A0A093JXH8_STRCA Loading...

Fibromodulin

Affects the rate of fibrils formation. May have a primary role in collagen fibrillogenesis.

AlphaFold DB , UniProt , Accession A0A093JXH8, Species STRCA (Struthio camelus australis), Gene n/a, Length 380 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	29.2	Very low	229 Å²	229	139.1 Å²	139.1	100%	1.128	79%	0.794	S	S	*	*				0	123.8	0	-72.6	164.7	69.3	0	0	106.9
2	H	30.5	Very low	29.1	Very low	148 Å²	148	141.8 Å²	141.8	69%	0.685	80%	0.803	S	S	*	*			cis	-178.1	125.9	1.3	-124.9	14.2	0	0	0	107.5
3	W	26.2	Very low	29	Very low	213 Å²	213	141.2 Å²	141.2	81%	0.807	81%	0.811	S	S	*	*			trans	62.1	131.4	154.5	-46	89.8	0	0	0	120
4	A	31.3	Very low	28.7	Very low	77 Å²	77	136.8 Å²	136.8	64%	0.636	81%	0.811	S	S	*	*			cis	73.5	109.2	31.7	0	0	0	0	0	116.4
5	T	36.8	Very low	28.7	Very low	140 Å²	140	136.9 Å²	136.9	86%	0.859	81%	0.813	S	S	*	*			trans	-176.3	114.5	149	29.1	0	0	0	0	106.9
6	V	31.6	Very low	28.5	Very low	123 Å²	123	135.3 Å²	135.3	75%	0.745	81%	0.811	S	S	*	*			cis	87.6	124.7	45	-172.1	0	0	0	0	114.1
7	L	27.5	Very low	28.5	Very low	153 Å²	153	136.4 Å²	136.4	80%	0.801	81%	0.811	S	S	*	*			trans	123.7	99.1	154.9	-71.3	169.8	0	0	0	113
8	I	30.2	Very low	28.3	Very low	145 Å²	145	132 Å²	132	74%	0.744	80%	0.799	S	S	*	*				57.8	113.8	74.7	-54.2	177.8	0	0	0	113.8
9	V	26.6	Very low	28.3	Very low	137 Å²	137	134.4 Å²	134.4	83%	0.83	80%	0.8	S	S	*	*				-168.7	120.1	119	167	0	0	0	0	111
10	A	25.6	Very low	28.3	Very low	97 Å²	97	138.8 Å²	138.8	80%	0.802	80%	0.804	S	S	*	*			trans	42.2	130.3	143.7	0	0	0	0	0	123.5
11	G	23.8	Very low	28.5	Very low	68 Å²	68	138.4 Å²	138.4	70%	0.701	80%	0.799	S	S	*	*				131.3	96.5	120.9	0	0	0	0	0	117.1
12	L	27.6	Very low	28.8	Very low	172 Å²	172	135.6 Å²	135.6	90%	0.901	78%	0.783	S	S	*	*			trans	69.3	103.6	146	-56.9	164.7	0	0	0	118.3
13	C	27.8	Very low	28.9	Very low	134 Å²	134	136.8 Å²	136.8	91%	0.905	79%	0.789	S	S	*	*				-177.8	117.1	115.7	-102.2	0	0	0	0	112.3
14	G	26	Very low	29.6	Very low	79 Å²	79	134.8 Å²	134.8	81%	0.814	79%	0.789	S	S	*	*			trans	49.4	86.9	142.8	0	0	0	0	0	119.4	S16	G14-S16 PolarHBondContact O-N 3.19Å
15	V	28.3	Very low	30.1	Very low	138 Å²	138	137.3 Å²	137.3	84%	0.836	79%	0.791	S	S	*	*			trans	-74	107.1	151.2	-174.3	0	0	0	0	106.5	L17	V15-L17 VanDerWaalsContact C-N 3.27Å; V15-L17 PolarHBondContact O-N 3.04Å
16	S	25.8	Very low	30.3	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	77%	0.774	S	S	*	*			trans	-68.5	87.8	170.4	177.6	0	0	0	0	108.7	G14 G18	G14-S16 PolarHBondContact O-N 3.19Å; S16-G18 PolarHBondContact O-N 2.9Å; S16-G18 VanDerWaalsContact O-N 3.15Å
17	L	27.9	Very low	30.7	Very low	153 Å²	153	132.3 Å²	132.3	80%	0.801	76%	0.764	S	S	*	*			trans	-61.9	106.6	154.7	-79.6	157	0	0	0	106.1	V15 Q19	V15-L17 VanDerWaalsContact C-N 3.27Å; V15-L17 PolarHBondContact O-N 3.04Å; L17-Q19 PolarHBondContact O-N 2.82Å
18	G	25.2	Very low	31.6	Very low	58 Å²	58	132.7 Å²	132.7	60%	0.598	75%	0.754	S	S	*	*			trans	-58.6	108.8	169.1	0	0	0	0	0	108.2	S16 Y20	S16-G18 PolarHBondContact O-N 2.9Å; S16-G18 VanDerWaalsContact O-N 3.15Å; G18-Y20 PolarHBondContact O-N 3.31Å; G18-Y20 VanDerWaalsContact O-N 3.08Å
19	Q	27.2	Very low	32.1	Very low	177 Å²	177	129.2 Å²	129.2	83%	0.827	74%	0.737	S	S	*	*			trans	-58.2	108.3	160.6	-86.2	169.4	-71.6	0	0	106.6	L17 D21	L17-Q19 PolarHBondContact O-N 2.82Å; Q19-D21 PolarHBondContact O-N 2.83Å
20	Y	29.6	Very low	32.6	Very low	222 Å²	222	129.7 Å²	129.7	87%	0.871	73%	0.73	S	S	*	*			trans	-69.8	111.6	160.7	-91.9	-98.1	0	0	0	106.2	G18 E22	G18-Y20 PolarHBondContact O-N 3.31Å; G18-Y20 VanDerWaalsContact O-N 3.08Å; Y20-E22 PolarHBondContact O-N 2.65Å; Y20-E22 VanDerWaalsContact O-N 3.09Å
21	D	31.2	Very low	33.3	Very low	132 Å²	132	132.7 Å²	132.7	71%	0.706	72%	0.722	S	S	*	*			trans	-71.1	97.5	175.3	-77.1	-37	0	0	0	109.4	Q19 E23	Q19-D21 PolarHBondContact O-N 2.83Å; D21-E23 PolarHBondContact O-N 3.27Å
22	E	37.3	Very low	34.1	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.794	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	5	169.4	-76.6	-174.7	153.5	0	0	113	Y20	Y20-E22 PolarHBondContact O-N 2.65Å; Y20-E22 VanDerWaalsContact O-N 3.09Å
23	E	34	Very low	34.6	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-16.3	-170.3	-107.8	178.7	171.4	0	0	115	D21	D21-E23 PolarHBondContact O-N 3.27Å
24	E	39.7	Very low	35	Very low	171 Å²	171	140 Å²	140	80%	0.799	71%	0.706	S	S	*	*	S	Bend	trans	-87.2	-20.4	179.6	-75.1	-167.3	152.9	0	0	114.3	L26	E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.3Å
25	D	42.3	Very low	35.6	Very low	129 Å²	129	143 Å²	143	69%	0.69	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-5	-175.3	-82.7	-28.3	0	0	0	114.8	W28	D25-W28 PolarHBondContact O-NE1 3.36Å
26	L	41.1	Very low	35.7	Very low	96 Å²	96	140.7 Å²	140.7	50%	0.503	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.1	-7.8	179.9	-69.2	173	0	0	0	114.1	E24 W28 L29 Q30	E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.3Å; L26-W28 VanDerWaalsContact C-N 3.27Å; L26-W28 PolarHBondContact O-N 3.11Å; L26-L29 HydrophobicContact CD2-CD1 3.79Å; L26-L29 PolarHBondContact O-N 2.92Å; L26-Q30 PolarHBondContact O-N 2.94Å
27	A	41.1	Very low	36	Very low	63 Å²	63	146.3 Å²	146.3	52%	0.521	69%	0.693	S	S	.	*	H	α-helix	trans	-63.1	-33.2	-177.5	0	0	0	0	0	112.6	Y31	A27-Y31 PolarHBondContact O-N 3.44Å
28	W	45.5	Very low	35.9	Very low	161 Å²	161	148.1 Å²	148.1	61%	0.61	70%	0.699	S	S	*	*	H	α-helix	trans	-75	-33.3	178.6	72.6	-91.4	0	0	0	112.9	D25 L26 Y31 Y32	D25-W28 PolarHBondContact O-NE1 3.36Å; L26-W28 VanDerWaalsContact C-N 3.27Å; L26-W28 PolarHBondContact O-N 3.11Å; W28-Y31 PolarHBondContact O-N 2.88Å; W28-Y32 PolarHBondContact O-N 2.69Å
29	L	40.7	Very low	35.9	Very low	72 Å²	72	150.4 Å²	150.4	38%	0.377	71%	0.706	S	S	.	*	H	α-helix	trans	-67.5	-38.1	174.9	-86.1	161.3	0	0	0	111.7	L26 Y32 M33	L26-L29 HydrophobicContact CD2-CD1 3.79Å; L26-L29 PolarHBondContact O-N 2.92Å; L29-Y32 PolarHBondContact O-N 3.02Å; L29-M33 VanDerWaalsContact O-CG 3.28Å; L29-M33 WeakPolarHBondContact O-CG 3.39Å; L29-M33 PolarHBondContact O-N 3.15Å; L29-M33 VanDerWaalsContact O-N 3.08Å
30	Q	37.3	Very low	36	Very low	146 Å²	146	146.9 Å²	146.9	68%	0.682	70%	0.701	S	S	*	*	H	α-helix	trans	-68.1	-35.6	174.5	-69.3	-173.8	-0.8	0	0	112.4	L26 R34	L26-Q30 PolarHBondContact O-N 2.94Å; Q30-R34 PolarHBondContact O-N 2.99Å
31	Y	39.2	Very low	35.7	Very low	160 Å²	160	146.9 Å²	146.9	63%	0.627	70%	0.701	S	S	*	*	H	α-helix	trans	-65.8	-41.1	174	-176.7	-102	0	0	0	112.2	A27 W28 R34 Q35	A27-Y31 PolarHBondContact O-N 3.44Å; W28-Y31 PolarHBondContact O-N 2.88Å; Y31-R34 PolarHBondContact O-N 2.85Å; Y31-Q35 PolarHBondContact OH-NE2 2.03Å
32	Y	40.5	Very low	35.6	Very low	170 Å²	170	147.8 Å²	147.8	67%	0.667	71%	0.706	S	S	*	*	H	α-helix	trans	-68.6	-38.5	179	-165.1	-96.7	0	0	0	113.1	W28 L29 R34 S36	W28-Y32 PolarHBondContact O-N 2.69Å; L29-Y32 PolarHBondContact O-N 3.02Å; Y32-R34 VanDerWaalsContact C-N 3.26Å; Y32-R34 PolarHBondContact O-N 3.42Å; Y32-S36 PolarHBondContact O-OG 2.91Å
33	M	38.4	Very low	35	Very low	138 Å²	138	149.8 Å²	149.8	68%	0.68	71%	0.708	S	S	*	*	H	α-helix	trans	-71.1	-18.8	176.5	-70.6	-106.8	-91.3	0	0	113.5	L29 S36	L29-M33 VanDerWaalsContact O-CG 3.28Å; L29-M33 WeakPolarHBondContact O-CG 3.39Å; L29-M33 PolarHBondContact O-N 3.15Å; L29-M33 VanDerWaalsContact O-N 3.08Å; M33-S36 PolarHBondContact O-OG 2.66Å
34	R	37.7	Very low	34.8	Very low	220 Å²	220	147.9 Å²	147.9	83%	0.83	71%	0.708	S	S	*	*	H	α-helix	trans	-83.2	-22.5	-179.8	-141.8	173.4	-174.7	176.1	1.5	113.2	Q30 Y31 Y32	Q30-R34 PolarHBondContact O-N 2.99Å; Y31-R34 PolarHBondContact O-N 2.85Å; Y32-R34 VanDerWaalsContact C-N 3.26Å; Y32-R34 PolarHBondContact O-N 3.42Å
35	Q	36.7	Very low	34.2	Very low	143 Å²	143	144.2 Å²	144.2	67%	0.668	70%	0.699	S	S	*	*	S	Bend	trans	-89.2	-7.6	179.5	-66.1	-153.5	5.3	0	0	114.6	Y31	Y31-Q35 PolarHBondContact OH-NE2 2.03Å
36	S	31.1	Very low	33.4	Very low	89 Å²	89	148.3 Å²	148.3	62%	0.622	71%	0.706	S	S	*	*	S	Bend	trans	-100.9	8.2	-176.6	33.1	0	0	0	0	114.7	Y32 M33	Y32-S36 PolarHBondContact O-OG 2.91Å; M33-S36 PolarHBondContact O-OG 2.66Å
37	R	31.7	Very low	32.8	Very low	229 Å²	229	154.6 Å²	154.6	86%	0.864	73%	0.725	S	S	*	*			trans	-111.1	79.5	173.9	-74.3	-172.9	179.6	-176.2	1.2	112.2
38	M	25.6	Very low	32.4	Very low	191 Å²	191	159.8 Å²	159.8	94%	0.941	74%	0.738	S	S	*	*			trans	-138.5	87.5	158.3	-99.1	-173.2	168	0	0	109.6
39	S	26.5	Very low	31.5	Very low	107 Å²	107	160.1 Å²	160.1	75%	0.748	75%	0.752	S	S	*	*			trans	-161.4	103.7	139	-153.6	0	0	0	0	108.7	Y41	S39-Y41 PolarHBondContact O-N 3.06Å
40	S	27.8	Very low	31.1	Very low	103 Å²	103	164.9 Å²	164.9	72%	0.72	77%	0.772	S	S	*	*			trans	-76.2	111.3	175	158.2	0	0	0	0	108.8
41	Y	25.2	Very low	30.8	Very low	221 Å²	221	165.6 Å²	165.6	87%	0.867	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74.9	119.4	164.9	-87.5	-88.1	0	0	0	109.4	S39	S39-Y41 PolarHBondContact O-N 3.06Å
42	N	27.4	Very low	30.4	Very low	151 Å²	151	164 Å²	164	81%	0.807	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-72	126.2	168.4	-84.5	-28.8	0	0	0	110
43	Y	24.8	Very low	30.4	Very low	212 Å²	212	160.2 Å²	160.2	83%	0.831	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-101.1	129.1	171.8	-160.2	-91.5	0	0	0	108
44	V	29.8	Very low	30	Very low	133 Å²	133	164.2 Å²	164.2	81%	0.806	79%	0.793	S	S	*	*			trans	-139.4	138.6	164.6	-175.6	0	0	0	0	108.4
45	P	28.5	Very low	29.8	Very low	94 Å²	94	159.5 Å²	159.5	61%	0.61	79%	0.789	S	S	*	*			trans	-98	166.3	-156.3	17.9	1.4	0	0	0	114.8
46	Y	24.1	Very low	29.4	Very low	215 Å²	215	161.7 Å²	161.7	84%	0.843	79%	0.792	S	S	*	*			trans	-46.1	143.7	168.7	-94.5	-108	0	0	0	114.8
47	Y	29	Very low	29.5	Very low	228 Å²	228	162.2 Å²	162.2	89%	0.894	80%	0.796	S	S	*	*			trans	-129.1	125.9	144.9	-87	-83.4	0	0	0	108.8
48	E	32.2	Very low	29.6	Very low	173 Å²	173	161.3 Å²	161.3	81%	0.808	79%	0.794	S	S	*	*			trans	-69.5	146.7	163.2	-68.7	173.8	146.6	0	0	109.3
49	D	27.8	Very low	30.1	Very low	168 Å²	168	160.1 Å²	160.1	90%	0.898	79%	0.791	S	S	*	*			trans	-150.3	134.2	147.8	-125	-17.7	0	0	0	111.4
50	E	32.2	Very low	30.7	Very low	171 Å²	171	160.8 Å²	160.8	80%	0.799	79%	0.792	S	S	*	*			trans	-75.3	139.6	-176.4	-61.7	178.9	139.3	0	0	111.7
51	N	29.7	Very low	31.1	Very low	161 Å²	161	160.4 Å²	160.4	86%	0.861	80%	0.795	S	S	*	*				179.2	125	128.2	-97.6	-37.4	0	0	0	112.2
52	T	31.4	Very low	31.8	Very low	127 Å²	127	155.3 Å²	155.3	78%	0.779	79%	0.789	S	S	*	*			trans	-93.7	-173.6	163.6	61.8	0	0	0	0	108.5
53	P	41.4	Very low	32.5	Very low	90 Å²	90	156 Å²	156	58%	0.584	79%	0.793	S	S	*	*			cis	-136.1	156.8	-10.3	35.3	-17.6	0	0	0	113.5
54	Y	28.7	Very low	33.2	Very low	223 Å²	223	152.3 Å²	152.3	88%	0.875	79%	0.792	S	S	*	*			trans	-140.6	112	146.8	-81.8	-73.6	0	0	0	111
55	V	33.5	Very low	33.8	Very low	121 Å²	121	155.6 Å²	155.6	73%	0.733	80%	0.799	S	S	*	*			trans	-77.4	124	167.3	173.9	0	0	0	0	107.6
56	Y	29.7	Very low	34.2	Very low	188 Å²	188	155.8 Å²	155.8	74%	0.737	81%	0.809	S	S	*	*			trans	-130.4	104.8	151.6	-87	-78	0	0	0	109.2	Y58	Y56-Y58 HydrophobicContact CD1-CE2 4.3Å
57	S	32.1	Very low	35.1	Very low	101 Å²	101	154 Å²	154	71%	0.706	81%	0.808	S	S	*	*			trans	-66.4	123.2	162	50.1	0	0	0	0	109.9
58	Y	33.9	Very low	35.8	Very low	210 Å²	210	149.3 Å²	149.3	82%	0.824	81%	0.805	S	S	*	*			trans	-127.9	124.8	155.9	-84	-82.2	0	0	0	109.5	Y56	Y56-Y58 HydrophobicContact CD1-CE2 4.3Å
59	L	37	Very low	36.3	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	80%	0.795	S	S	*	*			trans	-64.3	162.8	173	-82.6	154.5	0	0	0	111.6
60	P	38.3	Very low	37.1	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	79%	0.793	S	S	*	*			trans	-85.4	148.7	-161.9	33	-29.6	0	0	0	112.9
61	A	35.6	Very low	37.4	Very low	94 Å²	94	142.2 Å²	142.2	78%	0.777	79%	0.794	S	S	*	*			trans	-109.8	157.5	168.1	0	0	0	0	0	109.5
62	P	40.3	Very low	38	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	79%	0.79	S	S	*	*			trans	-89.3	162.8	-139.3	35.2	-36.8	0	0	0	115	T64	P62-T64 PolarHBondContact O-N 3.27Å
63	D	42.6	Very low	38.4	Very low	166 Å²	166	143.2 Å²	143.2	89%	0.888	80%	0.795	S	S	*	*			trans	-27.2	104.9	172.8	-58.4	-43.5	0	0	0	114.9
64	T	39.1	Very low	38.5	Very low	133 Å²	133	147.2 Å²	147.2	82%	0.816	81%	0.806	S	S	*	*			trans	-109.2	115.3	153.4	46.8	0	0	0	0	107.9	P62 A66	P62-T64 PolarHBondContact O-N 3.27Å; T64-A66 PolarHBondContact O-N 3.5Å
65	E	42.2	Very low	39.1	Very low	202 Å²	202	140.5 Å²	140.5	94%	0.944	80%	0.797	S	S	*	*			trans	-49	108.9	172.2	-66.4	176.8	153.8	0	0	109.9
66	A	38.3	Very low	39.8	Very low	98 Å²	98	140.3 Å²	140.3	81%	0.81	80%	0.797	S	S	*	*			trans	-84.6	119.1	171.3	0	0	0	0	0	108.4	T64	T64-A66 PolarHBondContact O-N 3.5Å
67	E	42.4	Very low	41.1	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	79%	0.793	S	S	*	*			trans	-53.6	146.3	165.9	-68.9	-158.1	156.3	0	0	110.4	G69	E67-G69 PolarHBondContact O-N 2.95Å
68	P	43.6	Very low	42.8	Very low	129 Å²	129	138.8 Å²	138.8	84%	0.838	79%	0.787	S	S	*	*			trans	-64.9	106.8	179.9	26	-30.5	0	0	0	108.9
69	G	43.4	Very low	45.2	Very low	58 Å²	58	135.4 Å²	135.4	60%	0.598	78%	0.778	S	S	*	*			trans	-55.3	147.7	169.5	0	0	0	0	0	110.1	E67 E71	E67-G69 PolarHBondContact O-N 2.95Å; G69-E71 PolarHBondContact O-N 3.02Å
70	P	43.3	Very low	47.9	Very low	131 Å²	131	129.5 Å²	129.5	85%	0.851	75%	0.751	S	S	*	*			trans	-55.8	134.1	-178.7	23.3	-31.4	0	0	0	109.4
71	E	38.2	Very low	50.6	Low	174 Å²	174	124.8 Å²	124.8	81%	0.813	72%	0.72	S	S	*	*			trans	-40.7	139.8	173.2	-77.6	178.7	144.1	0	0	110.2	G69 Q73	G69-E71 PolarHBondContact O-N 3.02Å; E71-Q73 PolarHBondContact O-N 2.89Å
72	P	44	Very low	53.5	Low	119 Å²	119	129.6 Å²	129.6	77%	0.773	73%	0.726	S	S	*	*			trans	-55.8	111.3	171.6	22.8	-29.9	0	0	0	106.9	Q74	P72-Q74 PolarHBondContact O-N 3.43Å
73	Q	38.8	Very low	56.1	Low	189 Å²	189	126.7 Å²	126.7	88%	0.883	70%	0.703	S	S	*	*			trans	-49.9	108.9	172	-73.4	176.6	-6.7	0	0	105.7	E71 A75	E71-Q73 PolarHBondContact O-N 2.89Å; Q73-A75 PolarHBondContact O-N 3Å
74	Q	42.8	Very low	58.7	Low	174 Å²	174	119.1 Å²	119.1	81%	0.813	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-50.1	117	174.7	-76	175.1	-1.8	0	0	105.6	P72	P72-Q74 PolarHBondContact O-N 3.43Å
75	A	42.7	Very low	61.5	Low	83 Å²	83	117.3 Å²	117.3	69%	0.686	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-47.1	131.4	171.5	0	0	0	0	0	106.4	Q73 T77	Q73-A75 PolarHBondContact O-N 3Å; A75-T77 PolarHBondContact O-N 3.26Å
76	P	48.3	Very low	64.1	Low	116 Å²	116	109 Å²	109	75%	0.753	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-49.4	118.8	-173.6	17.7	-30	0	0	0	107.4	R78	P76-R78 PolarHBondContact O-N 2.8Å
77	T	56.3	Low	66.8	Low	104 Å²	104	105.8 Å²	105.8	64%	0.638	58%	0.583	S	S	*	*			trans	-48.3	115.3	177.8	38.8	0	0	0	0	105.6	A75 E79	A75-T77 PolarHBondContact O-N 3.26Å; T77-E79 PolarHBondContact O-N 2.66Å
78	R	66.9	Low	69.2	Low	154 Å²	154	102.1 Å²	102.1	58%	0.581	58%	0.575	S	S	*	*			trans	-69.5	82.1	-179.7	-74.1	-176.2	177.4	-169.2	-1.5	106.6	P76 C80 P88	P76-R78 PolarHBondContact O-N 2.8Å; R78-C80 PolarHBondContact O-N 3.48Å; R78-P88 PolarHBondContact NH1-O 3.03Å
79	E	84.9	Confident	71.6	Confident	138 Å²	138	103.1 Å²	103.1	65%	0.645	57%	0.573	S	S	*	*			trans	-56.2	115.9	-179.3	-73.1	-179.6	175.7	0	0	107.3	T77 P108 R110	T77-E79 PolarHBondContact O-N 2.66Å; E79-P108 WeakPolarHBondContact O-CG 3.34Å; E79-R110 VanDerWaalsContact O-CZ 3.3Å; E79-R110 PolarHBondContact O-NH1 3.48Å; E79-R110 PolarHBondContact O-NH2 3.24Å
80	C	94.4	Very high	74.1	Confident	43 Å²	43	104.4 Å²	104.4	29%	0.291	56%	0.562	S	S	.	*			trans	-135.7	129.4	175.8	-171.8	0	0	0	0	105.8	R78 Q82 C86	R78-C80 PolarHBondContact O-N 3.48Å; C80-Q82 PolarHBondContact O-N 3.48Å; C80-C86 HydrophobicContact CB-CB 3.76Å; C80-C86 WeakPolarHBondContact CB-SG 3.01Å; C80-C86 WeakPolarHBondContact SG-CB 3.41Å; C80-C86 PolarHBondContact SG-N 2.89Å; C80-C86 VanDerWaalsContact SG-N 3.44Å; C80-C86 CovalentContact SG-SG 2.03Å; C80-C86 PolarHBondContact SG-SG 3.17Å
81	P	95.4	Very high	76.5	Confident	21 Å²	21	100.7 Å²	100.7	14%	0.136	54%	0.54	C	S	.	.			trans	-54.7	139.4	172.9	-23.3	33.8	0	0	0	110.5	E83 C84 M94 P105	P81-E83 HydrophobicContact CB-CG 4.19Å; P81-E83 WeakPolarHBondContact CB-OE2 3.03Å; P81-E83 PolarHBondContact O-N 3.04Å; P81-C84 HydrophobicContact CB-CB 4.22Å; P81-C84 PolarHBondContact O-N 3.02Å; P81-M94 HydrophobicContact CG-SD 3.89Å; P81-P105 HydrophobicContact CB-CB 3.84Å; P81-P105 HydrophobicContact CB-CG 4.15Å; P81-P105 HydrophobicContact CG-CB 3.87Å; P81-P105 HydrophobicContact CG-CG 4.16Å
82	Q	94.8	Very high	79.2	Confident	195 Å²	195	93.6 Å²	93.6	91%	0.911	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.4	-175.8	-68.6	-174.8	-15.5	0	0	112.5	C80 C84	C80-Q82 PolarHBondContact O-N 3.48Å; Q82-C84 PolarHBondContact O-N 3.2Å
83	E	95.9	Very high	81.8	Confident	54 Å²	54	87.9 Å²	87.9	25%	0.252	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	0	176.3	61.5	-95.6	-122.8	0	0	113.9	P81 R99 L101 Y103 P105	P81-E83 HydrophobicContact CB-CG 4.19Å; P81-E83 WeakPolarHBondContact CB-OE2 3.03Å; P81-E83 PolarHBondContact O-N 3.04Å; E83-R99 VanDerWaalsContact O-CD 3.31Å; E83-R99 WeakPolarHBondContact O-CD 3.46Å; E83-L101 HydrophobicContact CB-CD2 3.94Å; E83-L101 HydrophobicContact CG-CD2 4.25Å; E83-Y103 VanDerWaalsContact OE1-CE2 3.23Å; E83-Y103 WeakPolarHBondContact OE1-CE2 3.29Å; E83-Y103 VanDerWaalsContact OE1-CZ 3.31Å; E83-Y103 PolarHBondContact OE1-OH 2.83Å; E83-P105 HydrophobicContact CG-CB 4.47Å; E83-P105 HydrophobicContact CG-CG 4.21Å
84	C	97.6	Very high	84.6	Confident	8 Å²	8	78.9 Å²	78.9	5%	0.054	43%	0.43	C	S	.	.	S	Bend	trans	-131	157.5	-175.8	-61.8	0	0	0	0	111.9	P81 Q82 M94 Y95 C96	P81-C84 HydrophobicContact CB-CB 4.22Å; P81-C84 PolarHBondContact O-N 3.02Å; Q82-C84 PolarHBondContact O-N 3.2Å; C84-M94 HydrophobicContact CB-CG 3.9Å; C84-M94 HydrophobicContact CB-SD 4.28Å; C84-Y95 WeakPolarHBondContact CA-O 3.09Å; C84-C96 HydrophobicContact CB-CB 4.15Å; C84-C96 WeakPolarHBondContact CB-SG 3Å; C84-C96 WeakPolarHBondContact SG-CB 3.36Å; C84-C96 CovalentContact SG-SG 2.03Å; C84-C96 PolarHBondContact SG-SG 2.97Å
85	D	97.4	Very high	87.3	Confident	94 Å²	94	74.3 Å²	74.3	50%	0.503	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-106.2	125.2	175.5	-67.2	-46	0	0	0	111	Y95 R99	D85-Y95 PolarHBondContact N-O 3.46Å; D85-Y95 PolarHBondContact O-N 2.97Å; D85-R99 IonicContact OD2-CZ 2.89Å; D85-R99 IonicContact OD2-NE 3.95Å; D85-R99 IonicContact OD2-NH2 3.29Å; D85-R99 PolarHBondContact OD2-NH2 2.88Å
86	C	97.1	Very high	89.9	Confident	28 Å²	28	70.3 Å²	70.3	19%	0.189	37%	0.373	C	S	.	.			trans	-115.7	96	175.4	-57	0	0	0	0	109.9	C80 M111	C80-C86 HydrophobicContact CB-CB 3.76Å; C80-C86 WeakPolarHBondContact CB-SG 3.01Å; C80-C86 WeakPolarHBondContact SG-CB 3.41Å; C80-C86 PolarHBondContact SG-N 2.89Å; C80-C86 VanDerWaalsContact SG-N 3.44Å; C80-C86 CovalentContact SG-SG 2.03Å; C80-C86 PolarHBondContact SG-SG 3.17Å; C86-M111 HydrophobicContact CB-CE 4.38Å
87	P	95.2	Very high	92.3	Very high	31 Å²	31	66.6 Å²	66.6	20%	0.201	35%	0.347	C	S	.	.			trans	-67.5	131.1	-171.8	26	-34.1	0	0	0	112.2	N89 F90 S91 Y95	P87-N89 VanDerWaalsContact C-N 3.29Å; P87-N89 WeakPolarHBondContact CB-OD1 3.31Å; P87-N89 PolarHBondContact O-N 2.77Å; P87-F90 HydrophobicContact CG-CB 4.2Å; P87-F90 CarbonylContact O-C 3.17Å; P87-F90 PolarHBondContact O-N 2.81Å; P87-F90 VanDerWaalsContact O-N 3.11Å; P87-S91 PolarHBondContact O-N 2.03Å; P87-Y95 HydrophobicContact CG-CD2 4.16Å; P87-Y95 HydrophobicContact CG-CE2 3.77Å
88	P	92.7	Very high	94.3	Very high	102 Å²	102	65.9 Å²	65.9	66%	0.662	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.4	-175.7	-25.8	34.6	0	0	0	115.2	R78 F90	R78-P88 PolarHBondContact NH1-O 3.03Å; P88-F90 VanDerWaalsContact C-N 3.34Å
89	N	94.4	Very high	95.7	Very high	149 Å²	149	62.5 Å²	62.5	80%	0.797	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.5	177.7	62	-18.2	0	0	0	113	P87	P87-N89 VanDerWaalsContact C-N 3.29Å; P87-N89 WeakPolarHBondContact CB-OD1 3.31Å; P87-N89 PolarHBondContact O-N 2.77Å
90	F	94.3	Very high	96.4	Very high	85 Å²	85	61.3 Å²	61.3	37%	0.373	33%	0.328	S	S	.	.	S	Bend	trans	-137.3	66.6	176.3	-165	-130	0	0	0	110.1	P87 P88 S92 A93 Y113	P87-F90 HydrophobicContact CG-CB 4.2Å; P87-F90 CarbonylContact O-C 3.17Å; P87-F90 PolarHBondContact O-N 2.81Å; P87-F90 VanDerWaalsContact O-N 3.11Å; P88-F90 VanDerWaalsContact C-N 3.34Å; F90-S92 PolarHBondContact O-N 3.5Å; F90-A93 HydrophobicContact CD1-CB 3.28Å; F90-A93 HydrophobicContact CE1-CB 3.53Å; F90-A93 HydrophobicContact CG-CB 4.29Å; F90-A93 PolarHBondContact O-N 3.21Å; F90-Y113 AromaticContact CE1-CD2 3.69Å; F90-Y113 HydrophobicContact CE1-CD2 3.69Å; F90-Y113 HydrophobicContact CE1-CE2 4.18Å; F90-Y113 HydrophobicContact CE2-CE2 4.29Å; F90-Y113 AromaticContact CZ-CD2 3.47Å; F90-Y113 HydrophobicContact CZ-CD2 3.47Å; F90-Y113 VanDerWaalsContact CZ-CD2 3.47Å; F90-Y113 AromaticContact CZ-CE2 3.47Å; F90-Y113 HydrophobicContact CZ-CE2 3.47Å; F90-Y113 VanDerWaalsContact CZ-CE2 3.47Å
91	S	93.4	Very high	96.5	Very high	54 Å²	54	60 Å²	60	38%	0.378	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-9.1	-166.9	57.9	0	0	0	0	115.8	P87 R110	P87-S91 PolarHBondContact O-N 2.03Å; S91-R110 WeakPolarHBondContact O-CD 3.3Å; S91-R110 PolarHBondContact O-NE 3.17Å
92	S	96.1	Very high	96.6	Very high	24 Å²	24	67.8 Å²	67.8	17%	0.168	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	3.5	175.4	59.5	0	0	0	0	113.4	F90 K112 Y113	F90-S92 PolarHBondContact O-N 3.5Å; S92-K112 PolarHBondContact O-N 2.8Å; S92-Y113 PolarHBondContact O-N 3.21Å; S92-Y113 VanDerWaalsContact O-N 3.07Å
93	A	98	Very high	96.7	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.3	174	0	0	0	0	0	112.6	F90 Y95 Y113	F90-A93 HydrophobicContact CD1-CB 3.28Å; F90-A93 HydrophobicContact CE1-CB 3.53Å; F90-A93 HydrophobicContact CG-CB 4.29Å; F90-A93 PolarHBondContact O-N 3.21Å; A93-Y95 HydrophobicContact CB-CD2 4.46Å; A93-Y95 HydrophobicContact CB-CE2 3.68Å; A93-Y113 CarbonylContact C-O 3.11Å; A93-Y113 VanDerWaalsContact CA-O 3.26Å; A93-Y113 WeakPolarHBondContact CA-O 3.31Å
94	M	98	Very high	96.7	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.1	173.4	-173.6	174	72.2	0	0	110	P81 C84 V107 P108 M111 Y113 V114 Y115 F116	P81-M94 HydrophobicContact CG-SD 3.89Å; C84-M94 HydrophobicContact CB-CG 3.9Å; C84-M94 HydrophobicContact CB-SD 4.28Å; M94-V107 HydrophobicContact CE-CB 4.39Å; M94-V107 HydrophobicContact CE-CG1 4.12Å; M94-V107 HydrophobicContact CE-CG2 3.95Å; M94-P108 HydrophobicContact SD-CG 4.43Å; M94-M111 HydrophobicContact CB-CE 4.13Å; M94-M111 HydrophobicContact CB-CG 4.23Å; M94-M111 HydrophobicContact CB-SD 3.85Å; M94-Y113 PolarHBondContact N-O 3.27Å; M94-V114 HydrophobicContact CB-CG1 4.42Å; M94-V114 HydrophobicContact CB-CG2 4.32Å; M94-V114 HydrophobicContact CE-CG1 3.45Å; M94-V114 VanDerWaalsContact CE-CG1 3.45Å; M94-V114 HydrophobicContact CE-CG2 4.26Å; M94-Y115 PolarHBondContact O-N 3.27Å; M94-F116 HydrophobicContact CE-CE1 4.14Å; M94-F116 HydrophobicContact CE-CE2 4.39Å; M94-F116 HydrophobicContact CE-CZ 3.57Å
95	Y	98.6	Very high	96.6	Very high	77 Å²	77	62 Å²	62	30%	0.302	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.5	-177.7	-62.2	-90.3	0	0	0	110.1	C84 D85 P87 A93 Y115	C84-Y95 WeakPolarHBondContact CA-O 3.09Å; D85-Y95 PolarHBondContact N-O 3.46Å; D85-Y95 PolarHBondContact O-N 2.97Å; P87-Y95 HydrophobicContact CG-CD2 4.16Å; P87-Y95 HydrophobicContact CG-CE2 3.77Å; A93-Y95 HydrophobicContact CB-CD2 4.46Å; A93-Y95 HydrophobicContact CB-CE2 3.68Å; Y95-Y115 AromaticContact CD1-CD2 3.54Å; Y95-Y115 HydrophobicContact CD1-CD2 3.54Å; Y95-Y115 HydrophobicContact CD1-CE2 4.12Å; Y95-Y115 HydrophobicContact CD1-CG 4.11Å; Y95-Y115 AromaticContact CE1-CD2 3.46Å; Y95-Y115 HydrophobicContact CE1-CD2 3.46Å; Y95-Y115 VanDerWaalsContact CE1-CD2 3.46Å; Y95-Y115 AromaticContact CE1-CE2 3.54Å; Y95-Y115 HydrophobicContact CE1-CE2 3.54Å; Y95-Y115 HydrophobicContact CE1-CG 4.23Å; Y95-Y115 HydrophobicContact CG-CD2 4.22Å; Y95-Y115 AromaticContact CZ-CE2 3.86Å
96	C	98.4	Very high	96.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.316	C	S	.	.			trans	-128.6	13.4	179.6	-49.8	0	0	0	0	110.9	C84 L101 Y115 F116 N119	C84-C96 HydrophobicContact CB-CB 4.15Å; C84-C96 WeakPolarHBondContact CB-SG 3Å; C84-C96 WeakPolarHBondContact SG-CB 3.36Å; C84-C96 CovalentContact SG-SG 2.03Å; C84-C96 PolarHBondContact SG-SG 2.97Å; C96-L101 HydrophobicContact CB-CD1 3.72Å; C96-L101 VanDerWaalsContact O-CD1 3.3Å; C96-L101 WeakPolarHBondContact O-CD1 3.2Å; C96-Y115 CarbonylContact C-O 3.55Å; C96-Y115 VanDerWaalsContact C-O 3.3Å; C96-Y115 VanDerWaalsContact CA-O 3.29Å; C96-Y115 WeakPolarHBondContact CA-O 3.37Å; C96-Y115 WeakPolarHBondContact CB-O 3.15Å; C96-Y115 PolarHBondContact N-O 3.19Å; C96-F116 HydrophobicContact CB-CD1 3.41Å; C96-F116 VanDerWaalsContact CB-CD1 3.41Å; C96-F116 HydrophobicContact CB-CE1 3.58Å; C96-F116 HydrophobicContact CB-CG 4.45Å; C96-F116 WeakPolarHBondContact SG-CE1 3.42Å; C96-N119 PolarHBondContact O-ND2 3.06Å
97	D	98.3	Very high	96.6	Very high	37 Å²	37	62.7 Å²	62.7	20%	0.198	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	151.4	-175.1	63.4	-64.9	0	0	0	112.8	R99 Y115 Q117	D97-R99 VanDerWaalsContact C-N 3.29Å; D97-R99 VanDerWaalsContact N-NH1 3.1Å; D97-R99 WeakPolarHBondContact O-CG 3.26Å; D97-R99 PolarHBondContact O-N 2.95Å; D97-R99 VanDerWaalsContact O-N 3.15Å; D97-R99 PolarHBondContact O-NH1 2.8Å; D97-R99 IonicContact OD1-NH1 3.64Å; D97-R99 PolarHBondContact OD1-NH1 3.24Å; D97-Y115 PolarHBondContact N-O 3.37Å; D97-Y115 VanDerWaalsContact N-O 3.17Å; D97-Q117 CarbonylContact C-O 3.13Å; D97-Q117 WeakPolarHBondContact CA-O 3.23Å; D97-Q117 HydrophobicContact CB-CG 3.94Å; D97-Q117 WeakPolarHBondContact CB-O 3.42Å
98	T	98	Very high	96.6	Very high	89 Å²	89	62 Å²	62	55%	0.546	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	37.3	170.5	-36	0	0	0	0	114.6	Q117 N118	T98-Q117 PolarHBondContact N-O 3.38Å; T98-N118 VanDerWaalsContact CA-O 3.31Å; T98-N118 WeakPolarHBondContact CA-O 3.44Å; T98-N118 PolarHBondContact N-O 2.93Å
99	R	97.8	Very high	96.7	Very high	83 Å²	83	60.9 Å²	60.9	31%	0.313	30%	0.299	S	S	.	.	S	Bend	trans	-118.9	11.6	-174.3	-78.5	167.3	-176.9	84.7	-6.4	113.7	E83 D85 D97 L101 N119	E83-R99 VanDerWaalsContact O-CD 3.31Å; E83-R99 WeakPolarHBondContact O-CD 3.46Å; D85-R99 IonicContact OD2-CZ 2.89Å; D85-R99 IonicContact OD2-NE 3.95Å; D85-R99 IonicContact OD2-NH2 3.29Å; D85-R99 PolarHBondContact OD2-NH2 2.88Å; D97-R99 VanDerWaalsContact C-N 3.29Å; D97-R99 VanDerWaalsContact N-NH1 3.1Å; D97-R99 WeakPolarHBondContact O-CG 3.26Å; D97-R99 PolarHBondContact O-N 2.95Å; D97-R99 VanDerWaalsContact O-N 3.15Å; D97-R99 PolarHBondContact O-NH1 2.8Å; D97-R99 IonicContact OD1-NH1 3.64Å; D97-R99 PolarHBondContact OD1-NH1 3.24Å; R99-L101 HydrophobicContact CB-CD2 4.11Å; R99-L101 HydrophobicContact CB-CG 3.93Å; R99-L101 PolarHBondContact O-N 3.49Å; R99-N119 PolarHBondContact N-OD1 3.24Å
100	N	97.8	Very high	96.8	Very high	113 Å²	113	57.3 Å²	57.3	60%	0.604	27%	0.274	S	S	*	.			trans	55.9	30.5	-174	-57.8	-66.7	0	0	0	113.2	R102 N119 Q120	N100-R102 PolarHBondContact O-N 2.97Å; N100-N119 PolarHBondContact N-OD1 3.01Å; N100-Q120 PolarHBondContact OD1-NE2 3.09Å
101	L	98	Very high	96.9	Very high	17 Å²	17	53.3 Å²	53.3	9%	0.089	26%	0.257	C	S	.	.			trans	-64.7	136.4	178.7	-59.1	-176.1	0	0	0	110.2	E83 C96 R99 N119 Q120 I121	E83-L101 HydrophobicContact CB-CD2 3.94Å; E83-L101 HydrophobicContact CG-CD2 4.25Å; C96-L101 HydrophobicContact CB-CD1 3.72Å; C96-L101 VanDerWaalsContact O-CD1 3.3Å; C96-L101 WeakPolarHBondContact O-CD1 3.2Å; R99-L101 HydrophobicContact CB-CD2 4.11Å; R99-L101 HydrophobicContact CB-CG 3.93Å; R99-L101 PolarHBondContact O-N 3.49Å; L101-N119 HydrophobicContact CB-CB 4.14Å; L101-N119 PolarHBondContact N-OD1 2.81Å; L101-Q120 CarbonylContact O-C 3.48Å; L101-Q120 WeakPolarHBondContact O-CA 3.37Å; L101-Q120 PolarHBondContact O-N 3.06Å; L101-I121 HydrophobicContact CB-CG1 4.33Å; L101-I121 PolarHBondContact O-N 3.39Å
102	R	96.9	Very high	97.2	Very high	184 Å²	184	53.8 Å²	53.8	69%	0.694	25%	0.252	S	S	*	.	S	Bend	trans	-104.5	-14.6	179	-64.2	-175.2	178.1	-170.9	0	113.3	N100 Q120	N100-R102 PolarHBondContact O-N 2.97Å; R102-Q120 HydrophobicContact CG-CB 4.41Å
103	Y	96.3	Very high	97.3	Very high	127 Å²	127	54.7 Å²	54.7	50%	0.498	25%	0.252	S	S	.	.	S	Bend	trans	-137.3	163.4	179.3	67.3	-92.5	0	0	0	109.2	E83	E83-Y103 VanDerWaalsContact OE1-CE2 3.23Å; E83-Y103 WeakPolarHBondContact OE1-CE2 3.29Å; E83-Y103 VanDerWaalsContact OE1-CZ 3.31Å; E83-Y103 PolarHBondContact OE1-OH 2.83Å
104	L	96.8	Very high	97.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-98	121.8	177.3	-168.7	143.9	0	0	0	108.9	F116 I121 Q125 A128 F129 L140	L104-F116 HydrophobicContact CD1-CD2 3.8Å; L104-F116 HydrophobicContact CD1-CE2 3.77Å; L104-F116 HydrophobicContact CD1-CG 4.26Å; L104-F116 HydrophobicContact CD1-CZ 4.25Å; L104-F116 HydrophobicContact CD2-CE2 4.16Å; L104-F116 HydrophobicContact CD2-CZ 4.12Å; L104-F116 HydrophobicContact CG-CD1 4.48Å; L104-F116 HydrophobicContact CG-CD2 4.26Å; L104-F116 HydrophobicContact CG-CE1 4.17Å; L104-F116 HydrophobicContact CG-CE2 3.86Å; L104-F116 HydrophobicContact CG-CZ 3.83Å; L104-I121 HydrophobicContact CB-CG2 4.44Å; L104-Q125 PolarHBondContact O-NE2 3.25Å; L104-Q125 PolarHBondContact O-OE1 3.27Å; L104-A128 HydrophobicContact CD2-CB 3.64Å; L104-F129 HydrophobicContact CD1-CE1 4.03Å; L104-F129 HydrophobicContact CD1-CZ 3.7Å; L104-F129 HydrophobicContact CD2-CE1 3.77Å; L104-F129 HydrophobicContact CD2-CZ 4Å; L104-L140 HydrophobicContact CD1-CD2 3.53Å
105	P	96.2	Very high	97.3	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.058	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-70.9	153.9	172.5	28.3	-34.2	0	0	0	111.3	P81 E83 V107 F116	P81-P105 HydrophobicContact CB-CB 3.84Å; P81-P105 HydrophobicContact CB-CG 4.15Å; P81-P105 HydrophobicContact CG-CB 3.87Å; P81-P105 HydrophobicContact CG-CG 4.16Å; E83-P105 HydrophobicContact CG-CB 4.47Å; E83-P105 HydrophobicContact CG-CG 4.21Å; P105-V107 PolarHBondContact O-N 2.71Å; P105-F116 HydrophobicContact CG-CE1 3.81Å; P105-F116 HydrophobicContact CG-CZ 4.26Å
106	F	96	Very high	97.4	Very high	131 Å²	131	53.1 Å²	53.1	58%	0.575	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-61.1	132.5	174.1	-72	-80.9	0	0	0	110.8	P108 Q125	F106-P108 WeakPolarHBondContact O-CD 3.37Å; F106-Q125 HydrophobicContact CE1-CG 4.23Å; F106-Q125 HydrophobicContact CZ-CG 4.11Å
107	V	97	Very high	97.4	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.024	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-83.4	125.8	-176.2	-177.1	0	0	0	0	110.4	M94 P105 M111 V114 F116 A128 F129 A132	M94-V107 HydrophobicContact CE-CB 4.39Å; M94-V107 HydrophobicContact CE-CG1 4.12Å; M94-V107 HydrophobicContact CE-CG2 3.95Å; P105-V107 PolarHBondContact O-N 2.71Å; V107-M111 HydrophobicContact CG1-CB 3.71Å; V107-M111 HydrophobicContact CG1-CG 3.89Å; V107-V114 HydrophobicContact CG1-CG2 3.74Å; V107-V114 HydrophobicContact CG2-CG1 4.47Å; V107-F116 HydrophobicContact CG2-CE2 4.08Å; V107-F116 HydrophobicContact CG2-CZ 4.03Å; V107-A128 PolarHBondContact N-O 3.48Å; V107-F129 HydrophobicContact CB-CD1 4.26Å; V107-F129 HydrophobicContact CG2-CD1 3.54Å; V107-F129 HydrophobicContact CG2-CE1 3.79Å; V107-A132 HydrophobicContact CB-CB 4.02Å; V107-A132 HydrophobicContact CG1-CB 3.57Å
108	P	95.8	Very high	97.4	Very high	16 Å²	16	55.9 Å²	55.9	10%	0.104	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.6	150.2	175.6	-23	33.5	0	0	0	112.8	E79 M94 F106 R110 M111	E79-P108 WeakPolarHBondContact O-CG 3.34Å; M94-P108 HydrophobicContact SD-CG 4.43Å; F106-P108 WeakPolarHBondContact O-CD 3.37Å; P108-R110 VanDerWaalsContact C-N 3.28Å; P108-R110 PolarHBondContact O-N 3.38Å; P108-M111 HydrophobicContact CB-CE 4.08Å; P108-M111 HydrophobicContact CB-CG 4.19Å; P108-M111 HydrophobicContact CG-CE 3.98Å; P108-M111 HydrophobicContact CG-CG 4.41Å; P108-M111 WeakPolarHBondContact O-CB 3.21Å; P108-M111 WeakPolarHBondContact O-CG 3.32Å; P108-M111 PolarHBondContact O-N 3.05Å
109	S	95.6	Very high	97.4	Very high	79 Å²	79	52 Å²	52	55%	0.552	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.8	-172.8	54.7	0	0	0	0	115.5	M111 N131	S109-M111 PolarHBondContact O-N 3.07Å; S109-N131 WeakPolarHBondContact CA-O 3.49Å; S109-N131 WeakPolarHBondContact CB-O 3.41Å
110	R	95.1	Very high	97.5	Very high	75 Å²	75	50.8 Å²	50.8	28%	0.283	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.5	-178.7	71.2	178	-177.2	-89.6	-5.5	114.6	E79 S91 P108	E79-R110 VanDerWaalsContact O-CZ 3.3Å; E79-R110 PolarHBondContact O-NH1 3.48Å; E79-R110 PolarHBondContact O-NH2 3.24Å; S91-R110 WeakPolarHBondContact O-CD 3.3Å; S91-R110 PolarHBondContact O-NE 3.17Å; P108-R110 VanDerWaalsContact C-N 3.28Å; P108-R110 PolarHBondContact O-N 3.38Å
111	M	97.4	Very high	97.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.205	C	C	.	.			trans	-79.8	131	-171.4	-60.4	-54	169.5	0	0	111.7	C86 M94 V107 P108 S109 V114	C86-M111 HydrophobicContact CB-CE 4.38Å; M94-M111 HydrophobicContact CB-CE 4.13Å; M94-M111 HydrophobicContact CB-CG 4.23Å; M94-M111 HydrophobicContact CB-SD 3.85Å; V107-M111 HydrophobicContact CG1-CB 3.71Å; V107-M111 HydrophobicContact CG1-CG 3.89Å; P108-M111 HydrophobicContact CB-CE 4.08Å; P108-M111 HydrophobicContact CB-CG 4.19Å; P108-M111 HydrophobicContact CG-CE 3.98Å; P108-M111 HydrophobicContact CG-CG 4.41Å; P108-M111 WeakPolarHBondContact O-CB 3.21Å; P108-M111 WeakPolarHBondContact O-CG 3.32Å; P108-M111 PolarHBondContact O-N 3.05Å; S109-M111 PolarHBondContact O-N 3.07Å; M111-V114 HydrophobicContact CB-CG2 3.73Å; M111-V114 HydrophobicContact CG-CG2 4.33Å
112	K	98.3	Very high	97.5	Very high	65 Å²	65	46.6 Å²	46.6	28%	0.283	21%	0.213	S	C	.	.	S	Bend	trans	-107.6	-32.7	171.7	-67	-173.2	158.4	-137.3	0	112.1	S92 E134 E136 W137	S92-K112 PolarHBondContact O-N 2.8Å; K112-E134 HydrophobicContact CG-CB 4.37Å; K112-E136 WeakPolarHBondContact CD-OE1 3.33Å; K112-E136 IonicContact NZ-OE1 2.86Å; K112-E136 PolarHBondContact NZ-OE1 3.2Å; K112-E136 PolarHBondContact O-N 3.44Å; K112-W137 PolarHBondContact O-N 3.31Å
113	Y	98.7	Very high	97.5	Very high	43 Å²	43	39.5 Å²	39.5	17%	0.169	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.6	-175.6	-46.7	-72.5	0	0	0	109.5	F90 S92 A93 M94 E136 W137	F90-Y113 AromaticContact CE1-CD2 3.69Å; F90-Y113 HydrophobicContact CE1-CD2 3.69Å; F90-Y113 HydrophobicContact CE1-CE2 4.18Å; F90-Y113 HydrophobicContact CE2-CE2 4.29Å; F90-Y113 AromaticContact CZ-CD2 3.47Å; F90-Y113 HydrophobicContact CZ-CD2 3.47Å; F90-Y113 VanDerWaalsContact CZ-CD2 3.47Å; F90-Y113 AromaticContact CZ-CE2 3.47Å; F90-Y113 HydrophobicContact CZ-CE2 3.47Å; F90-Y113 VanDerWaalsContact CZ-CE2 3.47Å; S92-Y113 PolarHBondContact O-N 3.21Å; S92-Y113 VanDerWaalsContact O-N 3.07Å; A93-Y113 CarbonylContact C-O 3.11Å; A93-Y113 VanDerWaalsContact CA-O 3.26Å; A93-Y113 WeakPolarHBondContact CA-O 3.31Å; M94-Y113 PolarHBondContact N-O 3.27Å; Y113-E136 HydrophobicContact CE1-CB 4.07Å; Y113-E136 WeakPolarHBondContact CE1-OE2 3.16Å; Y113-E136 PolarHBondContact OH-OE2 3.25Å; Y113-W137 HydrophobicContact CD1-CB 3.92Å; Y113-W137 AromaticContact CD1-CD2 3.85Å; Y113-W137 HydrophobicContact CD1-CD2 3.85Å; Y113-W137 HydrophobicContact CD1-CE3 4.32Å; Y113-W137 AromaticContact CD1-CG 3.67Å; Y113-W137 HydrophobicContact CD1-CG 3.67Å; Y113-W137 HydrophobicContact CE1-CD2 4.21Å; Y113-W137 HydrophobicContact CE1-CG 4.1Å; Y113-W137 AromaticContact CE1-NE1 4Å
114	V	98.6	Very high	97.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.3	-177.4	-174.8	0	0	0	0	111.2	M94 V107 M111 F116 L135 W137 L138 A139	M94-V114 HydrophobicContact CB-CG1 4.42Å; M94-V114 HydrophobicContact CB-CG2 4.32Å; M94-V114 HydrophobicContact CE-CG1 3.45Å; M94-V114 VanDerWaalsContact CE-CG1 3.45Å; M94-V114 HydrophobicContact CE-CG2 4.26Å; V107-V114 HydrophobicContact CG1-CG2 3.74Å; V107-V114 HydrophobicContact CG2-CG1 4.47Å; M111-V114 HydrophobicContact CB-CG2 3.73Å; M111-V114 HydrophobicContact CG-CG2 4.33Å; V114-F116 HydrophobicContact CB-CE2 4.31Å; V114-F116 HydrophobicContact CG1-CD2 3.62Å; V114-F116 HydrophobicContact CG1-CE1 4.3Å; V114-F116 HydrophobicContact CG1-CE2 3.1Å; V114-F116 HydrophobicContact CG1-CG 4.43Å; V114-F116 HydrophobicContact CG1-CZ 3.49Å; V114-F116 VanDerWaalsContact CG1-CZ 3.49Å; V114-L135 HydrophobicContact CB-CD1 4.08Å; V114-L135 HydrophobicContact CG2-CD1 3.41Å; V114-L135 VanDerWaalsContact CG2-CD1 3.41Å; V114-W137 PolarHBondContact N-O 3.32Å; V114-L138 HydrophobicContact CB-CD1 4.47Å; V114-A139 PolarHBondContact O-N 2.73Å
115	Y	98.8	Very high	97.5	Very high	44 Å²	44	36 Å²	36	17%	0.173	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	107.9	-171.7	-57.3	-80.7	0	0	0	110.5	M94 Y95 C96 D97 Q117 A139	M94-Y115 PolarHBondContact O-N 3.27Å; Y95-Y115 AromaticContact CD1-CD2 3.54Å; Y95-Y115 HydrophobicContact CD1-CD2 3.54Å; Y95-Y115 HydrophobicContact CD1-CE2 4.12Å; Y95-Y115 HydrophobicContact CD1-CG 4.11Å; Y95-Y115 AromaticContact CE1-CD2 3.46Å; Y95-Y115 HydrophobicContact CE1-CD2 3.46Å; Y95-Y115 VanDerWaalsContact CE1-CD2 3.46Å; Y95-Y115 AromaticContact CE1-CE2 3.54Å; Y95-Y115 HydrophobicContact CE1-CE2 3.54Å; Y95-Y115 HydrophobicContact CE1-CG 4.23Å; Y95-Y115 HydrophobicContact CG-CD2 4.22Å; Y95-Y115 AromaticContact CZ-CE2 3.86Å; C96-Y115 CarbonylContact C-O 3.55Å; C96-Y115 VanDerWaalsContact C-O 3.3Å; C96-Y115 VanDerWaalsContact CA-O 3.29Å; C96-Y115 WeakPolarHBondContact CA-O 3.37Å; C96-Y115 WeakPolarHBondContact CB-O 3.15Å; C96-Y115 PolarHBondContact N-O 3.19Å; D97-Y115 PolarHBondContact N-O 3.37Å; D97-Y115 VanDerWaalsContact N-O 3.17Å; Y115-Q117 VanDerWaalsContact CB-OE1 3.3Å; Y115-A139 HydrophobicContact CD1-CB 4.1Å
116	F	98.8	Very high	97.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.206	C	C	.	.			trans	-118.1	10.2	177.7	-66.9	-67.2	0	0	0	112.7	M94 C96 L104 P105 V107 V114 N119 I121 F129 L138 A139 L140 N143	M94-F116 HydrophobicContact CE-CE1 4.14Å; M94-F116 HydrophobicContact CE-CE2 4.39Å; M94-F116 HydrophobicContact CE-CZ 3.57Å; C96-F116 HydrophobicContact CB-CD1 3.41Å; C96-F116 VanDerWaalsContact CB-CD1 3.41Å; C96-F116 HydrophobicContact CB-CE1 3.58Å; C96-F116 HydrophobicContact CB-CG 4.45Å; C96-F116 WeakPolarHBondContact SG-CE1 3.42Å; L104-F116 HydrophobicContact CD1-CD2 3.8Å; L104-F116 HydrophobicContact CD1-CE2 3.77Å; L104-F116 HydrophobicContact CD1-CG 4.26Å; L104-F116 HydrophobicContact CD1-CZ 4.25Å; L104-F116 HydrophobicContact CD2-CE2 4.16Å; L104-F116 HydrophobicContact CD2-CZ 4.12Å; L104-F116 HydrophobicContact CG-CD1 4.48Å; L104-F116 HydrophobicContact CG-CD2 4.26Å; L104-F116 HydrophobicContact CG-CE1 4.17Å; L104-F116 HydrophobicContact CG-CE2 3.86Å; L104-F116 HydrophobicContact CG-CZ 3.83Å; P105-F116 HydrophobicContact CG-CE1 3.81Å; P105-F116 HydrophobicContact CG-CZ 4.26Å; V107-F116 HydrophobicContact CG2-CE2 4.08Å; V107-F116 HydrophobicContact CG2-CZ 4.03Å; V114-F116 HydrophobicContact CB-CE2 4.31Å; V114-F116 HydrophobicContact CG1-CD2 3.62Å; V114-F116 HydrophobicContact CG1-CE1 4.3Å; V114-F116 HydrophobicContact CG1-CE2 3.1Å; V114-F116 HydrophobicContact CG1-CG 4.43Å; V114-F116 HydrophobicContact CG1-CZ 3.49Å; V114-F116 VanDerWaalsContact CG1-CZ 3.49Å; F116-N119 PolarHBondContact O-ND2 2.98Å; F116-I121 HydrophobicContact CB-CD1 3.98Å; F116-I121 HydrophobicContact CD1-CD1 4.38Å; F116-I121 HydrophobicContact CG-CD1 4.43Å; F116-F129 HydrophobicContact CE2-CE1 4.22Å; F116-L138 HydrophobicContact CD2-CD1 4.05Å; F116-L138 HydrophobicContact CE2-CD1 4.3Å; F116-A139 CarbonylContact C-O 3.6Å; F116-A139 WeakPolarHBondContact CA-O 3.35Å; F116-A139 WeakPolarHBondContact CB-O 3.23Å; F116-A139 PolarHBondContact N-O 3.09Å; F116-L140 HydrophobicContact CB-CD2 3.75Å; F116-L140 HydrophobicContact CD2-CD2 3.88Å; F116-L140 HydrophobicContact CG-CD2 4.15Å; F116-N143 PolarHBondContact O-ND2 2.8Å
117	Q	98.7	Very high	97.4	Very high	26 Å²	26	36.4 Å²	36.4	12%	0.121	19%	0.187	C	C	.	.			trans	-64.5	159.8	-175.6	68.1	-83.9	6.3	0	0	113.8	D97 T98 Y115 N119 A139 H141	D97-Q117 CarbonylContact C-O 3.13Å; D97-Q117 WeakPolarHBondContact CA-O 3.23Å; D97-Q117 HydrophobicContact CB-CG 3.94Å; D97-Q117 WeakPolarHBondContact CB-O 3.42Å; T98-Q117 PolarHBondContact N-O 3.38Å; Y115-Q117 VanDerWaalsContact CB-OE1 3.3Å; Q117-N119 PolarHBondContact O-ND2 3.08Å; Q117-A139 PolarHBondContact N-O 3Å; Q117-H141 WeakPolarHBondContact CA-O 3.43Å; Q117-H141 VanDerWaalsContact CB-CD2 3.47Å; Q117-H141 WeakPolarHBondContact CB-CD2 3.45Å; Q117-H141 VanDerWaalsContact CB-CE1 3.47Å; Q117-H141 WeakPolarHBondContact CB-CE1 3.33Å; Q117-H141 WeakPolarHBondContact CB-NE2 3.48Å; Q117-H141 WeakPolarHBondContact CB-O 3.15Å; Q117-H141 WeakPolarHBondContact CG-NE2 3.28Å
118	N	98.7	Very high	97.3	Very high	69 Å²	69	36.3 Å²	36.3	37%	0.369	19%	0.186	S	C	.	.	S	Bend	trans	59.5	47.8	175.7	-52.3	-37.1	0	0	0	112.9	T98 H141 N142	T98-N118 VanDerWaalsContact CA-O 3.31Å; T98-N118 WeakPolarHBondContact CA-O 3.44Å; T98-N118 PolarHBondContact N-O 2.93Å; N118-H141 PolarHBondContact N-O 3.15Å; N118-H141 VanDerWaalsContact N-O 3.17Å; N118-N142 VanDerWaalsContact CA-O 3.32Å; N118-N142 WeakPolarHBondContact CA-O 3.34Å; N118-N142 PolarHBondContact N-O 2.88Å; N118-N142 WeakPolarHBondContact OD1-CB 3.28Å; N118-N142 PolarHBondContact OD1-ND2 3.09Å
119	N	98.8	Very high	97.3	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.043	18%	0.181	C	C	.	.	S	Bend	trans	-126.4	-170.1	178	-79	-61.4	0	0	0	110.4	C96 R99 N100 L101 F116 Q117 I121 N142 N143	C96-N119 PolarHBondContact O-ND2 3.06Å; R99-N119 PolarHBondContact N-OD1 3.24Å; N100-N119 PolarHBondContact N-OD1 3.01Å; L101-N119 HydrophobicContact CB-CB 4.14Å; L101-N119 PolarHBondContact N-OD1 2.81Å; F116-N119 PolarHBondContact O-ND2 2.98Å; Q117-N119 PolarHBondContact O-ND2 3.08Å; N119-I121 HydrophobicContact CB-CD1 4.2Å; N119-I121 HydrophobicContact CB-CG1 4.02Å; N119-N142 PolarHBondContact N-O 3.22Å; N119-N143 WeakPolarHBondContact CA-OD1 3.46Å; N119-N143 WeakPolarHBondContact CB-OD1 3.42Å; N119-N143 PolarHBondContact N-OD1 3.31Å; N119-N143 PolarHBondContact O-OD1 2.96Å
120	Q	98.5	Very high	97.3	Very high	57 Å²	57	34.2 Å²	34.2	27%	0.266	17%	0.168	S	C	.	.			trans	-115.1	33.8	176.9	-65.3	127.5	42.7	0	0	110.7	N100 L101 R102 T122 N143	N100-Q120 PolarHBondContact OD1-NE2 3.09Å; L101-Q120 CarbonylContact O-C 3.48Å; L101-Q120 WeakPolarHBondContact O-CA 3.37Å; L101-Q120 PolarHBondContact O-N 3.06Å; R102-Q120 HydrophobicContact CG-CB 4.41Å; Q120-T122 PolarHBondContact O-N 3.29Å; Q120-N143 PolarHBondContact N-OD1 3Å
121	I	98.6	Very high	97.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.			trans	-69.7	126.8	-178.4	-59.9	170	0	0	0	108.4	L101 L104 F116 N119 S123 N143 Q144 I145	L101-I121 HydrophobicContact CB-CG1 4.33Å; L101-I121 PolarHBondContact O-N 3.39Å; L104-I121 HydrophobicContact CB-CG2 4.44Å; F116-I121 HydrophobicContact CB-CD1 3.98Å; F116-I121 HydrophobicContact CD1-CD1 4.38Å; F116-I121 HydrophobicContact CG-CD1 4.43Å; N119-I121 HydrophobicContact CB-CD1 4.2Å; N119-I121 HydrophobicContact CB-CG1 4.02Å; I121-S123 VanDerWaalsContact CG2-O 3.3Å; I121-S123 WeakPolarHBondContact CG2-O 3.49Å; I121-N143 HydrophobicContact CB-CB 4.38Å; I121-N143 VanDerWaalsContact CB-OD1 3.28Å; I121-N143 WeakPolarHBondContact CB-OD1 3.39Å; I121-N143 WeakPolarHBondContact CG1-OD1 3.32Å; I121-N143 PolarHBondContact N-OD1 3.12Å; I121-Q144 CarbonylContact O-C 3.53Å; I121-Q144 WeakPolarHBondContact O-CA 3.41Å; I121-Q144 PolarHBondContact O-N 3.09Å; I121-I145 HydrophobicContact CG2-CG1 4.19Å; I121-I145 WeakPolarHBondContact O-CG1 3.39Å; I121-I145 PolarHBondContact O-N 3.44Å
122	T	98	Very high	97.2	Very high	41 Å²	41	36 Å²	36	25%	0.252	18%	0.183	S	C	.	.			trans	-108.2	-12.9	-179.3	64.1	0	0	0	0	114.1	Q120 Q144 T146 K149	Q120-T122 PolarHBondContact O-N 3.29Å; T122-Q144 WeakPolarHBondContact CA-O 3.35Å; T122-Q144 HydrophobicContact CG2-CB 4.01Å; T122-T146 PolarHBondContact O-N 3.35Å; T122-K149 WeakPolarHBondContact O-CB 3.22Å; T122-K149 WeakPolarHBondContact O-CD 3.47Å
123	S	97.4	Very high	97.1	Very high	36 Å²	36	35.8 Å²	35.8	25%	0.252	19%	0.188	S	C	.	.			trans	-146.4	148.3	-172.9	59	0	0	0	0	111.2	I121 K149	I121-S123 VanDerWaalsContact CG2-O 3.3Å; I121-S123 WeakPolarHBondContact CG2-O 3.49Å; S123-K149 WeakPolarHBondContact CA-O 3.48Å; S123-K149 WeakPolarHBondContact CB-O 3.2Å
124	I	97.6	Very high	97	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-116	110	167.3	-55.2	172.6	0	0	0	106	A128 F129 L140 I145 K149 M150 G151 V154 F155 M166	I124-A128 HydrophobicContact CG2-CB 4.22Å; I124-F129 HydrophobicContact CG2-CE2 3.64Å; I124-F129 HydrophobicContact CG2-CZ 4.02Å; I124-L140 HydrophobicContact CD1-CD1 3.86Å; I124-I145 HydrophobicContact CD1-CD1 4.14Å; I124-I145 HydrophobicContact CD1-CG2 4.23Å; I124-I145 HydrophobicContact CG1-CD1 4.22Å; I124-I145 HydrophobicContact CG1-CG2 4.23Å; I124-K149 PolarHBondContact N-O 2.93Å; I124-M150 HydrophobicContact CD1-CE 4.14Å; I124-M150 HydrophobicContact CD1-CG 4.37Å; I124-G151 PolarHBondContact O-N 3.1Å; I124-V154 HydrophobicContact CG2-CG2 3.53Å; I124-F155 HydrophobicContact CD1-CZ 4.29Å; I124-M166 HydrophobicContact CD1-CE 4.02Å
125	Q	95.6	Very high	97	Very high	53 Å²	53	37.9 Å²	37.9	25%	0.248	20%	0.199	C	C	.	.			trans	-67.9	155.4	-178.6	70.8	-81.9	16.5	0	0	112.2	L104 F106 G127 A128	L104-Q125 PolarHBondContact O-NE2 3.25Å; L104-Q125 PolarHBondContact O-OE1 3.27Å; F106-Q125 HydrophobicContact CE1-CG 4.23Å; F106-Q125 HydrophobicContact CZ-CG 4.11Å; Q125-G127 PolarHBondContact O-N 2.9Å; Q125-A128 HydrophobicContact CG-CB 4.02Å; Q125-A128 WeakPolarHBondContact O-CB 3Å; Q125-A128 PolarHBondContact O-N 3.22Å
126	E	94.9	Very high	97	Very high	133 Å²	133	37.6 Å²	37.6	62%	0.621	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	136.6	174.3	-171.3	168.2	178.8	0	0	110.5	A128	E126-A128 VanDerWaalsContact C-N 3.27Å; E126-A128 PolarHBondContact O-N 3.47Å
127	G	93.9	Very high	97	Very high	16 Å²	16	41.3 Å²	41.3	17%	0.165	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	6.4	-179.6	0	0	0	0	0	116	Q125 F129 D130	Q125-G127 PolarHBondContact O-N 2.9Å; G127-F129 PolarHBondContact O-N 3.04Å; G127-D130 VanDerWaalsContact CA-CG 3.45Å; G127-D130 WeakPolarHBondContact O-CB 3.2Å; G127-D130 PolarHBondContact O-N 3.35Å; G127-D130 VanDerWaalsContact O-N 3.08Å
128	A	95.7	Very high	97	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.7	-177.4	0	0	0	0	0	114.4	L104 V107 I124 Q125 E126	L104-A128 HydrophobicContact CD2-CB 3.64Å; V107-A128 PolarHBondContact N-O 3.48Å; I124-A128 HydrophobicContact CG2-CB 4.22Å; Q125-A128 HydrophobicContact CG-CB 4.02Å; Q125-A128 WeakPolarHBondContact O-CB 3Å; Q125-A128 PolarHBondContact O-N 3.22Å; E126-A128 VanDerWaalsContact C-N 3.27Å; E126-A128 PolarHBondContact O-N 3.47Å
129	F	96.9	Very high	97	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	8.4	-179.5	-45.6	-64.9	0	0	0	113.6	L104 V107 F116 I124 G127 N131 A132 L138 L140 V154 F155 L158	L104-F129 HydrophobicContact CD1-CE1 4.03Å; L104-F129 HydrophobicContact CD1-CZ 3.7Å; L104-F129 HydrophobicContact CD2-CE1 3.77Å; L104-F129 HydrophobicContact CD2-CZ 4Å; V107-F129 HydrophobicContact CB-CD1 4.26Å; V107-F129 HydrophobicContact CG2-CD1 3.54Å; V107-F129 HydrophobicContact CG2-CE1 3.79Å; F116-F129 HydrophobicContact CE2-CE1 4.22Å; I124-F129 HydrophobicContact CG2-CE2 3.64Å; I124-F129 HydrophobicContact CG2-CZ 4.02Å; G127-F129 PolarHBondContact O-N 3.04Å; F129-N131 PolarHBondContact O-N 3.19Å; F129-A132 PolarHBondContact O-N 3.37Å; F129-A132 VanDerWaalsContact O-N 3.09Å; F129-L138 HydrophobicContact CD2-CD2 4.41Å; F129-L138 HydrophobicContact CE1-CD1 3.92Å; F129-L138 HydrophobicContact CE1-CD2 4.06Å; F129-L138 HydrophobicContact CE2-CD2 3.9Å; F129-L138 HydrophobicContact CZ-CD1 4.12Å; F129-L138 HydrophobicContact CZ-CD2 3.71Å; F129-L140 HydrophobicContact CZ-CD1 4.38Å; F129-V154 HydrophobicContact CD2-CG2 3.7Å; F129-V154 HydrophobicContact CE2-CG2 3.84Å; F129-F155 HydrophobicContact CD2-CD1 4.21Å; F129-F155 HydrophobicContact CD2-CE1 4.21Å; F129-F155 HydrophobicContact CE2-CD1 4.2Å; F129-F155 AromaticContact CE2-CE1 3.74Å; F129-F155 HydrophobicContact CE2-CE1 3.74Å; F129-L158 HydrophobicContact CB-CD1 4.09Å; F129-L158 HydrophobicContact CB-CD2 3.77Å; F129-L158 HydrophobicContact CB-CG 4.34Å; F129-L158 HydrophobicContact CD2-CD1 4.35Å; F129-L158 HydrophobicContact CG-CD1 4.33Å
130	D	95	Very high	97	Very high	51 Å²	51	36.6 Å²	36.6	27%	0.273	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30.2	-169.4	-90.1	15.9	0	0	0	113.9	G127 K157	G127-D130 VanDerWaalsContact CA-CG 3.45Å; G127-D130 WeakPolarHBondContact O-CB 3.2Å; G127-D130 PolarHBondContact O-N 3.35Å; G127-D130 VanDerWaalsContact O-N 3.08Å; D130-K157 HydrophobicContact CB-CD 4.16Å; D130-K157 VanDerWaalsContact CG-NZ 3.3Å; D130-K157 IonicContact OD1-NZ 2.7Å; D130-K157 IonicContact OD2-NZ 2.99Å; D130-K157 PolarHBondContact OD2-NZ 3.33Å
131	N	94.1	Very high	97	Very high	113 Å²	113	35.8 Å²	35.8	60%	0.604	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-26.4	178.5	-69.6	-17.3	0	0	0	112.5	S109 F129 T133	S109-N131 WeakPolarHBondContact CA-O 3.49Å; S109-N131 WeakPolarHBondContact CB-O 3.41Å; F129-N131 PolarHBondContact O-N 3.19Å; N131-T133 VanDerWaalsContact C-N 3.29Å; N131-T133 PolarHBondContact O-N 3.34Å; N131-T133 VanDerWaalsContact O-N 3.12Å
132	A	95.8	Very high	97	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.			trans	-89	58.9	-175	0	0	0	0	0	111.3	V107 F129 E134 L135 L158	V107-A132 HydrophobicContact CB-CB 4.02Å; V107-A132 HydrophobicContact CG1-CB 3.57Å; F129-A132 PolarHBondContact O-N 3.37Å; F129-A132 VanDerWaalsContact O-N 3.09Å; A132-E134 PolarHBondContact O-N 3.31Å; A132-L135 VanDerWaalsContact O-CB 3.31Å; A132-L135 WeakPolarHBondContact O-CB 3.29Å; A132-L135 PolarHBondContact O-N 3.27Å; A132-L158 VanDerWaalsContact O-CD2 3.29Å; A132-L158 WeakPolarHBondContact O-CD2 3.35Å
133	T	95.8	Very high	97	Very high	61 Å²	61	37.1 Å²	37.1	37%	0.374	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-20	-175	55.6	0	0	0	0	113.8	N131 L135	N131-T133 VanDerWaalsContact C-N 3.29Å; N131-T133 PolarHBondContact O-N 3.34Å; N131-T133 VanDerWaalsContact O-N 3.12Å; T133-L135 VanDerWaalsContact C-N 3.3Å
134	E	96.8	Very high	97.1	Very high	86 Å²	86	40 Å²	40	40%	0.402	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	7.8	177.6	-61.2	-56.3	139.5	0	0	113.4	K112 A132 E136 N160	K112-E134 HydrophobicContact CG-CB 4.37Å; A132-E134 PolarHBondContact O-N 3.31Å; E134-E136 PolarHBondContact O-N 3.05Å; E134-N160 PolarHBondContact OE2-ND2 3.08Å
135	L	98.4	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.			trans	-61.6	124	-178.7	-161.1	73.3	0	0	0	110.9	V114 A132 T133 L138 L158 N160 L161	V114-L135 HydrophobicContact CB-CD1 4.08Å; V114-L135 HydrophobicContact CG2-CD1 3.41Å; V114-L135 VanDerWaalsContact CG2-CD1 3.41Å; A132-L135 VanDerWaalsContact O-CB 3.31Å; A132-L135 WeakPolarHBondContact O-CB 3.29Å; A132-L135 PolarHBondContact O-N 3.27Å; T133-L135 VanDerWaalsContact C-N 3.3Å; L135-L138 HydrophobicContact CD2-CB 3.91Å; L135-L138 HydrophobicContact CD2-CD1 4.3Å; L135-L138 HydrophobicContact CD2-CD2 4.16Å; L135-L138 HydrophobicContact CD2-CG 4.35Å; L135-L158 HydrophobicContact CB-CD2 4.12Å; L135-L158 HydrophobicContact CD2-CD1 4.03Å; L135-L158 HydrophobicContact CD2-CD2 4.44Å; L135-N160 CarbonylContact O-C 3.09Å; L135-L161 HydrophobicContact CB-CD1 4.45Å; L135-L161 HydrophobicContact CD2-CD1 4.03Å; L135-L161 HydrophobicContact CG-CD1 4.08Å; L135-L161 WeakPolarHBondContact O-CA 3.35Å; L135-L161 PolarHBondContact O-N 3.31Å; L135-L161 VanDerWaalsContact O-N 3.09Å
136	E	98.6	Very high	97.3	Very high	38 Å²	38	39.5 Å²	39.5	18%	0.178	20%	0.201	C	C	.	.			trans	-103	-44	178.1	-68.9	171.8	-156.5	0	0	110.2	K112 Y113 E134 L161 E162 R163	K112-E136 WeakPolarHBondContact CD-OE1 3.33Å; K112-E136 IonicContact NZ-OE1 2.86Å; K112-E136 PolarHBondContact NZ-OE1 3.2Å; K112-E136 PolarHBondContact O-N 3.44Å; Y113-E136 HydrophobicContact CE1-CB 4.07Å; Y113-E136 WeakPolarHBondContact CE1-OE2 3.16Å; Y113-E136 PolarHBondContact OH-OE2 3.25Å; E134-E136 PolarHBondContact O-N 3.05Å; E136-L161 WeakPolarHBondContact O-CD1 3.47Å; E136-E162 PolarHBondContact O-N 3.45Å; E136-R163 PolarHBondContact O-N 2.74Å; E136-R163 VanDerWaalsContact O-N 3.08Å
137	W	98.8	Very high	97.4	Very high	79 Å²	79	34.1 Å²	34.1	30%	0.299	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.2	-177.7	-60.1	12.5	0	0	0	111.2	K112 Y113 V114 R163	K112-W137 PolarHBondContact O-N 3.31Å; Y113-W137 HydrophobicContact CD1-CB 3.92Å; Y113-W137 AromaticContact CD1-CD2 3.85Å; Y113-W137 HydrophobicContact CD1-CD2 3.85Å; Y113-W137 HydrophobicContact CD1-CE3 4.32Å; Y113-W137 AromaticContact CD1-CG 3.67Å; Y113-W137 HydrophobicContact CD1-CG 3.67Å; Y113-W137 HydrophobicContact CE1-CD2 4.21Å; Y113-W137 HydrophobicContact CE1-CG 4.1Å; Y113-W137 AromaticContact CE1-NE1 4Å; V114-W137 PolarHBondContact N-O 3.32Å; W137-R163 HydrophobicContact CG-CB 4.24Å
138	L	98.8	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	109.5	175.7	-179.9	54.4	0	0	0	110.5	V114 F116 F129 L135 L140 F155 L161 R163 L164 Y165	V114-L138 HydrophobicContact CB-CD1 4.47Å; F116-L138 HydrophobicContact CD2-CD1 4.05Å; F116-L138 HydrophobicContact CE2-CD1 4.3Å; F129-L138 HydrophobicContact CD2-CD2 4.41Å; F129-L138 HydrophobicContact CE1-CD1 3.92Å; F129-L138 HydrophobicContact CE1-CD2 4.06Å; F129-L138 HydrophobicContact CE2-CD2 3.9Å; F129-L138 HydrophobicContact CZ-CD1 4.12Å; F129-L138 HydrophobicContact CZ-CD2 3.71Å; L135-L138 HydrophobicContact CD2-CB 3.91Å; L135-L138 HydrophobicContact CD2-CD1 4.3Å; L135-L138 HydrophobicContact CD2-CD2 4.16Å; L135-L138 HydrophobicContact CD2-CG 4.35Å; L138-L140 HydrophobicContact CD1-CD1 4.05Å; L138-L140 HydrophobicContact CD1-CG 4.02Å; L138-L140 HydrophobicContact CD2-CD1 3.79Å; L138-L140 HydrophobicContact CG-CD1 3.77Å; L138-L140 HydrophobicContact CG-CG 4.09Å; L138-F155 HydrophobicContact CD2-CD1 4.21Å; L138-F155 HydrophobicContact CD2-CE1 3.69Å; L138-L161 HydrophobicContact CB-CD1 3.94Å; L138-R163 PolarHBondContact N-O 3.38Å; L138-L164 HydrophobicContact CB-CD1 4.05Å; L138-L164 HydrophobicContact CD2-CD1 3.89Å; L138-L164 HydrophobicContact CG-CD1 4Å; L138-Y165 PolarHBondContact O-N 2.96Å
139	A	98.9	Very high	97.6	Very high	4 Å²	4	45 Å²	45	3%	0.033	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.1	176.3	0	0	0	0	0	111.5	V114 Y115 F116 Q117 Y165	V114-A139 PolarHBondContact O-N 2.73Å; Y115-A139 HydrophobicContact CD1-CB 4.1Å; F116-A139 CarbonylContact C-O 3.6Å; F116-A139 WeakPolarHBondContact CA-O 3.35Å; F116-A139 WeakPolarHBondContact CB-O 3.23Å; F116-A139 PolarHBondContact N-O 3.09Å; Q117-A139 PolarHBondContact N-O 3Å; A139-Y165 HydrophobicContact CB-CD2 4.19Å
140	L	98.8	Very high	97.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.			trans	-125.8	10.2	179.3	-72.8	162.5	0	0	0	112.3	L104 F116 I124 F129 L138 N143 I145 Y165 M166 N169	L104-L140 HydrophobicContact CD1-CD2 3.53Å; F116-L140 HydrophobicContact CB-CD2 3.75Å; F116-L140 HydrophobicContact CD2-CD2 3.88Å; F116-L140 HydrophobicContact CG-CD2 4.15Å; I124-L140 HydrophobicContact CD1-CD1 3.86Å; F129-L140 HydrophobicContact CZ-CD1 4.38Å; L138-L140 HydrophobicContact CD1-CD1 4.05Å; L138-L140 HydrophobicContact CD1-CG 4.02Å; L138-L140 HydrophobicContact CD2-CD1 3.79Å; L138-L140 HydrophobicContact CG-CD1 3.77Å; L138-L140 HydrophobicContact CG-CG 4.09Å; L140-N143 PolarHBondContact O-ND2 3.17Å; L140-I145 HydrophobicContact CB-CD1 4.09Å; L140-I145 HydrophobicContact CD2-CD1 4.19Å; L140-Y165 CarbonylContact C-O 3.48Å; L140-Y165 WeakPolarHBondContact CA-O 3.26Å; L140-Y165 WeakPolarHBondContact CB-O 3.12Å; L140-Y165 PolarHBondContact N-O 2.77Å; L140-M166 HydrophobicContact CB-CG 4.31Å; L140-M166 HydrophobicContact CD1-CG 4.47Å; L140-N169 PolarHBondContact O-ND2 3.38Å
141	H	98.8	Very high	97.4	Very high	39 Å²	39	45 Å²	45	18%	0.181	23%	0.226	C	C	.	.			trans	-68.2	159.2	-176.4	59.4	-95.5	0	0	0	112.6	Q117 N118 N143 Y165 N167	Q117-H141 WeakPolarHBondContact CA-O 3.43Å; Q117-H141 VanDerWaalsContact CB-CD2 3.47Å; Q117-H141 WeakPolarHBondContact CB-CD2 3.45Å; Q117-H141 VanDerWaalsContact CB-CE1 3.47Å; Q117-H141 WeakPolarHBondContact CB-CE1 3.33Å; Q117-H141 WeakPolarHBondContact CB-NE2 3.48Å; Q117-H141 WeakPolarHBondContact CB-O 3.15Å; Q117-H141 WeakPolarHBondContact CG-NE2 3.28Å; N118-H141 PolarHBondContact N-O 3.15Å; N118-H141 VanDerWaalsContact N-O 3.17Å; H141-N143 PolarHBondContact O-ND2 3.22Å; H141-Y165 PolarHBondContact N-O 2.9Å; H141-Y165 WeakPolarHBondContact ND1-CB 3.27Å; H141-N167 CarbonylContact C-O 3.52Å; H141-N167 WeakPolarHBondContact CA-O 3.35Å; H141-N167 VanDerWaalsContact CB-O 3.26Å; H141-N167 WeakPolarHBondContact CB-O 3.42Å; H141-N167 VanDerWaalsContact CB-OD1 3.23Å; H141-N167 WeakPolarHBondContact CB-OD1 3.38Å
142	N	98.8	Very high	97.3	Very high	61 Å²	61	47.6 Å²	47.6	33%	0.326	23%	0.232	S	C	.	.	S	Bend	trans	55.8	57.4	-177	-57.3	-25.5	0	0	0	111.5	N118 N119 N167 N168	N118-N142 VanDerWaalsContact CA-O 3.32Å; N118-N142 WeakPolarHBondContact CA-O 3.34Å; N118-N142 PolarHBondContact N-O 2.88Å; N118-N142 WeakPolarHBondContact OD1-CB 3.28Å; N118-N142 PolarHBondContact OD1-ND2 3.09Å; N119-N142 PolarHBondContact N-O 3.22Å; N142-N167 PolarHBondContact N-O 3.01Å; N142-N167 VanDerWaalsContact N-O 3.09Å; N142-N168 VanDerWaalsContact CA-O 3.29Å; N142-N168 WeakPolarHBondContact CA-O 3.3Å; N142-N168 PolarHBondContact N-O 2.81Å; N142-N168 WeakPolarHBondContact OD1-CB 3.35Å; N142-N168 PolarHBondContact OD1-ND2 3.25Å
143	N	98.8	Very high	97.2	Very high	9 Å²	9	56 Å²	56	5%	0.048	26%	0.264	C	S	.	.	S	Bend	trans	-134.3	-168.9	175.1	-86.2	-75.6	0	0	0	109.3	F116 N119 Q120 I121 L140 H141 I145 N168 N169	F116-N143 PolarHBondContact O-ND2 2.8Å; N119-N143 WeakPolarHBondContact CA-OD1 3.46Å; N119-N143 WeakPolarHBondContact CB-OD1 3.42Å; N119-N143 PolarHBondContact N-OD1 3.31Å; N119-N143 PolarHBondContact O-OD1 2.96Å; Q120-N143 PolarHBondContact N-OD1 3Å; I121-N143 HydrophobicContact CB-CB 4.38Å; I121-N143 VanDerWaalsContact CB-OD1 3.28Å; I121-N143 WeakPolarHBondContact CB-OD1 3.39Å; I121-N143 WeakPolarHBondContact CG1-OD1 3.32Å; I121-N143 PolarHBondContact N-OD1 3.12Å; L140-N143 PolarHBondContact O-ND2 3.17Å; H141-N143 PolarHBondContact O-ND2 3.22Å; N143-I145 HydrophobicContact CB-CD1 4.14Å; N143-I145 HydrophobicContact CB-CG1 4.12Å; N143-N168 PolarHBondContact N-O 3.08Å; N143-N168 VanDerWaalsContact N-O 3.09Å; N143-N169 WeakPolarHBondContact CA-OD1 3.24Å; N143-N169 WeakPolarHBondContact CB-OD1 3.17Å; N143-N169 PolarHBondContact O-OD1 3.05Å
144	Q	98.6	Very high	97.1	Very high	96 Å²	96	53.4 Å²	53.4	45%	0.449	25%	0.248	S	C	.	.			trans	-122.5	32.5	-178	-62.8	173.3	32.7	0	0	111.3	I121 T122 T146 N169 N170	I121-Q144 CarbonylContact O-C 3.53Å; I121-Q144 WeakPolarHBondContact O-CA 3.41Å; I121-Q144 PolarHBondContact O-N 3.09Å; T122-Q144 WeakPolarHBondContact CA-O 3.35Å; T122-Q144 HydrophobicContact CG2-CB 4.01Å; Q144-T146 PolarHBondContact O-N 3.34Å; Q144-N169 PolarHBondContact N-OD1 2.83Å; Q144-N170 WeakPolarHBondContact CA-OD1 3.48Å
145	I	98.6	Very high	97.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.229	C	C	.	.			trans	-69.6	131.1	-174.1	-60	162.3	0	0	0	109.3	I121 I124 L140 N143 M150 N169 N170 L171	I121-I145 HydrophobicContact CG2-CG1 4.19Å; I121-I145 WeakPolarHBondContact O-CG1 3.39Å; I121-I145 PolarHBondContact O-N 3.44Å; I124-I145 HydrophobicContact CD1-CD1 4.14Å; I124-I145 HydrophobicContact CD1-CG2 4.23Å; I124-I145 HydrophobicContact CG1-CD1 4.22Å; I124-I145 HydrophobicContact CG1-CG2 4.23Å; L140-I145 HydrophobicContact CB-CD1 4.09Å; L140-I145 HydrophobicContact CD2-CD1 4.19Å; N143-I145 HydrophobicContact CB-CD1 4.14Å; N143-I145 HydrophobicContact CB-CG1 4.12Å; I145-M150 HydrophobicContact CG2-CG 3.88Å; I145-M150 HydrophobicContact CG2-SD 4.24Å; I145-N169 HydrophobicContact CB-CB 4.47Å; I145-N169 VanDerWaalsContact CB-OD1 3.27Å; I145-N169 WeakPolarHBondContact CB-OD1 3.2Å; I145-N169 WeakPolarHBondContact CG1-OD1 3.3Å; I145-N169 PolarHBondContact N-OD1 3.17Å; I145-N170 CarbonylContact O-C 3.52Å; I145-N170 VanDerWaalsContact O-CA 3.3Å; I145-N170 WeakPolarHBondContact O-CA 3.42Å; I145-N170 PolarHBondContact O-N 3.14Å; I145-L171 HydrophobicContact CG2-CD2 4.01Å; I145-L171 PolarHBondContact O-N 3.09Å
146	T	98.2	Very high	96.8	Very high	42 Å²	42	51.4 Å²	51.4	26%	0.258	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-110.7	148.5	175.5	66.3	0	0	0	0	111.5	T122 Q144 E148 K149 M150 N170	T122-T146 PolarHBondContact O-N 3.35Å; Q144-T146 PolarHBondContact O-N 3.34Å; T146-E148 PolarHBondContact O-N 3.28Å; T146-K149 PolarHBondContact O-N 3.14Å; T146-K149 WeakPolarHBondContact OG1-CB 3.43Å; T146-K149 WeakPolarHBondContact OG1-CG 3.5Å; T146-M150 PolarHBondContact O-N 2.85Å; T146-N170 HydrophobicContact CG2-CB 3.86Å
147	S	97.4	Very high	96.6	Very high	20 Å²	20	54.6 Å²	54.6	14%	0.14	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-55.6	-37.7	-179.4	-40.5	0	0	0	0	113.1	K149 M150 T172 K173	S147-K149 VanDerWaalsContact C-N 3.26Å; S147-K149 PolarHBondContact O-N 3.08Å; S147-M150 PolarHBondContact O-N 3.45Å; S147-T172 PolarHBondContact OG-N 3.32Å; S147-T172 PolarHBondContact OG-OG1 3.19Å; S147-K173 PolarHBondContact OG-N 3.25Å
148	E	96.8	Very high	96.6	Very high	136 Å²	136	50.8 Å²	50.8	64%	0.636	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-73.4	-19.6	-176.5	-55.4	-55.5	143.2	0	0	112.6	T146 K173	T146-E148 PolarHBondContact O-N 3.28Å; E148-K173 IonicContact OE1-NZ 3.63Å; E148-K173 PolarHBondContact OE1-NZ 3.02Å
149	K	96.5	Very high	96.4	Very high	110 Å²	110	58.6 Å²	58.6	48%	0.478	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-102.4	14.2	178.3	-68.3	-176	174	-176.4	0	112.9	T122 S123 I124 T146 S147	T122-K149 WeakPolarHBondContact O-CB 3.22Å; T122-K149 WeakPolarHBondContact O-CD 3.47Å; S123-K149 WeakPolarHBondContact CA-O 3.48Å; S123-K149 WeakPolarHBondContact CB-O 3.2Å; I124-K149 PolarHBondContact N-O 2.93Å; T146-K149 PolarHBondContact O-N 3.14Å; T146-K149 WeakPolarHBondContact OG1-CB 3.43Å; T146-K149 WeakPolarHBondContact OG1-CG 3.5Å; S147-K149 VanDerWaalsContact C-N 3.26Å; S147-K149 PolarHBondContact O-N 3.08Å
150	M	96.2	Very high	96.4	Very high	34 Å²	34	61.5 Å²	61.5	17%	0.167	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-92.1	128.8	170.7	-71.5	-175.2	62.3	0	0	110.5	I124 I145 T146 S147 V154 F155 M166 L171 P175	I124-M150 HydrophobicContact CD1-CE 4.14Å; I124-M150 HydrophobicContact CD1-CG 4.37Å; I145-M150 HydrophobicContact CG2-CG 3.88Å; I145-M150 HydrophobicContact CG2-SD 4.24Å; T146-M150 PolarHBondContact O-N 2.85Å; S147-M150 PolarHBondContact O-N 3.45Å; M150-V154 HydrophobicContact CE-CG1 3.98Å; M150-F155 HydrophobicContact CE-CE2 3.62Å; M150-F155 HydrophobicContact CE-CZ 3.9Å; M150-M166 HydrophobicContact CE-CE 3.92Å; M150-M166 HydrophobicContact SD-CE 3.96Å; M150-L171 HydrophobicContact SD-CD2 3.71Å; M150-P175 HydrophobicContact CE-CB 4.02Å
151	G	92.9	Very high	96.4	Very high	17 Å²	17	61.5 Å²	61.5	18%	0.175	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-57.4	150.2	173.8	0	0	0	0	0	111.7	I124 R153	I124-G151 PolarHBondContact O-N 3.1Å; G151-R153 PolarHBondContact O-N 2.95Å
152	K	91.8	Very high	96.4	Very high	167 Å²	167	62 Å²	62	73%	0.726	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	132	-179.8	-67.1	179.2	-177.3	173.9	0	109.7	V154	K152-V154 PolarHBondContact O-N 3.47Å; K152-V154 VanDerWaalsContact O-N 3.1Å
153	R	92.3	Very high	96.4	Very high	177 Å²	177	61.3 Å²	61.3	67%	0.668	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	33.2	173	-50.4	179.5	78	173	4.9	114	G151 F155 A156 P177	G151-R153 PolarHBondContact O-N 2.95Å; R153-F155 PolarHBondContact O-N 3.29Å; R153-F155 VanDerWaalsContact O-N 3.08Å; R153-A156 HydrophobicContact CB-CB 3.92Å; R153-A156 VanDerWaalsContact O-CB 3.23Å; R153-A156 WeakPolarHBondContact O-CB 3.37Å; R153-A156 PolarHBondContact O-N 2.98Å; R153-P177 HydrophobicContact CB-CG 4.44Å; R153-P177 HydrophobicContact CG-CG 4.42Å
154	V	95	Very high	96.4	Very high	7 Å²	7	60.9 Å²	60.9	4%	0.042	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.1	-170.5	69.6	0	0	0	0	114.7	I124 F129 M150 K152	I124-V154 HydrophobicContact CG2-CG2 3.53Å; F129-V154 HydrophobicContact CD2-CG2 3.7Å; F129-V154 HydrophobicContact CE2-CG2 3.84Å; M150-V154 HydrophobicContact CE-CG1 3.98Å; K152-V154 PolarHBondContact O-N 3.47Å; K152-V154 VanDerWaalsContact O-N 3.1Å
155	F	96.1	Very high	96.4	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.009	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-0.4	177.1	-51.2	-54.5	0	0	0	114	I124 F129 L138 M150 R153 K157 L158 L164 M166 P175 L178 P179	I124-F155 HydrophobicContact CD1-CZ 4.29Å; F129-F155 HydrophobicContact CD2-CD1 4.21Å; F129-F155 HydrophobicContact CD2-CE1 4.21Å; F129-F155 HydrophobicContact CE2-CD1 4.2Å; F129-F155 AromaticContact CE2-CE1 3.74Å; F129-F155 HydrophobicContact CE2-CE1 3.74Å; L138-F155 HydrophobicContact CD2-CD1 4.21Å; L138-F155 HydrophobicContact CD2-CE1 3.69Å; M150-F155 HydrophobicContact CE-CE2 3.62Å; M150-F155 HydrophobicContact CE-CZ 3.9Å; R153-F155 PolarHBondContact O-N 3.29Å; R153-F155 VanDerWaalsContact O-N 3.08Å; F155-K157 VanDerWaalsContact C-N 3.29Å; F155-K157 PolarHBondContact O-N 3.25Å; F155-L158 HydrophobicContact CB-CD1 4.34Å; F155-L158 HydrophobicContact CD1-CD1 3.94Å; F155-L158 PolarHBondContact O-N 3.24Å; F155-L158 VanDerWaalsContact O-N 3.17Å; F155-L164 HydrophobicContact CD2-CD2 4.3Å; F155-L164 HydrophobicContact CE1-CD1 4.33Å; F155-L164 HydrophobicContact CE2-CD2 4.07Å; F155-L164 HydrophobicContact CZ-CD1 4.31Å; F155-L164 HydrophobicContact CZ-CD2 4.28Å; F155-M166 HydrophobicContact CE2-SD 3.93Å; F155-M166 HydrophobicContact CZ-CE 4.22Å; F155-M166 HydrophobicContact CZ-SD 3.73Å; F155-P175 HydrophobicContact CE2-CB 4.02Å; F155-L178 HydrophobicContact CD2-CD2 4.34Å; F155-P179 HydrophobicContact CB-CG 4.38Å
156	A	92.2	Very high	96.4	Very high	42 Å²	42	58.6 Å²	58.6	35%	0.347	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-26	-168.3	0	0	0	0	0	114.3	R153 P177	R153-A156 HydrophobicContact CB-CB 3.92Å; R153-A156 VanDerWaalsContact O-CB 3.23Å; R153-A156 WeakPolarHBondContact O-CB 3.37Å; R153-A156 PolarHBondContact O-N 2.98Å; A156-P177 HydrophobicContact CB-CG 4.07Å
157	K	95.4	Very high	96.4	Very high	104 Å²	104	58 Å²	58	45%	0.452	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.4	178.8	-67.2	-174	-177.9	172.9	0	113.7	D130 F155 K159	D130-K157 HydrophobicContact CB-CD 4.16Å; D130-K157 VanDerWaalsContact CG-NZ 3.3Å; D130-K157 IonicContact OD1-NZ 2.7Å; D130-K157 IonicContact OD2-NZ 2.99Å; D130-K157 PolarHBondContact OD2-NZ 3.33Å; F155-K157 VanDerWaalsContact C-N 3.29Å; F155-K157 PolarHBondContact O-N 3.25Å; K157-K159 VanDerWaalsContact C-N 3.26Å; K157-K159 PolarHBondContact O-N 2.96Å
158	L	97.3	Very high	96.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.277	C	S	.	.			trans	-83.4	68.8	-174.5	-52	-179.8	0	0	0	110.9	F129 A132 L135 F155 N160 L161 P179	F129-L158 HydrophobicContact CB-CD1 4.09Å; F129-L158 HydrophobicContact CB-CD2 3.77Å; F129-L158 HydrophobicContact CB-CG 4.34Å; F129-L158 HydrophobicContact CD2-CD1 4.35Å; F129-L158 HydrophobicContact CG-CD1 4.33Å; A132-L158 VanDerWaalsContact O-CD2 3.29Å; A132-L158 WeakPolarHBondContact O-CD2 3.35Å; L135-L158 HydrophobicContact CB-CD2 4.12Å; L135-L158 HydrophobicContact CD2-CD1 4.03Å; L135-L158 HydrophobicContact CD2-CD2 4.44Å; F155-L158 HydrophobicContact CB-CD1 4.34Å; F155-L158 HydrophobicContact CD1-CD1 3.94Å; F155-L158 PolarHBondContact O-N 3.24Å; F155-L158 VanDerWaalsContact O-N 3.17Å; L158-N160 PolarHBondContact O-N 3.34Å; L158-L161 HydrophobicContact CB-CB 3.9Å; L158-L161 HydrophobicContact CB-CD2 4.48Å; L158-L161 HydrophobicContact CD1-CD2 4.11Å; L158-L161 WeakPolarHBondContact O-CB 3.31Å; L158-L161 PolarHBondContact O-N 3.48Å; L158-P179 WeakPolarHBondContact O-CB 3.34Å
159	K	96.1	Very high	96.6	Very high	163 Å²	163	53.5 Å²	53.5	71%	0.709	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.1	-172.8	-65.1	-179.7	-175.9	176	0	113.6	K157 S181	K157-K159 VanDerWaalsContact C-N 3.26Å; K157-K159 PolarHBondContact O-N 2.96Å; K159-S181 VanDerWaalsContact C-OG 3.24Å; K159-S181 WeakPolarHBondContact O-CB 3.34Å; K159-S181 PolarHBondContact O-OG 2.99Å
160	N	98	Very high	96.7	Very high	66 Å²	66	51.1 Å²	51.1	35%	0.353	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	6.7	-179.2	-61.7	-24.7	0	0	0	113.2	E134 L135 L158 E162	E134-N160 PolarHBondContact OE2-ND2 3.08Å; L135-N160 CarbonylContact O-C 3.09Å; L158-N160 PolarHBondContact O-N 3.34Å; N160-E162 PolarHBondContact O-N 2.95Å; N160-E162 VanDerWaalsContact O-N 3.17Å
161	L	98.6	Very high	96.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.232	C	C	.	.			trans	-69.3	114.7	-176.5	-168.2	74	0	0	0	111.1	L135 E136 L138 L158 L164 P179 S181 L182	L135-L161 HydrophobicContact CB-CD1 4.45Å; L135-L161 HydrophobicContact CD2-CD1 4.03Å; L135-L161 HydrophobicContact CG-CD1 4.08Å; L135-L161 WeakPolarHBondContact O-CA 3.35Å; L135-L161 PolarHBondContact O-N 3.31Å; L135-L161 VanDerWaalsContact O-N 3.09Å; E136-L161 WeakPolarHBondContact O-CD1 3.47Å; L138-L161 HydrophobicContact CB-CD1 3.94Å; L158-L161 HydrophobicContact CB-CB 3.9Å; L158-L161 HydrophobicContact CB-CD2 4.48Å; L158-L161 HydrophobicContact CD1-CD2 4.11Å; L158-L161 WeakPolarHBondContact O-CB 3.31Å; L158-L161 PolarHBondContact O-N 3.48Å; L161-L164 HydrophobicContact CD2-CB 4.23Å; L161-P179 HydrophobicContact CB-CB 4.46Å; L161-P179 HydrophobicContact CB-CG 3.84Å; L161-P179 HydrophobicContact CD2-CG 3.7Å; L161-P179 HydrophobicContact CG-CG 4.35Å; L161-S181 PolarHBondContact N-OG 3.47Å; L161-S181 CarbonylContact O-C 3.59Å; L161-S181 WeakPolarHBondContact O-CB 3.29Å; L161-S181 PolarHBondContact O-OG 3.39Å; L161-L182 HydrophobicContact CD2-CD2 4.04Å; L161-L182 HydrophobicContact CG-CD2 4.04Å; L161-L182 WeakPolarHBondContact O-CA 3.19Å; L161-L182 PolarHBondContact O-N 3.41Å; L161-L182 VanDerWaalsContact O-N 3.15Å
162	E	98.7	Very high	97.1	Very high	49 Å²	49	51.2 Å²	51.2	23%	0.229	24%	0.239	C	C	.	.			trans	-97.1	-36.3	179.5	-60.6	-159.4	138.9	0	0	112.2	E136 N160 R183 E184	E136-E162 PolarHBondContact O-N 3.45Å; N160-E162 PolarHBondContact O-N 2.95Å; N160-E162 VanDerWaalsContact O-N 3.17Å; E162-R183 HydrophobicContact CB-CG 4.37Å; E162-R183 PolarHBondContact O-N 3.2Å; E162-R183 IonicContact OE1-CZ 2.9Å; E162-R183 IonicContact OE1-NE 2.87Å; E162-R183 PolarHBondContact OE1-NE 3.47Å; E162-R183 IonicContact OE1-NH2 3.5Å; E162-R183 IonicContact OE2-NE 2.72Å; E162-E184 PolarHBondContact O-N 3.07Å
163	R	98.9	Very high	97.4	Very high	46 Å²	46	48.8 Å²	48.8	17%	0.174	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	122.2	-172.6	-58.7	-171.8	170.2	76.1	7.5	111.5	E136 W137 L138 Y165 E184	E136-R163 PolarHBondContact O-N 2.74Å; E136-R163 VanDerWaalsContact O-N 3.08Å; W137-R163 HydrophobicContact CG-CB 4.24Å; L138-R163 PolarHBondContact N-O 3.38Å; R163-Y165 HydrophobicContact CB-CE2 3.8Å; R163-Y165 WeakPolarHBondContact CD-OH 3.05Å; R163-E184 HydrophobicContact CG-CB 4.21Å; R163-E184 IonicContact CZ-OE1 2.65Å; R163-E184 VanDerWaalsContact NE-CD 3.28Å; R163-E184 IonicContact NE-OE1 2.88Å; R163-E184 PolarHBondContact NE-OE1 2.69Å; R163-E184 IonicContact NE-OE2 3.14Å; R163-E184 PolarHBondContact NE-OE2 3.3Å; R163-E184 IonicContact NH2-OE1 3.87Å; R163-E184 PolarHBondContact NH2-OE1 3.2Å
164	L	98.9	Very high	97.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	115.7	176.8	179.4	58.9	0	0	0	110.4	L138 F155 L161 M166 L178 L182 E184 L185 H186	L138-L164 HydrophobicContact CB-CD1 4.05Å; L138-L164 HydrophobicContact CD2-CD1 3.89Å; L138-L164 HydrophobicContact CG-CD1 4Å; F155-L164 HydrophobicContact CD2-CD2 4.3Å; F155-L164 HydrophobicContact CE1-CD1 4.33Å; F155-L164 HydrophobicContact CE2-CD2 4.07Å; F155-L164 HydrophobicContact CZ-CD1 4.31Å; F155-L164 HydrophobicContact CZ-CD2 4.28Å; L161-L164 HydrophobicContact CD2-CB 4.23Å; L164-M166 HydrophobicContact CD1-CG 3.86Å; L164-M166 HydrophobicContact CD1-SD 4.13Å; L164-M166 HydrophobicContact CD2-SD 4.07Å; L164-M166 HydrophobicContact CG-CG 4.01Å; L164-M166 HydrophobicContact CG-SD 4.2Å; L164-L178 HydrophobicContact CD2-CD2 3.81Å; L164-L182 HydrophobicContact CB-CD2 3.85Å; L164-E184 PolarHBondContact N-O 2.8Å; L164-E184 VanDerWaalsContact N-O 3.13Å; L164-L185 HydrophobicContact CB-CD1 4.1Å; L164-L185 HydrophobicContact CD2-CD1 3.91Å; L164-L185 HydrophobicContact CG-CD1 4.12Å; L164-H186 PolarHBondContact O-N 3.23Å
165	Y	98.9	Very high	97.7	Very high	49 Å²	49	41.1 Å²	41.1	19%	0.192	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	110.8	176.8	-52	-91.2	0	0	0	110.7	L138 A139 L140 H141 R163 H186	L138-Y165 PolarHBondContact O-N 2.96Å; A139-Y165 HydrophobicContact CB-CD2 4.19Å; L140-Y165 CarbonylContact C-O 3.48Å; L140-Y165 WeakPolarHBondContact CA-O 3.26Å; L140-Y165 WeakPolarHBondContact CB-O 3.12Å; L140-Y165 PolarHBondContact N-O 2.77Å; H141-Y165 PolarHBondContact N-O 2.9Å; H141-Y165 WeakPolarHBondContact ND1-CB 3.27Å; R163-Y165 HydrophobicContact CB-CE2 3.8Å; R163-Y165 WeakPolarHBondContact CD-OH 3.05Å; Y165-H186 HydrophobicContact CD1-CB 4.05Å; Y165-H186 AromaticContact CD1-CD2 3.35Å; Y165-H186 WeakPolarHBondContact CD1-CD2 3.05Å; Y165-H186 AromaticContact CD1-CG 3.63Å; Y165-H186 AromaticContact CD1-NE2 3.84Å; Y165-H186 AromaticContact CE1-CD2 3.34Å; Y165-H186 WeakPolarHBondContact CE1-CD2 3.44Å; Y165-H186 AromaticContact CE1-CE1 3.97Å; Y165-H186 AromaticContact CE1-CG 3.98Å; Y165-H186 AromaticContact CE1-NE2 3.35Å; Y165-H186 WeakPolarHBondContact CE1-NE2 3.5Å
166	M	98.7	Very high	97.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.			trans	-131.9	18.6	177	-65.6	-172.7	79.9	0	0	112	I124 L140 M150 F155 L164 N169 L171 P175 H186 L187 N190	I124-M166 HydrophobicContact CD1-CE 4.02Å; L140-M166 HydrophobicContact CB-CG 4.31Å; L140-M166 HydrophobicContact CD1-CG 4.47Å; M150-M166 HydrophobicContact CE-CE 3.92Å; M150-M166 HydrophobicContact SD-CE 3.96Å; F155-M166 HydrophobicContact CE2-SD 3.93Å; F155-M166 HydrophobicContact CZ-CE 4.22Å; F155-M166 HydrophobicContact CZ-SD 3.73Å; L164-M166 HydrophobicContact CD1-CG 3.86Å; L164-M166 HydrophobicContact CD1-SD 4.13Å; L164-M166 HydrophobicContact CD2-SD 4.07Å; L164-M166 HydrophobicContact CG-CG 4.01Å; L164-M166 HydrophobicContact CG-SD 4.2Å; M166-N169 PolarHBondContact O-ND2 2.79Å; M166-L171 HydrophobicContact CB-CD1 4.17Å; M166-L171 HydrophobicContact CE-CD1 3.91Å; M166-L171 HydrophobicContact CE-CD2 4.28Å; M166-L171 HydrophobicContact SD-CD1 4.45Å; M166-P175 HydrophobicContact SD-CG 4.45Å; M166-H186 CarbonylContact C-O 3.55Å; M166-H186 WeakPolarHBondContact CA-O 3.24Å; M166-H186 PolarHBondContact N-O 2.89Å; M166-L187 HydrophobicContact CB-CD2 3.83Å; M166-N190 PolarHBondContact O-ND2 2.89Å
167	N	98.8	Very high	97.5	Very high	28 Å²	28	45 Å²	45	15%	0.15	23%	0.225	C	C	.	.			trans	-64.5	157.8	173.8	57.7	-75.3	0	0	0	111.8	H141 N142 N169 H186 S188	H141-N167 CarbonylContact C-O 3.52Å; H141-N167 WeakPolarHBondContact CA-O 3.35Å; H141-N167 VanDerWaalsContact CB-O 3.26Å; H141-N167 WeakPolarHBondContact CB-O 3.42Å; H141-N167 VanDerWaalsContact CB-OD1 3.23Å; H141-N167 WeakPolarHBondContact CB-OD1 3.38Å; N142-N167 PolarHBondContact N-O 3.01Å; N142-N167 VanDerWaalsContact N-O 3.09Å; N167-N169 PolarHBondContact O-ND2 2.86Å; N167-H186 HydrophobicContact CB-CB 4.35Å; N167-H186 PolarHBondContact N-O 3.29Å; N167-H186 VanDerWaalsContact N-O 3.14Å; N167-S188 CarbonylContact C-O 3.55Å; N167-S188 WeakPolarHBondContact CA-O 3.33Å; N167-S188 WeakPolarHBondContact CB-O 3.29Å
168	N	98.8	Very high	97.6	Very high	58 Å²	58	40.9 Å²	40.9	31%	0.31	21%	0.207	S	C	.	.	S	Bend	trans	53.9	62.4	-177.2	-60.6	-63	0	0	0	112.1	N142 N143 S188 Y189	N142-N168 VanDerWaalsContact CA-O 3.29Å; N142-N168 WeakPolarHBondContact CA-O 3.3Å; N142-N168 PolarHBondContact N-O 2.81Å; N142-N168 WeakPolarHBondContact OD1-CB 3.35Å; N142-N168 PolarHBondContact OD1-ND2 3.25Å; N143-N168 PolarHBondContact N-O 3.08Å; N143-N168 VanDerWaalsContact N-O 3.09Å; N168-S188 PolarHBondContact N-O 3.08Å; N168-Y189 WeakPolarHBondContact CA-O 3.13Å; N168-Y189 PolarHBondContact N-O 3.48Å; N168-Y189 WeakPolarHBondContact OD1-CB 3.49Å
169	N	98.8	Very high	97.6	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.027	21%	0.21	C	C	.	.	S	Bend	trans	-137.7	-170.5	175	-87.9	-80.4	0	0	0	109.4	L140 N143 Q144 I145 M166 N167 L171 Y189 N190 Q191	L140-N169 PolarHBondContact O-ND2 3.38Å; N143-N169 WeakPolarHBondContact CA-OD1 3.24Å; N143-N169 WeakPolarHBondContact CB-OD1 3.17Å; N143-N169 PolarHBondContact O-OD1 3.05Å; Q144-N169 PolarHBondContact N-OD1 2.83Å; I145-N169 HydrophobicContact CB-CB 4.47Å; I145-N169 VanDerWaalsContact CB-OD1 3.27Å; I145-N169 WeakPolarHBondContact CB-OD1 3.2Å; I145-N169 WeakPolarHBondContact CG1-OD1 3.3Å; I145-N169 PolarHBondContact N-OD1 3.17Å; M166-N169 PolarHBondContact O-ND2 2.79Å; N167-N169 PolarHBondContact O-ND2 2.86Å; N169-L171 HydrophobicContact CB-CG 4.23Å; N169-Y189 PolarHBondContact N-O 3.24Å; N169-N190 WeakPolarHBondContact CA-OD1 3.11Å; N169-N190 WeakPolarHBondContact CB-OD1 3.43Å; N169-N190 PolarHBondContact N-OD1 3.25Å; N169-N190 PolarHBondContact O-OD1 2.94Å; N169-N190 VanDerWaalsContact O-OD1 3.1Å; N169-Q191 PolarHBondContact O-NE2 2.98Å
170	N	98.7	Very high	97.6	Very high	59 Å²	59	42.2 Å²	42.2	32%	0.316	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-112.2	36.6	179.3	-65.4	87.2	0	0	0	111.5	Q144 I145 T146 T172 N190 Q191	Q144-N170 WeakPolarHBondContact CA-OD1 3.48Å; I145-N170 CarbonylContact O-C 3.52Å; I145-N170 VanDerWaalsContact O-CA 3.3Å; I145-N170 WeakPolarHBondContact O-CA 3.42Å; I145-N170 PolarHBondContact O-N 3.14Å; T146-N170 HydrophobicContact CG2-CB 3.86Å; N170-T172 PolarHBondContact O-N 3.15Å; N170-N190 PolarHBondContact N-OD1 3.3Å; N170-Q191 PolarHBondContact ND2-OE1 2.99Å
171	L	98.7	Very high	97.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.2	C	C	.	.			trans	-72.7	127.4	178	-56.9	177.6	0	0	0	109.8	I145 M150 M166 N169 L187 N190 Q191 I192	I145-L171 HydrophobicContact CG2-CD2 4.01Å; I145-L171 PolarHBondContact O-N 3.09Å; M150-L171 HydrophobicContact SD-CD2 3.71Å; M166-L171 HydrophobicContact CB-CD1 4.17Å; M166-L171 HydrophobicContact CE-CD1 3.91Å; M166-L171 HydrophobicContact CE-CD2 4.28Å; M166-L171 HydrophobicContact SD-CD1 4.45Å; N169-L171 HydrophobicContact CB-CG 4.23Å; L171-L187 HydrophobicContact CD1-CD2 3.7Å; L171-N190 HydrophobicContact CB-CB 4.16Å; L171-N190 VanDerWaalsContact CB-OD1 3.24Å; L171-N190 WeakPolarHBondContact CB-OD1 3.38Å; L171-N190 VanDerWaalsContact CG-OD1 3.29Å; L171-N190 WeakPolarHBondContact CG-OD1 3.48Å; L171-N190 PolarHBondContact N-OD1 2.9Å; L171-Q191 CarbonylContact O-C 3.07Å; L171-Q191 VanDerWaalsContact O-CA 3.26Å; L171-Q191 WeakPolarHBondContact O-CA 3.14Å; L171-Q191 PolarHBondContact O-N 3.44Å; L171-I192 HydrophobicContact CB-CG1 4.25Å; L171-I192 PolarHBondContact O-N 2.97Å; L171-I192 VanDerWaalsContact O-N 3.12Å
172	T	98.4	Very high	97.6	Very high	53 Å²	53	40.2 Å²	40.2	33%	0.325	20%	0.2	S	C	.	.			trans	-102.4	-13.6	176.9	55.6	0	0	0	0	113.2	S147 N170 Q191 S193	S147-T172 PolarHBondContact OG-N 3.32Å; S147-T172 PolarHBondContact OG-OG1 3.19Å; N170-T172 PolarHBondContact O-N 3.15Å; T172-Q191 WeakPolarHBondContact CA-O 3.48Å; T172-Q191 HydrophobicContact CG2-CB 4.27Å; T172-S193 PolarHBondContact O-N 3.1Å
173	K	97.9	Very high	97.6	Very high	116 Å²	116	43 Å²	43	50%	0.504	21%	0.209	S	C	.	.	S	Bend	trans	-137.2	153.5	-176.8	-64.4	170.6	-177.1	158.5	0	109.1	S147 E148	S147-K173 PolarHBondContact OG-N 3.25Å; E148-K173 IonicContact OE1-NZ 3.63Å; E148-K173 PolarHBondContact OE1-NZ 3.02Å
174	M	97.6	Very high	97.6	Very high	17 Å²	17	42.9 Å²	42.9	8%	0.084	21%	0.21	C	C	.	.			trans	-59.8	132.3	170	-71	-63.8	-68.8	0	0	110.5	S176 L187 I192 V195 A199 L200 L211	M174-S176 PolarHBondContact O-N 3.19Å; M174-L187 HydrophobicContact CE-CD1 3.64Å; M174-L187 HydrophobicContact SD-CD1 3.86Å; M174-I192 HydrophobicContact CG-CG2 4.2Å; M174-I192 HydrophobicContact SD-CD1 4.01Å; M174-I192 HydrophobicContact SD-CG2 4.16Å; M174-V195 HydrophobicContact CE-CG1 4.4Å; M174-V195 HydrophobicContact CG-CB 4.33Å; M174-V195 HydrophobicContact CG-CG1 4.15Å; M174-V195 HydrophobicContact CG-CG2 4.06Å; M174-V195 HydrophobicContact SD-CG1 4.44Å; M174-V195 HydrophobicContact SD-CG2 3.98Å; M174-A199 HydrophobicContact CB-CB 4.1Å; M174-A199 HydrophobicContact CG-CB 4.2Å; M174-L200 HydrophobicContact CE-CD2 3.74Å; M174-L200 HydrophobicContact CE-CG 4.4Å; M174-L211 HydrophobicContact SD-CD2 3.9Å
175	P	95.2	Very high	97.6	Very high	7 Å²	7	42.9 Å²	42.9	5%	0.045	21%	0.21	C	C	.	.			trans	-62.8	135.3	169.4	26.1	-32.6	0	0	0	109.8	M150 F155 M166 L178 L187	M150-P175 HydrophobicContact CE-CB 4.02Å; F155-P175 HydrophobicContact CE2-CB 4.02Å; M166-P175 HydrophobicContact SD-CG 4.45Å; P175-L178 HydrophobicContact CB-CD2 4.4Å; P175-L178 HydrophobicContact CG-CD2 4.09Å; P175-L178 WeakPolarHBondContact O-CG 3.48Å; P175-L187 HydrophobicContact CG-CD1 4.28Å; P175-L187 HydrophobicContact CG-CD2 4.09Å
176	S	90.7	Very high	97.6	Very high	79 Å²	79	42.1 Å²	42.1	55%	0.552	21%	0.208	S	C	*	.	S	Bend	trans	-152.6	144.5	-177	-179.2	0	0	0	0	112.7	M174	M174-S176 PolarHBondContact O-N 3.19Å
177	P	94.5	Very high	97.7	Very high	46 Å²	46	42.1 Å²	42.1	30%	0.299	21%	0.208	S	C	.	.	S	Bend	cis	-72.1	152.1	-11.5	30.8	-37.6	0	0	0	112.5	R153 A156	R153-P177 HydrophobicContact CB-CG 4.44Å; R153-P177 HydrophobicContact CG-CG 4.42Å; A156-P177 HydrophobicContact CB-CG 4.07Å
178	L	97	Very high	97.7	Very high	17 Å²	17	41.2 Å²	41.2	9%	0.089	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-94.8	146.8	170.6	-72	167.6	0	0	0	110.8	F155 L164 P175 L182 L185 L200 L203	F155-L178 HydrophobicContact CD2-CD2 4.34Å; L164-L178 HydrophobicContact CD2-CD2 3.81Å; P175-L178 HydrophobicContact CB-CD2 4.4Å; P175-L178 HydrophobicContact CG-CD2 4.09Å; P175-L178 WeakPolarHBondContact O-CG 3.48Å; L178-L182 HydrophobicContact CB-CD1 4Å; L178-L182 HydrophobicContact CD2-CD1 3.99Å; L178-L182 HydrophobicContact CG-CD1 4.41Å; L178-L185 HydrophobicContact CD1-CD2 3.65Å; L178-L185 HydrophobicContact CD2-CD1 4.49Å; L178-L200 HydrophobicContact CD1-CD2 4.06Å; L178-L203 HydrophobicContact CB-CD1 4.17Å; L178-L203 HydrophobicContact CB-CD2 4.16Å; L178-L203 HydrophobicContact CD1-CD1 4.04Å
179	P	96.9	Very high	97.7	Very high	9 Å²	9	44 Å²	44	6%	0.058	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-71.7	136.6	178.1	22.7	-25.3	0	0	0	111.7	F155 L158 L161 S181 L182 L203	F155-P179 HydrophobicContact CB-CG 4.38Å; L158-P179 WeakPolarHBondContact O-CB 3.34Å; L161-P179 HydrophobicContact CB-CB 4.46Å; L161-P179 HydrophobicContact CB-CG 3.84Å; L161-P179 HydrophobicContact CD2-CG 3.7Å; L161-P179 HydrophobicContact CG-CG 4.35Å; P179-S181 PolarHBondContact O-N 2.99Å; P179-S181 VanDerWaalsContact O-N 3.15Å; P179-L182 HydrophobicContact CG-CD1 4.24Å; P179-L182 HydrophobicContact CG-CG 4.04Å; P179-L182 WeakPolarHBondContact O-CG 3.21Å; P179-L182 PolarHBondContact O-N 3.09Å; P179-L203 WeakPolarHBondContact O-CD2 3.49Å
180	R	97.5	Very high	97.7	Very high	183 Å²	183	44.2 Å²	44.2	69%	0.691	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.8	-175.2	-64.3	-176.7	-179	171.7	-2.2	114.7	L182	R180-L182 VanDerWaalsContact C-N 3.3Å
181	S	98.2	Very high	97.7	Very high	23 Å²	23	44.4 Å²	44.4	16%	0.161	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-10.3	177.3	36	0	0	0	0	114.1	K159 L161 P179 R183	K159-S181 VanDerWaalsContact C-OG 3.24Å; K159-S181 WeakPolarHBondContact O-CB 3.34Å; K159-S181 PolarHBondContact O-OG 2.99Å; L161-S181 PolarHBondContact N-OG 3.47Å; L161-S181 CarbonylContact O-C 3.59Å; L161-S181 WeakPolarHBondContact O-CB 3.29Å; L161-S181 PolarHBondContact O-OG 3.39Å; P179-S181 PolarHBondContact O-N 2.99Å; P179-S181 VanDerWaalsContact O-N 3.15Å; S181-R183 PolarHBondContact O-N 2.93Å
182	L	98.6	Very high	97.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.211	C	C	.	.			trans	-56.7	134.9	-177.2	-78.6	173.9	0	0	0	112.3	L161 L164 L178 P179 R180 N205 L206	L161-L182 HydrophobicContact CD2-CD2 4.04Å; L161-L182 HydrophobicContact CG-CD2 4.04Å; L161-L182 WeakPolarHBondContact O-CA 3.19Å; L161-L182 PolarHBondContact O-N 3.41Å; L161-L182 VanDerWaalsContact O-N 3.15Å; L164-L182 HydrophobicContact CB-CD2 3.85Å; L178-L182 HydrophobicContact CB-CD1 4Å; L178-L182 HydrophobicContact CD2-CD1 3.99Å; L178-L182 HydrophobicContact CG-CD1 4.41Å; P179-L182 HydrophobicContact CG-CD1 4.24Å; P179-L182 HydrophobicContact CG-CG 4.04Å; P179-L182 WeakPolarHBondContact O-CG 3.21Å; P179-L182 PolarHBondContact O-N 3.09Å; R180-L182 VanDerWaalsContact C-N 3.3Å; L182-N205 CarbonylContact O-C 3.17Å; L182-N205 VanDerWaalsContact O-C 3.24Å; L182-L206 HydrophobicContact CB-CD1 4.02Å; L182-L206 VanDerWaalsContact O-CA 3.3Å; L182-L206 WeakPolarHBondContact O-CA 3.18Å; L182-L206 PolarHBondContact O-N 3.13Å; L182-L206 VanDerWaalsContact O-N 3.15Å
183	R	98.8	Very high	97.7	Very high	109 Å²	109	44 Å²	44	41%	0.411	21%	0.211	S	C	.	.	S	Bend	trans	-109.9	-34	172.9	-64	-178.3	-178.4	-101.8	2.9	111.8	E162 S181 T207 A208	E162-R183 HydrophobicContact CB-CG 4.37Å; E162-R183 PolarHBondContact O-N 3.2Å; E162-R183 IonicContact OE1-CZ 2.9Å; E162-R183 IonicContact OE1-NE 2.87Å; E162-R183 PolarHBondContact OE1-NE 3.47Å; E162-R183 IonicContact OE1-NH2 3.5Å; E162-R183 IonicContact OE2-NE 2.72Å; S181-R183 PolarHBondContact O-N 2.93Å; R183-T207 PolarHBondContact O-N 3.17Å; R183-T207 PolarHBondContact O-OG1 3.18Å; R183-A208 PolarHBondContact O-N 2.88Å
184	E	98.9	Very high	97.7	Very high	42 Å²	42	42.7 Å²	42.7	20%	0.196	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.9	-178.9	-63.3	168.5	-142.7	0	0	110.4	E162 R163 L164 H186 A208	E162-E184 PolarHBondContact O-N 3.07Å; R163-E184 HydrophobicContact CG-CB 4.21Å; R163-E184 IonicContact CZ-OE1 2.65Å; R163-E184 VanDerWaalsContact NE-CD 3.28Å; R163-E184 IonicContact NE-OE1 2.88Å; R163-E184 PolarHBondContact NE-OE1 2.69Å; R163-E184 IonicContact NE-OE2 3.14Å; R163-E184 PolarHBondContact NE-OE2 3.3Å; R163-E184 IonicContact NH2-OE1 3.87Å; R163-E184 PolarHBondContact NH2-OE1 3.2Å; L164-E184 PolarHBondContact N-O 2.8Å; L164-E184 VanDerWaalsContact N-O 3.13Å; E184-H186 IonicContact OE2-NE2 3.54Å; E184-A208 HydrophobicContact CG-CB 4.35Å
185	L	98.9	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	114.8	178	179.5	60.8	0	0	0	110.5	L164 L178 L187 L200 L206 A208 L209 Y210	L164-L185 HydrophobicContact CB-CD1 4.1Å; L164-L185 HydrophobicContact CD2-CD1 3.91Å; L164-L185 HydrophobicContact CG-CD1 4.12Å; L178-L185 HydrophobicContact CD1-CD2 3.65Å; L178-L185 HydrophobicContact CD2-CD1 4.49Å; L185-L187 HydrophobicContact CD1-CD1 4.05Å; L185-L187 HydrophobicContact CD1-CG 4.04Å; L185-L187 HydrophobicContact CD2-CD1 3.79Å; L185-L187 HydrophobicContact CG-CD1 3.86Å; L185-L187 HydrophobicContact CG-CG 4.09Å; L185-L200 HydrophobicContact CD2-CD2 4.1Å; L185-L206 HydrophobicContact CB-CD1 3.96Å; L185-A208 PolarHBondContact N-O 3.27Å; L185-A208 VanDerWaalsContact N-O 3.09Å; L185-L209 HydrophobicContact CB-CD1 4.16Å; L185-L209 HydrophobicContact CD2-CD1 3.83Å; L185-L209 HydrophobicContact CG-CD1 4.15Å; L185-Y210 PolarHBondContact O-N 2.83Å
186	H	98.9	Very high	97.7	Very high	34 Å²	34	44.7 Å²	44.7	16%	0.157	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.8	178.2	-60.1	-107.1	0	0	0	110.8	L164 Y165 M166 N167 E184 Y210	L164-H186 PolarHBondContact O-N 3.23Å; Y165-H186 HydrophobicContact CD1-CB 4.05Å; Y165-H186 AromaticContact CD1-CD2 3.35Å; Y165-H186 WeakPolarHBondContact CD1-CD2 3.05Å; Y165-H186 AromaticContact CD1-CG 3.63Å; Y165-H186 AromaticContact CD1-NE2 3.84Å; Y165-H186 AromaticContact CE1-CD2 3.34Å; Y165-H186 WeakPolarHBondContact CE1-CD2 3.44Å; Y165-H186 AromaticContact CE1-CE1 3.97Å; Y165-H186 AromaticContact CE1-CG 3.98Å; Y165-H186 AromaticContact CE1-NE2 3.35Å; Y165-H186 WeakPolarHBondContact CE1-NE2 3.5Å; M166-H186 CarbonylContact C-O 3.55Å; M166-H186 WeakPolarHBondContact CA-O 3.24Å; M166-H186 PolarHBondContact N-O 2.89Å; N167-H186 HydrophobicContact CB-CB 4.35Å; N167-H186 PolarHBondContact N-O 3.29Å; N167-H186 VanDerWaalsContact N-O 3.14Å; E184-H186 IonicContact OE2-NE2 3.54Å; H186-Y210 AromaticContact CE1-CD2 3.31Å; H186-Y210 WeakPolarHBondContact CE1-CD2 3.41Å; H186-Y210 AromaticContact CE1-CE2 3.21Å; H186-Y210 WeakPolarHBondContact CE1-CE2 3.26Å; H186-Y210 AromaticContact CG-CD2 3.84Å; H186-Y210 AromaticContact ND1-CD2 3.3Å; H186-Y210 VanDerWaalsContact ND1-CD2 3.3Å; H186-Y210 WeakPolarHBondContact ND1-CD2 3.47Å; H186-Y210 AromaticContact ND1-CE2 3.72Å; H186-Y210 AromaticContact ND1-CG 3.87Å; H186-Y210 AromaticContact NE2-CD2 3.83Å; H186-Y210 AromaticContact NE2-CE2 3.71Å
187	L	98.9	Very high	97.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.			trans	-129.6	10.4	179.6	-72.7	169.8	0	0	0	112.3	M166 L171 M174 P175 L185 N190 I192 Y210 L211 N214	M166-L187 HydrophobicContact CB-CD2 3.83Å; L171-L187 HydrophobicContact CD1-CD2 3.7Å; M174-L187 HydrophobicContact CE-CD1 3.64Å; M174-L187 HydrophobicContact SD-CD1 3.86Å; P175-L187 HydrophobicContact CG-CD1 4.28Å; P175-L187 HydrophobicContact CG-CD2 4.09Å; L185-L187 HydrophobicContact CD1-CD1 4.05Å; L185-L187 HydrophobicContact CD1-CG 4.04Å; L185-L187 HydrophobicContact CD2-CD1 3.79Å; L185-L187 HydrophobicContact CG-CD1 3.86Å; L185-L187 HydrophobicContact CG-CG 4.09Å; L187-N190 PolarHBondContact O-ND2 3.15Å; L187-I192 HydrophobicContact CB-CD1 4.09Å; L187-I192 HydrophobicContact CD1-CD1 4.34Å; L187-I192 HydrophobicContact CD2-CD1 4.38Å; L187-Y210 CarbonylContact C-O 3.3Å; L187-Y210 WeakPolarHBondContact CA-O 3.31Å; L187-Y210 PolarHBondContact N-O 3.4Å; L187-L211 HydrophobicContact CB-CD2 3.66Å; L187-L211 HydrophobicContact CD1-CD2 3.96Å; L187-L211 HydrophobicContact CG-CD2 4.47Å; L187-N214 PolarHBondContact O-ND2 2.87Å
188	S	98.9	Very high	97.8	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.063	23%	0.23	C	C	.	.			trans	-59.5	157.5	177.6	-57.7	0	0	0	0	112.9	N167 N168 N190 Y210 S212	N167-S188 CarbonylContact C-O 3.55Å; N167-S188 WeakPolarHBondContact CA-O 3.33Å; N167-S188 WeakPolarHBondContact CB-O 3.29Å; N168-S188 PolarHBondContact N-O 3.08Å; S188-N190 PolarHBondContact O-ND2 2.95Å; S188-Y210 PolarHBondContact N-O 3.15Å; S188-Y210 WeakPolarHBondContact OG-CB 3.35Å; S188-S212 CarbonylContact C-O 3.57Å; S188-S212 WeakPolarHBondContact CA-O 3.31Å; S188-S212 VanDerWaalsContact CB-O 3.26Å; S188-S212 WeakPolarHBondContact CB-O 3.3Å; S188-S212 WeakPolarHBondContact CB-OG 3.41Å; S188-S212 PolarHBondContact OG-N 2.7Å; S188-S212 PolarHBondContact OG-OG 3.29Å
189	Y	98.9	Very high	97.8	Very high	117 Å²	117	46.2 Å²	46.2	46%	0.459	23%	0.229	S	C	.	.	S	Bend	trans	55.9	54.7	179.2	-60.9	-89.2	0	0	0	112.4	N168 N169 S212 H213	N168-Y189 WeakPolarHBondContact CA-O 3.13Å; N168-Y189 PolarHBondContact N-O 3.48Å; N168-Y189 WeakPolarHBondContact OD1-CB 3.49Å; N169-Y189 PolarHBondContact N-O 3.24Å; Y189-S212 PolarHBondContact N-O 2.68Å; Y189-H213 VanDerWaalsContact CA-O 3.24Å; Y189-H213 WeakPolarHBondContact CA-O 3.42Å; Y189-H213 HydrophobicContact CD1-CB 3.63Å; Y189-H213 AromaticContact CD1-CG 3.9Å; Y189-H213 HydrophobicContact CD2-CB 4.33Å; Y189-H213 HydrophobicContact CE1-CB 3.8Å; Y189-H213 AromaticContact CE1-CD2 3.69Å; Y189-H213 AromaticContact CE1-CG 3.5Å; Y189-H213 VanDerWaalsContact CE1-CG 3.5Å; Y189-H213 AromaticContact CE1-ND1 3.83Å; Y189-H213 HydrophobicContact CE2-CB 4.45Å; Y189-H213 AromaticContact CE2-CD2 3.81Å; Y189-H213 HydrophobicContact CG-CB 3.92Å; Y189-H213 AromaticContact CZ-CD2 3.37Å; Y189-H213 AromaticContact CZ-CG 3.71Å; Y189-H213 AromaticContact CZ-NE2 3.76Å; Y189-H213 PolarHBondContact N-O 3.15Å; Y189-H213 PolarHBondContact OH-CD2 3.26Å; Y189-H213 PolarHBondContact OH-NE2 3.28Å
190	N	98.9	Very high	97.8	Very high	8 Å²	8	46 Å²	46	4%	0.043	23%	0.227	C	C	.	.	S	Bend	trans	-128	-167.9	172.5	-85.5	-78.8	0	0	0	108.8	M166 N169 N170 L171 L187 S188 I192 H213 N214	M166-N190 PolarHBondContact O-ND2 2.89Å; N169-N190 WeakPolarHBondContact CA-OD1 3.11Å; N169-N190 WeakPolarHBondContact CB-OD1 3.43Å; N169-N190 PolarHBondContact N-OD1 3.25Å; N169-N190 PolarHBondContact O-OD1 2.94Å; N169-N190 VanDerWaalsContact O-OD1 3.1Å; N170-N190 PolarHBondContact N-OD1 3.3Å; L171-N190 HydrophobicContact CB-CB 4.16Å; L171-N190 VanDerWaalsContact CB-OD1 3.24Å; L171-N190 WeakPolarHBondContact CB-OD1 3.38Å; L171-N190 VanDerWaalsContact CG-OD1 3.29Å; L171-N190 WeakPolarHBondContact CG-OD1 3.48Å; L171-N190 PolarHBondContact N-OD1 2.9Å; L187-N190 PolarHBondContact O-ND2 3.15Å; S188-N190 PolarHBondContact O-ND2 2.95Å; N190-I192 HydrophobicContact CB-CD1 4.31Å; N190-I192 HydrophobicContact CB-CG1 4.18Å; N190-H213 PolarHBondContact N-O 2.64Å; N190-N214 WeakPolarHBondContact CA-OD1 3.47Å; N190-N214 WeakPolarHBondContact CB-OD1 3.47Å; N190-N214 PolarHBondContact O-OD1 2.86Å
191	Q	98.8	Very high	97.6	Very high	63 Å²	63	44 Å²	44	29%	0.294	23%	0.225	S	C	.	.			trans	-117.1	31.8	175.1	-62.4	107.9	58.2	0	0	111.6	N169 N170 L171 T172 S193 N214	N169-Q191 PolarHBondContact O-NE2 2.98Å; N170-Q191 PolarHBondContact ND2-OE1 2.99Å; L171-Q191 CarbonylContact O-C 3.07Å; L171-Q191 VanDerWaalsContact O-CA 3.26Å; L171-Q191 WeakPolarHBondContact O-CA 3.14Å; L171-Q191 PolarHBondContact O-N 3.44Å; T172-Q191 WeakPolarHBondContact CA-O 3.48Å; T172-Q191 HydrophobicContact CG2-CB 4.27Å; Q191-S193 PolarHBondContact O-N 3.35Å; Q191-N214 PolarHBondContact N-OD1 3.24Å
192	I	98.8	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.			trans	-66.3	125.3	-177.4	-61.6	166	0	0	0	108.9	L171 M174 L187 N190 K194 L211 N214 Q215 I216	L171-I192 HydrophobicContact CB-CG1 4.25Å; L171-I192 PolarHBondContact O-N 2.97Å; L171-I192 VanDerWaalsContact O-N 3.12Å; M174-I192 HydrophobicContact CG-CG2 4.2Å; M174-I192 HydrophobicContact SD-CD1 4.01Å; M174-I192 HydrophobicContact SD-CG2 4.16Å; L187-I192 HydrophobicContact CB-CD1 4.09Å; L187-I192 HydrophobicContact CD1-CD1 4.34Å; L187-I192 HydrophobicContact CD2-CD1 4.38Å; N190-I192 HydrophobicContact CB-CD1 4.31Å; N190-I192 HydrophobicContact CB-CG1 4.18Å; I192-K194 WeakPolarHBondContact CG2-O 3.19Å; I192-L211 HydrophobicContact CD1-CD2 4.17Å; I192-N214 HydrophobicContact CB-CB 4.39Å; I192-N214 VanDerWaalsContact CB-OD1 3.31Å; I192-N214 WeakPolarHBondContact CB-OD1 3.32Å; I192-N214 WeakPolarHBondContact CG1-OD1 3.23Å; I192-N214 PolarHBondContact N-OD1 3.45Å; I192-Q215 CarbonylContact O-C 3.57Å; I192-Q215 WeakPolarHBondContact O-CA 3.36Å; I192-Q215 PolarHBondContact O-N 3.45Å; I192-I216 HydrophobicContact CB-CG1 4.39Å; I192-I216 HydrophobicContact CG2-CG1 4.18Å; I192-I216 WeakPolarHBondContact O-CG1 3.48Å; I192-I216 PolarHBondContact O-N 3.44Å; I192-I216 VanDerWaalsContact O-N 3.09Å
193	S	98.4	Very high	97.5	Very high	45 Å²	45	44.1 Å²	44.1	32%	0.315	23%	0.23	S	C	.	.			trans	-99.2	-24.7	-175	56.4	0	0	0	0	114.2	T172 Q191 Q215 I216 F217	T172-S193 PolarHBondContact O-N 3.1Å; Q191-S193 PolarHBondContact O-N 3.35Å; S193-Q215 WeakPolarHBondContact CA-O 3.48Å; S193-I216 WeakPolarHBondContact O-CA 3.18Å; S193-F217 WeakPolarHBondContact O-CD1 3.26Å; S193-F217 WeakPolarHBondContact O-CE1 3.42Å; S193-F217 PolarHBondContact O-N 2.89Å
194	K	97.9	Very high	97.4	Very high	89 Å²	89	43 Å²	43	39%	0.387	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-146.1	148.9	-179.6	-67.5	-166.2	175	-148.4	0	111.5	I192 F217 E218	I192-K194 WeakPolarHBondContact CG2-O 3.19Å; K194-F217 HydrophobicContact CD-CE2 4.45Å; K194-F217 HydrophobicContact CD-CZ 4.05Å; K194-F217 HydrophobicContact CG-CD1 4.43Å; K194-F217 HydrophobicContact CG-CE1 3.82Å; K194-F217 HydrophobicContact CG-CE2 4.35Å; K194-F217 HydrophobicContact CG-CZ 3.84Å; K194-E218 IonicContact NZ-OE2 2.7Å; K194-E218 PolarHBondContact NZ-OE2 3.41Å
195	V	98.2	Very high	97.4	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	24%	0.241	C	C	.	.			trans	-114.2	99.5	165.2	-174.1	0	0	0	0	108.5	M174 A199 L200 L211 I216 E218 M219	M174-V195 HydrophobicContact CE-CG1 4.4Å; M174-V195 HydrophobicContact CG-CB 4.33Å; M174-V195 HydrophobicContact CG-CG1 4.15Å; M174-V195 HydrophobicContact CG-CG2 4.06Å; M174-V195 HydrophobicContact SD-CG1 4.44Å; M174-V195 HydrophobicContact SD-CG2 3.98Å; V195-A199 HydrophobicContact CG1-CB 4.14Å; V195-L200 HydrophobicContact CG1-CD1 4.22Å; V195-L200 HydrophobicContact CG1-CG 4.45Å; V195-L211 HydrophobicContact CG2-CD1 4.21Å; V195-I216 HydrophobicContact CG2-CD1 4Å; V195-I216 HydrophobicContact CG2-CG1 4.42Å; V195-I216 HydrophobicContact CG2-CG2 4.19Å; V195-E218 PolarHBondContact N-O 3.19Å; V195-M219 HydrophobicContact CB-CB 4.38Å; V195-M219 HydrophobicContact CB-CE 4.06Å; V195-M219 HydrophobicContact CB-CG 3.98Å; V195-M219 HydrophobicContact CG1-CE 4.22Å; V195-M219 HydrophobicContact CG2-CE 3.96Å; V195-M219 HydrophobicContact CG2-CG 4.09Å; V195-M219 HydrophobicContact CG2-SD 4.49Å; V195-M219 CarbonylContact O-C 3.46Å; V195-M219 WeakPolarHBondContact O-CA 3.04Å
196	P	96.2	Very high	97.4	Very high	62 Å²	62	44.9 Å²	44.9	40%	0.403	24%	0.241	S	C	.	.			trans	-55.8	148.6	175.1	-24.9	32.7	0	0	0	112.1	N198 A199	P196-N198 PolarHBondContact O-N 3.38Å; P196-N198 VanDerWaalsContact O-N 3.08Å; P196-A199 HydrophobicContact CB-CB 4.24Å; P196-A199 HydrophobicContact CG-CB 4.42Å; P196-A199 VanDerWaalsContact O-CB 3.24Å; P196-A199 WeakPolarHBondContact O-CB 3.36Å; P196-A199 PolarHBondContact O-N 3.12Å
197	A	93	Very high	97.4	Very high	67 Å²	67	45.1 Å²	45.1	55%	0.554	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.3	-177.2	0	0	0	0	0	113.7
198	N	93.8	Very high	97.4	Very high	101 Å²	101	45.6 Å²	45.6	54%	0.54	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	1.3	179	68.2	-29.4	0	0	0	114.2	P196 L200 E201	P196-N198 PolarHBondContact O-N 3.38Å; P196-N198 VanDerWaalsContact O-N 3.08Å; N198-L200 PolarHBondContact O-N 3.29Å; N198-E201 HydrophobicContact CB-CB 4.45Å; N198-E201 WeakPolarHBondContact O-CB 3.23Å; N198-E201 PolarHBondContact O-N 3.06Å
199	A	95.9	Very high	97.4	Very high	7 Å²	7	45.2 Å²	45.2	6%	0.058	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.1	-175.8	0	0	0	0	0	113.1	M174 V195 P196	M174-A199 HydrophobicContact CB-CB 4.1Å; M174-A199 HydrophobicContact CG-CB 4.2Å; V195-A199 HydrophobicContact CG1-CB 4.14Å; P196-A199 HydrophobicContact CB-CB 4.24Å; P196-A199 HydrophobicContact CG-CB 4.42Å; P196-A199 VanDerWaalsContact O-CB 3.24Å; P196-A199 WeakPolarHBondContact O-CB 3.36Å; P196-A199 PolarHBondContact O-N 3.12Å
200	L	97.1	Very high	97.4	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	18.6	-179	-55.9	172.4	0	0	0	111.7	M174 L178 L185 V195 N198 G202 L203 L209 L223 L226	M174-L200 HydrophobicContact CE-CD2 3.74Å; M174-L200 HydrophobicContact CE-CG 4.4Å; L178-L200 HydrophobicContact CD1-CD2 4.06Å; L185-L200 HydrophobicContact CD2-CD2 4.1Å; V195-L200 HydrophobicContact CG1-CD1 4.22Å; V195-L200 HydrophobicContact CG1-CG 4.45Å; N198-L200 PolarHBondContact O-N 3.29Å; L200-G202 PolarHBondContact O-N 2.78Å; L200-L203 HydrophobicContact CB-CD1 4.27Å; L200-L203 HydrophobicContact CD2-CD1 3.89Å; L200-L203 PolarHBondContact O-N 2.82Å; L200-L209 HydrophobicContact CD1-CD2 3.75Å; L200-L223 HydrophobicContact CD1-CD2 4.2Å; L200-L226 HydrophobicContact CB-CD2 4.12Å; L200-L226 HydrophobicContact CD1-CD1 4.07Å
201	E	94.5	Very high	97.4	Very high	141 Å²	141	42.2 Å²	42.2	66%	0.659	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	128.8	-175.2	-172.6	-179	175.3	0	0	112	N198 L203	N198-E201 HydrophobicContact CB-CB 4.45Å; N198-E201 WeakPolarHBondContact O-CB 3.23Å; N198-E201 PolarHBondContact O-N 3.06Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.82Å
202	G	95.8	Very high	97.4	Very high	25 Å²	25	39.6 Å²	39.6	26%	0.258	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	6	175.9	0	0	0	0	0	115.3	L200 E204	L200-G202 PolarHBondContact O-N 2.78Å; G202-E204 PolarHBondContact O-N 3.41Å
203	L	98	Very high	97.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.237	C	C	.	.			trans	-77.9	56.4	172.4	-54.6	-171	0	0	0	111.2	L178 P179 L200 E201 N205 L206 L226	L178-L203 HydrophobicContact CB-CD1 4.17Å; L178-L203 HydrophobicContact CB-CD2 4.16Å; L178-L203 HydrophobicContact CD1-CD1 4.04Å; P179-L203 WeakPolarHBondContact O-CD2 3.49Å; L200-L203 HydrophobicContact CB-CD1 4.27Å; L200-L203 HydrophobicContact CD2-CD1 3.89Å; L200-L203 PolarHBondContact O-N 2.82Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.82Å; L203-N205 PolarHBondContact O-N 3.14Å; L203-L206 HydrophobicContact CB-CB 4.07Å; L203-L206 HydrophobicContact CD1-CD2 4.32Å; L203-L206 WeakPolarHBondContact O-CB 3.09Å; L203-L206 PolarHBondContact O-N 2.88Å; L203-L206 VanDerWaalsContact O-N 3.17Å; L203-L226 HydrophobicContact CB-CD2 3.79Å; L203-L226 WeakPolarHBondContact O-CD2 3.11Å
204	E	97.8	Very high	97.5	Very high	85 Å²	85	40.9 Å²	40.9	40%	0.397	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.3	-173.4	-58.7	-165.1	174.3	0	0	113.3	G202 K227 S228	G202-E204 PolarHBondContact O-N 3.41Å; E204-K227 HydrophobicContact CG-CD 4.37Å; E204-K227 WeakPolarHBondContact OE1-CE 3.35Å; E204-K227 IonicContact OE1-NZ 3.33Å; E204-K227 PolarHBondContact OE1-NZ 3.25Å; E204-K227 IonicContact OE2-NZ 3.72Å; E204-K227 PolarHBondContact OE2-NZ 2.87Å; E204-S228 WeakPolarHBondContact O-CB 3.32Å; E204-S228 PolarHBondContact O-N 2.72Å; E204-S228 PolarHBondContact O-OG 3.41Å
205	N	98.4	Very high	97.5	Very high	82 Å²	82	40.9 Å²	40.9	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-3.4	178.7	-67	-11.9	0	0	0	113.5	L182 L203 T207	L182-N205 CarbonylContact O-C 3.17Å; L182-N205 VanDerWaalsContact O-C 3.24Å; L203-N205 PolarHBondContact O-N 3.14Å; N205-T207 PolarHBondContact O-N 2.73Å
206	L	98.8	Very high	97.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.			trans	-68.9	123.3	-177.5	-167.2	74.5	0	0	0	109.6	L182 L185 L203 L209 L226 S228 L229	L182-L206 HydrophobicContact CB-CD1 4.02Å; L182-L206 VanDerWaalsContact O-CA 3.3Å; L182-L206 WeakPolarHBondContact O-CA 3.18Å; L182-L206 PolarHBondContact O-N 3.13Å; L182-L206 VanDerWaalsContact O-N 3.15Å; L185-L206 HydrophobicContact CB-CD1 3.96Å; L203-L206 HydrophobicContact CB-CB 4.07Å; L203-L206 HydrophobicContact CD1-CD2 4.32Å; L203-L206 WeakPolarHBondContact O-CB 3.09Å; L203-L206 PolarHBondContact O-N 2.88Å; L203-L206 VanDerWaalsContact O-N 3.17Å; L206-L209 HydrophobicContact CD2-CB 4.17Å; L206-L209 HydrophobicContact CD2-CD1 4.38Å; L206-L226 HydrophobicContact CD2-CD1 4.25Å; L206-L226 HydrophobicContact CD2-CD2 4.34Å; L206-S228 CarbonylContact O-C 3.23Å; L206-L229 HydrophobicContact CD2-CD1 4.19Å; L206-L229 HydrophobicContact CG-CD1 4.21Å; L206-L229 WeakPolarHBondContact O-CA 3.47Å; L206-L229 PolarHBondContact O-N 3.25Å
207	T	98.9	Very high	97.6	Very high	39 Å²	39	42.3 Å²	42.3	24%	0.239	23%	0.225	C	C	.	.			trans	-106.6	-31.2	-177.6	59.7	0	0	0	0	112.8	R183 N205 S228 I230 L231	R183-T207 PolarHBondContact O-N 3.17Å; R183-T207 PolarHBondContact O-OG1 3.18Å; N205-T207 PolarHBondContact O-N 2.73Å; T207-S228 WeakPolarHBondContact CA-O 3.38Å; T207-I230 PolarHBondContact O-N 3.05Å; T207-L231 PolarHBondContact O-N 3Å; T207-L231 VanDerWaalsContact O-N 3.12Å
208	A	98.9	Very high	97.7	Very high	11 Å²	11	43.8 Å²	43.8	9%	0.091	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.4	178.6	0	0	0	0	0	111.5	R183 E184 L185 Y210	R183-A208 PolarHBondContact O-N 2.88Å; E184-A208 HydrophobicContact CG-CB 4.35Å; L185-A208 PolarHBondContact N-O 3.27Å; L185-A208 VanDerWaalsContact N-O 3.09Å; A208-Y210 HydrophobicContact CB-CD2 4.46Å; A208-Y210 HydrophobicContact CB-CE2 3.67Å
209	L	98.9	Very high	97.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	117.3	177.3	177.2	62.6	0	0	0	109.8	L185 L200 L206 L211 L223 L226 L229 L231 D233	L185-L209 HydrophobicContact CB-CD1 4.16Å; L185-L209 HydrophobicContact CD2-CD1 3.83Å; L185-L209 HydrophobicContact CG-CD1 4.15Å; L200-L209 HydrophobicContact CD1-CD2 3.75Å; L206-L209 HydrophobicContact CD2-CB 4.17Å; L206-L209 HydrophobicContact CD2-CD1 4.38Å; L209-L211 HydrophobicContact CD1-CD1 3.98Å; L209-L211 HydrophobicContact CD1-CG 4.07Å; L209-L211 HydrophobicContact CD2-CD1 3.86Å; L209-L211 HydrophobicContact CG-CD1 3.92Å; L209-L211 HydrophobicContact CG-CG 4.23Å; L209-L223 HydrophobicContact CD2-CD2 3.71Å; L209-L226 HydrophobicContact CD2-CD1 4.43Å; L209-L229 HydrophobicContact CB-CD1 3.93Å; L209-L231 PolarHBondContact N-O 2.78Å; L209-D233 PolarHBondContact O-N 2.96Å
210	Y	98.9	Very high	97.8	Very high	63 Å²	63	39.9 Å²	39.9	25%	0.247	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	113.9	178.2	-56.6	-89.1	0	0	0	110.3	L185 H186 L187 S188 A208 L231 D233	L185-Y210 PolarHBondContact O-N 2.83Å; H186-Y210 AromaticContact CE1-CD2 3.31Å; H186-Y210 WeakPolarHBondContact CE1-CD2 3.41Å; H186-Y210 AromaticContact CE1-CE2 3.21Å; H186-Y210 WeakPolarHBondContact CE1-CE2 3.26Å; H186-Y210 AromaticContact CG-CD2 3.84Å; H186-Y210 AromaticContact ND1-CD2 3.3Å; H186-Y210 VanDerWaalsContact ND1-CD2 3.3Å; H186-Y210 WeakPolarHBondContact ND1-CD2 3.47Å; H186-Y210 AromaticContact ND1-CE2 3.72Å; H186-Y210 AromaticContact ND1-CG 3.87Å; H186-Y210 AromaticContact NE2-CD2 3.83Å; H186-Y210 AromaticContact NE2-CE2 3.71Å; L187-Y210 CarbonylContact C-O 3.3Å; L187-Y210 WeakPolarHBondContact CA-O 3.31Å; L187-Y210 PolarHBondContact N-O 3.4Å; S188-Y210 PolarHBondContact N-O 3.15Å; S188-Y210 WeakPolarHBondContact OG-CB 3.35Å; A208-Y210 HydrophobicContact CB-CD2 4.46Å; A208-Y210 HydrophobicContact CB-CE2 3.67Å; Y210-L231 HydrophobicContact CD1-CD2 4.02Å; Y210-L231 HydrophobicContact CE1-CD1 4.3Å; Y210-L231 HydrophobicContact CE1-CD2 3.56Å; Y210-D233 HydrophobicContact CD1-CB 4.03Å
211	L	98.9	Very high	97.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.			trans	-130.2	14.3	-179.9	-77.9	166.6	0	0	0	111.6	M174 L187 I192 V195 L209 N214 I216 M219 D233 L234 N237	M174-L211 HydrophobicContact SD-CD2 3.9Å; L187-L211 HydrophobicContact CB-CD2 3.66Å; L187-L211 HydrophobicContact CD1-CD2 3.96Å; L187-L211 HydrophobicContact CG-CD2 4.47Å; I192-L211 HydrophobicContact CD1-CD2 4.17Å; V195-L211 HydrophobicContact CG2-CD1 4.21Å; L209-L211 HydrophobicContact CD1-CD1 3.98Å; L209-L211 HydrophobicContact CD1-CG 4.07Å; L209-L211 HydrophobicContact CD2-CD1 3.86Å; L209-L211 HydrophobicContact CG-CD1 3.92Å; L209-L211 HydrophobicContact CG-CG 4.23Å; L211-N214 PolarHBondContact O-ND2 3.34Å; L211-I216 HydrophobicContact CB-CD1 3.91Å; L211-I216 HydrophobicContact CD1-CD1 4.27Å; L211-I216 HydrophobicContact CD2-CD1 4.1Å; L211-I216 HydrophobicContact CG-CD1 4.33Å; L211-M219 HydrophobicContact CD1-CE 4.17Å; L211-D233 CarbonylContact C-O 3.59Å; L211-D233 WeakPolarHBondContact CA-O 3.45Å; L211-D233 PolarHBondContact N-O 3.06Å; L211-L234 HydrophobicContact CB-CD2 3.87Å; L211-L234 HydrophobicContact CD1-CD2 3.87Å; L211-N237 PolarHBondContact O-ND2 2.67Å
212	S	98.9	Very high	97.9	Very high	8 Å²	8	35.3 Å²	35.3	6%	0.056	19%	0.189	C	C	.	.			trans	-60.9	154.8	178.9	43.2	0	0	0	0	113.5	S188 Y189 N214 D233 S235	S188-S212 CarbonylContact C-O 3.57Å; S188-S212 WeakPolarHBondContact CA-O 3.31Å; S188-S212 VanDerWaalsContact CB-O 3.26Å; S188-S212 WeakPolarHBondContact CB-O 3.3Å; S188-S212 WeakPolarHBondContact CB-OG 3.41Å; S188-S212 PolarHBondContact OG-N 2.7Å; S188-S212 PolarHBondContact OG-OG 3.29Å; Y189-S212 PolarHBondContact N-O 2.68Å; S212-N214 PolarHBondContact O-N 3.11Å; S212-N214 PolarHBondContact O-ND2 2.79Å; S212-D233 WeakPolarHBondContact CB-OD1 3.3Å; S212-D233 WeakPolarHBondContact CB-OD2 3.09Å; S212-D233 PolarHBondContact N-O 2.85Å; S212-D233 PolarHBondContact OG-OD2 2.95Å; S212-S235 WeakPolarHBondContact CA-O 3.28Å; S212-S235 WeakPolarHBondContact CB-OG 3.33Å
213	H	98.9	Very high	98	Very high	63 Å²	63	34.1 Å²	34.1	29%	0.292	18%	0.177	S	C	.	.	S	Bend	trans	54.1	55.3	-178.5	-63	-89.8	0	0	0	112.5	Y189 N190 S235 Y236	Y189-H213 VanDerWaalsContact CA-O 3.24Å; Y189-H213 WeakPolarHBondContact CA-O 3.42Å; Y189-H213 HydrophobicContact CD1-CB 3.63Å; Y189-H213 AromaticContact CD1-CG 3.9Å; Y189-H213 HydrophobicContact CD2-CB 4.33Å; Y189-H213 HydrophobicContact CE1-CB 3.8Å; Y189-H213 AromaticContact CE1-CD2 3.69Å; Y189-H213 AromaticContact CE1-CG 3.5Å; Y189-H213 VanDerWaalsContact CE1-CG 3.5Å; Y189-H213 AromaticContact CE1-ND1 3.83Å; Y189-H213 HydrophobicContact CE2-CB 4.45Å; Y189-H213 AromaticContact CE2-CD2 3.81Å; Y189-H213 HydrophobicContact CG-CB 3.92Å; Y189-H213 AromaticContact CZ-CD2 3.37Å; Y189-H213 AromaticContact CZ-CG 3.71Å; Y189-H213 AromaticContact CZ-NE2 3.76Å; Y189-H213 PolarHBondContact N-O 3.15Å; Y189-H213 PolarHBondContact OH-CD2 3.26Å; Y189-H213 PolarHBondContact OH-NE2 3.28Å; N190-H213 PolarHBondContact N-O 2.64Å; H213-S235 PolarHBondContact N-O 3.02Å; H213-S235 VanDerWaalsContact N-O 3.15Å; H213-Y236 VanDerWaalsContact CA-O 3.23Å; H213-Y236 WeakPolarHBondContact CA-O 3.18Å; H213-Y236 AromaticContact CE1-CD1 3.64Å; H213-Y236 AromaticContact CE1-CD2 3.59Å; H213-Y236 AromaticContact CE1-CG 3.36Å; H213-Y236 PolarHBondContact N-O 3.24Å; H213-Y236 AromaticContact ND1-CG 3.78Å; H213-Y236 AromaticContact NE2-CD2 3.38Å; H213-Y236 WeakPolarHBondContact NE2-CD2 3.42Å; H213-Y236 AromaticContact NE2-CE2 3.86Å; H213-Y236 AromaticContact NE2-CG 3.63Å
214	N	98.9	Very high	97.9	Very high	8 Å²	8	41 Å²	41	4%	0.043	21%	0.207	C	C	.	.	S	Bend	trans	-125.1	-166.5	171.8	-86.7	-81.9	0	0	0	109.5	L187 N190 Q191 I192 L211 S212 I216 Y236 N237	L187-N214 PolarHBondContact O-ND2 2.87Å; N190-N214 WeakPolarHBondContact CA-OD1 3.47Å; N190-N214 WeakPolarHBondContact CB-OD1 3.47Å; N190-N214 PolarHBondContact O-OD1 2.86Å; Q191-N214 PolarHBondContact N-OD1 3.24Å; I192-N214 HydrophobicContact CB-CB 4.39Å; I192-N214 VanDerWaalsContact CB-OD1 3.31Å; I192-N214 WeakPolarHBondContact CB-OD1 3.32Å; I192-N214 WeakPolarHBondContact CG1-OD1 3.23Å; I192-N214 PolarHBondContact N-OD1 3.45Å; L211-N214 PolarHBondContact O-ND2 3.34Å; S212-N214 PolarHBondContact O-N 3.11Å; S212-N214 PolarHBondContact O-ND2 2.79Å; N214-I216 HydrophobicContact CB-CD1 4.03Å; N214-I216 HydrophobicContact CB-CG1 3.91Å; N214-Y236 PolarHBondContact N-O 3.36Å; N214-N237 WeakPolarHBondContact CA-OD1 3.34Å; N214-N237 WeakPolarHBondContact CB-OD1 3.21Å; N214-N237 PolarHBondContact O-OD1 3.23Å
215	Q	98.8	Very high	97.8	Very high	89 Å²	89	39 Å²	39	42%	0.416	21%	0.209	S	C	.	.			trans	-117.5	27	180	-59.4	176.4	7.1	0	0	111	I192 S193 F217 N237	I192-Q215 CarbonylContact O-C 3.57Å; I192-Q215 WeakPolarHBondContact O-CA 3.36Å; I192-Q215 PolarHBondContact O-N 3.45Å; S193-Q215 WeakPolarHBondContact CA-O 3.48Å; Q215-F217 PolarHBondContact O-N 3.13Å; Q215-N237 PolarHBondContact N-OD1 3.26Å
216	I	98.9	Very high	97.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.			trans	-69.6	119.2	-169.2	-58.3	165.7	0	0	0	108.9	I192 S193 V195 L211 N214 M219 N237 H238 L239	I192-I216 HydrophobicContact CB-CG1 4.39Å; I192-I216 HydrophobicContact CG2-CG1 4.18Å; I192-I216 WeakPolarHBondContact O-CG1 3.48Å; I192-I216 PolarHBondContact O-N 3.44Å; I192-I216 VanDerWaalsContact O-N 3.09Å; S193-I216 WeakPolarHBondContact O-CA 3.18Å; V195-I216 HydrophobicContact CG2-CD1 4Å; V195-I216 HydrophobicContact CG2-CG1 4.42Å; V195-I216 HydrophobicContact CG2-CG2 4.19Å; L211-I216 HydrophobicContact CB-CD1 3.91Å; L211-I216 HydrophobicContact CD1-CD1 4.27Å; L211-I216 HydrophobicContact CD2-CD1 4.1Å; L211-I216 HydrophobicContact CG-CD1 4.33Å; N214-I216 HydrophobicContact CB-CD1 4.03Å; N214-I216 HydrophobicContact CB-CG1 3.91Å; I216-M219 HydrophobicContact CG2-CG 3.56Å; I216-M219 HydrophobicContact CG2-SD 4.17Å; I216-N237 HydrophobicContact CB-CB 4.37Å; I216-N237 VanDerWaalsContact CB-OD1 3.23Å; I216-N237 WeakPolarHBondContact CB-OD1 3.23Å; I216-N237 VanDerWaalsContact CG1-OD1 3.26Å; I216-N237 WeakPolarHBondContact CG1-OD1 3.23Å; I216-N237 PolarHBondContact N-OD1 3.46Å; I216-H238 CarbonylContact O-C 3.14Å; I216-H238 VanDerWaalsContact O-CA 3.26Å; I216-H238 WeakPolarHBondContact O-CA 3.48Å; I216-H238 PolarHBondContact O-N 2.78Å; I216-L239 HydrophobicContact CG2-CD2 3.87Å; I216-L239 PolarHBondContact O-N 2.83Å
217	F	98.3	Very high	97.7	Very high	96 Å²	96	40.3 Å²	40.3	42%	0.421	21%	0.211	S	C	.	.			trans	-109.7	-10.7	176.1	66.5	-93.8	0	0	0	113.8	S193 K194 Q215 H238	S193-F217 WeakPolarHBondContact O-CD1 3.26Å; S193-F217 WeakPolarHBondContact O-CE1 3.42Å; S193-F217 PolarHBondContact O-N 2.89Å; K194-F217 HydrophobicContact CD-CE2 4.45Å; K194-F217 HydrophobicContact CD-CZ 4.05Å; K194-F217 HydrophobicContact CG-CD1 4.43Å; K194-F217 HydrophobicContact CG-CE1 3.82Å; K194-F217 HydrophobicContact CG-CE2 4.35Å; K194-F217 HydrophobicContact CG-CZ 3.84Å; Q215-F217 PolarHBondContact O-N 3.13Å; F217-H238 WeakPolarHBondContact CA-O 3.41Å; F217-H238 HydrophobicContact CB-CB 4.13Å
218	E	94.5	Very high	97.7	Very high	98 Å²	98	40.8 Å²	40.8	46%	0.458	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-152.5	134.4	-177.3	-173.8	-179.2	-171	0	0	111.4	K194 V195	K194-E218 IonicContact NZ-OE2 2.7Å; K194-E218 PolarHBondContact NZ-OE2 3.41Å; V195-E218 PolarHBondContact N-O 3.19Å
219	M	96.4	Very high	97.7	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.03	21%	0.211	C	C	.	.			trans	-130	-17	178.1	-65.6	-169.8	67.8	0	0	114.7	V195 L211 I216 A221 S222 L223 L234 L239 P243	V195-M219 HydrophobicContact CB-CB 4.38Å; V195-M219 HydrophobicContact CB-CE 4.06Å; V195-M219 HydrophobicContact CB-CG 3.98Å; V195-M219 HydrophobicContact CG1-CE 4.22Å; V195-M219 HydrophobicContact CG2-CE 3.96Å; V195-M219 HydrophobicContact CG2-CG 4.09Å; V195-M219 HydrophobicContact CG2-SD 4.49Å; V195-M219 CarbonylContact O-C 3.46Å; V195-M219 WeakPolarHBondContact O-CA 3.04Å; L211-M219 HydrophobicContact CD1-CE 4.17Å; I216-M219 HydrophobicContact CG2-CG 3.56Å; I216-M219 HydrophobicContact CG2-SD 4.17Å; M219-A221 PolarHBondContact O-N 2.92Å; M219-S222 VanDerWaalsContact O-CB 3.24Å; M219-S222 WeakPolarHBondContact O-CB 3.31Å; M219-S222 PolarHBondContact O-N 2.97Å; M219-S222 PolarHBondContact O-OG 3.23Å; M219-L223 HydrophobicContact CE-CD2 3.98Å; M219-L223 HydrophobicContact CE-CG 4.25Å; M219-L234 HydrophobicContact CE-CD1 4.23Å; M219-L234 HydrophobicContact CE-CD2 3.77Å; M219-L234 HydrophobicContact SD-CD1 3.7Å; M219-L234 HydrophobicContact SD-CD2 3.64Å; M219-L234 HydrophobicContact SD-CG 4.29Å; M219-L239 HydrophobicContact CG-CD2 3.95Å; M219-L239 HydrophobicContact SD-CD1 4.46Å; M219-L239 HydrophobicContact SD-CD2 4.24Å; M219-P243 HydrophobicContact SD-CG 4.38Å
220	G	95.7	Very high	97.7	Very high	19 Å²	19	43.3 Å²	43.3	20%	0.196	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	-139.2	-174	0	0	0	0	0	112.4	S222 D244	G220-S222 VanDerWaalsContact C-N 3.3Å; G220-S222 PolarHBondContact O-N 3.43Å; G220-D244 WeakPolarHBondContact CA-OD2 3.23Å; G220-D244 PolarHBondContact O-N 3.38Å
221	A	96.6	Very high	97.7	Very high	43 Å²	43	41.3 Å²	41.3	36%	0.355	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	22.2	-179.7	0	0	0	0	0	114.6	M219 L223 K224 D244	M219-A221 PolarHBondContact O-N 2.92Å; A221-L223 PolarHBondContact O-N 2.93Å; A221-L223 VanDerWaalsContact O-N 3.16Å; A221-K224 WeakPolarHBondContact O-CB 3.35Å; A221-K224 PolarHBondContact O-N 3Å; A221-K224 VanDerWaalsContact O-N 3.17Å; A221-D244 WeakPolarHBondContact CA-O 3.45Å; A221-D244 HydrophobicContact CB-CB 4.21Å; A221-D244 WeakPolarHBondContact CB-O 3.49Å
222	S	97.1	Very high	97.7	Very high	5 Å²	5	41.3 Å²	41.3	4%	0.035	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.6	-172.6	51.8	0	0	0	0	114.9	M219 G220	M219-S222 VanDerWaalsContact O-CB 3.24Å; M219-S222 WeakPolarHBondContact O-CB 3.31Å; M219-S222 PolarHBondContact O-N 2.97Å; M219-S222 PolarHBondContact O-OG 3.23Å; G220-S222 VanDerWaalsContact C-N 3.3Å; G220-S222 PolarHBondContact O-N 3.43Å
223	L	97.8	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-19.8	179.7	-57.4	-175.2	0	0	0	114.1	L200 L209 M219 A221 G225 L226 L234 P243	L200-L223 HydrophobicContact CD1-CD2 4.2Å; L209-L223 HydrophobicContact CD2-CD2 3.71Å; M219-L223 HydrophobicContact CE-CD2 3.98Å; M219-L223 HydrophobicContact CE-CG 4.25Å; A221-L223 PolarHBondContact O-N 2.93Å; A221-L223 VanDerWaalsContact O-N 3.16Å; L223-G225 PolarHBondContact O-N 3.49Å; L223-G225 VanDerWaalsContact O-N 3.13Å; L223-L226 HydrophobicContact CD2-CD1 3.87Å; L223-L226 WeakPolarHBondContact O-CB 3.23Å; L223-L226 PolarHBondContact O-N 2.88Å; L223-L226 VanDerWaalsContact O-N 3.09Å; L223-L234 HydrophobicContact CD1-CD1 4.18Å; L223-P243 HydrophobicContact CD1-CB 3.9Å; L223-P243 HydrophobicContact CD1-CG 3.77Å; L223-P243 HydrophobicContact CG-CB 4.3Å
224	K	95.6	Very high	97.7	Very high	147 Å²	147	39 Å²	39	64%	0.639	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-32	-168.5	-173.1	178.1	-179.8	178.5	0	113.4	A221	A221-K224 WeakPolarHBondContact O-CB 3.35Å; A221-K224 PolarHBondContact O-N 3Å; A221-K224 VanDerWaalsContact O-N 3.17Å
225	G	95.8	Very high	97.7	Very high	42 Å²	42	38.8 Å²	38.8	43%	0.433	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-6.3	-178.5	0	0	0	0	0	115.4	L223 K227	L223-G225 PolarHBondContact O-N 3.49Å; L223-G225 VanDerWaalsContact O-N 3.13Å; G225-K227 VanDerWaalsContact C-N 3.35Å; G225-K227 PolarHBondContact O-N 3.09Å
226	L	98.3	Very high	97.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.			trans	-85.8	73.3	-171.4	-54.9	176.8	0	0	0	111.3	L200 L203 L206 L209 L223 S228 L229 P247	L200-L226 HydrophobicContact CB-CD2 4.12Å; L200-L226 HydrophobicContact CD1-CD1 4.07Å; L203-L226 HydrophobicContact CB-CD2 3.79Å; L203-L226 WeakPolarHBondContact O-CD2 3.11Å; L206-L226 HydrophobicContact CD2-CD1 4.25Å; L206-L226 HydrophobicContact CD2-CD2 4.34Å; L209-L226 HydrophobicContact CD2-CD1 4.43Å; L223-L226 HydrophobicContact CD2-CD1 3.87Å; L223-L226 WeakPolarHBondContact O-CB 3.23Å; L223-L226 PolarHBondContact O-N 2.88Å; L223-L226 VanDerWaalsContact O-N 3.09Å; L226-S228 PolarHBondContact O-N 2.91Å; L226-S228 VanDerWaalsContact O-N 3.1Å; L226-L229 HydrophobicContact CB-CB 3.78Å; L226-L229 HydrophobicContact CB-CD2 4.22Å; L226-L229 HydrophobicContact CB-CG 4.49Å; L226-L229 HydrophobicContact CD1-CD1 4.47Å; L226-L229 HydrophobicContact CD1-CD2 3.8Å; L226-L229 WeakPolarHBondContact O-CB 3.26Å; L226-L229 PolarHBondContact O-N 3.15Å; L226-P247 HydrophobicContact CB-CB 4.48Å; L226-P247 WeakPolarHBondContact O-CB 3.11Å
227	K	97.4	Very high	97.7	Very high	110 Å²	110	39 Å²	39	48%	0.478	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.8	-169.4	-64	176.3	-170.6	161	0	115	E204 G225 A249	E204-K227 HydrophobicContact CG-CD 4.37Å; E204-K227 WeakPolarHBondContact OE1-CE 3.35Å; E204-K227 IonicContact OE1-NZ 3.33Å; E204-K227 PolarHBondContact OE1-NZ 3.25Å; E204-K227 IonicContact OE2-NZ 3.72Å; E204-K227 PolarHBondContact OE2-NZ 2.87Å; G225-K227 VanDerWaalsContact C-N 3.35Å; G225-K227 PolarHBondContact O-N 3.09Å; K227-A249 WeakPolarHBondContact O-CB 3.18Å
228	S	98.6	Very high	97.7	Very high	48 Å²	48	38 Å²	38	34%	0.336	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	7.5	-179	-51.1	0	0	0	0	113.8	E204 L206 T207 L226 I230	E204-S228 WeakPolarHBondContact O-CB 3.32Å; E204-S228 PolarHBondContact O-N 2.72Å; E204-S228 PolarHBondContact O-OG 3.41Å; L206-S228 CarbonylContact O-C 3.23Å; T207-S228 WeakPolarHBondContact CA-O 3.38Å; L226-S228 PolarHBondContact O-N 2.91Å; L226-S228 VanDerWaalsContact O-N 3.1Å; S228-I230 PolarHBondContact O-N 2.95Å
229	L	98.9	Very high	97.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.			trans	-70.4	122.5	-174.6	-166.3	71.9	0	0	0	110.5	L206 L209 L226 L231 A232 P247 A249 L250	L206-L229 HydrophobicContact CD2-CD1 4.19Å; L206-L229 HydrophobicContact CG-CD1 4.21Å; L206-L229 WeakPolarHBondContact O-CA 3.47Å; L206-L229 PolarHBondContact O-N 3.25Å; L209-L229 HydrophobicContact CB-CD1 3.93Å; L226-L229 HydrophobicContact CB-CB 3.78Å; L226-L229 HydrophobicContact CB-CD2 4.22Å; L226-L229 HydrophobicContact CB-CG 4.49Å; L226-L229 HydrophobicContact CD1-CD1 4.47Å; L226-L229 HydrophobicContact CD1-CD2 3.8Å; L226-L229 WeakPolarHBondContact O-CB 3.26Å; L226-L229 PolarHBondContact O-N 3.15Å; L229-L231 WeakPolarHBondContact CD1-O 3.35Å; L229-A232 HydrophobicContact CD2-CB 4.02Å; L229-P247 HydrophobicContact CB-CB 4.4Å; L229-P247 HydrophobicContact CB-CG 3.88Å; L229-P247 HydrophobicContact CD2-CG 3.84Å; L229-P247 HydrophobicContact CG-CG 4.42Å; L229-A249 CarbonylContact O-C 3.18Å; L229-L250 HydrophobicContact CB-CD1 4.49Å; L229-L250 HydrophobicContact CD2-CD1 3.96Å; L229-L250 HydrophobicContact CG-CD1 4Å; L229-L250 WeakPolarHBondContact O-CA 3.08Å; L229-L250 PolarHBondContact O-N 2.96Å; L229-L250 VanDerWaalsContact O-N 3.13Å
230	I	98.9	Very high	98	Very high	65 Å²	65	41.5 Å²	41.5	33%	0.333	21%	0.212	S	C	.	.			trans	-101.3	-43	179.5	-62.3	173	0	0	0	109.6	T207 S228 E251 Q252	T207-I230 PolarHBondContact O-N 3.05Å; S228-I230 PolarHBondContact O-N 2.95Å; I230-E251 HydrophobicContact CG2-CB 4Å; I230-E251 HydrophobicContact CG2-CG 4.07Å; I230-E251 PolarHBondContact O-N 2.99Å; I230-Q252 PolarHBondContact O-N 3.38Å
231	L	98.9	Very high	98	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.11	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.1	-176.3	-176.1	158.7	0	0	0	111.1	T207 L209 Y210 L229 D233 Q252 Y254	T207-L231 PolarHBondContact O-N 3Å; T207-L231 VanDerWaalsContact O-N 3.12Å; L209-L231 PolarHBondContact N-O 2.78Å; Y210-L231 HydrophobicContact CD1-CD2 4.02Å; Y210-L231 HydrophobicContact CE1-CD1 4.3Å; Y210-L231 HydrophobicContact CE1-CD2 3.56Å; L229-L231 WeakPolarHBondContact CD1-O 3.35Å; L231-D233 HydrophobicContact CD2-CB 4.08Å; L231-Q252 HydrophobicContact CB-CB 4.37Å; L231-Q252 HydrophobicContact CG-CB 4.22Å; L231-Y254 HydrophobicContact CD1-CE2 4.41Å
232	A	98.9	Very high	98.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	112.2	168.4	0	0	0	0	0	110.2	L229 L250 Q252 L253 Y254	L229-A232 HydrophobicContact CD2-CB 4.02Å; A232-L250 HydrophobicContact CB-CD1 4.01Å; A232-Q252 PolarHBondContact N-O 3.41Å; A232-L253 HydrophobicContact CB-CD1 4.13Å; A232-Y254 PolarHBondContact O-N 3.4Å
233	D	98.9	Very high	98.1	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.112	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108.7	174.2	-179.4	13.5	0	0	0	110.6	L209 Y210 L211 S212 L231 S235 Y254	L209-D233 PolarHBondContact O-N 2.96Å; Y210-D233 HydrophobicContact CD1-CB 4.03Å; L211-D233 CarbonylContact C-O 3.59Å; L211-D233 WeakPolarHBondContact CA-O 3.45Å; L211-D233 PolarHBondContact N-O 3.06Å; S212-D233 WeakPolarHBondContact CB-OD1 3.3Å; S212-D233 WeakPolarHBondContact CB-OD2 3.09Å; S212-D233 PolarHBondContact N-O 2.85Å; S212-D233 PolarHBondContact OG-OD2 2.95Å; L231-D233 HydrophobicContact CD2-CB 4.08Å; D233-S235 WeakPolarHBondContact OD1-CB 3.15Å; D233-S235 PolarHBondContact OD1-N 2.85Å; D233-S235 VanDerWaalsContact OD1-N 3.11Å; D233-S235 PolarHBondContact OD1-OG 3.06Å; D233-Y254 HydrophobicContact CB-CD2 4.13Å
234	L	98.9	Very high	98	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.			trans	-120.6	15.9	-180	-57.8	176.4	0	0	0	111.5	L211 M219 L223 N237 L239 P243 Y254 L255 N258	L211-L234 HydrophobicContact CB-CD2 3.87Å; L211-L234 HydrophobicContact CD1-CD2 3.87Å; M219-L234 HydrophobicContact CE-CD1 4.23Å; M219-L234 HydrophobicContact CE-CD2 3.77Å; M219-L234 HydrophobicContact SD-CD1 3.7Å; M219-L234 HydrophobicContact SD-CD2 3.64Å; M219-L234 HydrophobicContact SD-CG 4.29Å; L223-L234 HydrophobicContact CD1-CD1 4.18Å; L234-N237 PolarHBondContact O-ND2 3.31Å; L234-L239 HydrophobicContact CB-CD1 4.14Å; L234-L239 HydrophobicContact CD1-CD1 4.36Å; L234-P243 HydrophobicContact CD1-CG 3.88Å; L234-Y254 CarbonylContact C-O 3.12Å; L234-Y254 WeakPolarHBondContact CA-O 3.18Å; L234-Y254 WeakPolarHBondContact CB-O 3.08Å; L234-Y254 PolarHBondContact N-O 2.89Å; L234-L255 HydrophobicContact CB-CD2 3.77Å; L234-L255 HydrophobicContact CD1-CD2 3.84Å; L234-L255 HydrophobicContact CG-CD2 4.42Å; L234-N258 PolarHBondContact O-ND2 3.12Å
235	S	98.9	Very high	98	Very high	5 Å²	5	44.7 Å²	44.7	4%	0.035	22%	0.224	C	C	.	.			trans	-62.3	159.1	179.8	61.8	0	0	0	0	112.3	S212 H213 D233 N237 Y254 E256	S212-S235 WeakPolarHBondContact CA-O 3.28Å; S212-S235 WeakPolarHBondContact CB-OG 3.33Å; H213-S235 PolarHBondContact N-O 3.02Å; H213-S235 VanDerWaalsContact N-O 3.15Å; D233-S235 WeakPolarHBondContact OD1-CB 3.15Å; D233-S235 PolarHBondContact OD1-N 2.85Å; D233-S235 VanDerWaalsContact OD1-N 3.11Å; D233-S235 PolarHBondContact OD1-OG 3.06Å; S235-N237 PolarHBondContact O-N 3.06Å; S235-N237 PolarHBondContact O-ND2 3.17Å; S235-Y254 PolarHBondContact N-O 3.3Å; S235-E256 CarbonylContact C-O 3.43Å; S235-E256 VanDerWaalsContact CA-O 3.23Å; S235-E256 WeakPolarHBondContact CA-O 3.46Å; S235-E256 VanDerWaalsContact CB-CD 3.42Å
236	Y	98.9	Very high	98.1	Very high	90 Å²	90	43 Å²	43	35%	0.353	21%	0.205	S	C	.	.	S	Bend	trans	52	58	176.7	-62.2	-90.1	0	0	0	112.7	H213 N214 E256 Y257	H213-Y236 VanDerWaalsContact CA-O 3.23Å; H213-Y236 WeakPolarHBondContact CA-O 3.18Å; H213-Y236 AromaticContact CE1-CD1 3.64Å; H213-Y236 AromaticContact CE1-CD2 3.59Å; H213-Y236 AromaticContact CE1-CG 3.36Å; H213-Y236 PolarHBondContact N-O 3.24Å; H213-Y236 AromaticContact ND1-CG 3.78Å; H213-Y236 AromaticContact NE2-CD2 3.38Å; H213-Y236 WeakPolarHBondContact NE2-CD2 3.42Å; H213-Y236 AromaticContact NE2-CE2 3.86Å; H213-Y236 AromaticContact NE2-CG 3.63Å; N214-Y236 PolarHBondContact N-O 3.36Å; Y236-E256 PolarHBondContact N-O 3.2Å; Y236-Y257 VanDerWaalsContact CA-O 3.31Å; Y236-Y257 WeakPolarHBondContact CA-O 3.39Å; Y236-Y257 HydrophobicContact CD1-CD1 4.2Å; Y236-Y257 HydrophobicContact CD1-CD2 4.09Å; Y236-Y257 AromaticContact CD1-CG 3.7Å; Y236-Y257 HydrophobicContact CD1-CG 3.7Å; Y236-Y257 HydrophobicContact CD2-CD2 4.37Å; Y236-Y257 AromaticContact CE1-CD1 3.74Å; Y236-Y257 HydrophobicContact CE1-CD1 3.74Å; Y236-Y257 AromaticContact CE1-CD2 3.45Å; Y236-Y257 HydrophobicContact CE1-CD2 3.45Å; Y236-Y257 VanDerWaalsContact CE1-CD2 3.45Å; Y236-Y257 HydrophobicContact CE1-CE1 4.09Å; Y236-Y257 AromaticContact CE1-CE2 3.86Å; Y236-Y257 HydrophobicContact CE1-CE2 3.86Å; Y236-Y257 AromaticContact CE1-CG 3.38Å; Y236-Y257 HydrophobicContact CE1-CG 3.38Å; Y236-Y257 AromaticContact CE2-CD2 3.78Å; Y236-Y257 HydrophobicContact CE2-CD2 3.78Å; Y236-Y257 HydrophobicContact CE2-CE2 4.29Å; Y236-Y257 HydrophobicContact CE2-CG 4.37Å; Y236-Y257 HydrophobicContact CG-CG 4.33Å; Y236-Y257 AromaticContact CZ-CD2 3.27Å; Y236-Y257 AromaticContact CZ-CE2 3.51Å; Y236-Y257 AromaticContact CZ-CG 3.76Å; Y236-Y257 PolarHBondContact N-O 3.13Å; Y236-Y257 WeakPolarHBondContact OH-CD2 3.38Å; Y236-Y257 WeakPolarHBondContact OH-CE2 3.37Å
237	N	98.9	Very high	98	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.206	C	C	.	.	S	Bend	trans	-133.9	-170.4	179.6	-90.6	-76.6	0	0	0	110.3	L211 N214 Q215 I216 L234 S235 L239 Y257 N258	L211-N237 PolarHBondContact O-ND2 2.67Å; N214-N237 WeakPolarHBondContact CA-OD1 3.34Å; N214-N237 WeakPolarHBondContact CB-OD1 3.21Å; N214-N237 PolarHBondContact O-OD1 3.23Å; Q215-N237 PolarHBondContact N-OD1 3.26Å; I216-N237 HydrophobicContact CB-CB 4.37Å; I216-N237 VanDerWaalsContact CB-OD1 3.23Å; I216-N237 WeakPolarHBondContact CB-OD1 3.23Å; I216-N237 VanDerWaalsContact CG1-OD1 3.26Å; I216-N237 WeakPolarHBondContact CG1-OD1 3.23Å; I216-N237 PolarHBondContact N-OD1 3.46Å; L234-N237 PolarHBondContact O-ND2 3.31Å; S235-N237 PolarHBondContact O-N 3.06Å; S235-N237 PolarHBondContact O-ND2 3.17Å; N237-L239 HydrophobicContact CB-CG 4.43Å; N237-Y257 PolarHBondContact N-O 3.33Å; N237-Y257 VanDerWaalsContact N-O 3.13Å; N237-N258 WeakPolarHBondContact CA-OD1 3.37Å; N237-N258 WeakPolarHBondContact CB-OD1 3.44Å; N237-N258 PolarHBondContact O-OD1 3Å
238	H	98.8	Very high	98	Very high	74 Å²	74	43.3 Å²	43.3	34%	0.343	21%	0.211	S	C	.	.			trans	-112.7	25.3	-178.7	-59.4	156.9	0	0	0	112.9	I216 F217 R240 N258 Y259	I216-H238 CarbonylContact O-C 3.14Å; I216-H238 VanDerWaalsContact O-CA 3.26Å; I216-H238 WeakPolarHBondContact O-CA 3.48Å; I216-H238 PolarHBondContact O-N 2.78Å; F217-H238 WeakPolarHBondContact CA-O 3.41Å; F217-H238 HydrophobicContact CB-CB 4.13Å; H238-R240 PolarHBondContact O-N 2.78Å; H238-N258 PolarHBondContact N-OD1 3.11Å; H238-Y259 HydrophobicContact CB-CD2 4.17Å; H238-Y259 HydrophobicContact CB-CE2 4.03Å; H238-Y259 AromaticContact CD2-CE2 3.56Å
239	L	98.6	Very high	98	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	20%	0.202	C	C	.	.			trans	-64.4	127.6	-175.8	-66.2	171.6	0	0	0	110.2	I216 M219 L234 N237 L255 N258 Y259 I260	I216-L239 HydrophobicContact CG2-CD2 3.87Å; I216-L239 PolarHBondContact O-N 2.83Å; M219-L239 HydrophobicContact CG-CD2 3.95Å; M219-L239 HydrophobicContact SD-CD1 4.46Å; M219-L239 HydrophobicContact SD-CD2 4.24Å; L234-L239 HydrophobicContact CB-CD1 4.14Å; L234-L239 HydrophobicContact CD1-CD1 4.36Å; N237-L239 HydrophobicContact CB-CG 4.43Å; L239-L255 HydrophobicContact CD1-CD2 3.69Å; L239-N258 HydrophobicContact CB-CB 4.22Å; L239-N258 VanDerWaalsContact CB-OD1 3.22Å; L239-N258 WeakPolarHBondContact CB-OD1 3.42Å; L239-N258 WeakPolarHBondContact CG-OD1 3.29Å; L239-N258 PolarHBondContact N-OD1 2.94Å; L239-Y259 CarbonylContact O-C 3.08Å; L239-Y259 VanDerWaalsContact O-CA 3.25Å; L239-Y259 WeakPolarHBondContact O-CA 3.4Å; L239-Y259 PolarHBondContact O-N 3.39Å; L239-I260 HydrophobicContact CB-CD1 4.46Å; L239-I260 HydrophobicContact CB-CG1 4.17Å; L239-I260 PolarHBondContact O-N 2.65Å; L239-I260 VanDerWaalsContact O-N 3.13Å
240	R	97.1	Very high	98	Very high	174 Å²	174	41.9 Å²	41.9	66%	0.657	20%	0.202	S	C	*	.	S	Bend	trans	-97.7	-16.6	172.9	-65.6	-177.9	178.8	178.3	-0.5	113.1	H238	H238-R240 PolarHBondContact O-N 2.78Å
241	K	96.6	Very high	98	Very high	148 Å²	148	41.8 Å²	41.8	64%	0.643	20%	0.2	S	C	*	.	S	Bend	trans	-137.1	150.1	179.1	-64	-176.6	179.6	-178.3	0	108.3
242	V	97.9	Very high	98	Very high	8 Å²	8	43.2 Å²	43.2	5%	0.048	21%	0.206	C	C	.	.			trans	-63.4	154.9	166.9	-63.1	0	0	0	0	110.5	L255 I260 I263 P264 Y267 M279	V242-L255 HydrophobicContact CG1-CD1 4.36Å; V242-I260 HydrophobicContact CG1-CD1 4.15Å; V242-I260 HydrophobicContact CG1-CG2 4.01Å; V242-I263 HydrophobicContact CG1-CG1 4.13Å; V242-I263 HydrophobicContact CG2-CG2 4.47Å; V242-P264 HydrophobicContact CG2-CG 4.35Å; V242-Y267 HydrophobicContact CB-CE1 4Å; V242-Y267 HydrophobicContact CB-CE2 4.24Å; V242-Y267 HydrophobicContact CG1-CE1 4.34Å; V242-Y267 HydrophobicContact CG2-CD1 4.45Å; V242-Y267 HydrophobicContact CG2-CD2 4.07Å; V242-Y267 HydrophobicContact CG2-CE1 4.01Å; V242-Y267 HydrophobicContact CG2-CE2 3.58Å; V242-Y267 HydrophobicContact CG2-CG 4.48Å; V242-M279 HydrophobicContact CG1-CE 3.91Å
243	P	97.4	Very high	98	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.019	21%	0.206	C	C	.	.			trans	-55.6	144.8	172.8	-25.7	34.9	0	0	0	112.4	M219 L223 L234 G245 Y267	M219-P243 HydrophobicContact SD-CG 4.38Å; L223-P243 HydrophobicContact CD1-CB 3.9Å; L223-P243 HydrophobicContact CD1-CG 3.77Å; L223-P243 HydrophobicContact CG-CB 4.3Å; L234-P243 HydrophobicContact CD1-CG 3.88Å; P243-G245 VanDerWaalsContact C-N 3.26Å; P243-G245 PolarHBondContact O-N 2.93Å; P243-Y267 WeakPolarHBondContact O-CE2 3.43Å; P243-Y267 PolarHBondContact O-OH 3.28Å
244	D	96.1	Very high	98	Very high	100 Å²	100	43.8 Å²	43.8	54%	0.535	21%	0.207	S	C	.	.	S	Bend	trans	-76.7	76.9	-177.9	-62.6	-30.8	0	0	0	110.9	G220 A221	G220-D244 WeakPolarHBondContact CA-OD2 3.23Å; G220-D244 PolarHBondContact O-N 3.38Å; A221-D244 WeakPolarHBondContact CA-O 3.45Å; A221-D244 HydrophobicContact CB-CB 4.21Å; A221-D244 WeakPolarHBondContact CB-O 3.49Å
245	G	95.1	Very high	98	Very high	22 Å²	22	43.8 Å²	43.8	23%	0.227	21%	0.207	C	C	.	.	S	Bend	trans	99.2	138.1	-179	0	0	0	0	0	113	P243	P243-G245 VanDerWaalsContact C-N 3.26Å; P243-G245 PolarHBondContact O-N 2.93Å
246	L	97.7	Very high	98	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	21%	0.21	C	C	.	.			trans	-102.4	153.9	177.4	-62.7	177	0	0	0	110.8	L250 L253 Y267 F268 V270 S271 L274	L246-L250 HydrophobicContact CB-CD2 4.43Å; L246-L250 HydrophobicContact CD1-CD2 4.38Å; L246-L250 HydrophobicContact CD2-CD2 4.06Å; L246-L253 HydrophobicContact CD1-CD2 3.92Å; L246-L253 HydrophobicContact CD2-CD2 3.93Å; L246-Y267 HydrophobicContact CD1-CD1 4.18Å; L246-Y267 HydrophobicContact CD1-CE1 3.57Å; L246-Y267 HydrophobicContact CD2-CE1 4.22Å; L246-Y267 VanDerWaalsContact CD2-OH 3.28Å; L246-Y267 WeakPolarHBondContact CD2-OH 3.36Å; L246-Y267 HydrophobicContact CG-CE1 3.82Å; L246-Y267 HydrophobicContact CG-CE2 4.44Å; L246-Y267 WeakPolarHBondContact CG-OH 3.41Å; L246-F268 HydrophobicContact CD1-CD1 3.91Å; L246-F268 HydrophobicContact CD1-CE1 4.27Å; L246-V270 HydrophobicContact CB-CG2 4.02Å; L246-S271 WeakPolarHBondContact CB-OG 3.24Å; L246-L274 HydrophobicContact CD1-CD2 4.47Å
247	P	97.5	Very high	98	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.013	21%	0.21	C	C	.	.			trans	-72.9	150.5	172.2	24.4	-25.4	0	0	0	111.8	L226 L229 A249 L250 S271	L226-P247 HydrophobicContact CB-CB 4.48Å; L226-P247 WeakPolarHBondContact O-CB 3.11Å; L229-P247 HydrophobicContact CB-CB 4.4Å; L229-P247 HydrophobicContact CB-CG 3.88Å; L229-P247 HydrophobicContact CD2-CG 3.84Å; L229-P247 HydrophobicContact CG-CG 4.42Å; P247-A249 VanDerWaalsContact C-N 3.28Å; P247-A249 PolarHBondContact O-N 2.82Å; P247-L250 HydrophobicContact CG-CB 4.15Å; P247-L250 HydrophobicContact CG-CD1 4.27Å; P247-L250 WeakPolarHBondContact O-CB 3.37Å; P247-L250 PolarHBondContact O-N 3.04Å; P247-S271 PolarHBondContact O-OG 3.37Å
248	I	97.2	Very high	98	Very high	114 Å²	114	44.7 Å²	44.7	59%	0.585	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.9	-173.8	59.7	170	0	0	0	114.1
249	A	98.3	Very high	98	Very high	17 Å²	17	47.1 Å²	47.1	14%	0.14	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-2	-176	0	0	0	0	0	113.6	K227 L229 P247 E251	K227-A249 WeakPolarHBondContact O-CB 3.18Å; L229-A249 CarbonylContact O-C 3.18Å; P247-A249 VanDerWaalsContact C-N 3.28Å; P247-A249 PolarHBondContact O-N 2.82Å; A249-E251 PolarHBondContact O-N 3.03Å
250	L	98.8	Very high	98	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.217	C	C	.	.			trans	-63.6	131.6	-172.8	-161.3	69.2	0	0	0	111.4	L229 A232 L246 P247 L253 K273 L274	L229-L250 HydrophobicContact CB-CD1 4.49Å; L229-L250 HydrophobicContact CD2-CD1 3.96Å; L229-L250 HydrophobicContact CG-CD1 4Å; L229-L250 WeakPolarHBondContact O-CA 3.08Å; L229-L250 PolarHBondContact O-N 2.96Å; L229-L250 VanDerWaalsContact O-N 3.13Å; A232-L250 HydrophobicContact CB-CD1 4.01Å; L246-L250 HydrophobicContact CB-CD2 4.43Å; L246-L250 HydrophobicContact CD1-CD2 4.38Å; L246-L250 HydrophobicContact CD2-CD2 4.06Å; P247-L250 HydrophobicContact CG-CB 4.15Å; P247-L250 HydrophobicContact CG-CD1 4.27Å; P247-L250 WeakPolarHBondContact O-CB 3.37Å; P247-L250 PolarHBondContact O-N 3.04Å; L250-L253 HydrophobicContact CD2-CB 4.01Å; L250-L253 HydrophobicContact CD2-CD1 4.27Å; L250-L253 HydrophobicContact CD2-CD2 4.41Å; L250-L253 HydrophobicContact CD2-CG 4.47Å; L250-K273 CarbonylContact O-C 3.17Å; L250-K273 VanDerWaalsContact O-C 3.23Å; L250-L274 HydrophobicContact CB-CD1 4.4Å; L250-L274 HydrophobicContact CD2-CD1 4.06Å; L250-L274 HydrophobicContact CG-CD1 4.05Å; L250-L274 VanDerWaalsContact O-CA 3.23Å; L250-L274 WeakPolarHBondContact O-CA 3.26Å; L250-L274 PolarHBondContact O-N 3.22Å; L250-L274 VanDerWaalsContact O-N 3.12Å
251	E	98.9	Very high	98	Very high	63 Å²	63	42.4 Å²	42.4	29%	0.294	21%	0.205	S	C	.	.			trans	-115	-32	178.2	-60.5	-174.1	-173.7	0	0	111.8	I230 A249 K273 L275 Y276	I230-E251 HydrophobicContact CG2-CB 4Å; I230-E251 HydrophobicContact CG2-CG 4.07Å; I230-E251 PolarHBondContact O-N 2.99Å; A249-E251 PolarHBondContact O-N 3.03Å; E251-K273 HydrophobicContact CG-CB 4.21Å; E251-L275 PolarHBondContact O-N 3.02Å; E251-Y276 PolarHBondContact O-N 2.94Å
252	Q	98.9	Very high	98	Very high	51 Å²	51	37.5 Å²	37.5	24%	0.238	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.5	-176.5	-68.3	170.4	56.2	0	0	110.9	I230 L231 A232 Y254 Y276	I230-Q252 PolarHBondContact O-N 3.38Å; L231-Q252 HydrophobicContact CB-CB 4.37Å; L231-Q252 HydrophobicContact CG-CB 4.22Å; A232-Q252 PolarHBondContact N-O 3.41Å; Q252-Y254 HydrophobicContact CB-CE1 4.42Å; Q252-Y254 HydrophobicContact CB-CE2 4.48Å; Q252-Y254 PolarHBondContact OE1-OH 3Å; Q252-Y276 HydrophobicContact CG-CD2 3.74Å; Q252-Y276 HydrophobicContact CG-CG 4.4Å
253	L	98.9	Very high	98	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	115.9	177.3	179.9	61.1	0	0	0	110.7	A232 L246 L250 L255 F268 L274 Y276 V277 R278	A232-L253 HydrophobicContact CB-CD1 4.13Å; L246-L253 HydrophobicContact CD1-CD2 3.92Å; L246-L253 HydrophobicContact CD2-CD2 3.93Å; L250-L253 HydrophobicContact CD2-CB 4.01Å; L250-L253 HydrophobicContact CD2-CD1 4.27Å; L250-L253 HydrophobicContact CD2-CD2 4.41Å; L250-L253 HydrophobicContact CD2-CG 4.47Å; L253-L255 HydrophobicContact CD1-CD1 4.1Å; L253-L255 HydrophobicContact CD1-CG 4.09Å; L253-L255 HydrophobicContact CD2-CD1 3.78Å; L253-L255 HydrophobicContact CG-CD1 3.83Å; L253-L255 HydrophobicContact CG-CG 4.11Å; L253-F268 HydrophobicContact CD2-CE1 4.1Å; L253-L274 HydrophobicContact CB-CD1 4.04Å; L253-Y276 PolarHBondContact N-O 2.82Å; L253-V277 WeakPolarHBondContact O-CA 3.22Å; L253-R278 PolarHBondContact O-N 3.13Å
254	Y	98.9	Very high	97.9	Very high	33 Å²	33	40.7 Å²	40.7	13%	0.129	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.8	179.8	-52.6	-37.7	0	0	0	109.8	L231 A232 D233 L234 S235 Q252 E256 R278	L231-Y254 HydrophobicContact CD1-CE2 4.41Å; A232-Y254 PolarHBondContact O-N 3.4Å; D233-Y254 HydrophobicContact CB-CD2 4.13Å; L234-Y254 CarbonylContact C-O 3.12Å; L234-Y254 WeakPolarHBondContact CA-O 3.18Å; L234-Y254 WeakPolarHBondContact CB-O 3.08Å; L234-Y254 PolarHBondContact N-O 2.89Å; S235-Y254 PolarHBondContact N-O 3.3Å; Q252-Y254 HydrophobicContact CB-CE1 4.42Å; Q252-Y254 HydrophobicContact CB-CE2 4.48Å; Q252-Y254 PolarHBondContact OE1-OH 3Å; Y254-E256 WeakPolarHBondContact CA-OE2 3.12Å; Y254-E256 WeakPolarHBondContact CB-OE2 3.29Å; Y254-R278 HydrophobicContact CD1-CB 3.97Å; Y254-R278 HydrophobicContact CD1-CG 3.82Å; Y254-R278 HydrophobicContact CE1-CG 4.13Å
255	L	98.9	Very high	97.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.			trans	-137.5	11.7	-174.1	-74.1	167	0	0	0	111.3	L234 L239 V242 L253 N258 I260 R278 M279 N282	L234-L255 HydrophobicContact CB-CD2 3.77Å; L234-L255 HydrophobicContact CD1-CD2 3.84Å; L234-L255 HydrophobicContact CG-CD2 4.42Å; L239-L255 HydrophobicContact CD1-CD2 3.69Å; V242-L255 HydrophobicContact CG1-CD1 4.36Å; L253-L255 HydrophobicContact CD1-CD1 4.1Å; L253-L255 HydrophobicContact CD1-CG 4.09Å; L253-L255 HydrophobicContact CD2-CD1 3.78Å; L253-L255 HydrophobicContact CG-CD1 3.83Å; L253-L255 HydrophobicContact CG-CG 4.11Å; L255-N258 PolarHBondContact O-ND2 3.43Å; L255-I260 HydrophobicContact CB-CD1 4.1Å; L255-I260 HydrophobicContact CD1-CD1 4.27Å; L255-I260 HydrophobicContact CD2-CD1 4.05Å; L255-I260 HydrophobicContact CG-CD1 4.4Å; L255-R278 CarbonylContact C-O 3.5Å; L255-R278 WeakPolarHBondContact CA-O 3.23Å; L255-R278 WeakPolarHBondContact CB-O 3.22Å; L255-R278 PolarHBondContact N-O 3.04Å; L255-M279 HydrophobicContact CB-CG 4.19Å; L255-M279 HydrophobicContact CD1-CE 4.01Å; L255-M279 HydrophobicContact CD1-CG 4.46Å; L255-M279 HydrophobicContact CD1-SD 4.5Å; L255-N282 PolarHBondContact O-ND2 2.82Å
256	E	98.8	Very high	97.5	Very high	21 Å²	21	42.2 Å²	42.2	10%	0.098	21%	0.213	C	C	.	.			trans	-60.4	154.7	177.6	64.4	-86	-156.8	0	0	112	S235 Y236 Y254 N258 R278 S280	S235-E256 CarbonylContact C-O 3.43Å; S235-E256 VanDerWaalsContact CA-O 3.23Å; S235-E256 WeakPolarHBondContact CA-O 3.46Å; S235-E256 VanDerWaalsContact CB-CD 3.42Å; Y236-E256 PolarHBondContact N-O 3.2Å; Y254-E256 WeakPolarHBondContact CA-OE2 3.12Å; Y254-E256 WeakPolarHBondContact CB-OE2 3.29Å; E256-N258 PolarHBondContact O-ND2 3.26Å; E256-R278 PolarHBondContact N-O 3.33Å; E256-R278 VanDerWaalsContact OE2-CB 3.23Å; E256-R278 WeakPolarHBondContact OE2-CB 3.41Å; E256-S280 CarbonylContact C-O 3.19Å; E256-S280 WeakPolarHBondContact CA-O 3.47Å; E256-S280 WeakPolarHBondContact CB-O 3.15Å; E256-S280 WeakPolarHBondContact CB-OG 3.49Å
257	Y	98.8	Very high	97.5	Very high	92 Å²	92	42.5 Å²	42.5	36%	0.361	21%	0.214	S	C	.	.	S	Bend	trans	54.5	58.2	-178.5	-65.8	-91.2	0	0	0	112.6	Y236 N237 S280 H281	Y236-Y257 VanDerWaalsContact CA-O 3.31Å; Y236-Y257 WeakPolarHBondContact CA-O 3.39Å; Y236-Y257 HydrophobicContact CD1-CD1 4.2Å; Y236-Y257 HydrophobicContact CD1-CD2 4.09Å; Y236-Y257 AromaticContact CD1-CG 3.7Å; Y236-Y257 HydrophobicContact CD1-CG 3.7Å; Y236-Y257 HydrophobicContact CD2-CD2 4.37Å; Y236-Y257 AromaticContact CE1-CD1 3.74Å; Y236-Y257 HydrophobicContact CE1-CD1 3.74Å; Y236-Y257 AromaticContact CE1-CD2 3.45Å; Y236-Y257 HydrophobicContact CE1-CD2 3.45Å; Y236-Y257 VanDerWaalsContact CE1-CD2 3.45Å; Y236-Y257 HydrophobicContact CE1-CE1 4.09Å; Y236-Y257 AromaticContact CE1-CE2 3.86Å; Y236-Y257 HydrophobicContact CE1-CE2 3.86Å; Y236-Y257 AromaticContact CE1-CG 3.38Å; Y236-Y257 HydrophobicContact CE1-CG 3.38Å; Y236-Y257 AromaticContact CE2-CD2 3.78Å; Y236-Y257 HydrophobicContact CE2-CD2 3.78Å; Y236-Y257 HydrophobicContact CE2-CE2 4.29Å; Y236-Y257 HydrophobicContact CE2-CG 4.37Å; Y236-Y257 HydrophobicContact CG-CG 4.33Å; Y236-Y257 AromaticContact CZ-CD2 3.27Å; Y236-Y257 AromaticContact CZ-CE2 3.51Å; Y236-Y257 AromaticContact CZ-CG 3.76Å; Y236-Y257 PolarHBondContact N-O 3.13Å; Y236-Y257 WeakPolarHBondContact OH-CD2 3.38Å; Y236-Y257 WeakPolarHBondContact OH-CE2 3.37Å; N237-Y257 PolarHBondContact N-O 3.33Å; N237-Y257 VanDerWaalsContact N-O 3.13Å; Y257-S280 PolarHBondContact N-O 2.92Å; Y257-H281 WeakPolarHBondContact CA-O 3.43Å; Y257-H281 HydrophobicContact CD1-CB 3.68Å; Y257-H281 AromaticContact CD1-CG 3.92Å; Y257-H281 HydrophobicContact CD2-CB 4.13Å; Y257-H281 HydrophobicContact CE1-CB 3.86Å; Y257-H281 AromaticContact CE1-CD2 3.81Å; Y257-H281 AromaticContact CE1-CG 3.53Å; Y257-H281 AromaticContact CE1-ND1 3.74Å; Y257-H281 HydrophobicContact CE2-CB 4.27Å; Y257-H281 AromaticContact CE2-CD2 3.56Å; Y257-H281 AromaticContact CE2-CG 3.98Å; Y257-H281 HydrophobicContact CG-CB 3.85Å; Y257-H281 AromaticContact CZ-CD2 3.32Å; Y257-H281 AromaticContact CZ-CG 3.57Å; Y257-H281 AromaticContact CZ-ND1 3.99Å; Y257-H281 AromaticContact CZ-NE2 3.63Å; Y257-H281 PolarHBondContact N-O 3.04Å; Y257-H281 PolarHBondContact OH-CD2 3.37Å; Y257-H281 PolarHBondContact OH-NE2 2.87Å
258	N	98.9	Very high	97.4	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.032	21%	0.213	C	C	.	.	S	Bend	trans	-132	-171.7	173.3	-84.7	-81.8	0	0	0	109.8	L234 N237 H238 L239 L255 E256 I260 H281 N282	L234-N258 PolarHBondContact O-ND2 3.12Å; N237-N258 WeakPolarHBondContact CA-OD1 3.37Å; N237-N258 WeakPolarHBondContact CB-OD1 3.44Å; N237-N258 PolarHBondContact O-OD1 3Å; H238-N258 PolarHBondContact N-OD1 3.11Å; L239-N258 HydrophobicContact CB-CB 4.22Å; L239-N258 VanDerWaalsContact CB-OD1 3.22Å; L239-N258 WeakPolarHBondContact CB-OD1 3.42Å; L239-N258 WeakPolarHBondContact CG-OD1 3.29Å; L239-N258 PolarHBondContact N-OD1 2.94Å; L255-N258 PolarHBondContact O-ND2 3.43Å; E256-N258 PolarHBondContact O-ND2 3.26Å; N258-I260 HydrophobicContact CB-CD1 4.28Å; N258-I260 HydrophobicContact CB-CG1 4.14Å; N258-H281 PolarHBondContact N-O 3.06Å; N258-H281 VanDerWaalsContact O-O 3.13Å; N258-N282 WeakPolarHBondContact CA-OD1 3.4Å; N258-N282 WeakPolarHBondContact CB-OD1 3.34Å; N258-N282 PolarHBondContact O-OD1 3.13Å
259	Y	98.6	Very high	97.3	Very high	125 Å²	125	43 Å²	43	49%	0.49	21%	0.208	S	C	.	.			trans	-114.8	28.6	178.6	-55.1	-72.4	0	0	0	112.3	H238 L239 N261 N282	H238-Y259 HydrophobicContact CB-CD2 4.17Å; H238-Y259 HydrophobicContact CB-CE2 4.03Å; H238-Y259 AromaticContact CD2-CE2 3.56Å; L239-Y259 CarbonylContact O-C 3.08Å; L239-Y259 VanDerWaalsContact O-CA 3.25Å; L239-Y259 WeakPolarHBondContact O-CA 3.4Å; L239-Y259 PolarHBondContact O-N 3.39Å; Y259-N261 PolarHBondContact O-N 2.83Å; Y259-N282 PolarHBondContact N-OD1 2.75Å
260	I	98.6	Very high	97.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.			trans	-68.6	126.7	-176.7	-57.8	168.1	0	0	0	108.6	L239 V242 L255 N258 S262 M279 N282 S283 L284	L239-I260 HydrophobicContact CB-CD1 4.46Å; L239-I260 HydrophobicContact CB-CG1 4.17Å; L239-I260 PolarHBondContact O-N 2.65Å; L239-I260 VanDerWaalsContact O-N 3.13Å; V242-I260 HydrophobicContact CG1-CD1 4.15Å; V242-I260 HydrophobicContact CG1-CG2 4.01Å; L255-I260 HydrophobicContact CB-CD1 4.1Å; L255-I260 HydrophobicContact CD1-CD1 4.27Å; L255-I260 HydrophobicContact CD2-CD1 4.05Å; L255-I260 HydrophobicContact CG-CD1 4.4Å; N258-I260 HydrophobicContact CB-CD1 4.28Å; N258-I260 HydrophobicContact CB-CG1 4.14Å; I260-S262 WeakPolarHBondContact CG2-O 3.15Å; I260-M279 HydrophobicContact CD1-CE 3.94Å; I260-M279 HydrophobicContact CG2-CE 4.18Å; I260-N282 HydrophobicContact CB-CB 4.48Å; I260-N282 VanDerWaalsContact CB-OD1 3.24Å; I260-N282 WeakPolarHBondContact CB-OD1 3.45Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.41Å; I260-N282 PolarHBondContact N-OD1 2.97Å; I260-S283 CarbonylContact O-C 3.54Å; I260-S283 VanDerWaalsContact O-CA 3.32Å; I260-S283 WeakPolarHBondContact O-CA 3.24Å; I260-S283 PolarHBondContact O-N 2.89Å; I260-L284 HydrophobicContact CG2-CD2 3.92Å; I260-L284 PolarHBondContact O-N 3.4Å
261	N	97.4	Very high	97	Very high	77 Å²	77	45.8 Å²	45.8	41%	0.412	22%	0.223	S	C	.	.			trans	-117.3	-11	-177.2	63.4	23.7	0	0	0	114	Y259 S283	Y259-N261 PolarHBondContact O-N 2.83Å; N261-S283 WeakPolarHBondContact CA-O 3.36Å
262	S	97	Very high	96.9	Very high	45 Å²	45	47 Å²	47	32%	0.315	24%	0.236	S	C	.	.			trans	-152.6	151	-177.1	51.5	0	0	0	0	111.1	I260 G288	I260-S262 WeakPolarHBondContact CG2-O 3.15Å; S262-G288 CarbonylContact C-O 3.57Å; S262-G288 WeakPolarHBondContact CA-O 3.45Å; S262-G288 WeakPolarHBondContact CB-O 3.47Å
263	I	97.6	Very high	96.9	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.041	25%	0.249	C	C	.	.			trans	-133.1	132.6	176.3	-53.9	176.1	0	0	0	107.5	V242 Y267 F268 M279 L284 G288 L289 T293 F294	V242-I263 HydrophobicContact CG1-CG1 4.13Å; V242-I263 HydrophobicContact CG2-CG2 4.47Å; I263-Y267 HydrophobicContact CG2-CD1 3.86Å; I263-Y267 HydrophobicContact CG2-CG 3.83Å; I263-F268 HydrophobicContact CG2-CE2 4.5Å; I263-M279 HydrophobicContact CD1-CE 3.57Å; I263-M279 HydrophobicContact CD1-SD 3.64Å; I263-M279 HydrophobicContact CG1-CE 4.18Å; I263-L284 HydrophobicContact CD1-CD1 4.3Å; I263-L284 HydrophobicContact CD1-CD2 4.04Å; I263-L284 HydrophobicContact CG1-CD2 3.93Å; I263-G288 PolarHBondContact N-O 3.04Å; I263-L289 HydrophobicContact CB-CD2 4Å; I263-L289 HydrophobicContact CD1-CD2 3.83Å; I263-L289 HydrophobicContact CG1-CD2 3.94Å; I263-T293 HydrophobicContact CB-CG2 3.76Å; I263-T293 HydrophobicContact CD1-CG2 4.12Å; I263-T293 HydrophobicContact CG2-CG2 3.57Å; I263-F294 HydrophobicContact CD1-CE1 4.01Å; I263-F294 HydrophobicContact CD1-CE2 4.47Å; I263-F294 HydrophobicContact CD1-CZ 3.57Å
264	P	94.7	Very high	96.9	Very high	71 Å²	71	50.2 Å²	50.2	46%	0.461	25%	0.249	S	C	.	.			trans	-58.4	160.2	176.3	-24	34.4	0	0	0	113.4	V242 Y267	V242-P264 HydrophobicContact CG2-CG 4.35Å; P264-Y267 HydrophobicContact CB-CD2 4.46Å; P264-Y267 HydrophobicContact CG-CD2 4.19Å; P264-Y267 WeakPolarHBondContact O-CB 3.1Å
265	D	92.9	Very high	96.9	Very high	94 Å²	94	50.9 Å²	50.9	50%	0.503	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	145.5	174	-162.7	17.3	0	0	0	111.4	Y267 S290	D265-Y267 PolarHBondContact O-N 2.89Å; D265-S290 VanDerWaalsContact OD1-CB 3.23Å; D265-S290 WeakPolarHBondContact OD1-CB 3.2Å; D265-S290 PolarHBondContact OD1-OG 3.06Å
266	D	90.9	Very high	96.9	Very high	59 Å²	59	55 Å²	55	32%	0.316	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	22.8	179.9	-65.4	-34.3	0	0	0	115.4	F268 R269	D266-F268 VanDerWaalsContact C-N 3.34Å; D266-F268 PolarHBondContact O-N 3.37Å; D266-R269 HydrophobicContact CB-CG 4.11Å; D266-R269 WeakPolarHBondContact O-CB 3.4Å; D266-R269 PolarHBondContact O-N 3.35Å; D266-R269 IonicContact OD1-CZ 2.96Å; D266-R269 IonicContact OD1-NE 3.61Å; D266-R269 PolarHBondContact OD1-NE 3.39Å; D266-R269 IonicContact OD1-NH2 3.89Å; D266-R269 PolarHBondContact OD1-NH2 3.38Å; D266-R269 IonicContact OD2-NE 3.67Å
267	Y	96.3	Very high	96.9	Very high	15 Å²	15	54.1 Å²	54.1	6%	0.059	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-54.4	-43.8	-171.5	-178.2	-107.6	0	0	0	113.9	V242 P243 L246 I263 P264 D265 V270	V242-Y267 HydrophobicContact CB-CE1 4Å; V242-Y267 HydrophobicContact CB-CE2 4.24Å; V242-Y267 HydrophobicContact CG1-CE1 4.34Å; V242-Y267 HydrophobicContact CG2-CD1 4.45Å; V242-Y267 HydrophobicContact CG2-CD2 4.07Å; V242-Y267 HydrophobicContact CG2-CE1 4.01Å; V242-Y267 HydrophobicContact CG2-CE2 3.58Å; V242-Y267 HydrophobicContact CG2-CG 4.48Å; P243-Y267 WeakPolarHBondContact O-CE2 3.43Å; P243-Y267 PolarHBondContact O-OH 3.28Å; L246-Y267 HydrophobicContact CD1-CD1 4.18Å; L246-Y267 HydrophobicContact CD1-CE1 3.57Å; L246-Y267 HydrophobicContact CD2-CE1 4.22Å; L246-Y267 VanDerWaalsContact CD2-OH 3.28Å; L246-Y267 WeakPolarHBondContact CD2-OH 3.36Å; L246-Y267 HydrophobicContact CG-CE1 3.82Å; L246-Y267 HydrophobicContact CG-CE2 4.44Å; L246-Y267 WeakPolarHBondContact CG-OH 3.41Å; I263-Y267 HydrophobicContact CG2-CD1 3.86Å; I263-Y267 HydrophobicContact CG2-CG 3.83Å; P264-Y267 HydrophobicContact CB-CD2 4.46Å; P264-Y267 HydrophobicContact CG-CD2 4.19Å; P264-Y267 WeakPolarHBondContact O-CB 3.1Å; D265-Y267 PolarHBondContact O-N 2.89Å; Y267-V270 WeakPolarHBondContact O-CG2 3.33Å
268	F	97.1	Very high	96.9	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-82.4	-9.8	-177.8	-59.5	-65.6	0	0	0	114.1	L246 L253 I263 D266 V270 S271 L274 V277 M279 T293 F294 I299	L246-F268 HydrophobicContact CD1-CD1 3.91Å; L246-F268 HydrophobicContact CD1-CE1 4.27Å; L253-F268 HydrophobicContact CD2-CE1 4.1Å; I263-F268 HydrophobicContact CG2-CE2 4.5Å; D266-F268 VanDerWaalsContact C-N 3.34Å; D266-F268 PolarHBondContact O-N 3.37Å; F268-V270 PolarHBondContact O-N 3.27Å; F268-S271 PolarHBondContact O-N 3.31Å; F268-L274 HydrophobicContact CB-CD2 4.21Å; F268-L274 HydrophobicContact CD1-CD2 3.36Å; F268-L274 HydrophobicContact CE1-CD2 4.06Å; F268-L274 HydrophobicContact CG-CD2 4.09Å; F268-V277 HydrophobicContact CE1-CG1 4.19Å; F268-V277 HydrophobicContact CE1-CG2 4.42Å; F268-V277 HydrophobicContact CZ-CG1 4.1Å; F268-M279 HydrophobicContact CZ-SD 4.03Å; F268-T293 VanDerWaalsContact CD2-O 3.28Å; F268-T293 WeakPolarHBondContact CD2-O 3.22Å; F268-T293 HydrophobicContact CE2-CG2 4.27Å; F268-F294 HydrophobicContact CD2-CD1 4.14Å; F268-F294 HydrophobicContact CD2-CE1 4.49Å; F268-F294 AromaticContact CE2-CD1 3.59Å; F268-F294 HydrophobicContact CE2-CD1 3.59Å; F268-F294 AromaticContact CE2-CE1 3.53Å; F268-F294 HydrophobicContact CE2-CE1 3.53Å; F268-F294 HydrophobicContact CZ-CE1 4.14Å; F268-I299 HydrophobicContact CB-CD1 4.25Å; F268-I299 HydrophobicContact CD2-CD1 4.38Å; F268-I299 HydrophobicContact CG-CD1 4.25Å
269	R	93.9	Very high	96.9	Very high	125 Å²	125	54 Å²	54	47%	0.472	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66	-25.1	-179.8	-66.9	-164.3	-158.5	-110.3	4.4	113.1	D266 S271	D266-R269 HydrophobicContact CB-CG 4.11Å; D266-R269 WeakPolarHBondContact O-CB 3.4Å; D266-R269 PolarHBondContact O-N 3.35Å; D266-R269 IonicContact OD1-CZ 2.96Å; D266-R269 IonicContact OD1-NE 3.61Å; D266-R269 PolarHBondContact OD1-NE 3.39Å; D266-R269 IonicContact OD1-NH2 3.89Å; D266-R269 PolarHBondContact OD1-NH2 3.38Å; D266-R269 IonicContact OD2-NE 3.67Å; R269-S271 PolarHBondContact O-N 2.91Å
270	V	94.6	Very high	96.9	Very high	75 Å²	75	48.4 Å²	48.4	46%	0.455	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-69.2	-18.7	179.6	-53.8	0	0	0	0	112.7	L246 Y267 F268 P272	L246-V270 HydrophobicContact CB-CG2 4.02Å; Y267-V270 WeakPolarHBondContact O-CG2 3.33Å; F268-V270 PolarHBondContact O-N 3.27Å; V270-P272 VanDerWaalsContact O-CD 3.23Å; V270-P272 WeakPolarHBondContact O-CD 3.25Å
271	S	97.4	Very high	96.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.			trans	-114.6	79	179.9	-61.8	0	0	0	0	109.7	L246 P247 F268 R269 K273 L274	L246-S271 WeakPolarHBondContact CB-OG 3.24Å; P247-S271 PolarHBondContact O-OG 3.37Å; F268-S271 PolarHBondContact O-N 3.31Å; R269-S271 PolarHBondContact O-N 2.91Å; S271-K273 PolarHBondContact O-N 3.48Å; S271-L274 VanDerWaalsContact O-CB 3.32Å; S271-L274 WeakPolarHBondContact O-CB 3.42Å; S271-L274 PolarHBondContact O-N 2.88Å; S271-L274 VanDerWaalsContact O-N 3.07Å
272	P	96.8	Very high	97	Very high	89 Å²	89	48 Å²	48	58%	0.578	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-6.2	-173	29.9	-38	0	0	0	114.1	V270 S298	V270-P272 VanDerWaalsContact O-CD 3.23Å; V270-P272 WeakPolarHBondContact O-CD 3.25Å; P272-S298 WeakPolarHBondContact O-CB 3.08Å
273	K	98.2	Very high	97	Very high	118 Å²	118	47 Å²	47	51%	0.513	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	1.8	176.9	-61.6	-171	178.4	-174.9	0	113.3	L250 E251 S271 L275	L250-K273 CarbonylContact O-C 3.17Å; L250-K273 VanDerWaalsContact O-C 3.23Å; E251-K273 HydrophobicContact CG-CB 4.21Å; S271-K273 PolarHBondContact O-N 3.48Å; K273-L275 WeakPolarHBondContact O-CG 2.99Å; K273-L275 PolarHBondContact O-N 3.26Å
274	L	98.7	Very high	97.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.			trans	-69	119.5	-174.1	-170	66.4	0	0	0	110.5	L246 L250 L253 F268 S271 V277 S298 I299	L246-L274 HydrophobicContact CD1-CD2 4.47Å; L250-L274 HydrophobicContact CB-CD1 4.4Å; L250-L274 HydrophobicContact CD2-CD1 4.06Å; L250-L274 HydrophobicContact CG-CD1 4.05Å; L250-L274 VanDerWaalsContact O-CA 3.23Å; L250-L274 WeakPolarHBondContact O-CA 3.26Å; L250-L274 PolarHBondContact O-N 3.22Å; L250-L274 VanDerWaalsContact O-N 3.12Å; L253-L274 HydrophobicContact CB-CD1 4.04Å; F268-L274 HydrophobicContact CB-CD2 4.21Å; F268-L274 HydrophobicContact CD1-CD2 3.36Å; F268-L274 HydrophobicContact CE1-CD2 4.06Å; F268-L274 HydrophobicContact CG-CD2 4.09Å; S271-L274 VanDerWaalsContact O-CB 3.32Å; S271-L274 WeakPolarHBondContact O-CB 3.42Å; S271-L274 PolarHBondContact O-N 2.88Å; S271-L274 VanDerWaalsContact O-N 3.07Å; L274-V277 HydrophobicContact CD1-CG2 4.24Å; L274-V277 HydrophobicContact CD2-CG2 3.48Å; L274-V277 VanDerWaalsContact CD2-CG2 3.48Å; L274-V277 HydrophobicContact CG-CG2 3.72Å; L274-S298 CarbonylContact O-C 3.17Å; L274-S298 VanDerWaalsContact O-CB 3.23Å; L274-S298 WeakPolarHBondContact O-CB 3.36Å; L274-S298 PolarHBondContact O-OG 3.38Å; L274-I299 HydrophobicContact CD2-CD1 4.49Å; L274-I299 WeakPolarHBondContact O-CA 3.37Å; L274-I299 PolarHBondContact O-N 2.94Å
275	L	98.8	Very high	97.2	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.246	22%	0.222	C	C	.	.			trans	-106.7	-45.3	-174.7	-60.2	179.5	0	0	0	112	E251 K273 S298 L300 E301	E251-L275 PolarHBondContact O-N 3.02Å; K273-L275 WeakPolarHBondContact O-CG 2.99Å; K273-L275 PolarHBondContact O-N 3.26Å; L275-S298 WeakPolarHBondContact CD2-O 3.5Å; L275-L300 HydrophobicContact CD2-CD1 4.05Å; L275-L300 HydrophobicContact CD2-CG 4.18Å; L275-L300 PolarHBondContact O-N 2.86Å; L275-E301 PolarHBondContact O-N 3.02Å; L275-E301 VanDerWaalsContact O-N 3.14Å
276	Y	98.9	Very high	97.4	Very high	88 Å²	88	43.2 Å²	43.2	35%	0.345	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.6	-171.3	-53.2	-85	0	0	0	110.4	E251 Q252 L253 E301	E251-Y276 PolarHBondContact O-N 2.94Å; Q252-Y276 HydrophobicContact CG-CD2 3.74Å; Q252-Y276 HydrophobicContact CG-CG 4.4Å; L253-Y276 PolarHBondContact N-O 2.82Å; Y276-E301 HydrophobicContact CD1-CB 3.78Å; Y276-E301 HydrophobicContact CE1-CB 4.3Å
277	V	98.9	Very high	97.7	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	117.8	178.7	-179.1	0	0	0	0	109.6	L253 F268 L274 M279 I299 E301 L302 D303	L253-V277 WeakPolarHBondContact O-CA 3.22Å; F268-V277 HydrophobicContact CE1-CG1 4.19Å; F268-V277 HydrophobicContact CE1-CG2 4.42Å; F268-V277 HydrophobicContact CZ-CG1 4.1Å; L274-V277 HydrophobicContact CD1-CG2 4.24Å; L274-V277 HydrophobicContact CD2-CG2 3.48Å; L274-V277 VanDerWaalsContact CD2-CG2 3.48Å; L274-V277 HydrophobicContact CG-CG2 3.72Å; V277-M279 HydrophobicContact CG1-CG 3.83Å; V277-M279 HydrophobicContact CG1-SD 4.12Å; V277-I299 HydrophobicContact CG2-CD1 4.08Å; V277-I299 HydrophobicContact CG2-CG1 4.39Å; V277-E301 PolarHBondContact N-O 3.09Å; V277-L302 HydrophobicContact CB-CD1 3.95Å; V277-L302 HydrophobicContact CG1-CD1 3.98Å; V277-L302 WeakPolarHBondContact O-CA 3.25Å; V277-D303 PolarHBondContact O-N 3.13Å
278	R	98.9	Very high	97.6	Very high	95 Å²	95	49.6 Å²	49.6	36%	0.358	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.5	174.1	-63	-178.4	-179.1	168.6	-1.9	109.9	L253 Y254 L255 E256 D303	L253-R278 PolarHBondContact O-N 3.13Å; Y254-R278 HydrophobicContact CD1-CB 3.97Å; Y254-R278 HydrophobicContact CD1-CG 3.82Å; Y254-R278 HydrophobicContact CE1-CG 4.13Å; L255-R278 CarbonylContact C-O 3.5Å; L255-R278 WeakPolarHBondContact CA-O 3.23Å; L255-R278 WeakPolarHBondContact CB-O 3.22Å; L255-R278 PolarHBondContact N-O 3.04Å; E256-R278 PolarHBondContact N-O 3.33Å; E256-R278 VanDerWaalsContact OE2-CB 3.23Å; E256-R278 WeakPolarHBondContact OE2-CB 3.41Å; R278-D303 HydrophobicContact CG-CB 4.33Å
279	M	98.6	Very high	97.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.			trans	-137.5	27.2	177.1	-52.6	-172.4	70.5	0	0	111.1	V242 L255 I260 I263 F268 V277 N282 L284 F294 D303 L304 N307	V242-M279 HydrophobicContact CG1-CE 3.91Å; L255-M279 HydrophobicContact CB-CG 4.19Å; L255-M279 HydrophobicContact CD1-CE 4.01Å; L255-M279 HydrophobicContact CD1-CG 4.46Å; L255-M279 HydrophobicContact CD1-SD 4.5Å; I260-M279 HydrophobicContact CD1-CE 3.94Å; I260-M279 HydrophobicContact CG2-CE 4.18Å; I263-M279 HydrophobicContact CD1-CE 3.57Å; I263-M279 HydrophobicContact CD1-SD 3.64Å; I263-M279 HydrophobicContact CG1-CE 4.18Å; F268-M279 HydrophobicContact CZ-SD 4.03Å; V277-M279 HydrophobicContact CG1-CG 3.83Å; V277-M279 HydrophobicContact CG1-SD 4.12Å; M279-N282 PolarHBondContact O-ND2 3.07Å; M279-N282 VanDerWaalsContact O-ND2 3.11Å; M279-L284 HydrophobicContact CB-CD1 4.35Å; M279-L284 HydrophobicContact CE-CD1 4.37Å; M279-F294 HydrophobicContact SD-CE1 4.3Å; M279-D303 CarbonylContact C-O 3.49Å; M279-D303 PolarHBondContact N-O 3.3Å; M279-L304 HydrophobicContact CB-CD2 4Å; M279-N307 PolarHBondContact O-ND2 3.02Å
280	S	98.8	Very high	97.7	Very high	8 Å²	8	46.4 Å²	46.4	6%	0.056	24%	0.239	C	C	.	.			trans	-64.1	160.4	175.1	47.3	0	0	0	0	112.2	E256 Y257 N282 D303 S305	E256-S280 CarbonylContact C-O 3.19Å; E256-S280 WeakPolarHBondContact CA-O 3.47Å; E256-S280 WeakPolarHBondContact CB-O 3.15Å; E256-S280 WeakPolarHBondContact CB-OG 3.49Å; Y257-S280 PolarHBondContact N-O 2.92Å; S280-N282 VanDerWaalsContact C-N 3.34Å; S280-N282 PolarHBondContact O-N 3Å; S280-N282 PolarHBondContact O-ND2 3.18Å; S280-N282 VanDerWaalsContact O-ND2 3.13Å; S280-D303 WeakPolarHBondContact CB-OD2 3.28Å; S280-D303 PolarHBondContact N-O 3.28Å; S280-D303 PolarHBondContact OG-OD2 3.38Å; S280-S305 CarbonylContact C-O 3.19Å; S280-S305 WeakPolarHBondContact CA-O 3.45Å; S280-S305 VanDerWaalsContact CB-O 3.29Å; S280-S305 WeakPolarHBondContact CB-O 3.23Å; S280-S305 WeakPolarHBondContact CB-OG 3.33Å
281	H	98.8	Very high	97.5	Very high	59 Å²	59	47.6 Å²	47.6	27%	0.273	25%	0.247	S	C	.	.	S	Bend	trans	52.5	51.2	-178.9	-64.3	-88.1	0	0	0	112.7	Y257 N258 S305 Y306	Y257-H281 WeakPolarHBondContact CA-O 3.43Å; Y257-H281 HydrophobicContact CD1-CB 3.68Å; Y257-H281 AromaticContact CD1-CG 3.92Å; Y257-H281 HydrophobicContact CD2-CB 4.13Å; Y257-H281 HydrophobicContact CE1-CB 3.86Å; Y257-H281 AromaticContact CE1-CD2 3.81Å; Y257-H281 AromaticContact CE1-CG 3.53Å; Y257-H281 AromaticContact CE1-ND1 3.74Å; Y257-H281 HydrophobicContact CE2-CB 4.27Å; Y257-H281 AromaticContact CE2-CD2 3.56Å; Y257-H281 AromaticContact CE2-CG 3.98Å; Y257-H281 HydrophobicContact CG-CB 3.85Å; Y257-H281 AromaticContact CZ-CD2 3.32Å; Y257-H281 AromaticContact CZ-CG 3.57Å; Y257-H281 AromaticContact CZ-ND1 3.99Å; Y257-H281 AromaticContact CZ-NE2 3.63Å; Y257-H281 PolarHBondContact N-O 3.04Å; Y257-H281 PolarHBondContact OH-CD2 3.37Å; Y257-H281 PolarHBondContact OH-NE2 2.87Å; N258-H281 PolarHBondContact N-O 3.06Å; N258-H281 VanDerWaalsContact O-O 3.13Å; H281-S305 PolarHBondContact N-O 3.4Å; H281-Y306 VanDerWaalsContact CA-O 3.29Å; H281-Y306 WeakPolarHBondContact CA-O 3.23Å; H281-Y306 AromaticContact CE1-CD1 3.96Å; H281-Y306 AromaticContact CE1-CD2 3.63Å; H281-Y306 AromaticContact CE1-CG 3.44Å; H281-Y306 VanDerWaalsContact CE1-CG 3.44Å; H281-Y306 PolarHBondContact N-O 2.93Å; H281-Y306 AromaticContact ND1-CG 3.98Å; H281-Y306 AromaticContact NE2-CD2 3.34Å; H281-Y306 VanDerWaalsContact NE2-CD2 3.34Å; H281-Y306 WeakPolarHBondContact NE2-CD2 3.03Å; H281-Y306 AromaticContact NE2-CE2 3.98Å; H281-Y306 AromaticContact NE2-CG 3.63Å
282	N	98.8	Very high	97.1	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.048	26%	0.258	C	S	.	.	S	Bend	trans	-119.8	-167.9	172.9	-88.6	-82.4	0	0	0	110.1	L255 N258 Y259 I260 M279 S280 L284 N307	L255-N282 PolarHBondContact O-ND2 2.82Å; N258-N282 WeakPolarHBondContact CA-OD1 3.4Å; N258-N282 WeakPolarHBondContact CB-OD1 3.34Å; N258-N282 PolarHBondContact O-OD1 3.13Å; Y259-N282 PolarHBondContact N-OD1 2.75Å; I260-N282 HydrophobicContact CB-CB 4.48Å; I260-N282 VanDerWaalsContact CB-OD1 3.24Å; I260-N282 WeakPolarHBondContact CB-OD1 3.45Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.41Å; I260-N282 PolarHBondContact N-OD1 2.97Å; M279-N282 PolarHBondContact O-ND2 3.07Å; M279-N282 VanDerWaalsContact O-ND2 3.11Å; S280-N282 VanDerWaalsContact C-N 3.34Å; S280-N282 PolarHBondContact O-N 3Å; S280-N282 PolarHBondContact O-ND2 3.18Å; S280-N282 VanDerWaalsContact O-ND2 3.13Å; N282-L284 HydrophobicContact CB-CG 4.32Å; N282-N307 WeakPolarHBondContact CA-OD1 3.4Å; N282-N307 WeakPolarHBondContact CB-OD1 3.46Å; N282-N307 PolarHBondContact O-OD1 2.89Å
283	S	98.4	Very high	97.1	Very high	24 Å²	24	45.7 Å²	45.7	17%	0.168	23%	0.232	C	C	.	.			trans	-115.8	29	179.1	-65	0	0	0	0	112.2	I260 N261 N307	I260-S283 CarbonylContact O-C 3.54Å; I260-S283 VanDerWaalsContact O-CA 3.32Å; I260-S283 WeakPolarHBondContact O-CA 3.24Å; I260-S283 PolarHBondContact O-N 2.89Å; N261-S283 WeakPolarHBondContact CA-O 3.36Å; S283-N307 PolarHBondContact N-OD1 3.17Å
284	L	98.4	Very high	97	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.			trans	-65.7	138	-177.3	-62.6	173.2	0	0	0	111.1	I260 I263 M279 N282 L289 L304 N307 R308 L309	I260-L284 HydrophobicContact CG2-CD2 3.92Å; I260-L284 PolarHBondContact O-N 3.4Å; I263-L284 HydrophobicContact CD1-CD1 4.3Å; I263-L284 HydrophobicContact CD1-CD2 4.04Å; I263-L284 HydrophobicContact CG1-CD2 3.93Å; M279-L284 HydrophobicContact CB-CD1 4.35Å; M279-L284 HydrophobicContact CE-CD1 4.37Å; N282-L284 HydrophobicContact CB-CG 4.32Å; L284-L289 HydrophobicContact CD2-CD2 4.35Å; L284-L304 HydrophobicContact CD1-CD2 3.96Å; L284-N307 HydrophobicContact CB-CB 4.18Å; L284-N307 VanDerWaalsContact CB-OD1 3.26Å; L284-N307 WeakPolarHBondContact CB-OD1 3.35Å; L284-N307 WeakPolarHBondContact CG-OD1 3.41Å; L284-N307 PolarHBondContact N-OD1 3.16Å; L284-R308 CarbonylContact O-C 3.38Å; L284-R308 VanDerWaalsContact O-CA 3.27Å; L284-R308 WeakPolarHBondContact O-CA 3.38Å; L284-R308 WeakPolarHBondContact O-CB 3.32Å; L284-R308 PolarHBondContact O-N 3.09Å; L284-L309 HydrophobicContact CB-CD2 4.25Å
285	T	97.9	Very high	96.8	Very high	44 Å²	44	41.9 Å²	41.9	27%	0.27	22%	0.217	S	C	.	.			trans	-130.7	158.2	173.9	64.1	0	0	0	0	109	Q287 G288 L289 R308	T285-Q287 PolarHBondContact O-N 2.89Å; T285-G288 PolarHBondContact O-N 3.25Å; T285-G288 PolarHBondContact OG1-N 3.01Å; T285-L289 WeakPolarHBondContact O-CG 3.23Å; T285-R308 HydrophobicContact CG2-CB 3.94Å
286	N	96.6	Very high	96.7	Very high	50 Å²	50	40 Å²	40	27%	0.267	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-61.1	-25.3	176.6	-62.4	88.4	0	0	0	113.5	G288 L289 Q310 K311	N286-G288 VanDerWaalsContact C-N 3.33Å; N286-L289 PolarHBondContact O-N 2.93Å; N286-L289 VanDerWaalsContact O-O 3.13Å; N286-Q310 WeakPolarHBondContact OD1-CA 3.32Å; N286-Q310 PolarHBondContact OD1-N 2.83Å; N286-K311 PolarHBondContact ND2-O 3.34Å; N286-K311 PolarHBondContact OD1-N 3.31Å
287	Q	96.2	Very high	96.5	Very high	192 Å²	192	39.8 Å²	39.8	90%	0.897	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-71.9	-28	175.4	-67.2	-178.3	-7.5	0	0	112.6	T285 L289	T285-Q287 PolarHBondContact O-N 2.89Å; Q287-L289 VanDerWaalsContact C-N 3.26Å
288	G	95.8	Very high	96.5	Very high	16 Å²	16	40.5 Å²	40.5	17%	0.165	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-83.7	1.9	176.2	0	0	0	0	0	113.9	S262 I263 T285 N286	S262-G288 CarbonylContact C-O 3.57Å; S262-G288 WeakPolarHBondContact CA-O 3.45Å; S262-G288 WeakPolarHBondContact CB-O 3.47Å; I263-G288 PolarHBondContact N-O 3.04Å; T285-G288 PolarHBondContact O-N 3.25Å; T285-G288 PolarHBondContact OG1-N 3.01Å; N286-G288 VanDerWaalsContact C-N 3.33Å
289	L	96.9	Very high	96.4	Very high	23 Å²	23	36.1 Å²	36.1	12%	0.12	21%	0.207	C	C	.	.	S	Bend	trans	-121.5	140.7	-176.5	-60.8	173.1	0	0	0	110	I263 L284 T285 N286 Q287 T293 F294 L309	I263-L289 HydrophobicContact CB-CD2 4Å; I263-L289 HydrophobicContact CD1-CD2 3.83Å; I263-L289 HydrophobicContact CG1-CD2 3.94Å; L284-L289 HydrophobicContact CD2-CD2 4.35Å; T285-L289 WeakPolarHBondContact O-CG 3.23Å; N286-L289 PolarHBondContact O-N 2.93Å; N286-L289 VanDerWaalsContact O-O 3.13Å; Q287-L289 VanDerWaalsContact C-N 3.26Å; L289-T293 HydrophobicContact CD2-CG2 4.04Å; L289-F294 HydrophobicContact CD1-CE2 3.8Å; L289-F294 HydrophobicContact CD2-CE2 3.78Å; L289-F294 HydrophobicContact CD2-CZ 4.15Å; L289-F294 HydrophobicContact CG-CE2 4.4Å; L289-L309 HydrophobicContact CD1-CD2 3.6Å
290	S	94.9	Very high	96.4	Very high	36 Å²	36	38.5 Å²	38.5	25%	0.252	22%	0.22	S	C	.	.			trans	-81.5	166.6	167.1	80.9	0	0	0	0	110.1	D265 N292 T293	D265-S290 VanDerWaalsContact OD1-CB 3.23Å; D265-S290 WeakPolarHBondContact OD1-CB 3.2Å; D265-S290 PolarHBondContact OD1-OG 3.06Å; S290-N292 PolarHBondContact O-N 3.14Å; S290-N292 PolarHBondContact OG-N 3.21Å; S290-T293 PolarHBondContact N-OG1 3.07Å; S290-T293 PolarHBondContact O-N 2.71Å; S290-T293 PolarHBondContact O-OG1 3.44Å; S290-T293 PolarHBondContact OG-N 3.12Å; S290-T293 VanDerWaalsContact OG-N 3.13Å; S290-T293 PolarHBondContact OG-OG1 3.13Å
291	T	90.3	Very high	96.4	Very high	100 Å²	100	39.8 Å²	39.8	61%	0.613	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.4	176.9	-58.3	0	0	0	0	112.6	R314	T291-R314 WeakPolarHBondContact O-CB 3.26Å
292	N	90.1	Very high	96.4	Very high	46 Å²	46	37 Å²	37	25%	0.246	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	5.2	-175	-68.5	-42.1	0	0	0	113.8	S290 F294 N295	S290-N292 PolarHBondContact O-N 3.14Å; S290-N292 PolarHBondContact OG-N 3.21Å; N292-F294 VanDerWaalsContact C-N 3.3Å; N292-F294 PolarHBondContact O-N 3.38Å; N292-N295 HydrophobicContact CB-CB 4.32Å; N292-N295 PolarHBondContact O-N 3.1Å; N292-N295 PolarHBondContact OD1-ND2 3Å
293	T	95.7	Very high	96.4	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-51.9	-177.3	-62.3	0	0	0	0	112.1	I263 F268 L289 S290	I263-T293 HydrophobicContact CB-CG2 3.76Å; I263-T293 HydrophobicContact CD1-CG2 4.12Å; I263-T293 HydrophobicContact CG2-CG2 3.57Å; F268-T293 VanDerWaalsContact CD2-O 3.28Å; F268-T293 WeakPolarHBondContact CD2-O 3.22Å; F268-T293 HydrophobicContact CE2-CG2 4.27Å; L289-T293 HydrophobicContact CD2-CG2 4.04Å; S290-T293 PolarHBondContact N-OG1 3.07Å; S290-T293 PolarHBondContact O-N 2.71Å; S290-T293 PolarHBondContact O-OG1 3.44Å; S290-T293 PolarHBondContact OG-N 3.12Å; S290-T293 VanDerWaalsContact OG-N 3.13Å; S290-T293 PolarHBondContact OG-OG1 3.13Å
294	F	96.4	Very high	96.5	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.026	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	10.7	-177.9	-59	-72.1	0	0	0	113.9	I263 F268 M279 L289 N292 S296 L302 L304 P313 V315	I263-F294 HydrophobicContact CD1-CE1 4.01Å; I263-F294 HydrophobicContact CD1-CE2 4.47Å; I263-F294 HydrophobicContact CD1-CZ 3.57Å; F268-F294 HydrophobicContact CD2-CD1 4.14Å; F268-F294 HydrophobicContact CD2-CE1 4.49Å; F268-F294 AromaticContact CE2-CD1 3.59Å; F268-F294 HydrophobicContact CE2-CD1 3.59Å; F268-F294 AromaticContact CE2-CE1 3.53Å; F268-F294 HydrophobicContact CE2-CE1 3.53Å; F268-F294 HydrophobicContact CZ-CE1 4.14Å; M279-F294 HydrophobicContact SD-CE1 4.3Å; L289-F294 HydrophobicContact CD1-CE2 3.8Å; L289-F294 HydrophobicContact CD2-CE2 3.78Å; L289-F294 HydrophobicContact CD2-CZ 4.15Å; L289-F294 HydrophobicContact CG-CE2 4.4Å; N292-F294 VanDerWaalsContact C-N 3.3Å; N292-F294 PolarHBondContact O-N 3.38Å; F294-S296 PolarHBondContact O-N 3.3Å; F294-L302 HydrophobicContact CB-CD2 3.91Å; F294-L302 HydrophobicContact CD1-CD1 3.92Å; F294-L302 HydrophobicContact CD1-CD2 3.69Å; F294-L302 HydrophobicContact CD1-CG 4.48Å; F294-L302 HydrophobicContact CE1-CD1 3.98Å; F294-L302 HydrophobicContact CE1-CD2 4.38Å; F294-L302 HydrophobicContact CG-CD2 3.86Å; F294-L304 HydrophobicContact CD2-CD1 4.16Å; F294-L304 HydrophobicContact CE1-CD1 4.28Å; F294-L304 HydrophobicContact CE1-CD2 3.93Å; F294-L304 HydrophobicContact CE2-CD1 3.78Å; F294-L304 HydrophobicContact CE2-CD2 4.37Å; F294-L304 HydrophobicContact CZ-CD1 3.85Å; F294-L304 HydrophobicContact CZ-CD2 3.63Å; F294-L304 HydrophobicContact CZ-CG 4.38Å; F294-P313 HydrophobicContact CD2-CB 3.9Å; F294-P313 HydrophobicContact CD2-CG 4.21Å; F294-P313 HydrophobicContact CE2-CB 4.42Å; F294-V315 HydrophobicContact CB-CG1 4.43Å
295	N	94.6	Very high	96.5	Very high	33 Å²	33	36.8 Å²	36.8	18%	0.176	21%	0.209	C	C	.	.			trans	-85.2	60.9	177.8	-170.7	10.8	0	0	0	110.7	N292	N292-N295 HydrophobicContact CB-CB 4.32Å; N292-N295 PolarHBondContact O-N 3.1Å; N292-N295 PolarHBondContact OD1-ND2 3Å
296	S	95.9	Very high	96.5	Very high	8 Å²	8	40.5 Å²	40.5	6%	0.056	22%	0.219	C	C	.	.			trans	-105.2	132.6	174.5	-177.3	0	0	0	0	110.4	F294 S298 S316	F294-S296 PolarHBondContact O-N 3.3Å; S296-S298 VanDerWaalsContact C-N 3.26Å; S296-S298 PolarHBondContact O-N 2.83Å; S296-S298 PolarHBondContact OG-OG 3.34Å; S296-S316 WeakPolarHBondContact O-CB 3.19Å
297	S	95.8	Very high	96.6	Very high	83 Å²	83	38.5 Å²	38.5	58%	0.58	21%	0.209	S	C	*	.	S	Bend	trans	-74.3	-13.6	-178.6	57.7	0	0	0	0	114.3	N318	S297-N318 WeakPolarHBondContact O-CB 3.27Å; S297-N318 PolarHBondContact O-ND2 2.82Å
298	S	97.7	Very high	96.7	Very high	15 Å²	15	35.7 Å²	35.7	11%	0.105	19%	0.19	C	C	.	.	S	Bend	trans	-89.4	-28.6	-175.9	65	0	0	0	0	113.4	P272 L274 L275 S296 L300	P272-S298 WeakPolarHBondContact O-CB 3.08Å; L274-S298 CarbonylContact O-C 3.17Å; L274-S298 VanDerWaalsContact O-CB 3.23Å; L274-S298 WeakPolarHBondContact O-CB 3.36Å; L274-S298 PolarHBondContact O-OG 3.38Å; L275-S298 WeakPolarHBondContact CD2-O 3.5Å; S296-S298 VanDerWaalsContact C-N 3.26Å; S296-S298 PolarHBondContact O-N 2.83Å; S296-S298 PolarHBondContact OG-OG 3.34Å; S298-L300 PolarHBondContact O-N 3.25Å
299	I	98.5	Very high	96.9	Very high	3 Å²	3	35 Å²	35	2%	0.015	18%	0.182	C	C	.	.			trans	-70.8	127.2	-171.9	-59.1	174.6	0	0	0	109.2	F268 L274 V277 E301 L302 L319	F268-I299 HydrophobicContact CB-CD1 4.25Å; F268-I299 HydrophobicContact CD2-CD1 4.38Å; F268-I299 HydrophobicContact CG-CD1 4.25Å; L274-I299 HydrophobicContact CD2-CD1 4.49Å; L274-I299 WeakPolarHBondContact O-CA 3.37Å; L274-I299 PolarHBondContact O-N 2.94Å; V277-I299 HydrophobicContact CG2-CD1 4.08Å; V277-I299 HydrophobicContact CG2-CG1 4.39Å; I299-E301 WeakPolarHBondContact CG2-O 3.35Å; I299-L302 HydrophobicContact CG2-CB 4.25Å; I299-L319 HydrophobicContact CB-CD1 4.38Å; I299-L319 HydrophobicContact CG2-CD1 3.71Å
300	L	98.6	Very high	96.9	Very high	51 Å²	51	38.7 Å²	38.7	27%	0.267	20%	0.199	S	C	.	.			trans	-101.2	-36.2	176.9	-60.8	-179.4	0	0	0	111.4	L275 S298 L319 E320 N321	L275-L300 HydrophobicContact CD2-CD1 4.05Å; L275-L300 HydrophobicContact CD2-CG 4.18Å; L275-L300 PolarHBondContact O-N 2.86Å; S298-L300 PolarHBondContact O-N 3.25Å; L300-L319 WeakPolarHBondContact O-CD1 3.4Å; L300-E320 HydrophobicContact CD2-CG 4.3Å; L300-E320 PolarHBondContact O-N 2.85Å; L300-N321 PolarHBondContact O-N 2.84Å
301	E	98.9	Very high	97	Very high	35 Å²	35	42.4 Å²	42.4	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.1	-178.9	-177.8	164.1	124.5	0	0	111.5	L275 Y276 V277 I299 N321 Y323	L275-E301 PolarHBondContact O-N 3.02Å; L275-E301 VanDerWaalsContact O-N 3.14Å; Y276-E301 HydrophobicContact CD1-CB 3.78Å; Y276-E301 HydrophobicContact CE1-CB 4.3Å; V277-E301 PolarHBondContact N-O 3.09Å; I299-E301 WeakPolarHBondContact CG2-O 3.35Å; E301-N321 HydrophobicContact CB-CB 4.25Å; E301-N321 HydrophobicContact CG-CB 3.96Å; E301-N321 PolarHBondContact OE2-ND2 2.72Å; E301-Y323 HydrophobicContact CG-CE2 3.89Å
302	L	98.9	Very high	97.3	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	114.8	-179	178.8	59	0	0	0	110.3	V277 F294 I299 L304 V315 L319 N321 L322 Y323	V277-L302 HydrophobicContact CB-CD1 3.95Å; V277-L302 HydrophobicContact CG1-CD1 3.98Å; V277-L302 WeakPolarHBondContact O-CA 3.25Å; F294-L302 HydrophobicContact CB-CD2 3.91Å; F294-L302 HydrophobicContact CD1-CD1 3.92Å; F294-L302 HydrophobicContact CD1-CD2 3.69Å; F294-L302 HydrophobicContact CD1-CG 4.48Å; F294-L302 HydrophobicContact CE1-CD1 3.98Å; F294-L302 HydrophobicContact CE1-CD2 4.38Å; F294-L302 HydrophobicContact CG-CD2 3.86Å; I299-L302 HydrophobicContact CG2-CB 4.25Å; L302-L304 HydrophobicContact CD1-CD1 4.38Å; L302-L304 HydrophobicContact CD1-CD2 4.01Å; L302-L304 HydrophobicContact CD1-CG 3.96Å; L302-L304 HydrophobicContact CD2-CD1 3.9Å; L302-L304 HydrophobicContact CD2-CG 4.29Å; L302-L304 HydrophobicContact CG-CD1 4.07Å; L302-L304 HydrophobicContact CG-CD2 4.48Å; L302-L304 HydrophobicContact CG-CG 3.89Å; L302-V315 HydrophobicContact CD2-CG1 4.31Å; L302-L319 HydrophobicContact CB-CD1 3.91Å; L302-L319 HydrophobicContact CB-CD2 4.27Å; L302-N321 PolarHBondContact N-O 3.35Å; L302-L322 HydrophobicContact CB-CD1 4.13Å; L302-L322 HydrophobicContact CD2-CD1 4Å; L302-L322 HydrophobicContact CG-CD1 4.05Å; L302-Y323 PolarHBondContact O-N 3.23Å
303	D	98.9	Very high	97.7	Very high	23 Å²	23	36.3 Å²	36.3	12%	0.123	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.7	173.2	-178.3	14.4	0	0	0	111.4	V277 R278 M279 S280 S305 Y323	V277-D303 PolarHBondContact O-N 3.13Å; R278-D303 HydrophobicContact CG-CB 4.33Å; M279-D303 CarbonylContact C-O 3.49Å; M279-D303 PolarHBondContact N-O 3.3Å; S280-D303 WeakPolarHBondContact CB-OD2 3.28Å; S280-D303 PolarHBondContact N-O 3.28Å; S280-D303 PolarHBondContact OG-OD2 3.38Å; D303-S305 VanDerWaalsContact OD1-CB 3.23Å; D303-S305 WeakPolarHBondContact OD1-CB 3.44Å; D303-S305 PolarHBondContact OD1-N 2.91Å; D303-S305 PolarHBondContact OD1-OG 3.25Å; D303-Y323 HydrophobicContact CB-CD2 4.04Å; D303-Y323 WeakPolarHBondContact OD1-CB 3.26Å
304	L	98.8	Very high	97.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.			trans	-122	18.3	176.7	-62.6	178.3	0	0	0	111.5	M279 L284 F294 L302 N307 L309 P313 Y323 L324 N327	M279-L304 HydrophobicContact CB-CD2 4Å; L284-L304 HydrophobicContact CD1-CD2 3.96Å; F294-L304 HydrophobicContact CD2-CD1 4.16Å; F294-L304 HydrophobicContact CE1-CD1 4.28Å; F294-L304 HydrophobicContact CE1-CD2 3.93Å; F294-L304 HydrophobicContact CE2-CD1 3.78Å; F294-L304 HydrophobicContact CE2-CD2 4.37Å; F294-L304 HydrophobicContact CZ-CD1 3.85Å; F294-L304 HydrophobicContact CZ-CD2 3.63Å; F294-L304 HydrophobicContact CZ-CG 4.38Å; L302-L304 HydrophobicContact CD1-CD1 4.38Å; L302-L304 HydrophobicContact CD1-CD2 4.01Å; L302-L304 HydrophobicContact CD1-CG 3.96Å; L302-L304 HydrophobicContact CD2-CD1 3.9Å; L302-L304 HydrophobicContact CD2-CG 4.29Å; L302-L304 HydrophobicContact CG-CD1 4.07Å; L302-L304 HydrophobicContact CG-CD2 4.48Å; L302-L304 HydrophobicContact CG-CG 3.89Å; L304-N307 PolarHBondContact O-ND2 3.08Å; L304-N307 VanDerWaalsContact O-ND2 3.08Å; L304-L309 HydrophobicContact CB-CD1 4.15Å; L304-L309 HydrophobicContact CD1-CD1 4.26Å; L304-P313 HydrophobicContact CD1-CG 3.84Å; L304-Y323 CarbonylContact C-O 3.42Å; L304-Y323 WeakPolarHBondContact CA-O 3.42Å; L304-Y323 PolarHBondContact N-O 3.48Å; L304-L324 HydrophobicContact CB-CD2 3.74Å; L304-L324 HydrophobicContact CD1-CD2 4.18Å; L304-N327 PolarHBondContact O-ND2 3.07Å
305	S	98.9	Very high	97.8	Very high	4 Å²	4	40 Å²	40	3%	0.028	19%	0.189	C	C	.	.			trans	-61.1	155.6	179.5	62.2	0	0	0	0	112.2	S280 H281 D303 N307 Y323 Q325	S280-S305 CarbonylContact C-O 3.19Å; S280-S305 WeakPolarHBondContact CA-O 3.45Å; S280-S305 VanDerWaalsContact CB-O 3.29Å; S280-S305 WeakPolarHBondContact CB-O 3.23Å; S280-S305 WeakPolarHBondContact CB-OG 3.33Å; H281-S305 PolarHBondContact N-O 3.4Å; D303-S305 VanDerWaalsContact OD1-CB 3.23Å; D303-S305 WeakPolarHBondContact OD1-CB 3.44Å; D303-S305 PolarHBondContact OD1-N 2.91Å; D303-S305 PolarHBondContact OD1-OG 3.25Å; S305-N307 VanDerWaalsContact C-N 3.32Å; S305-N307 PolarHBondContact O-N 2.82Å; S305-N307 PolarHBondContact O-ND2 2.91Å; S305-Y323 PolarHBondContact N-O 3.08Å; S305-Q325 CarbonylContact C-O 3.14Å; S305-Q325 VanDerWaalsContact CA-O 3.22Å; S305-Q325 WeakPolarHBondContact CA-O 3.32Å; S305-Q325 WeakPolarHBondContact CB-O 3.45Å
306	Y	98.8	Very high	97.9	Very high	122 Å²	122	39 Å²	39	48%	0.478	18%	0.184	S	C	.	.	S	Bend	trans	52.4	47	178.3	-60.8	-82.6	0	0	0	113.8	H281 Q325 G326	H281-Y306 VanDerWaalsContact CA-O 3.29Å; H281-Y306 WeakPolarHBondContact CA-O 3.23Å; H281-Y306 AromaticContact CE1-CD1 3.96Å; H281-Y306 AromaticContact CE1-CD2 3.63Å; H281-Y306 AromaticContact CE1-CG 3.44Å; H281-Y306 VanDerWaalsContact CE1-CG 3.44Å; H281-Y306 PolarHBondContact N-O 2.93Å; H281-Y306 AromaticContact ND1-CG 3.98Å; H281-Y306 AromaticContact NE2-CD2 3.34Å; H281-Y306 VanDerWaalsContact NE2-CD2 3.34Å; H281-Y306 WeakPolarHBondContact NE2-CD2 3.03Å; H281-Y306 AromaticContact NE2-CE2 3.98Å; H281-Y306 AromaticContact NE2-CG 3.63Å; Y306-Q325 HydrophobicContact CE2-CG 4.24Å; Y306-Q325 PolarHBondContact N-O 3.36Å; Y306-G326 WeakPolarHBondContact CA-O 3.48Å
307	N	98.8	Very high	97.9	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.048	20%	0.199	C	C	.	.	S	Bend	trans	-111.9	-160.8	169.9	-85.7	-81.5	0	0	0	109.9	M279 N282 S283 L284 L304 S305 L309 N327	M279-N307 PolarHBondContact O-ND2 3.02Å; N282-N307 WeakPolarHBondContact CA-OD1 3.4Å; N282-N307 WeakPolarHBondContact CB-OD1 3.46Å; N282-N307 PolarHBondContact O-OD1 2.89Å; S283-N307 PolarHBondContact N-OD1 3.17Å; L284-N307 HydrophobicContact CB-CB 4.18Å; L284-N307 VanDerWaalsContact CB-OD1 3.26Å; L284-N307 WeakPolarHBondContact CB-OD1 3.35Å; L284-N307 WeakPolarHBondContact CG-OD1 3.41Å; L284-N307 PolarHBondContact N-OD1 3.16Å; L304-N307 PolarHBondContact O-ND2 3.08Å; L304-N307 VanDerWaalsContact O-ND2 3.08Å; S305-N307 VanDerWaalsContact C-N 3.32Å; S305-N307 PolarHBondContact O-N 2.82Å; S305-N307 PolarHBondContact O-ND2 2.91Å; N307-L309 HydrophobicContact CB-CG 4.25Å; N307-N327 VanDerWaalsContact CA-OD1 3.26Å; N307-N327 WeakPolarHBondContact CA-OD1 3.24Å; N307-N327 WeakPolarHBondContact CB-OD1 3.42Å; N307-N327 PolarHBondContact N-OD1 2.95Å; N307-N327 PolarHBondContact O-OD1 2.9Å
308	R	98.3	Very high	98	Very high	133 Å²	133	39.7 Å²	39.7	50%	0.502	18%	0.183	S	C	.	.			trans	-122	37.4	179.4	-55.9	178.7	-170.6	175.4	3	111	L284 T285 N327	L284-R308 CarbonylContact O-C 3.38Å; L284-R308 VanDerWaalsContact O-CA 3.27Å; L284-R308 WeakPolarHBondContact O-CA 3.38Å; L284-R308 WeakPolarHBondContact O-CB 3.32Å; L284-R308 PolarHBondContact O-N 3.09Å; T285-R308 HydrophobicContact CG2-CB 3.94Å; R308-N327 PolarHBondContact N-OD1 3.28Å
309	L	98.4	Very high	98	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.179	C	C	.	.			trans	-75.4	131.6	179	-58.8	173.1	0	0	0	109.8	L284 L289 L304 N307 L324 N327 Q328 I329	L284-L309 HydrophobicContact CB-CD2 4.25Å; L289-L309 HydrophobicContact CD1-CD2 3.6Å; L304-L309 HydrophobicContact CB-CD1 4.15Å; L304-L309 HydrophobicContact CD1-CD1 4.26Å; N307-L309 HydrophobicContact CB-CG 4.25Å; L309-L324 HydrophobicContact CD1-CD2 3.63Å; L309-N327 HydrophobicContact CB-CB 4.24Å; L309-N327 VanDerWaalsContact CB-OD1 3.32Å; L309-N327 WeakPolarHBondContact CB-OD1 3.2Å; L309-N327 WeakPolarHBondContact CG-OD1 3.25Å; L309-N327 PolarHBondContact N-OD1 3.06Å; L309-Q328 CarbonylContact O-C 3.07Å; L309-Q328 VanDerWaalsContact O-CA 3.25Å; L309-Q328 WeakPolarHBondContact O-CA 3.24Å; L309-Q328 PolarHBondContact O-N 2.82Å; L309-I329 HydrophobicContact CB-CG1 4.37Å; L309-I329 WeakPolarHBondContact O-CG1 3.49Å; L309-I329 PolarHBondContact O-N 3.26Å; L309-I329 VanDerWaalsContact O-N 3.09Å
310	Q	97.4	Very high	98	Very high	102 Å²	102	41.7 Å²	41.7	48%	0.477	19%	0.191	S	C	.	.	S	Bend	trans	-98.6	-17.3	174.7	-65.7	175.9	14.4	0	0	112.8	N286 Q328 I329 N330	N286-Q310 WeakPolarHBondContact OD1-CA 3.32Å; N286-Q310 PolarHBondContact OD1-N 2.83Å; Q310-Q328 WeakPolarHBondContact CA-O 3.32Å; Q310-Q328 HydrophobicContact CG-CB 4.23Å; Q310-I329 WeakPolarHBondContact O-CA 3.28Å; Q310-N330 PolarHBondContact O-N 3.41Å; Q310-N330 PolarHBondContact O-OD1 2.99Å
311	K	97.4	Very high	98	Very high	113 Å²	113	40.8 Å²	40.8	49%	0.491	19%	0.186	S	C	.	.	B	Isolated β-bridge	trans	-136.9	148.9	177.1	-56.1	-174	178.3	-165.6	0	110.4	N286 P313	N286-K311 PolarHBondContact ND2-O 3.34Å; N286-K311 PolarHBondContact OD1-N 3.31Å; K311-P313 WeakPolarHBondContact O-CD 3.12Å
312	I	97.6	Very high	98	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.031	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-61.9	118.6	172.4	-56.3	174.7	0	0	0	108.6	L324 I329 F332 S336 F337 L354	I312-L324 HydrophobicContact CG1-CD1 4.41Å; I312-L324 HydrophobicContact CG2-CD1 3.93Å; I312-I329 HydrophobicContact CG1-CD1 4.19Å; I312-I329 HydrophobicContact CG1-CG2 4.04Å; I312-F332 HydrophobicContact CD1-CD2 3.96Å; I312-F332 HydrophobicContact CD1-CE2 4.25Å; I312-F332 HydrophobicContact CD1-CG 4.39Å; I312-S336 PolarHBondContact O-OG 3.33Å; I312-F337 HydrophobicContact CD1-CE2 4.11Å; I312-F337 HydrophobicContact CD1-CZ 4.14Å; I312-F337 HydrophobicContact CG2-CE1 4.29Å; I312-F337 HydrophobicContact CG2-CE2 4.23Å; I312-F337 HydrophobicContact CG2-CZ 3.77Å; I312-L354 HydrophobicContact CD1-CD1 4.15Å; I312-L354 HydrophobicContact CD1-CD2 4.21Å; I312-L354 HydrophobicContact CG1-CD2 4.19Å
313	P	97.3	Very high	98	Very high	12 Å²	12	41.9 Å²	41.9	8%	0.078	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-66.2	151.3	177.3	28.4	-33.6	0	0	0	110.6	F294 L304 K311 V315	F294-P313 HydrophobicContact CD2-CB 3.9Å; F294-P313 HydrophobicContact CD2-CG 4.21Å; F294-P313 HydrophobicContact CE2-CB 4.42Å; L304-P313 HydrophobicContact CD1-CG 3.84Å; K311-P313 WeakPolarHBondContact O-CD 3.12Å; P313-V315 PolarHBondContact O-N 2.91Å
314	R	96.5	Very high	98	Very high	83 Å²	83	40.8 Å²	40.8	31%	0.313	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-70.1	131.3	176.2	-178.2	178.2	176.8	176.3	-3.9	110	T291 S336 T339	T291-R314 WeakPolarHBondContact O-CB 3.26Å; R314-S336 WeakPolarHBondContact CA-O 3.13Å; R314-T339 VanDerWaalsContact CZ-CG2 3.44Å
315	V	97.3	Very high	98	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.03	19%	0.189	C	C	.	.			trans	-120.5	164.2	-179.8	-64.2	0	0	0	0	111	F294 L302 P313 L319 L322 S336 F337	F294-V315 HydrophobicContact CB-CG1 4.43Å; L302-V315 HydrophobicContact CD2-CG1 4.31Å; P313-V315 PolarHBondContact O-N 2.91Å; V315-L319 HydrophobicContact CB-CD2 3.89Å; V315-L319 HydrophobicContact CG1-CD2 3.84Å; V315-L319 HydrophobicContact CG2-CD2 4.13Å; V315-L322 HydrophobicContact CG1-CD2 4.29Å; V315-S336 PolarHBondContact N-O 3.21Å; V315-F337 HydrophobicContact CG2-CD1 3.85Å; V315-F337 HydrophobicContact CG2-CE1 4.41Å
316	S	96.8	Very high	98	Very high	11 Å²	11	43.1 Å²	43.1	8%	0.077	20%	0.2	C	C	.	.			trans	-71.8	150.7	170.7	-173.9	0	0	0	0	110.9	S296 N318 L319	S296-S316 WeakPolarHBondContact O-CB 3.19Å; S316-N318 PolarHBondContact O-N 2.99Å; S316-N318 PolarHBondContact OG-N 3.45Å; S316-L319 PolarHBondContact O-N 3.21Å
317	T	97.1	Very high	98	Very high	59 Å²	59	37.7 Å²	37.7	36%	0.362	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.7	172.3	50.2	0	0	0	0	113.3	R348	T317-R348 VanDerWaalsContact O-CB 3.28Å; T317-R348 WeakPolarHBondContact O-CB 3.28Å; T317-R348 WeakPolarHBondContact O-CG 3.16Å; T317-R348 PolarHBondContact O-N 3Å
318	N	97.4	Very high	97.9	Very high	46 Å²	46	41 Å²	41	25%	0.246	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-16	176.7	-74.6	-14.7	0	0	0	114.3	S297 S316	S297-N318 WeakPolarHBondContact O-CB 3.27Å; S297-N318 PolarHBondContact O-ND2 2.82Å; S316-N318 PolarHBondContact O-N 2.99Å; S316-N318 PolarHBondContact OG-N 3.45Å
319	L	98.4	Very high	97.9	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	17%	0.171	C	C	.	.			trans	-62.1	136.5	-177.4	-171.3	71.2	0	0	0	110.6	I299 L300 L302 V315 S316 L322 R348 L349	I299-L319 HydrophobicContact CB-CD1 4.38Å; I299-L319 HydrophobicContact CG2-CD1 3.71Å; L300-L319 WeakPolarHBondContact O-CD1 3.4Å; L302-L319 HydrophobicContact CB-CD1 3.91Å; L302-L319 HydrophobicContact CB-CD2 4.27Å; V315-L319 HydrophobicContact CB-CD2 3.89Å; V315-L319 HydrophobicContact CG1-CD2 3.84Å; V315-L319 HydrophobicContact CG2-CD2 4.13Å; S316-L319 PolarHBondContact O-N 3.21Å; L319-L322 HydrophobicContact CD2-CB 3.89Å; L319-L322 HydrophobicContact CD2-CD1 4.1Å; L319-L322 HydrophobicContact CD2-CD2 4.34Å; L319-L322 HydrophobicContact CD2-CG 4.33Å; L319-R348 CarbonylContact O-C 3.07Å; L319-L349 HydrophobicContact CB-CD1 4.44Å; L319-L349 HydrophobicContact CD2-CD1 4.15Å; L319-L349 HydrophobicContact CG-CD1 4.12Å; L319-L349 VanDerWaalsContact O-CA 3.22Å; L319-L349 WeakPolarHBondContact O-CA 3.39Å; L319-L349 PolarHBondContact O-N 2.83Å
320	E	98.4	Very high	97.8	Very high	57 Å²	57	38.7 Å²	38.7	27%	0.266	19%	0.192	S	C	.	.			trans	-105.1	-41.5	-178.1	-58.6	-166	176.2	0	0	111.9	L300 L349 Q350 V351	L300-E320 HydrophobicContact CD2-CG 4.3Å; L300-E320 PolarHBondContact O-N 2.85Å; E320-L349 WeakPolarHBondContact O-CD1 3.34Å; E320-Q350 HydrophobicContact CB-CG 4.49Å; E320-Q350 PolarHBondContact O-N 3.31Å; E320-Q350 PolarHBondContact OE2-NE2 3.47Å; E320-V351 PolarHBondContact O-N 2.72Å; E320-V351 VanDerWaalsContact O-N 3.13Å
321	N	98.8	Very high	97.7	Very high	31 Å²	31	38.7 Å²	38.7	17%	0.166	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.9	-177.5	-57.7	-36.4	0	0	0	110.9	L300 E301 L302 Y323	L300-N321 PolarHBondContact O-N 2.84Å; E301-N321 HydrophobicContact CB-CB 4.25Å; E301-N321 HydrophobicContact CG-CB 3.96Å; E301-N321 PolarHBondContact OE2-ND2 2.72Å; L302-N321 PolarHBondContact N-O 3.35Å; N321-Y323 HydrophobicContact CB-CE2 3.98Å
322	L	98.8	Very high	97.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.5	176.9	-177.9	58.1	0	0	0	111.4	L302 V315 L319 L324 F337 L349 V351 L352 R353	L302-L322 HydrophobicContact CB-CD1 4.13Å; L302-L322 HydrophobicContact CD2-CD1 4Å; L302-L322 HydrophobicContact CG-CD1 4.05Å; V315-L322 HydrophobicContact CG1-CD2 4.29Å; L319-L322 HydrophobicContact CD2-CB 3.89Å; L319-L322 HydrophobicContact CD2-CD1 4.1Å; L319-L322 HydrophobicContact CD2-CD2 4.34Å; L319-L322 HydrophobicContact CD2-CG 4.33Å; L322-L324 HydrophobicContact CD1-CD1 4.26Å; L322-L324 HydrophobicContact CD1-CG 4.1Å; L322-L324 HydrophobicContact CD2-CD1 3.69Å; L322-L324 HydrophobicContact CD2-CG 4.39Å; L322-L324 HydrophobicContact CG-CD1 3.85Å; L322-L324 HydrophobicContact CG-CG 4.02Å; L322-F337 HydrophobicContact CD2-CE1 3.86Å; L322-L349 HydrophobicContact CB-CD1 3.82Å; L322-V351 PolarHBondContact N-O 3.17Å; L322-L352 HydrophobicContact CB-CD1 4.1Å; L322-L352 HydrophobicContact CD2-CD1 3.94Å; L322-L352 HydrophobicContact CG-CD1 4.08Å; L322-L352 WeakPolarHBondContact O-CA 3.4Å; L322-R353 PolarHBondContact O-N 3.01Å
323	Y	98.9	Very high	97.5	Very high	60 Å²	60	35.3 Å²	35.3	24%	0.235	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.5	177.9	-52.6	-82.7	0	0	0	110.3	E301 L302 D303 L304 S305 N321 V351 R353	E301-Y323 HydrophobicContact CG-CE2 3.89Å; L302-Y323 PolarHBondContact O-N 3.23Å; D303-Y323 HydrophobicContact CB-CD2 4.04Å; D303-Y323 WeakPolarHBondContact OD1-CB 3.26Å; L304-Y323 CarbonylContact C-O 3.42Å; L304-Y323 WeakPolarHBondContact CA-O 3.42Å; L304-Y323 PolarHBondContact N-O 3.48Å; S305-Y323 PolarHBondContact N-O 3.08Å; N321-Y323 HydrophobicContact CB-CE2 3.98Å; Y323-V351 HydrophobicContact CE1-CG1 4.3Å; Y323-R353 HydrophobicContact CD1-CB 4.05Å; Y323-R353 HydrophobicContact CD1-CG 3.7Å; Y323-R353 HydrophobicContact CE1-CG 4.07Å
324	L	98.8	Very high	97.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.			trans	-133.8	11.8	-177.1	-75.3	168.8	0	0	0	112.2	L304 L309 I312 L322 N327 I329 R353 L354 N357	L304-L324 HydrophobicContact CB-CD2 3.74Å; L304-L324 HydrophobicContact CD1-CD2 4.18Å; L309-L324 HydrophobicContact CD1-CD2 3.63Å; I312-L324 HydrophobicContact CG1-CD1 4.41Å; I312-L324 HydrophobicContact CG2-CD1 3.93Å; L322-L324 HydrophobicContact CD1-CD1 4.26Å; L322-L324 HydrophobicContact CD1-CG 4.1Å; L322-L324 HydrophobicContact CD2-CD1 3.69Å; L322-L324 HydrophobicContact CD2-CG 4.39Å; L322-L324 HydrophobicContact CG-CD1 3.85Å; L322-L324 HydrophobicContact CG-CG 4.02Å; L324-N327 PolarHBondContact O-ND2 3.03Å; L324-I329 HydrophobicContact CB-CD1 4.06Å; L324-I329 HydrophobicContact CD1-CD1 4.18Å; L324-I329 HydrophobicContact CD2-CD1 4.31Å; L324-I329 HydrophobicContact CG-CD1 4.44Å; L324-R353 CarbonylContact C-O 3.24Å; L324-R353 WeakPolarHBondContact CA-O 3.4Å; L324-R353 WeakPolarHBondContact CB-O 3.22Å; L324-R353 PolarHBondContact N-O 2.95Å; L324-L354 HydrophobicContact CB-CD2 3.72Å; L324-L354 HydrophobicContact CD1-CD2 3.84Å; L324-L354 HydrophobicContact CG-CD2 4.45Å; L324-N357 PolarHBondContact O-ND2 2.04Å
325	Q	98.5	Very high	97.3	Very high	27 Å²	27	36 Å²	36	13%	0.126	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	149.6	-179.7	69	-82.4	16.7	0	0	112.5	S305 Y306 N327 R353 D355	S305-Q325 CarbonylContact C-O 3.14Å; S305-Q325 VanDerWaalsContact CA-O 3.22Å; S305-Q325 WeakPolarHBondContact CA-O 3.32Å; S305-Q325 WeakPolarHBondContact CB-O 3.45Å; Y306-Q325 HydrophobicContact CE2-CG 4.24Å; Y306-Q325 PolarHBondContact N-O 3.36Å; Q325-N327 VanDerWaalsContact C-N 3.35Å; Q325-N327 PolarHBondContact O-N 2.78Å; Q325-R353 PolarHBondContact N-O 2.73Å; Q325-D355 CarbonylContact C-O 3.36Å; Q325-D355 WeakPolarHBondContact CA-O 3.37Å; Q325-D355 WeakPolarHBondContact CB-O 3.44Å; Q325-D355 WeakPolarHBondContact CB-OD1 3.45Å
326	G	98.1	Very high	97.2	Very high	25 Å²	25	36.4 Å²	36.4	26%	0.258	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	30.7	178.3	0	0	0	0	0	114.8	Y306 D355	Y306-G326 WeakPolarHBondContact CA-O 3.48Å; G326-D355 PolarHBondContact N-O 2.91Å
327	N	98.7	Very high	97.2	Very high	9 Å²	9	36 Å²	36	5%	0.048	20%	0.196	C	C	.	.	S	Bend	trans	-100.7	-166.5	171.1	-84.1	-83.5	0	0	0	110.7	L304 N307 R308 L309 L324 Q325 I329 N357	L304-N327 PolarHBondContact O-ND2 3.07Å; N307-N327 VanDerWaalsContact CA-OD1 3.26Å; N307-N327 WeakPolarHBondContact CA-OD1 3.24Å; N307-N327 WeakPolarHBondContact CB-OD1 3.42Å; N307-N327 PolarHBondContact N-OD1 2.95Å; N307-N327 PolarHBondContact O-OD1 2.9Å; R308-N327 PolarHBondContact N-OD1 3.28Å; L309-N327 HydrophobicContact CB-CB 4.24Å; L309-N327 VanDerWaalsContact CB-OD1 3.32Å; L309-N327 WeakPolarHBondContact CB-OD1 3.2Å; L309-N327 WeakPolarHBondContact CG-OD1 3.25Å; L309-N327 PolarHBondContact N-OD1 3.06Å; L324-N327 PolarHBondContact O-ND2 3.03Å; Q325-N327 VanDerWaalsContact C-N 3.35Å; Q325-N327 PolarHBondContact O-N 2.78Å; N327-I329 HydrophobicContact CB-CD1 4.2Å; N327-I329 HydrophobicContact CB-CG1 4.07Å; N327-N357 VanDerWaalsContact CA-OD1 3.23Å; N327-N357 WeakPolarHBondContact CA-OD1 3.42Å; N327-N357 WeakPolarHBondContact CB-OD1 3.19Å; N327-N357 PolarHBondContact N-OD1 3.45Å; N327-N357 PolarHBondContact O-OD1 3.14Å
328	Q	98.2	Very high	97.1	Very high	78 Å²	78	33.6 Å²	33.6	36%	0.364	18%	0.182	S	C	.	.			trans	-113.1	27.8	178.7	-63	174.3	-18	0	0	111.3	L309 Q310 N330 N357	L309-Q328 CarbonylContact O-C 3.07Å; L309-Q328 VanDerWaalsContact O-CA 3.25Å; L309-Q328 WeakPolarHBondContact O-CA 3.24Å; L309-Q328 PolarHBondContact O-N 2.82Å; Q310-Q328 WeakPolarHBondContact CA-O 3.32Å; Q310-Q328 HydrophobicContact CG-CB 4.23Å; Q328-N330 PolarHBondContact O-N 3.38Å; Q328-N357 PolarHBondContact N-OD1 3.03Å
329	I	98.1	Very high	96.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.			trans	-68.6	127.7	-173.9	-61	168.2	0	0	0	108.7	L309 Q310 I312 L324 N327 E331 L354 N357 E358 I359	L309-I329 HydrophobicContact CB-CG1 4.37Å; L309-I329 WeakPolarHBondContact O-CG1 3.49Å; L309-I329 PolarHBondContact O-N 3.26Å; L309-I329 VanDerWaalsContact O-N 3.09Å; Q310-I329 WeakPolarHBondContact O-CA 3.28Å; I312-I329 HydrophobicContact CG1-CD1 4.19Å; I312-I329 HydrophobicContact CG1-CG2 4.04Å; L324-I329 HydrophobicContact CB-CD1 4.06Å; L324-I329 HydrophobicContact CD1-CD1 4.18Å; L324-I329 HydrophobicContact CD2-CD1 4.31Å; L324-I329 HydrophobicContact CG-CD1 4.44Å; N327-I329 HydrophobicContact CB-CD1 4.2Å; N327-I329 HydrophobicContact CB-CG1 4.07Å; I329-E331 WeakPolarHBondContact CG2-O 3.46Å; I329-L354 HydrophobicContact CD1-CD2 3.82Å; I329-N357 HydrophobicContact CB-CB 4.09Å; I329-N357 VanDerWaalsContact CB-OD1 3.23Å; I329-N357 WeakPolarHBondContact CB-OD1 3.46Å; I329-N357 WeakPolarHBondContact CG1-OD1 3.45Å; I329-N357 PolarHBondContact N-OD1 3.41Å; I329-E358 CarbonylContact O-C 3.5Å; I329-E358 VanDerWaalsContact O-CA 3.22Å; I329-E358 WeakPolarHBondContact O-CA 3.36Å; I329-E358 WeakPolarHBondContact O-CB 3.38Å; I329-E358 PolarHBondContact O-N 3.18Å; I329-I359 HydrophobicContact CG2-CG2 4.15Å; I329-I359 WeakPolarHBondContact O-CG2 3.38Å; I329-I359 PolarHBondContact O-N 3.22Å
330	N	96.2	Very high	96.5	Very high	84 Å²	84	40.2 Å²	40.2	45%	0.449	22%	0.223	S	C	.	.			trans	-118.9	-3.5	-177.3	58.6	27.2	0	0	0	114	Q310 Q328 E358	Q310-N330 PolarHBondContact O-N 3.41Å; Q310-N330 PolarHBondContact O-OD1 2.99Å; Q328-N330 PolarHBondContact O-N 3.38Å; N330-E358 HydrophobicContact CB-CB 4.09Å
331	E	94.9	Very high	96.2	Very high	103 Å²	103	40.6 Å²	40.6	48%	0.481	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-138.9	136.5	179.7	-176.6	-179.5	-168	0	0	110.8	I329	I329-E331 WeakPolarHBondContact CG2-O 3.46Å
332	F	95.9	Very high	96	Very high	12 Å²	12	42.4 Å²	42.4	5%	0.053	24%	0.239	C	C	.	.			trans	-94.8	111.2	170.1	-170.4	-79.3	0	0	0	109.8	I312 I334 F337 L352 L354 A363 V364 A368 L372	I312-F332 HydrophobicContact CD1-CD2 3.96Å; I312-F332 HydrophobicContact CD1-CE2 4.25Å; I312-F332 HydrophobicContact CD1-CG 4.39Å; F332-I334 HydrophobicContact CE1-CD1 4.18Å; F332-F337 HydrophobicContact CE1-CE2 4.37Å; F332-F337 HydrophobicContact CE2-CE2 4.4Å; F332-F337 AromaticContact CZ-CE2 3.93Å; F332-F337 HydrophobicContact CZ-CE2 3.93Å; F332-L352 HydrophobicContact CE2-CD2 4.08Å; F332-L352 HydrophobicContact CZ-CD2 4.44Å; F332-L354 HydrophobicContact CD2-CD1 3.83Å; F332-L354 HydrophobicContact CE2-CD1 3.74Å; F332-A363 HydrophobicContact CB-CB 4.49Å; F332-V364 HydrophobicContact CD1-CG1 4.49Å; F332-V364 HydrophobicContact CD2-CG2 4.04Å; F332-V364 HydrophobicContact CE1-CG1 4.22Å; F332-V364 HydrophobicContact CE2-CG2 4.22Å; F332-V364 HydrophobicContact CG-CG2 4.25Å; F332-V364 HydrophobicContact CZ-CG1 4.34Å; F332-A368 HydrophobicContact CE1-CB 4.41Å; F332-L372 HydrophobicContact CZ-CD1 3.86Å
333	S	94.4	Very high	95.6	Very high	35 Å²	35	48.1 Å²	48.1	25%	0.245	27%	0.274	C	S	.	.			trans	-110.3	114.9	178.9	176.6	0	0	0	0	111.3	S335 S336	S333-S335 PolarHBondContact O-N 3.15Å; S333-S335 PolarHBondContact OG-OG 3.02Å; S333-S336 WeakPolarHBondContact O-CB 3.23Å; S333-S336 PolarHBondContact O-N 2.87Å
334	I	94.8	Very high	95.2	Very high	42 Å²	42	52.5 Å²	52.5	22%	0.215	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.7	-26.4	177.1	-160	61.6	0	0	0	112.5	F332 S336 F337 C338 A368 C371 L372	F332-I334 HydrophobicContact CE1-CD1 4.18Å; I334-S336 PolarHBondContact O-N 2.99Å; I334-F337 HydrophobicContact CD1-CD2 4.36Å; I334-F337 PolarHBondContact O-N 3.26Å; I334-C338 PolarHBondContact O-N 2.82Å; I334-C338 VanDerWaalsContact O-N 3.14Å; I334-A368 HydrophobicContact CD1-CB 3.88Å; I334-C371 HydrophobicContact CD1-CB 3.79Å; I334-C371 HydrophobicContact CG1-CB 3.8Å; I334-L372 HydrophobicContact CD1-CD1 4.02Å; I334-L372 HydrophobicContact CD1-CG 3.98Å
335	S	94.5	Very high	95	Very high	68 Å²	68	56.6 Å²	56.6	48%	0.476	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-67.5	-16.6	179.7	65.4	0	0	0	0	113.6	S333 F337 C338	S333-S335 PolarHBondContact O-N 3.15Å; S333-S335 PolarHBondContact OG-OG 3.02Å; S335-F337 PolarHBondContact O-N 2.72Å; S335-C338 WeakPolarHBondContact CA-O 3.04Å
336	S	96.2	Very high	94.9	Very high	13 Å²	13	58.6 Å²	58.6	9%	0.091	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-68.2	-21.9	171.5	-62.9	0	0	0	0	112.6	I312 R314 V315 S333 I334	I312-S336 PolarHBondContact O-OG 3.33Å; R314-S336 WeakPolarHBondContact CA-O 3.13Å; V315-S336 PolarHBondContact N-O 3.21Å; S333-S336 WeakPolarHBondContact O-CB 3.23Å; S333-S336 PolarHBondContact O-N 2.87Å; I334-S336 PolarHBondContact O-N 2.99Å
337	F	96.9	Very high	94.9	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.018	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-40.4	-178.9	-54.8	-78.2	0	0	0	112.8	I312 V315 L322 F332 I334 S335 L349 L352 L372	I312-F337 HydrophobicContact CD1-CE2 4.11Å; I312-F337 HydrophobicContact CD1-CZ 4.14Å; I312-F337 HydrophobicContact CG2-CE1 4.29Å; I312-F337 HydrophobicContact CG2-CE2 4.23Å; I312-F337 HydrophobicContact CG2-CZ 3.77Å; V315-F337 HydrophobicContact CG2-CD1 3.85Å; V315-F337 HydrophobicContact CG2-CE1 4.41Å; L322-F337 HydrophobicContact CD2-CE1 3.86Å; F332-F337 HydrophobicContact CE1-CE2 4.37Å; F332-F337 HydrophobicContact CE2-CE2 4.4Å; F332-F337 AromaticContact CZ-CE2 3.93Å; F332-F337 HydrophobicContact CZ-CE2 3.93Å; I334-F337 HydrophobicContact CD1-CD2 4.36Å; I334-F337 PolarHBondContact O-N 3.26Å; S335-F337 PolarHBondContact O-N 2.72Å; F337-L349 HydrophobicContact CD1-CD2 4.08Å; F337-L349 HydrophobicContact CE1-CD2 3.77Å; F337-L352 HydrophobicContact CE1-CD1 4.37Å; F337-L352 HydrophobicContact CE1-CD2 4.31Å; F337-L352 HydrophobicContact CE2-CD2 4.49Å; F337-L352 HydrophobicContact CZ-CD1 4.22Å; F337-L352 HydrophobicContact CZ-CD2 3.76Å; F337-L372 HydrophobicContact CB-CD2 3.97Å; F337-L372 HydrophobicContact CD1-CD2 4.09Å; F337-L372 HydrophobicContact CD2-CD1 4.37Å; F337-L372 HydrophobicContact CD2-CD2 4.22Å; F337-L372 HydrophobicContact CE2-CD1 4.42Å; F337-L372 HydrophobicContact CG-CD2 3.84Å
338	C	95.1	Very high	94.8	Very high	8 Å²	8	62.8 Å²	62.8	5%	0.054	34%	0.335	C	S	.	.			trans	-135.3	125.5	-178.6	-56.2	0	0	0	0	111	I334 S335 V341 S347 C371	I334-C338 PolarHBondContact O-N 2.82Å; I334-C338 VanDerWaalsContact O-N 3.14Å; S335-C338 WeakPolarHBondContact CA-O 3.04Å; C338-V341 HydrophobicContact CB-CG2 3.57Å; C338-S347 PolarHBondContact SG-N 2.87Å; C338-C371 HydrophobicContact CB-CB 3.85Å; C338-C371 WeakPolarHBondContact CB-SG 2.98Å; C338-C371 WeakPolarHBondContact SG-CB 3.18Å; C338-C371 CovalentContact SG-SG 2.04Å; C338-C371 PolarHBondContact SG-SG 2.96Å
339	T	90.9	Very high	94.8	Very high	98 Å²	98	59 Å²	59	60%	0.601	32%	0.317	S	S	*	.	S	Bend	trans	-83.2	-31.1	169.4	45.6	0	0	0	0	113.3	R314	R314-T339 VanDerWaalsContact CZ-CG2 3.44Å
340	V	90.8	Very high	94.8	Very high	90 Å²	90	62 Å²	62	55%	0.545	33%	0.331	S	S	.	.	S	Bend	trans	-135.3	137.8	176.6	-179.9	0	0	0	0	106.5
341	V	93.8	Very high	94.9	Very high	66 Å²	66	59.2 Å²	59.2	40%	0.4	32%	0.317	S	S	.	.			trans	-124.4	121.2	-179	-177.2	0	0	0	0	108.8	C338 N345 L370 C371	C338-V341 HydrophobicContact CB-CG2 3.57Å; V341-N345 WeakPolarHBondContact CA-O 3.48Å; V341-L370 HydrophobicContact CG1-CB 3.87Å; V341-C371 HydrophobicContact CG2-CB 3.86Å
342	D	92.8	Very high	95	Very high	69 Å²	69	54.3 Å²	54.3	37%	0.369	29%	0.294	S	S	.	.	S	Bend	trans	-152.2	-166.7	172.9	65.2	45.6	0	0	0	111	M344 N345	D342-M344 PolarHBondContact O-N 2.89Å; D342-M344 WeakPolarHBondContact OD1-CA 3.23Å; D342-M344 PolarHBondContact OD1-N 3.14Å; D342-N345 PolarHBondContact N-O 3.22Å; D342-N345 PolarHBondContact OD1-N 3.35Å; D342-N345 PolarHBondContact OD1-ND2 3.32Å; D342-N345 PolarHBondContact OD2-ND2 2.83Å
343	V	90.3	Very high	95.1	Very high	120 Å²	120	56.9 Å²	56.9	73%	0.727	30%	0.303	S	S	*	.	S	Bend	trans	-62.8	-28.6	-178.5	-174.2	0	0	0	0	112.3	R373	V343-R373 PolarHBondContact O-NH2 2.52Å
344	M	92	Very high	95.3	Very high	152 Å²	152	55.2 Å²	55.2	75%	0.749	29%	0.292	S	S	*	.	S	Bend	trans	-105.7	-27.3	-178	-59.1	-57.3	-68.8	0	0	113.3	D342 Y346	D342-M344 PolarHBondContact O-N 2.89Å; D342-M344 WeakPolarHBondContact OD1-CA 3.23Å; D342-M344 PolarHBondContact OD1-N 3.14Å; M344-Y346 WeakPolarHBondContact O-CD1 3.12Å
345	N	93.9	Very high	95.4	Very high	85 Å²	85	55.2 Å²	55.2	46%	0.455	29%	0.292	S	S	.	.			trans	-105.2	107.6	-175.7	-66	-58.5	0	0	0	111.3	V341 D342	V341-N345 WeakPolarHBondContact CA-O 3.48Å; D342-N345 PolarHBondContact N-O 3.22Å; D342-N345 PolarHBondContact OD1-N 3.35Å; D342-N345 PolarHBondContact OD1-ND2 3.32Å; D342-N345 PolarHBondContact OD2-ND2 2.83Å
346	Y	95.9	Very high	95.5	Very high	69 Å²	69	54.9 Å²	54.9	27%	0.271	30%	0.299	S	S	.	.			trans	-162.5	164.2	-177.5	62.7	-72.1	0	0	0	109.7	M344 R373 R374	M344-Y346 WeakPolarHBondContact O-CD1 3.12Å; Y346-R373 HydrophobicContact CD2-CG 3.69Å; Y346-R373 HydrophobicContact CE2-CG 4.16Å; Y346-R373 HydrophobicContact CG-CG 4.37Å; Y346-R373 VanDerWaalsContact CG-NH2 3.33Å; Y346-R374 HydrophobicContact CD2-CG 4.3Å; Y346-R374 HydrophobicContact CE2-CG 3.82Å
347	S	97.6	Very high	95.6	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.007	30%	0.3	C	S	.	.			trans	-79.5	141.3	177.9	-175.9	0	0	0	0	111.6	C338 L349 C371	C338-S347 PolarHBondContact SG-N 2.87Å; S347-L349 VanDerWaalsContact C-N 3.28Å; S347-L349 WeakPolarHBondContact OG-CB 3.48Å; S347-L349 PolarHBondContact OG-N 3.37Å; S347-C371 WeakPolarHBondContact CB-O 3.14Å; S347-C371 PolarHBondContact N-O 3.04Å
348	R	97.3	Very high	95.5	Very high	121 Å²	121	61.2 Å²	61.2	46%	0.457	33%	0.329	S	S	.	.			trans	-86.4	1.6	173.8	-63.9	-174.3	-175.9	-172.4	1.3	113.5	T317 L319 Q350	T317-R348 VanDerWaalsContact O-CB 3.28Å; T317-R348 WeakPolarHBondContact O-CB 3.28Å; T317-R348 WeakPolarHBondContact O-CG 3.16Å; T317-R348 PolarHBondContact O-N 3Å; L319-R348 CarbonylContact O-C 3.07Å; R348-Q350 WeakPolarHBondContact O-CG 3.46Å; R348-Q350 PolarHBondContact O-N 2.67Å
349	L	98.1	Very high	95.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.329	C	S	.	.			trans	-53.1	130.4	-178.6	-159.1	74.7	0	0	0	111.1	L319 E320 L322 F337 S347 L352 L372 R374 A375	L319-L349 HydrophobicContact CB-CD1 4.44Å; L319-L349 HydrophobicContact CD2-CD1 4.15Å; L319-L349 HydrophobicContact CG-CD1 4.12Å; L319-L349 VanDerWaalsContact O-CA 3.22Å; L319-L349 WeakPolarHBondContact O-CA 3.39Å; L319-L349 PolarHBondContact O-N 2.83Å; E320-L349 WeakPolarHBondContact O-CD1 3.34Å; L322-L349 HydrophobicContact CB-CD1 3.82Å; F337-L349 HydrophobicContact CD1-CD2 4.08Å; F337-L349 HydrophobicContact CE1-CD2 3.77Å; S347-L349 VanDerWaalsContact C-N 3.28Å; S347-L349 WeakPolarHBondContact OG-CB 3.48Å; S347-L349 PolarHBondContact OG-N 3.37Å; L349-L352 HydrophobicContact CD2-CB 3.84Å; L349-L352 HydrophobicContact CD2-CD1 4.25Å; L349-L352 HydrophobicContact CD2-CD2 4.21Å; L349-L352 HydrophobicContact CD2-CG 4.32Å; L349-L372 HydrophobicContact CB-CD2 4.38Å; L349-L372 HydrophobicContact CD2-CD2 4.17Å; L349-R374 CarbonylContact O-C 3.45Å; L349-A375 VanDerWaalsContact O-CA 3.23Å; L349-A375 WeakPolarHBondContact O-CA 3.43Å; L349-A375 PolarHBondContact O-N 2.72Å
350	Q	97.9	Very high	95.5	Very high	62 Å²	62	64.2 Å²	64.2	29%	0.29	33%	0.333	S	S	.	.			trans	-107.9	-44.7	179.3	-57.5	-176.7	33.7	0	0	110.1	E320 R348 A375 T376 I377	E320-Q350 HydrophobicContact CB-CG 4.49Å; E320-Q350 PolarHBondContact O-N 3.31Å; E320-Q350 PolarHBondContact OE2-NE2 3.47Å; R348-Q350 WeakPolarHBondContact O-CG 3.46Å; R348-Q350 PolarHBondContact O-N 2.67Å; Q350-A375 CarbonylContact O-C 3.42Å; Q350-A375 WeakPolarHBondContact O-CA 3.46Å; Q350-T376 PolarHBondContact O-N 3.01Å; Q350-T376 PolarHBondContact O-OG1 2.76Å; Q350-I377 PolarHBondContact O-N 3.3Å; Q350-I377 VanDerWaalsContact O-N 3.15Å
351	V	98.4	Very high	95.2	Very high	26 Å²	26	69.8 Å²	69.8	16%	0.158	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.2	-178.1	-176.8	0	0	0	0	110.4	E320 L322 Y323 R353 I377	E320-V351 PolarHBondContact O-N 2.72Å; E320-V351 VanDerWaalsContact O-N 3.13Å; L322-V351 PolarHBondContact N-O 3.17Å; Y323-V351 HydrophobicContact CE1-CG1 4.3Å; V351-R353 HydrophobicContact CG1-CG 4.33Å; V351-I377 HydrophobicContact CG1-CB 4.39Å; V351-I377 HydrophobicContact CG1-CG2 4.37Å; V351-I377 HydrophobicContact CG2-CB 4.49Å; V351-I377 HydrophobicContact CG2-CD1 4.38Å
352	L	98.1	Very high	94.9	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	115.9	172.6	179.7	56.9	0	0	0	110	L322 F332 F337 L349 L354 I377 I378 E379	L322-L352 HydrophobicContact CB-CD1 4.1Å; L322-L352 HydrophobicContact CD2-CD1 3.94Å; L322-L352 HydrophobicContact CG-CD1 4.08Å; L322-L352 WeakPolarHBondContact O-CA 3.4Å; F332-L352 HydrophobicContact CE2-CD2 4.08Å; F332-L352 HydrophobicContact CZ-CD2 4.44Å; F337-L352 HydrophobicContact CE1-CD1 4.37Å; F337-L352 HydrophobicContact CE1-CD2 4.31Å; F337-L352 HydrophobicContact CE2-CD2 4.49Å; F337-L352 HydrophobicContact CZ-CD1 4.22Å; F337-L352 HydrophobicContact CZ-CD2 3.76Å; L349-L352 HydrophobicContact CD2-CB 3.84Å; L349-L352 HydrophobicContact CD2-CD1 4.25Å; L349-L352 HydrophobicContact CD2-CD2 4.21Å; L349-L352 HydrophobicContact CD2-CG 4.32Å; L352-L354 HydrophobicContact CD1-CD1 4.17Å; L352-L354 HydrophobicContact CD1-CG 4.01Å; L352-L354 HydrophobicContact CD2-CD1 3.81Å; L352-L354 HydrophobicContact CD2-CG 4.5Å; L352-L354 HydrophobicContact CG-CD1 3.91Å; L352-L354 HydrophobicContact CG-CG 4.06Å; L352-I377 PolarHBondContact N-O 2.76Å; L352-I378 HydrophobicContact CB-CG1 4.29Å; L352-I378 HydrophobicContact CD2-CG2 4.19Å; L352-I378 HydrophobicContact CG-CG2 4.5Å; L352-I378 WeakPolarHBondContact O-CA 3.45Å; L352-E379 PolarHBondContact O-N 3.3Å
353	R	98.1	Very high	94.8	Very high	65 Å²	65	72 Å²	72	25%	0.245	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	115.4	174.9	-67.3	-73	-58.3	-124	-7.7	109.9	L322 Y323 L324 Q325 V351 D355 E379	L322-R353 PolarHBondContact O-N 3.01Å; Y323-R353 HydrophobicContact CD1-CB 4.05Å; Y323-R353 HydrophobicContact CD1-CG 3.7Å; Y323-R353 HydrophobicContact CE1-CG 4.07Å; L324-R353 CarbonylContact C-O 3.24Å; L324-R353 WeakPolarHBondContact CA-O 3.4Å; L324-R353 WeakPolarHBondContact CB-O 3.22Å; L324-R353 PolarHBondContact N-O 2.95Å; Q325-R353 PolarHBondContact N-O 2.73Å; V351-R353 HydrophobicContact CG1-CG 4.33Å; R353-D355 IonicContact CZ-OD1 2.77Å; R353-D355 IonicContact CZ-OD2 2.78Å; R353-D355 IonicContact NE-OD1 2.84Å; R353-D355 PolarHBondContact NE-OD1 3.12Å; R353-D355 IonicContact NE-OD2 3.22Å; R353-D355 VanDerWaalsContact NH2-CG 3.34Å; R353-D355 IonicContact NH2-OD1 3.88Å; R353-D355 PolarHBondContact NH2-OD1 3.01Å; R353-D355 IonicContact NH2-OD2 2.82Å; R353-D355 PolarHBondContact NH2-OD2 3.14Å; R353-E379 VanDerWaalsContact CD-OE1 3.28Å; R353-E379 WeakPolarHBondContact CD-OE1 3.44Å; R353-E379 VanDerWaalsContact CZ-CD 3.43Å; R353-E379 IonicContact CZ-OE1 3.29Å; R353-E379 IonicContact CZ-OE2 3.68Å; R353-E379 IonicContact NE-OE1 2.82Å; R353-E379 IonicContact NE-OE2 3.43Å; R353-E379 PolarHBondContact NE-OE2 2.84Å; R353-E379 VanDerWaalsContact NE-OE2 3.14Å; R353-E379 IonicContact NH1-OE1 2.78Å; R353-E379 PolarHBondContact NH1-OE1 3.25Å; R353-E379 IonicContact NH1-OE2 3.81Å; R353-E379 PolarHBondContact NH1-OE2 2.7Å; R353-E379 IonicContact NH2-OE2 2.79Å
354	L	97.7	Very high	94.8	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.336	C	S	.	.			trans	-126.3	8.6	177.5	-71.3	164.2	0	0	0	112.3	I312 L324 I329 F332 L352 N357 I359 E379 I380	I312-L354 HydrophobicContact CD1-CD1 4.15Å; I312-L354 HydrophobicContact CD1-CD2 4.21Å; I312-L354 HydrophobicContact CG1-CD2 4.19Å; L324-L354 HydrophobicContact CB-CD2 3.72Å; L324-L354 HydrophobicContact CD1-CD2 3.84Å; L324-L354 HydrophobicContact CG-CD2 4.45Å; I329-L354 HydrophobicContact CD1-CD2 3.82Å; F332-L354 HydrophobicContact CD2-CD1 3.83Å; F332-L354 HydrophobicContact CE2-CD1 3.74Å; L352-L354 HydrophobicContact CD1-CD1 4.17Å; L352-L354 HydrophobicContact CD1-CG 4.01Å; L352-L354 HydrophobicContact CD2-CD1 3.81Å; L352-L354 HydrophobicContact CD2-CG 4.5Å; L352-L354 HydrophobicContact CG-CD1 3.91Å; L352-L354 HydrophobicContact CG-CG 4.06Å; L354-N357 WeakPolarHBondContact O-CB 3.39Å; L354-N357 PolarHBondContact O-ND2 2.93Å; L354-I359 HydrophobicContact CB-CD1 3.85Å; L354-I359 HydrophobicContact CD1-CD1 3.92Å; L354-I359 HydrophobicContact CD2-CD1 4.44Å; L354-I359 HydrophobicContact CG-CD1 4.31Å; L354-E379 CarbonylContact C-O 3.2Å; L354-E379 WeakPolarHBondContact CA-O 3.37Å; L354-E379 WeakPolarHBondContact CB-O 3.36Å; L354-E379 PolarHBondContact N-O 3.42Å; L354-I380 HydrophobicContact CB-CG1 4.37Å
355	D	96.9	Very high	94.8	Very high	42 Å²	42	62.7 Å²	62.7	23%	0.225	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	147.7	178.3	51.9	-61.8	0	0	0	112.7	Q325 G326 R353 N357 E379 I380	Q325-D355 CarbonylContact C-O 3.36Å; Q325-D355 WeakPolarHBondContact CA-O 3.37Å; Q325-D355 WeakPolarHBondContact CB-O 3.44Å; Q325-D355 WeakPolarHBondContact CB-OD1 3.45Å; G326-D355 PolarHBondContact N-O 2.91Å; R353-D355 IonicContact CZ-OD1 2.77Å; R353-D355 IonicContact CZ-OD2 2.78Å; R353-D355 IonicContact NE-OD1 2.84Å; R353-D355 PolarHBondContact NE-OD1 3.12Å; R353-D355 IonicContact NE-OD2 3.22Å; R353-D355 VanDerWaalsContact NH2-CG 3.34Å; R353-D355 IonicContact NH2-OD1 3.88Å; R353-D355 PolarHBondContact NH2-OD1 3.01Å; R353-D355 IonicContact NH2-OD2 2.82Å; R353-D355 PolarHBondContact NH2-OD2 3.14Å; D355-N357 VanDerWaalsContact C-N 3.3Å; D355-N357 PolarHBondContact O-N 3.13Å; D355-E379 PolarHBondContact N-O 3.36Å; D355-I380 WeakPolarHBondContact CA-OXT 3.23Å
356	G	96.6	Very high	94.7	Very high	61 Å²	61	65 Å²	65	63%	0.629	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	26.3	-178.6	0	0	0	0	0	114.3
357	N	98.1	Very high	94.4	Very high	21 Å²	21	66 Å²	66	11%	0.112	34%	0.342	C	S	.	.	S	Bend	trans	-103.3	178.1	168.4	-80.1	-83.7	0	0	0	111.6	L324 N327 Q328 I329 L354 D355 I359	L324-N357 PolarHBondContact O-ND2 2.04Å; N327-N357 VanDerWaalsContact CA-OD1 3.23Å; N327-N357 WeakPolarHBondContact CA-OD1 3.42Å; N327-N357 WeakPolarHBondContact CB-OD1 3.19Å; N327-N357 PolarHBondContact N-OD1 3.45Å; N327-N357 PolarHBondContact O-OD1 3.14Å; Q328-N357 PolarHBondContact N-OD1 3.03Å; I329-N357 HydrophobicContact CB-CB 4.09Å; I329-N357 VanDerWaalsContact CB-OD1 3.23Å; I329-N357 WeakPolarHBondContact CB-OD1 3.46Å; I329-N357 WeakPolarHBondContact CG1-OD1 3.45Å; I329-N357 PolarHBondContact N-OD1 3.41Å; L354-N357 WeakPolarHBondContact O-CB 3.39Å; L354-N357 PolarHBondContact O-ND2 2.93Å; D355-N357 VanDerWaalsContact C-N 3.3Å; D355-N357 PolarHBondContact O-N 3.13Å; N357-I359 HydrophobicContact CB-CG1 3.9Å; N357-I359 PolarHBondContact O-N 2.97Å
358	E	96.3	Very high	94.2	Very high	130 Å²	130	66.1 Å²	66.1	61%	0.607	34%	0.343	S	S	*	.	S	Bend	trans	-86.8	25.5	176	-59.2	179.5	-169.2	0	0	112.7	I329 N330	I329-E358 CarbonylContact O-C 3.5Å; I329-E358 VanDerWaalsContact O-CA 3.22Å; I329-E358 WeakPolarHBondContact O-CA 3.36Å; I329-E358 WeakPolarHBondContact O-CB 3.38Å; I329-E358 PolarHBondContact O-N 3.18Å; N330-E358 HydrophobicContact CB-CB 4.09Å
359	I	94.6	Very high	94	Very high	13 Å²	13	64.3 Å²	64.3	7%	0.067	35%	0.346	C	S	.	.			trans	-108.7	155	175.7	52.7	166	0	0	0	111.6	I329 L354 N357 I380	I329-I359 HydrophobicContact CG2-CG2 4.15Å; I329-I359 WeakPolarHBondContact O-CG2 3.38Å; I329-I359 PolarHBondContact O-N 3.22Å; L354-I359 HydrophobicContact CB-CD1 3.85Å; L354-I359 HydrophobicContact CD1-CD1 3.92Å; L354-I359 HydrophobicContact CD2-CD1 4.44Å; L354-I359 HydrophobicContact CG-CD1 4.31Å; N357-I359 HydrophobicContact CB-CG1 3.9Å; N357-I359 PolarHBondContact O-N 2.97Å; I359-I380 HydrophobicContact CD1-CG2 3.79Å; I359-I380 HydrophobicContact CG1-CG2 3.88Å
360	K	89.8	Confident	93.9	Very high	155 Å²	155	69.6 Å²	69.6	67%	0.674	37%	0.374	S	S	*	.			trans	-114.9	156.6	173.4	-66.6	-178.6	-177.4	179.6	0	109.6	N362 A363	K360-N362 WeakPolarHBondContact CB-OD1 3.5Å; K360-N362 PolarHBondContact O-N 3.27Å; K360-N362 VanDerWaalsContact O-N 3.14Å; K360-A363 WeakPolarHBondContact O-CB 3.42Å; K360-A363 PolarHBondContact O-N 2.8Å
361	R	85.4	Confident	93.8	Very high	207 Å²	207	66.7 Å²	66.7	78%	0.781	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-57.1	-31.8	-179.3	-163.2	174.1	-168.7	-156.7	3	114.2	A363 V364	R361-A363 PolarHBondContact O-N 3.45Å; R361-V364 PolarHBondContact O-N 2.77Å
362	N	88.3	Confident	93.7	Very high	140 Å²	140	65.8 Å²	65.8	75%	0.749	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-73.7	-6.7	176.7	67.7	-27.5	0	0	0	114.1	K360 V364	K360-N362 WeakPolarHBondContact CB-OD1 3.5Å; K360-N362 PolarHBondContact O-N 3.27Å; K360-N362 VanDerWaalsContact O-N 3.14Å; N362-V364 VanDerWaalsContact C-N 3.26Å
363	A	90.1	Very high	93.6	Very high	42 Å²	42	71.2 Å²	71.2	35%	0.347	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-75.4	-17.1	172.5	0	0	0	0	0	112.4	F332 K360 R361 P365	F332-A363 HydrophobicContact CB-CB 4.49Å; K360-A363 WeakPolarHBondContact O-CB 3.42Å; K360-A363 PolarHBondContact O-N 2.8Å; R361-A363 PolarHBondContact O-N 3.45Å; A363-P365 VanDerWaalsContact O-CD 3.3Å; A363-P365 WeakPolarHBondContact O-CD 3.19Å
364	V	90.7	Very high	93.4	Very high	38 Å²	38	74 Å²	74	23%	0.23	39%	0.386	C	S	.	.	S	Bend	trans	-71.4	121.3	175.7	-175.5	0	0	0	0	109.4	F332 R361 N362 A368 I380	F332-V364 HydrophobicContact CD1-CG1 4.49Å; F332-V364 HydrophobicContact CD2-CG2 4.04Å; F332-V364 HydrophobicContact CE1-CG1 4.22Å; F332-V364 HydrophobicContact CE2-CG2 4.22Å; F332-V364 HydrophobicContact CG-CG2 4.25Å; F332-V364 HydrophobicContact CZ-CG1 4.34Å; R361-V364 PolarHBondContact O-N 2.77Å; N362-V364 VanDerWaalsContact C-N 3.26Å; V364-A368 HydrophobicContact CG1-CB 3.63Å; V364-I380 HydrophobicContact CG2-CD1 3.13Å
365	P	91.6	Very high	93.3	Very high	39 Å²	39	75.1 Å²	75.1	25%	0.253	40%	0.395	S	S	.	.			trans	-60.4	143.2	177.6	-26.1	36.8	0	0	0	112.3	A363 D367 A368	A363-P365 VanDerWaalsContact O-CD 3.3Å; A363-P365 WeakPolarHBondContact O-CD 3.19Å; P365-D367 WeakPolarHBondContact CB-OD1 3.46Å; P365-D367 PolarHBondContact O-N 3.02Å; P365-D367 VanDerWaalsContact O-N 3.12Å; P365-A368 WeakPolarHBondContact O-CB 3.31Å; P365-A368 PolarHBondContact O-N 3.13Å
366	P	90.4	Very high	93.1	Very high	133 Å²	133	78.5 Å²	78.5	86%	0.864	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.7	178.5	-24.9	34	0	0	0	114.6	P369	P366-P369 WeakPolarHBondContact O-CD 3.39Å
367	D	90.4	Very high	92.9	Very high	91 Å²	91	79 Å²	79	49%	0.487	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.4	178.8	63.7	-31.6	0	0	0	113.6	P365 P369 L370	P365-D367 WeakPolarHBondContact CB-OD1 3.46Å; P365-D367 PolarHBondContact O-N 3.02Å; P365-D367 VanDerWaalsContact O-N 3.12Å; D367-P369 VanDerWaalsContact C-N 3.26Å; D367-P369 VanDerWaalsContact O-N 3.17Å; D367-L370 HydrophobicContact CB-CD1 4.16Å; D367-L370 VanDerWaalsContact O-CB 3.31Å; D367-L370 WeakPolarHBondContact O-CB 3.09Å; D367-L370 WeakPolarHBondContact O-CG 3.03Å; D367-L370 PolarHBondContact O-N 3.19Å
368	A	93.4	Very high	92.6	Very high	3 Å²	3	81 Å²	81	3%	0.025	42%	0.415	C	S	.	.	H	α-helix	trans	-51.1	-36.9	175.6	0	0	0	0	0	114.2	F332 I334 V364 P365 L370 C371 L372	F332-A368 HydrophobicContact CE1-CB 4.41Å; I334-A368 HydrophobicContact CD1-CB 3.88Å; V364-A368 HydrophobicContact CG1-CB 3.63Å; P365-A368 WeakPolarHBondContact O-CB 3.31Å; P365-A368 PolarHBondContact O-N 3.13Å; A368-L370 PolarHBondContact O-N 3.45Å; A368-L370 VanDerWaalsContact O-N 3.13Å; A368-C371 PolarHBondContact O-N 2.95Å; A368-C371 VanDerWaalsContact O-N 3.14Å; A368-L372 PolarHBondContact O-N 3.31Å
369	P	93.9	Very high	92.4	Very high	82 Å²	82	78.3 Å²	78.3	53%	0.532	40%	0.403	S	S	.	.	H	α-helix	trans	-59.5	-20.7	174.8	-26.3	36.8	0	0	0	114.7	P366 D367 C371 R373	P366-P369 WeakPolarHBondContact O-CD 3.39Å; D367-P369 VanDerWaalsContact C-N 3.26Å; D367-P369 VanDerWaalsContact O-N 3.17Å; P369-C371 VanDerWaalsContact C-N 3.34Å; P369-R373 VanDerWaalsContact O-CA 3.24Å; P369-R373 WeakPolarHBondContact O-CA 3.3Å; P369-R373 WeakPolarHBondContact O-CB 3.35Å; P369-R373 PolarHBondContact O-N 2.95Å
370	L	94.8	Very high	92.1	Very high	112 Å²	112	80.5 Å²	80.5	59%	0.586	41%	0.414	S	S	*	.	H	α-helix	trans	-64.8	-40.5	175.5	-62.9	177.6	0	0	0	111.6	V341 D367 A368	V341-L370 HydrophobicContact CG1-CB 3.87Å; D367-L370 HydrophobicContact CB-CD1 4.16Å; D367-L370 VanDerWaalsContact O-CB 3.31Å; D367-L370 WeakPolarHBondContact O-CB 3.09Å; D367-L370 WeakPolarHBondContact O-CG 3.03Å; D367-L370 PolarHBondContact O-N 3.19Å; A368-L370 PolarHBondContact O-N 3.45Å; A368-L370 VanDerWaalsContact O-N 3.13Å
371	C	96.9	Very high	92.2	Very high	1 Å²	1	76.8 Å²	76.8	1%	0.007	40%	0.401	C	S	.	.	H	α-helix	trans	-85	-42.4	176.3	165.8	0	0	0	0	112.1	I334 C338 V341 S347 A368 P369	I334-C371 HydrophobicContact CD1-CB 3.79Å; I334-C371 HydrophobicContact CG1-CB 3.8Å; C338-C371 HydrophobicContact CB-CB 3.85Å; C338-C371 WeakPolarHBondContact CB-SG 2.98Å; C338-C371 WeakPolarHBondContact SG-CB 3.18Å; C338-C371 CovalentContact SG-SG 2.04Å; C338-C371 PolarHBondContact SG-SG 2.96Å; V341-C371 HydrophobicContact CG2-CB 3.86Å; S347-C371 WeakPolarHBondContact CB-O 3.14Å; S347-C371 PolarHBondContact N-O 3.04Å; A368-C371 PolarHBondContact O-N 2.95Å; A368-C371 VanDerWaalsContact O-N 3.14Å; P369-C371 VanDerWaalsContact C-N 3.34Å
372	L	96.3	Very high	92.6	Very high	6 Å²	6	69.9 Å²	69.9	3%	0.031	38%	0.381	C	S	.	.	S	Bend	trans	-98.6	29.5	-173.5	-61.6	178.1	0	0	0	113.3	F332 I334 F337 L349 A368 R374 A375 I378	F332-L372 HydrophobicContact CZ-CD1 3.86Å; I334-L372 HydrophobicContact CD1-CD1 4.02Å; I334-L372 HydrophobicContact CD1-CG 3.98Å; F337-L372 HydrophobicContact CB-CD2 3.97Å; F337-L372 HydrophobicContact CD1-CD2 4.09Å; F337-L372 HydrophobicContact CD2-CD1 4.37Å; F337-L372 HydrophobicContact CD2-CD2 4.22Å; F337-L372 HydrophobicContact CE2-CD1 4.42Å; F337-L372 HydrophobicContact CG-CD2 3.84Å; L349-L372 HydrophobicContact CB-CD2 4.38Å; L349-L372 HydrophobicContact CD2-CD2 4.17Å; A368-L372 PolarHBondContact O-N 3.31Å; L372-R374 PolarHBondContact O-N 3.41Å; L372-A375 HydrophobicContact CB-CB 4.22Å; L372-A375 VanDerWaalsContact O-CB 3.25Å; L372-A375 WeakPolarHBondContact O-CB 3.43Å; L372-A375 PolarHBondContact O-N 3.28Å; L372-I378 HydrophobicContact CD1-CD1 4.31Å
373	R	95.1	Very high	92.8	Very high	115 Å²	115	66.1 Å²	66.1	43%	0.434	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.4	-174.4	59.6	-171.2	-179.7	-173.2	4.5	116.2	V343 Y346 P369	V343-R373 PolarHBondContact O-NH2 2.52Å; Y346-R373 HydrophobicContact CD2-CG 3.69Å; Y346-R373 HydrophobicContact CE2-CG 4.16Å; Y346-R373 HydrophobicContact CG-CG 4.37Å; Y346-R373 VanDerWaalsContact CG-NH2 3.33Å; P369-R373 VanDerWaalsContact O-CA 3.24Å; P369-R373 WeakPolarHBondContact O-CA 3.3Å; P369-R373 WeakPolarHBondContact O-CB 3.35Å; P369-R373 PolarHBondContact O-N 2.95Å
374	R	95.3	Very high	92.9	Very high	123 Å²	123	67.5 Å²	67.5	46%	0.464	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.9	175.5	-59.3	-156.6	85.8	-161.6	3.7	113.4	Y346 L349 L372 T376	Y346-R374 HydrophobicContact CD2-CG 4.3Å; Y346-R374 HydrophobicContact CE2-CG 3.82Å; L349-R374 CarbonylContact O-C 3.45Å; L372-R374 PolarHBondContact O-N 3.41Å; R374-T376 PolarHBondContact O-N 3.39Å
375	A	94.3	Very high	93.1	Very high	24 Å²	24	69.3 Å²	69.3	20%	0.198	37%	0.369	C	S	.	.			trans	-70	114.9	-177.7	0	0	0	0	0	109.4	L349 Q350 L372 I378	L349-A375 VanDerWaalsContact O-CA 3.23Å; L349-A375 WeakPolarHBondContact O-CA 3.43Å; L349-A375 PolarHBondContact O-N 2.72Å; Q350-A375 CarbonylContact O-C 3.42Å; Q350-A375 WeakPolarHBondContact O-CA 3.46Å; L372-A375 HydrophobicContact CB-CB 4.22Å; L372-A375 VanDerWaalsContact O-CB 3.25Å; L372-A375 WeakPolarHBondContact O-CB 3.43Å; L372-A375 PolarHBondContact O-N 3.28Å; A375-I378 HydrophobicContact CB-CD1 3.86Å; A375-I378 HydrophobicContact CB-CG1 3.86Å
376	T	92.4	Very high	93.2	Very high	112 Å²	112	71.3 Å²	71.3	69%	0.687	38%	0.377	S	S	*	.	S	Bend	trans	-89.6	-29.3	175.2	52.3	0	0	0	0	110.9	Q350 R374	Q350-T376 PolarHBondContact O-N 3.01Å; Q350-T376 PolarHBondContact O-OG1 2.76Å; R374-T376 PolarHBondContact O-N 3.39Å
377	I	92.1	Very high	93.4	Very high	72 Å²	72	66.9 Å²	66.9	37%	0.369	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.9	-178	-60.8	172	0	0	0	108.8	Q350 V351 L352 E379	Q350-I377 PolarHBondContact O-N 3.3Å; Q350-I377 VanDerWaalsContact O-N 3.15Å; V351-I377 HydrophobicContact CG1-CB 4.39Å; V351-I377 HydrophobicContact CG1-CG2 4.37Å; V351-I377 HydrophobicContact CG2-CB 4.49Å; V351-I377 HydrophobicContact CG2-CD1 4.38Å; L352-I377 PolarHBondContact N-O 2.76Å; I377-E379 HydrophobicContact CG2-CG 3.86Å
378	I	91.6	Very high	93.6	Very high	63 Å²	63	65.1 Å²	65.1	32%	0.323	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	103.8	167.6	-57.7	173.8	0	0	0	107	L352 L372 A375 I380	L352-I378 HydrophobicContact CB-CG1 4.29Å; L352-I378 HydrophobicContact CD2-CG2 4.19Å; L352-I378 HydrophobicContact CG-CG2 4.5Å; L352-I378 WeakPolarHBondContact O-CA 3.45Å; L372-I378 HydrophobicContact CD1-CD1 4.31Å; A375-I378 HydrophobicContact CB-CD1 3.86Å; A375-I378 HydrophobicContact CB-CG1 3.86Å; I378-I380 HydrophobicContact CG2-CD1 4.06Å; I378-I380 HydrophobicContact CG2-CG1 4.06Å
379	E	92.5	Very high	93.6	Very high	74 Å²	74	70.3 Å²	70.3	35%	0.346	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.7	176.4	-60.5	-175.9	-142.4	0	0	109.6	L352 R353 L354 D355 I377	L352-E379 PolarHBondContact O-N 3.3Å; R353-E379 VanDerWaalsContact CD-OE1 3.28Å; R353-E379 WeakPolarHBondContact CD-OE1 3.44Å; R353-E379 VanDerWaalsContact CZ-CD 3.43Å; R353-E379 IonicContact CZ-OE1 3.29Å; R353-E379 IonicContact CZ-OE2 3.68Å; R353-E379 IonicContact NE-OE1 2.82Å; R353-E379 IonicContact NE-OE2 3.43Å; R353-E379 PolarHBondContact NE-OE2 2.84Å; R353-E379 VanDerWaalsContact NE-OE2 3.14Å; R353-E379 IonicContact NH1-OE1 2.78Å; R353-E379 PolarHBondContact NH1-OE1 3.25Å; R353-E379 IonicContact NH1-OE2 3.81Å; R353-E379 PolarHBondContact NH1-OE2 2.7Å; R353-E379 IonicContact NH2-OE2 2.79Å; L354-E379 CarbonylContact C-O 3.2Å; L354-E379 WeakPolarHBondContact CA-O 3.37Å; L354-E379 WeakPolarHBondContact CB-O 3.36Å; L354-E379 PolarHBondContact N-O 3.42Å; D355-E379 PolarHBondContact N-O 3.36Å; I377-E379 HydrophobicContact CG2-CG 3.86Å
380	I	88.5	Confident	93.6	Very high	59 Å²	59	69.2 Å²	69.2	30%	0.303	34%	0.341	S	S	.	.			trans	-134.9	0	-176.1	-61.3	178.5	0	0	0	109.2	L354 D355 I359 V364 I378	L354-I380 HydrophobicContact CB-CG1 4.37Å; D355-I380 WeakPolarHBondContact CA-OXT 3.23Å; I359-I380 HydrophobicContact CD1-CG2 3.79Å; I359-I380 HydrophobicContact CG1-CG2 3.88Å; V364-I380 HydrophobicContact CG2-CD1 3.13Å; I378-I380 HydrophobicContact CG2-CD1 4.06Å; I378-I380 HydrophobicContact CG2-CG1 4.06Å

Retrieved 380 of 380 residues in 372 ms (Link to these results)

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