A0A096NIL9_PAPAN Loading...

Collectin-11

Lectin that plays a role in innate immunity, apoptosis and embryogenesis. Calcium-dependent lectin that binds self and non-self glycoproteins presenting high mannose oligosaccharides with at least one terminal alpha-1,2-linked mannose epitope. Primarily recognizes the terminal disaccharide of the glycan. Also recognizes a subset of fucosylated glycans and lipopolysaccharides. Plays a role in innate immunity through its ability to bind non-self sugars presented by microorganisms and to activate the complement through the recruitment of MAPS1. Also plays a role in apoptosis through its ability to bind in a calcium-independent manner the DNA present at the surface of apoptotic cells and to activate the complement in response to this binding. Finally, plays a role in development, probably serving as a guidance cue during the migration of neural crest cells and other cell types during embryogenesis.

AlphaFold DB , UniProt , Accession A0A096NIL9, Species PAPAN (Papio anubis, Olive baboon), Gene COLEC11, Length 304 aa.

Structure Viewer

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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	41	Very low	39.4	Very low	246 Å²	246	173.5 Å²	173.5	100%	1.212	90%	0.902	S	S	*	*				0	99.8	0	-71.2	173.5	-178.6	0	0	108.7
2	R	32.7	Very low	39.5	Very low	252 Å²	252	167.3 Å²	167.3	95%	0.951	90%	0.895	S	S	*	*	P	Polyproline II helix	trans	-92.5	124.7	173.1	-76.1	-177.7	176	-171.7	-1.1	108
3	R	38.7	Very low	39.5	Very low	250 Å²	250	165.1 Å²	165.1	94%	0.943	89%	0.892	S	S	*	*	P	Polyproline II helix	trans	-96.1	133	171.8	-81.5	-170.1	-179.6	-154.5	1.4	110
4	L	38.3	Very low	39.1	Very low	182 Å²	182	165.3 Å²	165.3	95%	0.953	89%	0.892	S	S	*	*	P	Polyproline II helix	trans	-74.3	151.8	170.1	-75.5	146.5	0	0	0	111.4
5	G	38.5	Very low	38.7	Very low	69 Å²	69	157.5 Å²	157.5	71%	0.711	87%	0.866	S	S	*	*			trans	-179.1	89	163.7	0	0	0	0	0	109.5
6	Q	41.2	Very low	38.4	Very low	197 Å²	197	156.8 Å²	156.8	92%	0.921	87%	0.868	S	S	*	*				69.2	115.9	94.5	-78.1	-178.7	19	0	0	115.3
7	C	32.2	Very low	38.1	Very low	126 Å²	126	155.2 Å²	155.2	85%	0.851	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-77.3	147.2	171.4	-61.3	0	0	0	0	112.2
8	P	48.2	Very low	37.7	Very low	129 Å²	129	160.3 Å²	160.3	84%	0.838	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-86.9	139.1	165.9	32	-27.9	0	0	0	112.1
9	R	37.3	Very low	37.4	Very low	254 Å²	254	157.6 Å²	157.6	96%	0.958	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-85	134.3	169.2	-66.3	179.2	-161.3	-171	3.4	109.8
10	G	40.8	Very low	37.7	Very low	69 Å²	69	155 Å²	155	71%	0.711	86%	0.855	S	S	*	*			trans	-108.5	157.8	164.3	0	0	0	0	0	111.1
11	P	44.4	Very low	37.3	Very low	135 Å²	135	154.8 Å²	154.8	88%	0.877	85%	0.853	S	S	*	*			trans	-85.8	157.3	-160.6	34.7	-34.3	0	0	0	113.9
12	A	40.3	Very low	36.8	Very low	99 Å²	99	147.1 Å²	147.1	82%	0.818	83%	0.828	S	S	*	*			trans	-92.3	130.2	175.8	0	0	0	0	0	111.3
13	T	39.2	Very low	36.7	Very low	138 Å²	138	141.5 Å²	141.5	85%	0.847	83%	0.827	S	S	*	*			trans	-150.1	113.7	156.8	51.5	0	0	0	0	110.8
14	D	34.4	Very low	36.4	Very low	168 Å²	168	135.7 Å²	135.7	90%	0.898	82%	0.824	S	S	*	*			trans	45.7	130.1	134.3	-150.3	15.9	0	0	0	123.1
15	G	33.2	Very low	36.1	Very low	49 Å²	49	130 Å²	130	51%	0.505	81%	0.809	S	S	.	*				89.1	95.3	120.4	0	0	0	0	0	120.1
16	T	34.6	Very low	35.7	Very low	145 Å²	145	134.4 Å²	134.4	89%	0.89	82%	0.822	S	S	*	*			trans	71	132.3	150.7	57.6	0	0	0	0	120.5
17	P	33	Very low	35.3	Very low	130 Å²	130	127.9 Å²	127.9	84%	0.844	81%	0.808	S	S	*	*			trans	-96.5	135.6	176.8	36	-28.5	0	0	0	112
18	R	29.7	Very low	35.4	Very low	248 Å²	248	129.1 Å²	129.1	94%	0.936	81%	0.811	S	S	*	*			trans	-131.9	113.5	161	-119.4	-179.2	-166	-179	4.7	109.8
19	S	33.6	Very low	34.7	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	81%	0.812	S	S	*	*			trans	-64.4	154.4	158.7	-157	0	0	0	0	109.3
20	P	42.7	Very low	34.7	Very low	104 Å²	104	123.7 Å²	123.7	68%	0.675	80%	0.799	S	S	*	*				-151.8	140.6	88.4	38.7	-20.1	0	0	0	114.3
21	N	30.2	Very low	34.5	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	80%	0.804	S	S	*	*				145.1	148.9	102.8	-92.1	-22.5	0	0	0	104.9
22	A	29.9	Very low	34	Very low	84 Å²	84	126.8 Å²	126.8	69%	0.694	81%	0.805	S	S	*	*			cis	-172.5	142.8	-6.7	0	0	0	0	0	104.3
23	C	29.7	Very low	33.7	Very low	135 Å²	135	133.1 Å²	133.1	91%	0.912	81%	0.808	S	S	*	*			trans	-160.1	117.4	147.1	-107.8	0	0	0	0	108.9
24	S	33.3	Very low	33.7	Very low	128 Å²	128	135.4 Å²	135.4	90%	0.895	81%	0.811	S	S	*	*			trans	-41.3	154.6	169	-51	0	0	0	0	113.3
25	G	31.6	Very low	33.8	Very low	62 Å²	62	139 Å²	139	64%	0.639	81%	0.812	S	S	*	*			cis	153.7	149.5	7.5	0	0	0	0	0	109
26	V	31.1	Very low	33.8	Very low	161 Å²	161	139.7 Å²	139.7	98%	0.976	82%	0.819	S	S	*	*			trans	67.8	134	155.4	-159.7	0	0	0	0	115.9
27	G	31.6	Very low	34	Very low	61 Å²	61	140.1 Å²	140.1	63%	0.629	82%	0.816	S	S	*	*			cis	-179.3	156.9	6.2	0	0	0	0	0	108.4
28	V	34.7	Very low	34.3	Very low	151 Å²	151	142.4 Å²	142.4	92%	0.915	82%	0.82	S	S	*	*			trans	-67.4	135.5	-178.7	176.6	0	0	0	0	110.7
29	L	33.1	Very low	35	Very low	163 Å²	163	135 Å²	135	85%	0.853	81%	0.812	S	S	*	*			trans	-117	141.5	165.9	-95.5	151.5	0	0	0	109.8
30	P	38.1	Very low	35.8	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	82%	0.82	S	S	*	*			trans	-90.1	165.5	-170.8	36.4	-32.2	0	0	0	113.2
31	A	37	Very low	35.8	Very low	99 Å²	99	138.4 Å²	138.4	82%	0.818	83%	0.83	S	S	*	*			trans	-51.9	134.2	174	0	0	0	0	0	113.6
32	L	33.7	Very low	36.6	Very low	169 Å²	169	134.4 Å²	134.4	89%	0.885	83%	0.825	S	S	*	*			trans	-127.2	102.6	166.7	-131.2	87	0	0	0	111.5
33	R	33.1	Very low	37.5	Very low	233 Å²	233	136.4 Å²	136.4	88%	0.879	83%	0.828	S	S	*	*			trans	4	122.9	143.7	-147.8	170.9	-169.5	167.5	1.9	118.1
34	M	38.8	Very low	38.1	Very low	186 Å²	186	137.6 Å²	137.6	92%	0.916	83%	0.825	S	S	*	*			trans	-67.5	136.2	164.3	-72.6	-166.5	119.4	0	0	113
35	R	36.3	Very low	38.8	Very low	242 Å²	242	139.4 Å²	139.4	91%	0.913	82%	0.822	S	S	*	*			trans	-179.6	117.7	152.7	-98.7	167.3	-177.1	-144.4	-0.9	104.6
36	G	33.3	Very low	39.7	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	83%	0.828	S	S	*	*				111.5	120.9	71.2	0	0	0	0	0	107.2
37	D	39.5	Very low	40.5	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	82%	0.821	S	S	*	*			trans	72.5	111.5	165.1	-51.7	-46.5	0	0	0	119.3
38	L	40.1	Very low	41.4	Very low	177 Å²	177	142.7 Å²	142.7	93%	0.927	83%	0.825	S	S	*	*				-170.5	81.2	125.5	-119.8	82.5	0	0	0	110
39	A	44.5	Very low	42	Very low	93 Å²	93	145.6 Å²	145.6	77%	0.769	83%	0.826	S	S	*	*			trans	-80.6	107.2	158	0	0	0	0	0	107.8
40	L	48.9	Very low	42.5	Very low	177 Å²	177	146 Å²	146	93%	0.927	83%	0.828	S	S	*	*			trans	-178.7	57.7	153.9	-125	81.9	0	0	0	112.7
41	A	44.1	Very low	42.8	Very low	107 Å²	107	145.8 Å²	145.8	88%	0.884	83%	0.829	S	S	*	*	S	Bend	trans	-151.9	18.8	172.5	0	0	0	0	0	115.3
42	G	45.8	Very low	43.4	Very low	69 Å²	69	149.3 Å²	149.3	71%	0.711	83%	0.833	S	S	*	*	S	Bend	trans	-128	18.8	-171.8	0	0	0	0	0	115.9
43	V	50	Low	43.7	Very low	125 Å²	125	149.1 Å²	149.1	76%	0.758	83%	0.832	S	S	*	*	S	Bend	trans	-116.5	0.1	-173.8	-176	0	0	0	0	113.4
44	L	42.3	Very low	44.1	Very low	161 Å²	161	143.9 Å²	143.9	84%	0.843	83%	0.828	S	S	*	*	S	Bend	trans	-106.1	8	-176.7	-69.2	173.9	0	0	0	115.5
45	I	47.8	Very low	44.3	Very low	165 Å²	165	141.1 Å²	141.1	85%	0.846	83%	0.827	S	S	*	*	S	Bend	trans	-114.6	29.9	177.5	-46.5	176.2	0	0	0	111.3
46	S	49.5	Very low	44.5	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	82%	0.816	S	S	*	*	S	Bend	trans	-124.4	3.1	172.9	-66.8	0	0	0	0	115.1
47	L	48.9	Very low	44.8	Very low	160 Å²	160	138.1 Å²	138.1	84%	0.838	82%	0.824	S	S	*	*	S	Bend	trans	-115.1	9	-177.6	-76.1	167.8	0	0	0	115.2
48	A	50	Low	44.7	Very low	86 Å²	86	136.4 Å²	136.4	71%	0.711	82%	0.822	S	S	*	*	S	Bend	trans	-120.3	18	-178	0	0	0	0	0	114.9
49	F	47.4	Very low	44.7	Very low	211 Å²	211	136 Å²	136	93%	0.925	82%	0.815	S	S	*	*	S	Bend	trans	-120.5	15.7	176.8	-109.9	-86.8	0	0	0	113.8
50	L	43.9	Very low	44.5	Very low	172 Å²	172	137.6 Å²	137.6	90%	0.901	82%	0.817	S	S	*	*	S	Bend	trans	-118.3	39.2	-174.4	-144.4	87.8	0	0	0	113.5
51	S	44.3	Very low	43.9	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	81%	0.808	S	S	*	*	S	Bend	trans	-140.4	13	-179.8	49.9	0	0	0	0	116.4
52	L	49	Very low	43.7	Very low	172 Å²	172	131.3 Å²	131.3	90%	0.901	80%	0.797	S	S	*	*			trans	-136.7	74.1	173.4	-81.9	153.7	0	0	0	111.4
53	L	40	Very low	43.6	Very low	165 Å²	165	135.7 Å²	135.7	86%	0.864	80%	0.804	S	S	*	*			trans	-130.6	129.9	161.4	-86.9	162.7	0	0	0	109.1
54	P	42.6	Very low	43.2	Very low	123 Å²	123	137.6 Å²	137.6	80%	0.799	81%	0.81	S	S	*	*			trans	-65.8	142	179.6	-15.5	28.7	0	0	0	111.8	G56	P54-G56 PolarHBondContact O-N 3.47Å
55	S	42.3	Very low	43.2	Very low	128 Å²	128	133.4 Å²	133.4	90%	0.895	80%	0.799	S	S	*	*			trans	-66.6	85.9	174.8	-46.4	0	0	0	0	111.5
56	G	40.8	Very low	43.2	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	80%	0.797	S	S	*	*			trans	-85.8	110.4	164	0	0	0	0	0	109.9	P54 P58	P54-G56 PolarHBondContact O-N 3.47Å; G56-P58 WeakPolarHBondContact O-CD 3.45Å
57	H	39.3	Very low	43	Very low	177 Å²	177	130.5 Å²	130.5	82%	0.819	79%	0.792	S	S	*	*			trans	-54.3	124.9	164.7	-99	42.5	0	0	0	109.9	Q59	H57-Q59 PolarHBondContact O-N 3.45Å
58	P	37.4	Very low	43	Very low	120 Å²	120	128.8 Å²	128.8	78%	0.779	79%	0.788	S	S	*	*			trans	-79	103.4	156.6	12.4	4.5	0	0	0	106.6	G56	G56-P58 WeakPolarHBondContact O-CD 3.45Å
59	Q	40.7	Very low	42.7	Very low	169 Å²	169	131.6 Å²	131.6	79%	0.79	79%	0.786	S	S	*	*			trans	-62	134.6	158.9	-65.3	-160.8	-84.1	0	0	107.4	H57 A61	H57-Q59 PolarHBondContact O-N 3.45Å; Q59-A61 PolarHBondContact O-N 3.17Å
60	P	39.1	Very low	43	Very low	125 Å²	125	129.1 Å²	129.1	81%	0.812	78%	0.781	S	S	*	*			trans	-63.7	112	160.2	-3.8	19.2	0	0	0	105.8	G62	P60-G62 PolarHBondContact O-N 2.89Å
61	A	37.3	Very low	43.1	Very low	89 Å²	89	127.4 Å²	127.4	74%	0.736	77%	0.772	S	S	*	*			trans	-50.2	123.4	158.5	0	0	0	0	0	106.2	Q59 D63	Q59-A61 PolarHBondContact O-N 3.17Å; A61-D63 PolarHBondContact O-N 3.24Å
62	G	39.3	Very low	43.1	Very low	64 Å²	64	128 Å²	128	66%	0.66	77%	0.771	S	S	*	*			trans	-53.2	129.1	172.1	0	0	0	0	0	107.9	P60 D64	P60-G62 PolarHBondContact O-N 2.89Å; G62-D64 VanDerWaalsContact C-N 3.28Å; G62-D64 PolarHBondContact O-N 3.3Å
63	D	42.9	Very low	43.6	Very low	161 Å²	161	125.4 Å²	125.4	86%	0.861	76%	0.764	S	S	*	*			trans	-53.7	97.7	165.8	-74.7	-43.2	0	0	0	107.6	A61 A65	A61-D63 PolarHBondContact O-N 3.24Å; D63-A65 PolarHBondContact O-N 3.3Å
64	D	43.3	Very low	44.1	Very low	164 Å²	164	121.1 Å²	121.1	88%	0.877	76%	0.76	S	S	*	*			trans	-69.7	72.4	159.2	-83.8	-32.8	0	0	0	106.9	G62 C66	G62-D64 VanDerWaalsContact C-N 3.28Å; G62-D64 PolarHBondContact O-N 3.3Å; D64-C66 PolarHBondContact O-N 3.38Å
65	A	41.7	Very low	44.5	Very low	74 Å²	74	123.4 Å²	123.4	61%	0.612	77%	0.765	S	S	*	*			trans	-59.1	98.3	155	0	0	0	0	0	106.1	D63 S67	D63-A65 PolarHBondContact O-N 3.3Å; A65-S67 PolarHBondContact O-N 3.33Å
66	C	47.2	Very low	45.1	Very low	120 Å²	120	127 Å²	127	81%	0.811	76%	0.764	S	S	*	*			trans	-58	79.3	155.6	-89.6	0	0	0	0	107.8	D64 V68	D64-C66 PolarHBondContact O-N 3.38Å; C66-V68 VanDerWaalsContact C-N 3.27Å; C66-V68 PolarHBondContact O-N 3.42Å
67	S	45.2	Very low	45.9	Very low	92 Å²	92	126.9 Å²	126.9	64%	0.643	76%	0.763	S	S	*	*			trans	-68.6	95.4	163.8	-62.7	0	0	0	0	105.4	A65 Q69	A65-S67 PolarHBondContact O-N 3.33Å; S67-Q69 PolarHBondContact O-N 3.18Å
68	V	49.1	Very low	46.9	Very low	123 Å²	123	126.3 Å²	126.3	75%	0.745	77%	0.766	S	S	*	*			trans	-65.3	81.5	169.5	-178.9	0	0	0	0	107.4	C66 I70	C66-V68 VanDerWaalsContact C-N 3.27Å; C66-V68 PolarHBondContact O-N 3.42Å; V68-I70 HydrophobicContact CG1-CG1 4.13Å
69	Q	44.6	Very low	47.9	Very low	145 Å²	145	125.4 Å²	125.4	68%	0.678	77%	0.769	S	S	*	*			trans	-89.7	98.2	160.6	-79.3	-176.3	13.6	0	0	107.2	S67 L71	S67-Q69 PolarHBondContact O-N 3.18Å; Q69-L71 VanDerWaalsContact C-N 3.29Å; Q69-L71 HydrophobicContact CB-CD1 3.91Å; Q69-L71 HydrophobicContact CB-CG 4.17Å; Q69-L71 PolarHBondContact O-N 3.13Å
70	I	53.4	Low	48.8	Very low	159 Å²	159	120.8 Å²	120.8	82%	0.815	77%	0.766	S	S	*	*			trans	-61.8	96.9	160.8	-64.2	167.4	0	0	0	106.2	V68	V68-I70 HydrophobicContact CG1-CG1 4.13Å
71	L	45	Very low	50.1	Low	137 Å²	137	124.3 Å²	124.3	72%	0.717	77%	0.772	S	S	*	*			trans	-96	107.9	179.3	-87.2	148.6	0	0	0	110.3	Q69	Q69-L71 VanDerWaalsContact C-N 3.29Å; Q69-L71 HydrophobicContact CB-CD1 3.91Å; Q69-L71 HydrophobicContact CB-CG 4.17Å; Q69-L71 PolarHBondContact O-N 3.13Å
72	V	46.2	Very low	51.3	Low	114 Å²	114	129.8 Å²	129.8	69%	0.691	78%	0.779	S	S	*	*			trans	-40.9	148.1	154.7	179.5	0	0	0	0	110.2	G74	V72-G74 PolarHBondContact O-N 3.27Å
73	P	58.1	Low	52.4	Low	118 Å²	118	129.9 Å²	129.9	77%	0.766	78%	0.78	S	S	*	*	S	Bend	trans	-45.6	131.5	176.8	-28.9	34.4	0	0	0	112.2	L75	P73-L75 PolarHBondContact O-N 3.26Å
74	G	49.9	Very low	53.4	Low	75 Å²	75	130.1 Å²	130.1	77%	0.773	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-49.8	131.9	-172.9	0	0	0	0	0	112.8	V72 K76	V72-G74 PolarHBondContact O-N 3.27Å; G74-K76 PolarHBondContact O-N 3.41Å
75	L	51	Low	54.5	Low	172 Å²	172	132.1 Å²	132.1	90%	0.901	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.1	134.7	176.9	-66.7	170.3	0	0	0	109.7	P73 G77	P73-L75 PolarHBondContact O-N 3.26Å; L75-G77 PolarHBondContact O-N 3.44Å
76	K	55.6	Low	55.5	Low	202 Å²	202	131.8 Å²	131.8	88%	0.878	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-53.5	124.8	173.4	179.9	176.6	179.1	175.8	0	108.5	G74	G74-K76 PolarHBondContact O-N 3.41Å
77	G	57.4	Low	56.3	Low	64 Å²	64	130.7 Å²	130.7	66%	0.66	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-53.2	145.6	179	0	0	0	0	0	112	L75	L75-G77 PolarHBondContact O-N 3.44Å
78	D	60.2	Low	57.4	Low	165 Å²	165	132.4 Å²	132.4	88%	0.882	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-55.4	147.8	-179.4	-67.8	-61.4	0	0	0	111.8	G80	D78-G80 PolarHBondContact O-N 3.23Å
79	A	58.1	Low	58	Low	101 Å²	101	130 Å²	130	84%	0.835	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-61.9	131.4	176.5	0	0	0	0	0	109.9
80	G	60.6	Low	59	Low	72 Å²	72	134.5 Å²	134.5	74%	0.742	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-55.4	148.2	179.9	0	0	0	0	0	112.6	D78 K82	D78-G80 PolarHBondContact O-N 3.23Å; G80-K82 PolarHBondContact O-N 3.05Å
81	E	65.7	Low	59.7	Low	200 Å²	200	133 Å²	133	94%	0.935	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-56.4	136.4	179.1	-71.3	-170.8	123.8	0	0	111.2	G83	E81-G83 PolarHBondContact O-N 3.21Å
82	K	62.9	Low	60.7	Low	203 Å²	203	130 Å²	130	88%	0.883	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65.7	124.4	179.5	-175.1	178.6	-176.9	174.9	0	109.1	G80	G80-K82 PolarHBondContact O-N 3.05Å
83	G	63.2	Low	61.5	Low	66 Å²	66	136.6 Å²	136.6	68%	0.68	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-54.8	149.1	179	0	0	0	0	0	113.6	E81	E81-G83 PolarHBondContact O-N 3.21Å
84	D	64.3	Low	62.1	Low	166 Å²	166	138 Å²	138	89%	0.888	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-58.3	148.4	-178.9	-69.7	-47.6	0	0	0	112.8	G86	D84-G86 PolarHBondContact O-N 3.5Å
85	K	66.1	Low	62.5	Low	207 Å²	207	137 Å²	137	90%	0.9	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.2	128.5	-180	-167.1	178.2	-174.4	179.4	0	110.4
86	G	62.9	Low	63.1	Low	66 Å²	66	135.1 Å²	135.1	68%	0.68	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-55.2	149.5	176	0	0	0	0	0	113.4	D84	D84-G86 PolarHBondContact O-N 3.5Å
87	A	63.1	Low	63.7	Low	97 Å²	97	132.3 Å²	132.3	80%	0.802	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-60.8	148.6	-179.3	0	0	0	0	0	112.4
88	P	67.8	Low	64.1	Low	128 Å²	128	132.6 Å²	132.6	83%	0.831	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-57.5	139.6	177.7	-23.7	33.4	0	0	0	113.1
89	G	62.5	Low	64.4	Low	74 Å²	74	134.2 Å²	134.2	76%	0.763	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-61.3	148.9	177.2	0	0	0	0	0	112.9
90	R	65.1	Low	64.6	Low	239 Å²	239	139.3 Å²	139.3	90%	0.902	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-68	144.4	179	-64.7	-177.9	-179.6	-166	0.2	110.9
91	P	69.2	Low	64.5	Low	127 Å²	127	139 Å²	139	83%	0.825	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-55.9	140	175.1	-24.3	33.5	0	0	0	112.6
92	G	64.5	Low	64.3	Low	75 Å²	75	137.9 Å²	137.9	77%	0.773	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-63.9	152.9	177.9	0	0	0	0	0	112.9
93	R	63.1	Low	63.9	Low	252 Å²	252	135.3 Å²	135.3	95%	0.951	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-70.1	138.2	177.7	-66.2	-174.1	178.3	-141.5	1.4	110.6	G95	R93-G95 PolarHBondContact O-N 3.41Å
94	V	71	Confident	63.4	Low	146 Å²	146	135.1 Å²	135.1	89%	0.885	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.1	130	174.7	-179.5	0	0	0	0	109.3
95	G	59.5	Low	62.7	Low	56 Å²	56	135.3 Å²	135.3	58%	0.577	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.4	153.8	179.2	0	0	0	0	0	112.9	R93	R93-G95 PolarHBondContact O-N 3.41Å
96	P	63.6	Low	61.9	Low	132 Å²	132	135.4 Å²	135.4	86%	0.857	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-66.9	144.1	-179	27.1	-33.3	0	0	0	112.4	G98	P96-G98 PolarHBondContact O-N 3.45Å
97	T	68.2	Low	61.3	Low	142 Å²	142	135.5 Å²	135.5	87%	0.871	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-63.8	125.6	175.3	-53.4	0	0	0	0	110.4
98	G	65.9	Low	60.3	Low	70 Å²	70	140.9 Å²	140.9	72%	0.722	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-66.4	144.8	179.6	0	0	0	0	0	113.3	P96	P96-G98 PolarHBondContact O-N 3.45Å
99	E	66.4	Low	59.6	Low	199 Å²	199	145.1 Å²	145.1	93%	0.93	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-68.1	145.7	-178.3	-67	-178.2	120	0	0	112.9
100	K	61.8	Low	58.8	Low	209 Å²	209	145 Å²	145	91%	0.909	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-81.5	128.2	-177.9	-172.6	-179.6	-174.2	180	0	109.8
101	G	57.8	Low	58	Low	66 Å²	66	139.4 Å²	139.4	68%	0.68	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-78.7	164.2	-171.6	0	0	0	0	0	116.4
102	D	60.8	Low	57.1	Low	175 Å²	175	140.6 Å²	140.6	94%	0.936	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-88.1	151.1	172.5	-64.1	-48.3	0	0	0	112.2
103	V	54.5	Low	56.3	Low	150 Å²	150	140.3 Å²	140.3	91%	0.909	84%	0.835	S	S	*	*			trans	-114.6	136.2	-170.7	168.3	0	0	0	0	112
104	G	52.9	Low	55.7	Low	62 Å²	62	140.3 Å²	140.3	64%	0.639	84%	0.835	S	S	*	*			trans	104.9	139.6	151.7	0	0	0	0	0	116.8
105	D	50.8	Low	55	Low	169 Å²	169	142.4 Å²	142.4	90%	0.904	84%	0.835	S	S	*	*			cis	-151.9	162	28	-89.6	-41.1	0	0	0	116.6
106	K	49.6	Very low	54.7	Low	209 Å²	209	143.2 Å²	143.2	91%	0.909	84%	0.844	S	S	*	*			trans	-37.2	152.8	179.7	-81.2	164.3	166.1	166.1	0	118.4
107	G	49.3	Very low	54.2	Low	69 Å²	69	146.6 Å²	146.6	71%	0.711	85%	0.845	S	S	*	*			cis	163.7	165.8	1.9	0	0	0	0	0	112.9
108	Q	41.4	Very low	53.8	Low	210 Å²	210	147.8 Å²	147.8	98%	0.981	84%	0.844	S	S	*	*			trans	-173.9	155	141.5	-104.2	-175.7	47	0	0	109.6
109	K	53.4	Low	53.2	Low	216 Å²	216	146.9 Å²	146.9	94%	0.939	84%	0.835	S	S	*	*			trans	-72	137.3	-154.9	-167.2	176.8	-173.7	177.8	0	114.8
110	G	46.6	Very low	53	Low	72 Å²	72	143.6 Å²	143.6	74%	0.742	83%	0.831	S	S	*	*			trans	-150.5	151.4	170.2	0	0	0	0	0	112.3
111	S	47.1	Very low	53.1	Low	122 Å²	122	141.4 Å²	141.4	85%	0.853	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-51.4	147.6	-163	37.6	0	0	0	0	118.4
112	V	51.6	Low	53	Low	151 Å²	151	141.3 Å²	141.3	92%	0.915	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-49.7	132.1	176.6	170.7	0	0	0	0	112.2
113	G	46.7	Very low	53.1	Low	70 Å²	70	138.7 Å²	138.7	72%	0.722	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.5	147.1	-169.1	0	0	0	0	0	115.7
114	R	51.9	Low	53.6	Low	251 Å²	251	141.4 Å²	141.4	95%	0.947	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-90	135.7	159.1	-113.8	178.5	173.3	-175	-2.3	108.4
115	H	55.3	Low	54	Low	190 Å²	190	141.5 Å²	141.5	88%	0.88	82%	0.822	S	S	*	*			trans	-41.6	140.5	-177.2	-96.2	52.6	0	0	0	114.3
116	G	53.5	Low	54.7	Low	74 Å²	74	142.8 Å²	142.8	76%	0.763	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-54.6	136.6	178.5	0	0	0	0	0	112	I118	G116-I118 PolarHBondContact O-N 3.3Å
117	K	52.4	Low	55.5	Low	203 Å²	203	142.2 Å²	142.2	88%	0.883	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.7	130.1	177.3	-47.7	-176.5	-172.6	-175.6	0	107.7	G119	K117-G119 PolarHBondContact O-N 3.44Å
118	I	60	Low	56.2	Low	166 Å²	166	142 Å²	142	85%	0.851	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-47	127.1	170.6	-68	165.1	0	0	0	107.7	G116	G116-I118 PolarHBondContact O-N 3.3Å
119	G	54.3	Low	57.4	Low	51 Å²	51	139.7 Å²	139.7	53%	0.526	81%	0.812	S	S	.	*	P	Polyproline II helix	trans	-55.1	146.9	179	0	0	0	0	0	110.6	K117 I121	K117-G119 PolarHBondContact O-N 3.44Å; G119-I121 PolarHBondContact O-N 2.83Å
120	P	62.3	Low	57.9	Low	130 Å²	130	134.8 Å²	134.8	84%	0.844	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-55.6	131.6	-178.7	23.2	-32.1	0	0	0	109.9	G122	P120-G122 PolarHBondContact O-N 3.36Å
121	I	62	Low	58.7	Low	164 Å²	164	134.8 Å²	134.8	84%	0.841	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-51.6	123.4	168.2	-71.3	169.5	0	0	0	106.8	G119 S123	G119-I121 PolarHBondContact O-N 2.83Å; I121-S123 PolarHBondContact O-N 2.8Å
122	G	57.1	Low	59.8	Low	63 Å²	63	136.7 Å²	136.7	65%	0.649	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-51.8	136.9	177.5	0	0	0	0	0	110.2	P120 K124	P120-G122 PolarHBondContact O-N 3.36Å; G122-K124 PolarHBondContact O-N 3.38Å
123	S	62.8	Low	60.8	Low	120 Å²	120	137.7 Å²	137.7	84%	0.839	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-52.2	130.1	179.4	39.7	0	0	0	0	110	I121 G125	I121-S123 PolarHBondContact O-N 2.8Å; S123-G125 PolarHBondContact O-N 2.81Å; S123-G125 VanDerWaalsContact O-N 3.13Å
124	K	64.6	Low	61.7	Low	207 Å²	207	136.8 Å²	136.8	90%	0.9	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-54	121	171.2	-176.4	176.3	-178.2	175.5	0	107.3	G122	G122-K124 PolarHBondContact O-N 3.38Å
125	G	61.1	Low	62.8	Low	65 Å²	65	130.6 Å²	130.6	67%	0.67	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-52.4	143.8	-179.2	0	0	0	0	0	111.4	S123 K127	S123-G125 PolarHBondContact O-N 2.81Å; S123-G125 VanDerWaalsContact O-N 3.13Å; G125-K127 PolarHBondContact O-N 3.29Å
126	E	66.3	Low	64	Low	196 Å²	196	127.6 Å²	127.6	92%	0.916	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-54.5	135.6	179.3	-66.9	-179.8	138.8	0	0	110	G128	E126-G128 PolarHBondContact O-N 3.25Å
127	K	66.5	Low	64.9	Low	196 Å²	196	126.8 Å²	126.8	85%	0.852	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.4	119.2	174.3	-176.3	-176.9	-178	-174.8	0	106.5	G125	G125-K127 PolarHBondContact O-N 3.29Å
128	G	62.6	Low	66	Low	64 Å²	64	123.2 Å²	123.2	66%	0.66	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-51.8	143.5	176.8	0	0	0	0	0	111.2	E126	E126-G128 PolarHBondContact O-N 3.25Å
129	D	67.8	Low	66.8	Low	162 Å²	162	123.2 Å²	123.2	87%	0.866	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-52.8	140.7	-176.4	-61.6	-49	0	0	0	111.3	G131	D129-G131 PolarHBondContact O-N 2.9Å
130	S	64	Low	67.5	Low	114 Å²	114	124.2 Å²	124.2	80%	0.797	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.2	130.5	170.5	-92.3	0	0	0	0	108.4
131	G	62.1	Low	68	Low	71 Å²	71	127 Å²	127	73%	0.732	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-56	147.9	172.5	0	0	0	0	0	111.4	D129	D129-G131 PolarHBondContact O-N 2.9Å
132	D	71.2	Confident	68.5	Low	163 Å²	163	125.3 Å²	125.3	87%	0.872	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-56.8	143.7	-177.1	-61.7	-49.6	0	0	0	111.8	G134	D132-G134 PolarHBondContact O-N 3.21Å
133	I	72.3	Confident	68.6	Low	171 Å²	171	125.7 Å²	125.7	88%	0.877	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61	127.1	175.3	-62.8	171.7	0	0	0	107.9
134	G	65	Low	68.8	Low	51 Å²	51	128 Å²	128	53%	0.526	79%	0.793	S	S	.	*	P	Polyproline II helix	trans	-56.2	151.9	177.1	0	0	0	0	0	111.9	D132	D132-G134 PolarHBondContact O-N 3.21Å
135	P	75.7	Confident	68.8	Low	122 Å²	122	123.2 Å²	123.2	79%	0.792	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.1	146.4	-179.1	24.9	-33.4	0	0	0	110.9	G137	P135-G137 PolarHBondContact O-N 2.68Å
136	P	79.4	Confident	69	Low	126 Å²	126	125.4 Å²	125.4	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-51.7	139.1	172.2	-25.1	33.8	0	0	0	111.1
137	G	72.6	Confident	69	Low	57 Å²	57	120.9 Å²	120.9	59%	0.588	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.4	155.1	174.8	0	0	0	0	0	111.6	P135 N139	P135-G137 PolarHBondContact O-N 2.68Å; G137-N139 PolarHBondContact O-N 3.24Å
138	P	75.6	Confident	69	Low	129 Å²	129	115.5 Å²	115.5	84%	0.838	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-58.6	141.8	176.7	25.8	-33.2	0	0	0	110.1	G140	P138-G140 PolarHBondContact O-N 3.4Å
139	N	76.8	Confident	69.7	Low	165 Å²	165	116 Å²	116	88%	0.882	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-57.6	136.2	171.9	-77.1	-22.1	0	0	0	109.2	G137	G137-N139 PolarHBondContact O-N 3.24Å
140	G	70.2	Confident	70.5	Confident	72 Å²	72	114.3 Å²	114.3	74%	0.742	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-57.9	152.7	173.9	0	0	0	0	0	111.5	P138	P138-G140 PolarHBondContact O-N 3.4Å
141	E	73.1	Confident	71.4	Confident	190 Å²	190	114.2 Å²	114.2	89%	0.888	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-59.3	141.7	179.8	-64.4	-170.3	141.2	0	0	111	G143	E141-G143 PolarHBondContact O-N 3.45Å
142	P	71.9	Confident	72.6	Confident	128 Å²	128	120.5 Å²	120.5	83%	0.831	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-53.9	133.7	173.8	-23.9	33.2	0	0	0	111
143	G	60	Low	73.4	Confident	71 Å²	71	119.4 Å²	119.4	73%	0.732	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-59.1	142.9	172.6	0	0	0	0	0	111.2	E141	E141-G143 PolarHBondContact O-N 3.45Å
144	L	65.6	Low	74.2	Confident	168 Å²	168	113.7 Å²	113.7	88%	0.88	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-59.4	131.8	177.9	-68.7	169.9	0	0	0	110.1	C146	L144-C146 PolarHBondContact O-N 3.28Å
145	P	65.1	Low	75.4	Confident	107 Å²	107	115 Å²	115	70%	0.695	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-64	121	179.6	23.5	-30.3	0	0	0	110.1	E147	P145-E147 PolarHBondContact O-N 2.94Å
146	C	64.4	Low	76.1	Confident	110 Å²	110	110.5 Å²	110.5	74%	0.743	66%	0.66	S	S	*	*			trans	-75.7	105.7	169.1	52.5	0	0	0	0	108.9	L144 C148	L144-C146 PolarHBondContact O-N 3.28Å; C146-C148 PolarHBondContact O-N 3.02Å
147	E	67.6	Low	76.8	Confident	102 Å²	102	109.5 Å²	109.5	48%	0.477	64%	0.644	S	S	.	*			trans	-71.8	61.2	174.8	-73.7	-83.5	142.1	0	0	111	P145 S149 Q150	P145-E147 PolarHBondContact O-N 2.94Å; E147-S149 PolarHBondContact O-N 3.19Å; E147-S149 PolarHBondContact OE2-OG 3.28Å; E147-Q150 HydrophobicContact CB-CB 4.47Å; E147-Q150 HydrophobicContact CB-CG 4.2Å; E147-Q150 PolarHBondContact O-N 2.97Å; E147-Q150 VanDerWaalsContact OE2-CD 3.32Å; E147-Q150 WeakPolarHBondContact OE2-CG 3.34Å; E147-Q150 PolarHBondContact OE2-NE2 3.3Å
148	C	65.3	Low	77.6	Confident	83 Å²	83	111.6 Å²	111.6	56%	0.561	64%	0.64	S	S	*	*	H	α-helix	trans	-61.5	-20.4	172.2	-73.2	0	0	0	0	112.3	C146 R152	C146-C148 PolarHBondContact O-N 3.02Å; C148-R152 WeakPolarHBondContact O-CB 3.44Å; C148-R152 PolarHBondContact O-N 2.99Å
149	S	77.5	Confident	78.4	Confident	73 Å²	73	110 Å²	110	51%	0.51	62%	0.624	S	S	.	*	H	α-helix	trans	-62.2	-46.7	174.4	44.4	0	0	0	0	112.4	E147 K153	E147-S149 PolarHBondContact O-N 3.19Å; E147-S149 PolarHBondContact OE2-OG 3.28Å; S149-K153 WeakPolarHBondContact O-CB 3.4Å; S149-K153 PolarHBondContact O-N 2.79Å
150	Q	84.7	Confident	79.2	Confident	128 Å²	128	107.7 Å²	107.7	60%	0.598	61%	0.612	S	S	*	*	H	α-helix	trans	-68.1	-44.6	-179.4	-65.3	-178.4	12.6	0	0	110.9	E147 K153 A154	E147-Q150 HydrophobicContact CB-CB 4.47Å; E147-Q150 HydrophobicContact CB-CG 4.2Å; E147-Q150 PolarHBondContact O-N 2.97Å; E147-Q150 VanDerWaalsContact OE2-CD 3.32Å; E147-Q150 WeakPolarHBondContact OE2-CG 3.34Å; E147-Q150 PolarHBondContact OE2-NE2 3.3Å; Q150-K153 PolarHBondContact O-N 2.77Å; Q150-A154 PolarHBondContact O-N 2.94Å
151	L	84.2	Confident	80.3	Confident	112 Å²	112	110.4 Å²	110.4	59%	0.586	61%	0.605	S	S	*	*	H	α-helix	trans	-63.1	-44.5	176.8	-177.6	61	0	0	0	112	K153 A154 I155	L151-K153 VanDerWaalsContact C-N 3.29Å; L151-K153 PolarHBondContact O-N 3.25Å; L151-A154 PolarHBondContact O-N 2.88Å; L151-I155 HydrophobicContact CD1-CD1 4.32Å; L151-I155 HydrophobicContact CG-CD1 4.08Å; L151-I155 WeakPolarHBondContact O-CG1 3.2Å; L151-I155 PolarHBondContact O-N 3.45Å
152	R	85.9	Confident	81.3	Confident	203 Å²	203	105.2 Å²	105.2	77%	0.766	59%	0.586	S	S	*	*	H	α-helix	trans	-62.2	-37.7	176.6	-174	178.2	-173.5	175	3	112.1	C148 G156	C148-R152 WeakPolarHBondContact O-CB 3.44Å; C148-R152 PolarHBondContact O-N 2.99Å; R152-G156 PolarHBondContact O-N 3.37Å
153	K	89.6	Confident	82.3	Confident	140 Å²	140	102.8 Å²	102.8	61%	0.609	57%	0.572	S	S	*	*	H	α-helix	trans	-66.4	-45	176.3	-170.2	-178.5	177.7	-165.5	0	111.1	S149 Q150 L151 I155 G156 E157	S149-K153 WeakPolarHBondContact O-CB 3.4Å; S149-K153 PolarHBondContact O-N 2.79Å; Q150-K153 PolarHBondContact O-N 2.77Å; L151-K153 VanDerWaalsContact C-N 3.29Å; L151-K153 PolarHBondContact O-N 3.25Å; K153-I155 PolarHBondContact O-N 3.07Å; K153-G156 PolarHBondContact O-N 3.38Å; K153-E157 WeakPolarHBondContact CE-OE1 3.49Å; K153-E157 IonicContact NZ-OE1 3.98Å; K153-E157 WeakPolarHBondContact O-CG 3.37Å; K153-E157 PolarHBondContact O-N 3.23Å
154	A	88.7	Confident	83.9	Confident	51 Å²	51	104.2 Å²	104.2	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-61.1	-42.1	176.4	0	0	0	0	0	112.4	Q150 L151 E157 M158	Q150-A154 PolarHBondContact O-N 2.94Å; L151-A154 PolarHBondContact O-N 2.88Å; A154-E157 PolarHBondContact O-N 3.47Å; A154-M158 WeakPolarHBondContact O-CB 3.33Å; A154-M158 PolarHBondContact O-N 3.39Å
155	I	90.3	Very high	85.2	Confident	78 Å²	78	101.7 Å²	101.7	40%	0.4	55%	0.547	S	S	.	.	H	α-helix	trans	-62.5	-45.4	174.8	-66.7	165.8	0	0	0	110.7	L151 K153 E157 M158 D159	L151-I155 HydrophobicContact CD1-CD1 4.32Å; L151-I155 HydrophobicContact CG-CD1 4.08Å; L151-I155 WeakPolarHBondContact O-CG1 3.2Å; L151-I155 PolarHBondContact O-N 3.45Å; K153-I155 PolarHBondContact O-N 3.07Å; I155-E157 VanDerWaalsContact C-N 3.34Å; I155-E157 PolarHBondContact O-N 3.02Å; I155-M158 PolarHBondContact O-N 2.97Å; I155-D159 PolarHBondContact O-N 2.8Å
156	G	90.6	Very high	86.3	Confident	28 Å²	28	100.7 Å²	100.7	29%	0.289	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-37.2	177.9	0	0	0	0	0	113.3	R152 K153 D159 N160	R152-G156 PolarHBondContact O-N 3.37Å; K153-G156 PolarHBondContact O-N 3.38Å; G156-D159 PolarHBondContact O-N 2.93Å; G156-N160 PolarHBondContact O-N 3.09Å; G156-N160 PolarHBondContact O-ND2 3.49Å; G156-N160 VanDerWaalsContact O-ND2 3.09Å
157	E	93.5	Very high	87.5	Confident	105 Å²	105	98.3 Å²	98.3	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-42.7	174	-75.7	173.9	-174.6	0	0	111.5	K153 A154 I155 N160 Q161	K153-E157 WeakPolarHBondContact CE-OE1 3.49Å; K153-E157 IonicContact NZ-OE1 3.98Å; K153-E157 WeakPolarHBondContact O-CG 3.37Å; K153-E157 PolarHBondContact O-N 3.23Å; A154-E157 PolarHBondContact O-N 3.47Å; I155-E157 VanDerWaalsContact C-N 3.34Å; I155-E157 PolarHBondContact O-N 3.02Å; E157-N160 PolarHBondContact O-N 2.96Å; E157-Q161 WeakPolarHBondContact O-CG 3.5Å; E157-Q161 PolarHBondContact O-N 3.28Å
158	M	89.2	Confident	88.4	Confident	100 Å²	100	97.8 Å²	97.8	49%	0.493	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-42.8	175.3	-176.9	174.1	52.5	0	0	112.3	A154 I155 N160 Q161 V162	A154-M158 WeakPolarHBondContact O-CB 3.33Å; A154-M158 PolarHBondContact O-N 3.39Å; I155-M158 PolarHBondContact O-N 2.97Å; M158-N160 VanDerWaalsContact C-N 3.3Å; M158-N160 PolarHBondContact O-N 3.49Å; M158-Q161 WeakPolarHBondContact O-CB 3.35Å; M158-Q161 PolarHBondContact O-N 3.11Å; M158-Q161 VanDerWaalsContact O-N 3.11Å; M158-V162 WeakPolarHBondContact O-CG2 3.2Å; M158-V162 PolarHBondContact O-N 2.9Å
159	D	91.7	Very high	89.3	Confident	97 Å²	97	99.5 Å²	99.5	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-39.7	175.9	-79.7	-15.9	0	0	0	111.8	I155 G156 Q161 V162 S163	I155-D159 PolarHBondContact O-N 2.8Å; G156-D159 PolarHBondContact O-N 2.93Å; D159-Q161 VanDerWaalsContact C-N 3.33Å; D159-Q161 PolarHBondContact O-N 3.4Å; D159-V162 PolarHBondContact O-N 2.89Å; D159-S163 WeakPolarHBondContact O-CB 3.39Å; D159-S163 PolarHBondContact O-N 3.47Å
160	N	94.5	Very high	89.6	Confident	115 Å²	115	102.8 Å²	102.8	62%	0.615	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-40.8	174.4	-71.9	-31.9	0	0	0	111.5	G156 E157 M158 S163 Q164	G156-N160 PolarHBondContact O-N 3.09Å; G156-N160 PolarHBondContact O-ND2 3.49Å; G156-N160 VanDerWaalsContact O-ND2 3.09Å; E157-N160 PolarHBondContact O-N 2.96Å; M158-N160 VanDerWaalsContact C-N 3.3Å; M158-N160 PolarHBondContact O-N 3.49Å; N160-S163 PolarHBondContact O-N 3.36Å; N160-Q164 WeakPolarHBondContact O-CB 3.34Å; N160-Q164 PolarHBondContact O-N 2.91Å
161	Q	92.7	Very high	89.6	Confident	129 Å²	129	103.1 Å²	103.1	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-64.2	-44.3	175.5	-72.7	179.7	-32.6	0	0	112.1	E157 M158 D159 S163 Q164 L165	E157-Q161 WeakPolarHBondContact O-CG 3.5Å; E157-Q161 PolarHBondContact O-N 3.28Å; M158-Q161 WeakPolarHBondContact O-CB 3.35Å; M158-Q161 PolarHBondContact O-N 3.11Å; M158-Q161 VanDerWaalsContact O-N 3.11Å; D159-Q161 VanDerWaalsContact C-N 3.33Å; D159-Q161 PolarHBondContact O-N 3.4Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 3.05Å; Q161-Q164 PolarHBondContact O-N 2.94Å; Q161-L165 WeakPolarHBondContact O-CB 3.42Å; Q161-L165 WeakPolarHBondContact O-CG 3.38Å; Q161-L165 PolarHBondContact O-N 2.97Å
162	V	94.3	Very high	89.3	Confident	81 Å²	81	102.1 Å²	102.1	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-43.9	177.2	172.8	0	0	0	0	110.8	M158 D159 Q164 L165 T166	M158-V162 WeakPolarHBondContact O-CG2 3.2Å; M158-V162 PolarHBondContact O-N 2.9Å; D159-V162 PolarHBondContact O-N 2.89Å; V162-Q164 PolarHBondContact O-N 3.42Å; V162-L165 PolarHBondContact O-N 2.72Å; V162-T166 VanDerWaalsContact O-CB 3.3Å; V162-T166 WeakPolarHBondContact O-CB 3.48Å; V162-T166 PolarHBondContact O-N 2.94Å; V162-T166 PolarHBondContact O-OG1 3.47Å
163	S	92.9	Very high	89.1	Confident	77 Å²	77	95.2 Å²	95.2	54%	0.538	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-45.1	176.4	-175.8	0	0	0	0	111.7	D159 N160 Q161 T166 S167	D159-S163 WeakPolarHBondContact O-CB 3.39Å; D159-S163 PolarHBondContact O-N 3.47Å; N160-S163 PolarHBondContact O-N 3.36Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 3.05Å; S163-T166 PolarHBondContact O-N 3.49Å; S163-S167 WeakPolarHBondContact O-CB 3.42Å; S163-S167 PolarHBondContact O-N 2.93Å
164	Q	93.8	Very high	88.3	Confident	102 Å²	102	92.8 Å²	92.8	48%	0.477	49%	0.492	S	S	.	.	H	α-helix	trans	-60.5	-53.8	177.2	-176.3	64.5	21.8	0	0	111.3	N160 Q161 V162 T166 S167 E168	N160-Q164 WeakPolarHBondContact O-CB 3.34Å; N160-Q164 PolarHBondContact O-N 2.91Å; Q161-Q164 PolarHBondContact O-N 2.94Å; V162-Q164 PolarHBondContact O-N 3.42Å; Q164-T166 VanDerWaalsContact C-N 3.27Å; Q164-T166 PolarHBondContact O-N 3.42Å; Q164-S167 PolarHBondContact O-N 3.31Å; Q164-S167 VanDerWaalsContact O-N 3.09Å; Q164-S167 PolarHBondContact O-OG 3.36Å; Q164-E168 PolarHBondContact NE2-OE1 2.71Å; Q164-E168 WeakPolarHBondContact O-CG 3.36Å; Q164-E168 PolarHBondContact O-N 3.49Å
165	L	91.9	Very high	87.5	Confident	114 Å²	114	93.5 Å²	93.5	60%	0.597	50%	0.498	S	S	*	.	H	α-helix	trans	-58.2	-39.8	178.3	-72.6	171.4	0	0	0	112.1	Q161 V162 E168 L169	Q161-L165 WeakPolarHBondContact O-CB 3.42Å; Q161-L165 WeakPolarHBondContact O-CG 3.38Å; Q161-L165 PolarHBondContact O-N 2.97Å; V162-L165 PolarHBondContact O-N 2.72Å; L165-E168 PolarHBondContact O-N 3.09Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 PolarHBondContact O-N 2.91Å
166	T	89.8	Confident	86.6	Confident	87 Å²	87	94.9 Å²	94.9	53%	0.534	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-42.1	177.2	-58.3	0	0	0	0	111.3	V162 S163 Q164 K170	V162-T166 VanDerWaalsContact O-CB 3.3Å; V162-T166 WeakPolarHBondContact O-CB 3.48Å; V162-T166 PolarHBondContact O-N 2.94Å; V162-T166 PolarHBondContact O-OG1 3.47Å; S163-T166 PolarHBondContact O-N 3.49Å; Q164-T166 VanDerWaalsContact C-N 3.27Å; Q164-T166 PolarHBondContact O-N 3.42Å; T166-K170 WeakPolarHBondContact O-CB 3.3Å; T166-K170 PolarHBondContact O-N 2.84Å
167	S	88.3	Confident	85.7	Confident	60 Å²	60	95.7 Å²	95.7	42%	0.42	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-40.6	178.5	78.9	0	0	0	0	112.3	S163 Q164 K170 F171	S163-S167 WeakPolarHBondContact O-CB 3.42Å; S163-S167 PolarHBondContact O-N 2.93Å; Q164-S167 PolarHBondContact O-N 3.31Å; Q164-S167 VanDerWaalsContact O-N 3.09Å; Q164-S167 PolarHBondContact O-OG 3.36Å; S167-K170 PolarHBondContact O-N 2.99Å; S167-F171 PolarHBondContact O-N 3.43Å
168	E	87.5	Confident	85.1	Confident	91 Å²	91	91.7 Å²	91.7	43%	0.425	50%	0.5	S	S	.	.	H	α-helix	trans	-67.2	-44.3	177.8	-72.2	179	-174.6	0	0	111.4	Q164 L165 K170 F171 I172	Q164-E168 PolarHBondContact NE2-OE1 2.71Å; Q164-E168 WeakPolarHBondContact O-CG 3.36Å; Q164-E168 PolarHBondContact O-N 3.49Å; L165-E168 PolarHBondContact O-N 3.09Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 3.31Å; E168-F171 WeakPolarHBondContact O-CB 3.08Å; E168-F171 PolarHBondContact O-N 3.31Å; E168-F171 VanDerWaalsContact O-N 3.16Å; E168-I172 WeakPolarHBondContact O-CG1 3.43Å; E168-I172 PolarHBondContact O-N 3.46Å
169	L	84.4	Confident	85	Confident	119 Å²	119	87.8 Å²	87.8	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-40.6	175.9	-174	64.3	0	0	0	111.5	L165 F171 I172 K173	L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 PolarHBondContact O-N 2.91Å; L169-F171 VanDerWaalsContact C-N 3.31Å; L169-F171 PolarHBondContact O-N 2.9Å; L169-I172 PolarHBondContact O-N 3.16Å; L169-K173 WeakPolarHBondContact O-CB 3.41Å; L169-K173 PolarHBondContact O-N 3.29Å
170	K	83.1	Confident	84.9	Confident	142 Å²	142	86.5 Å²	86.5	62%	0.617	47%	0.47	S	S	*	.	H	α-helix	trans	-62.3	-39.6	174.7	-173.7	177.3	-177.9	177.6	0	111.6	T166 S167 E168 N174	T166-K170 WeakPolarHBondContact O-CB 3.3Å; T166-K170 PolarHBondContact O-N 2.84Å; S167-K170 PolarHBondContact O-N 2.99Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 3.31Å; K170-N174 WeakPolarHBondContact O-CB 3.44Å; K170-N174 PolarHBondContact O-N 2.92Å; K170-N174 PolarHBondContact O-ND2 3.17Å
171	F	83.9	Confident	84.6	Confident	135 Å²	135	84.9 Å²	84.9	59%	0.592	46%	0.459	S	S	*	.	H	α-helix	trans	-62.9	-49.7	173.8	176	-95.4	0	0	0	111.2	S167 E168 L169 K173 N174 A175 V176	S167-F171 PolarHBondContact O-N 3.43Å; E168-F171 WeakPolarHBondContact O-CB 3.08Å; E168-F171 PolarHBondContact O-N 3.31Å; E168-F171 VanDerWaalsContact O-N 3.16Å; L169-F171 VanDerWaalsContact C-N 3.31Å; L169-F171 PolarHBondContact O-N 2.9Å; F171-K173 VanDerWaalsContact C-N 3.35Å; F171-K173 PolarHBondContact O-N 2.8Å; F171-N174 PolarHBondContact O-N 3.33Å; F171-A175 HydrophobicContact CD2-CB 3.92Å; F171-A175 HydrophobicContact CE1-CB 4.26Å; F171-A175 HydrophobicContact CE2-CB 3.63Å; F171-A175 HydrophobicContact CG-CB 4.36Å; F171-A175 HydrophobicContact CZ-CB 3.81Å; F171-A175 VanDerWaalsContact O-CB 3.22Å; F171-A175 WeakPolarHBondContact O-CB 3.4Å; F171-A175 PolarHBondContact O-N 3.4Å; F171-V176 HydrophobicContact CE1-CG2 4.27Å
172	I	79.7	Confident	84.3	Confident	90 Å²	90	80.8 Å²	80.8	46%	0.462	44%	0.443	S	S	.	.	I	π-helix	trans	-60.2	-44.7	-179.5	-67.4	168.7	0	0	0	111.1	E168 L169 N174 V176 A177	E168-I172 WeakPolarHBondContact O-CG1 3.43Å; E168-I172 PolarHBondContact O-N 3.46Å; L169-I172 PolarHBondContact O-N 3.16Å; I172-N174 PolarHBondContact O-N 2.95Å; I172-V176 WeakPolarHBondContact O-CB 3.42Å; I172-V176 PolarHBondContact O-N 3.36Å; I172-A177 PolarHBondContact O-N 3.39Å
173	K	79.8	Confident	83.9	Confident	58 Å²	58	84.6 Å²	84.6	25%	0.252	46%	0.461	S	S	.	.	I	π-helix	trans	-61.6	-42.9	-179.5	-166.8	167.6	91.8	-170.7	0	112.6	L169 F171 G178 V179 E181	L169-K173 WeakPolarHBondContact O-CB 3.41Å; L169-K173 PolarHBondContact O-N 3.29Å; F171-K173 VanDerWaalsContact C-N 3.35Å; F171-K173 PolarHBondContact O-N 2.8Å; K173-G178 PolarHBondContact O-N 3.33Å; K173-G178 VanDerWaalsContact O-N 3.11Å; K173-V179 HydrophobicContact CG-CB 3.84Å; K173-V179 HydrophobicContact CG-CG1 4.39Å; K173-V179 HydrophobicContact CG-CG2 4.29Å; K173-V179 PolarHBondContact O-N 3Å; K173-V179 VanDerWaalsContact O-N 3.1Å; K173-E181 IonicContact NZ-OE1 2.71Å; K173-E181 PolarHBondContact NZ-OE1 3.11Å; K173-E181 IonicContact NZ-OE2 3.04Å; K173-E181 PolarHBondContact NZ-OE2 3.36Å
174	N	74.8	Confident	83.8	Confident	90 Å²	90	83.9 Å²	83.9	48%	0.481	46%	0.455	S	S	.	.	I	π-helix	trans	-88.7	-43.9	-173.2	-65.6	-16.4	0	0	0	113.2	K170 F171 I172	K170-N174 WeakPolarHBondContact O-CB 3.44Å; K170-N174 PolarHBondContact O-N 2.92Å; K170-N174 PolarHBondContact O-ND2 3.17Å; F171-N174 PolarHBondContact O-N 3.33Å; I172-N174 PolarHBondContact O-N 2.95Å
175	A	71.5	Confident	83.8	Confident	65 Å²	65	80.9 Å²	80.9	54%	0.537	44%	0.441	S	S	.	.	I	π-helix	trans	-89.1	-33.1	-171.8	0	0	0	0	0	113.2	F171	F171-A175 HydrophobicContact CD2-CB 3.92Å; F171-A175 HydrophobicContact CE1-CB 4.26Å; F171-A175 HydrophobicContact CE2-CB 3.63Å; F171-A175 HydrophobicContact CG-CB 4.36Å; F171-A175 HydrophobicContact CZ-CB 3.81Å; F171-A175 VanDerWaalsContact O-CB 3.22Å; F171-A175 WeakPolarHBondContact O-CB 3.4Å; F171-A175 PolarHBondContact O-N 3.4Å
176	V	69.9	Low	83.9	Confident	107 Å²	107	76.8 Å²	76.8	65%	0.648	42%	0.419	S	S	*	.	I	π-helix	trans	-103.3	-55.8	-173.2	-175.8	0	0	0	0	111.1	F171 I172	F171-V176 HydrophobicContact CE1-CG2 4.27Å; I172-V176 WeakPolarHBondContact O-CB 3.42Å; I172-V176 PolarHBondContact O-N 3.36Å
177	A	73.3	Confident	84.2	Confident	46 Å²	46	72.8 Å²	72.8	38%	0.38	39%	0.394	S	S	.	.	S	Bend	trans	-83.5	-16.8	-177.1	0	0	0	0	0	112.9	I172 V179	I172-A177 PolarHBondContact O-N 3.39Å; A177-V179 HydrophobicContact CB-CG2 3.58Å; A177-V179 PolarHBondContact O-N 3Å; A177-V179 VanDerWaalsContact O-N 3.09Å
178	G	79.5	Confident	84.5	Confident	20 Å²	20	71.5 Å²	71.5	21%	0.206	38%	0.383	C	S	.	.			trans	62.1	16.8	176.3	0	0	0	0	0	114.4	K173 R180 Y225	K173-G178 PolarHBondContact O-N 3.33Å; K173-G178 VanDerWaalsContact O-N 3.11Å; G178-R180 PolarHBondContact O-NH1 3.47Å; G178-Y225 VanDerWaalsContact C-OH 3.3Å; G178-Y225 WeakPolarHBondContact O-CE2 3.48Å; G178-Y225 PolarHBondContact O-OH 2.87Å
179	V	87.5	Confident	85	Confident	18 Å²	18	67.9 Å²	67.9	11%	0.109	37%	0.366	C	S	.	.			trans	-60.9	148.1	-171.1	-177	0	0	0	0	111	K173 A177 I186 Y187 L188	K173-V179 HydrophobicContact CG-CB 3.84Å; K173-V179 HydrophobicContact CG-CG1 4.39Å; K173-V179 HydrophobicContact CG-CG2 4.29Å; K173-V179 PolarHBondContact O-N 3Å; K173-V179 VanDerWaalsContact O-N 3.1Å; A177-V179 HydrophobicContact CB-CG2 3.58Å; A177-V179 PolarHBondContact O-N 3Å; A177-V179 VanDerWaalsContact O-N 3.09Å; V179-I186 HydrophobicContact CG1-CG2 3.26Å; V179-Y187 VanDerWaalsContact CG1-O 3.29Å; V179-Y187 WeakPolarHBondContact CG1-O 3.33Å; V179-L188 HydrophobicContact CG2-CD1 3.91Å
180	R	89.2	Confident	85.5	Confident	70 Å²	70	62.6 Å²	62.6	26%	0.264	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	143.3	169.1	-66.1	-70	171.6	-75.8	-8	109.5	G178 Y187 L221 Y225	G178-R180 PolarHBondContact O-NH1 3.47Å; R180-Y187 PolarHBondContact N-O 2.88Å; R180-Y187 PolarHBondContact O-N 3.1Å; R180-L221 HydrophobicContact CB-CD1 4.49Å; R180-L221 HydrophobicContact CB-CD2 3.66Å; R180-L221 HydrophobicContact CB-CG 4.26Å; R180-L221 HydrophobicContact CG-CD2 4.36Å; R180-Y225 HydrophobicContact CB-CD1 3.94Å; R180-Y225 HydrophobicContact CB-CE1 4.23Å; R180-Y225 HydrophobicContact CB-CG 4.42Å; R180-Y225 HydrophobicContact CG-CD1 3.49Å; R180-Y225 VanDerWaalsContact CG-CD1 3.49Å; R180-Y225 HydrophobicContact CG-CD2 3.92Å; R180-Y225 HydrophobicContact CG-CE1 3.91Å; R180-Y225 HydrophobicContact CG-CE2 4.33Å; R180-Y225 HydrophobicContact CG-CG 3.5Å
181	E	87.9	Confident	86.1	Confident	81 Å²	81	61.8 Å²	61.8	38%	0.379	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	140.5	-173.1	-177.5	-179	-116.5	0	0	109.6	K173 K185 I186 K301	K173-E181 IonicContact NZ-OE1 2.71Å; K173-E181 PolarHBondContact NZ-OE1 3.11Å; K173-E181 IonicContact NZ-OE2 3.04Å; K173-E181 PolarHBondContact NZ-OE2 3.36Å; E181-K185 WeakPolarHBondContact CA-O 3.36Å; E181-I186 HydrophobicContact CB-CG1 4.4Å; E181-I186 HydrophobicContact CG-CG1 3.88Å; E181-K301 VanDerWaalsContact CD-CE 3.41Å; E181-K301 VanDerWaalsContact CG-NZ 3.31Å; E181-K301 WeakPolarHBondContact OE1-CE 3.38Å; E181-K301 IonicContact OE1-NZ 3.23Å; E181-K301 PolarHBondContact OE1-NZ 3.43Å; E181-K301 IonicContact OE2-NZ 2.61Å
182	T	87.9	Confident	86.7	Confident	43 Å²	43	59.4 Å²	59.4	26%	0.264	33%	0.326	S	S	.	.			trans	-109.5	-176.9	167.5	65.4	0	0	0	0	109.1	S184 K185 Y187 L221 K301	T182-S184 PolarHBondContact O-N 2.93Å; T182-K185 PolarHBondContact N-O 2.98Å; T182-K185 PolarHBondContact OG1-N 2.72Å; T182-K185 PolarHBondContact OG1-O 3.45Å; T182-Y187 HydrophobicContact CG2-CE2 3.99Å; T182-L221 HydrophobicContact CG2-CD1 3.54Å; T182-K301 WeakPolarHBondContact O-CE 3.42Å; T182-K301 PolarHBondContact O-NZ 3.42Å
183	D	85.6	Confident	87.6	Confident	162 Å²	162	61.2 Å²	61.2	87%	0.866	33%	0.332	S	S	*	.	S	Bend	trans	-60.4	-36.5	177.2	-64.5	-33.5	0	0	0	112.5	K301	D183-K301 WeakPolarHBondContact O-CD 3.38Å; D183-K301 PolarHBondContact O-NZ 3.5Å; D183-K301 VanDerWaalsContact O-NZ 3.08Å
184	S	89.8	Confident	88.5	Confident	61 Å²	61	61 Å²	61	43%	0.427	33%	0.331	S	S	.	.	S	Bend	trans	-110	-18.7	-174.2	55.6	0	0	0	0	115.7	T182 K301	T182-S184 PolarHBondContact O-N 2.93Å; S184-K301 WeakPolarHBondContact O-CB 3.36Å; S184-K301 WeakPolarHBondContact O-CG 3.22Å; S184-K301 PolarHBondContact O-N 2.89Å
185	K	94.2	Very high	89.6	Confident	39 Å²	39	63.2 Å²	63.2	17%	0.17	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.2	-170.6	-68	177.6	177.5	-67.5	0	113.2	E181 T182 Y187 E298 F299 D300	E181-K185 WeakPolarHBondContact CA-O 3.36Å; T182-K185 PolarHBondContact N-O 2.98Å; T182-K185 PolarHBondContact OG1-N 2.72Å; T182-K185 PolarHBondContact OG1-O 3.45Å; K185-Y187 HydrophobicContact CB-CE2 4.03Å; K185-E298 HydrophobicContact CB-CG 4.49Å; K185-E298 HydrophobicContact CD-CG 4.09Å; K185-E298 WeakPolarHBondContact CD-OE1 3.4Å; K185-E298 VanDerWaalsContact CE-OE1 3.27Å; K185-E298 WeakPolarHBondContact CE-OE1 3.25Å; K185-E298 HydrophobicContact CG-CG 4.49Å; K185-E298 IonicContact NZ-OE1 2.65Å; K185-E298 PolarHBondContact NZ-OE1 2.9Å; K185-F299 CarbonylContact C-O 3.52Å; K185-F299 VanDerWaalsContact CA-O 3.29Å; K185-F299 WeakPolarHBondContact CA-O 3.32Å; K185-D300 WeakPolarHBondContact CG-OD1 3.48Å; K185-D300 VanDerWaalsContact NZ-CG 3.29Å; K185-D300 IonicContact NZ-OD1 3.33Å; K185-D300 PolarHBondContact NZ-OD1 3.02Å; K185-D300 IonicContact NZ-OD2 3.64Å; K185-D300 PolarHBondContact NZ-OD2 2.77Å
186	I	93.8	Very high	90.9	Very high	28 Å²	28	60.6 Å²	60.6	14%	0.144	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.8	174.4	-67.8	169.1	0	0	0	108.7	V179 E181 E298 F299 K301 M304	V179-I186 HydrophobicContact CG1-CG2 3.26Å; E181-I186 HydrophobicContact CB-CG1 4.4Å; E181-I186 HydrophobicContact CG-CG1 3.88Å; I186-E298 CarbonylContact O-C 3.17Å; I186-E298 VanDerWaalsContact O-CA 3.31Å; I186-E298 WeakPolarHBondContact O-CA 3.46Å; I186-F299 HydrophobicContact CB-CB 4.29Å; I186-F299 HydrophobicContact CB-CD2 4.4Å; I186-F299 HydrophobicContact CG2-CD2 4.22Å; I186-F299 PolarHBondContact N-O 3.44Å; I186-F299 PolarHBondContact O-N 3.35Å; I186-K301 HydrophobicContact CD1-CG 4.1Å; I186-K301 HydrophobicContact CG1-CG 4.12Å; I186-M304 HydrophobicContact CD1-SD 3.76Å
187	Y	96.3	Very high	92.3	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.1	178.6	-61	-86.6	0	0	0	110.6	V179 R180 T182 K185 L221 M222 Y225 C297 E298	V179-Y187 VanDerWaalsContact CG1-O 3.29Å; V179-Y187 WeakPolarHBondContact CG1-O 3.33Å; R180-Y187 PolarHBondContact N-O 2.88Å; R180-Y187 PolarHBondContact O-N 3.1Å; T182-Y187 HydrophobicContact CG2-CE2 3.99Å; K185-Y187 HydrophobicContact CB-CE2 4.03Å; Y187-L221 HydrophobicContact CD2-CD2 3.52Å; Y187-L221 HydrophobicContact CE2-CD2 3.97Å; Y187-L221 HydrophobicContact CG-CD2 4.02Å; Y187-M222 HydrophobicContact CD1-CG 4.05Å; Y187-M222 HydrophobicContact CD1-SD 4.34Å; Y187-M222 HydrophobicContact CE1-CG 4.04Å; Y187-M222 HydrophobicContact CE1-SD 3.93Å; Y187-Y225 WeakPolarHBondContact O-CE1 3.43Å; Y187-C297 CarbonylContact C-O 3.59Å; Y187-C297 VanDerWaalsContact CA-O 3.31Å; Y187-C297 WeakPolarHBondContact CA-O 3.16Å; Y187-E298 HydrophobicContact CD1-CB 4.06Å; Y187-E298 HydrophobicContact CD1-CG 4.27Å; Y187-E298 HydrophobicContact CE1-CB 3.99Å; Y187-E298 HydrophobicContact CE1-CG 3.82Å; Y187-E298 WeakPolarHBondContact CE1-OE2 3.34Å
188	L	95.6	Very high	93.5	Very high	33 Å²	33	60.3 Å²	60.3	17%	0.173	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.1	178.6	178	66.5	0	0	0	109.9	V179 V190 M296 C297 F299	V179-L188 HydrophobicContact CG2-CD1 3.91Å; L188-V190 HydrophobicContact CD2-CG2 4.16Å; L188-V190 HydrophobicContact CG-CG2 4.16Å; L188-M296 WeakPolarHBondContact O-CA 3.35Å; L188-C297 PolarHBondContact N-O 3.09Å; L188-C297 PolarHBondContact O-N 3.11Å; L188-F299 HydrophobicContact CB-CE2 3.78Å; L188-F299 HydrophobicContact CD2-CE2 4.37Å; L188-F299 HydrophobicContact CD2-CZ 4.47Å
189	L	96.8	Very high	94.4	Very high	15 Å²	15	59.3 Å²	59.3	8%	0.079	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.9	172.8	-179.1	67.4	0	0	0	109.4	Y225 L226 A229 L231 V234	L189-Y225 HydrophobicContact CB-CD1 4.39Å; L189-Y225 HydrophobicContact CB-CE1 3.71Å; L189-Y225 HydrophobicContact CB-CE2 3.99Å; L189-Y225 VanDerWaalsContact CB-CZ 3.45Å; L189-Y225 WeakPolarHBondContact CB-OH 3.13Å; L189-Y225 HydrophobicContact CD2-CE2 4.17Å; L189-Y225 PolarHBondContact N-OH 3.2Å; L189-L226 HydrophobicContact CD1-CD1 4.46Å; L189-A229 HydrophobicContact CD2-CB 3.37Å; L189-L231 HydrophobicContact CD1-CD1 3.69Å; L189-L231 HydrophobicContact CD2-CD1 3.54Å; L189-L231 HydrophobicContact CD2-CG 4.42Å; L189-L231 HydrophobicContact CG-CD1 3.98Å; L189-V234 HydrophobicContact CD1-CG1 3.76Å
190	V	96.6	Very high	94.9	Very high	7 Å²	7	59.7 Å²	59.7	4%	0.042	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.4	-179.8	-173.6	0	0	0	0	109.2	L188 E192 Y294 F295	L188-V190 HydrophobicContact CD2-CG2 4.16Å; L188-V190 HydrophobicContact CG-CG2 4.16Å; V190-E192 HydrophobicContact CG1-CB 4.05Å; V190-E192 HydrophobicContact CG1-CG 4Å; V190-E192 PolarHBondContact O-N 3.46Å; V190-E192 VanDerWaalsContact O-N 3.1Å; V190-Y294 WeakPolarHBondContact O-CB 3.3Å; V190-F295 HydrophobicContact CB-CD1 4.31Å; V190-F295 HydrophobicContact CB-CD2 3.99Å; V190-F295 HydrophobicContact CB-CE1 3.9Å; V190-F295 HydrophobicContact CB-CE2 3.57Å; V190-F295 HydrophobicContact CB-CG 4.35Å; V190-F295 HydrophobicContact CB-CZ 3.51Å; V190-F295 HydrophobicContact CG1-CE1 3.73Å; V190-F295 HydrophobicContact CG1-CE2 3.91Å; V190-F295 HydrophobicContact CG1-CZ 3.34Å; V190-F295 HydrophobicContact CG2-CD2 4.2Å; V190-F295 HydrophobicContact CG2-CE2 3.66Å; V190-F295 HydrophobicContact CG2-CZ 4.02Å; V190-F295 PolarHBondContact N-O 3.12Å; V190-F295 PolarHBondContact O-N 3.16Å
191	K	95.7	Very high	95.4	Very high	126 Å²	126	61.3 Å²	61.3	55%	0.548	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	49.1	-179.2	-59.5	-175.6	-178.4	-175.4	0	111.8	Y294	K191-Y294 VanDerWaalsContact C-CD1 3.4Å; K191-Y294 HydrophobicContact CB-CD1 4.42Å; K191-Y294 HydrophobicContact CB-CE1 4.24Å; K191-Y294 HydrophobicContact CB-CE2 4.38Å; K191-Y294 WeakPolarHBondContact O-CE1 3.39Å
192	E	96.3	Very high	95.8	Very high	84 Å²	84	58.4 Å²	58.4	39%	0.393	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126	172.5	-65.5	172.3	-160.3	0	0	107.8	V190 K194 F295	V190-E192 HydrophobicContact CG1-CB 4.05Å; V190-E192 HydrophobicContact CG1-CG 4Å; V190-E192 PolarHBondContact O-N 3.46Å; V190-E192 VanDerWaalsContact O-N 3.1Å; E192-K194 PolarHBondContact O-N 3.29Å; E192-K194 WeakPolarHBondContact OE2-CE 3.22Å; E192-K194 IonicContact OE2-NZ 3.86Å; E192-K194 PolarHBondContact OE2-NZ 2.85Å; E192-F295 HydrophobicContact CB-CE1 4.31Å; E192-F295 WeakPolarHBondContact O-CE1 3.44Å
193	E	97.9	Very high	96.3	Very high	129 Å²	129	56.3 Å²	56.3	60%	0.603	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	119	178	-65.9	-175.1	-175	0	0	110.1	M293 Y294	E193-M293 WeakPolarHBondContact CA-O 3.46Å; E193-Y294 HydrophobicContact CG-CD1 3.86Å; E193-Y294 HydrophobicContact CG-CE1 3.59Å
194	K	98.6	Very high	96.9	Very high	52 Å²	52	53.1 Å²	53.1	23%	0.226	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.1	-179.2	-70.1	-169.1	-174.4	174.9	0	110.7	E192 D198 A199 S202 F235 T292 M293 F295	E192-K194 PolarHBondContact O-N 3.29Å; E192-K194 WeakPolarHBondContact OE2-CE 3.22Å; E192-K194 IonicContact OE2-NZ 3.86Å; E192-K194 PolarHBondContact OE2-NZ 2.85Å; K194-D198 HydrophobicContact CB-CB 4.02Å; K194-D198 HydrophobicContact CD-CB 4.12Å; K194-D198 HydrophobicContact CG-CB 4.37Å; K194-A199 HydrophobicContact CB-CB 4.2Å; K194-S202 PolarHBondContact NZ-OG 2.9Å; K194-F235 WeakPolarHBondContact O-CE2 3.37Å; K194-T292 WeakPolarHBondContact O-CA 3.44Å; K194-M293 PolarHBondContact N-O 3.49Å; K194-M293 PolarHBondContact O-N 2.81Å; K194-F295 HydrophobicContact CB-CD1 4.33Å; K194-F295 HydrophobicContact CB-CE1 4.09Å; K194-F295 HydrophobicContact CD-CE1 3.78Å; K194-F295 HydrophobicContact CD-CZ 4.09Å; K194-F295 HydrophobicContact CG-CE1 4.01Å
195	R	98.6	Very high	97.2	Very high	137 Å²	137	53.7 Å²	53.7	52%	0.517	28%	0.282	S	S	.	.			trans	-72.2	161.9	166.4	-60.5	-176.6	-179.7	-166	0	109.7	A197 D198 A199 T292	R195-A197 VanDerWaalsContact C-N 3.34Å; R195-A197 PolarHBondContact O-N 2.92Å; R195-D198 PolarHBondContact O-N 3.16Å; R195-D198 VanDerWaalsContact O-N 3.12Å; R195-A199 WeakPolarHBondContact O-CB 3.41Å; R195-A199 PolarHBondContact O-N 2.92Å; R195-T292 HydrophobicContact CG-CG2 3.82Å
196	Y	98.6	Very high	97.3	Very high	10 Å²	10	57.7 Å²	57.7	4%	0.039	30%	0.295	C	S	.	.	H	α-helix	trans	-54.5	-47.1	-175.2	-171.6	-91.7	0	0	0	113.3	D198 A199 Q200 L210 F235 I236 I238 N239 L241 C275 C289	Y196-D198 PolarHBondContact O-N 2.95Å; Y196-A199 WeakPolarHBondContact O-CB 3.29Å; Y196-A199 PolarHBondContact O-N 3.48Å; Y196-Q200 WeakPolarHBondContact O-CB 3.33Å; Y196-Q200 PolarHBondContact O-N 2.8Å; Y196-L210 HydrophobicContact CD2-CD1 4.11Å; Y196-L210 HydrophobicContact CE1-CD1 4.11Å; Y196-L210 HydrophobicContact CE2-CD1 3.71Å; Y196-F235 HydrophobicContact CD2-CB 4.41Å; Y196-F235 AromaticContact CD2-CD1 3.66Å; Y196-F235 HydrophobicContact CD2-CD1 3.66Å; Y196-F235 AromaticContact CD2-CE1 3.97Å; Y196-F235 HydrophobicContact CD2-CE1 3.97Å; Y196-F235 HydrophobicContact CD2-CG 4.02Å; Y196-F235 HydrophobicContact CE2-CD1 4.39Å; Y196-I236 VanDerWaalsContact CE2-O 3.28Å; Y196-I236 WeakPolarHBondContact CE2-O 3.4Å; Y196-I238 PolarHBondContact OH-N 3.1Å; Y196-I238 PolarHBondContact OH-O 2.94Å; Y196-N239 HydrophobicContact CE1-CB 4.24Å; Y196-N239 PolarHBondContact OH-ND2 2.98Å; Y196-L241 HydrophobicContact CE1-CD1 4.49Å; Y196-C275 WeakPolarHBondContact CB-SG 3.22Å; Y196-C275 WeakPolarHBondContact CD1-SG 3.38Å; Y196-C275 HydrophobicContact CD2-CB 3.63Å; Y196-C275 VanDerWaalsContact CD2-SG 3.51Å; Y196-C275 HydrophobicContact CE2-CB 4.03Å; Y196-C275 HydrophobicContact CG-CB 3.95Å; Y196-C289 PolarHBondContact N-O 3.01Å; Y196-C289 VanDerWaalsContact N-O 3.15Å
197	A	98.4	Very high	97.4	Very high	63 Å²	63	58.9 Å²	58.9	52%	0.521	32%	0.315	S	S	.	.	H	α-helix	trans	-61.5	-43.9	179.1	0	0	0	0	0	112.4	R195 A199 Q200 L201	R195-A197 VanDerWaalsContact C-N 3.34Å; R195-A197 PolarHBondContact O-N 2.92Å; A197-A199 VanDerWaalsContact C-N 3.35Å; A197-Q200 PolarHBondContact O-N 3.41Å; A197-L201 WeakPolarHBondContact O-CG 3.09Å; A197-L201 PolarHBondContact O-N 3.35Å
198	D	98.7	Very high	97.4	Very high	84 Å²	84	59.2 Å²	59.2	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-69.5	-34.3	178.8	-61.5	-42.2	0	0	0	112	K194 R195 Y196 S202	K194-D198 HydrophobicContact CB-CB 4.02Å; K194-D198 HydrophobicContact CD-CB 4.12Å; K194-D198 HydrophobicContact CG-CB 4.37Å; R195-D198 PolarHBondContact O-N 3.16Å; R195-D198 VanDerWaalsContact O-N 3.12Å; Y196-D198 PolarHBondContact O-N 2.95Å; D198-S202 WeakPolarHBondContact O-CB 3.46Å; D198-S202 PolarHBondContact O-N 3.16Å
199	A	98.6	Very high	97.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-46.4	174.2	0	0	0	0	0	111.1	K194 R195 Y196 A197 S202 C203 L210 F295	K194-A199 HydrophobicContact CB-CB 4.2Å; R195-A199 WeakPolarHBondContact O-CB 3.41Å; R195-A199 PolarHBondContact O-N 2.92Å; Y196-A199 WeakPolarHBondContact O-CB 3.29Å; Y196-A199 PolarHBondContact O-N 3.48Å; A197-A199 VanDerWaalsContact C-N 3.35Å; A199-S202 WeakPolarHBondContact O-CB 3.46Å; A199-S202 PolarHBondContact O-N 3.03Å; A199-S202 VanDerWaalsContact O-N 3.16Å; A199-C203 PolarHBondContact O-N 3.02Å; A199-C203 PolarHBondContact O-SG 2.04Å; A199-L210 HydrophobicContact CB-CD2 4.11Å; A199-F295 HydrophobicContact CB-CB 3.83Å; A199-F295 HydrophobicContact CB-CD1 3.71Å; A199-F295 HydrophobicContact CB-CD2 3.93Å; A199-F295 HydrophobicContact CB-CE1 4.22Å; A199-F295 HydrophobicContact CB-CE2 4.39Å; A199-F295 HydrophobicContact CB-CG 3.56Å
200	Q	98.4	Very high	97.6	Very high	25 Å²	25	58.4 Å²	58.4	12%	0.117	32%	0.317	C	S	.	.	H	α-helix	trans	-60.4	-47.6	175.1	178.9	64.8	-10.2	0	0	111.7	Y196 A197 S202 C203 Q204 L210	Y196-Q200 WeakPolarHBondContact O-CB 3.33Å; Y196-Q200 PolarHBondContact O-N 2.8Å; A197-Q200 PolarHBondContact O-N 3.41Å; Q200-S202 VanDerWaalsContact C-N 3.26Å; Q200-S202 PolarHBondContact O-N 2.87Å; Q200-C203 PolarHBondContact O-N 3.14Å; Q200-C203 VanDerWaalsContact O-N 3.16Å; Q200-Q204 WeakPolarHBondContact O-CG 3.5Å; Q200-Q204 PolarHBondContact O-N 2.85Å; Q200-L210 HydrophobicContact CB-CD1 3.88Å; Q200-L210 HydrophobicContact CB-CG 4.28Å; Q200-L210 VanDerWaalsContact OE1-CG 3.27Å
201	L	98.3	Very high	97.7	Very high	105 Å²	105	58.1 Å²	58.1	55%	0.55	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-37	174.6	-72.5	172.7	0	0	0	112	A197 C203 Q204 G205	A197-L201 WeakPolarHBondContact O-CG 3.09Å; A197-L201 PolarHBondContact O-N 3.35Å; L201-C203 VanDerWaalsContact C-N 3.33Å; L201-C203 PolarHBondContact O-N 3.33Å; L201-Q204 PolarHBondContact O-N 2.91Å; L201-G205 PolarHBondContact O-N 2.56Å
202	S	98.3	Very high	97.7	Very high	19 Å²	19	52.4 Å²	52.4	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-31.8	177.3	-171.8	0	0	0	0	113	K194 D198 A199 Q200 R206 F295	K194-S202 PolarHBondContact NZ-OG 2.9Å; D198-S202 WeakPolarHBondContact O-CB 3.46Å; D198-S202 PolarHBondContact O-N 3.16Å; A199-S202 WeakPolarHBondContact O-CB 3.46Å; A199-S202 PolarHBondContact O-N 3.03Å; A199-S202 VanDerWaalsContact O-N 3.16Å; Q200-S202 VanDerWaalsContact C-N 3.26Å; Q200-S202 PolarHBondContact O-N 2.87Å; S202-R206 WeakPolarHBondContact O-CD 3.08Å; S202-R206 WeakPolarHBondContact O-CG 3.29Å; S202-F295 WeakPolarHBondContact OG-CZ 3.23Å
203	C	98.1	Very high	97.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-75.6	-41.6	172.1	-62.2	0	0	0	0	111.2	A199 Q200 L201 G205 R206 G207 G208 T209 C297	A199-C203 PolarHBondContact O-N 3.02Å; A199-C203 PolarHBondContact O-SG 2.04Å; Q200-C203 PolarHBondContact O-N 3.14Å; Q200-C203 VanDerWaalsContact O-N 3.16Å; L201-C203 VanDerWaalsContact C-N 3.33Å; L201-C203 PolarHBondContact O-N 3.33Å; C203-G205 PolarHBondContact O-N 3.28Å; C203-R206 WeakPolarHBondContact O-CA 3.26Å; C203-R206 WeakPolarHBondContact O-CB 3.46Å; C203-R206 PolarHBondContact O-N 2.95Å; C203-G207 PolarHBondContact O-N 3.08Å; C203-G208 CarbonylContact C-O 3.44Å; C203-G208 CarbonylContact O-C 3.52Å; C203-G208 PolarHBondContact O-N 2.65Å; C203-T209 WeakPolarHBondContact CB-O 3.37Å; C203-C297 WeakPolarHBondContact CA-SG 3.24Å; C203-C297 HydrophobicContact CB-CB 3.77Å; C203-C297 WeakPolarHBondContact CB-SG 3.26Å; C203-C297 WeakPolarHBondContact SG-CA 3.06Å; C203-C297 WeakPolarHBondContact SG-CB 3.31Å; C203-C297 CovalentContact SG-SG 2.04Å; C203-C297 PolarHBondContact SG-SG 2.73Å
204	Q	97.6	Very high	97.7	Very high	95 Å²	95	45.8 Å²	45.8	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-42.1	177.1	-71.6	173.9	-7.6	0	0	112.6	Q200 L201 R206 G207 G208	Q200-Q204 WeakPolarHBondContact O-CG 3.5Å; Q200-Q204 PolarHBondContact O-N 2.85Å; L201-Q204 PolarHBondContact O-N 2.91Å; Q204-R206 PolarHBondContact O-N 3.04Å; Q204-R206 VanDerWaalsContact O-N 3.11Å; Q204-G207 PolarHBondContact O-N 3.2Å; Q204-G208 WeakPolarHBondContact CA-O 3.18Å; Q204-G208 PolarHBondContact N-O 3.23Å; Q204-G208 VanDerWaalsContact N-O 3.14Å
205	G	96.9	Very high	97.5	Very high	73 Å²	73	47.2 Å²	47.2	75%	0.753	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.7	175	0	0	0	0	0	114.3	L201 C203	L201-G205 PolarHBondContact O-N 2.56Å; C203-G205 PolarHBondContact O-N 3.28Å
206	R	95.4	Very high	97.4	Very high	122 Å²	122	45.6 Å²	45.6	46%	0.46	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	1.8	174.5	-62.8	170.3	-174.1	-93.2	2.9	112.7	S202 C203 Q204 F299	S202-R206 WeakPolarHBondContact O-CD 3.08Å; S202-R206 WeakPolarHBondContact O-CG 3.29Å; C203-R206 WeakPolarHBondContact O-CA 3.26Å; C203-R206 WeakPolarHBondContact O-CB 3.46Å; C203-R206 PolarHBondContact O-N 2.95Å; Q204-R206 PolarHBondContact O-N 3.04Å; Q204-R206 VanDerWaalsContact O-N 3.11Å; R206-F299 HydrophobicContact CB-CE1 3.67Å; R206-F299 HydrophobicContact CB-CZ 3.89Å; R206-F299 WeakPolarHBondContact O-CE1 3.36Å
207	G	95.5	Very high	97.2	Very high	54 Å²	54	48.8 Å²	48.8	56%	0.557	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	24.7	-176.3	0	0	0	0	0	114.6	C203 Q204	C203-G207 PolarHBondContact O-N 3.08Å; Q204-G207 PolarHBondContact O-N 3.2Å
208	G	96.4	Very high	97	Very high	10 Å²	10	46.1 Å²	46.1	10%	0.103	27%	0.273	C	S	.	.			trans	-138.5	-165.2	178.4	0	0	0	0	0	112.8	C203 Q204 E298	C203-G208 CarbonylContact C-O 3.44Å; C203-G208 CarbonylContact O-C 3.52Å; C203-G208 PolarHBondContact O-N 2.65Å; Q204-G208 WeakPolarHBondContact CA-O 3.18Å; Q204-G208 PolarHBondContact N-O 3.23Å; Q204-G208 VanDerWaalsContact N-O 3.14Å; G208-E298 VanDerWaalsContact CA-O 3.26Å; G208-E298 WeakPolarHBondContact CA-O 3.44Å
209	T	98.2	Very high	97	Very high	32 Å²	32	42.2 Å²	42.2	20%	0.196	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	174.8	173	57.1	0	0	0	0	110.2	C203 C297 E298	C203-T209 WeakPolarHBondContact CB-O 3.37Å; T209-C297 CarbonylContact O-C 3.49Å; T209-C297 VanDerWaalsContact O-CA 3.23Å; T209-C297 WeakPolarHBondContact O-CA 3.46Å; T209-E298 PolarHBondContact N-O 3.34Å; T209-E298 PolarHBondContact O-N 2.89Å
210	L	98.6	Very high	96.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	146.9	162.2	-72.6	168.4	0	0	0	110.1	Y196 A199 Q200 M212 F235 F295 M296	Y196-L210 HydrophobicContact CD2-CD1 4.11Å; Y196-L210 HydrophobicContact CE1-CD1 4.11Å; Y196-L210 HydrophobicContact CE2-CD1 3.71Å; A199-L210 HydrophobicContact CB-CD2 4.11Å; Q200-L210 HydrophobicContact CB-CD1 3.88Å; Q200-L210 HydrophobicContact CB-CG 4.28Å; Q200-L210 VanDerWaalsContact OE1-CG 3.27Å; L210-M212 WeakPolarHBondContact O-CG 3.44Å; L210-F235 HydrophobicContact CD2-CB 4.48Å; L210-F295 HydrophobicContact CD2-CB 3.81Å; L210-F295 HydrophobicContact CD2-CD2 4.04Å; L210-F295 HydrophobicContact CD2-CG 4.32Å; L210-M296 CarbonylContact C-O 3.49Å; L210-M296 WeakPolarHBondContact CA-O 3.3Å
211	G	97.8	Very high	96.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.272	C	S	.	.			trans	-68.7	133.6	-173.1	0	0	0	0	0	113.2	P213 G237 M296	G211-P213 WeakPolarHBondContact O-CD 3.41Å; G211-G237 WeakPolarHBondContact O-CA 3.33Å; G211-G237 PolarHBondContact O-N 3.42Å; G211-M296 PolarHBondContact N-O 3.08Å
212	M	97.6	Very high	96.8	Very high	7 Å²	7	39.5 Å²	39.5	3%	0.034	25%	0.246	C	C	.	.			trans	-115.8	92.2	-171	-63.4	176.2	-68	0	0	109.7	L210 K214 Y249 D251 E298	L210-M212 WeakPolarHBondContact O-CG 3.44Å; M212-K214 VanDerWaalsContact C-N 3.3Å; M212-K214 HydrophobicContact CB-CG 4.39Å; M212-K214 PolarHBondContact O-N 2.74Å; M212-Y249 HydrophobicContact CB-CD1 3.74Å; M212-Y249 HydrophobicContact CB-CE1 4.37Å; M212-Y249 HydrophobicContact CB-CG 4.38Å; M212-Y249 HydrophobicContact CG-CD1 4.04Å; M212-Y249 HydrophobicContact CG-CG 4.45Å; M212-D251 HydrophobicContact CE-CB 4.04Å; M212-D251 HydrophobicContact SD-CB 3.77Å; M212-D251 VanDerWaalsContact SD-CG 3.56Å; M212-D251 PolarHBondContact SD-N 2.83Å; M212-D251 VanDerWaalsContact SD-N 3.4Å; M212-E298 PolarHBondContact N-OE2 3.17Å
213	P	96.8	Very high	96.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.244	C	C	.	.			trans	-73.6	82.4	-179.1	30	-34	0	0	0	110.7	G211 D215 N219 M222 I236 I238 F258 M278 W284	G211-P213 WeakPolarHBondContact O-CD 3.41Å; P213-D215 VanDerWaalsContact C-N 3.33Å; P213-N219 HydrophobicContact CB-CB 3.91Å; P213-M222 HydrophobicContact CB-SD 3.8Å; P213-M222 HydrophobicContact CG-CE 4.39Å; P213-M222 HydrophobicContact CG-SD 4.27Å; P213-I236 HydrophobicContact CG-CD1 3.97Å; P213-I238 HydrophobicContact CG-CD1 4.22Å; P213-F258 WeakPolarHBondContact O-CD1 3.15Å; P213-F258 VanDerWaalsContact O-CE1 3.25Å; P213-F258 WeakPolarHBondContact O-CE1 3.17Å; P213-M278 HydrophobicContact CB-CE 4.27Å; P213-M278 HydrophobicContact CG-CE 4.06Å; P213-W284 HydrophobicContact CB-CZ2 3.89Å; P213-W284 HydrophobicContact CG-CH2 4.17Å; P213-W284 HydrophobicContact CG-CZ2 3.46Å; P213-W284 VanDerWaalsContact CG-CZ2 3.46Å
214	K	95.9	Very high	96.6	Very high	74 Å²	74	41.2 Å²	41.2	32%	0.322	26%	0.262	S	S	.	.			trans	-80.4	-12.5	-177.4	-68.5	179.6	-178.3	-177.9	0	114.1	M212 Y249 D251 S253	M212-K214 VanDerWaalsContact C-N 3.3Å; M212-K214 HydrophobicContact CB-CG 4.39Å; M212-K214 PolarHBondContact O-N 2.74Å; K214-Y249 HydrophobicContact CG-CD1 4.32Å; K214-Y249 HydrophobicContact CG-CD2 4.3Å; K214-Y249 HydrophobicContact CG-CE1 3.97Å; K214-Y249 HydrophobicContact CG-CE2 3.93Å; K214-Y249 HydrophobicContact CG-CG 4.49Å; K214-D251 IonicContact NZ-OD1 2.77Å; K214-D251 IonicContact NZ-OD2 3.96Å; K214-D251 PolarHBondContact NZ-OD2 3.07Å; K214-S253 WeakPolarHBondContact CE-OG 3.42Å; K214-S253 PolarHBondContact NZ-OG 3.35Å; K214-S253 VanDerWaalsContact NZ-OG 3.12Å
215	D	94.9	Very high	96.5	Very high	81 Å²	81	37.3 Å²	37.3	43%	0.433	24%	0.243	S	C	.	.	S	Bend	trans	-146.8	169.9	179.1	61.9	55.6	0	0	0	112.1	P213 A217 A218 N219 F258	P213-D215 VanDerWaalsContact C-N 3.33Å; D215-A217 VanDerWaalsContact C-N 3.28Å; D215-A217 PolarHBondContact O-N 3.15Å; D215-A217 WeakPolarHBondContact OD1-CB 3.26Å; D215-A217 PolarHBondContact OD1-N 3.27Å; D215-A218 WeakPolarHBondContact OD1-CB 3.48Å; D215-A218 PolarHBondContact OD1-N 3.25Å; D215-N219 WeakPolarHBondContact O-CB 3.39Å; D215-N219 PolarHBondContact O-N 3.03Å; D215-F258 VanDerWaalsContact C-CE1 3.49Å; D215-F258 WeakPolarHBondContact O-CE1 3.5Å; D215-F258 WeakPolarHBondContact O-CZ 3.29Å
216	E	95.5	Very high	96.5	Very high	104 Å²	104	33.8 Å²	33.8	49%	0.486	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-31.9	-177.4	-173.8	67.1	-143.6	0	0	112.4	G220 F258 K260	E216-G220 PolarHBondContact O-N 2.82Å; E216-F258 HydrophobicContact CB-CE2 3.92Å; E216-F258 HydrophobicContact CB-CZ 4.39Å; E216-F258 WeakPolarHBondContact OE2-CE2 3.37Å; E216-K260 VanDerWaalsContact CD-NZ 3.26Å; E216-K260 IonicContact OE1-NZ 2.91Å; E216-K260 PolarHBondContact OE1-NZ 2.96Å; E216-K260 IonicContact OE2-NZ 2.56Å; E216-K260 PolarHBondContact OE2-NZ 3.07Å
217	A	94.5	Very high	96.5	Very high	77 Å²	77	30.8 Å²	30.8	64%	0.636	21%	0.208	S	C	*	.	H	α-helix	trans	-71.6	-46.5	-178.4	0	0	0	0	0	111.1	D215 G220 L221	D215-A217 VanDerWaalsContact C-N 3.28Å; D215-A217 PolarHBondContact O-N 3.15Å; D215-A217 WeakPolarHBondContact OD1-CB 3.26Å; D215-A217 PolarHBondContact OD1-N 3.27Å; A217-G220 PolarHBondContact O-N 2.76Å; A217-L221 WeakPolarHBondContact O-CB 3.39Å; A217-L221 PolarHBondContact O-N 2.84Å
218	A	95.3	Very high	96.4	Very high	6 Å²	6	34.3 Å²	34.3	5%	0.05	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-48.2	173.8	0	0	0	0	0	110.8	D215 G220 L221 M222	D215-A218 WeakPolarHBondContact OD1-CB 3.48Å; D215-A218 PolarHBondContact OD1-N 3.25Å; A218-G220 PolarHBondContact O-N 3.35Å; A218-L221 PolarHBondContact O-N 2.85Å; A218-M222 WeakPolarHBondContact O-CB 3.47Å; A218-M222 VanDerWaalsContact O-CG 3.25Å; A218-M222 WeakPolarHBondContact O-CG 3.44Å; A218-M222 PolarHBondContact O-N 3.4Å
219	N	97.6	Very high	96.2	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-45.4	178.4	-167.5	83.1	0	0	0	112.4	P213 D215 L221 M222 A223 F258 K260 M278 G282 W284	P213-N219 HydrophobicContact CB-CB 3.91Å; D215-N219 WeakPolarHBondContact O-CB 3.39Å; D215-N219 PolarHBondContact O-N 3.03Å; N219-L221 PolarHBondContact O-N 3.42Å; N219-M222 PolarHBondContact O-N 2.85Å; N219-A223 WeakPolarHBondContact O-CB 3.13Å; N219-A223 PolarHBondContact O-N 2.71Å; N219-F258 HydrophobicContact CB-CE1 4.22Å; N219-F258 HydrophobicContact CB-CZ 3.88Å; N219-K260 HydrophobicContact CB-CG 4.46Å; N219-M278 WeakPolarHBondContact OD1-CE 3.2Å; N219-G282 PolarHBondContact ND2-O 2.8Å; N219-G282 PolarHBondContact OD1-O 2.89Å; N219-W284 WeakPolarHBondContact OD1-CZ2 3.44Å; N219-W284 PolarHBondContact OD1-NE1 3.37Å
220	G	97.3	Very high	96.1	Very high	33 Å²	33	36.9 Å²	36.9	34%	0.34	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-40.8	179.1	0	0	0	0	0	112.6	E216 A217 A218 A224	E216-G220 PolarHBondContact O-N 2.82Å; A217-G220 PolarHBondContact O-N 2.76Å; A218-G220 PolarHBondContact O-N 3.35Å; G220-A224 WeakPolarHBondContact O-CB 3.17Å; G220-A224 PolarHBondContact O-N 2.95Å
221	L	96.3	Very high	96	Very high	39 Å²	39	38.1 Å²	38.1	20%	0.204	25%	0.247	C	C	.	.	H	α-helix	trans	-64.3	-46.6	174.9	178.4	155.1	0	0	0	111.6	R180 T182 Y187 A217 A218 N219 A224 Y225	R180-L221 HydrophobicContact CB-CD1 4.49Å; R180-L221 HydrophobicContact CB-CD2 3.66Å; R180-L221 HydrophobicContact CB-CG 4.26Å; R180-L221 HydrophobicContact CG-CD2 4.36Å; T182-L221 HydrophobicContact CG2-CD1 3.54Å; Y187-L221 HydrophobicContact CD2-CD2 3.52Å; Y187-L221 HydrophobicContact CE2-CD2 3.97Å; Y187-L221 HydrophobicContact CG-CD2 4.02Å; A217-L221 WeakPolarHBondContact O-CB 3.39Å; A217-L221 PolarHBondContact O-N 2.84Å; A218-L221 PolarHBondContact O-N 2.85Å; N219-L221 PolarHBondContact O-N 3.42Å; L221-A224 PolarHBondContact O-N 2.87Å; L221-Y225 WeakPolarHBondContact O-CB 3.49Å; L221-Y225 PolarHBondContact O-N 3.31Å
222	M	97.4	Very high	95.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-46.9	176.8	-74.1	174.7	73.3	0	0	111.2	Y187 P213 A218 N219 Y225 L226 I236 M278 M296	Y187-M222 HydrophobicContact CD1-CG 4.05Å; Y187-M222 HydrophobicContact CD1-SD 4.34Å; Y187-M222 HydrophobicContact CE1-CG 4.04Å; Y187-M222 HydrophobicContact CE1-SD 3.93Å; P213-M222 HydrophobicContact CB-SD 3.8Å; P213-M222 HydrophobicContact CG-CE 4.39Å; P213-M222 HydrophobicContact CG-SD 4.27Å; A218-M222 WeakPolarHBondContact O-CB 3.47Å; A218-M222 VanDerWaalsContact O-CG 3.25Å; A218-M222 WeakPolarHBondContact O-CG 3.44Å; A218-M222 PolarHBondContact O-N 3.4Å; N219-M222 PolarHBondContact O-N 2.85Å; M222-Y225 WeakPolarHBondContact O-CB 3.45Å; M222-Y225 PolarHBondContact O-N 3.04Å; M222-L226 WeakPolarHBondContact O-CD1 3.31Å; M222-L226 PolarHBondContact O-N 2.87Å; M222-I236 HydrophobicContact CE-CB 4.3Å; M222-I236 HydrophobicContact CE-CG2 3.58Å; M222-M278 HydrophobicContact CB-CE 3.91Å; M222-M278 HydrophobicContact CB-SD 3.7Å; M222-M278 HydrophobicContact CE-CE 3.97Å; M222-M278 HydrophobicContact SD-CE 4.28Å; M222-M296 HydrophobicContact CB-CE 3.37Å; M222-M296 HydrophobicContact CB-SD 4.48Å; M222-M296 HydrophobicContact CE-CE 3.5Å; M222-M296 VanDerWaalsContact CE-CE 3.5Å; M222-M296 HydrophobicContact CG-CE 3.49Å; M222-M296 VanDerWaalsContact CG-CE 3.49Å; M222-M296 HydrophobicContact CG-SD 4.24Å; M222-M296 HydrophobicContact SD-CE 4.3Å
223	A	97.7	Very high	95.9	Very high	12 Å²	12	47.3 Å²	47.3	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-45.9	177.1	0	0	0	0	0	112.5	N219 Y225 L226 A227 G282	N219-A223 WeakPolarHBondContact O-CB 3.13Å; N219-A223 PolarHBondContact O-N 2.71Å; A223-Y225 VanDerWaalsContact C-N 3.26Å; A223-Y225 PolarHBondContact O-N 3.28Å; A223-L226 WeakPolarHBondContact O-CB 3.47Å; A223-L226 PolarHBondContact O-N 3.32Å; A223-A227 WeakPolarHBondContact O-CB 3.47Å; A223-A227 PolarHBondContact O-N 2.61Å; A223-G282 VanDerWaalsContact CB-CA 3.42Å
224	A	95.9	Very high	96	Very high	44 Å²	44	47.3 Å²	47.3	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-36.4	176	0	0	0	0	0	111.8	G220 L221 A227 Q228	G220-A224 WeakPolarHBondContact O-CB 3.17Å; G220-A224 PolarHBondContact O-N 2.95Å; L221-A224 PolarHBondContact O-N 2.87Å; A224-A227 PolarHBondContact O-N 2.56Å; A224-Q228 WeakPolarHBondContact O-CB 3.47Å; A224-Q228 WeakPolarHBondContact O-CG 3.38Å; A224-Q228 PolarHBondContact O-N 3.13Å
225	Y	95.9	Very high	96.2	Very high	12 Å²	12	43.8 Å²	43.8	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-46	176.1	-165.5	-177.3	0	0	0	111.3	G178 R180 Y187 L189 L221 M222 A223 A227 Q228 A229 M296	G178-Y225 VanDerWaalsContact C-OH 3.3Å; G178-Y225 WeakPolarHBondContact O-CE2 3.48Å; G178-Y225 PolarHBondContact O-OH 2.87Å; R180-Y225 HydrophobicContact CB-CD1 3.94Å; R180-Y225 HydrophobicContact CB-CE1 4.23Å; R180-Y225 HydrophobicContact CB-CG 4.42Å; R180-Y225 HydrophobicContact CG-CD1 3.49Å; R180-Y225 VanDerWaalsContact CG-CD1 3.49Å; R180-Y225 HydrophobicContact CG-CD2 3.92Å; R180-Y225 HydrophobicContact CG-CE1 3.91Å; R180-Y225 HydrophobicContact CG-CE2 4.33Å; R180-Y225 HydrophobicContact CG-CG 3.5Å; Y187-Y225 WeakPolarHBondContact O-CE1 3.43Å; L189-Y225 HydrophobicContact CB-CD1 4.39Å; L189-Y225 HydrophobicContact CB-CE1 3.71Å; L189-Y225 HydrophobicContact CB-CE2 3.99Å; L189-Y225 VanDerWaalsContact CB-CZ 3.45Å; L189-Y225 WeakPolarHBondContact CB-OH 3.13Å; L189-Y225 HydrophobicContact CD2-CE2 4.17Å; L189-Y225 PolarHBondContact N-OH 3.2Å; L221-Y225 WeakPolarHBondContact O-CB 3.49Å; L221-Y225 PolarHBondContact O-N 3.31Å; M222-Y225 WeakPolarHBondContact O-CB 3.45Å; M222-Y225 PolarHBondContact O-N 3.04Å; A223-Y225 VanDerWaalsContact C-N 3.26Å; A223-Y225 PolarHBondContact O-N 3.28Å; Y225-A227 PolarHBondContact O-N 2.92Å; Y225-Q228 PolarHBondContact O-N 2.65Å; Y225-A229 VanDerWaalsContact O-CB 3.29Å; Y225-A229 WeakPolarHBondContact O-CB 3.48Å; Y225-A229 PolarHBondContact O-N 3.47Å; Y225-M296 HydrophobicContact CD1-SD 3.68Å; Y225-M296 HydrophobicContact CE1-SD 4.27Å; Y225-M296 HydrophobicContact CG-SD 4.5Å
226	L	96.6	Very high	96.3	Very high	0 Å²	0	40 Å²	40	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-49.3	174.2	-96.9	66.1	0	0	0	112.1	L189 M222 A223 Q228 A229 G230 L231 V234 M278 M296	L189-L226 HydrophobicContact CD1-CD1 4.46Å; M222-L226 WeakPolarHBondContact O-CD1 3.31Å; M222-L226 PolarHBondContact O-N 2.87Å; A223-L226 WeakPolarHBondContact O-CB 3.47Å; A223-L226 PolarHBondContact O-N 3.32Å; L226-Q228 PolarHBondContact O-N 3.06Å; L226-A229 CarbonylContact O-C 3.57Å; L226-A229 PolarHBondContact O-N 3.46Å; L226-G230 PolarHBondContact O-N 3.11Å; L226-G230 VanDerWaalsContact O-N 3.08Å; L226-L231 PolarHBondContact O-N 2.87Å; L226-V234 HydrophobicContact CD1-CG1 4.01Å; L226-V234 HydrophobicContact CD1-CG2 3.78Å; L226-V234 HydrophobicContact CD2-CB 4.49Å; L226-V234 HydrophobicContact CD2-CG1 4.09Å; L226-V234 HydrophobicContact CD2-CG2 3.92Å; L226-V234 HydrophobicContact CG-CG1 3.96Å; L226-V234 HydrophobicContact CG-CG2 4.25Å; L226-M278 HydrophobicContact CD2-CG 4.2Å; L226-M278 WeakPolarHBondContact CD2-O 3.4Å; L226-M296 HydrophobicContact CD1-CE 3.51Å; L226-M296 HydrophobicContact CD1-SD 4.29Å
227	A	94.7	Very high	96.5	Very high	59 Å²	59	35 Å²	35	49%	0.488	24%	0.237	S	C	.	.	H	α-helix	trans	-61	-45	-179.3	0	0	0	0	0	111.8	A223 A224 Y225 A229 G230	A223-A227 WeakPolarHBondContact O-CB 3.47Å; A223-A227 PolarHBondContact O-N 2.61Å; A224-A227 PolarHBondContact O-N 2.56Å; Y225-A227 PolarHBondContact O-N 2.92Å; A227-A229 VanDerWaalsContact C-N 3.3Å; A227-A229 PolarHBondContact O-N 3.22Å; A227-G230 PolarHBondContact O-N 3.08Å; A227-G230 VanDerWaalsContact O-N 3.11Å
228	Q	93	Very high	96.7	Very high	128 Å²	128	31.3 Å²	31.3	60%	0.598	21%	0.207	S	C	*	.	H	α-helix	trans	-66	-32.2	176.5	-72.4	169.7	5.2	0	0	112.6	A224 Y225 L226 G230	A224-Q228 WeakPolarHBondContact O-CB 3.47Å; A224-Q228 WeakPolarHBondContact O-CG 3.38Å; A224-Q228 PolarHBondContact O-N 3.13Å; Y225-Q228 PolarHBondContact O-N 2.65Å; L226-Q228 PolarHBondContact O-N 3.06Å; Q228-G230 PolarHBondContact O-N 3.44Å
229	A	93.3	Very high	96.8	Very high	27 Å²	27	32 Å²	32	22%	0.223	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.7	175.3	0	0	0	0	0	113.4	L189 Y225 L226 A227 L231	L189-A229 HydrophobicContact CD2-CB 3.37Å; Y225-A229 VanDerWaalsContact O-CB 3.29Å; Y225-A229 WeakPolarHBondContact O-CB 3.48Å; Y225-A229 PolarHBondContact O-N 3.47Å; L226-A229 CarbonylContact O-C 3.57Å; L226-A229 PolarHBondContact O-N 3.46Å; A227-A229 VanDerWaalsContact C-N 3.3Å; A227-A229 PolarHBondContact O-N 3.22Å; A229-L231 VanDerWaalsContact C-N 3.29Å; A229-L231 HydrophobicContact CB-CD1 4.38Å; A229-L231 HydrophobicContact CB-CG 4.05Å; A229-L231 PolarHBondContact O-N 2.92Å
230	G	95.4	Very high	96.8	Very high	68 Å²	68	31.9 Å²	31.9	70%	0.701	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.5	27.1	-177.7	0	0	0	0	0	113.3	L226 A227 Q228	L226-G230 PolarHBondContact O-N 3.11Å; L226-G230 VanDerWaalsContact O-N 3.08Å; A227-G230 PolarHBondContact O-N 3.08Å; A227-G230 VanDerWaalsContact O-N 3.11Å; Q228-G230 PolarHBondContact O-N 3.44Å
231	L	95.8	Very high	96.8	Very high	26 Å²	26	34.8 Å²	34.8	14%	0.136	22%	0.216	C	C	.	.			trans	-96.7	139.9	-179.2	-62.9	-173.7	0	0	0	111.4	L189 L226 A229 V234 A280 Y294	L189-L231 HydrophobicContact CD1-CD1 3.69Å; L189-L231 HydrophobicContact CD2-CD1 3.54Å; L189-L231 HydrophobicContact CD2-CG 4.42Å; L189-L231 HydrophobicContact CG-CD1 3.98Å; L226-L231 PolarHBondContact O-N 2.87Å; A229-L231 VanDerWaalsContact C-N 3.29Å; A229-L231 HydrophobicContact CB-CD1 4.38Å; A229-L231 HydrophobicContact CB-CG 4.05Å; A229-L231 PolarHBondContact O-N 2.92Å; L231-V234 HydrophobicContact CD1-CG1 3.96Å; L231-A280 WeakPolarHBondContact O-CB 3.49Å; L231-Y294 HydrophobicContact CD1-CD2 3.75Å; L231-Y294 HydrophobicContact CD2-CD2 3.62Å; L231-Y294 HydrophobicContact CD2-CE2 3.71Å; L231-Y294 HydrophobicContact CG-CD2 4.33Å
232	A	96.8	Very high	96.8	Very high	71 Å²	71	40 Å²	40	59%	0.587	24%	0.239	S	C	*	.	S	Bend	trans	-77.1	-39.1	178.3	0	0	0	0	0	112.7	V279 A280	A232-V279 CarbonylContact O-C 3.54Å; A232-V279 VanDerWaalsContact O-CA 3.28Å; A232-V279 WeakPolarHBondContact O-CA 3.47Å; A232-A280 PolarHBondContact O-N 2.98Å
233	R	98.1	Very high	96.7	Very high	130 Å²	130	48.7 Å²	48.7	49%	0.491	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	156	-174.4	65.1	-176	92.4	139.2	-7.1	112.6	E277 M278 V279 M293	R233-E277 WeakPolarHBondContact CD-OE2 3.1Å; R233-E277 IonicContact NE-OE1 2.89Å; R233-M278 CarbonylContact C-O 3.5Å; R233-M278 WeakPolarHBondContact CA-O 3.27Å; R233-V279 HydrophobicContact CB-CG1 4.35Å; R233-M293 HydrophobicContact CG-SD 4.29Å
234	V	98.7	Very high	96.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	157.3	171.7	-53.9	0	0	0	0	111.3	L189 L226 L231 I236 E277 M278 Y294 M296	L189-V234 HydrophobicContact CD1-CG1 3.76Å; L226-V234 HydrophobicContact CD1-CG1 4.01Å; L226-V234 HydrophobicContact CD1-CG2 3.78Å; L226-V234 HydrophobicContact CD2-CB 4.49Å; L226-V234 HydrophobicContact CD2-CG1 4.09Å; L226-V234 HydrophobicContact CD2-CG2 3.92Å; L226-V234 HydrophobicContact CG-CG1 3.96Å; L226-V234 HydrophobicContact CG-CG2 4.25Å; L231-V234 HydrophobicContact CD1-CG1 3.96Å; V234-I236 HydrophobicContact CG2-CG2 4.21Å; V234-E277 CarbonylContact O-C 3.6Å; V234-E277 WeakPolarHBondContact O-CA 3.39Å; V234-E277 WeakPolarHBondContact O-CB 3.49Å; V234-M278 PolarHBondContact N-O 3.18Å; V234-M278 PolarHBondContact O-N 2.93Å; V234-Y294 CarbonylContact C-O 3.56Å; V234-Y294 WeakPolarHBondContact CA-O 3.45Å; V234-Y294 WeakPolarHBondContact CB-O 3.21Å; V234-M296 HydrophobicContact CG2-CB 4.2Å; V234-M296 HydrophobicContact CG2-CE 4.4Å
235	F	98.8	Very high	96.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	140.6	165.7	-78.9	-53.5	0	0	0	112.3	K194 Y196 L210 C275 V287 T291 M293 Y294 F295 M296	K194-F235 WeakPolarHBondContact O-CE2 3.37Å; Y196-F235 HydrophobicContact CD2-CB 4.41Å; Y196-F235 AromaticContact CD2-CD1 3.66Å; Y196-F235 HydrophobicContact CD2-CD1 3.66Å; Y196-F235 AromaticContact CD2-CE1 3.97Å; Y196-F235 HydrophobicContact CD2-CE1 3.97Å; Y196-F235 HydrophobicContact CD2-CG 4.02Å; Y196-F235 HydrophobicContact CE2-CD1 4.39Å; L210-F235 HydrophobicContact CD2-CB 4.48Å; F235-C275 HydrophobicContact CE1-CB 4.24Å; F235-V287 HydrophobicContact CD1-CG2 4.49Å; F235-V287 HydrophobicContact CE1-CG2 3.75Å; F235-T291 VanDerWaalsContact CE2-O 3.26Å; F235-T291 WeakPolarHBondContact CE2-O 3.25Å; F235-T291 VanDerWaalsContact CZ-O 3.29Å; F235-T291 WeakPolarHBondContact CZ-O 3.42Å; F235-M293 HydrophobicContact CD1-CE 4.24Å; F235-M293 HydrophobicContact CD1-CG 4.3Å; F235-M293 HydrophobicContact CD1-SD 3.96Å; F235-M293 HydrophobicContact CD2-CG 3.37Å; F235-M293 HydrophobicContact CD2-SD 4.12Å; F235-M293 HydrophobicContact CE1-CE 3.79Å; F235-M293 HydrophobicContact CE1-CG 4.42Å; F235-M293 HydrophobicContact CE1-SD 4.13Å; F235-M293 HydrophobicContact CE2-CE 4.22Å; F235-M293 HydrophobicContact CE2-CG 3.51Å; F235-M293 HydrophobicContact CE2-SD 4.27Å; F235-M293 HydrophobicContact CG-CG 3.81Å; F235-M293 HydrophobicContact CG-SD 3.96Å; F235-M293 HydrophobicContact CZ-CE 3.78Å; F235-M293 HydrophobicContact CZ-CG 4.05Å; F235-M293 HydrophobicContact CZ-SD 4.28Å; F235-Y294 PolarHBondContact N-O 3.01Å; F235-F295 HydrophobicContact CB-CB 3.94Å; F235-M296 PolarHBondContact O-N 2.8Å
236	I	98.7	Very high	96.6	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	164.5	171.9	60.6	165.2	0	0	0	110.8	Y196 P213 M222 V234 I238 V276 M278 W284	Y196-I236 VanDerWaalsContact CE2-O 3.28Å; Y196-I236 WeakPolarHBondContact CE2-O 3.4Å; P213-I236 HydrophobicContact CG-CD1 3.97Å; M222-I236 HydrophobicContact CE-CB 4.3Å; M222-I236 HydrophobicContact CE-CG2 3.58Å; V234-I236 HydrophobicContact CG2-CG2 4.21Å; I236-I238 HydrophobicContact CD1-CD1 3.71Å; I236-I238 HydrophobicContact CD1-CG1 4.13Å; I236-I238 HydrophobicContact CG1-CG1 4.45Å; I236-I238 PolarHBondContact O-N 3.47Å; I236-V276 HydrophobicContact CD1-CG1 3.81Å; I236-V276 HydrophobicContact CG1-CB 4.12Å; I236-V276 HydrophobicContact CG1-CG1 3.85Å; I236-V276 WeakPolarHBondContact CG1-O 3.47Å; I236-V276 PolarHBondContact N-O 2.79Å; I236-M278 HydrophobicContact CD1-CB 4.23Å; I236-M278 HydrophobicContact CD1-CE 4.36Å; I236-M278 HydrophobicContact CG1-CB 4.46Å; I236-M278 HydrophobicContact CG2-CB 3.59Å; I236-M278 HydrophobicContact CG2-CE 4.26Å; I236-W284 HydrophobicContact CD1-CD2 4.38Å; I236-W284 HydrophobicContact CD1-CG 4.18Å
237	G	98.4	Very high	96.7	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	52.8	-171	0	0	0	0	0	114.1	G211 Y249 S250	G211-G237 WeakPolarHBondContact O-CA 3.33Å; G211-G237 PolarHBondContact O-N 3.42Å; G237-Y249 CarbonylContact O-C 3.41Å; G237-Y249 VanDerWaalsContact O-CA 3.25Å; G237-Y249 WeakPolarHBondContact O-CA 3.49Å; G237-S250 WeakPolarHBondContact CA-OG 3.16Å; G237-S250 PolarHBondContact O-N 3.21Å; G237-S250 PolarHBondContact O-OG 2.91Å
238	I	98.5	Very high	96.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	138.5	174.4	-48.8	176.8	0	0	0	108.2	Y196 P213 I236 F247 V248 Y249 M255 V276 W284	Y196-I238 PolarHBondContact OH-N 3.1Å; Y196-I238 PolarHBondContact OH-O 2.94Å; P213-I238 HydrophobicContact CG-CD1 4.22Å; I236-I238 HydrophobicContact CD1-CD1 3.71Å; I236-I238 HydrophobicContact CD1-CG1 4.13Å; I236-I238 HydrophobicContact CG1-CG1 4.45Å; I236-I238 PolarHBondContact O-N 3.47Å; I238-F247 HydrophobicContact CG2-CB 4.03Å; I238-F247 HydrophobicContact CG2-CD1 3.93Å; I238-F247 HydrophobicContact CG2-CG 4.39Å; I238-V248 WeakPolarHBondContact CA-O 3.46Å; I238-Y249 HydrophobicContact CD1-CD1 4.39Å; I238-Y249 HydrophobicContact CD1-CE1 3.9Å; I238-Y249 HydrophobicContact CG1-CD1 3.82Å; I238-Y249 HydrophobicContact CG1-CE1 3.84Å; I238-M255 HydrophobicContact CG2-SD 4.04Å; I238-V276 HydrophobicContact CB-CB 3.87Å; I238-V276 HydrophobicContact CB-CG1 4.36Å; I238-V276 HydrophobicContact CB-CG2 3.72Å; I238-V276 HydrophobicContact CG2-CB 4.46Å; I238-V276 HydrophobicContact CG2-CG2 3.78Å; I238-V276 WeakPolarHBondContact O-CB 3.47Å; I238-V276 WeakPolarHBondContact O-CG2 3.18Å; I238-V276 PolarHBondContact O-N 3.01Å; I238-W284 HydrophobicContact CD1-CD2 4.22Å; I238-W284 HydrophobicContact CD1-CE3 3.86Å; I238-W284 HydrophobicContact CD1-CH2 4.03Å; I238-W284 HydrophobicContact CD1-CZ2 4.4Å; I238-W284 HydrophobicContact CD1-CZ3 3.72Å
239	N	98.4	Very high	97.1	Very high	19 Å²	19	47.9 Å²	47.9	10%	0.102	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	163	176.8	62.5	88.3	0	0	0	110.5	Y196 L241 F247 V248 D274	Y196-N239 HydrophobicContact CE1-CB 4.24Å; Y196-N239 PolarHBondContact OH-ND2 2.98Å; N239-L241 HydrophobicContact CB-CD1 4.06Å; N239-L241 HydrophobicContact CB-CG 4.11Å; N239-F247 CarbonylContact O-C 3.55Å; N239-F247 WeakPolarHBondContact O-CA 3.2Å; N239-V248 PolarHBondContact N-O 2.84Å; N239-V248 WeakPolarHBondContact O-CG2 3.34Å; N239-V248 PolarHBondContact O-N 3.49Å; N239-D274 WeakPolarHBondContact CA-O 3.25Å; N239-D274 WeakPolarHBondContact CB-O 3.43Å
240	D	98.1	Very high	97.3	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.011	27%	0.265	C	S	.	.			trans	-126.2	22.9	171.9	61.4	-31.2	0	0	0	112.9	E242 R243 G245 F247 D274	D240-E242 PolarHBondContact O-N 3.26Å; D240-R243 CarbonylContact O-C 3.52Å; D240-R243 PolarHBondContact O-N 3.47Å; D240-G245 PolarHBondContact OD2-N 2.96Å; D240-F247 HydrophobicContact CB-CD1 3.89Å; D240-F247 HydrophobicContact CB-CD2 4.2Å; D240-F247 HydrophobicContact CB-CE1 4.05Å; D240-F247 HydrophobicContact CB-CE2 4.32Å; D240-F247 HydrophobicContact CB-CG 3.97Å; D240-F247 HydrophobicContact CB-CZ 4.26Å; D240-F247 VanDerWaalsContact OD1-CE1 3.28Å; D240-F247 WeakPolarHBondContact OD1-CE1 3.49Å; D240-F247 WeakPolarHBondContact OD2-CZ 3.01Å; D240-D274 PolarHBondContact N-O 2.88Å; D240-D274 VanDerWaalsContact N-O 3.1Å; D240-D274 VanDerWaalsContact OD1-CA 3.25Å; D240-D274 WeakPolarHBondContact OD1-CA 3.4Å
241	L	97.1	Very high	97.2	Very high	94 Å²	94	47.7 Å²	47.7	49%	0.492	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.6	-33.5	176.9	-74.5	165.9	0	0	0	115.7	Y196 N239 D274	Y196-L241 HydrophobicContact CE1-CD1 4.49Å; N239-L241 HydrophobicContact CB-CD1 4.06Å; N239-L241 HydrophobicContact CB-CG 4.11Å; L241-D274 HydrophobicContact CD2-CB 3.63Å; L241-D274 HydrophobicContact CG-CB 3.95Å
242	E	95.6	Very high	97.2	Very high	148 Å²	148	55.4 Å²	55.4	69%	0.692	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-31.1	-179.7	-68	-170.5	-175.5	0	0	112.6	D240 R252	D240-E242 PolarHBondContact O-N 3.26Å; E242-R252 IonicContact OE1-NH1 2.84Å; E242-R252 PolarHBondContact OE1-NH1 2.9Å
243	R	96	Very high	97.2	Very high	182 Å²	182	53.3 Å²	53.3	69%	0.687	26%	0.259	S	S	*	.	S	Bend	trans	-159.2	111.1	-177.7	-177.3	176.1	67	-170.6	-0.4	110.3	D240 G245 A246	D240-R243 CarbonylContact O-C 3.52Å; D240-R243 PolarHBondContact O-N 3.47Å; R243-G245 PolarHBondContact O-N 3.03Å; R243-A246 HydrophobicContact CB-CB 4.17Å; R243-A246 HydrophobicContact CG-CB 4.15Å; R243-A246 WeakPolarHBondContact O-CA 3.29Å; R243-A246 VanDerWaalsContact O-CB 3.3Å; R243-A246 WeakPolarHBondContact O-CB 3.18Å; R243-A246 PolarHBondContact O-N 3.06Å
244	E	96.4	Very high	97	Very high	100 Å²	100	50.9 Å²	50.9	47%	0.467	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.7	128.1	175.3	-179.1	55.2	-144.8	0	0	113.5	A246 N268	E244-A246 PolarHBondContact O-N 3.27Å; E244-N268 PolarHBondContact OE1-ND2 2.9Å; E244-N268 PolarHBondContact OE2-ND2 3.42Å; E244-N268 VanDerWaalsContact OE2-ND2 3.08Å
245	G	94.3	Very high	96.7	Very high	55 Å²	55	52.9 Å²	52.9	57%	0.567	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	-2.5	-179.8	0	0	0	0	0	114.7	D240 R243	D240-G245 PolarHBondContact OD2-N 2.96Å; R243-G245 PolarHBondContact O-N 3.03Å
246	A	96.5	Very high	96.3	Very high	25 Å²	25	61.6 Å²	61.6	21%	0.207	30%	0.303	C	S	.	.			trans	-109.1	71.2	179.2	0	0	0	0	0	112	R243 E244	R243-A246 HydrophobicContact CB-CB 4.17Å; R243-A246 HydrophobicContact CG-CB 4.15Å; R243-A246 WeakPolarHBondContact O-CA 3.29Å; R243-A246 VanDerWaalsContact O-CB 3.3Å; R243-A246 WeakPolarHBondContact O-CB 3.18Å; R243-A246 PolarHBondContact O-N 3.06Å; E244-A246 PolarHBondContact O-N 3.27Å
247	F	97.6	Very high	95.9	Very high	22 Å²	22	68.3 Å²	68.3	10%	0.096	34%	0.344	C	S	.	.			trans	-57.7	136.1	179.6	-67.8	-90.1	0	0	0	113.6	I238 N239 D240 M255 W261 P266 V276 D286	I238-F247 HydrophobicContact CG2-CB 4.03Å; I238-F247 HydrophobicContact CG2-CD1 3.93Å; I238-F247 HydrophobicContact CG2-CG 4.39Å; N239-F247 CarbonylContact O-C 3.55Å; N239-F247 WeakPolarHBondContact O-CA 3.2Å; D240-F247 HydrophobicContact CB-CD1 3.89Å; D240-F247 HydrophobicContact CB-CD2 4.2Å; D240-F247 HydrophobicContact CB-CE1 4.05Å; D240-F247 HydrophobicContact CB-CE2 4.32Å; D240-F247 HydrophobicContact CB-CG 3.97Å; D240-F247 HydrophobicContact CB-CZ 4.26Å; D240-F247 VanDerWaalsContact OD1-CE1 3.28Å; D240-F247 WeakPolarHBondContact OD1-CE1 3.49Å; D240-F247 WeakPolarHBondContact OD2-CZ 3.01Å; F247-M255 HydrophobicContact CB-CB 4.44Å; F247-M255 HydrophobicContact CB-SD 3.83Å; F247-M255 WeakPolarHBondContact O-CB 3.33Å; F247-M255 PolarHBondContact O-N 2.77Å; F247-W261 AromaticContact CD1-CH2 3.97Å; F247-W261 HydrophobicContact CD1-CH2 3.97Å; F247-W261 AromaticContact CD1-CZ2 3.96Å; F247-W261 HydrophobicContact CD1-CZ2 3.96Å; F247-W261 HydrophobicContact CD2-CZ2 4.1Å; F247-W261 AromaticContact CE1-CH2 3.73Å; F247-W261 HydrophobicContact CE1-CH2 3.73Å; F247-W261 HydrophobicContact CE1-CZ2 4.06Å; F247-W261 HydrophobicContact CE2-CH2 4.49Å; F247-W261 HydrophobicContact CE2-CZ2 4.23Å; F247-W261 HydrophobicContact CG-CH2 4.44Å; F247-W261 AromaticContact CG-CZ2 3.97Å; F247-W261 HydrophobicContact CG-CZ2 3.97Å; F247-W261 HydrophobicContact CZ-CH2 4.02Å; F247-W261 HydrophobicContact CZ-CZ2 4.2Å; F247-P266 HydrophobicContact CD2-CG 4.32Å; F247-P266 HydrophobicContact CE2-CB 3.74Å; F247-P266 HydrophobicContact CE2-CG 3.49Å; F247-P266 VanDerWaalsContact CE2-CG 3.49Å; F247-P266 HydrophobicContact CZ-CB 3.61Å; F247-P266 HydrophobicContact CZ-CG 3.92Å; F247-V276 HydrophobicContact CD1-CG2 3.97Å; F247-V276 HydrophobicContact CE1-CG2 3.82Å; F247-D286 HydrophobicContact CZ-CB 4.4Å
248	V	97.9	Very high	95.8	Very high	34 Å²	34	70.1 Å²	70.1	21%	0.206	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.7	176.6	-64.1	0	0	0	0	110.2	I238 N239	I238-V248 WeakPolarHBondContact CA-O 3.46Å; N239-V248 PolarHBondContact N-O 2.84Å; N239-V248 WeakPolarHBondContact O-CG2 3.34Å; N239-V248 PolarHBondContact O-N 3.49Å
249	Y	98.3	Very high	95.7	Very high	3 Å²	3	73.8 Å²	73.8	1%	0.012	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	164.2	172.6	-68.8	-74.5	0	0	0	111.5	M212 K214 G237 I238 D251 R252 S253 M255	M212-Y249 HydrophobicContact CB-CD1 3.74Å; M212-Y249 HydrophobicContact CB-CE1 4.37Å; M212-Y249 HydrophobicContact CB-CG 4.38Å; M212-Y249 HydrophobicContact CG-CD1 4.04Å; M212-Y249 HydrophobicContact CG-CG 4.45Å; K214-Y249 HydrophobicContact CG-CD1 4.32Å; K214-Y249 HydrophobicContact CG-CD2 4.3Å; K214-Y249 HydrophobicContact CG-CE1 3.97Å; K214-Y249 HydrophobicContact CG-CE2 3.93Å; K214-Y249 HydrophobicContact CG-CG 4.49Å; G237-Y249 CarbonylContact O-C 3.41Å; G237-Y249 VanDerWaalsContact O-CA 3.25Å; G237-Y249 WeakPolarHBondContact O-CA 3.49Å; I238-Y249 HydrophobicContact CD1-CD1 4.39Å; I238-Y249 HydrophobicContact CD1-CE1 3.9Å; I238-Y249 HydrophobicContact CG1-CD1 3.82Å; I238-Y249 HydrophobicContact CG1-CE1 3.84Å; Y249-D251 WeakPolarHBondContact CB-OD1 3.22Å; Y249-D251 PolarHBondContact O-N 3.37Å; Y249-D251 VanDerWaalsContact O-N 3.13Å; Y249-R252 WeakPolarHBondContact O-CA 3.4Å; Y249-R252 PolarHBondContact O-N 2.97Å; Y249-S253 WeakPolarHBondContact CD2-OG 3.05Å; Y249-S253 PolarHBondContact N-O 3Å; Y249-M255 HydrophobicContact CE2-CB 4.45Å; Y249-M255 HydrophobicContact CE2-CG 4.47Å
250	S	97.3	Very high	95.7	Very high	17 Å²	17	76 Å²	76	12%	0.119	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-23.5	179.1	-77.5	0	0	0	0	115.2	G237 R252	G237-S250 WeakPolarHBondContact CA-OG 3.16Å; G237-S250 PolarHBondContact O-N 3.21Å; G237-S250 PolarHBondContact O-OG 2.91Å; S250-R252 VanDerWaalsContact C-N 3.25Å
251	D	95.1	Very high	95.7	Very high	73 Å²	73	78 Å²	78	39%	0.39	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	10.8	173.4	70.3	-12.3	0	0	0	113.5	M212 K214 Y249 S253	M212-D251 HydrophobicContact CE-CB 4.04Å; M212-D251 HydrophobicContact SD-CB 3.77Å; M212-D251 VanDerWaalsContact SD-CG 3.56Å; M212-D251 PolarHBondContact SD-N 2.83Å; M212-D251 VanDerWaalsContact SD-N 3.4Å; K214-D251 IonicContact NZ-OD1 2.77Å; K214-D251 IonicContact NZ-OD2 3.96Å; K214-D251 PolarHBondContact NZ-OD2 3.07Å; Y249-D251 WeakPolarHBondContact CB-OD1 3.22Å; Y249-D251 PolarHBondContact O-N 3.37Å; Y249-D251 VanDerWaalsContact O-N 3.13Å; D251-S253 PolarHBondContact O-N 2.02Å; D251-S253 WeakPolarHBondContact OD1-CB 3.33Å; D251-S253 PolarHBondContact OD1-N 3.48Å; D251-S253 PolarHBondContact OD1-OG 3.1Å; D251-S253 PolarHBondContact OD2-OG 3.22Å
252	R	95	Very high	95.8	Very high	189 Å²	189	79 Å²	79	71%	0.713	39%	0.385	S	S	*	.	S	Bend	trans	64.5	9.1	-174.1	-51.7	175.3	175.9	-98.3	-0.9	114.4	E242 Y249 S250	E242-R252 IonicContact OE1-NH1 2.84Å; E242-R252 PolarHBondContact OE1-NH1 2.9Å; Y249-R252 WeakPolarHBondContact O-CA 3.4Å; Y249-R252 PolarHBondContact O-N 2.97Å; S250-R252 VanDerWaalsContact C-N 3.25Å
253	S	95.8	Very high	95.9	Very high	27 Å²	27	78.4 Å²	78.4	19%	0.189	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-70.1	139.2	171.6	67.7	0	0	0	0	110.1	K214 Y249 D251	K214-S253 WeakPolarHBondContact CE-OG 3.42Å; K214-S253 PolarHBondContact NZ-OG 3.35Å; K214-S253 VanDerWaalsContact NZ-OG 3.12Å; Y249-S253 WeakPolarHBondContact CD2-OG 3.05Å; Y249-S253 PolarHBondContact N-O 3Å; D251-S253 PolarHBondContact O-N 2.02Å; D251-S253 WeakPolarHBondContact OD1-CB 3.33Å; D251-S253 PolarHBondContact OD1-N 3.48Å; D251-S253 PolarHBondContact OD1-OG 3.1Å; D251-S253 PolarHBondContact OD2-OG 3.22Å
254	P	94.8	Very high	95.9	Very high	79 Å²	79	72.6 Å²	72.6	51%	0.513	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-69.1	147.8	-179.9	28.8	-34.9	0	0	0	110.4
255	M	92.8	Very high	96	Very high	42 Å²	42	69.7 Å²	69.7	21%	0.207	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-60.1	140.9	172.7	-167.3	139.8	154.4	0	0	110.9	I238 F247 Y249 N259 W261 W284	I238-M255 HydrophobicContact CG2-SD 4.04Å; F247-M255 HydrophobicContact CB-CB 4.44Å; F247-M255 HydrophobicContact CB-SD 3.83Å; F247-M255 WeakPolarHBondContact O-CB 3.33Å; F247-M255 PolarHBondContact O-N 2.77Å; Y249-M255 HydrophobicContact CE2-CB 4.45Å; Y249-M255 HydrophobicContact CE2-CG 4.47Å; M255-N259 HydrophobicContact CE-CB 3.58Å; M255-W261 HydrophobicContact CE-CZ2 4.07Å; M255-W284 HydrophobicContact CE-CE3 4.11Å; M255-W284 HydrophobicContact CE-CZ3 3.51Å; M255-W284 HydrophobicContact SD-CZ3 4.42Å
256	R	89.4	Confident	96.1	Very high	182 Å²	182	69.6 Å²	69.6	69%	0.687	37%	0.37	S	S	*	.			trans	-100.7	-169.3	-177.3	-62.3	-69.5	-174.8	153.8	1.7	109.6	F258	R256-F258 VanDerWaalsContact C-N 3.25Å; R256-F258 PolarHBondContact O-N 2.95Å
257	T	91.4	Very high	96.2	Very high	141 Å²	141	72.4 Å²	72.4	87%	0.865	38%	0.381	S	S	*	.	S	Bend	trans	-65.9	-28	176.4	48.9	0	0	0	0	113.1	N259	T257-N259 PolarHBondContact O-N 3.35Å; T257-N259 PolarHBondContact O-ND2 3.35Å
258	F	96.2	Very high	96.1	Very high	38 Å²	38	72.4 Å²	72.4	17%	0.167	38%	0.382	C	S	.	.			trans	-69.4	129.1	176.3	177.7	-101.6	0	0	0	111.1	P213 D215 E216 N219 R256 K260 W284	P213-F258 WeakPolarHBondContact O-CD1 3.15Å; P213-F258 VanDerWaalsContact O-CE1 3.25Å; P213-F258 WeakPolarHBondContact O-CE1 3.17Å; D215-F258 VanDerWaalsContact C-CE1 3.49Å; D215-F258 WeakPolarHBondContact O-CE1 3.5Å; D215-F258 WeakPolarHBondContact O-CZ 3.29Å; E216-F258 HydrophobicContact CB-CE2 3.92Å; E216-F258 HydrophobicContact CB-CZ 4.39Å; E216-F258 WeakPolarHBondContact OE2-CE2 3.37Å; N219-F258 HydrophobicContact CB-CE1 4.22Å; N219-F258 HydrophobicContact CB-CZ 3.88Å; R256-F258 VanDerWaalsContact C-N 3.25Å; R256-F258 PolarHBondContact O-N 2.95Å; F258-K260 HydrophobicContact CE1-CG 4.17Å; F258-K260 HydrophobicContact CE2-CD 4.01Å; F258-K260 HydrophobicContact CE2-CG 4.15Å; F258-K260 HydrophobicContact CZ-CD 3.89Å; F258-K260 HydrophobicContact CZ-CG 3.56Å; F258-W284 AromaticContact CD1-CH2 4Å; F258-W284 HydrophobicContact CD1-CH2 4Å; F258-W284 HydrophobicContact CD1-CZ2 4.46Å; F258-W284 AromaticContact CE1-CH2 3.77Å; F258-W284 HydrophobicContact CE1-CH2 3.77Å; F258-W284 AromaticContact CE1-CZ2 3.78Å; F258-W284 HydrophobicContact CE1-CZ2 3.78Å
259	N	96.7	Very high	96	Very high	78 Å²	78	71.9 Å²	71.9	42%	0.417	38%	0.381	S	S	.	.			trans	-154.7	157.6	172.7	68.5	90.7	0	0	0	110.7	M255 T257 W284	M255-N259 HydrophobicContact CE-CB 3.58Å; T257-N259 PolarHBondContact O-N 3.35Å; T257-N259 PolarHBondContact O-ND2 3.35Å; N259-W284 VanDerWaalsContact CA-CZ3 3.47Å; N259-W284 HydrophobicContact CB-CE3 4.43Å; N259-W284 HydrophobicContact CB-CZ3 3.9Å
260	K	98.2	Very high	95.8	Very high	64 Å²	64	81.8 Å²	81.8	28%	0.278	42%	0.42	S	S	.	.			trans	-130	33.9	175	-56.6	-74.4	-75.2	-156.1	0	111.6	E216 N219 F258 R262 G283 W284	E216-K260 VanDerWaalsContact CD-NZ 3.26Å; E216-K260 IonicContact OE1-NZ 2.91Å; E216-K260 PolarHBondContact OE1-NZ 2.96Å; E216-K260 IonicContact OE2-NZ 2.56Å; E216-K260 PolarHBondContact OE2-NZ 3.07Å; N219-K260 HydrophobicContact CB-CG 4.46Å; F258-K260 HydrophobicContact CE1-CG 4.17Å; F258-K260 HydrophobicContact CE2-CD 4.01Å; F258-K260 HydrophobicContact CE2-CG 4.15Å; F258-K260 HydrophobicContact CZ-CD 3.89Å; F258-K260 HydrophobicContact CZ-CG 3.56Å; K260-R262 PolarHBondContact O-N 3.46Å; K260-G283 CarbonylContact O-C 3.48Å; K260-G283 VanDerWaalsContact O-CA 3.25Å; K260-G283 WeakPolarHBondContact O-CA 3.49Å; K260-W284 HydrophobicContact CB-CD2 3.94Å; K260-W284 HydrophobicContact CB-CG 4.21Å; K260-W284 HydrophobicContact CB-CZ2 3.94Å; K260-W284 HydrophobicContact CG-CZ2 3.92Å; K260-W284 PolarHBondContact O-N 2.79Å
261	W	98.1	Very high	95.8	Very high	44 Å²	44	87.4 Å²	87.4	17%	0.167	45%	0.449	C	S	.	.	B	Isolated β-bridge	trans	-53.6	137.8	173.8	-64.9	123.2	0	0	0	111	F247 M255 E265 P266 V276 W284	F247-W261 AromaticContact CD1-CH2 3.97Å; F247-W261 HydrophobicContact CD1-CH2 3.97Å; F247-W261 AromaticContact CD1-CZ2 3.96Å; F247-W261 HydrophobicContact CD1-CZ2 3.96Å; F247-W261 HydrophobicContact CD2-CZ2 4.1Å; F247-W261 AromaticContact CE1-CH2 3.73Å; F247-W261 HydrophobicContact CE1-CH2 3.73Å; F247-W261 HydrophobicContact CE1-CZ2 4.06Å; F247-W261 HydrophobicContact CE2-CH2 4.49Å; F247-W261 HydrophobicContact CE2-CZ2 4.23Å; F247-W261 HydrophobicContact CG-CH2 4.44Å; F247-W261 AromaticContact CG-CZ2 3.97Å; F247-W261 HydrophobicContact CG-CZ2 3.97Å; F247-W261 HydrophobicContact CZ-CH2 4.02Å; F247-W261 HydrophobicContact CZ-CZ2 4.2Å; M255-W261 HydrophobicContact CE-CZ2 4.07Å; W261-E265 HydrophobicContact CB-CB 4.32Å; W261-E265 WeakPolarHBondContact CB-O 3.47Å; W261-E265 HydrophobicContact CE3-CB 4.05Å; W261-P266 HydrophobicContact CD2-CG 4.37Å; W261-P266 HydrophobicContact CE3-CB 4.34Å; W261-P266 HydrophobicContact CH2-CB 4.1Å; W261-P266 HydrophobicContact CH2-CG 4.46Å; W261-P266 HydrophobicContact CZ2-CB 4.31Å; W261-P266 HydrophobicContact CZ2-CG 4.16Å; W261-P266 HydrophobicContact CZ3-CB 4.14Å; W261-V276 HydrophobicContact CH2-CB 4.42Å; W261-V276 HydrophobicContact CH2-CG1 3.94Å; W261-V276 HydrophobicContact CH2-CG2 3.52Å; W261-V276 HydrophobicContact CZ3-CG1 3.84Å; W261-V276 HydrophobicContact CZ3-CG2 4.12Å; W261-W284 HydrophobicContact CD2-CB 4.18Å; W261-W284 HydrophobicContact CD2-CE3 4.22Å; W261-W284 HydrophobicContact CE3-CB 3.51Å; W261-W284 HydrophobicContact CZ2-CE3 4.49Å; W261-W284 HydrophobicContact CZ3-CB 3.79Å
262	R	98.3	Very high	95.8	Very high	117 Å²	117	88.4 Å²	88.4	44%	0.442	45%	0.451	S	S	.	.			trans	-69.9	162.8	172.9	-67	173.7	68	-153.3	-2.1	109.5	K260 G264 E265 W284 N285	K260-R262 PolarHBondContact O-N 3.46Å; R262-G264 PolarHBondContact O-N 2.82Å; R262-E265 HydrophobicContact CB-CG 3.78Å; R262-E265 PolarHBondContact O-N 2.92Å; R262-W284 WeakPolarHBondContact CG-O 3.36Å; R262-W284 PolarHBondContact N-O 3.03Å; R262-N285 PolarHBondContact NH1-OD1 2.79Å
263	S	97.8	Very high	96	Very high	134 Å²	134	80.8 Å²	80.8	94%	0.937	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	115.9	177.1	-179.8	0	0	0	0	110.1
264	G	96.8	Very high	96.1	Very high	61 Å²	61	81.7 Å²	81.7	63%	0.629	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-10.3	-178.2	0	0	0	0	0	114.3	R262 N267	R262-G264 PolarHBondContact O-N 2.82Å; G264-N267 WeakPolarHBondContact O-CB 3.49Å
265	E	97.9	Very high	96.3	Very high	39 Å²	39	77.9 Å²	77.9	18%	0.182	40%	0.402	C	S	.	.			trans	-101.3	156.4	-178.9	-46.1	-54.7	169.7	0	0	112	W261 R262 N267 N285	W261-E265 HydrophobicContact CB-CB 4.32Å; W261-E265 WeakPolarHBondContact CB-O 3.47Å; W261-E265 HydrophobicContact CE3-CB 4.05Å; R262-E265 HydrophobicContact CB-CG 3.78Å; R262-E265 PolarHBondContact O-N 2.92Å; E265-N267 WeakPolarHBondContact OE2-CB 3.28Å; E265-N267 PolarHBondContact OE2-ND2 3.12Å; E265-N285 PolarHBondContact OE1-OD1 3.24Å; E265-N285 VanDerWaalsContact OE1-OD1 3.07Å
266	P	97	Very high	96.5	Very high	53 Å²	53	75.9 Å²	75.9	34%	0.344	39%	0.392	S	S	.	.	S	Bend	cis	-72.2	142	-10.4	31.1	-32.2	0	0	0	111.3	F247 W261 D286	F247-P266 HydrophobicContact CD2-CG 4.32Å; F247-P266 HydrophobicContact CE2-CB 3.74Å; F247-P266 HydrophobicContact CE2-CG 3.49Å; F247-P266 VanDerWaalsContact CE2-CG 3.49Å; F247-P266 HydrophobicContact CZ-CB 3.61Å; F247-P266 HydrophobicContact CZ-CG 3.92Å; W261-P266 HydrophobicContact CD2-CG 4.37Å; W261-P266 HydrophobicContact CE3-CB 4.34Å; W261-P266 HydrophobicContact CH2-CB 4.1Å; W261-P266 HydrophobicContact CH2-CG 4.46Å; W261-P266 HydrophobicContact CZ2-CB 4.31Å; W261-P266 HydrophobicContact CZ2-CG 4.16Å; W261-P266 HydrophobicContact CZ3-CB 4.14Å; P266-D286 WeakPolarHBondContact CA-OD1 3.47Å; P266-D286 HydrophobicContact CB-CB 4.11Å; P266-D286 WeakPolarHBondContact CB-OD2 3.34Å
267	N	97.1	Very high	97	Very high	83 Å²	83	67.9 Å²	67.9	44%	0.444	36%	0.362	S	S	.	.			trans	-116	-8.3	-172.8	77.8	40.4	0	0	0	114.7	G264 E265 A269 E273 D286	G264-N267 WeakPolarHBondContact O-CB 3.49Å; E265-N267 WeakPolarHBondContact OE2-CB 3.28Å; E265-N267 PolarHBondContact OE2-ND2 3.12Å; N267-A269 VanDerWaalsContact OD1-CA 3.26Å; N267-A269 WeakPolarHBondContact OD1-CA 3.33Å; N267-A269 VanDerWaalsContact OD1-CB 3.24Å; N267-A269 WeakPolarHBondContact OD1-CB 3.25Å; N267-A269 PolarHBondContact OD1-N 3.37Å; N267-E273 PolarHBondContact OD1-OE2 2.93Å; N267-D286 PolarHBondContact N-OD1 3.33Å; N267-D286 PolarHBondContact N-OD2 3.38Å
268	N	97	Very high	97.3	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.123	32%	0.321	C	S	.	.			trans	41.4	62.8	-172.2	-172.6	11.3	0	0	0	112.4	E244 Y270 D271 E272 E273 D286	E244-N268 PolarHBondContact OE1-ND2 2.9Å; E244-N268 PolarHBondContact OE2-ND2 3.42Å; E244-N268 VanDerWaalsContact OE2-ND2 3.08Å; N268-Y270 PolarHBondContact O-N 3.11Å; N268-D271 PolarHBondContact ND2-OD1 2.69Å; N268-D271 VanDerWaalsContact ND2-OD1 3.16Å; N268-D271 PolarHBondContact O-N 3.45Å; N268-D271 VanDerWaalsContact OD1-CA 3.32Å; N268-D271 WeakPolarHBondContact OD1-CA 3.42Å; N268-E272 PolarHBondContact OD1-N 2.84Å; N268-E272 VanDerWaalsContact OD1-N 3.11Å; N268-E273 PolarHBondContact OD1-N 2.81Å; N268-D286 WeakPolarHBondContact CA-OD2 3.02Å; N268-D286 PolarHBondContact N-OD2 3.04Å
269	A	94.9	Very high	97.4	Very high	22 Å²	22	60.2 Å²	60.2	18%	0.182	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-60.2	129.2	-171.3	0	0	0	0	0	109.9	N267 D271 E272 E273	N267-A269 VanDerWaalsContact OD1-CA 3.26Å; N267-A269 WeakPolarHBondContact OD1-CA 3.33Å; N267-A269 VanDerWaalsContact OD1-CB 3.24Å; N267-A269 WeakPolarHBondContact OD1-CB 3.25Å; N267-A269 PolarHBondContact OD1-N 3.37Å; A269-D271 PolarHBondContact O-N 3.16Å; A269-D271 VanDerWaalsContact O-N 3.11Å; A269-E272 WeakPolarHBondContact O-CG 3.37Å; A269-E272 PolarHBondContact O-N 2.98Å; A269-E273 VanDerWaalsContact CB-CD 3.43Å; A269-E273 HydrophobicContact CB-CG 4.09Å; A269-E273 WeakPolarHBondContact CB-OE2 3.42Å; A269-E273 PolarHBondContact N-OE2 3.37Å
270	Y	95.4	Very high	97.4	Very high	211 Å²	211	58.4 Å²	58.4	83%	0.827	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	58.9	17.1	-179.2	-48.1	-82.8	0	0	0	115.2	N268 E272	N268-Y270 PolarHBondContact O-N 3.11Å; Y270-E272 VanDerWaalsContact C-N 3.27Å; Y270-E272 PolarHBondContact O-N 3.05Å
271	D	95.3	Very high	97.3	Very high	135 Å²	135	60.2 Å²	60.2	72%	0.722	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	60.6	35.3	-179	-158.9	36.4	0	0	0	112.3	N268 A269	N268-D271 PolarHBondContact ND2-OD1 2.69Å; N268-D271 VanDerWaalsContact ND2-OD1 3.16Å; N268-D271 PolarHBondContact O-N 3.45Å; N268-D271 VanDerWaalsContact OD1-CA 3.32Å; N268-D271 WeakPolarHBondContact OD1-CA 3.42Å; A269-D271 PolarHBondContact O-N 3.16Å; A269-D271 VanDerWaalsContact O-N 3.11Å
272	E	96.3	Very high	97.3	Very high	95 Å²	95	58.1 Å²	58.1	44%	0.444	33%	0.327	S	S	.	.			trans	-136.7	10.3	-177.9	70.1	178.3	-170.4	0	0	114.9	N268 A269 Y270 A288	N268-E272 PolarHBondContact OD1-N 2.84Å; N268-E272 VanDerWaalsContact OD1-N 3.11Å; A269-E272 WeakPolarHBondContact O-CG 3.37Å; A269-E272 PolarHBondContact O-N 2.98Å; Y270-E272 VanDerWaalsContact C-N 3.27Å; Y270-E272 PolarHBondContact O-N 3.05Å; E272-A288 HydrophobicContact CG-CB 4.31Å; E272-A288 VanDerWaalsContact O-CA 3.27Å; E272-A288 WeakPolarHBondContact O-CA 3.38Å; E272-A288 WeakPolarHBondContact O-CB 3.25Å
273	E	98	Very high	97.3	Very high	28 Å²	28	53 Å²	53	13%	0.131	31%	0.311	C	S	.	.			trans	-107.8	77.4	-173	-63	-164.8	139.1	0	0	113.8	N267 N268 A269 D286 V287	N267-E273 PolarHBondContact OD1-OE2 2.93Å; N268-E273 PolarHBondContact OD1-N 2.81Å; A269-E273 VanDerWaalsContact CB-CD 3.43Å; A269-E273 HydrophobicContact CB-CG 4.09Å; A269-E273 WeakPolarHBondContact CB-OE2 3.42Å; A269-E273 PolarHBondContact N-OE2 3.37Å; E273-D286 HydrophobicContact CB-CB 4.17Å; E273-V287 WeakPolarHBondContact OE1-CA 3.32Å
274	D	98.3	Very high	97.3	Very high	46 Å²	46	46.7 Å²	46.7	25%	0.246	27%	0.267	C	S	.	.			trans	-94.3	0.1	-178.2	-50.1	-62.2	0	0	0	115.1	N239 D240 L241	N239-D274 WeakPolarHBondContact CA-O 3.25Å; N239-D274 WeakPolarHBondContact CB-O 3.43Å; D240-D274 PolarHBondContact N-O 2.88Å; D240-D274 VanDerWaalsContact N-O 3.1Å; D240-D274 VanDerWaalsContact OD1-CA 3.25Å; D240-D274 WeakPolarHBondContact OD1-CA 3.4Å; L241-D274 HydrophobicContact CD2-CB 3.63Å; L241-D274 HydrophobicContact CG-CB 3.95Å
275	C	98.6	Very high	97.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.1	-171.5	-74.3	0	0	0	0	111.8	Y196 F235 D286 V287 C289	Y196-C275 WeakPolarHBondContact CB-SG 3.22Å; Y196-C275 WeakPolarHBondContact CD1-SG 3.38Å; Y196-C275 HydrophobicContact CD2-CB 3.63Å; Y196-C275 VanDerWaalsContact CD2-SG 3.51Å; Y196-C275 HydrophobicContact CE2-CB 4.03Å; Y196-C275 HydrophobicContact CG-CB 3.95Å; F235-C275 HydrophobicContact CE1-CB 4.24Å; C275-D286 CarbonylContact O-C 3.12Å; C275-D286 VanDerWaalsContact O-CA 3.25Å; C275-D286 WeakPolarHBondContact O-CA 3.36Å; C275-V287 PolarHBondContact N-O 3.04Å; C275-V287 VanDerWaalsContact N-O 3.16Å; C275-V287 WeakPolarHBondContact O-CG2 3.25Å; C275-V287 PolarHBondContact O-N 3.11Å; C275-V287 VanDerWaalsContact O-O 3.09Å; C275-C289 HydrophobicContact CB-CB 3.95Å; C275-C289 WeakPolarHBondContact CB-SG 3.13Å; C275-C289 PolarHBondContact N-SG 2.82Å; C275-C289 VanDerWaalsContact SG-CA 3.52Å; C275-C289 WeakPolarHBondContact SG-CB 3.43Å; C275-C289 CovalentContact SG-SG 2.02Å; C275-C289 PolarHBondContact SG-SG 3.33Å
276	V	98.7	Very high	97.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.2	-172.6	-174.1	0	0	0	0	113	I236 I238 F247 W261 W284 N285	I236-V276 HydrophobicContact CD1-CG1 3.81Å; I236-V276 HydrophobicContact CG1-CB 4.12Å; I236-V276 HydrophobicContact CG1-CG1 3.85Å; I236-V276 WeakPolarHBondContact CG1-O 3.47Å; I236-V276 PolarHBondContact N-O 2.79Å; I238-V276 HydrophobicContact CB-CB 3.87Å; I238-V276 HydrophobicContact CB-CG1 4.36Å; I238-V276 HydrophobicContact CB-CG2 3.72Å; I238-V276 HydrophobicContact CG2-CB 4.46Å; I238-V276 HydrophobicContact CG2-CG2 3.78Å; I238-V276 WeakPolarHBondContact O-CB 3.47Å; I238-V276 WeakPolarHBondContact O-CG2 3.18Å; I238-V276 PolarHBondContact O-N 3.01Å; F247-V276 HydrophobicContact CD1-CG2 3.97Å; F247-V276 HydrophobicContact CE1-CG2 3.82Å; W261-V276 HydrophobicContact CH2-CB 4.42Å; W261-V276 HydrophobicContact CH2-CG1 3.94Å; W261-V276 HydrophobicContact CH2-CG2 3.52Å; W261-V276 HydrophobicContact CZ3-CG1 3.84Å; W261-V276 HydrophobicContact CZ3-CG2 4.12Å; V276-W284 HydrophobicContact CG1-CB 3.96Å; V276-W284 HydrophobicContact CG1-CG 4.47Å; V276-N285 WeakPolarHBondContact CA-O 3.49Å
277	E	98.6	Very high	97.5	Very high	13 Å²	13	41 Å²	41	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	150.6	166	68.3	172.5	-135.1	0	0	112.2	R233 V234 W284 N285 V287 M293	R233-E277 WeakPolarHBondContact CD-OE2 3.1Å; R233-E277 IonicContact NE-OE1 2.89Å; V234-E277 CarbonylContact O-C 3.6Å; V234-E277 WeakPolarHBondContact O-CA 3.39Å; V234-E277 WeakPolarHBondContact O-CB 3.49Å; E277-W284 WeakPolarHBondContact O-CA 3.42Å; E277-N285 HydrophobicContact CG-CB 3.73Å; E277-N285 PolarHBondContact N-O 2.93Å; E277-N285 PolarHBondContact O-N 3.49Å; E277-V287 HydrophobicContact CB-CG2 4.21Å; E277-V287 HydrophobicContact CG-CG1 3.77Å; E277-V287 HydrophobicContact CG-CG2 4.25Å; E277-M293 HydrophobicContact CB-CE 4.25Å; E277-M293 HydrophobicContact CB-SD 3.87Å; E277-M293 WeakPolarHBondContact OE2-CE 3.38Å
278	M	98.7	Very high	97.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.8	166.1	177.8	-178.7	-70.7	0	0	109	P213 N219 M222 L226 R233 V234 I236 G283	P213-M278 HydrophobicContact CB-CE 4.27Å; P213-M278 HydrophobicContact CG-CE 4.06Å; N219-M278 WeakPolarHBondContact OD1-CE 3.2Å; M222-M278 HydrophobicContact CB-CE 3.91Å; M222-M278 HydrophobicContact CB-SD 3.7Å; M222-M278 HydrophobicContact CE-CE 3.97Å; M222-M278 HydrophobicContact SD-CE 4.28Å; L226-M278 HydrophobicContact CD2-CG 4.2Å; L226-M278 WeakPolarHBondContact CD2-O 3.4Å; R233-M278 CarbonylContact C-O 3.5Å; R233-M278 WeakPolarHBondContact CA-O 3.27Å; V234-M278 PolarHBondContact N-O 3.18Å; V234-M278 PolarHBondContact O-N 2.93Å; I236-M278 HydrophobicContact CD1-CB 4.23Å; I236-M278 HydrophobicContact CD1-CE 4.36Å; I236-M278 HydrophobicContact CG1-CB 4.46Å; I236-M278 HydrophobicContact CG2-CB 3.59Å; I236-M278 HydrophobicContact CG2-CE 4.26Å; M278-G283 WeakPolarHBondContact CA-O 3.28Å
279	V	98	Very high	97.6	Very high	19 Å²	19	37.5 Å²	37.5	12%	0.115	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	166.7	173.3	-62.1	0	0	0	0	111.9	A232 R233 S281 G282 G283	A232-V279 CarbonylContact O-C 3.54Å; A232-V279 VanDerWaalsContact O-CA 3.28Å; A232-V279 WeakPolarHBondContact O-CA 3.47Å; R233-V279 HydrophobicContact CB-CG1 4.35Å; V279-S281 VanDerWaalsContact CG2-OG 3.3Å; V279-S281 WeakPolarHBondContact CG2-OG 3.5Å; V279-S281 PolarHBondContact O-N 3.04Å; V279-G282 WeakPolarHBondContact O-CA 3.27Å; V279-G282 PolarHBondContact O-N 3.43Å; V279-G283 WeakPolarHBondContact CG2-O 3.47Å; V279-G283 PolarHBondContact N-O 3Å
280	A	95.8	Very high	97.8	Very high	40 Å²	40	41.2 Å²	41.2	33%	0.331	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-26.6	-178.3	0	0	0	0	0	115.1	L231 A232 G282	L231-A280 WeakPolarHBondContact O-CB 3.49Å; A232-A280 PolarHBondContact O-N 2.98Å; A280-G282 PolarHBondContact O-N 2.87Å
281	S	96.6	Very high	97.9	Very high	101 Å²	101	33.4 Å²	33.4	71%	0.706	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-7.2	174.9	62	0	0	0	0	113.9	V279 G283	V279-S281 VanDerWaalsContact CG2-OG 3.3Å; V279-S281 WeakPolarHBondContact CG2-OG 3.5Å; V279-S281 PolarHBondContact O-N 3.04Å; S281-G283 VanDerWaalsContact C-N 3.34Å
282	G	97.8	Very high	98	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.01	18%	0.179	C	C	.	.	S	Bend	trans	83.1	6.3	-174.6	0	0	0	0	0	114.7	N219 A223 V279 A280	N219-G282 PolarHBondContact ND2-O 2.8Å; N219-G282 PolarHBondContact OD1-O 2.89Å; A223-G282 VanDerWaalsContact CB-CA 3.42Å; V279-G282 WeakPolarHBondContact O-CA 3.27Å; V279-G282 PolarHBondContact O-N 3.43Å; A280-G282 PolarHBondContact O-N 2.87Å
283	G	98.5	Very high	98.1	Very high	10 Å²	10	26.5 Å²	26.5	10%	0.103	16%	0.161	C	C	.	.			trans	-79.8	155.2	172.1	0	0	0	0	0	112.3	K260 M278 V279 S281	K260-G283 CarbonylContact O-C 3.48Å; K260-G283 VanDerWaalsContact O-CA 3.25Å; K260-G283 WeakPolarHBondContact O-CA 3.49Å; M278-G283 WeakPolarHBondContact CA-O 3.28Å; V279-G283 WeakPolarHBondContact CG2-O 3.47Å; V279-G283 PolarHBondContact N-O 3Å; S281-G283 VanDerWaalsContact C-N 3.34Å
284	W	98.6	Very high	98.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148	-178	-51.5	-17.8	0	0	0	111.5	P213 N219 I236 I238 M255 F258 N259 K260 W261 R262 V276 E277	P213-W284 HydrophobicContact CB-CZ2 3.89Å; P213-W284 HydrophobicContact CG-CH2 4.17Å; P213-W284 HydrophobicContact CG-CZ2 3.46Å; P213-W284 VanDerWaalsContact CG-CZ2 3.46Å; N219-W284 WeakPolarHBondContact OD1-CZ2 3.44Å; N219-W284 PolarHBondContact OD1-NE1 3.37Å; I236-W284 HydrophobicContact CD1-CD2 4.38Å; I236-W284 HydrophobicContact CD1-CG 4.18Å; I238-W284 HydrophobicContact CD1-CD2 4.22Å; I238-W284 HydrophobicContact CD1-CE3 3.86Å; I238-W284 HydrophobicContact CD1-CH2 4.03Å; I238-W284 HydrophobicContact CD1-CZ2 4.4Å; I238-W284 HydrophobicContact CD1-CZ3 3.72Å; M255-W284 HydrophobicContact CE-CE3 4.11Å; M255-W284 HydrophobicContact CE-CZ3 3.51Å; M255-W284 HydrophobicContact SD-CZ3 4.42Å; F258-W284 AromaticContact CD1-CH2 4Å; F258-W284 HydrophobicContact CD1-CH2 4Å; F258-W284 HydrophobicContact CD1-CZ2 4.46Å; F258-W284 AromaticContact CE1-CH2 3.77Å; F258-W284 HydrophobicContact CE1-CH2 3.77Å; F258-W284 AromaticContact CE1-CZ2 3.78Å; F258-W284 HydrophobicContact CE1-CZ2 3.78Å; N259-W284 VanDerWaalsContact CA-CZ3 3.47Å; N259-W284 HydrophobicContact CB-CE3 4.43Å; N259-W284 HydrophobicContact CB-CZ3 3.9Å; K260-W284 HydrophobicContact CB-CD2 3.94Å; K260-W284 HydrophobicContact CB-CG 4.21Å; K260-W284 HydrophobicContact CB-CZ2 3.94Å; K260-W284 HydrophobicContact CG-CZ2 3.92Å; K260-W284 PolarHBondContact O-N 2.79Å; W261-W284 HydrophobicContact CD2-CB 4.18Å; W261-W284 HydrophobicContact CD2-CE3 4.22Å; W261-W284 HydrophobicContact CE3-CB 3.51Å; W261-W284 HydrophobicContact CZ2-CE3 4.49Å; W261-W284 HydrophobicContact CZ3-CB 3.79Å; R262-W284 WeakPolarHBondContact CG-O 3.36Å; R262-W284 PolarHBondContact N-O 3.03Å; V276-W284 HydrophobicContact CG1-CB 3.96Å; V276-W284 HydrophobicContact CG1-CG 4.47Å; E277-W284 WeakPolarHBondContact O-CA 3.42Å
285	N	98.6	Very high	98.2	Very high	20 Å²	20	26.3 Å²	26.3	11%	0.107	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	129.5	177.9	-154.3	99.4	0	0	0	107.1	R262 E265 V276 E277	R262-N285 PolarHBondContact NH1-OD1 2.79Å; E265-N285 PolarHBondContact OE1-OD1 3.24Å; E265-N285 VanDerWaalsContact OE1-OD1 3.07Å; V276-N285 WeakPolarHBondContact CA-O 3.49Å; E277-N285 HydrophobicContact CG-CB 3.73Å; E277-N285 PolarHBondContact N-O 2.93Å; E277-N285 PolarHBondContact O-N 3.49Å
286	D	98.3	Very high	98.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	145.9	163.8	52	-32.3	0	0	0	109.6	F247 P266 N267 N268 E273 C275	F247-D286 HydrophobicContact CZ-CB 4.4Å; P266-D286 WeakPolarHBondContact CA-OD1 3.47Å; P266-D286 HydrophobicContact CB-CB 4.11Å; P266-D286 WeakPolarHBondContact CB-OD2 3.34Å; N267-D286 PolarHBondContact N-OD1 3.33Å; N267-D286 PolarHBondContact N-OD2 3.38Å; N268-D286 WeakPolarHBondContact CA-OD2 3.02Å; N268-D286 PolarHBondContact N-OD2 3.04Å; E273-D286 HydrophobicContact CB-CB 4.17Å; C275-D286 CarbonylContact O-C 3.12Å; C275-D286 VanDerWaalsContact O-CA 3.25Å; C275-D286 WeakPolarHBondContact O-CA 3.36Å
287	V	98.5	Very high	98.1	Very high	12 Å²	12	26.3 Å²	26.3	7%	0.073	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	155.7	-174.4	-71.8	0	0	0	0	109.9	F235 E273 C275 E277 C289 M293	F235-V287 HydrophobicContact CD1-CG2 4.49Å; F235-V287 HydrophobicContact CE1-CG2 3.75Å; E273-V287 WeakPolarHBondContact OE1-CA 3.32Å; C275-V287 PolarHBondContact N-O 3.04Å; C275-V287 VanDerWaalsContact N-O 3.16Å; C275-V287 WeakPolarHBondContact O-CG2 3.25Å; C275-V287 PolarHBondContact O-N 3.11Å; C275-V287 VanDerWaalsContact O-O 3.09Å; E277-V287 HydrophobicContact CB-CG2 4.21Å; E277-V287 HydrophobicContact CG-CG1 3.77Å; E277-V287 HydrophobicContact CG-CG2 4.25Å; V287-C289 PolarHBondContact O-N 3.21Å; V287-M293 HydrophobicContact CG2-CE 4.21Å
288	A	98.5	Very high	98.1	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.041	15%	0.154	C	C	.	.			trans	-61.3	127.2	175.3	0	0	0	0	0	111.5	E272 H290 T291	E272-A288 HydrophobicContact CG-CB 4.31Å; E272-A288 VanDerWaalsContact O-CA 3.27Å; E272-A288 WeakPolarHBondContact O-CA 3.38Å; E272-A288 WeakPolarHBondContact O-CB 3.25Å; A288-H290 VanDerWaalsContact CB-CE1 3.47Å; A288-H290 WeakPolarHBondContact CB-CE1 3.45Å; A288-H290 WeakPolarHBondContact CB-NE2 3.48Å; A288-H290 PolarHBondContact O-N 3.07Å; A288-T291 WeakPolarHBondContact O-CB 3.28Å; A288-T291 PolarHBondContact O-N 2.71Å; A288-T291 PolarHBondContact O-OG1 3.04Å
289	C	98.4	Very high	97.9	Very high	28 Å²	28	26.4 Å²	26.4	19%	0.189	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21	-175.1	-64.4	0	0	0	0	114.5	Y196 C275 V287 T291	Y196-C289 PolarHBondContact N-O 3.01Å; Y196-C289 VanDerWaalsContact N-O 3.15Å; C275-C289 HydrophobicContact CB-CB 3.95Å; C275-C289 WeakPolarHBondContact CB-SG 3.13Å; C275-C289 PolarHBondContact N-SG 2.82Å; C275-C289 VanDerWaalsContact SG-CA 3.52Å; C275-C289 WeakPolarHBondContact SG-CB 3.43Å; C275-C289 CovalentContact SG-SG 2.02Å; C275-C289 PolarHBondContact SG-SG 3.33Å; V287-C289 PolarHBondContact O-N 3.21Å; C289-T291 VanDerWaalsContact C-N 3.3Å
290	H	97.9	Very high	97.7	Very high	101 Å²	101	28.8 Å²	28.8	47%	0.468	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.4	176.2	60.4	61.6	0	0	0	113.7	A288	A288-H290 VanDerWaalsContact CB-CE1 3.47Å; A288-H290 WeakPolarHBondContact CB-CE1 3.45Å; A288-H290 WeakPolarHBondContact CB-NE2 3.48Å; A288-H290 PolarHBondContact O-N 3.07Å
291	T	97.7	Very high	97.5	Very high	46 Å²	46	30 Å²	30	28%	0.282	17%	0.166	S	C	.	.			trans	-59.8	142.1	172.1	-56.4	0	0	0	0	109.7	F235 A288 C289 M293	F235-T291 VanDerWaalsContact CE2-O 3.26Å; F235-T291 WeakPolarHBondContact CE2-O 3.25Å; F235-T291 VanDerWaalsContact CZ-O 3.29Å; F235-T291 WeakPolarHBondContact CZ-O 3.42Å; A288-T291 WeakPolarHBondContact O-CB 3.28Å; A288-T291 PolarHBondContact O-N 2.71Å; A288-T291 PolarHBondContact O-OG1 3.04Å; C289-T291 VanDerWaalsContact C-N 3.3Å; T291-M293 HydrophobicContact CG2-CE 3.6Å
292	T	98.4	Very high	97	Very high	74 Å²	74	34.2 Å²	34.2	45%	0.454	18%	0.175	S	C	.	.			trans	-105.4	126.2	177.3	52.8	0	0	0	0	110.2	K194 R195	K194-T292 WeakPolarHBondContact O-CA 3.44Å; R195-T292 HydrophobicContact CG-CG2 3.82Å
293	M	98.4	Very high	95.8	Very high	11 Å²	11	38.2 Å²	38.2	5%	0.054	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	174.1	174.8	60.7	-177.7	85.4	0	0	110.6	E193 K194 R233 F235 E277 V287 T291	E193-M293 WeakPolarHBondContact CA-O 3.46Å; K194-M293 PolarHBondContact N-O 3.49Å; K194-M293 PolarHBondContact O-N 2.81Å; R233-M293 HydrophobicContact CG-SD 4.29Å; F235-M293 HydrophobicContact CD1-CE 4.24Å; F235-M293 HydrophobicContact CD1-CG 4.3Å; F235-M293 HydrophobicContact CD1-SD 3.96Å; F235-M293 HydrophobicContact CD2-CG 3.37Å; F235-M293 HydrophobicContact CD2-SD 4.12Å; F235-M293 HydrophobicContact CE1-CE 3.79Å; F235-M293 HydrophobicContact CE1-CG 4.42Å; F235-M293 HydrophobicContact CE1-SD 4.13Å; F235-M293 HydrophobicContact CE2-CE 4.22Å; F235-M293 HydrophobicContact CE2-CG 3.51Å; F235-M293 HydrophobicContact CE2-SD 4.27Å; F235-M293 HydrophobicContact CG-CG 3.81Å; F235-M293 HydrophobicContact CG-SD 3.96Å; F235-M293 HydrophobicContact CZ-CE 3.78Å; F235-M293 HydrophobicContact CZ-CG 4.05Å; F235-M293 HydrophobicContact CZ-SD 4.28Å; E277-M293 HydrophobicContact CB-CE 4.25Å; E277-M293 HydrophobicContact CB-SD 3.87Å; E277-M293 WeakPolarHBondContact OE2-CE 3.38Å; V287-M293 HydrophobicContact CG2-CE 4.21Å; T291-M293 HydrophobicContact CG2-CE 3.6Å
294	Y	98.6	Very high	94.1	Very high	70 Å²	70	45.2 Å²	45.2	28%	0.275	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	163	168.7	-60.1	-27.6	0	0	0	111.1	V190 K191 E193 L231 V234 F235	V190-Y294 WeakPolarHBondContact O-CB 3.3Å; K191-Y294 VanDerWaalsContact C-CD1 3.4Å; K191-Y294 HydrophobicContact CB-CD1 4.42Å; K191-Y294 HydrophobicContact CB-CE1 4.24Å; K191-Y294 HydrophobicContact CB-CE2 4.38Å; K191-Y294 WeakPolarHBondContact O-CE1 3.39Å; E193-Y294 HydrophobicContact CG-CD1 3.86Å; E193-Y294 HydrophobicContact CG-CE1 3.59Å; L231-Y294 HydrophobicContact CD1-CD2 3.75Å; L231-Y294 HydrophobicContact CD2-CD2 3.62Å; L231-Y294 HydrophobicContact CD2-CE2 3.71Å; L231-Y294 HydrophobicContact CG-CD2 4.33Å; V234-Y294 CarbonylContact C-O 3.56Å; V234-Y294 WeakPolarHBondContact CA-O 3.45Å; V234-Y294 WeakPolarHBondContact CB-O 3.21Å; F235-Y294 PolarHBondContact N-O 3.01Å
295	F	98.7	Very high	93.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	158.7	-175.2	58.5	-83.8	0	0	0	110.9	V190 E192 K194 A199 S202 L210 F235	V190-F295 HydrophobicContact CB-CD1 4.31Å; V190-F295 HydrophobicContact CB-CD2 3.99Å; V190-F295 HydrophobicContact CB-CE1 3.9Å; V190-F295 HydrophobicContact CB-CE2 3.57Å; V190-F295 HydrophobicContact CB-CG 4.35Å; V190-F295 HydrophobicContact CB-CZ 3.51Å; V190-F295 HydrophobicContact CG1-CE1 3.73Å; V190-F295 HydrophobicContact CG1-CE2 3.91Å; V190-F295 HydrophobicContact CG1-CZ 3.34Å; V190-F295 HydrophobicContact CG2-CD2 4.2Å; V190-F295 HydrophobicContact CG2-CE2 3.66Å; V190-F295 HydrophobicContact CG2-CZ 4.02Å; V190-F295 PolarHBondContact N-O 3.12Å; V190-F295 PolarHBondContact O-N 3.16Å; E192-F295 HydrophobicContact CB-CE1 4.31Å; E192-F295 WeakPolarHBondContact O-CE1 3.44Å; K194-F295 HydrophobicContact CB-CD1 4.33Å; K194-F295 HydrophobicContact CB-CE1 4.09Å; K194-F295 HydrophobicContact CD-CE1 3.78Å; K194-F295 HydrophobicContact CD-CZ 4.09Å; K194-F295 HydrophobicContact CG-CE1 4.01Å; A199-F295 HydrophobicContact CB-CB 3.83Å; A199-F295 HydrophobicContact CB-CD1 3.71Å; A199-F295 HydrophobicContact CB-CD2 3.93Å; A199-F295 HydrophobicContact CB-CE1 4.22Å; A199-F295 HydrophobicContact CB-CE2 4.39Å; A199-F295 HydrophobicContact CB-CG 3.56Å; S202-F295 WeakPolarHBondContact OG-CZ 3.23Å; L210-F295 HydrophobicContact CD2-CB 3.81Å; L210-F295 HydrophobicContact CD2-CD2 4.04Å; L210-F295 HydrophobicContact CD2-CG 4.32Å; F235-F295 HydrophobicContact CB-CB 3.94Å
296	M	98.3	Very high	93.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.3	177.8	-175.3	148	50.1	0	0	110.1	L188 L210 G211 M222 Y225 L226 V234 F235	L188-M296 WeakPolarHBondContact O-CA 3.35Å; L210-M296 CarbonylContact C-O 3.49Å; L210-M296 WeakPolarHBondContact CA-O 3.3Å; G211-M296 PolarHBondContact N-O 3.08Å; M222-M296 HydrophobicContact CB-CE 3.37Å; M222-M296 HydrophobicContact CB-SD 4.48Å; M222-M296 HydrophobicContact CE-CE 3.5Å; M222-M296 VanDerWaalsContact CE-CE 3.5Å; M222-M296 HydrophobicContact CG-CE 3.49Å; M222-M296 VanDerWaalsContact CG-CE 3.49Å; M222-M296 HydrophobicContact CG-SD 4.24Å; M222-M296 HydrophobicContact SD-CE 4.3Å; Y225-M296 HydrophobicContact CD1-SD 3.68Å; Y225-M296 HydrophobicContact CE1-SD 4.27Å; Y225-M296 HydrophobicContact CG-SD 4.5Å; L226-M296 HydrophobicContact CD1-CE 3.51Å; L226-M296 HydrophobicContact CD1-SD 4.29Å; V234-M296 HydrophobicContact CG2-CB 4.2Å; V234-M296 HydrophobicContact CG2-CE 4.4Å; F235-M296 PolarHBondContact O-N 2.8Å
297	C	98	Very high	93.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	151.3	173.6	-56.9	0	0	0	0	110.9	Y187 L188 C203 T209 F299	Y187-C297 CarbonylContact C-O 3.59Å; Y187-C297 VanDerWaalsContact CA-O 3.31Å; Y187-C297 WeakPolarHBondContact CA-O 3.16Å; L188-C297 PolarHBondContact N-O 3.09Å; L188-C297 PolarHBondContact O-N 3.11Å; C203-C297 WeakPolarHBondContact CA-SG 3.24Å; C203-C297 HydrophobicContact CB-CB 3.77Å; C203-C297 WeakPolarHBondContact CB-SG 3.26Å; C203-C297 WeakPolarHBondContact SG-CA 3.06Å; C203-C297 WeakPolarHBondContact SG-CB 3.31Å; C203-C297 CovalentContact SG-SG 2.04Å; C203-C297 PolarHBondContact SG-SG 2.73Å; T209-C297 CarbonylContact O-C 3.49Å; T209-C297 VanDerWaalsContact O-CA 3.23Å; T209-C297 WeakPolarHBondContact O-CA 3.46Å; C297-F299 HydrophobicContact CB-CE2 3.76Å; C297-F299 HydrophobicContact CB-CZ 3.77Å
298	E	97.1	Very high	93.1	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.019	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.4	172.2	175.5	-173.9	130.5	0	0	109.9	K185 I186 Y187 G208 T209 M212	K185-E298 HydrophobicContact CB-CG 4.49Å; K185-E298 HydrophobicContact CD-CG 4.09Å; K185-E298 WeakPolarHBondContact CD-OE1 3.4Å; K185-E298 VanDerWaalsContact CE-OE1 3.27Å; K185-E298 WeakPolarHBondContact CE-OE1 3.25Å; K185-E298 HydrophobicContact CG-CG 4.49Å; K185-E298 IonicContact NZ-OE1 2.65Å; K185-E298 PolarHBondContact NZ-OE1 2.9Å; I186-E298 CarbonylContact O-C 3.17Å; I186-E298 VanDerWaalsContact O-CA 3.31Å; I186-E298 WeakPolarHBondContact O-CA 3.46Å; Y187-E298 HydrophobicContact CD1-CB 4.06Å; Y187-E298 HydrophobicContact CD1-CG 4.27Å; Y187-E298 HydrophobicContact CE1-CB 3.99Å; Y187-E298 HydrophobicContact CE1-CG 3.82Å; Y187-E298 WeakPolarHBondContact CE1-OE2 3.34Å; G208-E298 VanDerWaalsContact CA-O 3.26Å; G208-E298 WeakPolarHBondContact CA-O 3.44Å; T209-E298 PolarHBondContact N-O 3.34Å; T209-E298 PolarHBondContact O-N 2.89Å; M212-E298 PolarHBondContact N-OE2 3.17Å
299	F	95.9	Very high	92.7	Very high	12 Å²	12	56.9 Å²	56.9	5%	0.053	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.1	177.7	-50.8	-90.4	0	0	0	109.7	K185 I186 L188 R206 C297 M304	K185-F299 CarbonylContact C-O 3.52Å; K185-F299 VanDerWaalsContact CA-O 3.29Å; K185-F299 WeakPolarHBondContact CA-O 3.32Å; I186-F299 HydrophobicContact CB-CB 4.29Å; I186-F299 HydrophobicContact CB-CD2 4.4Å; I186-F299 HydrophobicContact CG2-CD2 4.22Å; I186-F299 PolarHBondContact N-O 3.44Å; I186-F299 PolarHBondContact O-N 3.35Å; L188-F299 HydrophobicContact CB-CE2 3.78Å; L188-F299 HydrophobicContact CD2-CE2 4.37Å; L188-F299 HydrophobicContact CD2-CZ 4.47Å; R206-F299 HydrophobicContact CB-CE1 3.67Å; R206-F299 HydrophobicContact CB-CZ 3.89Å; R206-F299 WeakPolarHBondContact O-CE1 3.36Å; C297-F299 HydrophobicContact CB-CE2 3.76Å; C297-F299 HydrophobicContact CB-CZ 3.77Å; F299-M304 HydrophobicContact CB-CE 3.56Å; F299-M304 HydrophobicContact CB-SD 3.98Å; F299-M304 HydrophobicContact CD1-CE 3.86Å; F299-M304 HydrophobicContact CD2-CE 4.44Å; F299-M304 HydrophobicContact CG-CE 3.69Å
300	D	94.3	Very high	92.3	Very high	68 Å²	68	58.9 Å²	58.9	36%	0.364	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.7	172.6	-85.5	-51.1	0	0	0	110.4	K185 E302 S303 M304	K185-D300 WeakPolarHBondContact CG-OD1 3.48Å; K185-D300 VanDerWaalsContact NZ-CG 3.29Å; K185-D300 IonicContact NZ-OD1 3.33Å; K185-D300 PolarHBondContact NZ-OD1 3.02Å; K185-D300 IonicContact NZ-OD2 3.64Å; K185-D300 PolarHBondContact NZ-OD2 2.77Å; D300-E302 PolarHBondContact O-N 3.41Å; D300-S303 WeakPolarHBondContact CB-OG 3.42Å; D300-S303 PolarHBondContact O-N 3.05Å; D300-S303 PolarHBondContact O-OG 2.96Å; D300-M304 PolarHBondContact O-N 3.23Å
301	K	90.6	Very high	91.9	Very high	65 Å²	65	55.9 Å²	55.9	28%	0.283	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-66.4	-23.6	-179.8	-68.4	-170.8	-167.7	175.3	0	113.7	E181 T182 D183 S184 I186	E181-K301 VanDerWaalsContact CD-CE 3.41Å; E181-K301 VanDerWaalsContact CG-NZ 3.31Å; E181-K301 WeakPolarHBondContact OE1-CE 3.38Å; E181-K301 IonicContact OE1-NZ 3.23Å; E181-K301 PolarHBondContact OE1-NZ 3.43Å; E181-K301 IonicContact OE2-NZ 2.61Å; T182-K301 WeakPolarHBondContact O-CE 3.42Å; T182-K301 PolarHBondContact O-NZ 3.42Å; D183-K301 WeakPolarHBondContact O-CD 3.38Å; D183-K301 PolarHBondContact O-NZ 3.5Å; D183-K301 VanDerWaalsContact O-NZ 3.08Å; S184-K301 WeakPolarHBondContact O-CB 3.36Å; S184-K301 WeakPolarHBondContact O-CG 3.22Å; S184-K301 PolarHBondContact O-N 2.89Å; I186-K301 HydrophobicContact CD1-CG 4.1Å; I186-K301 HydrophobicContact CG1-CG 4.12Å
302	E	86.9	Confident	91.5	Very high	190 Å²	190	56.6 Å²	56.6	89%	0.888	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-73.1	-20	174.5	-64.1	-176.5	-180	0	0	112.4	D300	D300-E302 PolarHBondContact O-N 3.41Å
303	S	72.8	Confident	90.9	Very high	85 Å²	85	55.2 Å²	55.2	59%	0.594	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-99.9	1.3	-179.4	67.5	0	0	0	0	114	D300	D300-S303 WeakPolarHBondContact CB-OG 3.42Å; D300-S303 PolarHBondContact O-N 3.05Å; D300-S303 PolarHBondContact O-OG 2.96Å
304	M	61.5	Low	90.2	Very high	157 Å²	157	59.2 Å²	59.2	77%	0.773	30%	0.295	S	S	*	.			trans	-101.7	0	178.7	-72	-176.7	133.9	0	0	111.3	I186 F299 D300	I186-M304 HydrophobicContact CD1-SD 3.76Å; F299-M304 HydrophobicContact CB-CE 3.56Å; F299-M304 HydrophobicContact CB-SD 3.98Å; F299-M304 HydrophobicContact CD1-CE 3.86Å; F299-M304 HydrophobicContact CD2-CE 4.44Å; F299-M304 HydrophobicContact CG-CE 3.69Å; D300-M304 PolarHBondContact O-N 3.23Å

Retrieved 304 of 304 residues in 122.5 ms (Link to these results)

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