A0A096NT36_PAPAN Loading...

Sphingosine kinase 1

Has serine acetyltransferase activity on PTGS2/COX2 in an acetyl-CoA dependent manner. The acetyltransferase activity increases in presence of the kinase substrate, sphingosine. During neuroinflammation, through PTGS2 acetylation, promotes neuronal secretion of specialized preresolving mediators (SPMs), especially 15-R-lipoxin A4, which results in an increase of phagocytic microglia.

AlphaFold DB , UniProt , Accession A0A096NT36, Species PAPAN (Papio anubis, Olive baboon), Gene SPHK1, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.7	Very low	42.6	Very low	145 Å²	145	84.2 Å²	84.2	71%	0.714	46%	0.46	S	S	*	.				0	111.9	0	-79.5	-171.7	172.3	0	0	107.3	L6 L9 L390	M1-L6 HydrophobicContact CB-CD1 3.84Å; M1-L6 HydrophobicContact SD-CD1 3.96Å; M1-L9 HydrophobicContact CE-CD1 4.43Å; M1-L9 HydrophobicContact SD-CD1 4.49Å; M1-L390 HydrophobicContact CE-CD1 4.44Å
2	S	42.6	Very low	42.3	Very low	23 Å²	23	91.1 Å²	91.1	16%	0.161	47%	0.474	C	S	.	.			trans	-50.8	145.4	170.7	169	0	0	0	0	110.9	Q4 V5 L6	S2-Q4 PolarHBondContact O-N 3.44Å; S2-Q4 PolarHBondContact OG-N 3.49Å; S2-V5 PolarHBondContact O-N 3.34Å; S2-L6 PolarHBondContact O-N 2.94Å
3	A	37.7	Very low	41.4	Very low	88 Å²	88	90.1 Å²	90.1	73%	0.727	49%	0.487	S	S	*	.	H	α-helix	trans	-54.3	-26.2	178	0	0	0	0	0	112.3	G7	A3-G7 PolarHBondContact O-N 3.15Å
4	Q	45.3	Very low	41	Very low	96 Å²	96	91.9 Å²	91.9	45%	0.449	51%	0.506	S	S	.	.	H	α-helix	trans	-74	-37.3	177.4	-59.8	-175.8	5.3	0	0	112.9	S2 G7 F8 M276	S2-Q4 PolarHBondContact O-N 3.44Å; S2-Q4 PolarHBondContact OG-N 3.49Å; Q4-G7 PolarHBondContact O-N 3.12Å; Q4-F8 PolarHBondContact O-N 2.9Å; Q4-M276 HydrophobicContact CB-SD 4.47Å; Q4-M276 PolarHBondContact OE1-SD 2.9Å
5	V	42.2	Very low	40.5	Very low	15 Å²	15	96.8 Å²	96.8	9%	0.091	53%	0.53	C	S	.	.	H	α-helix	trans	-66.9	-39.1	175.6	177.3	0	0	0	0	110.5	S2 G7 F8 L9	S2-V5 PolarHBondContact O-N 3.34Å; V5-G7 VanDerWaalsContact C-N 3.33Å; V5-F8 PolarHBondContact O-N 3.37Å; V5-L9 HydrophobicContact CG1-CD1 4.17Å; V5-L9 WeakPolarHBondContact O-CG 3.22Å; V5-L9 PolarHBondContact O-N 3.28Å
6	L	44.9	Very low	39.9	Very low	71 Å²	71	98.2 Å²	98.2	37%	0.372	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-37.8	173	-119.5	98.2	0	0	0	112	M1 S2 R10	M1-L6 HydrophobicContact CB-CD1 3.84Å; M1-L6 HydrophobicContact SD-CD1 3.96Å; S2-L6 PolarHBondContact O-N 2.94Å; L6-R10 WeakPolarHBondContact O-CB 3.23Å; L6-R10 VanDerWaalsContact O-CG 3.25Å; L6-R10 WeakPolarHBondContact O-CG 3.31Å; L6-R10 PolarHBondContact O-N 2.75Å; L6-R10 VanDerWaalsContact O-N 3.1Å
7	G	44.7	Very low	39.5	Very low	38 Å²	38	102.8 Å²	102.8	39%	0.392	57%	0.568	S	S	.	*	H	α-helix	trans	-63.1	-41.6	175.7	0	0	0	0	0	112.9	A3 Q4 V5 R10 S11	A3-G7 PolarHBondContact O-N 3.15Å; Q4-G7 PolarHBondContact O-N 3.12Å; V5-G7 VanDerWaalsContact C-N 3.33Å; G7-R10 PolarHBondContact O-N 2.83Å; G7-S11 PolarHBondContact O-N 3.22Å; G7-S11 PolarHBondContact O-OG 2.96Å
8	F	46	Very low	39.2	Very low	66 Å²	66	102.7 Å²	102.7	29%	0.289	58%	0.582	S	S	.	*	H	α-helix	trans	-68.8	-44.9	177.1	-179.2	-99.1	0	0	0	112.7	Q4 V5 R10 S11 W12 L280	Q4-F8 PolarHBondContact O-N 2.9Å; V5-F8 PolarHBondContact O-N 3.37Å; F8-R10 PolarHBondContact O-N 3.2Å; F8-S11 PolarHBondContact O-N 2.87Å; F8-S11 VanDerWaalsContact O-N 3.12Å; F8-S11 PolarHBondContact O-OG 2.68Å; F8-W12 HydrophobicContact CE1-CE3 4.41Å; F8-W12 PolarHBondContact O-N 3.27Å; F8-W12 VanDerWaalsContact O-N 3.07Å; F8-L280 HydrophobicContact CE2-CD1 4.44Å; F8-L280 HydrophobicContact CZ-CD1 3.85Å
9	L	43.9	Very low	38.8	Very low	83 Å²	83	101.8 Å²	101.8	44%	0.435	59%	0.589	S	S	.	*	H	α-helix	trans	-63.8	-27.8	176.7	-72	170.6	0	0	0	112.4	M1 V5 W12	M1-L9 HydrophobicContact CE-CD1 4.43Å; M1-L9 HydrophobicContact SD-CD1 4.49Å; V5-L9 HydrophobicContact CG1-CD1 4.17Å; V5-L9 WeakPolarHBondContact O-CG 3.22Å; V5-L9 PolarHBondContact O-N 3.28Å; L9-W12 HydrophobicContact CD2-CE3 4.35Å
10	R	43.8	Very low	38.6	Very low	210 Å²	210	103.2 Å²	103.2	79%	0.792	60%	0.602	S	S	*	*	H	α-helix	trans	-77.7	-23.7	174.8	-77.1	177.9	178.3	-165	0.4	114	L6 G7 F8	L6-R10 WeakPolarHBondContact O-CB 3.23Å; L6-R10 VanDerWaalsContact O-CG 3.25Å; L6-R10 WeakPolarHBondContact O-CG 3.31Å; L6-R10 PolarHBondContact O-N 2.75Å; L6-R10 VanDerWaalsContact O-N 3.1Å; G7-R10 PolarHBondContact O-N 2.83Å; F8-R10 PolarHBondContact O-N 3.2Å
11	S	36.4	Very low	38.2	Very low	91 Å²	91	110.1 Å²	110.1	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-101	-5.5	-178.8	63.3	0	0	0	0	113.9	G7 F8 A13	G7-S11 PolarHBondContact O-N 3.22Å; G7-S11 PolarHBondContact O-OG 2.96Å; F8-S11 PolarHBondContact O-N 2.87Å; F8-S11 VanDerWaalsContact O-N 3.12Å; F8-S11 PolarHBondContact O-OG 2.68Å; S11-A13 PolarHBondContact O-N 2.76Å
12	W	38.8	Very low	37.6	Very low	167 Å²	167	110.8 Å²	110.8	63%	0.633	62%	0.624	S	S	*	*			trans	-76.5	106.2	-179.5	-167.8	11.5	0	0	0	111.6	F8 L9	F8-W12 HydrophobicContact CE1-CE3 4.41Å; F8-W12 PolarHBondContact O-N 3.27Å; F8-W12 VanDerWaalsContact O-N 3.07Å; L9-W12 HydrophobicContact CD2-CE3 4.35Å
13	A	30.9	Very low	37.2	Very low	78 Å²	78	115.6 Å²	115.6	65%	0.645	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-95.2	129	160.8	0	0	0	0	0	109.2	S11 L15	S11-A13 PolarHBondContact O-N 2.76Å; A13-L15 PolarHBondContact O-N 2.87Å
14	P	34.8	Very low	36.9	Very low	116 Å²	116	116.1 Å²	116.1	75%	0.753	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-66.5	129.4	174.7	25	-30	0	0	0	110.2
15	L	33.8	Very low	36.2	Very low	165 Å²	165	116.5 Å²	116.5	86%	0.864	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-66.2	137.7	169.5	-84.3	152	0	0	0	109.5	A13 L17	A13-L15 PolarHBondContact O-N 2.87Å; L15-L17 PolarHBondContact O-N 3.37Å
16	P	31.7	Very low	35.9	Very low	119 Å²	119	121.2 Å²	121.2	77%	0.773	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-67.1	132.2	178	25.9	-31	0	0	0	110.5	A18	P16-A18 PolarHBondContact O-N 2.93Å
17	L	33.2	Very low	35	Very low	177 Å²	177	121.5 Å²	121.5	93%	0.927	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.7	119.3	171	-83.9	137.6	0	0	0	109.5	L15	L15-L17 PolarHBondContact O-N 3.37Å
18	A	32.8	Very low	34.4	Very low	100 Å²	100	126.9 Å²	126.9	83%	0.826	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70	127.9	170.2	0	0	0	0	0	109.7	P16	P16-A18 PolarHBondContact O-N 2.93Å
19	A	33	Very low	33.6	Very low	86 Å²	86	131.2 Å²	131.2	71%	0.711	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.8	148.7	174.6	0	0	0	0	0	111.4
20	P	33.6	Very low	33	Very low	130 Å²	130	132 Å²	132	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.5	137.8	180	27.5	-32	0	0	0	111.2
21	R	30.3	Very low	32.2	Very low	248 Å²	248	125.6 Å²	125.6	94%	0.936	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.6	131.1	172.9	-80	-178.2	170.4	175.1	-3.7	110.3
22	D	28.5	Very low	31.9	Very low	159 Å²	159	126 Å²	126	85%	0.85	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.8	144.5	166.2	-84.4	-39.9	0	0	0	111.9
23	P	35.7	Very low	31.8	Very low	124 Å²	124	123.9 Å²	123.9	81%	0.805	82%	0.82	S	S	*	*			trans	-101.1	97	174.4	35.3	-24.4	0	0	0	110.3
24	A	31.2	Very low	31.6	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	83%	0.827	S	S	*	*			trans	-159	134.1	161.8	0	0	0	0	0	111.7
25	A	30.2	Very low	31.3	Very low	104 Å²	104	125 Å²	125	86%	0.86	83%	0.825	S	S	*	*			trans	112.9	87.4	164.6	0	0	0	0	0	114.4
26	A	35.1	Very low	30.9	Very low	113 Å²	113	124.1 Å²	124.1	93%	0.934	83%	0.827	S	S	*	*			trans	-67.7	131.1	151.7	0	0	0	0	0	108.8
27	G	27.5	Very low	30.8	Very low	77 Å²	77	122.6 Å²	122.6	79%	0.794	83%	0.825	S	S	*	*			trans	-161.2	122.8	173.8	0	0	0	0	0	109.7
28	N	30.9	Very low	30.9	Very low	151 Å²	151	120.4 Å²	120.4	81%	0.807	82%	0.821	S	S	*	*			trans	-49.1	147.6	179.5	-67.3	-27.5	0	0	0	113.4
29	D	30.8	Very low	30.6	Very low	157 Å²	157	123.5 Å²	123.5	84%	0.84	82%	0.824	S	S	*	*				178.9	153.6	97.5	-99.3	-32.3	0	0	0	114.6
30	A	30.6	Very low	30.3	Very low	101 Å²	101	123.2 Å²	123.2	84%	0.835	83%	0.829	S	S	*	*			trans	-31.1	153.2	176.8	0	0	0	0	0	120.4
31	G	27.5	Very low	30.1	Very low	75 Å²	75	126.7 Å²	126.7	77%	0.773	83%	0.834	S	S	*	*			trans	157.2	79.8	149.6	0	0	0	0	0	115.9
32	A	29.8	Very low	29.8	Very low	98 Å²	98	118.9 Å²	118.9	81%	0.81	83%	0.831	S	S	*	*			trans	-70.7	157.5	154	0	0	0	0	0	109.3
33	P	36	Very low	29.7	Very low	124 Å²	124	120.3 Å²	120.3	81%	0.805	83%	0.832	S	S	*	*				-144.1	169.2	84.7	33.6	-13.6	0	0	0	116.4
34	T	27.4	Very low	29.9	Very low	131 Å²	131	118.8 Å²	118.8	80%	0.804	82%	0.822	S	S	*	*			trans	-63	148.2	-175.5	28.9	0	0	0	0	119
35	A	27.6	Very low	29.7	Very low	86 Å²	86	123.4 Å²	123.4	71%	0.711	83%	0.826	S	S	*	*			trans	64.3	130.9	131.1	0	0	0	0	0	121.7
36	T	26.4	Very low	29.5	Very low	146 Å²	146	123.3 Å²	123.3	90%	0.896	82%	0.819	S	S	*	*				-172.8	131.5	110.4	19.4	0	0	0	0	111.4
37	A	29.9	Very low	29.1	Very low	88 Å²	88	128.9 Å²	128.9	73%	0.727	82%	0.816	S	S	*	*			trans	-91.6	169.8	159.9	0	0	0	0	0	109.5
38	P	35	Very low	29	Very low	130 Å²	130	131.1 Å²	131.1	84%	0.844	82%	0.817	S	S	*	*				-134.7	143.1	127	33.7	-20.8	0	0	0	113.8
39	D	26.5	Very low	28.8	Very low	166 Å²	166	130.2 Å²	130.2	89%	0.888	82%	0.821	S	S	*	*			trans	-68.1	156.7	166.9	-71	-53.3	0	0	0	112.6
40	G	26.1	Very low	28.6	Very low	79 Å²	79	130.2 Å²	130.2	81%	0.814	82%	0.82	S	S	*	*			trans	-171.8	105.1	165.8	0	0	0	0	0	111
41	E	28.3	Very low	28.6	Very low	204 Å²	204	129.6 Å²	129.6	95%	0.953	82%	0.816	S	S	*	*			trans	-63.2	156.5	-171.7	-58.9	173.7	133.4	0	0	115.9
42	G	24.6	Very low	28.6	Very low	84 Å²	84	137.4 Å²	137.4	87%	0.866	82%	0.822	S	S	*	*			trans	163.5	94.6	159.7	0	0	0	0	0	114.9
43	E	26.2	Very low	28.7	Very low	189 Å²	189	140.4 Å²	140.4	88%	0.883	82%	0.823	S	S	*	*			trans	-113.2	172.7	161.1	-107.2	-157.3	163.5	0	0	108.9
44	P	39.5	Very low	28.4	Very low	92 Å²	92	138.2 Å²	138.2	60%	0.597	82%	0.823	S	S	*	*			cis	-134.4	153.5	-26.1	33.9	-16.8	0	0	0	112.5
45	H	27.2	Very low	28.4	Very low	197 Å²	197	136.5 Å²	136.5	91%	0.912	82%	0.817	S	S	*	*			trans	-148.5	123	155.3	-86.9	-47.6	0	0	0	113.5
46	S	26.6	Very low	28.5	Very low	101 Å²	101	139 Å²	139	71%	0.706	82%	0.823	S	S	*	*			trans	-66.4	136.6	172.8	47.4	0	0	0	0	114.7
47	R	25.7	Very low	28.7	Very low	231 Å²	231	139.2 Å²	139.2	87%	0.872	82%	0.819	S	S	*	*				169.9	147.7	116.4	-91.4	176.1	-175.1	-171.2	2	111.4
48	P	26.1	Very low	28.6	Very low	124 Å²	124	145.1 Å²	145.1	81%	0.805	83%	0.828	S	S	*	*			trans	-83.8	134.5	-177.8	9.1	9.3	0	0	0	111.3	D50	P48-D50 PolarHBondContact O-N 3.41Å
49	C	26.8	Very low	28.2	Very low	132 Å²	132	147.7 Å²	147.7	89%	0.892	83%	0.829	S	S	*	*			trans	-79.5	108.3	171.3	-86.6	0	0	0	0	110.6	A51	C49-A51 PolarHBondContact O-N 3.44Å
50	D	27.6	Very low	28.2	Very low	156 Å²	156	148.5 Å²	148.5	83%	0.834	83%	0.832	S	S	*	*			trans	-64.8	112.3	159.2	-88.3	-41.7	0	0	0	109.6	P48	P48-D50 PolarHBondContact O-N 3.41Å
51	A	29.2	Very low	28	Very low	89 Å²	89	154 Å²	154	74%	0.736	83%	0.834	S	S	*	*			trans	-104.9	74.8	172.7	0	0	0	0	0	110.5	C49	C49-A51 PolarHBondContact O-N 3.44Å
52	R	28.1	Very low	27.8	Very low	238 Å²	238	148.4 Å²	148.4	90%	0.898	82%	0.822	S	S	*	*			trans	-85.6	111.1	159.3	-69.8	-174.9	-171.2	-159.2	1.3	108
53	L	32.7	Very low	27.8	Very low	161 Å²	161	153.5 Å²	153.5	84%	0.843	82%	0.824	S	S	*	*			trans	-105.5	111.3	177.6	-82.4	161	0	0	0	110.8
54	G	27.8	Very low	27.7	Very low	78 Å²	78	149.3 Å²	149.3	80%	0.804	82%	0.821	S	S	*	*			trans	88.6	98.6	157.8	0	0	0	0	0	117
55	S	29.1	Very low	27.1	Very low	96 Å²	96	150 Å²	150	67%	0.671	84%	0.835	S	S	*	*			trans	-111.2	141.3	155	151.1	0	0	0	0	107.8	D57	S55-D57 PolarHBondContact OG-OD2 3.1Å
56	T	29.6	Very low	27	Very low	138 Å²	138	145.2 Å²	145.2	85%	0.847	83%	0.829	S	S	*	*			trans	-109	102.4	164.7	46.9	0	0	0	0	107.5
57	D	29.5	Very low	27	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	84%	0.839	S	S	*	*			trans	-138.9	128	169.5	-78.2	-47.3	0	0	0	110.3	S55	S55-D57 PolarHBondContact OG-OD2 3.1Å
58	K	28.7	Very low	26.8	Very low	213 Å²	213	139.8 Å²	139.8	93%	0.926	83%	0.831	S	S	*	*			trans	-90	123.3	168.4	-88.6	-178.2	172.6	179.1	0	108.3
59	E	25.6	Very low	26.9	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	84%	0.837	S	S	*	*			trans	-65.7	138.9	170.9	-75.8	-179.9	116.8	0	0	112.4
60	L	26.4	Very low	26.8	Very low	184 Å²	184	138.4 Å²	138.4	96%	0.963	83%	0.832	S	S	*	*			trans	-138.2	133.4	147.6	-91	164.4	0	0	0	107.9
61	K	22.2	Very low	27.2	Very low	194 Å²	194	136.7 Å²	136.7	84%	0.843	83%	0.83	S	S	*	*			trans	-118	161.9	-169.4	-157.9	-179.4	-173.6	178.4	0	110.1
62	A	25	Very low	27.1	Very low	86 Å²	86	139.6 Å²	139.6	71%	0.711	84%	0.838	S	S	*	*			trans	96.4	136.7	170.4	0	0	0	0	0	114.4
63	E	23.9	Very low	27.2	Very low	192 Å²	192	132.6 Å²	132.6	90%	0.897	83%	0.831	S	S	*	*			cis	-164.8	169.7	5.6	-128.1	169.9	-178.5	0	0	109.7
64	A	24.7	Very low	27.1	Very low	100 Å²	100	131.1 Å²	131.1	83%	0.826	83%	0.831	S	S	*	*			trans	-84.9	159.2	-167.6	0	0	0	0	0	115.8
65	A	26.2	Very low	27	Very low	108 Å²	108	131.1 Å²	131.1	89%	0.893	83%	0.831	S	S	*	*			trans	-157.9	132.8	143.3	0	0	0	0	0	111.4
66	A	25.3	Very low	26.9	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	84%	0.838	S	S	*	*			trans	-97.5	154	-178.9	0	0	0	0	0	112.3
67	T	26.1	Very low	26.8	Very low	149 Å²	149	132.4 Å²	132.4	91%	0.914	84%	0.837	S	S	*	*			trans	177.2	125.9	148.9	23.7	0	0	0	0	104.7
68	G	23.2	Very low	26.6	Very low	69 Å²	69	136.8 Å²	136.8	71%	0.711	84%	0.843	S	S	*	*			cis	109.7	91.6	29.2	0	0	0	0	0	108.1
69	S	26.2	Very low	26.5	Very low	132 Å²	132	136.2 Å²	136.2	92%	0.923	84%	0.843	S	S	*	*			trans	170.3	133.4	149.1	-75.3	0	0	0	0	112.6
70	A	25.1	Very low	26.5	Very low	95 Å²	95	139 Å²	139	79%	0.785	85%	0.846	S	S	*	*			trans	-142	178.5	168.9	0	0	0	0	0	107.3
71	P	37.3	Very low	26.3	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	84%	0.839	S	S	*	*			cis	-128	172	-38.2	31.1	-12.6	0	0	0	112.2
72	T	25.6	Very low	26.5	Very low	150 Å²	150	135.4 Å²	135.4	92%	0.92	84%	0.838	S	S	*	*			trans	-132.5	132.7	162.3	-35.6	0	0	0	0	110.1
73	A	30.6	Very low	26.4	Very low	90 Å²	90	141.8 Å²	141.8	74%	0.744	84%	0.844	S	S	*	*			trans	-94.4	-172.4	-167.9	0	0	0	0	0	113
74	P	30.3	Very low	26.7	Very low	130 Å²	130	139 Å²	139	84%	0.844	84%	0.84	S	S	*	*				-110.3	144.2	-114.7	28.3	-8.4	0	0	0	114.1
75	G	26.3	Very low	26.8	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	84%	0.838	S	S	*	*			trans	-97	128.3	171	0	0	0	0	0	112
76	T	26.4	Very low	27.1	Very low	134 Å²	134	143.3 Å²	143.3	82%	0.822	83%	0.833	S	S	*	*			trans	-45.1	137.8	175.6	34.9	0	0	0	0	115.2	R78	T76-R78 PolarHBondContact O-N 2.99Å
77	P	28	Very low	27.9	Very low	128 Å²	128	143.2 Å²	143.2	83%	0.831	82%	0.817	S	S	*	*			trans	-80.4	118.8	178.9	31.3	-31.8	0	0	0	111.6	Q79	P77-Q79 PolarHBondContact O-N 3.32Å
78	R	26.6	Very low	28.3	Very low	241 Å²	241	142.9 Å²	142.9	91%	0.909	81%	0.81	S	S	*	*			trans	-66.5	124.5	161.1	-85.4	179.6	167.3	165	-4	108.5	T76 R80	T76-R78 PolarHBondContact O-N 2.99Å; R78-R80 PolarHBondContact O-N 3.26Å; R78-R80 VanDerWaalsContact O-N 3.12Å
79	Q	25.6	Very low	29.3	Very low	201 Å²	201	143 Å²	143	94%	0.939	80%	0.798	S	S	*	*			trans	-54.5	115.3	167.5	-74	178.5	-17.6	0	0	109	P77	P77-Q79 PolarHBondContact O-N 3.32Å
80	R	25	Very low	30.3	Very low	242 Å²	242	138.3 Å²	138.3	91%	0.913	77%	0.767	S	S	*	*			trans	-96.8	115.9	168.3	-114.6	179.4	178	-179.7	-1.9	106.5	R78	R78-R80 PolarHBondContact O-N 3.26Å; R78-R80 VanDerWaalsContact O-N 3.12Å
81	E	23.5	Very low	30.8	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.822	77%	0.766	S	S	*	*			trans	-52.9	141.3	166.4	-65.6	171.8	153.4	0	0	109.6	R83	E81-R83 PolarHBondContact O-N 2.99Å
82	P	24.9	Very low	30.8	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	75%	0.75	S	S	*	*			trans	-71	97.6	179	28.1	-30.1	0	0	0	108.7	V84	P82-V84 PolarHBondContact O-N 2.93Å
83	R	24.5	Very low	31.5	Very low	219 Å²	219	132.9 Å²	132.9	83%	0.826	75%	0.748	S	S	*	*			trans	-67.2	119.3	161.2	-78	-176.7	173.9	-173.1	-3.9	107.2	E81 E85	E81-R83 PolarHBondContact O-N 2.99Å; R83-E85 VanDerWaalsContact C-N 3.26Å; R83-E85 PolarHBondContact O-N 2.7Å
84	V	29.2	Very low	32.7	Very low	134 Å²	134	138 Å²	138	81%	0.812	75%	0.748	S	S	*	*			trans	-66.5	90.4	166.6	179.2	0	0	0	0	106.8	P82 V86	P82-V84 PolarHBondContact O-N 2.93Å; V84-V86 PolarHBondContact O-N 3.15Å
85	E	26.1	Very low	34.6	Very low	168 Å²	168	133.5 Å²	133.5	79%	0.785	73%	0.725	S	S	*	*			trans	-79.2	107.9	164.8	-75.8	-176.1	176.7	0	0	107.1	R83 M87	R83-E85 VanDerWaalsContact C-N 3.26Å; R83-E85 PolarHBondContact O-N 2.7Å; E85-M87 PolarHBondContact O-N 3.21Å
86	V	34	Very low	37.7	Very low	131 Å²	131	133.8 Å²	133.8	79%	0.794	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.9	168.2	177.5	0	0	0	0	106.8	V84 D88	V84-V86 PolarHBondContact O-N 3.15Å; V86-D88 PolarHBondContact O-N 3.43Å
87	M	41.1	Very low	40.8	Very low	92 Å²	92	127.8 Å²	127.8	45%	0.453	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-58.2	133.3	-179.4	-172.1	171.2	72.4	0	0	110.9	E85 Y444	E85-M87 PolarHBondContact O-N 3.21Å; M87-Y444 HydrophobicContact CE-CD2 4.08Å; M87-Y444 HydrophobicContact CE-CE2 3.37Å
88	D	35.2	Very low	43.8	Very low	143 Å²	143	124.7 Å²	124.7	77%	0.765	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-67.4	122.9	172.4	-102.5	-33.2	0	0	0	109.7	V86 A90	V86-D88 PolarHBondContact O-N 3.43Å; D88-A90 PolarHBondContact O-N 3.28Å; D88-A90 VanDerWaalsContact O-N 3.09Å
89	P	44.1	Very low	46.3	Very low	71 Å²	71	123.6 Å²	123.6	46%	0.461	65%	0.649	S	S	.	*			trans	-68.3	107.9	-178.1	26.2	-33	0	0	0	110.2	G91	P89-G91 VanDerWaalsContact O-CA 3.23Å; P89-G91 WeakPolarHBondContact O-CA 3.46Å; P89-G91 PolarHBondContact O-N 3Å
90	A	47.7	Very low	49.3	Very low	33 Å²	33	118.3 Å²	118.3	27%	0.273	64%	0.635	S	S	.	*	S	Bend	trans	31	44	169.9	0	0	0	0	0	114.6	D88 G92 N443 W446	D88-A90 PolarHBondContact O-N 3.28Å; D88-A90 VanDerWaalsContact O-N 3.09Å; A90-G92 PolarHBondContact O-N 2.96Å; A90-N443 HydrophobicContact CB-CB 4.29Å; A90-N443 VanDerWaalsContact CB-O 3.27Å; A90-N443 WeakPolarHBondContact CB-O 3.46Å; A90-W446 HydrophobicContact CB-CH2 4.46Å; A90-W446 HydrophobicContact CB-CZ2 3.64Å
91	G	34.4	Very low	52.5	Low	73 Å²	73	106.9 Å²	106.9	75%	0.753	59%	0.592	S	S	*	*			trans	-96.6	72.4	-159.7	0	0	0	0	0	110.9	P89	P89-G91 VanDerWaalsContact O-CA 3.23Å; P89-G91 WeakPolarHBondContact O-CA 3.46Å; P89-G91 PolarHBondContact O-N 3Å
92	G	37.7	Very low	56	Low	44 Å²	44	103.4 Å²	103.4	45%	0.454	57%	0.571	S	S	.	*	S	Bend	trans	177.8	153	174.8	0	0	0	0	0	112.8	A90 R94	A90-G92 PolarHBondContact O-N 2.96Å; G92-R94 PolarHBondContact O-N 2.92Å
93	P	41.2	Very low	59.5	Low	135 Å²	135	97.3 Å²	97.3	88%	0.877	53%	0.532	S	S	*	.			trans	-77.1	83.5	-170.4	32.6	-33.9	0	0	0	111.2
94	R	55	Low	63	Low	199 Å²	199	87 Å²	87	75%	0.751	49%	0.493	S	S	*	.			trans	-110.5	59.3	152.3	-74.4	-169.4	179.7	-140.1	2.4	108.7	G92 V96 L233	G92-R94 PolarHBondContact O-N 2.92Å; R94-V96 PolarHBondContact O-N 2.9Å; R94-L233 WeakPolarHBondContact O-CD1 3.24Å
95	G	71.3	Confident	66.3	Low	34 Å²	34	80.6 Å²	80.6	35%	0.351	45%	0.454	S	S	.	.			trans	-76.2	-4.8	178.2	0	0	0	0	0	114.1	L232 L233	G95-L232 WeakPolarHBondContact O-CA 3.3Å; G95-L233 PolarHBondContact O-N 3.28Å
96	V	90.4	Very high	69.8	Low	84 Å²	84	72.6 Å²	72.6	51%	0.509	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-147.4	140.4	-174.4	-160.8	0	0	0	0	111.4	R94 R231 L232	R94-V96 PolarHBondContact O-N 2.9Å; V96-R231 CarbonylContact C-O 3.59Å; V96-R231 WeakPolarHBondContact CA-O 3.43Å; V96-R231 HydrophobicContact CG1-CB 3.73Å; V96-R231 WeakPolarHBondContact CG1-O 3.44Å; V96-L232 HydrophobicContact CG1-CD2 4.37Å; V96-L232 HydrophobicContact CG2-CD2 3.86Å
97	L	92.1	Very high	72.8	Confident	9 Å²	9	66.4 Å²	66.4	5%	0.047	38%	0.379	C	S	.	.			trans	-69.4	152.4	166	-61.4	172.6	0	0	0	111.2	A160 P190 L228 R231 L233 V448	L97-A160 HydrophobicContact CD1-CB 4.04Å; L97-A160 HydrophobicContact CD2-CB 4.07Å; L97-P190 HydrophobicContact CD2-CB 3.88Å; L97-P190 HydrophobicContact CD2-CG 3.88Å; L97-L228 HydrophobicContact CD1-CD1 4.25Å; L97-R231 HydrophobicContact CB-CB 3.86Å; L97-R231 HydrophobicContact CB-CG 4.02Å; L97-R231 PolarHBondContact N-O 2.88Å; L97-L233 HydrophobicContact CD1-CD2 4.48Å; L97-L233 HydrophobicContact CD2-CD1 3.97Å; L97-L233 HydrophobicContact CD2-CD2 4.22Å; L97-L233 HydrophobicContact CG-CD1 4.27Å; L97-L233 HydrophobicContact CG-CD2 4.02Å; L97-L233 HydrophobicContact CG-CG 4.32Å; L97-V448 HydrophobicContact CD1-CG2 3.94Å
98	P	90.3	Very high	75.4	Confident	62 Å²	62	64.1 Å²	64.1	40%	0.403	37%	0.369	S	S	.	.			trans	-61	153.9	176.2	23.4	-29.7	0	0	0	111.9	C101 D159 R231	P98-C101 HydrophobicContact CG-CB 3.89Å; P98-C101 WeakPolarHBondContact O-CB 3.32Å; P98-D159 HydrophobicContact CG-CB 4.26Å; P98-D159 WeakPolarHBondContact CG-OD1 3.49Å; P98-R231 WeakPolarHBondContact O-CD 3.39Å; P98-R231 PolarHBondContact O-NE 3.41Å
99	R	80.4	Confident	78.1	Confident	218 Å²	218	59.3 Å²	59.3	82%	0.823	35%	0.345	S	S	*	.	S	Bend	trans	-61.7	-55.3	-177.9	-107.4	-169	-179.5	169.8	0.5	111.8	R231	R99-R231 PolarHBondContact O-NE 3.27Å; R99-R231 PolarHBondContact O-NH2 3.17Å
100	S	86.8	Confident	80.2	Confident	90 Å²	90	65 Å²	65	63%	0.629	36%	0.357	S	S	*	.	S	Bend	trans	-85.3	114.9	163.3	-170.3	0	0	0	0	106.8
101	C	92.7	Very high	81.8	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.014	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.8	178.6	67.9	0	0	0	0	111.5	P98 S134 D159	P98-C101 HydrophobicContact CG-CB 3.89Å; P98-C101 WeakPolarHBondContact O-CB 3.32Å; C101-S134 PolarHBondContact O-N 2.71Å; C101-S134 PolarHBondContact O-OG 3.48Å; C101-D159 WeakPolarHBondContact CA-OD2 3.2Å; C101-D159 HydrophobicContact CB-CB 3.87Å; C101-D159 WeakPolarHBondContact CB-OD2 3.33Å
102	R	96.9	Very high	83.8	Confident	103 Å²	103	61.5 Å²	61.5	39%	0.389	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.8	178.6	-170.5	-178.9	179.4	-148.3	-0.5	110	S134 W158 D159	R102-S134 CarbonylContact C-O 3.6Å; R102-S134 WeakPolarHBondContact CA-O 3.28Å; R102-S134 VanDerWaalsContact CA-OG 3.28Å; R102-S134 WeakPolarHBondContact CA-OG 3.06Å; R102-S134 VanDerWaalsContact CB-OG 3.32Å; R102-S134 WeakPolarHBondContact CB-OG 3.5Å; R102-S134 WeakPolarHBondContact CG-OG 3.29Å; R102-W158 HydrophobicContact CG-CE3 3.8Å; R102-W158 HydrophobicContact CG-CZ3 3.68Å; R102-W158 VanDerWaalsContact NE-CZ3 3.27Å; R102-W158 VanDerWaalsContact NH2-CH2 3.33Å; R102-W158 CarbonylContact O-C 3.58Å; R102-W158 WeakPolarHBondContact O-CA 3.44Å; R102-D159 PolarHBondContact N-OD2 2.85Å; R102-D159 PolarHBondContact O-N 2.9Å
103	V	98.3	Very high	86.1	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.2	-176.8	-56.6	0	0	0	0	112.4	V105 I133 S134 F135 T136 A160 V162	V103-V105 HydrophobicContact CG2-CG2 4.17Å; V103-I133 HydrophobicContact CG1-CG2 3.97Å; V103-I133 HydrophobicContact CG2-CG2 3.75Å; V103-S134 PolarHBondContact N-O 2.78Å; V103-F135 HydrophobicContact CG2-CB 3.75Å; V103-F135 CarbonylContact O-C 3.5Å; V103-F135 VanDerWaalsContact O-CA 3.25Å; V103-F135 WeakPolarHBondContact O-CA 3.28Å; V103-T136 PolarHBondContact O-N 2.89Å; V103-A160 WeakPolarHBondContact CA-O 3.48Å; V103-A160 HydrophobicContact CG1-CB 4.01Å; V103-V162 HydrophobicContact CB-CG2 3.86Å; V103-V162 HydrophobicContact CG1-CG2 4.25Å; V103-V162 HydrophobicContact CG2-CG2 3.89Å
104	L	98.6	Very high	88.3	Confident	2 Å²	2	62 Å²	62	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.3	167.6	179.5	61.8	0	0	0	108.5	L106 M138 E153 W158 A160 L161 V162	L104-L106 HydrophobicContact CD2-CD2 4.39Å; L104-L106 HydrophobicContact CG-CG 4.46Å; L104-M138 HydrophobicContact CD1-CB 4.05Å; L104-M138 HydrophobicContact CD1-CE 4.38Å; L104-E153 HydrophobicContact CD2-CG 4.14Å; L104-W158 HydrophobicContact CB-CD2 3.7Å; L104-W158 HydrophobicContact CB-CE3 3.98Å; L104-W158 HydrophobicContact CB-CG 4Å; L104-W158 HydrophobicContact CB-CZ2 4.36Å; L104-W158 HydrophobicContact CB-CZ3 4.41Å; L104-W158 HydrophobicContact CD1-CH2 4.34Å; L104-W158 HydrophobicContact CD1-CZ2 4.07Å; L104-A160 PolarHBondContact N-O 3.46Å; L104-L161 HydrophobicContact CB-CD2 3.85Å; L104-L161 HydrophobicContact CD2-CD2 4.11Å; L104-V162 PolarHBondContact O-N 2.94Å
105	V	98.6	Very high	90	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	108	176.8	-174.4	0	0	0	0	109	V103 F120 F135 T136 L137 M138 V162 M164	V103-V105 HydrophobicContact CG2-CG2 4.17Å; V105-F120 HydrophobicContact CB-CE2 4.4Å; V105-F120 HydrophobicContact CG1-CD2 4.21Å; V105-F120 HydrophobicContact CG1-CE2 3.81Å; V105-F120 HydrophobicContact CG2-CE2 4.04Å; V105-F120 HydrophobicContact CG2-CZ 4.29Å; V105-F135 HydrophobicContact CG2-CB 3.9Å; V105-F135 HydrophobicContact CG2-CD2 4.37Å; V105-F135 HydrophobicContact CG2-CG 4.4Å; V105-T136 PolarHBondContact N-O 3.45Å; V105-L137 HydrophobicContact CB-CD1 3.74Å; V105-L137 HydrophobicContact CG1-CD1 3.55Å; V105-M138 PolarHBondContact O-N 2.72Å; V105-V162 CarbonylContact C-O 3.55Å; V105-V162 VanDerWaalsContact CA-O 3.28Å; V105-V162 WeakPolarHBondContact CA-O 3.38Å; V105-V162 HydrophobicContact CG1-CG1 4.45Å; V105-V162 HydrophobicContact CG2-CB 4.14Å; V105-V162 HydrophobicContact CG2-CG1 4.47Å; V105-M164 HydrophobicContact CG1-CB 4.46Å
106	L	98.5	Very high	91.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.9	170.7	-66	168.4	0	0	0	108.6	L104 M138 L149 V150 V162 M164 V173	L104-L106 HydrophobicContact CD2-CD2 4.39Å; L104-L106 HydrophobicContact CG-CG 4.46Å; L106-M138 HydrophobicContact CD2-CB 4.08Å; L106-M138 HydrophobicContact CD2-CG 4.08Å; L106-M138 HydrophobicContact CD2-SD 3.8Å; L106-L149 HydrophobicContact CD2-CD1 4.46Å; L106-V150 HydrophobicContact CD1-CG2 3.53Å; L106-V162 PolarHBondContact N-O 3.49Å; L106-M164 PolarHBondContact O-N 2.76Å; L106-V173 HydrophobicContact CD1-CG2 3.54Å
107	L	97.9	Very high	91.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.1	-174.4	-175.4	148.7	0	0	0	110.9	P109 A116 L117 F120 L137 M138 L139 T140 M164	L107-P109 HydrophobicContact CD2-CB 4.25Å; L107-P109 WeakPolarHBondContact O-CD 2.95Å; L107-A116 HydrophobicContact CD2-CB 4.05Å; L107-A116 HydrophobicContact CG-CB 4.31Å; L107-L117 HydrophobicContact CD2-CB 4.31Å; L107-F120 HydrophobicContact CD1-CB 3.73Å; L107-F120 HydrophobicContact CD1-CD2 4.4Å; L107-F120 HydrophobicContact CD1-CG 4.14Å; L107-L137 HydrophobicContact CB-CD1 3.82Å; L107-L137 HydrophobicContact CD1-CD1 4.11Å; L107-M138 PolarHBondContact N-O 2.92Å; L107-L139 HydrophobicContact CB-CD2 4.17Å; L107-L139 HydrophobicContact CD2-CD2 3.69Å; L107-L139 HydrophobicContact CG-CD2 4.5Å; L107-L139 WeakPolarHBondContact O-CA 3.15Å; L107-T140 PolarHBondContact O-N 2.88Å; L107-T140 PolarHBondContact O-OG1 2.9Å; L107-M164 HydrophobicContact CB-CB 4.47Å; L107-M164 HydrophobicContact CD1-CB 4.27Å; L107-M164 HydrophobicContact CD1-CG 4.2Å; L107-M164 HydrophobicContact CD1-SD 3.76Å; L107-M164 HydrophobicContact CG-CB 4.37Å
108	N	94.7	Very high	91.6	Very high	44 Å²	44	61.5 Å²	61.5	24%	0.235	31%	0.307	C	S	.	.			trans	-91.8	108.5	168.8	-178.4	-7.8	0	0	0	109.9	R110 G111 A116 T140 M164 S165 L169	N108-R110 PolarHBondContact O-N 2.78Å; N108-R110 WeakPolarHBondContact OD1-CB 3.43Å; N108-R110 PolarHBondContact OD1-N 3.07Å; N108-G111 PolarHBondContact O-N 2.84Å; N108-A116 VanDerWaalsContact O-CB 3.26Å; N108-A116 WeakPolarHBondContact O-CB 3.34Å; N108-T140 WeakPolarHBondContact CA-OG1 3.15Å; N108-T140 WeakPolarHBondContact CB-OG1 3.48Å; N108-M164 PolarHBondContact N-O 2.84Å; N108-S165 WeakPolarHBondContact CB-OG 3.23Å; N108-L169 HydrophobicContact CB-CD2 4.32Å
109	P	92.1	Very high	91.9	Very high	42 Å²	42	59.8 Å²	59.8	27%	0.273	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.9	-176	28.3	-34.3	0	0	0	112.7	L107 G111 G114 T140	L107-P109 HydrophobicContact CD2-CB 4.25Å; L107-P109 WeakPolarHBondContact O-CD 2.95Å; P109-G111 VanDerWaalsContact C-N 3.27Å; P109-G114 CarbonylContact O-C 3.53Å; P109-G114 WeakPolarHBondContact O-CA 3.32Å; P109-T140 WeakPolarHBondContact CD-O 3.14Å
110	R	87.8	Confident	92.7	Very high	190 Å²	190	49.4 Å²	49.4	72%	0.717	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.9	175.3	-57.9	-179.3	-178.7	166.7	3.4	112.5	N108 G114	N108-R110 PolarHBondContact O-N 2.78Å; N108-R110 WeakPolarHBondContact OD1-CB 3.43Å; N108-R110 PolarHBondContact OD1-N 3.07Å; R110-G114 PolarHBondContact O-N 2.95Å
111	G	82.3	Confident	93.2	Very high	8 Å²	8	50.7 Å²	50.7	8%	0.082	25%	0.246	C	C	.	.	H	α-helix	trans	-58.7	153.2	172.8	0	0	0	0	0	112.4	N108 P109 K113 G114 K115 A116 A196	N108-G111 PolarHBondContact O-N 2.84Å; P109-G111 VanDerWaalsContact C-N 3.27Å; G111-K113 VanDerWaalsContact C-N 3.3Å; G111-K113 PolarHBondContact O-N 2.87Å; G111-G114 PolarHBondContact O-N 3.26Å; G111-K115 PolarHBondContact O-N 2.72Å; G111-A116 PolarHBondContact O-N 3.07Å; G111-A196 CarbonylContact C-O 3.58Å; G111-A196 VanDerWaalsContact CA-O 3.26Å; G111-A196 WeakPolarHBondContact CA-O 3.45Å
112	G	77.3	Confident	93.4	Very high	26 Å²	26	53.5 Å²	53.5	27%	0.268	27%	0.266	S	S	.	.	H	α-helix	trans	65.6	35.6	170.3	0	0	0	0	0	112.3	G114 K115 A196	G112-G114 VanDerWaalsContact C-N 3.28Å; G112-G114 PolarHBondContact O-N 3.35Å; G112-K115 WeakPolarHBondContact O-CB 3.32Å; G112-K115 PolarHBondContact O-N 3.2Å; G112-A196 VanDerWaalsContact CA-O 3.3Å; G112-A196 WeakPolarHBondContact CA-O 3.4Å; G112-A196 PolarHBondContact N-O 2.86Å
113	K	84.6	Confident	93.4	Very high	138 Å²	138	51.5 Å²	51.5	60%	0.6	26%	0.26	S	S	*	.	H	α-helix	trans	59.4	37.8	-173.3	-48.4	178.9	-170.4	-171.4	0	112.2	G111 R272	G111-K113 VanDerWaalsContact C-N 3.3Å; G111-K113 PolarHBondContact O-N 2.87Å; K113-R272 WeakPolarHBondContact CE-O 3.49Å; K113-R272 PolarHBondContact NZ-O 2.87Å
114	G	87.5	Confident	93.4	Very high	50 Å²	50	51.5 Å²	51.5	52%	0.515	26%	0.26	S	S	.	.	H	α-helix	trans	82.8	10.2	-179.7	0	0	0	0	0	115	P109 R110 G111 G112	P109-G114 CarbonylContact O-C 3.53Å; P109-G114 WeakPolarHBondContact O-CA 3.32Å; R110-G114 PolarHBondContact O-N 2.95Å; G111-G114 PolarHBondContact O-N 3.26Å; G112-G114 VanDerWaalsContact C-N 3.28Å; G112-G114 PolarHBondContact O-N 3.35Å
115	K	91.7	Very high	93.3	Very high	117 Å²	117	54.4 Å²	54.4	51%	0.509	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-1.3	-175.1	-59.7	-177.2	178.4	-177	0	114.2	G111 G112 L117 Q118 L119	G111-K115 PolarHBondContact O-N 2.72Å; G112-K115 WeakPolarHBondContact O-CB 3.32Å; G112-K115 PolarHBondContact O-N 3.2Å; K115-L117 VanDerWaalsContact C-N 3.3Å; K115-L117 PolarHBondContact O-N 3.47Å; K115-Q118 WeakPolarHBondContact O-CB 3.48Å; K115-Q118 PolarHBondContact O-N 3.25Å; K115-L119 HydrophobicContact CB-CD1 4.42Å; K115-L119 HydrophobicContact CB-CG 4.42Å; K115-L119 WeakPolarHBondContact O-CG 3.39Å; K115-L119 PolarHBondContact O-N 3.49Å
116	A	94	Very high	93.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-53	-44.2	-174.1	0	0	0	0	0	113.3	L107 N108 G111 L119 F120 A196	L107-A116 HydrophobicContact CD2-CB 4.05Å; L107-A116 HydrophobicContact CG-CB 4.31Å; N108-A116 VanDerWaalsContact O-CB 3.26Å; N108-A116 WeakPolarHBondContact O-CB 3.34Å; G111-A116 PolarHBondContact O-N 3.07Å; A116-L119 PolarHBondContact O-N 3.18Å; A116-F120 WeakPolarHBondContact O-CB 3.34Å; A116-F120 PolarHBondContact O-N 3.15Å; A116-A196 HydrophobicContact CB-CB 3.87Å
117	L	96.2	Very high	93.3	Very high	65 Å²	65	59 Å²	59	34%	0.34	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-39.8	178.2	-176.9	61.4	0	0	0	112.4	L107 K115 F120 R121 L137	L107-L117 HydrophobicContact CD2-CB 4.31Å; K115-L117 VanDerWaalsContact C-N 3.3Å; K115-L117 PolarHBondContact O-N 3.47Å; L117-F120 PolarHBondContact O-N 3.33Å; L117-R121 WeakPolarHBondContact O-CG 3.27Å; L117-R121 PolarHBondContact O-N 3.15Å; L117-R121 VanDerWaalsContact O-N 3.13Å; L117-L137 HydrophobicContact CD1-CD2 3.52Å
118	Q	96.3	Very high	93.3	Very high	135 Å²	135	59.1 Å²	59.1	63%	0.631	30%	0.302	S	S	*	.	H	α-helix	trans	-64.8	-45	176	-176.3	-176.6	-1.3	0	0	110.8	K115 F120 R121 S122	K115-Q118 WeakPolarHBondContact O-CB 3.48Å; K115-Q118 PolarHBondContact O-N 3.25Å; Q118-F120 VanDerWaalsContact C-N 3.31Å; Q118-F120 PolarHBondContact O-N 3.47Å; Q118-R121 PolarHBondContact O-N 2.71Å; Q118-S122 PolarHBondContact O-N 3.36Å; Q118-S122 PolarHBondContact O-OG 3.29Å
119	L	96.4	Very high	93.3	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.131	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-40.9	176.2	-72.2	172.2	0	0	0	111.7	K115 A116 R121 S122 H123 M164 E218 L221	K115-L119 HydrophobicContact CB-CD1 4.42Å; K115-L119 HydrophobicContact CB-CG 4.42Å; K115-L119 WeakPolarHBondContact O-CG 3.39Å; K115-L119 PolarHBondContact O-N 3.49Å; A116-L119 PolarHBondContact O-N 3.18Å; L119-R121 PolarHBondContact O-N 2.87Å; L119-S122 PolarHBondContact O-N 3.29Å; L119-S122 PolarHBondContact O-OG 3.26Å; L119-H123 WeakPolarHBondContact O-CB 3.12Å; L119-H123 PolarHBondContact O-N 2.86Å; L119-M164 HydrophobicContact CB-CE 3.87Å; L119-E218 HydrophobicContact CD2-CG 3.94Å; L119-L221 HydrophobicContact CB-CD2 3.94Å
120	F	97.8	Very high	93.5	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.341	C	S	.	.	I	π-helix	trans	-58.8	-48.4	174.8	-179.9	-94.8	0	0	0	111.3	V105 L107 A116 L117 Q118 S122 V124 Q125 L128 F135 L137 M164	V105-F120 HydrophobicContact CB-CE2 4.4Å; V105-F120 HydrophobicContact CG1-CD2 4.21Å; V105-F120 HydrophobicContact CG1-CE2 3.81Å; V105-F120 HydrophobicContact CG2-CE2 4.04Å; V105-F120 HydrophobicContact CG2-CZ 4.29Å; L107-F120 HydrophobicContact CD1-CB 3.73Å; L107-F120 HydrophobicContact CD1-CD2 4.4Å; L107-F120 HydrophobicContact CD1-CG 4.14Å; A116-F120 WeakPolarHBondContact O-CB 3.34Å; A116-F120 PolarHBondContact O-N 3.15Å; L117-F120 PolarHBondContact O-N 3.33Å; Q118-F120 VanDerWaalsContact C-N 3.31Å; Q118-F120 PolarHBondContact O-N 3.47Å; F120-S122 PolarHBondContact O-N 2.7Å; F120-V124 HydrophobicContact CD2-CB 3.75Å; F120-V124 HydrophobicContact CD2-CG1 3.78Å; F120-V124 HydrophobicContact CD2-CG2 4.23Å; F120-V124 HydrophobicContact CE2-CB 4.07Å; F120-V124 HydrophobicContact CE2-CG1 3.65Å; F120-V124 HydrophobicContact CG-CB 4.36Å; F120-V124 WeakPolarHBondContact O-CA 3.07Å; F120-V124 WeakPolarHBondContact O-CB 3.07Å; F120-V124 PolarHBondContact O-N 2.81Å; F120-V124 VanDerWaalsContact O-N 3.12Å; F120-Q125 HydrophobicContact CE1-CB 4.24Å; F120-Q125 PolarHBondContact O-N 3.21Å; F120-L128 HydrophobicContact CE2-CD1 4.35Å; F120-L128 HydrophobicContact CZ-CD1 4.36Å; F120-F135 HydrophobicContact CE1-CD2 4.08Å; F120-F135 HydrophobicContact CE1-CE1 4.41Å; F120-F135 AromaticContact CE1-CE2 3.41Å; F120-F135 HydrophobicContact CE1-CE2 3.41Å; F120-F135 VanDerWaalsContact CE1-CE2 3.41Å; F120-F135 AromaticContact CE1-CZ 3.61Å; F120-F135 HydrophobicContact CE1-CZ 3.61Å; F120-F135 HydrophobicContact CZ-CD1 4.33Å; F120-F135 AromaticContact CZ-CD2 3.62Å; F120-F135 HydrophobicContact CZ-CD2 3.62Å; F120-F135 HydrophobicContact CZ-CE1 4.17Å; F120-F135 AromaticContact CZ-CE2 3.44Å; F120-F135 HydrophobicContact CZ-CE2 3.44Å; F120-F135 VanDerWaalsContact CZ-CE2 3.44Å; F120-F135 HydrophobicContact CZ-CG 4.09Å; F120-F135 AromaticContact CZ-CZ 3.73Å; F120-F135 HydrophobicContact CZ-CZ 3.73Å; F120-L137 HydrophobicContact CD1-CD1 4.46Å; F120-L137 HydrophobicContact CD1-CD2 4.44Å; F120-L137 HydrophobicContact CE1-CD1 4.36Å; F120-L137 HydrophobicContact CZ-CD1 4.4Å; F120-M164 HydrophobicContact CB-CE 4.09Å; F120-M164 HydrophobicContact CB-SD 3.71Å; F120-M164 HydrophobicContact CD2-SD 3.68Å; F120-M164 HydrophobicContact CG-SD 4.18Å
121	R	97.4	Very high	93.9	Very high	117 Å²	117	57.8 Å²	57.8	44%	0.442	31%	0.314	S	S	.	.	I	π-helix	trans	-65.9	-36.8	-179.4	-65.5	-60.9	-175.4	179.1	-0.4	113	L117 Q118 L119	L117-R121 WeakPolarHBondContact O-CG 3.27Å; L117-R121 PolarHBondContact O-N 3.15Å; L117-R121 VanDerWaalsContact O-N 3.13Å; Q118-R121 PolarHBondContact O-N 2.71Å; L119-R121 PolarHBondContact O-N 2.87Å
122	S	96.8	Very high	94.5	Very high	62 Å²	62	63.8 Å²	63.8	43%	0.434	34%	0.341	S	S	.	.	I	π-helix	trans	-88.3	-37.1	-174.7	55.5	0	0	0	0	114.6	Q118 L119 F120	Q118-S122 PolarHBondContact O-N 3.36Å; Q118-S122 PolarHBondContact O-OG 3.29Å; L119-S122 PolarHBondContact O-N 3.29Å; L119-S122 PolarHBondContact O-OG 3.26Å; F120-S122 PolarHBondContact O-N 2.7Å
123	H	96.3	Very high	95.5	Very high	60 Å²	60	62.9 Å²	62.9	28%	0.278	33%	0.329	S	S	.	.	I	π-helix	trans	-110.6	-31.3	-172.6	-64.5	72.5	0	0	0	113.3	L119 L127 L221	L119-H123 WeakPolarHBondContact O-CB 3.12Å; L119-H123 PolarHBondContact O-N 2.86Å; H123-L127 WeakPolarHBondContact O-CD1 3.41Å; H123-L221 HydrophobicContact CB-CD2 4.05Å
124	V	98.1	Very high	96.1	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-94.5	-54.8	-173.2	-176.3	0	0	0	0	111.3	F120 L127 L128 M164 L194 L221 T225	F120-V124 HydrophobicContact CD2-CB 3.75Å; F120-V124 HydrophobicContact CD2-CG1 3.78Å; F120-V124 HydrophobicContact CD2-CG2 4.23Å; F120-V124 HydrophobicContact CE2-CB 4.07Å; F120-V124 HydrophobicContact CE2-CG1 3.65Å; F120-V124 HydrophobicContact CG-CB 4.36Å; F120-V124 WeakPolarHBondContact O-CA 3.07Å; F120-V124 WeakPolarHBondContact O-CB 3.07Å; F120-V124 PolarHBondContact O-N 2.81Å; F120-V124 VanDerWaalsContact O-N 3.12Å; V124-L127 PolarHBondContact O-N 2.98Å; V124-L127 VanDerWaalsContact O-N 3.15Å; V124-L128 HydrophobicContact CG1-CD1 3.87Å; V124-L128 HydrophobicContact CG1-CG 3.99Å; V124-L128 WeakPolarHBondContact O-CG 3.35Å; V124-L128 PolarHBondContact O-N 2.84Å; V124-M164 HydrophobicContact CG2-CE 4.12Å; V124-M164 HydrophobicContact CG2-SD 4.12Å; V124-L194 HydrophobicContact CG1-CD1 3.73Å; V124-L194 HydrophobicContact CG2-CD1 4.18Å; V124-L221 HydrophobicContact CG2-CD1 3.8Å; V124-L221 HydrophobicContact CG2-CD2 4.19Å; V124-L221 HydrophobicContact CG2-CG 4.14Å; V124-T225 HydrophobicContact CB-CG2 4.5Å; V124-T225 HydrophobicContact CG1-CG2 4.06Å
125	Q	98	Very high	96.7	Very high	63 Å²	63	59.2 Å²	59.2	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-55.5	-43.1	-174	175.3	177.5	-21.7	0	0	114.2	F120 L127 L128 A129 F135	F120-Q125 HydrophobicContact CE1-CB 4.24Å; F120-Q125 PolarHBondContact O-N 3.21Å; Q125-L127 VanDerWaalsContact C-N 3.34Å; Q125-L127 PolarHBondContact O-N 3.43Å; Q125-L128 PolarHBondContact O-N 2.73Å; Q125-A129 PolarHBondContact O-N 2.94Å; Q125-F135 HydrophobicContact CB-CZ 4.5Å; Q125-F135 HydrophobicContact CG-CE1 3.97Å; Q125-F135 HydrophobicContact CG-CZ 4.01Å
126	P	98.2	Very high	97	Very high	57 Å²	57	56 Å²	56	37%	0.37	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-43	178.4	-23.8	35.6	0	0	0	112.3	L128 A129 E130	P126-L128 PolarHBondContact O-N 2.83Å; P126-A129 PolarHBondContact O-N 2.91Å; P126-E130 WeakPolarHBondContact O-CG 3.46Å; P126-E130 PolarHBondContact O-N 2.79Å
127	L	97.8	Very high	97.2	Very high	41 Å²	41	58.2 Å²	58.2	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-38.5	178.6	-63.5	178.8	0	0	0	111.9	H123 V124 Q125 A129 A131 T225	H123-L127 WeakPolarHBondContact O-CD1 3.41Å; V124-L127 PolarHBondContact O-N 2.98Å; V124-L127 VanDerWaalsContact O-N 3.15Å; Q125-L127 VanDerWaalsContact C-N 3.34Å; Q125-L127 PolarHBondContact O-N 3.43Å; L127-A129 VanDerWaalsContact C-N 3.34Å; L127-A131 WeakPolarHBondContact O-CB 3.44Å; L127-A131 PolarHBondContact O-N 2.91Å; L127-T225 HydrophobicContact CB-CG2 3.79Å; L127-T225 HydrophobicContact CD1-CG2 3.62Å; L127-T225 HydrophobicContact CG-CG2 4.33Å
128	L	97.6	Very high	97.3	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-40.3	174.2	-63.5	-172.8	0	0	0	111.9	F120 V124 Q125 P126 A131 E132 I133 F135 L228	F120-L128 HydrophobicContact CE2-CD1 4.35Å; F120-L128 HydrophobicContact CZ-CD1 4.36Å; V124-L128 HydrophobicContact CG1-CD1 3.87Å; V124-L128 HydrophobicContact CG1-CG 3.99Å; V124-L128 WeakPolarHBondContact O-CG 3.35Å; V124-L128 PolarHBondContact O-N 2.84Å; Q125-L128 PolarHBondContact O-N 2.73Å; P126-L128 PolarHBondContact O-N 2.83Å; L128-A131 PolarHBondContact O-N 2.87Å; L128-E132 PolarHBondContact O-N 2.56Å; L128-E132 VanDerWaalsContact O-N 3.13Å; L128-I133 HydrophobicContact CB-CB 4.15Å; L128-I133 HydrophobicContact CD2-CB 4.02Å; L128-I133 HydrophobicContact CD2-CD1 3.9Å; L128-I133 HydrophobicContact CD2-CG1 4.47Å; L128-I133 HydrophobicContact CD2-CG2 4.08Å; L128-I133 PolarHBondContact O-N 2.85Å; L128-F135 HydrophobicContact CD1-CB 4.39Å; L128-F135 HydrophobicContact CD1-CD1 3.85Å; L128-F135 HydrophobicContact CD1-CE1 4.49Å; L128-F135 HydrophobicContact CD1-CG 4.27Å; L128-L228 HydrophobicContact CD2-CD2 3.7Å; L128-L228 HydrophobicContact CD2-CG 4.23Å
129	A	96.1	Very high	97.3	Very high	72 Å²	72	54.5 Å²	54.5	60%	0.595	29%	0.292	S	S	*	.	H	α-helix	trans	-64.5	-46.7	178	0	0	0	0	0	111.7	Q125 P126 L127 A131 E132	Q125-A129 PolarHBondContact O-N 2.94Å; P126-A129 PolarHBondContact O-N 2.91Å; L127-A129 VanDerWaalsContact C-N 3.34Å; A129-A131 VanDerWaalsContact C-N 3.26Å; A129-A131 PolarHBondContact O-N 2.86Å; A129-E132 PolarHBondContact O-N 2.7Å; A129-E132 VanDerWaalsContact O-N 3.16Å
130	E	96.1	Very high	97.3	Very high	156 Å²	156	53.5 Å²	53.5	73%	0.729	29%	0.287	S	S	*	.	H	α-helix	trans	-62.1	-35.1	175	-72.6	176.8	-163.7	0	0	112.4	P126 E132	P126-E130 WeakPolarHBondContact O-CG 3.46Å; P126-E130 PolarHBondContact O-N 2.79Å; E130-E132 VanDerWaalsContact C-N 3.29Å; E130-E132 PolarHBondContact O-N 3.08Å
131	A	95.4	Very high	97.1	Very high	20 Å²	20	59.7 Å²	59.7	17%	0.165	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-5.7	178.6	0	0	0	0	0	113.4	L127 L128 A129 I133 C229 R231	L127-A131 WeakPolarHBondContact O-CB 3.44Å; L127-A131 PolarHBondContact O-N 2.91Å; L128-A131 PolarHBondContact O-N 2.87Å; A129-A131 VanDerWaalsContact C-N 3.26Å; A129-A131 PolarHBondContact O-N 2.86Å; A131-I133 VanDerWaalsContact C-N 3.35Å; A131-I133 HydrophobicContact CB-CD1 4.06Å; A131-I133 HydrophobicContact CB-CG1 3.97Å; A131-C229 HydrophobicContact CB-CB 3.85Å; A131-R231 PolarHBondContact O-NH1 3.25Å; A131-R231 PolarHBondContact O-NH2 3.49Å
132	E	95.9	Very high	97	Very high	135 Å²	135	60.1 Å²	60.1	63%	0.631	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	35.3	-171.7	-54.3	174.1	-147	0	0	113.8	L128 A129 E130	L128-E132 PolarHBondContact O-N 2.56Å; L128-E132 VanDerWaalsContact O-N 3.13Å; A129-E132 PolarHBondContact O-N 2.7Å; A129-E132 VanDerWaalsContact O-N 3.16Å; E130-E132 VanDerWaalsContact C-N 3.29Å; E130-E132 PolarHBondContact O-N 3.08Å
133	I	97.8	Very high	96.7	Very high	6 Å²	6	64.2 Å²	64.2	3%	0.031	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	106.6	173.6	-57.2	-179.6	0	0	0	108.8	V103 L128 A131 L228	V103-I133 HydrophobicContact CG1-CG2 3.97Å; V103-I133 HydrophobicContact CG2-CG2 3.75Å; L128-I133 HydrophobicContact CB-CB 4.15Å; L128-I133 HydrophobicContact CD2-CB 4.02Å; L128-I133 HydrophobicContact CD2-CD1 3.9Å; L128-I133 HydrophobicContact CD2-CG1 4.47Å; L128-I133 HydrophobicContact CD2-CG2 4.08Å; L128-I133 PolarHBondContact O-N 2.85Å; A131-I133 VanDerWaalsContact C-N 3.35Å; A131-I133 HydrophobicContact CB-CD1 4.06Å; A131-I133 HydrophobicContact CB-CG1 3.97Å; I133-L228 HydrophobicContact CD1-CD1 4.46Å; I133-L228 HydrophobicContact CD1-CG 4.04Å
134	S	97.8	Very high	96.6	Very high	58 Å²	58	64.1 Å²	64.1	41%	0.406	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143.9	170.9	65.1	0	0	0	0	109.9	C101 R102 V103	C101-S134 PolarHBondContact O-N 2.71Å; C101-S134 PolarHBondContact O-OG 3.48Å; R102-S134 CarbonylContact C-O 3.6Å; R102-S134 WeakPolarHBondContact CA-O 3.28Å; R102-S134 VanDerWaalsContact CA-OG 3.28Å; R102-S134 WeakPolarHBondContact CA-OG 3.06Å; R102-S134 VanDerWaalsContact CB-OG 3.32Å; R102-S134 WeakPolarHBondContact CB-OG 3.5Å; R102-S134 WeakPolarHBondContact CG-OG 3.29Å; V103-S134 PolarHBondContact N-O 2.78Å
135	F	98.3	Very high	96.6	Very high	53 Å²	53	65.5 Å²	65.5	23%	0.232	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.1	-178.7	69.4	-91.2	0	0	0	112.5	V103 V105 F120 Q125 L128 L137	V103-F135 HydrophobicContact CG2-CB 3.75Å; V103-F135 CarbonylContact O-C 3.5Å; V103-F135 VanDerWaalsContact O-CA 3.25Å; V103-F135 WeakPolarHBondContact O-CA 3.28Å; V105-F135 HydrophobicContact CG2-CB 3.9Å; V105-F135 HydrophobicContact CG2-CD2 4.37Å; V105-F135 HydrophobicContact CG2-CG 4.4Å; F120-F135 HydrophobicContact CE1-CD2 4.08Å; F120-F135 HydrophobicContact CE1-CE1 4.41Å; F120-F135 AromaticContact CE1-CE2 3.41Å; F120-F135 HydrophobicContact CE1-CE2 3.41Å; F120-F135 VanDerWaalsContact CE1-CE2 3.41Å; F120-F135 AromaticContact CE1-CZ 3.61Å; F120-F135 HydrophobicContact CE1-CZ 3.61Å; F120-F135 HydrophobicContact CZ-CD1 4.33Å; F120-F135 AromaticContact CZ-CD2 3.62Å; F120-F135 HydrophobicContact CZ-CD2 3.62Å; F120-F135 HydrophobicContact CZ-CE1 4.17Å; F120-F135 AromaticContact CZ-CE2 3.44Å; F120-F135 HydrophobicContact CZ-CE2 3.44Å; F120-F135 VanDerWaalsContact CZ-CE2 3.44Å; F120-F135 HydrophobicContact CZ-CG 4.09Å; F120-F135 AromaticContact CZ-CZ 3.73Å; F120-F135 HydrophobicContact CZ-CZ 3.73Å; Q125-F135 HydrophobicContact CB-CZ 4.5Å; Q125-F135 HydrophobicContact CG-CE1 3.97Å; Q125-F135 HydrophobicContact CG-CZ 4.01Å; L128-F135 HydrophobicContact CD1-CB 4.39Å; L128-F135 HydrophobicContact CD1-CD1 3.85Å; L128-F135 HydrophobicContact CD1-CE1 4.49Å; L128-F135 HydrophobicContact CD1-CG 4.27Å; F135-L137 HydrophobicContact CD2-CB 4.49Å; F135-L137 HydrophobicContact CE2-CB 4.47Å
136	T	98.5	Very high	96.6	Very high	51 Å²	51	62.5 Å²	62.5	31%	0.313	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.8	164.3	-62	0	0	0	0	108.1	V103 V105 W158	V103-T136 PolarHBondContact O-N 2.89Å; V105-T136 PolarHBondContact N-O 3.45Å; T136-W158 HydrophobicContact CG2-CH2 4.03Å; T136-W158 VanDerWaalsContact OG1-CH2 3.31Å; T136-W158 WeakPolarHBondContact OG1-CH2 3.37Å
137	L	98.1	Very high	96.6	Very high	45 Å²	45	62.4 Å²	62.4	24%	0.236	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.4	-177.6	-170.9	69.4	0	0	0	110.1	V105 L107 L117 F120 F135 L139	V105-L137 HydrophobicContact CB-CD1 3.74Å; V105-L137 HydrophobicContact CG1-CD1 3.55Å; L107-L137 HydrophobicContact CB-CD1 3.82Å; L107-L137 HydrophobicContact CD1-CD1 4.11Å; L117-L137 HydrophobicContact CD1-CD2 3.52Å; F120-L137 HydrophobicContact CD1-CD1 4.46Å; F120-L137 HydrophobicContact CD1-CD2 4.44Å; F120-L137 HydrophobicContact CE1-CD1 4.36Å; F120-L137 HydrophobicContact CZ-CD1 4.4Å; F135-L137 HydrophobicContact CD2-CB 4.49Å; F135-L137 HydrophobicContact CE2-CB 4.47Å; L137-L139 HydrophobicContact CD2-CD2 4.14Å; L137-L139 HydrophobicContact CG-CD2 4.18Å
138	M	97.9	Very high	96.6	Very high	52 Å²	52	64.2 Å²	64.2	26%	0.256	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.2	176.5	-178.7	176.4	-74.3	0	0	109.3	L104 V105 L106 L107 L149	L104-M138 HydrophobicContact CD1-CB 4.05Å; L104-M138 HydrophobicContact CD1-CE 4.38Å; V105-M138 PolarHBondContact O-N 2.72Å; L106-M138 HydrophobicContact CD2-CB 4.08Å; L106-M138 HydrophobicContact CD2-CG 4.08Å; L106-M138 HydrophobicContact CD2-SD 3.8Å; L107-M138 PolarHBondContact N-O 2.92Å; M138-L149 HydrophobicContact CG-CD1 4.12Å; M138-L149 HydrophobicContact SD-CB 4.22Å; M138-L149 HydrophobicContact SD-CD1 3.6Å; M138-L149 HydrophobicContact SD-CD2 3.79Å; M138-L149 HydrophobicContact SD-CG 4.06Å
139	L	97.8	Very high	96.6	Very high	71 Å²	71	65.9 Å²	65.9	37%	0.372	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.9	-176.1	-57.6	-177.1	0	0	0	110.4	L107 L137	L107-L139 HydrophobicContact CB-CD2 4.17Å; L107-L139 HydrophobicContact CD2-CD2 3.69Å; L107-L139 HydrophobicContact CG-CD2 4.5Å; L107-L139 WeakPolarHBondContact O-CA 3.15Å; L137-L139 HydrophobicContact CD2-CD2 4.14Å; L137-L139 HydrophobicContact CG-CD2 4.18Å
140	T	96.8	Very high	96.6	Very high	4 Å²	4	62.5 Å²	62.5	3%	0.025	30%	0.298	C	S	.	.			trans	-92.7	144.8	175.3	64.7	0	0	0	0	109.8	L107 N108 P109 A146 L169	L107-T140 PolarHBondContact O-N 2.88Å; L107-T140 PolarHBondContact O-OG1 2.9Å; N108-T140 WeakPolarHBondContact CA-OG1 3.15Å; N108-T140 WeakPolarHBondContact CB-OG1 3.48Å; P109-T140 WeakPolarHBondContact CD-O 3.14Å; T140-A146 HydrophobicContact CG2-CB 3.95Å; T140-L169 HydrophobicContact CG2-CD1 4.26Å; T140-L169 HydrophobicContact CG2-CD2 4.44Å
141	E	93.6	Very high	96.7	Very high	129 Å²	129	61.2 Å²	61.2	60%	0.603	29%	0.286	S	S	*	.			trans	-120.3	-28.4	-166.8	-61	-175.1	159.8	0	0	114.1	H145	E141-H145 PolarHBondContact N-ND1 3.24Å
142	R	93.9	Very high	96.8	Very high	127 Å²	127	64.9 Å²	64.9	48%	0.479	31%	0.311	S	S	.	.	S	Bend	trans	-147.8	166.6	-174.4	65.1	178.1	-166.3	-75.4	-5.5	110.5	H145 E148	R142-H145 HydrophobicContact CG-CB 3.87Å; R142-H145 WeakPolarHBondContact O-CB 3.36Å; R142-H145 PolarHBondContact O-N 3.48Å; R142-H145 VanDerWaalsContact O-N 3.14Å; R142-E148 IonicContact CZ-OE2 2.76Å; R142-E148 VanDerWaalsContact NH2-CD 3.32Å; R142-E148 IonicContact NH2-OE1 3.59Å; R142-E148 PolarHBondContact NH2-OE1 2.97Å; R142-E148 IonicContact NH2-OE2 2.91Å; R142-E148 PolarHBondContact NH2-OE2 3.06Å
143	R	91	Very high	96.8	Very high	147 Å²	147	60 Å²	60	56%	0.555	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	140.3	171.9	-166	179.3	-164.2	-158.8	1.2	110.3	H145 E429	R143-H145 PolarHBondContact O-N 3.17Å; R143-E429 IonicContact CZ-OE2 3.8Å; R143-E429 IonicContact NE-OE2 2.78Å; R143-E429 PolarHBondContact NE-OE2 3.02Å; R143-E429 IonicContact NH2-OE2 3.47Å; R143-E429 PolarHBondContact NH2-OE2 3Å
144	N	95.1	Very high	96.8	Very high	59 Å²	59	64.6 Å²	64.6	32%	0.316	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	2.6	-174.1	-61.4	-54.5	0	0	0	115.7	A146 R147 E148 E172	N144-A146 VanDerWaalsContact C-N 3.35Å; N144-A146 PolarHBondContact O-N 2.88Å; N144-R147 HydrophobicContact CB-CB 4.41Å; N144-R147 WeakPolarHBondContact O-CB 3.42Å; N144-R147 PolarHBondContact O-N 2.95Å; N144-E148 WeakPolarHBondContact O-CG 3.22Å; N144-E148 PolarHBondContact O-N 2.97Å; N144-E172 VanDerWaalsContact C-OE2 3.3Å; N144-E172 VanDerWaalsContact CA-CD 3.48Å; N144-E172 WeakPolarHBondContact CA-OE2 3.39Å; N144-E172 PolarHBondContact N-OE1 2.75Å; N144-E172 PolarHBondContact N-OE2 3.21Å; N144-E172 VanDerWaalsContact N-OE2 3.13Å
145	H	97.4	Very high	96.7	Very high	29 Å²	29	62.5 Å²	62.5	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-40.8	177.5	-168.1	-175.2	0	0	0	110.8	E141 R142 R143 R147 E148 L149 E172	E141-H145 PolarHBondContact N-ND1 3.24Å; R142-H145 HydrophobicContact CG-CB 3.87Å; R142-H145 WeakPolarHBondContact O-CB 3.36Å; R142-H145 PolarHBondContact O-N 3.48Å; R142-H145 VanDerWaalsContact O-N 3.14Å; R143-H145 PolarHBondContact O-N 3.17Å; H145-R147 VanDerWaalsContact C-N 3.33Å; H145-R147 PolarHBondContact O-N 2.93Å; H145-E148 PolarHBondContact O-N 3.13Å; H145-L149 WeakPolarHBondContact O-CB 2.97Å; H145-L149 WeakPolarHBondContact O-CD1 3.12Å; H145-L149 WeakPolarHBondContact O-CG 3.45Å; H145-L149 PolarHBondContact O-N 3.19Å; H145-E172 PolarHBondContact N-OE2 2.84Å
146	A	97.4	Very high	96.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-38.1	177.9	0	0	0	0	0	111.8	T140 N144 L149 V150 L169 E172 V173	T140-A146 HydrophobicContact CG2-CB 3.95Å; N144-A146 VanDerWaalsContact C-N 3.35Å; N144-A146 PolarHBondContact O-N 2.88Å; A146-L149 PolarHBondContact O-N 3.21Å; A146-V150 WeakPolarHBondContact O-CB 3.22Å; A146-V150 WeakPolarHBondContact O-CG2 3.3Å; A146-V150 PolarHBondContact O-N 3.21Å; A146-L169 HydrophobicContact CB-CD1 3.54Å; A146-L169 HydrophobicContact CB-CG 4.18Å; A146-E172 HydrophobicContact CB-CB 4.08Å; A146-E172 WeakPolarHBondContact CB-OE2 3.43Å; A146-E172 PolarHBondContact N-OE2 2.92Å; A146-E172 VanDerWaalsContact N-OE2 3.13Å; A146-V173 HydrophobicContact CB-CG2 4.17Å
147	R	97.8	Very high	96.5	Very high	54 Å²	54	67.7 Å²	67.7	20%	0.204	33%	0.329	C	S	.	.	H	α-helix	trans	-57	-50.2	174.7	-172.7	179.4	-174.4	157.3	3.5	111.3	N144 H145 R151 E172 E179	N144-R147 HydrophobicContact CB-CB 4.41Å; N144-R147 WeakPolarHBondContact O-CB 3.42Å; N144-R147 PolarHBondContact O-N 2.95Å; H145-R147 VanDerWaalsContact C-N 3.33Å; H145-R147 PolarHBondContact O-N 2.93Å; R147-R151 VanDerWaalsContact O-CB 3.27Å; R147-R151 WeakPolarHBondContact O-CB 3.26Å; R147-R151 PolarHBondContact O-N 3.03Å; R147-E172 WeakPolarHBondContact CA-O 3.43Å; R147-E172 HydrophobicContact CB-CB 4.09Å; R147-E172 WeakPolarHBondContact CB-O 3.49Å; R147-E179 IonicContact CZ-OE1 3.9Å; R147-E179 IonicContact NE-OE1 3.85Å; R147-E179 PolarHBondContact NE-OE1 3.04Å; R147-E179 IonicContact NE-OE2 3.96Å; R147-E179 IonicContact NH2-OE1 2.66Å; R147-E179 PolarHBondContact NH2-OE1 2.9Å
148	E	97.9	Very high	96.5	Very high	80 Å²	80	66.2 Å²	66.2	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-64.1	-43.2	178.9	-69.3	168.7	-154.5	0	0	112.8	R142 N144 H145 R151 S152	R142-E148 IonicContact CZ-OE2 2.76Å; R142-E148 VanDerWaalsContact NH2-CD 3.32Å; R142-E148 IonicContact NH2-OE1 3.59Å; R142-E148 PolarHBondContact NH2-OE1 2.97Å; R142-E148 IonicContact NH2-OE2 2.91Å; R142-E148 PolarHBondContact NH2-OE2 3.06Å; N144-E148 WeakPolarHBondContact O-CG 3.22Å; N144-E148 PolarHBondContact O-N 2.97Å; H145-E148 PolarHBondContact O-N 3.13Å; E148-R151 PolarHBondContact O-N 2.77Å; E148-S152 PolarHBondContact O-N 2.89Å; E148-S152 PolarHBondContact O-OG 2.78Å
149	L	97.3	Very high	96.5	Very high	36 Å²	36	66.5 Å²	66.5	19%	0.188	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-53.8	178.6	-72.7	165.3	0	0	0	110.6	L106 M138 H145 A146 R151 S152 E153	L106-L149 HydrophobicContact CD2-CD1 4.46Å; M138-L149 HydrophobicContact CG-CD1 4.12Å; M138-L149 HydrophobicContact SD-CB 4.22Å; M138-L149 HydrophobicContact SD-CD1 3.6Å; M138-L149 HydrophobicContact SD-CD2 3.79Å; M138-L149 HydrophobicContact SD-CG 4.06Å; H145-L149 WeakPolarHBondContact O-CB 2.97Å; H145-L149 WeakPolarHBondContact O-CD1 3.12Å; H145-L149 WeakPolarHBondContact O-CG 3.45Å; H145-L149 PolarHBondContact O-N 3.19Å; A146-L149 PolarHBondContact O-N 3.21Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 2.87Å; L149-S152 CarbonylContact O-C 3.59Å; L149-S152 PolarHBondContact O-N 2.97Å; L149-S152 VanDerWaalsContact O-N 3.09Å; L149-S152 PolarHBondContact O-OG 2.89Å; L149-E153 WeakPolarHBondContact O-CB 3.35Å; L149-E153 PolarHBondContact O-N 3.18Å
150	V	97.8	Very high	96.5	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-33.6	-177.6	174.6	0	0	0	0	112.2	L106 A146 S152 E153 L161 V173 L177 R180	L106-V150 HydrophobicContact CD1-CG2 3.53Å; A146-V150 WeakPolarHBondContact O-CB 3.22Å; A146-V150 WeakPolarHBondContact O-CG2 3.3Å; A146-V150 PolarHBondContact O-N 3.21Å; V150-S152 PolarHBondContact O-N 2.93Å; V150-E153 PolarHBondContact O-N 3.21Å; V150-L161 HydrophobicContact CG1-CD1 4.13Å; V150-L161 HydrophobicContact CG2-CD1 4.37Å; V150-V173 HydrophobicContact CG1-CG1 4.42Å; V150-V173 HydrophobicContact CG2-CG1 4.23Å; V150-V173 HydrophobicContact CG2-CG2 4.12Å; V150-L177 HydrophobicContact CG1-CD2 3.3Å; V150-L177 HydrophobicContact CG1-CG 3.54Å; V150-R180 PolarHBondContact O-NH1 2.63Å; V150-R180 VanDerWaalsContact O-NH1 3.13Å
151	R	97.6	Very high	96.6	Very high	128 Å²	128	62.9 Å²	62.9	48%	0.483	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-30	175	-168.1	177.4	74.5	-174.8	4.6	112.9	R147 E148 L149 E179 R180	R147-R151 VanDerWaalsContact O-CB 3.27Å; R147-R151 WeakPolarHBondContact O-CB 3.26Å; R147-R151 PolarHBondContact O-N 3.03Å; E148-R151 PolarHBondContact O-N 2.77Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 2.87Å; R151-E179 VanDerWaalsContact CD-OE2 3.23Å; R151-E179 WeakPolarHBondContact CD-OE2 3.45Å; R151-E179 HydrophobicContact CG-CB 4.34Å; R151-E179 IonicContact CZ-OE2 2.86Å; R151-E179 IonicContact NE-OE2 3.78Å; R151-E179 IonicContact NH1-OE2 3.6Å; R151-E179 PolarHBondContact NH1-OE2 3.48Å; R151-R180 HydrophobicContact CB-CG 4.47Å; R151-R180 HydrophobicContact CG-CG 4.01Å; R151-R180 PolarHBondContact O-NH1 3.09Å
152	S	96.3	Very high	96.9	Very high	97 Å²	97	56.8 Å²	56.8	68%	0.678	28%	0.275	S	S	*	.	H	α-helix	trans	-104.2	-5.6	-179.1	56.7	0	0	0	0	114.5	E148 L149 V150	E148-S152 PolarHBondContact O-N 2.89Å; E148-S152 PolarHBondContact O-OG 2.78Å; L149-S152 CarbonylContact O-C 3.59Å; L149-S152 PolarHBondContact O-N 2.97Å; L149-S152 VanDerWaalsContact O-N 3.09Å; L149-S152 PolarHBondContact O-OG 2.89Å; V150-S152 PolarHBondContact O-N 2.93Å
153	E	97.4	Very high	97.1	Very high	33 Å²	33	50.9 Å²	50.9	15%	0.154	25%	0.253	C	S	.	.	S	Bend	trans	-71.5	149.6	-175.1	-172.7	57.1	-138.6	0	0	113.3	L104 L149 V150 L155 W158 R180	L104-E153 HydrophobicContact CD2-CG 4.14Å; L149-E153 WeakPolarHBondContact O-CB 3.35Å; L149-E153 PolarHBondContact O-N 3.18Å; V150-E153 PolarHBondContact O-N 3.21Å; E153-L155 HydrophobicContact CB-CD2 4.29Å; E153-L155 HydrophobicContact CG-CD2 4.27Å; E153-L155 PolarHBondContact O-N 3.36Å; E153-W158 PolarHBondContact OE1-NE1 3.5Å; E153-R180 PolarHBondContact O-NH1 2.98Å
154	E	96.8	Very high	97.4	Very high	103 Å²	103	43.9 Å²	43.9	48%	0.481	23%	0.227	S	C	.	.			trans	-88.1	85.5	172.7	-169.9	-177.7	138.4	0	0	110.5	G156 R157	E154-G156 PolarHBondContact O-N 3.07Å; E154-R157 VanDerWaalsContact CD-CZ 3.47Å; E154-R157 HydrophobicContact CG-CG 4.25Å; E154-R157 PolarHBondContact O-N 3.22Å; E154-R157 IonicContact OE1-CZ 3.67Å; E154-R157 IonicContact OE1-NE 3.68Å; E154-R157 PolarHBondContact OE1-NE 3.38Å; E154-R157 IonicContact OE1-NH2 2.73Å; E154-R157 IonicContact OE2-CZ 3.55Å; E154-R157 IonicContact OE2-NE 3.69Å; E154-R157 PolarHBondContact OE2-NE 3.37Å; E154-R157 VanDerWaalsContact OE2-NE 3.09Å; E154-R157 IonicContact OE2-NH1 2.73Å; E154-R157 IonicContact OE2-NH2 3.14Å; E154-R157 PolarHBondContact OE2-NH2 2.82Å
155	L	96.8	Very high	97.3	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-60.8	-18.1	-172.7	-59.9	178.7	0	0	0	114.7	E153 R157 W158 L161 L177 A186 K189	E153-L155 HydrophobicContact CB-CD2 4.29Å; E153-L155 HydrophobicContact CG-CD2 4.27Å; E153-L155 PolarHBondContact O-N 3.36Å; L155-R157 PolarHBondContact O-N 2.89Å; L155-W158 PolarHBondContact O-N 2.92Å; L155-L161 HydrophobicContact CD2-CD1 4.12Å; L155-L161 HydrophobicContact CD2-CD2 4.38Å; L155-L177 HydrophobicContact CD1-CD2 3.57Å; L155-L177 HydrophobicContact CD2-CD2 4.2Å; L155-A186 HydrophobicContact CD1-CB 3.52Å; L155-K189 WeakPolarHBondContact O-CE 3.37Å; L155-K189 PolarHBondContact O-NZ 2.97Å
156	G	95.8	Very high	97.1	Very high	75 Å²	75	40.8 Å²	40.8	77%	0.773	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-65.5	-19.8	177.7	0	0	0	0	0	114.3	E154 W158	E154-G156 PolarHBondContact O-N 3.07Å; G156-W158 VanDerWaalsContact C-N 3.34Å
157	R	96.6	Very high	96.8	Very high	137 Å²	137	41.3 Å²	41.3	52%	0.517	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-82.8	-10.8	-178.9	-62.5	178.9	178.6	174.3	-0.1	114.4	E154 L155	E154-R157 VanDerWaalsContact CD-CZ 3.47Å; E154-R157 HydrophobicContact CG-CG 4.25Å; E154-R157 PolarHBondContact O-N 3.22Å; E154-R157 IonicContact OE1-CZ 3.67Å; E154-R157 IonicContact OE1-NE 3.68Å; E154-R157 PolarHBondContact OE1-NE 3.38Å; E154-R157 IonicContact OE1-NH2 2.73Å; E154-R157 IonicContact OE2-CZ 3.55Å; E154-R157 IonicContact OE2-NE 3.69Å; E154-R157 PolarHBondContact OE2-NE 3.37Å; E154-R157 VanDerWaalsContact OE2-NE 3.09Å; E154-R157 IonicContact OE2-NH1 2.73Å; E154-R157 IonicContact OE2-NH2 3.14Å; E154-R157 PolarHBondContact OE2-NH2 2.82Å; L155-R157 PolarHBondContact O-N 2.89Å
158	W	98	Very high	96.6	Very high	14 Å²	14	39.4 Å²	39.4	5%	0.053	22%	0.215	C	C	.	.			trans	-122.4	135.6	-170.3	-51.4	112.7	0	0	0	110	R102 L104 T136 E153 L155 G156 L161 K189	R102-W158 HydrophobicContact CG-CE3 3.8Å; R102-W158 HydrophobicContact CG-CZ3 3.68Å; R102-W158 VanDerWaalsContact NE-CZ3 3.27Å; R102-W158 VanDerWaalsContact NH2-CH2 3.33Å; R102-W158 CarbonylContact O-C 3.58Å; R102-W158 WeakPolarHBondContact O-CA 3.44Å; L104-W158 HydrophobicContact CB-CD2 3.7Å; L104-W158 HydrophobicContact CB-CE3 3.98Å; L104-W158 HydrophobicContact CB-CG 4Å; L104-W158 HydrophobicContact CB-CZ2 4.36Å; L104-W158 HydrophobicContact CB-CZ3 4.41Å; L104-W158 HydrophobicContact CD1-CH2 4.34Å; L104-W158 HydrophobicContact CD1-CZ2 4.07Å; T136-W158 HydrophobicContact CG2-CH2 4.03Å; T136-W158 VanDerWaalsContact OG1-CH2 3.31Å; T136-W158 WeakPolarHBondContact OG1-CH2 3.37Å; E153-W158 PolarHBondContact OE1-NE1 3.5Å; L155-W158 PolarHBondContact O-N 2.92Å; G156-W158 VanDerWaalsContact C-N 3.34Å; W158-L161 HydrophobicContact CB-CD2 4.34Å; W158-L161 HydrophobicContact CG-CD2 4.46Å; W158-K189 WeakPolarHBondContact O-CE 3.34Å; W158-K189 PolarHBondContact O-NZ 3.21Å
159	D	97.9	Very high	96.5	Very high	58 Å²	58	36.1 Å²	36.1	31%	0.31	20%	0.2	S	C	.	.	S	Bend	trans	-77.6	-32.7	172.5	-65.3	-61.8	0	0	0	111.6	P98 C101 R102 P190	P98-D159 HydrophobicContact CG-CB 4.26Å; P98-D159 WeakPolarHBondContact CG-OD1 3.49Å; C101-D159 WeakPolarHBondContact CA-OD2 3.2Å; C101-D159 HydrophobicContact CB-CB 3.87Å; C101-D159 WeakPolarHBondContact CB-OD2 3.33Å; R102-D159 PolarHBondContact N-OD2 2.85Å; R102-D159 PolarHBondContact O-N 2.9Å; D159-P190 WeakPolarHBondContact O-CD 3.39Å
160	A	98.2	Very high	96.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	158.5	176.7	0	0	0	0	0	111.8	L97 V103 L104 P190	L97-A160 HydrophobicContact CD1-CB 4.04Å; L97-A160 HydrophobicContact CD2-CB 4.07Å; V103-A160 WeakPolarHBondContact CA-O 3.48Å; V103-A160 HydrophobicContact CG1-CB 4.01Å; L104-A160 PolarHBondContact N-O 3.46Å; A160-P190 CarbonylContact C-O 3.5Å; A160-P190 WeakPolarHBondContact CA-O 3.49Å; A160-P190 HydrophobicContact CB-CB 4.09Å; A160-P190 WeakPolarHBondContact CB-O 3.31Å
161	L	98.7	Very high	96.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122	167.8	-50.1	-179.5	0	0	0	109	L104 V150 L155 W158 V173 L177 K189 P190 L191 C192	L104-L161 HydrophobicContact CB-CD2 3.85Å; L104-L161 HydrophobicContact CD2-CD2 4.11Å; V150-L161 HydrophobicContact CG1-CD1 4.13Å; V150-L161 HydrophobicContact CG2-CD1 4.37Å; L155-L161 HydrophobicContact CD2-CD1 4.12Å; L155-L161 HydrophobicContact CD2-CD2 4.38Å; W158-L161 HydrophobicContact CB-CD2 4.34Å; W158-L161 HydrophobicContact CG-CD2 4.46Å; L161-V173 HydrophobicContact CD1-CG1 4.25Å; L161-L177 HydrophobicContact CD1-CD2 4.45Å; L161-K189 HydrophobicContact CD1-CG 4.27Å; L161-K189 HydrophobicContact CD2-CG 4.45Å; L161-K189 HydrophobicContact CG-CG 3.84Å; L161-P190 PolarHBondContact N-O 3.04Å; L161-L191 HydrophobicContact CB-CD2 3.79Å; L161-L191 HydrophobicContact CD1-CD2 4.01Å; L161-L191 HydrophobicContact CG-CD2 4.17Å; L161-L191 CarbonylContact O-C 3.29Å; L161-L191 WeakPolarHBondContact O-CA 3.43Å; L161-C192 PolarHBondContact O-N 2.93Å
162	V	98.6	Very high	96.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.4	177.3	179.4	0	0	0	0	108.1	V103 L104 V105 L106 C192 L194 L228	V103-V162 HydrophobicContact CB-CG2 3.86Å; V103-V162 HydrophobicContact CG1-CG2 4.25Å; V103-V162 HydrophobicContact CG2-CG2 3.89Å; L104-V162 PolarHBondContact O-N 2.94Å; V105-V162 CarbonylContact C-O 3.55Å; V105-V162 VanDerWaalsContact CA-O 3.28Å; V105-V162 WeakPolarHBondContact CA-O 3.38Å; V105-V162 HydrophobicContact CG1-CG1 4.45Å; V105-V162 HydrophobicContact CG2-CB 4.14Å; V105-V162 HydrophobicContact CG2-CG1 4.47Å; L106-V162 PolarHBondContact N-O 3.49Å; V162-C192 HydrophobicContact CB-CB 4.38Å; V162-C192 HydrophobicContact CG1-CB 4.35Å; V162-C192 HydrophobicContact CG2-CB 3.98Å; V162-L194 HydrophobicContact CG1-CD1 3.49Å; V162-L194 VanDerWaalsContact CG1-CD1 3.49Å; V162-L194 HydrophobicContact CG1-CG 3.76Å; V162-L228 HydrophobicContact CG1-CD2 4.25Å; V162-L228 HydrophobicContact CG2-CD1 4.27Å; V162-L228 HydrophobicContact CG2-CD2 3.75Å
163	V	98.3	Very high	96.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	110.5	-177.7	-173.5	0	0	0	0	108.3	L169 M170 V173 C192 L194	V163-L169 HydrophobicContact CG1-CB 3.72Å; V163-L169 HydrophobicContact CG1-CD2 3.68Å; V163-L169 HydrophobicContact CG1-CG 3.71Å; V163-M170 HydrophobicContact CB-CE 3.76Å; V163-M170 HydrophobicContact CG2-CE 3.71Å; V163-M170 HydrophobicContact CG2-SD 4.04Å; V163-V173 HydrophobicContact CG2-CB 4.32Å; V163-V173 HydrophobicContact CG2-CG1 4.31Å; V163-V173 HydrophobicContact CG2-CG2 3.86Å; V163-C192 PolarHBondContact N-O 3.26Å; V163-L194 PolarHBondContact O-N 3.47Å
164	M	97.5	Very high	96.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	90.5	179.7	-171.5	170.1	178.3	0	0	111.1	V105 L106 L107 N108 L119 F120 V124 L194 A196 L221	V105-M164 HydrophobicContact CG1-CB 4.46Å; L106-M164 PolarHBondContact O-N 2.76Å; L107-M164 HydrophobicContact CB-CB 4.47Å; L107-M164 HydrophobicContact CD1-CB 4.27Å; L107-M164 HydrophobicContact CD1-CG 4.2Å; L107-M164 HydrophobicContact CD1-SD 3.76Å; L107-M164 HydrophobicContact CG-CB 4.37Å; N108-M164 PolarHBondContact N-O 2.84Å; L119-M164 HydrophobicContact CB-CE 3.87Å; F120-M164 HydrophobicContact CB-CE 4.09Å; F120-M164 HydrophobicContact CB-SD 3.71Å; F120-M164 HydrophobicContact CD2-SD 3.68Å; F120-M164 HydrophobicContact CG-SD 4.18Å; V124-M164 HydrophobicContact CG2-CE 4.12Å; V124-M164 HydrophobicContact CG2-SD 4.12Å; M164-L194 VanDerWaalsContact CA-O 3.3Å; M164-L194 WeakPolarHBondContact CA-O 3.49Å; M164-L194 HydrophobicContact CB-CB 4.12Å; M164-L194 HydrophobicContact CG-CB 4.02Å; M164-A196 HydrophobicContact CE-CB 3.81Å; M164-A196 HydrophobicContact CG-CB 3.66Å; M164-L221 HydrophobicContact CE-CD1 3.97Å; M164-L221 HydrophobicContact CE-CD2 3.85Å
165	S	93.9	Very high	96.6	Very high	11 Å²	11	18.9 Å²	18.9	8%	0.077	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	-145.8	-180	-162.9	0	0	0	0	110.3	N108 L169 L194 A196 G197 N200	N108-S165 WeakPolarHBondContact CB-OG 3.23Å; S165-L169 VanDerWaalsContact CB-CD2 3.44Å; S165-L194 PolarHBondContact N-O 2.89Å; S165-A196 CarbonylContact O-C 3.38Å; S165-A196 PolarHBondContact O-N 3.28Å; S165-G197 PolarHBondContact O-N 3.21Å; S165-N200 PolarHBondContact O-OD1 2.65Å
166	G	91.8	Very high	96.6	Very high	12 Å²	12	18.2 Å²	18.2	12%	0.124	11%	0.11	C	C	.	.			trans	-100.8	-172.6	162	0	0	0	0	0	112.5	G168 L169 G199	G166-G168 VanDerWaalsContact C-N 3.28Å; G166-G168 PolarHBondContact O-N 2.86Å; G166-L169 PolarHBondContact O-N 2.94Å; G166-G199 CarbonylContact C-O 3.57Å; G166-G199 WeakPolarHBondContact CA-O 3.11Å
167	D	92.7	Very high	96.8	Very high	12 Å²	12	14.7 Å²	14.7	6%	0.064	7%	0.073	C	C	.	.	H	α-helix	trans	-56.6	-37	-174.6	-57.2	-54.2	0	0	0	113.3	L169 M170 H171 G199 N200 A201 L202 L253	D167-L169 VanDerWaalsContact C-N 3.29Å; D167-L169 PolarHBondContact O-N 2.79Å; D167-M170 WeakPolarHBondContact O-CB 3.05Å; D167-M170 PolarHBondContact O-N 2.66Å; D167-H171 PolarHBondContact O-N 2.89Å; D167-G199 PolarHBondContact N-O 2.85Å; D167-G199 VanDerWaalsContact OD2-O 3.07Å; D167-N200 PolarHBondContact OD2-N 3.3Å; D167-A201 PolarHBondContact OD1-N 2.97Å; D167-A201 VanDerWaalsContact OD1-N 3.16Å; D167-A201 WeakPolarHBondContact OD2-CB 3.3Å; D167-A201 PolarHBondContact OD2-N 2.82Å; D167-L202 VanDerWaalsContact OD1-CB 3.29Å; D167-L202 WeakPolarHBondContact OD1-CB 3.49Å; D167-L202 PolarHBondContact OD1-N 2.9Å; D167-L253 HydrophobicContact CB-CD2 4.07Å
168	G	93.1	Very high	96.8	Very high	14 Å²	14	8.4 Å²	8.4	14%	0.144	5%	0.05	C	C	.	.	H	α-helix	trans	-61.1	-28.2	-179.9	0	0	0	0	0	115.2	G166 H171 E172	G166-G168 VanDerWaalsContact C-N 3.28Å; G166-G168 PolarHBondContact O-N 2.86Å; G168-H171 WeakPolarHBondContact O-CB 3.43Å; G168-H171 PolarHBondContact O-N 3.01Å; G168-E172 PolarHBondContact O-N 2.94Å; G168-E172 VanDerWaalsContact O-N 3.1Å
169	L	95.6	Very high	96.7	Very high	11 Å²	11	10.5 Å²	10.5	6%	0.058	6%	0.06	C	C	.	.	H	α-helix	trans	-75.8	-32.8	175.7	-159.8	67.5	0	0	0	111.4	N108 T140 A146 V163 S165 G166 D167 H171 E172 V173	N108-L169 HydrophobicContact CB-CD2 4.32Å; T140-L169 HydrophobicContact CG2-CD1 4.26Å; T140-L169 HydrophobicContact CG2-CD2 4.44Å; A146-L169 HydrophobicContact CB-CD1 3.54Å; A146-L169 HydrophobicContact CB-CG 4.18Å; V163-L169 HydrophobicContact CG1-CB 3.72Å; V163-L169 HydrophobicContact CG1-CD2 3.68Å; V163-L169 HydrophobicContact CG1-CG 3.71Å; S165-L169 VanDerWaalsContact CB-CD2 3.44Å; G166-L169 PolarHBondContact O-N 2.94Å; D167-L169 VanDerWaalsContact C-N 3.29Å; D167-L169 PolarHBondContact O-N 2.79Å; L169-H171 VanDerWaalsContact C-N 3.32Å; L169-E172 PolarHBondContact O-N 3.14Å; L169-V173 VanDerWaalsContact O-CG2 3.32Å; L169-V173 WeakPolarHBondContact O-CG2 3.22Å; L169-V173 PolarHBondContact O-N 3.43Å
170	M	97.1	Very high	96.6	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-65.9	-40.5	172.6	-173.7	61.4	71.4	0	0	110.5	V163 D167 E172 V173 V174 L191 L202 V252 M447	V163-M170 HydrophobicContact CB-CE 3.76Å; V163-M170 HydrophobicContact CG2-CE 3.71Å; V163-M170 HydrophobicContact CG2-SD 4.04Å; D167-M170 WeakPolarHBondContact O-CB 3.05Å; D167-M170 PolarHBondContact O-N 2.66Å; M170-E172 PolarHBondContact O-N 3.21Å; M170-V173 PolarHBondContact O-N 3.17Å; M170-V174 PolarHBondContact O-N 2.86Å; M170-V174 HydrophobicContact SD-CG2 4.32Å; M170-L191 HydrophobicContact CE-CB 4.3Å; M170-L191 HydrophobicContact SD-CB 4.2Å; M170-L191 HydrophobicContact SD-CD1 3.81Å; M170-L202 HydrophobicContact CB-CD2 4.27Å; M170-L202 HydrophobicContact CE-CD2 4.41Å; M170-L202 HydrophobicContact CG-CD2 3.71Å; M170-V252 HydrophobicContact CB-CG2 4.48Å; M170-V252 HydrophobicContact CG-CG2 4.09Å; M170-M447 HydrophobicContact CE-CE 3.99Å
171	H	96.3	Very high	96.5	Very high	18 Å²	18	15.2 Å²	15.2	8%	0.083	9%	0.09	C	C	.	.	H	α-helix	trans	-55.1	-48.5	172.3	175	87.3	0	0	0	111.9	D167 G168 L169 V173 N175 F250 D427	D167-H171 PolarHBondContact O-N 2.89Å; G168-H171 WeakPolarHBondContact O-CB 3.43Å; G168-H171 PolarHBondContact O-N 3.01Å; L169-H171 VanDerWaalsContact C-N 3.32Å; H171-V173 PolarHBondContact O-N 2.86Å; H171-N175 PolarHBondContact CE1-ND2 3.21Å; H171-N175 VanDerWaalsContact CE1-ND2 3.26Å; H171-N175 PolarHBondContact ND1-ND2 2.93Å; H171-N175 PolarHBondContact NE2-ND2 3.12Å; H171-N175 WeakPolarHBondContact O-CB 2.87Å; H171-N175 PolarHBondContact O-N 3.37Å; H171-N175 PolarHBondContact O-ND2 2.7Å; H171-F250 PolarHBondContact CE1-O 2.77Å; H171-F250 PolarHBondContact ND1-O 3.35Å; H171-D427 HydrophobicContact CB-CB 3.93Å; H171-D427 IonicContact CE1-OD2 3.6Å; H171-D427 IonicContact CG-OD2 2.7Å; H171-D427 IonicContact ND1-OD2 3.13Å; H171-D427 PolarHBondContact ND1-OD2 2.88Å
172	E	97.7	Very high	96.4	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.07	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-45	176	-76.1	-169.3	-160	0	0	112.6	N144 H145 A146 R147 G168 L169 M170 G176	N144-E172 VanDerWaalsContact C-OE2 3.3Å; N144-E172 VanDerWaalsContact CA-CD 3.48Å; N144-E172 WeakPolarHBondContact CA-OE2 3.39Å; N144-E172 PolarHBondContact N-OE1 2.75Å; N144-E172 PolarHBondContact N-OE2 3.21Å; N144-E172 VanDerWaalsContact N-OE2 3.13Å; H145-E172 PolarHBondContact N-OE2 2.84Å; A146-E172 HydrophobicContact CB-CB 4.08Å; A146-E172 WeakPolarHBondContact CB-OE2 3.43Å; A146-E172 PolarHBondContact N-OE2 2.92Å; A146-E172 VanDerWaalsContact N-OE2 3.13Å; R147-E172 WeakPolarHBondContact CA-O 3.43Å; R147-E172 HydrophobicContact CB-CB 4.09Å; R147-E172 WeakPolarHBondContact CB-O 3.49Å; G168-E172 PolarHBondContact O-N 2.94Å; G168-E172 VanDerWaalsContact O-N 3.1Å; L169-E172 PolarHBondContact O-N 3.14Å; M170-E172 PolarHBondContact O-N 3.21Å; E172-G176 PolarHBondContact O-N 3.26Å
173	V	98.3	Very high	96.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-48.7	-179.4	167.6	0	0	0	0	111.2	L106 A146 V150 L161 V163 L169 M170 H171 G176 L177 L191	L106-V173 HydrophobicContact CD1-CG2 3.54Å; A146-V173 HydrophobicContact CB-CG2 4.17Å; V150-V173 HydrophobicContact CG1-CG1 4.42Å; V150-V173 HydrophobicContact CG2-CG1 4.23Å; V150-V173 HydrophobicContact CG2-CG2 4.12Å; L161-V173 HydrophobicContact CD1-CG1 4.25Å; V163-V173 HydrophobicContact CG2-CB 4.32Å; V163-V173 HydrophobicContact CG2-CG1 4.31Å; V163-V173 HydrophobicContact CG2-CG2 3.86Å; L169-V173 VanDerWaalsContact O-CG2 3.32Å; L169-V173 WeakPolarHBondContact O-CG2 3.22Å; L169-V173 PolarHBondContact O-N 3.43Å; M170-V173 PolarHBondContact O-N 3.17Å; H171-V173 PolarHBondContact O-N 2.86Å; V173-G176 PolarHBondContact O-N 3.48Å; V173-L177 HydrophobicContact CG1-CD1 4.36Å; V173-L177 WeakPolarHBondContact O-CG 3.19Å; V173-L177 PolarHBondContact O-N 3.37Å; V173-L191 HydrophobicContact CG1-CD2 4.18Å
174	V	98.1	Very high	96.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-43.6	-178.9	168.7	0	0	0	0	111.7	M170 G176 L177 M178 I187 L191 L238 F250 V252	M170-V174 PolarHBondContact O-N 2.86Å; M170-V174 HydrophobicContact SD-CG2 4.32Å; V174-G176 VanDerWaalsContact C-N 3.27Å; V174-G176 PolarHBondContact O-N 3.24Å; V174-L177 PolarHBondContact O-N 3.3Å; V174-M178 HydrophobicContact CG1-CG 4.4Å; V174-M178 WeakPolarHBondContact O-CG 3.48Å; V174-M178 PolarHBondContact O-N 3.39Å; V174-I187 HydrophobicContact CG1-CD1 4.05Å; V174-L191 HydrophobicContact CG2-CD1 3.53Å; V174-L238 HydrophobicContact CG1-CD1 3.71Å; V174-F250 HydrophobicContact CG1-CB 4.49Å; V174-V252 HydrophobicContact CB-CG1 3.76Å; V174-V252 HydrophobicContact CG1-CG1 3.8Å; V174-V252 HydrophobicContact CG2-CG1 3.6Å
175	N	97.8	Very high	96	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-35.8	174.6	-78.2	-89.5	0	0	0	111.6	H171 L177 M178 E179 F250	H171-N175 PolarHBondContact CE1-ND2 3.21Å; H171-N175 VanDerWaalsContact CE1-ND2 3.26Å; H171-N175 PolarHBondContact ND1-ND2 2.93Å; H171-N175 PolarHBondContact NE2-ND2 3.12Å; H171-N175 WeakPolarHBondContact O-CB 2.87Å; H171-N175 PolarHBondContact O-N 3.37Å; H171-N175 PolarHBondContact O-ND2 2.7Å; N175-L177 PolarHBondContact O-N 3.09Å; N175-M178 PolarHBondContact O-N 3.41Å; N175-E179 WeakPolarHBondContact O-CG 3.39Å; N175-E179 PolarHBondContact O-N 2.75Å; N175-F250 PolarHBondContact ND2-O 2.94Å; N175-F250 PolarHBondContact OD1-N 3.42Å
176	G	97.9	Very high	96.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-38.2	174.5	0	0	0	0	0	113.1	E172 V173 V174 R180	E172-G176 PolarHBondContact O-N 3.26Å; V173-G176 PolarHBondContact O-N 3.48Å; V174-G176 VanDerWaalsContact C-N 3.27Å; V174-G176 PolarHBondContact O-N 3.24Å; G176-R180 WeakPolarHBondContact O-CG 3.38Å
177	L	98.2	Very high	96.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.7	-44.4	173.7	-67.5	170.3	0	0	0	111.9	V150 L155 L161 V173 V174 N175 E179 R180 A186 I187 L191	V150-L177 HydrophobicContact CG1-CD2 3.3Å; V150-L177 HydrophobicContact CG1-CG 3.54Å; L155-L177 HydrophobicContact CD1-CD2 3.57Å; L155-L177 HydrophobicContact CD2-CD2 4.2Å; L161-L177 HydrophobicContact CD1-CD2 4.45Å; V173-L177 HydrophobicContact CG1-CD1 4.36Å; V173-L177 WeakPolarHBondContact O-CG 3.19Å; V173-L177 PolarHBondContact O-N 3.37Å; V174-L177 PolarHBondContact O-N 3.3Å; N175-L177 PolarHBondContact O-N 3.09Å; L177-E179 VanDerWaalsContact C-N 3.27Å; L177-E179 PolarHBondContact O-N 3.22Å; L177-R180 WeakPolarHBondContact O-CB 3.35Å; L177-R180 PolarHBondContact O-N 3.01Å; L177-A186 HydrophobicContact CD2-CB 4.03Å; L177-I187 HydrophobicContact CB-CD1 4.25Å; L177-I187 HydrophobicContact CD1-CD1 4.26Å; L177-L191 HydrophobicContact CD1-CD1 4.4Å; L177-L191 HydrophobicContact CD1-CD2 4.14Å
178	M	97.2	Very high	96.6	Very high	5 Å²	5	32.2 Å²	32.2	3%	0.025	17%	0.173	C	C	.	.	H	α-helix	trans	-70.1	-21.2	-177	-69.2	-57.7	-65.9	0	0	113.9	V174 N175 R180 W183 I187 L238 F250 Y444	V174-M178 HydrophobicContact CG1-CG 4.4Å; V174-M178 WeakPolarHBondContact O-CG 3.48Å; V174-M178 PolarHBondContact O-N 3.39Å; N175-M178 PolarHBondContact O-N 3.41Å; M178-R180 VanDerWaalsContact C-N 3.33Å; M178-W183 HydrophobicContact CE-CD2 4.33Å; M178-W183 HydrophobicContact CE-CE3 3.69Å; M178-W183 HydrophobicContact CE-CZ3 4.18Å; M178-W183 HydrophobicContact SD-CE3 4.07Å; M178-I187 HydrophobicContact CG-CD1 4.1Å; M178-I187 HydrophobicContact SD-CB 3.83Å; M178-I187 HydrophobicContact SD-CD1 3.78Å; M178-I187 HydrophobicContact SD-CG1 3.59Å; M178-I187 VanDerWaalsContact SD-CG1 3.59Å; M178-I187 HydrophobicContact SD-CG2 4.39Å; M178-L238 HydrophobicContact CE-CD2 4.39Å; M178-L238 HydrophobicContact CG-CD2 4.33Å; M178-L238 HydrophobicContact SD-CD2 4.18Å; M178-F250 HydrophobicContact CB-CD2 3.5Å; M178-F250 VanDerWaalsContact CB-CD2 3.5Å; M178-F250 HydrophobicContact CB-CE2 3.38Å; M178-F250 HydrophobicContact CB-CG 4.31Å; M178-F250 HydrophobicContact CB-CZ 4.09Å; M178-F250 HydrophobicContact CE-CD1 4.26Å; M178-F250 HydrophobicContact CE-CE1 3.61Å; M178-F250 HydrophobicContact CE-CE2 3.95Å; M178-F250 HydrophobicContact CE-CZ 3.42Å; M178-F250 VanDerWaalsContact CE-CZ 3.42Å; M178-F250 HydrophobicContact CG-CD1 4.43Å; M178-F250 HydrophobicContact CG-CD2 3.71Å; M178-F250 HydrophobicContact CG-CE2 3.85Å; M178-F250 HydrophobicContact CG-CG 4.01Å; M178-F250 HydrophobicContact CG-CZ 4.26Å; M178-Y444 HydrophobicContact CE-CE1 3.76Å; M178-Y444 HydrophobicContact SD-CD1 4.5Å; M178-Y444 HydrophobicContact SD-CE1 4.01Å
179	E	96.1	Very high	96.8	Very high	59 Å²	59	33.4 Å²	33.4	28%	0.276	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.4	173.7	-85.5	177.5	-158.3	0	0	114.4	R147 R151 N175 L177 Q317	R147-E179 IonicContact CZ-OE1 3.9Å; R147-E179 IonicContact NE-OE1 3.85Å; R147-E179 PolarHBondContact NE-OE1 3.04Å; R147-E179 IonicContact NE-OE2 3.96Å; R147-E179 IonicContact NH2-OE1 2.66Å; R147-E179 PolarHBondContact NH2-OE1 2.9Å; R151-E179 VanDerWaalsContact CD-OE2 3.23Å; R151-E179 WeakPolarHBondContact CD-OE2 3.45Å; R151-E179 HydrophobicContact CG-CB 4.34Å; R151-E179 IonicContact CZ-OE2 2.86Å; R151-E179 IonicContact NE-OE2 3.78Å; R151-E179 IonicContact NH1-OE2 3.6Å; R151-E179 PolarHBondContact NH1-OE2 3.48Å; N175-E179 WeakPolarHBondContact O-CG 3.39Å; N175-E179 PolarHBondContact O-N 2.75Å; L177-E179 VanDerWaalsContact C-N 3.27Å; L177-E179 PolarHBondContact O-N 3.22Å; E179-Q317 PolarHBondContact O-NE2 2.94Å
180	R	96.5	Very high	97	Very high	28 Å²	28	33.7 Å²	33.7	11%	0.106	18%	0.176	C	C	.	.	S	Bend	trans	-72.1	148.6	-173.3	-60.5	171.2	54	102.2	2.3	111.3	V150 R151 E153 G176 L177 M178 D182 W183 Q317	V150-R180 PolarHBondContact O-NH1 2.63Å; V150-R180 VanDerWaalsContact O-NH1 3.13Å; R151-R180 HydrophobicContact CB-CG 4.47Å; R151-R180 HydrophobicContact CG-CG 4.01Å; R151-R180 PolarHBondContact O-NH1 3.09Å; E153-R180 PolarHBondContact O-NH1 2.98Å; G176-R180 WeakPolarHBondContact O-CG 3.38Å; L177-R180 WeakPolarHBondContact O-CB 3.35Å; L177-R180 PolarHBondContact O-N 3.01Å; M178-R180 VanDerWaalsContact C-N 3.33Å; R180-D182 WeakPolarHBondContact CB-OD1 3.47Å; R180-D182 IonicContact CZ-OD1 2.63Å; R180-D182 IonicContact CZ-OD2 3.68Å; R180-D182 IonicContact NE-OD1 2.95Å; R180-D182 PolarHBondContact NE-OD1 2.82Å; R180-D182 IonicContact NE-OD2 3.94Å; R180-D182 IonicContact NH2-OD1 3.09Å; R180-D182 PolarHBondContact NH2-OD1 2.89Å; R180-D182 IonicContact NH2-OD2 3.98Å; R180-D182 PolarHBondContact NH2-OD2 2.8Å; R180-D182 PolarHBondContact O-N 3.26Å; R180-W183 WeakPolarHBondContact O-CB 3.11Å; R180-W183 PolarHBondContact O-N 2.89Å; R180-Q317 PolarHBondContact O-NE2 3.24Å
181	P	95.6	Very high	97	Very high	128 Å²	128	33.7 Å²	33.7	83%	0.831	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-32.3	173	-24.7	34.4	0	0	0	113.3	W183	P181-W183 VanDerWaalsContact C-N 3.34Å
182	D	96.4	Very high	97.1	Very high	65 Å²	65	33 Å²	33	35%	0.348	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	24.7	177.5	64.4	-22.9	0	0	0	113.2	R180 E184 T185 A186	R180-D182 WeakPolarHBondContact CB-OD1 3.47Å; R180-D182 IonicContact CZ-OD1 2.63Å; R180-D182 IonicContact CZ-OD2 3.68Å; R180-D182 IonicContact NE-OD1 2.95Å; R180-D182 PolarHBondContact NE-OD1 2.82Å; R180-D182 IonicContact NE-OD2 3.94Å; R180-D182 IonicContact NH2-OD1 3.09Å; R180-D182 PolarHBondContact NH2-OD1 2.89Å; R180-D182 IonicContact NH2-OD2 3.98Å; R180-D182 PolarHBondContact NH2-OD2 2.8Å; R180-D182 PolarHBondContact O-N 3.26Å; D182-E184 PolarHBondContact O-N 2.79Å; D182-T185 PolarHBondContact O-N 3.13Å; D182-T185 PolarHBondContact O-OG1 3.05Å; D182-A186 PolarHBondContact O-N 3Å
183	W	95.9	Very high	97.1	Very high	19 Å²	19	32.5 Å²	32.5	7%	0.072	17%	0.172	C	C	.	.	H	α-helix	trans	-49.2	-38.1	-173	66.3	-86	0	0	0	113.8	M178 R180 P181 T185 A186 I187 G318 P319 Y444	M178-W183 HydrophobicContact CE-CD2 4.33Å; M178-W183 HydrophobicContact CE-CE3 3.69Å; M178-W183 HydrophobicContact CE-CZ3 4.18Å; M178-W183 HydrophobicContact SD-CE3 4.07Å; R180-W183 WeakPolarHBondContact O-CB 3.11Å; R180-W183 PolarHBondContact O-N 2.89Å; P181-W183 VanDerWaalsContact C-N 3.34Å; W183-T185 PolarHBondContact O-N 3.29Å; W183-A186 PolarHBondContact O-N 3.4Å; W183-I187 WeakPolarHBondContact O-CB 3.34Å; W183-I187 WeakPolarHBondContact O-CG2 3.32Å; W183-I187 PolarHBondContact O-N 2.94Å; W183-G318 VanDerWaalsContact CZ2-C 3.43Å; W183-P319 HydrophobicContact CH2-CB 4.41Å; W183-Y444 HydrophobicContact CE3-CE1 4.49Å; W183-Y444 WeakPolarHBondContact CH2-OH 3.45Å; W183-Y444 AromaticContact CZ3-CE1 3.97Å; W183-Y444 HydrophobicContact CZ3-CE1 3.97Å; W183-Y444 AromaticContact CZ3-CZ 3.78Å; W183-Y444 WeakPolarHBondContact CZ3-OH 3.42Å
184	E	94.3	Very high	97.1	Very high	107 Å²	107	32.5 Å²	32.5	50%	0.5	17%	0.172	S	C	.	.	H	α-helix	trans	-56.8	-34.8	180	-73.6	-177.7	177.1	0	0	113	D182 Q188	D182-E184 PolarHBondContact O-N 2.79Å; E184-Q188 WeakPolarHBondContact O-CG 3.45Å; E184-Q188 PolarHBondContact O-NE2 3.48Å
185	T	95.8	Very high	97	Very high	93 Å²	93	32.9 Å²	32.9	57%	0.571	18%	0.175	S	C	*	.	H	α-helix	trans	-94.9	-33.9	177.4	64.5	0	0	0	0	111.6	D182 W183 Q188	D182-T185 PolarHBondContact O-N 3.13Å; D182-T185 PolarHBondContact O-OG1 3.05Å; W183-T185 PolarHBondContact O-N 3.29Å; T185-Q188 WeakPolarHBondContact O-CB 3.23Å; T185-Q188 PolarHBondContact O-N 3.29Å
186	A	97.3	Very high	96.7	Very high	2 Å²	2	33 Å²	33	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-43.6	-179.5	0	0	0	0	0	111.9	L155 L177 D182 W183 Q188 K189	L155-A186 HydrophobicContact CD1-CB 3.52Å; L177-A186 HydrophobicContact CD2-CB 4.03Å; D182-A186 PolarHBondContact O-N 3Å; W183-A186 PolarHBondContact O-N 3.4Å; A186-Q188 PolarHBondContact O-N 3.34Å; A186-K189 WeakPolarHBondContact O-CB 3.43Å; A186-K189 PolarHBondContact O-N 3.04Å
187	I	97.4	Very high	95.8	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.015	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.7	-179.9	-164	56.4	0	0	0	113.2	V174 L177 M178 W183 K189 Y444 F445	V174-I187 HydrophobicContact CG1-CD1 4.05Å; L177-I187 HydrophobicContact CB-CD1 4.25Å; L177-I187 HydrophobicContact CD1-CD1 4.26Å; M178-I187 HydrophobicContact CG-CD1 4.1Å; M178-I187 HydrophobicContact SD-CB 3.83Å; M178-I187 HydrophobicContact SD-CD1 3.78Å; M178-I187 HydrophobicContact SD-CG1 3.59Å; M178-I187 VanDerWaalsContact SD-CG1 3.59Å; M178-I187 HydrophobicContact SD-CG2 4.39Å; W183-I187 WeakPolarHBondContact O-CB 3.34Å; W183-I187 WeakPolarHBondContact O-CG2 3.32Å; W183-I187 PolarHBondContact O-N 2.94Å; I187-K189 PolarHBondContact O-N 3.09Å; I187-Y444 HydrophobicContact CG1-CD1 4.01Å; I187-Y444 HydrophobicContact CG1-CE1 4.4Å; I187-Y444 HydrophobicContact CG2-CD1 4.35Å; I187-Y444 HydrophobicContact CG2-CE1 4.23Å; I187-F445 HydrophobicContact CD1-CB 4.01Å; I187-F445 HydrophobicContact CG1-CB 3.96Å; I187-F445 WeakPolarHBondContact O-CB 3.44Å
188	Q	96.4	Very high	94.6	Very high	106 Å²	106	34.7 Å²	34.7	50%	0.495	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-8.3	175.2	-61.1	-176.2	37.8	0	0	113	E184 T185 A186 P190	E184-Q188 WeakPolarHBondContact O-CG 3.45Å; E184-Q188 PolarHBondContact O-NE2 3.48Å; T185-Q188 WeakPolarHBondContact O-CB 3.23Å; T185-Q188 PolarHBondContact O-N 3.29Å; A186-Q188 PolarHBondContact O-N 3.34Å; Q188-P190 VanDerWaalsContact O-CD 3.27Å; Q188-P190 WeakPolarHBondContact O-CD 3.27Å
189	K	97.8	Very high	93.8	Very high	39 Å²	39	35 Å²	35	17%	0.17	20%	0.195	C	C	.	.	S	Bend	trans	-61.1	121.3	173.9	-175.8	58.3	53.4	-174.7	0	109.3	L155 W158 L161 A186 I187 L191	L155-K189 WeakPolarHBondContact O-CE 3.37Å; L155-K189 PolarHBondContact O-NZ 2.97Å; W158-K189 WeakPolarHBondContact O-CE 3.34Å; W158-K189 PolarHBondContact O-NZ 3.21Å; L161-K189 HydrophobicContact CD1-CG 4.27Å; L161-K189 HydrophobicContact CD2-CG 4.45Å; L161-K189 HydrophobicContact CG-CG 3.84Å; A186-K189 WeakPolarHBondContact O-CB 3.43Å; A186-K189 PolarHBondContact O-N 3.04Å; I187-K189 PolarHBondContact O-N 3.09Å; K189-L191 PolarHBondContact O-N 3.17Å
190	P	98	Very high	93.5	Very high	17 Å²	17	32.7 Å²	32.7	11%	0.11	19%	0.185	C	C	.	.			trans	-58.1	136	178.7	-28.7	37.4	0	0	0	112.7	L97 D159 A160 L161 Q188 L233 W446	L97-P190 HydrophobicContact CD2-CB 3.88Å; L97-P190 HydrophobicContact CD2-CG 3.88Å; D159-P190 WeakPolarHBondContact O-CD 3.39Å; A160-P190 CarbonylContact C-O 3.5Å; A160-P190 WeakPolarHBondContact CA-O 3.49Å; A160-P190 HydrophobicContact CB-CB 4.09Å; A160-P190 WeakPolarHBondContact CB-O 3.31Å; L161-P190 PolarHBondContact N-O 3.04Å; Q188-P190 VanDerWaalsContact O-CD 3.27Å; Q188-P190 WeakPolarHBondContact O-CD 3.27Å; P190-L233 HydrophobicContact CB-CD1 3.99Å; P190-L233 HydrophobicContact CB-CD2 3.85Å; P190-L233 HydrophobicContact CG-CD1 3.64Å; P190-L233 HydrophobicContact CG-CD2 4.43Å; P190-W446 HydrophobicContact CB-CB 4.38Å; P190-W446 HydrophobicContact CG-CB 4.38Å
191	L	98.5	Very high	93.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.9	179.3	-54.5	-178	0	0	0	110.6	L161 M170 V173 V174 L177 K189 F445 W446 M447 V448	L161-L191 HydrophobicContact CB-CD2 3.79Å; L161-L191 HydrophobicContact CD1-CD2 4.01Å; L161-L191 HydrophobicContact CG-CD2 4.17Å; L161-L191 CarbonylContact O-C 3.29Å; L161-L191 WeakPolarHBondContact O-CA 3.43Å; M170-L191 HydrophobicContact CE-CB 4.3Å; M170-L191 HydrophobicContact SD-CB 4.2Å; M170-L191 HydrophobicContact SD-CD1 3.81Å; V173-L191 HydrophobicContact CG1-CD2 4.18Å; V174-L191 HydrophobicContact CG2-CD1 3.53Å; L177-L191 HydrophobicContact CD1-CD1 4.4Å; L177-L191 HydrophobicContact CD1-CD2 4.14Å; K189-L191 PolarHBondContact O-N 3.17Å; L191-F445 HydrophobicContact CD1-CD2 3.92Å; L191-F445 HydrophobicContact CD1-CE2 4.32Å; L191-W446 PolarHBondContact N-O 3.4Å; L191-M447 CarbonylContact O-C 3.56Å; L191-M447 VanDerWaalsContact O-CA 3.24Å; L191-M447 WeakPolarHBondContact O-CA 3.25Å; L191-V448 PolarHBondContact O-N 3.24Å
192	C	98.3	Very high	93.5	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.02	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	134.1	173.1	179.7	0	0	0	0	109.2	L161 V162 V163 L228 V448	L161-C192 PolarHBondContact O-N 2.93Å; V162-C192 HydrophobicContact CB-CB 4.38Å; V162-C192 HydrophobicContact CG1-CB 4.35Å; V162-C192 HydrophobicContact CG2-CB 3.98Å; V163-C192 PolarHBondContact N-O 3.26Å; C192-L228 HydrophobicContact CB-CD1 4.33Å; C192-V448 HydrophobicContact CB-CB 3.94Å; C192-V448 HydrophobicContact CB-CG2 3.86Å
193	S	98	Very high	93.6	Very high	6 Å²	6	22.2 Å²	22.2	4%	0.042	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.4	175.2	-172	0	0	0	0	109.6
194	L	98.1	Very high	93.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.3	171.5	-63.5	-174.7	0	0	0	109.1	V124 V162 V163 M164 S165 A196 L221 C224	V124-L194 HydrophobicContact CG1-CD1 3.73Å; V124-L194 HydrophobicContact CG2-CD1 4.18Å; V162-L194 HydrophobicContact CG1-CD1 3.49Å; V162-L194 VanDerWaalsContact CG1-CD1 3.49Å; V162-L194 HydrophobicContact CG1-CG 3.76Å; V163-L194 PolarHBondContact O-N 3.47Å; M164-L194 VanDerWaalsContact CA-O 3.3Å; M164-L194 WeakPolarHBondContact CA-O 3.49Å; M164-L194 HydrophobicContact CB-CB 4.12Å; M164-L194 HydrophobicContact CG-CB 4.02Å; S165-L194 PolarHBondContact N-O 2.89Å; L194-A196 PolarHBondContact O-N 2.92Å; L194-L221 HydrophobicContact CB-CD1 3.93Å; L194-C224 HydrophobicContact CD2-CB 3.87Å
195	P	96.3	Very high	93.8	Very high	8 Å²	8	16.3 Å²	16.3	5%	0.052	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	117.3	-173.8	31.2	-37.3	0	0	0	110.8	N200 A203 L220 L221	P195-N200 WeakPolarHBondContact CA-OD1 3.32Å; P195-N200 HydrophobicContact CB-CB 3.8Å; P195-N200 WeakPolarHBondContact CB-OD1 3.38Å; P195-A203 HydrophobicContact CB-CB 4.01Å; P195-A203 HydrophobicContact CG-CB 4.19Å; P195-L220 HydrophobicContact CB-CD2 4.12Å; P195-L220 HydrophobicContact CG-CB 4.24Å; P195-L220 HydrophobicContact CG-CD2 4.05Å; P195-L220 HydrophobicContact CG-CG 3.9Å; P195-L221 HydrophobicContact CG-CB 4.04Å; P195-L221 HydrophobicContact CG-CD1 4.36Å
196	A	91	Very high	93.9	Very high	5 Å²	5	12 Å²	12	4%	0.041	7%	0.071	C	C	.	.			trans	-139.2	18.2	167.6	0	0	0	0	0	110.5	G111 G112 A116 M164 S165 L194	G111-A196 CarbonylContact C-O 3.58Å; G111-A196 VanDerWaalsContact CA-O 3.26Å; G111-A196 WeakPolarHBondContact CA-O 3.45Å; G112-A196 VanDerWaalsContact CA-O 3.3Å; G112-A196 WeakPolarHBondContact CA-O 3.4Å; G112-A196 PolarHBondContact N-O 2.86Å; A116-A196 HydrophobicContact CB-CB 3.87Å; M164-A196 HydrophobicContact CE-CB 3.81Å; M164-A196 HydrophobicContact CG-CB 3.66Å; S165-A196 CarbonylContact O-C 3.38Å; S165-A196 PolarHBondContact O-N 3.28Å; L194-A196 PolarHBondContact O-N 2.92Å
197	G	78.3	Confident	93.9	Very high	19 Å²	19	12.1 Å²	12.1	20%	0.196	7%	0.071	C	C	.	.	S	Bend	trans	-106.9	-174.5	178.3	0	0	0	0	0	112.7	S165 N200	S165-G197 PolarHBondContact O-N 3.21Å; G197-N200 PolarHBondContact N-OD1 3.22Å; G197-N200 PolarHBondContact O-ND2 2.9Å
198	S	73.8	Confident	93.9	Very high	17 Å²	17	15.1 Å²	15.1	12%	0.119	9%	0.085	C	C	.	.	S	Bend	trans	-98.1	-3.1	168	54.5	0	0	0	0	113	E275 F278	S198-E275 WeakPolarHBondContact O-CG 3.33Å; S198-F278 WeakPolarHBondContact O-CE2 3.28Å
199	G	79.2	Confident	93.8	Very high	12 Å²	12	10.5 Å²	10.5	12%	0.124	6%	0.063	C	C	.	.			trans	-132.1	108	172.4	0	0	0	0	0	106.4	G166 D167	G166-G199 CarbonylContact C-O 3.57Å; G166-G199 WeakPolarHBondContact CA-O 3.11Å; D167-G199 PolarHBondContact N-O 2.85Å; D167-G199 VanDerWaalsContact OD2-O 3.07Å
200	N	90.1	Very high	93.7	Very high	9 Å²	9	9.1 Å²	9.1	5%	0.048	6%	0.059	C	C	.	.			trans	-130.3	35.7	-171.7	-56.9	-60.5	0	0	0	110.4	S165 D167 P195 G197 L202 A203 A204 L220 E275	S165-N200 PolarHBondContact O-OD1 2.65Å; D167-N200 PolarHBondContact OD2-N 3.3Å; P195-N200 WeakPolarHBondContact CA-OD1 3.32Å; P195-N200 HydrophobicContact CB-CB 3.8Å; P195-N200 WeakPolarHBondContact CB-OD1 3.38Å; G197-N200 PolarHBondContact N-OD1 3.22Å; G197-N200 PolarHBondContact O-ND2 2.9Å; N200-L202 VanDerWaalsContact C-N 3.29Å; N200-L202 PolarHBondContact O-N 2.83Å; N200-A203 HydrophobicContact CB-CB 4.36Å; N200-A203 PolarHBondContact O-N 3.03Å; N200-A204 WeakPolarHBondContact O-CB 3.5Å; N200-A204 PolarHBondContact O-N 2.89Å; N200-L220 HydrophobicContact CB-CD2 4.35Å; N200-E275 PolarHBondContact ND2-OE1 2.85Å
201	A	95.9	Very high	93.6	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-62.5	-36.7	-172.8	0	0	0	0	0	112.3	D167 S205 L253	D167-A201 PolarHBondContact OD1-N 2.97Å; D167-A201 VanDerWaalsContact OD1-N 3.16Å; D167-A201 WeakPolarHBondContact OD2-CB 3.3Å; D167-A201 PolarHBondContact OD2-N 2.82Å; A201-S205 WeakPolarHBondContact O-CB 3.43Å; A201-S205 PolarHBondContact O-N 3.25Å; A201-S205 PolarHBondContact O-OG 2.89Å; A201-L253 HydrophobicContact CB-CD1 3.9Å; A201-L253 HydrophobicContact CB-CD2 3.55Å; A201-L253 HydrophobicContact CB-CG 4.34Å
202	L	96.9	Very high	93.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.4	-49.3	175	-176.9	59.7	0	0	0	110.9	D167 M170 N200 A204 S205 L206 H351 M447	D167-L202 VanDerWaalsContact OD1-CB 3.29Å; D167-L202 WeakPolarHBondContact OD1-CB 3.49Å; D167-L202 PolarHBondContact OD1-N 2.9Å; M170-L202 HydrophobicContact CB-CD2 4.27Å; M170-L202 HydrophobicContact CE-CD2 4.41Å; M170-L202 HydrophobicContact CG-CD2 3.71Å; N200-L202 VanDerWaalsContact C-N 3.29Å; N200-L202 PolarHBondContact O-N 2.83Å; L202-A204 VanDerWaalsContact C-N 3.35Å; L202-A204 PolarHBondContact O-N 2.78Å; L202-S205 WeakPolarHBondContact O-CB 3.27Å; L202-S205 PolarHBondContact O-N 2.81Å; L202-L206 WeakPolarHBondContact O-CG 3.49Å; L202-L206 PolarHBondContact O-N 2.99Å; L202-H351 VanDerWaalsContact CD1-CD2 3.45Å; L202-H351 WeakPolarHBondContact CD1-CD2 3.29Å; L202-H351 VanDerWaalsContact CD1-NE2 3.28Å; L202-H351 WeakPolarHBondContact CD1-NE2 3.41Å; L202-M447 HydrophobicContact CD1-CE 4.41Å; L202-M447 HydrophobicContact CD1-SD 3.88Å; L202-M447 HydrophobicContact CD2-CE 3.68Å; L202-M447 HydrophobicContact CD2-SD 3.97Å; L202-M447 HydrophobicContact CG-CE 4.04Å; L202-M447 HydrophobicContact CG-SD 4.17Å
203	A	97.5	Very high	93.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61	-42.5	178	0	0	0	0	0	112.2	P195 N200 S205 L206 N207 L220	P195-A203 HydrophobicContact CB-CB 4.01Å; P195-A203 HydrophobicContact CG-CB 4.19Å; N200-A203 HydrophobicContact CB-CB 4.36Å; N200-A203 PolarHBondContact O-N 3.03Å; A203-S205 VanDerWaalsContact C-N 3.33Å; A203-S205 PolarHBondContact O-N 3.04Å; A203-L206 PolarHBondContact O-N 2.98Å; A203-N207 WeakPolarHBondContact O-CB 3.31Å; A203-N207 PolarHBondContact O-N 3.01Å; A203-L220 HydrophobicContact CB-CD2 4.46Å
204	A	97.6	Very high	93.3	Very high	3 Å²	3	24.3 Å²	24.3	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-42.5	175.1	0	0	0	0	0	112.3	N200 L202 N207 H208 L220 H353	N200-A204 WeakPolarHBondContact O-CB 3.5Å; N200-A204 PolarHBondContact O-N 2.89Å; L202-A204 VanDerWaalsContact C-N 3.35Å; L202-A204 PolarHBondContact O-N 2.78Å; A204-N207 PolarHBondContact O-N 3.41Å; A204-H208 WeakPolarHBondContact O-CB 3.45Å; A204-H208 PolarHBondContact O-N 3.34Å; A204-L220 HydrophobicContact CB-CD2 4.45Å; A204-H353 HydrophobicContact CB-CB 4.03Å
205	S	97.8	Very high	93.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-44.2	176.4	-63.3	0	0	0	0	112.3	A201 L202 A203 N207 H208 Y209 H351 S352 H353	A201-S205 WeakPolarHBondContact O-CB 3.43Å; A201-S205 PolarHBondContact O-N 3.25Å; A201-S205 PolarHBondContact O-OG 2.89Å; L202-S205 WeakPolarHBondContact O-CB 3.27Å; L202-S205 PolarHBondContact O-N 2.81Å; A203-S205 VanDerWaalsContact C-N 3.33Å; A203-S205 PolarHBondContact O-N 3.04Å; S205-N207 VanDerWaalsContact C-N 3.34Å; S205-N207 PolarHBondContact O-N 3.41Å; S205-H208 PolarHBondContact O-N 3.06Å; S205-Y209 WeakPolarHBondContact O-CD2 3.29Å; S205-Y209 PolarHBondContact O-N 3.1Å; S205-H351 WeakPolarHBondContact OG-CB 3.28Å; S205-S352 WeakPolarHBondContact CA-OG 3.23Å; S205-S352 VanDerWaalsContact CB-OG 3.24Å; S205-S352 WeakPolarHBondContact CB-OG 3.44Å; S205-S352 PolarHBondContact OG-N 3.46Å; S205-S352 PolarHBondContact OG-OG 3.47Å; S205-S352 VanDerWaalsContact OG-OG 3.06Å; S205-H353 WeakPolarHBondContact OG-CB 3.48Å; S205-H353 PolarHBondContact OG-N 3.03Å
206	L	97.1	Very high	93.1	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-39	177	-62.5	176	0	0	0	112.4	L202 A203 Y209 A210 M236 M447	L202-L206 WeakPolarHBondContact O-CG 3.49Å; L202-L206 PolarHBondContact O-N 2.99Å; A203-L206 PolarHBondContact O-N 2.98Å; L206-Y209 HydrophobicContact CD2-CD2 4.36Å; L206-Y209 PolarHBondContact O-N 3.37Å; L206-A210 PolarHBondContact O-N 3.12Å; L206-A210 VanDerWaalsContact O-N 3.14Å; L206-M236 HydrophobicContact CD2-CE 3.52Å; L206-M447 HydrophobicContact CD1-CE 3.58Å; L206-M447 HydrophobicContact CD1-SD 4.09Å; L206-M447 HydrophobicContact CD2-SD 4.36Å
207	N	97.4	Very high	93.1	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-46.4	173.3	174.9	86.6	0	0	0	111.1	A203 A204 S205 A210 Y212 E213 L220 N223	A203-N207 WeakPolarHBondContact O-CB 3.31Å; A203-N207 PolarHBondContact O-N 3.01Å; A204-N207 PolarHBondContact O-N 3.41Å; S205-N207 VanDerWaalsContact C-N 3.34Å; S205-N207 PolarHBondContact O-N 3.41Å; N207-A210 PolarHBondContact O-N 2.87Å; N207-Y212 WeakPolarHBondContact O-CB 3.2Å; N207-Y212 PolarHBondContact O-N 3.13Å; N207-Y212 WeakPolarHBondContact OD1-CB 3.41Å; N207-E213 PolarHBondContact ND2-O 3.48Å; N207-L220 HydrophobicContact CB-CD1 3.53Å; N207-N223 WeakPolarHBondContact OD1-CB 3.43Å; N207-N223 PolarHBondContact OD1-ND2 3.02Å
208	H	97.1	Very high	93.9	Very high	66 Å²	66	34.7 Å²	34.7	31%	0.306	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-44.4	177.1	177	69.6	0	0	0	112.7	A204 S205 A210 G211 H353 F359	A204-H208 WeakPolarHBondContact O-CB 3.45Å; A204-H208 PolarHBondContact O-N 3.34Å; S205-H208 PolarHBondContact O-N 3.06Å; H208-A210 PolarHBondContact O-N 2.84Å; H208-G211 PolarHBondContact O-N 3.37Å; H208-H353 AromaticContact CG-CE1 3.66Å; H208-F359 AromaticContact CE1-CE1 3.97Å; H208-F359 AromaticContact CE1-CZ 3.66Å; H208-F359 AromaticContact NE2-CE2 3.89Å; H208-F359 AromaticContact NE2-CZ 3.43Å; H208-F359 WeakPolarHBondContact NE2-CZ 3.36Å
209	Y	95.6	Very high	94.9	Very high	9 Å²	9	38.8 Å²	38.8	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-25.1	177.1	-58.5	-29.4	0	0	0	113.2	S205 L206 G211 H351 S352 R365 V452	S205-Y209 WeakPolarHBondContact O-CD2 3.29Å; S205-Y209 PolarHBondContact O-N 3.1Å; L206-Y209 HydrophobicContact CD2-CD2 4.36Å; L206-Y209 PolarHBondContact O-N 3.37Å; Y209-G211 PolarHBondContact O-N 3.47Å; Y209-H351 AromaticContact CE2-ND1 3.85Å; Y209-H351 WeakPolarHBondContact OH-CA 3.25Å; Y209-S352 WeakPolarHBondContact CE1-OG 3.22Å; Y209-S352 PolarHBondContact OH-N 2.9Å; Y209-R365 HydrophobicContact CD1-CB 4.29Å; Y209-R365 HydrophobicContact CD1-CG 4.43Å; Y209-R365 HydrophobicContact CE1-CB 3.88Å; Y209-R365 HydrophobicContact CE1-CG 4Å; Y209-R365 HydrophobicContact CE2-CG 4.3Å; Y209-V452 PolarHBondContact O-N 3.34Å
210	A	95.4	Very high	95.8	Very high	11 Å²	11	38.3 Å²	38.3	9%	0.091	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	4.9	173.2	0	0	0	0	0	114.8	L206 N207 H208 Y212 L227 D450	L206-A210 PolarHBondContact O-N 3.12Å; L206-A210 VanDerWaalsContact O-N 3.14Å; N207-A210 PolarHBondContact O-N 2.87Å; H208-A210 PolarHBondContact O-N 2.84Å; A210-Y212 HydrophobicContact CB-CD2 3.79Å; A210-Y212 HydrophobicContact CB-CE2 4.03Å; A210-Y212 PolarHBondContact O-N 3.13Å; A210-L227 HydrophobicContact CB-CD1 4.21Å; A210-L227 HydrophobicContact CB-CD2 3.64Å; A210-D450 WeakPolarHBondContact CA-O 3.31Å; A210-D450 HydrophobicContact CB-CB 4.19Å; A210-D450 WeakPolarHBondContact CB-O 3.49Å
211	G	95.4	Very high	96.2	Very high	65 Å²	65	37.9 Å²	37.9	67%	0.67	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	15.4	178.5	0	0	0	0	0	113.9	H208 Y209	H208-G211 PolarHBondContact O-N 3.37Å; Y209-G211 PolarHBondContact O-N 3.47Å
212	Y	95.9	Very high	96.3	Very high	48 Å²	48	39.2 Å²	39.2	19%	0.188	21%	0.214	C	C	.	.			trans	-77.7	152.6	171.5	-71.7	-67.8	0	0	0	111.3	N207 A210 N223 L227 R230	N207-Y212 WeakPolarHBondContact O-CB 3.2Å; N207-Y212 PolarHBondContact O-N 3.13Å; N207-Y212 WeakPolarHBondContact OD1-CB 3.41Å; A210-Y212 HydrophobicContact CB-CD2 3.79Å; A210-Y212 HydrophobicContact CB-CE2 4.03Å; A210-Y212 PolarHBondContact O-N 3.13Å; Y212-N223 HydrophobicContact CD2-CB 4.26Å; Y212-N223 HydrophobicContact CE2-CB 4.42Å; Y212-N223 HydrophobicContact CG-CB 4.48Å; Y212-L227 HydrophobicContact CE2-CD2 3.99Å; Y212-L227 HydrophobicContact CE2-CG 4.45Å; Y212-R230 PolarHBondContact OH-NH2 2.8Å
213	E	96.1	Very high	96.3	Very high	159 Å²	159	40.1 Å²	40.1	74%	0.743	22%	0.219	S	C	*	.			trans	-58.4	152.8	168.8	-68.6	-64.6	156.3	0	0	111.4	N207 V215	N207-E213 PolarHBondContact ND2-O 3.48Å; E213-V215 HydrophobicContact CB-CG1 4.39Å; E213-V215 PolarHBondContact O-N 3.22Å; E213-V215 VanDerWaalsContact O-N 3.08Å
214	Q	96.1	Very high	96.3	Very high	73 Å²	73	40.2 Å²	40.2	34%	0.341	22%	0.219	S	C	.	.			trans	-69.8	105.5	174.4	-170.7	177.8	-67.1	0	0	109.4	H353 S356 E393	Q214-H353 PolarHBondContact OE1-NE2 2.96Å; Q214-S356 WeakPolarHBondContact CG-O 3.28Å; Q214-E393 PolarHBondContact NE2-O 3.48Å; Q214-E393 PolarHBondContact OE1-O 3.47Å
215	V	95.9	Very high	96.4	Very high	31 Å²	31	40.1 Å²	40.1	19%	0.188	22%	0.218	C	C	.	.			trans	-123.4	163.1	-177.8	-64.9	0	0	0	0	111.2	E213 D219 L220	E213-V215 HydrophobicContact CB-CG1 4.39Å; E213-V215 PolarHBondContact O-N 3.22Å; E213-V215 VanDerWaalsContact O-N 3.08Å; V215-D219 HydrophobicContact CB-CB 3.86Å; V215-D219 HydrophobicContact CG1-CB 4.33Å; V215-D219 HydrophobicContact CG2-CB 4.08Å; V215-L220 HydrophobicContact CG2-CB 4.06Å; V215-L220 HydrophobicContact CG2-CD1 4.07Å
216	T	94.1	Very high	96.4	Very high	30 Å²	30	45.9 Å²	45.9	18%	0.184	24%	0.24	C	C	.	.			trans	-127.5	171.7	-177.4	64.4	0	0	0	0	111.1	E218 D219 L220 E357	T216-E218 PolarHBondContact O-N 3.14Å; T216-D219 PolarHBondContact O-N 2.82Å; T216-L220 PolarHBondContact O-N 3.11Å; T216-E357 HydrophobicContact CG2-CG 3.49Å; T216-E357 VanDerWaalsContact CG2-CG 3.49Å
217	N	92	Very high	96.4	Very high	100 Å²	100	45.9 Å²	45.9	54%	0.535	24%	0.24	S	C	.	.	H	α-helix	trans	50.7	-130.9	172.3	-51.2	-68.1	0	0	0	114.2	D219 L220 L221	N217-D219 VanDerWaalsContact C-N 3.28Å; N217-D219 PolarHBondContact O-N 2.66Å; N217-L220 PolarHBondContact O-N 3.47Å; N217-L221 PolarHBondContact O-N 2.98Å
218	E	94.5	Very high	96.4	Very high	88 Å²	88	45.8 Å²	45.8	41%	0.411	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-31.9	-175.4	-66	83	178.8	0	0	113.3	L119 T216 L221 T222	L119-E218 HydrophobicContact CD2-CG 3.94Å; T216-E218 PolarHBondContact O-N 3.14Å; E218-L221 PolarHBondContact O-N 3.48Å; E218-T222 WeakPolarHBondContact O-CB 3.36Å; E218-T222 PolarHBondContact O-N 3.02Å; E218-T222 PolarHBondContact O-OG1 3.36Å
219	D	96.5	Very high	96.3	Very high	104 Å²	104	44 Å²	44	56%	0.556	23%	0.234	S	C	*	.	H	α-helix	trans	-68	-43.7	177.4	-69.8	-27	0	0	0	110.7	V215 T216 N217 L221 T222 N223	V215-D219 HydrophobicContact CB-CB 3.86Å; V215-D219 HydrophobicContact CG1-CB 4.33Å; V215-D219 HydrophobicContact CG2-CB 4.08Å; T216-D219 PolarHBondContact O-N 2.82Å; N217-D219 VanDerWaalsContact C-N 3.28Å; N217-D219 PolarHBondContact O-N 2.66Å; D219-L221 VanDerWaalsContact C-N 3.35Å; D219-T222 PolarHBondContact O-N 2.91Å; D219-N223 PolarHBondContact O-N 3.01Å
220	L	97.2	Very high	96.3	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-42.5	174.8	-171.1	66.2	0	0	0	111	P195 N200 A203 A204 N207 V215 T216 N217 T222 N223 C224	P195-L220 HydrophobicContact CB-CD2 4.12Å; P195-L220 HydrophobicContact CG-CB 4.24Å; P195-L220 HydrophobicContact CG-CD2 4.05Å; P195-L220 HydrophobicContact CG-CG 3.9Å; N200-L220 HydrophobicContact CB-CD2 4.35Å; A203-L220 HydrophobicContact CB-CD2 4.46Å; A204-L220 HydrophobicContact CB-CD2 4.45Å; N207-L220 HydrophobicContact CB-CD1 3.53Å; V215-L220 HydrophobicContact CG2-CB 4.06Å; V215-L220 HydrophobicContact CG2-CD1 4.07Å; T216-L220 PolarHBondContact O-N 3.11Å; N217-L220 PolarHBondContact O-N 3.47Å; L220-T222 VanDerWaalsContact C-N 3.31Å; L220-T222 PolarHBondContact O-N 3.43Å; L220-N223 PolarHBondContact O-N 3.45Å; L220-C224 WeakPolarHBondContact O-CB 3.46Å; L220-C224 PolarHBondContact O-N 3.31Å; L220-C224 PolarHBondContact O-SG 3.38Å
221	L	97.7	Very high	96.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-43.6	174.9	177.5	59.6	0	0	0	111.7	L119 H123 V124 M164 L194 P195 N217 E218 D219 T225	L119-L221 HydrophobicContact CB-CD2 3.94Å; H123-L221 HydrophobicContact CB-CD2 4.05Å; V124-L221 HydrophobicContact CG2-CD1 3.8Å; V124-L221 HydrophobicContact CG2-CD2 4.19Å; V124-L221 HydrophobicContact CG2-CG 4.14Å; M164-L221 HydrophobicContact CE-CD1 3.97Å; M164-L221 HydrophobicContact CE-CD2 3.85Å; L194-L221 HydrophobicContact CB-CD1 3.93Å; P195-L221 HydrophobicContact CG-CB 4.04Å; P195-L221 HydrophobicContact CG-CD1 4.36Å; N217-L221 PolarHBondContact O-N 2.98Å; E218-L221 PolarHBondContact O-N 3.48Å; D219-L221 VanDerWaalsContact C-N 3.35Å; L221-T225 WeakPolarHBondContact O-CB 3.4Å; L221-T225 PolarHBondContact O-N 3.34Å; L221-T225 PolarHBondContact O-OG1 2.98Å
222	T	97.8	Very high	96.3	Very high	28 Å²	28	49.5 Å²	49.5	17%	0.172	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-44.7	179.1	-60.1	0	0	0	0	111	E218 D219 L220 T225 R226	E218-T222 WeakPolarHBondContact O-CB 3.36Å; E218-T222 PolarHBondContact O-N 3.02Å; E218-T222 PolarHBondContact O-OG1 3.36Å; D219-T222 PolarHBondContact O-N 2.91Å; L220-T222 VanDerWaalsContact C-N 3.31Å; L220-T222 PolarHBondContact O-N 3.43Å; T222-T225 PolarHBondContact O-N 3.49Å; T222-R226 VanDerWaalsContact O-CG 3.31Å; T222-R226 WeakPolarHBondContact O-CG 3.47Å; T222-R226 PolarHBondContact O-N 3.46Å
223	N	97.9	Very high	96.3	Very high	19 Å²	19	48 Å²	48	10%	0.102	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-49	176.9	-73.9	-6	0	0	0	111.8	N207 Y212 D219 L220 T225 R226 L227	N207-N223 WeakPolarHBondContact OD1-CB 3.43Å; N207-N223 PolarHBondContact OD1-ND2 3.02Å; Y212-N223 HydrophobicContact CD2-CB 4.26Å; Y212-N223 HydrophobicContact CE2-CB 4.42Å; Y212-N223 HydrophobicContact CG-CB 4.48Å; D219-N223 PolarHBondContact O-N 3.01Å; L220-N223 PolarHBondContact O-N 3.45Å; N223-T225 VanDerWaalsContact C-N 3.28Å; N223-T225 PolarHBondContact O-N 2.85Å; N223-R226 WeakPolarHBondContact O-CB 3.33Å; N223-R226 PolarHBondContact O-N 2.91Å; N223-R226 VanDerWaalsContact O-N 3.1Å; N223-L227 WeakPolarHBondContact O-CG 3.27Å; N223-L227 PolarHBondContact O-N 2.76Å
224	C	98.1	Very high	96.2	Very high	3 Å²	3	41 Å²	41	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-35.9	177.3	-65.3	0	0	0	0	112.3	L194 L220 L227 L228	L194-C224 HydrophobicContact CD2-CB 3.87Å; L220-C224 WeakPolarHBondContact O-CB 3.46Å; L220-C224 PolarHBondContact O-N 3.31Å; L220-C224 PolarHBondContact O-SG 3.38Å; C224-L227 WeakPolarHBondContact O-CB 3.4Å; C224-L227 PolarHBondContact O-N 3.3Å; C224-L228 PolarHBondContact O-N 2.87Å; C224-L228 VanDerWaalsContact O-N 3.16Å
225	T	98.3	Very high	96.2	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-38.6	174.4	-55	0	0	0	0	111.6	V124 L127 L221 T222 N223 L227 L228 C229	V124-T225 HydrophobicContact CB-CG2 4.5Å; V124-T225 HydrophobicContact CG1-CG2 4.06Å; L127-T225 HydrophobicContact CB-CG2 3.79Å; L127-T225 HydrophobicContact CD1-CG2 3.62Å; L127-T225 HydrophobicContact CG-CG2 4.33Å; L221-T225 WeakPolarHBondContact O-CB 3.4Å; L221-T225 PolarHBondContact O-N 3.34Å; L221-T225 PolarHBondContact O-OG1 2.98Å; T222-T225 PolarHBondContact O-N 3.49Å; N223-T225 VanDerWaalsContact C-N 3.28Å; N223-T225 PolarHBondContact O-N 2.85Å; T225-L227 VanDerWaalsContact C-N 3.32Å; T225-L227 PolarHBondContact O-N 3.43Å; T225-L228 WeakPolarHBondContact O-CB 3.48Å; T225-L228 PolarHBondContact O-N 3.2Å; T225-C229 PolarHBondContact O-N 2.87Å; T225-C229 PolarHBondContact O-SG 3.35Å
226	R	97.6	Very high	96.1	Very high	121 Å²	121	37.8 Å²	37.8	46%	0.457	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-37.3	173.9	-73.3	170.7	176	-178.6	-1.1	111.9	T222 N223 L228 C229 R230	T222-R226 VanDerWaalsContact O-CG 3.31Å; T222-R226 WeakPolarHBondContact O-CG 3.47Å; T222-R226 PolarHBondContact O-N 3.46Å; N223-R226 WeakPolarHBondContact O-CB 3.33Å; N223-R226 PolarHBondContact O-N 2.91Å; N223-R226 VanDerWaalsContact O-N 3.1Å; R226-L228 VanDerWaalsContact C-N 3.32Å; R226-L228 PolarHBondContact O-N 3.13Å; R226-C229 WeakPolarHBondContact O-CB 3.39Å; R226-C229 PolarHBondContact O-N 3.43Å; R226-R230 WeakPolarHBondContact O-CG 3.41Å; R226-R230 PolarHBondContact O-N 3.01Å
227	L	97.4	Very high	96.3	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-59.6	-43.3	172.6	-63.6	178.2	0	0	0	111.4	A210 Y212 N223 C224 T225 C229 R230 R231 V448 D450	A210-L227 HydrophobicContact CB-CD1 4.21Å; A210-L227 HydrophobicContact CB-CD2 3.64Å; Y212-L227 HydrophobicContact CE2-CD2 3.99Å; Y212-L227 HydrophobicContact CE2-CG 4.45Å; N223-L227 WeakPolarHBondContact O-CG 3.27Å; N223-L227 PolarHBondContact O-N 2.76Å; C224-L227 WeakPolarHBondContact O-CB 3.4Å; C224-L227 PolarHBondContact O-N 3.3Å; T225-L227 VanDerWaalsContact C-N 3.32Å; T225-L227 PolarHBondContact O-N 3.43Å; L227-C229 VanDerWaalsContact C-N 3.33Å; L227-C229 PolarHBondContact O-N 2.68Å; L227-R230 WeakPolarHBondContact O-CB 3.4Å; L227-R230 PolarHBondContact O-N 3.04Å; L227-R230 VanDerWaalsContact O-N 3.16Å; L227-R231 PolarHBondContact O-N 2.96Å; L227-R231 VanDerWaalsContact O-N 3.09Å; L227-V448 VanDerWaalsContact C-CG1 3.48Å; L227-V448 HydrophobicContact CB-CG1 4.19Å; L227-V448 WeakPolarHBondContact O-CG1 3.21Å; L227-D450 HydrophobicContact CD2-CB 3.6Å
228	L	97.4	Very high	96.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-41.9	173.1	178.1	59.5	0	0	0	112.6	L97 L128 I133 V162 C192 C224 T225 R226 R230 R231 V448	L97-L228 HydrophobicContact CD1-CD1 4.25Å; L128-L228 HydrophobicContact CD2-CD2 3.7Å; L128-L228 HydrophobicContact CD2-CG 4.23Å; I133-L228 HydrophobicContact CD1-CD1 4.46Å; I133-L228 HydrophobicContact CD1-CG 4.04Å; V162-L228 HydrophobicContact CG1-CD2 4.25Å; V162-L228 HydrophobicContact CG2-CD1 4.27Å; V162-L228 HydrophobicContact CG2-CD2 3.75Å; C192-L228 HydrophobicContact CB-CD1 4.33Å; C224-L228 PolarHBondContact O-N 2.87Å; C224-L228 VanDerWaalsContact O-N 3.16Å; T225-L228 WeakPolarHBondContact O-CB 3.48Å; T225-L228 PolarHBondContact O-N 3.2Å; R226-L228 VanDerWaalsContact C-N 3.32Å; R226-L228 PolarHBondContact O-N 3.13Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 2.84Å; L228-R231 WeakPolarHBondContact O-CG 3.33Å; L228-R231 PolarHBondContact O-N 3.24Å; L228-R231 VanDerWaalsContact O-N 3.13Å; L228-V448 HydrophobicContact CB-CG1 4.07Å; L228-V448 HydrophobicContact CD1-CG1 4.36Å; L228-V448 HydrophobicContact CD1-CG2 3.98Å
229	C	96.5	Very high	96.7	Very high	28 Å²	28	28 Å²	28	19%	0.189	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-31.5	176.4	-60.6	0	0	0	0	112.6	A131 T225 R226 L227 R231	A131-C229 HydrophobicContact CB-CB 3.85Å; T225-C229 PolarHBondContact O-N 2.87Å; T225-C229 PolarHBondContact O-SG 3.35Å; R226-C229 WeakPolarHBondContact O-CB 3.39Å; R226-C229 PolarHBondContact O-N 3.43Å; L227-C229 VanDerWaalsContact C-N 3.33Å; L227-C229 PolarHBondContact O-N 2.68Å; C229-R231 VanDerWaalsContact C-N 3.32Å; C229-R231 PolarHBondContact O-NH1 3.37Å
230	R	95.1	Very high	96.8	Very high	118 Å²	118	23 Å²	23	45%	0.445	11%	0.109	S	C	.	.	H	α-helix	trans	-72.8	-22.1	173.3	-71.9	179.8	-177.3	176.6	3	113.6	Y212 R226 L227 L228 L232 D450	Y212-R230 PolarHBondContact OH-NH2 2.8Å; R226-R230 WeakPolarHBondContact O-CG 3.41Å; R226-R230 PolarHBondContact O-N 3.01Å; L227-R230 WeakPolarHBondContact O-CB 3.4Å; L227-R230 PolarHBondContact O-N 3.04Å; L227-R230 VanDerWaalsContact O-N 3.16Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 2.84Å; R230-L232 PolarHBondContact O-N 2.94Å; R230-L232 VanDerWaalsContact O-N 3.13Å; R230-D450 WeakPolarHBondContact CD-OD2 3.34Å; R230-D450 IonicContact CZ-OD2 3.68Å; R230-D450 IonicContact NE-OD2 3.94Å; R230-D450 IonicContact NH1-OD2 2.72Å; R230-D450 PolarHBondContact NH1-OD2 3.49Å
231	R	95.1	Very high	96.8	Very high	23 Å²	23	23 Å²	23	9%	0.087	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	6.8	172	-65.1	171.8	171.2	78.7	0	116.3	V96 L97 P98 R99 A131 L227 L228 C229	V96-R231 CarbonylContact C-O 3.59Å; V96-R231 WeakPolarHBondContact CA-O 3.43Å; V96-R231 HydrophobicContact CG1-CB 3.73Å; V96-R231 WeakPolarHBondContact CG1-O 3.44Å; L97-R231 HydrophobicContact CB-CB 3.86Å; L97-R231 HydrophobicContact CB-CG 4.02Å; L97-R231 PolarHBondContact N-O 2.88Å; P98-R231 WeakPolarHBondContact O-CD 3.39Å; P98-R231 PolarHBondContact O-NE 3.41Å; R99-R231 PolarHBondContact O-NE 3.27Å; R99-R231 PolarHBondContact O-NH2 3.17Å; A131-R231 PolarHBondContact O-NH1 3.25Å; A131-R231 PolarHBondContact O-NH2 3.49Å; L227-R231 PolarHBondContact O-N 2.96Å; L227-R231 VanDerWaalsContact O-N 3.09Å; L228-R231 WeakPolarHBondContact O-CG 3.33Å; L228-R231 PolarHBondContact O-N 3.24Å; L228-R231 VanDerWaalsContact O-N 3.13Å; C229-R231 VanDerWaalsContact C-N 3.32Å; C229-R231 PolarHBondContact O-NH1 3.37Å
232	L	95.5	Very high	96.7	Very high	60 Å²	60	23.9 Å²	23.9	31%	0.314	11%	0.113	S	C	.	.	B	Isolated β-bridge	trans	-70.4	140.7	178.8	-60.4	179.2	0	0	0	110.3	G95 V96 R230 V448 S449 D450	G95-L232 WeakPolarHBondContact O-CA 3.3Å; V96-L232 HydrophobicContact CG1-CD2 4.37Å; V96-L232 HydrophobicContact CG2-CD2 3.86Å; R230-L232 PolarHBondContact O-N 2.94Å; R230-L232 VanDerWaalsContact O-N 3.13Å; L232-V448 CarbonylContact O-C 3.55Å; L232-V448 WeakPolarHBondContact O-CA 3.42Å; L232-S449 CarbonylContact C-O 3.1Å; L232-S449 VanDerWaalsContact C-O 3.29Å; L232-S449 WeakPolarHBondContact CB-O 3.14Å; L232-S449 PolarHBondContact O-N 3.3Å; L232-S449 VanDerWaalsContact O-O 3.09Å; L232-D450 HydrophobicContact CD1-CB 4.11Å; L232-D450 WeakPolarHBondContact CD1-OD1 3.37Å
233	L	95.5	Very high	96.6	Very high	16 Å²	16	22.8 Å²	22.8	8%	0.084	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.6	-178.1	-61.2	-178.8	0	0	0	109.8	R94 G95 L97 P190 W446 M447 V448	R94-L233 WeakPolarHBondContact O-CD1 3.24Å; G95-L233 PolarHBondContact O-N 3.28Å; L97-L233 HydrophobicContact CD1-CD2 4.48Å; L97-L233 HydrophobicContact CD2-CD1 3.97Å; L97-L233 HydrophobicContact CD2-CD2 4.22Å; L97-L233 HydrophobicContact CG-CD1 4.27Å; L97-L233 HydrophobicContact CG-CD2 4.02Å; L97-L233 HydrophobicContact CG-CG 4.32Å; P190-L233 HydrophobicContact CB-CD1 3.99Å; P190-L233 HydrophobicContact CB-CD2 3.85Å; P190-L233 HydrophobicContact CG-CD1 3.64Å; P190-L233 HydrophobicContact CG-CD2 4.43Å; L233-W446 HydrophobicContact CB-CE3 3.92Å; L233-W446 HydrophobicContact CB-CZ3 4.48Å; L233-M447 WeakPolarHBondContact CA-O 3.4Å; L233-V448 HydrophobicContact CD2-CB 4.46Å; L233-V448 HydrophobicContact CD2-CG2 3.76Å
234	S	94.3	Very high	96.3	Very high	14 Å²	14	24.3 Å²	24.3	10%	0.098	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.1	172.3	-66.7	0	0	0	0	109.8	M447 C451	S234-M447 PolarHBondContact N-O 2.95Å; S234-M447 PolarHBondContact O-N 3.33Å; S234-C451 PolarHBondContact OG-SG 3.2Å
235	P	95	Very high	96	Very high	31 Å²	31	28.1 Å²	28.1	20%	0.201	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	148.6	174.4	31.8	-33.9	0	0	0	110.3	R365 N443 F445 W446	P235-R365 PolarHBondContact O-NH2 3.03Å; P235-N443 HydrophobicContact CB-CB 3.62Å; P235-N443 HydrophobicContact CG-CB 4.2Å; P235-F445 CarbonylContact C-O 3.5Å; P235-F445 WeakPolarHBondContact CA-O 3.31Å; P235-W446 HydrophobicContact CB-CE3 4.26Å; P235-W446 HydrophobicContact CB-CH2 4.44Å; P235-W446 HydrophobicContact CB-CZ3 4.18Å; P235-W446 HydrophobicContact CG-CZ3 4.27Å
236	M	95.3	Very high	95.6	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.02	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.7	179.9	-61.9	-57.1	165.6	0	0	110.8	L206 N443 Y444 F445 M447	L206-M236 HydrophobicContact CD2-CE 3.52Å; M236-N443 CarbonylContact O-C 3.51Å; M236-N443 WeakPolarHBondContact O-CA 3.39Å; M236-Y444 PolarHBondContact O-N 3.46Å; M236-F445 HydrophobicContact CB-CD1 4.09Å; M236-F445 HydrophobicContact CB-CD2 4.28Å; M236-F445 HydrophobicContact CB-CE1 3.65Å; M236-F445 HydrophobicContact CB-CE2 3.87Å; M236-F445 HydrophobicContact CB-CG 4.39Å; M236-F445 HydrophobicContact CB-CZ 3.53Å; M236-F445 HydrophobicContact CG-CE2 4.21Å; M236-F445 HydrophobicContact CG-CZ 4.22Å; M236-F445 PolarHBondContact N-O 3.13Å; M236-F445 PolarHBondContact O-N 3.16Å; M236-M447 HydrophobicContact CB-CG 4.49Å; M236-M447 HydrophobicContact CE-CB 3.86Å; M236-M447 HydrophobicContact CE-CG 4.49Å; M236-M447 HydrophobicContact CG-CB 3.87Å; M236-M447 HydrophobicContact CG-CG 3.59Å; M236-M447 HydrophobicContact CG-SD 3.92Å
237	N	96.9	Very high	95.3	Very high	12 Å²	12	29.6 Å²	29.6	6%	0.064	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	151.5	172.7	-66.9	-23	0	0	0	110.3	L350 A367 A368 G369 V370 V440 H441 N443 F445	N237-L350 HydrophobicContact CB-CD2 4.22Å; N237-L350 WeakPolarHBondContact O-CD2 3.44Å; N237-A367 PolarHBondContact ND2-O 3.22Å; N237-A368 WeakPolarHBondContact OD1-CA 3.42Å; N237-G369 PolarHBondContact ND2-N 3.03Å; N237-G369 PolarHBondContact OD1-N 3.16Å; N237-V370 PolarHBondContact ND2-N 3.4Å; N237-V370 PolarHBondContact ND2-O 3.4Å; N237-V440 HydrophobicContact CB-CG1 3.68Å; N237-H441 WeakPolarHBondContact CA-O 3.49Å; N237-N443 PolarHBondContact OD1-N 3.04Å; N237-F445 VanDerWaalsContact O-CE1 3.28Å; N237-F445 WeakPolarHBondContact O-CE1 3.45Å
238	L	98	Very high	95.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.4	175.1	-174.2	68.6	0	0	0	110	V174 M178 F250 V252 H441 Y444 F445	V174-L238 HydrophobicContact CG1-CD1 3.71Å; M178-L238 HydrophobicContact CE-CD2 4.39Å; M178-L238 HydrophobicContact CG-CD2 4.33Å; M178-L238 HydrophobicContact SD-CD2 4.18Å; L238-F250 HydrophobicContact CD1-CB 4.15Å; L238-F250 HydrophobicContact CD2-CB 4.36Å; L238-F250 HydrophobicContact CD2-CD1 3.74Å; L238-F250 HydrophobicContact CD2-CE1 4.4Å; L238-F250 HydrophobicContact CD2-CG 4.24Å; L238-F250 HydrophobicContact CG-CB 4.35Å; L238-F250 HydrophobicContact CG-CD1 4.14Å; L238-V252 HydrophobicContact CD1-CG1 4.03Å; L238-H441 PolarHBondContact N-O 3.12Å; L238-H441 PolarHBondContact O-N 3.07Å; L238-Y444 HydrophobicContact CB-CD1 4.26Å; L238-Y444 HydrophobicContact CB-CG 4.14Å; L238-Y444 HydrophobicContact CD2-CD1 3.53Å; L238-Y444 HydrophobicContact CD2-CE1 4.13Å; L238-Y444 HydrophobicContact CD2-CG 4.24Å; L238-F445 HydrophobicContact CB-CD1 4.21Å; L238-F445 HydrophobicContact CB-CE1 4.31Å; L238-F445 HydrophobicContact CD1-CD1 4.21Å; L238-F445 HydrophobicContact CD1-CE1 4Å
239	L	98.3	Very high	95	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	116.4	177.3	173.1	61.4	0	0	0	109.9	L241 F250 S251 L350 M371 F413 V440	L239-L241 HydrophobicContact CD1-CD2 4.2Å; L239-L241 HydrophobicContact CD2-CD2 3.91Å; L239-L241 HydrophobicContact CD2-CG 4.36Å; L239-L241 HydrophobicContact CG-CD2 3.86Å; L239-L241 HydrophobicContact CG-CG 4.06Å; L239-F250 CarbonylContact O-C 3.5Å; L239-F250 WeakPolarHBondContact O-CA 3.31Å; L239-S251 PolarHBondContact N-O 3.5Å; L239-S251 PolarHBondContact O-N 3.19Å; L239-L350 HydrophobicContact CB-CD1 3.86Å; L239-L350 HydrophobicContact CB-CD2 4.12Å; L239-L350 HydrophobicContact CD2-CD1 4Å; L239-M371 HydrophobicContact CD1-CE 4.4Å; L239-M371 HydrophobicContact CD1-SD 3.95Å; L239-M371 HydrophobicContact CD2-SD 4.03Å; L239-F413 HydrophobicContact CD1-CE1 4.3Å; L239-F413 HydrophobicContact CD2-CE1 4.41Å; L239-V440 HydrophobicContact CD1-CG2 4.37Å
240	S	97.9	Very high	95	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.4	169.1	-179.4	0	0	0	0	108.8	D321 G438 Q439	S240-D321 WeakPolarHBondContact CB-OD1 3.45Å; S240-D321 PolarHBondContact OG-OD1 3.36Å; S240-D321 PolarHBondContact OG-OD2 3.18Å; S240-G438 CarbonylContact O-C 3.1Å; S240-G438 WeakPolarHBondContact O-CA 3.16Å; S240-Q439 PolarHBondContact N-O 3.27Å; S240-Q439 PolarHBondContact O-N 3.45Å
241	L	97.3	Very high	95.2	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.3	-179.6	-64.3	171.2	0	0	0	110.7	L239 R248 L249 L255 F413 V426 V436 Q437	L239-L241 HydrophobicContact CD1-CD2 4.2Å; L239-L241 HydrophobicContact CD2-CD2 3.91Å; L239-L241 HydrophobicContact CD2-CG 4.36Å; L239-L241 HydrophobicContact CG-CD2 3.86Å; L239-L241 HydrophobicContact CG-CG 4.06Å; L241-R248 WeakPolarHBondContact O-CA 3.41Å; L241-L249 HydrophobicContact CB-CD2 3.96Å; L241-L249 HydrophobicContact CB-CG 3.97Å; L241-L249 WeakPolarHBondContact CB-O 3.27Å; L241-L249 HydrophobicContact CD1-CD1 4.19Å; L241-L249 HydrophobicContact CD1-CG 4.14Å; L241-L249 PolarHBondContact N-O 3.28Å; L241-L249 PolarHBondContact O-N 2.93Å; L241-L249 VanDerWaalsContact O-N 3.08Å; L241-L255 HydrophobicContact CD1-CD1 3.78Å; L241-L255 HydrophobicContact CD2-CD1 3.78Å; L241-L255 HydrophobicContact CG-CD1 4.44Å; L241-F413 HydrophobicContact CD2-CE1 4Å; L241-F413 HydrophobicContact CD2-CZ 4Å; L241-V426 HydrophobicContact CD1-CG1 3.69Å; L241-V426 HydrophobicContact CD1-CG2 4.04Å; L241-V436 HydrophobicContact CD2-CG2 4.19Å; L241-Q437 WeakPolarHBondContact CA-O 3.34Å
242	H	95.8	Very high	95.3	Very high	21 Å²	21	25 Å²	25	10%	0.097	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.8	173	-64.6	-108.2	0	0	0	109.4	R248 D321 V436 Q437	H242-R248 PolarHBondContact CE1-NH1 2.9Å; H242-R248 PolarHBondContact NE2-NH1 3.24Å; H242-R248 VanDerWaalsContact NE2-NH1 3.15Å; H242-D321 IonicContact CD2-OD2 2.92Å; H242-D321 IonicContact CE1-OD2 2.7Å; H242-D321 IonicContact NE2-OD2 2.87Å; H242-D321 PolarHBondContact NE2-OD2 3.46Å; H242-V436 CarbonylContact O-C 3.52Å; H242-V436 WeakPolarHBondContact O-CA 3.29Å; H242-Q437 HydrophobicContact CB-CG 4.04Å; H242-Q437 PolarHBondContact N-O 3.42Å; H242-Q437 PolarHBondContact O-N 2.83Å
243	T	94.6	Very high	95.4	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.025	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	163.9	176.1	79.1	0	0	0	0	111.8	S245 G246 L247 L249 M431 E434 A435 V436	T243-S245 PolarHBondContact O-N 3.06Å; T243-S245 PolarHBondContact OG1-OG 3.19Å; T243-G246 PolarHBondContact O-N 3.05Å; T243-L247 HydrophobicContact CG2-CB 4.39Å; T243-L247 PolarHBondContact N-O 3.29Å; T243-L247 WeakPolarHBondContact OG1-CB 3.41Å; T243-L247 PolarHBondContact OG1-N 3.03Å; T243-L249 HydrophobicContact CG2-CD2 4.04Å; T243-M431 HydrophobicContact CG2-CE 4.15Å; T243-M431 HydrophobicContact CG2-SD 3.87Å; T243-E434 VanDerWaalsContact CB-CD 3.43Å; T243-E434 WeakPolarHBondContact CB-OE1 3.21Å; T243-E434 HydrophobicContact CG2-CG 4.5Å; T243-E434 PolarHBondContact OG1-OE1 3Å; T243-A435 CarbonylContact C-O 3.56Å; T243-A435 VanDerWaalsContact CA-O 3.32Å; T243-A435 WeakPolarHBondContact CA-O 3.19Å; T243-V436 HydrophobicContact CG2-CG2 4.37Å
244	A	92.8	Very high	95.4	Very high	52 Å²	52	22 Å²	22	43%	0.43	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-30.6	179.8	0	0	0	0	0	113.5	G246 L327 E434 A435	A244-G246 PolarHBondContact O-N 2.93Å; A244-L327 HydrophobicContact CB-CD1 4.21Å; A244-L327 VanDerWaalsContact N-CD1 3.33Å; A244-E434 HydrophobicContact CB-CB 4.37Å; A244-E434 PolarHBondContact N-OE2 3.23Å; A244-A435 HydrophobicContact CB-CB 4.2Å; A244-A435 PolarHBondContact N-O 3.05Å
245	S	91.6	Very high	95.6	Very high	83 Å²	83	21.4 Å²	21.4	58%	0.58	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-2.9	174.3	61.5	0	0	0	0	113.9	T243 L247 E434	T243-S245 PolarHBondContact O-N 3.06Å; T243-S245 PolarHBondContact OG1-OG 3.19Å; S245-L247 VanDerWaalsContact C-N 3.3Å; S245-E434 VanDerWaalsContact CB-OE2 3.27Å; S245-E434 WeakPolarHBondContact CB-OE2 3.45Å; S245-E434 PolarHBondContact N-OE2 3.22Å; S245-E434 PolarHBondContact OG-OE1 3.22Å; S245-E434 PolarHBondContact OG-OE2 2.91Å
246	G	90.4	Very high	95.7	Very high	66 Å²	66	20 Å²	20	68%	0.68	13%	0.131	S	C	*	.			trans	81.3	8.6	-176.1	0	0	0	0	0	113.3	T243 A244 R248	T243-G246 PolarHBondContact O-N 3.05Å; A244-G246 PolarHBondContact O-N 2.93Å; G246-R248 PolarHBondContact O-N 3.23Å
247	L	91.5	Very high	95.8	Very high	85 Å²	85	19.8 Å²	19.8	45%	0.445	13%	0.131	S	C	.	.			trans	-69.4	129	173.2	-179	66.8	0	0	0	109.5	T243 S245 L249	T243-L247 HydrophobicContact CG2-CB 4.39Å; T243-L247 PolarHBondContact N-O 3.29Å; T243-L247 WeakPolarHBondContact OG1-CB 3.41Å; T243-L247 PolarHBondContact OG1-N 3.03Å; S245-L247 VanDerWaalsContact C-N 3.3Å; L247-L249 HydrophobicContact CD2-CD2 4.12Å; L247-L249 HydrophobicContact CG-CD2 4.14Å
248	R	92.8	Very high	95.7	Very high	50 Å²	50	19.2 Å²	19.2	19%	0.189	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.2	171.1	-177.6	178.8	167.7	101.5	-8.4	109.3	L241 H242 G246 Q317 G318 P319 D321	L241-R248 WeakPolarHBondContact O-CA 3.41Å; H242-R248 PolarHBondContact CE1-NH1 2.9Å; H242-R248 PolarHBondContact NE2-NH1 3.24Å; H242-R248 VanDerWaalsContact NE2-NH1 3.15Å; G246-R248 PolarHBondContact O-N 3.23Å; R248-Q317 PolarHBondContact NH2-O 3.38Å; R248-G318 VanDerWaalsContact NH2-C 3.31Å; R248-G318 PolarHBondContact NH2-O 3.38Å; R248-P319 VanDerWaalsContact NH2-CD 3.31Å; R248-P319 PolarHBondContact NH2-O 3Å; R248-D321 IonicContact CZ-OD2 3.96Å; R248-D321 IonicContact NH1-OD2 3.85Å; R248-D321 PolarHBondContact NH1-OD2 3.28Å; R248-D321 IonicContact NH2-OD2 3.64Å
249	L	94.8	Very high	95.6	Very high	14 Å²	14	20.1 Å²	20.1	7%	0.073	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	163.8	177.9	66.9	152.5	0	0	0	110.9	L241 T243 L247 V426 M431	L241-L249 HydrophobicContact CB-CD2 3.96Å; L241-L249 HydrophobicContact CB-CG 3.97Å; L241-L249 WeakPolarHBondContact CB-O 3.27Å; L241-L249 HydrophobicContact CD1-CD1 4.19Å; L241-L249 HydrophobicContact CD1-CG 4.14Å; L241-L249 PolarHBondContact N-O 3.28Å; L241-L249 PolarHBondContact O-N 2.93Å; L241-L249 VanDerWaalsContact O-N 3.08Å; T243-L249 HydrophobicContact CG2-CD2 4.04Å; L247-L249 HydrophobicContact CD2-CD2 4.12Å; L247-L249 HydrophobicContact CG-CD2 4.14Å; L249-V426 HydrophobicContact CD1-CB 4.19Å; L249-V426 HydrophobicContact CD1-CG1 3.9Å; L249-V426 HydrophobicContact CD1-CG2 4.15Å; L249-M431 HydrophobicContact CD1-SD 4.11Å; L249-M431 HydrophobicContact CD2-SD 3.94Å
250	F	97.3	Very high	95.4	Very high	12 Å²	12	21.7 Å²	21.7	5%	0.053	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.5	178.8	-59.7	-84.7	0	0	0	110.7	H171 V174 N175 M178 L238 L239	H171-F250 PolarHBondContact CE1-O 2.77Å; H171-F250 PolarHBondContact ND1-O 3.35Å; V174-F250 HydrophobicContact CG1-CB 4.49Å; N175-F250 PolarHBondContact ND2-O 2.94Å; N175-F250 PolarHBondContact OD1-N 3.42Å; M178-F250 HydrophobicContact CB-CD2 3.5Å; M178-F250 VanDerWaalsContact CB-CD2 3.5Å; M178-F250 HydrophobicContact CB-CE2 3.38Å; M178-F250 HydrophobicContact CB-CG 4.31Å; M178-F250 HydrophobicContact CB-CZ 4.09Å; M178-F250 HydrophobicContact CE-CD1 4.26Å; M178-F250 HydrophobicContact CE-CE1 3.61Å; M178-F250 HydrophobicContact CE-CE2 3.95Å; M178-F250 HydrophobicContact CE-CZ 3.42Å; M178-F250 VanDerWaalsContact CE-CZ 3.42Å; M178-F250 HydrophobicContact CG-CD1 4.43Å; M178-F250 HydrophobicContact CG-CD2 3.71Å; M178-F250 HydrophobicContact CG-CE2 3.85Å; M178-F250 HydrophobicContact CG-CG 4.01Å; M178-F250 HydrophobicContact CG-CZ 4.26Å; L238-F250 HydrophobicContact CD1-CB 4.15Å; L238-F250 HydrophobicContact CD2-CB 4.36Å; L238-F250 HydrophobicContact CD2-CD1 3.74Å; L238-F250 HydrophobicContact CD2-CE1 4.4Å; L238-F250 HydrophobicContact CD2-CG 4.24Å; L238-F250 HydrophobicContact CG-CB 4.35Å; L238-F250 HydrophobicContact CG-CD1 4.14Å; L239-F250 CarbonylContact O-C 3.5Å; L239-F250 WeakPolarHBondContact O-CA 3.31Å
251	S	97.9	Very high	95.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.6	176.3	169.3	0	0	0	0	110.3	L239 S254 D427	L239-S251 PolarHBondContact N-O 3.5Å; L239-S251 PolarHBondContact O-N 3.19Å; S251-S254 PolarHBondContact OG-N 3Å; S251-S254 PolarHBondContact OG-O 2.93Å; S251-D427 VanDerWaalsContact CA-OD2 3.27Å; S251-D427 WeakPolarHBondContact CA-OD2 3.49Å; S251-D427 PolarHBondContact OG-OD1 3.41Å
252	V	97.4	Very high	95.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-97.9	-14.5	177.7	-61.8	0	0	0	0	112.7	M170 V174 L238 H351 D427 F445	M170-V252 HydrophobicContact CB-CG2 4.48Å; M170-V252 HydrophobicContact CG-CG2 4.09Å; V174-V252 HydrophobicContact CB-CG1 3.76Å; V174-V252 HydrophobicContact CG1-CG1 3.8Å; V174-V252 HydrophobicContact CG2-CG1 3.6Å; L238-V252 HydrophobicContact CD1-CG1 4.03Å; V252-H351 PolarHBondContact O-CD2 2.9Å; V252-H351 VanDerWaalsContact O-CD2 3.28Å; V252-H351 PolarHBondContact O-NE2 2.91Å; V252-D427 WeakPolarHBondContact CG2-OD2 3.43Å; V252-D427 PolarHBondContact N-OD1 3.44Å; V252-D427 PolarHBondContact N-OD2 2.93Å; V252-F445 HydrophobicContact CB-CZ 4.28Å; V252-F445 HydrophobicContact CG1-CE1 4.38Å; V252-F445 HydrophobicContact CG1-CZ 4.12Å
253	L	97.1	Very high	95	Very high	5 Å²	5	21.6 Å²	21.6	3%	0.026	14%	0.14	C	C	.	.	S	Bend	trans	-133	-64	-171.1	176.3	70.8	0	0	0	111.9	D167 A201 L349 L350 H351 D427	D167-L253 HydrophobicContact CB-CD2 4.07Å; A201-L253 HydrophobicContact CB-CD1 3.9Å; A201-L253 HydrophobicContact CB-CD2 3.55Å; A201-L253 HydrophobicContact CB-CG 4.34Å; L253-L349 HydrophobicContact CD1-CD1 4.18Å; L253-L349 HydrophobicContact CG-CD1 4.47Å; L253-L350 WeakPolarHBondContact O-CD1 3.4Å; L253-L350 PolarHBondContact O-N 3.03Å; L253-H351 HydrophobicContact CD1-CB 4.09Å; L253-D427 WeakPolarHBondContact CA-OD1 3.16Å; L253-D427 HydrophobicContact CB-CB 4.42Å; L253-D427 WeakPolarHBondContact CB-OD1 3.39Å; L253-D427 PolarHBondContact N-OD1 3.47Å
254	S	97.1	Very high	94.8	Very high	10 Å²	10	22.5 Å²	22.5	7%	0.07	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	153.3	-169.5	59.9	0	0	0	0	114.5	S251 A348 V426 D427	S251-S254 PolarHBondContact OG-N 3Å; S251-S254 PolarHBondContact OG-O 2.93Å; S254-A348 CarbonylContact C-O 3.42Å; S254-A348 WeakPolarHBondContact CA-O 3.37Å; S254-A348 VanDerWaalsContact CB-O 3.31Å; S254-A348 WeakPolarHBondContact CB-O 3.49Å; S254-V426 CarbonylContact O-C 3.48Å; S254-V426 WeakPolarHBondContact O-CA 3.45Å; S254-D427 PolarHBondContact N-OD1 3.41Å; S254-D427 PolarHBondContact O-N 3.5Å
255	L	97.9	Very high	94.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.3	157.7	177.3	146.1	0	0	0	108.2	L241 L347 A348 F413 F424 T425 V426 M431 V436	L241-L255 HydrophobicContact CD1-CD1 3.78Å; L241-L255 HydrophobicContact CD2-CD1 3.78Å; L241-L255 HydrophobicContact CG-CD1 4.44Å; L255-L347 WeakPolarHBondContact O-CA 3.37Å; L255-A348 HydrophobicContact CB-CB 4.35Å; L255-A348 PolarHBondContact N-O 3.44Å; L255-A348 PolarHBondContact O-N 3.21Å; L255-F413 HydrophobicContact CD1-CZ 4.08Å; L255-F413 HydrophobicContact CD2-CE2 3.98Å; L255-F413 HydrophobicContact CD2-CZ 3.87Å; L255-F413 HydrophobicContact CG-CZ 4.39Å; L255-F424 HydrophobicContact CD1-CD1 4.41Å; L255-F424 HydrophobicContact CD2-CD1 3.86Å; L255-F424 HydrophobicContact CD2-CE1 4.07Å; L255-F424 HydrophobicContact CG-CD1 4.2Å; L255-T425 CarbonylContact C-O 3.55Å; L255-T425 WeakPolarHBondContact CA-O 3.39Å; L255-V426 HydrophobicContact CD1-CG2 4.02Å; L255-V426 HydrophobicContact CG-CG2 4.34Å; L255-M431 HydrophobicContact CD1-CE 4.4Å; L255-V436 HydrophobicContact CD1-CG1 4.14Å; L255-V436 HydrophobicContact CD1-CG2 3.88Å
256	A	97.2	Very high	94.6	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.008	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.2	177.6	0	0	0	0	0	111.6	I260 V346 L347 F424 T425	A256-I260 HydrophobicContact CB-CB 3.95Å; A256-I260 HydrophobicContact CB-CG2 3.59Å; A256-V346 WeakPolarHBondContact CA-O 3.34Å; A256-L347 HydrophobicContact CB-CD1 3.91Å; A256-F424 WeakPolarHBondContact O-CA 3.15Å; A256-T425 PolarHBondContact N-O 3.48Å; A256-T425 PolarHBondContact O-N 3.18Å
257	W	96.7	Very high	94.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.3	174.8	-178.8	67.6	0	0	0	110.6	Y292 F343 L345 V346 L415 P417 F424	W257-Y292 VanDerWaalsContact CH2-CB 3.44Å; W257-Y292 WeakPolarHBondContact CH2-O 3.32Å; W257-Y292 VanDerWaalsContact CZ2-CB 3.49Å; W257-Y292 HydrophobicContact CZ2-CG 4.46Å; W257-F343 HydrophobicContact CZ3-CB 3.95Å; W257-F343 AromaticContact CZ3-CD2 3.95Å; W257-F343 HydrophobicContact CZ3-CD2 3.95Å; W257-F343 HydrophobicContact CZ3-CG 4.24Å; W257-L345 VanDerWaalsContact O-CA 3.31Å; W257-L345 WeakPolarHBondContact O-CA 3.19Å; W257-V346 HydrophobicContact CE3-CB 4.16Å; W257-V346 HydrophobicContact CE3-CG2 3.77Å; W257-V346 HydrophobicContact CZ3-CG2 4.12Å; W257-V346 PolarHBondContact N-O 3.14Å; W257-V346 PolarHBondContact O-N 3.22Å; W257-L415 HydrophobicContact CB-CD2 3.75Å; W257-L415 HydrophobicContact CD2-CD1 4.5Å; W257-L415 HydrophobicContact CD2-CD2 4.01Å; W257-L415 HydrophobicContact CE3-CD1 3.95Å; W257-L415 HydrophobicContact CE3-CD2 3.89Å; W257-L415 HydrophobicContact CE3-CG 4.4Å; W257-L415 HydrophobicContact CG-CD2 3.98Å; W257-L415 HydrophobicContact CZ3-CD1 4.01Å; W257-P417 HydrophobicContact CZ2-CB 3.85Å; W257-P417 HydrophobicContact CZ2-CG 4.17Å; W257-F424 HydrophobicContact CB-CD1 3.69Å; W257-F424 HydrophobicContact CB-CE1 3.49Å; W257-F424 VanDerWaalsContact CB-CE1 3.49Å; W257-F424 HydrophobicContact CB-CZ 4.43Å; W257-F424 AromaticContact CD1-CD1 3.91Å; W257-F424 AromaticContact CD1-CE1 3.56Å; W257-F424 AromaticContact CD1-CZ 3.71Å; W257-F424 HydrophobicContact CG-CD1 4.1Å; W257-F424 AromaticContact CG-CE1 3.62Å; W257-F424 HydrophobicContact CG-CE1 3.62Å; W257-F424 HydrophobicContact CG-CZ 4.1Å
258	G	95	Very high	94.4	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.1	-133.4	-178.4	0	0	0	0	0	112.2	I260 A261 D262 Y292	G258-I260 VanDerWaalsContact C-N 3.34Å; G258-I260 PolarHBondContact O-N 3.01Å; G258-A261 PolarHBondContact O-N 3.23Å; G258-A261 VanDerWaalsContact O-N 3.14Å; G258-D262 PolarHBondContact O-N 3.41Å; G258-Y292 VanDerWaalsContact C-CZ 3.47Å; G258-Y292 VanDerWaalsContact CA-CD2 3.49Å; G258-Y292 VanDerWaalsContact CA-CZ 3.42Å
259	F	95.5	Very high	94.3	Very high	19 Å²	19	21.5 Å²	21.5	8%	0.083	10%	0.104	C	C	.	.	H	α-helix	trans	-51.5	-46.1	-170.5	-174.5	-86.3	0	0	0	114	D262 V263 T282 R285 L286 L289 V344 L345	F259-D262 PolarHBondContact O-N 2.84Å; F259-V263 HydrophobicContact CD1-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.77Å; F259-V263 HydrophobicContact CZ-CG2 4.28Å; F259-V263 WeakPolarHBondContact O-CG2 3.48Å; F259-V263 PolarHBondContact O-N 3.32Å; F259-T282 HydrophobicContact CE1-CG2 4Å; F259-T282 HydrophobicContact CZ-CG2 4.03Å; F259-R285 HydrophobicContact CD2-CB 4.18Å; F259-R285 HydrophobicContact CE2-CB 3.64Å; F259-R285 HydrophobicContact CZ-CB 3.89Å; F259-L286 HydrophobicContact CE2-CB 4.41Å; F259-L286 HydrophobicContact CE2-CD1 4.39Å; F259-L286 HydrophobicContact CZ-CB 4.29Å; F259-L286 HydrophobicContact CZ-CD1 4.47Å; F259-L289 HydrophobicContact CD2-CD1 3.71Å; F259-L289 HydrophobicContact CE2-CD1 3.89Å; F259-V344 HydrophobicContact CB-CG1 3.86Å; F259-V344 VanDerWaalsContact CB-O 3.3Å; F259-V344 WeakPolarHBondContact CB-O 3.5Å; F259-V344 HydrophobicContact CD2-CG1 4.31Å; F259-V344 HydrophobicContact CG-CG1 4.3Å; F259-V344 PolarHBondContact N-O 3.13Å; F259-L345 HydrophobicContact CB-CB 4.06Å; F259-L345 HydrophobicContact CB-CD2 4.33Å
260	I	95.3	Very high	94.1	Very high	34 Å²	34	24.4 Å²	24.4	17%	0.174	11%	0.114	C	C	.	.	H	α-helix	trans	-65.7	-44.9	-178.1	-66.6	172.8	0	0	0	110.8	A256 G258 D262 V263 D264 L345 L347 L354	A256-I260 HydrophobicContact CB-CB 3.95Å; A256-I260 HydrophobicContact CB-CG2 3.59Å; G258-I260 VanDerWaalsContact C-N 3.34Å; G258-I260 PolarHBondContact O-N 3.01Å; I260-D262 PolarHBondContact O-N 2.73Å; I260-V263 WeakPolarHBondContact O-CB 3.38Å; I260-V263 PolarHBondContact O-N 3.13Å; I260-V263 VanDerWaalsContact O-N 3.11Å; I260-D264 PolarHBondContact O-N 2.7Å; I260-L345 HydrophobicContact CD1-CD1 4.09Å; I260-L345 HydrophobicContact CD1-CD2 4.19Å; I260-L345 HydrophobicContact CG1-CD2 4.18Å; I260-L347 HydrophobicContact CD1-CB 4.11Å; I260-L347 HydrophobicContact CD1-CD1 4.32Å; I260-L347 HydrophobicContact CD1-CD2 3.92Å; I260-L347 HydrophobicContact CD1-CG 4.34Å; I260-L354 HydrophobicContact CD1-CD1 4.4Å
261	A	94.6	Very high	93.6	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-36.6	178.7	0	0	0	0	0	112.4	G258 V263 D264 L265 V423 T425	G258-A261 PolarHBondContact O-N 3.23Å; G258-A261 VanDerWaalsContact O-N 3.14Å; A261-V263 VanDerWaalsContact C-N 3.31Å; A261-V263 PolarHBondContact O-N 2.71Å; A261-D264 PolarHBondContact O-N 3.3Å; A261-L265 PolarHBondContact O-N 3.38Å; A261-V423 HydrophobicContact CB-CG2 4.07Å; A261-V423 WeakPolarHBondContact CB-O 3.38Å; A261-T425 HydrophobicContact CB-CG2 4.08Å
262	D	93.9	Very high	93	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.059	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-35.3	171.6	-99.8	35.9	0	0	0	111.5	G258 F259 I260 E266 R285 R290 Y292	G258-D262 PolarHBondContact O-N 3.41Å; F259-D262 PolarHBondContact O-N 2.84Å; I260-D262 PolarHBondContact O-N 2.73Å; D262-E266 WeakPolarHBondContact O-CB 3.33Å; D262-E266 PolarHBondContact O-N 3.36Å; D262-R285 HydrophobicContact CB-CG 4.34Å; D262-R285 IonicContact OD2-NH1 3.51Å; D262-R290 IonicContact OD1-NH1 3.9Å; D262-R290 IonicContact OD2-CZ 2.7Å; D262-R290 IonicContact OD2-NE 2.94Å; D262-R290 IonicContact OD2-NH1 3.79Å; D262-R290 PolarHBondContact OD2-NH1 3.16Å; D262-Y292 PolarHBondContact OD2-OH 3.25Å
263	V	93.8	Very high	92.5	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-45.5	173.3	168.5	0	0	0	0	110.8	F259 I260 A261 L265 E266 S267 F278 R285	F259-V263 HydrophobicContact CD1-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.77Å; F259-V263 HydrophobicContact CZ-CG2 4.28Å; F259-V263 WeakPolarHBondContact O-CG2 3.48Å; F259-V263 PolarHBondContact O-N 3.32Å; I260-V263 WeakPolarHBondContact O-CB 3.38Å; I260-V263 PolarHBondContact O-N 3.13Å; I260-V263 VanDerWaalsContact O-N 3.11Å; A261-V263 VanDerWaalsContact C-N 3.31Å; A261-V263 PolarHBondContact O-N 2.71Å; V263-L265 VanDerWaalsContact C-N 3.34Å; V263-L265 PolarHBondContact O-N 2.83Å; V263-E266 PolarHBondContact O-N 3.3Å; V263-S267 WeakPolarHBondContact O-CB 3.35Å; V263-S267 PolarHBondContact O-N 3.36Å; V263-S267 PolarHBondContact O-OG 3.47Å; V263-F278 HydrophobicContact CG1-CD1 4.44Å; V263-R285 HydrophobicContact CG2-CB 3.95Å; V263-R285 HydrophobicContact CG2-CG 3.73Å
264	D	91.4	Very high	92	Very high	24 Å²	24	45 Å²	45	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-55.5	-51.6	176.6	-75.4	-31	0	0	0	110.4	I260 A261 E266 S267 E268 F278 T425	I260-D264 PolarHBondContact O-N 2.7Å; A261-D264 PolarHBondContact O-N 3.3Å; D264-E266 PolarHBondContact O-N 2.89Å; D264-S267 PolarHBondContact O-N 3.22Å; D264-S267 PolarHBondContact O-OG 2.84Å; D264-E268 PolarHBondContact O-N 3.49Å; D264-F278 WeakPolarHBondContact OD1-CE1 3.45Å; D264-T425 HydrophobicContact CB-CG2 3.61Å; D264-T425 VanDerWaalsContact OD2-CB 3.32Å; D264-T425 WeakPolarHBondContact OD2-CB 3.48Å; D264-T425 WeakPolarHBondContact OD2-CG2 3.42Å; D264-T425 PolarHBondContact OD2-OG1 3.22Å
265	L	89.8	Confident	91.4	Very high	74 Å²	74	46 Å²	46	39%	0.387	20%	0.204	S	C	.	.	H	α-helix	trans	-57.9	-49.4	178	-179.5	63	0	0	0	112.8	A261 V263 S267 V423 L430	A261-L265 PolarHBondContact O-N 3.38Å; V263-L265 VanDerWaalsContact C-N 3.34Å; V263-L265 PolarHBondContact O-N 2.83Å; L265-S267 VanDerWaalsContact C-N 3.33Å; L265-S267 PolarHBondContact O-N 3.45Å; L265-V423 HydrophobicContact CB-CG2 4.45Å; L265-V423 HydrophobicContact CD2-CG2 4.26Å; L265-L430 HydrophobicContact CB-CD2 4.01Å; L265-L430 HydrophobicContact CD1-CD1 3.5Å; L265-L430 HydrophobicContact CD1-CD2 3.9Å; L265-L430 HydrophobicContact CD1-CG 4.37Å; L265-L430 HydrophobicContact CG-CD2 4.47Å
266	E	90	Very high	91	Very high	35 Å²	35	48.1 Å²	48.1	16%	0.164	21%	0.214	C	C	.	.	H	α-helix	trans	-68.6	-35.1	-177.9	-170.3	59.3	-140	0	0	111.5	D262 V263 D264 E268 K269 Y270 L284	D262-E266 WeakPolarHBondContact O-CB 3.33Å; D262-E266 PolarHBondContact O-N 3.36Å; V263-E266 PolarHBondContact O-N 3.3Å; D264-E266 PolarHBondContact O-N 2.89Å; E266-E268 VanDerWaalsContact C-N 3.26Å; E266-E268 PolarHBondContact O-N 3.12Å; E266-K269 IonicContact OE1-NZ 2.71Å; E266-K269 PolarHBondContact OE1-NZ 2.81Å; E266-K269 IonicContact OE2-NZ 3.55Å; E266-K269 PolarHBondContact OE2-NZ 3.34Å; E266-Y270 HydrophobicContact CG-CE2 4.5Å; E266-Y270 WeakPolarHBondContact O-CD2 3.43Å; E266-L284 HydrophobicContact CG-CD1 4.39Å
267	S	89.6	Confident	90.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-20.5	-177	79.4	0	0	0	0	113.8	V263 D264 L265 K269 Y270 R277	V263-S267 WeakPolarHBondContact O-CB 3.35Å; V263-S267 PolarHBondContact O-N 3.36Å; V263-S267 PolarHBondContact O-OG 3.47Å; D264-S267 PolarHBondContact O-N 3.22Å; D264-S267 PolarHBondContact O-OG 2.84Å; L265-S267 VanDerWaalsContact C-N 3.33Å; L265-S267 PolarHBondContact O-N 3.45Å; S267-K269 PolarHBondContact O-N 3.27Å; S267-Y270 CarbonylContact O-C 3.49Å; S267-Y270 WeakPolarHBondContact O-CA 3.28Å; S267-Y270 PolarHBondContact O-N 3.33Å; S267-R277 WeakPolarHBondContact CB-O 3.39Å; S267-R277 PolarHBondContact OG-NH1 3.06Å
268	E	88.4	Confident	90.4	Very high	61 Å²	61	49.6 Å²	49.6	29%	0.285	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-57.2	-36.1	178.7	-74.5	-62.8	116.9	0	0	112.5	D264 E266 Y270 R271 R277	D264-E268 PolarHBondContact O-N 3.49Å; E266-E268 VanDerWaalsContact C-N 3.26Å; E266-E268 PolarHBondContact O-N 3.12Å; E268-Y270 PolarHBondContact O-N 2.99Å; E268-Y270 VanDerWaalsContact O-N 3.12Å; E268-R271 VanDerWaalsContact CD-NH2 3.32Å; E268-R271 WeakPolarHBondContact O-CG 3.46Å; E268-R271 PolarHBondContact O-N 2.93Å; E268-R271 IonicContact OE1-CZ 2.7Å; E268-R271 IonicContact OE1-NE 3.23Å; E268-R271 IonicContact OE1-NH2 3.48Å; E268-R271 PolarHBondContact OE1-NH2 3.38Å; E268-R271 VanDerWaalsContact OE1-NH2 3.13Å; E268-R271 IonicContact OE2-CZ 2.56Å; E268-R271 IonicContact OE2-NE 2.89Å; E268-R271 PolarHBondContact OE2-NE 2.87Å; E268-R271 IonicContact OE2-NH2 3.5Å; E268-R271 PolarHBondContact OE2-NH2 3.07Å; E268-R277 IonicContact OE1-CZ 2.72Å; E268-R277 IonicContact OE1-NH1 2.88Å; E268-R277 PolarHBondContact OE1-NH1 2.96Å; E268-R277 IonicContact OE1-NH2 2.98Å
269	K	90.5	Very high	90.3	Very high	144 Å²	144	50.7 Å²	50.7	63%	0.626	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-62.7	-20.8	176.5	-57.9	172.6	-163.5	161.9	0	112.3	E266 S267	E266-K269 IonicContact OE1-NZ 2.71Å; E266-K269 PolarHBondContact OE1-NZ 2.81Å; E266-K269 IonicContact OE2-NZ 3.55Å; E266-K269 PolarHBondContact OE2-NZ 3.34Å; S267-K269 PolarHBondContact O-N 3.27Å
270	Y	90.4	Very high	90.2	Very high	76 Å²	76	51.3 Å²	51.3	30%	0.298	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-110.9	21.2	-174.2	-51.4	-69.6	0	0	0	113.4	E266 S267 E268 R272 L273 L280 L284	E266-Y270 HydrophobicContact CG-CE2 4.5Å; E266-Y270 WeakPolarHBondContact O-CD2 3.43Å; S267-Y270 CarbonylContact O-C 3.49Å; S267-Y270 WeakPolarHBondContact O-CA 3.28Å; S267-Y270 PolarHBondContact O-N 3.33Å; E268-Y270 PolarHBondContact O-N 2.99Å; E268-Y270 VanDerWaalsContact O-N 3.12Å; Y270-R272 PolarHBondContact O-N 3.12Å; Y270-L273 HydrophobicContact CG-CD1 4.5Å; Y270-L273 WeakPolarHBondContact O-CB 3.48Å; Y270-L273 PolarHBondContact O-N 3.02Å; Y270-L280 HydrophobicContact CD1-CD2 3.85Å; Y270-L280 HydrophobicContact CD2-CD2 4.01Å; Y270-L280 HydrophobicContact CE1-CD2 4.01Å; Y270-L280 HydrophobicContact CE2-CD2 4.18Å; Y270-L280 HydrophobicContact CG-CD2 3.85Å; Y270-L284 HydrophobicContact CE2-CD1 3.91Å
271	R	86	Confident	90.1	Very high	129 Å²	129	49.7 Å²	49.7	49%	0.487	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-49.1	-28.4	177.4	-84.8	-176.7	179.1	-107.9	-1.3	114.8	E268 L273 G274	E268-R271 VanDerWaalsContact CD-NH2 3.32Å; E268-R271 WeakPolarHBondContact O-CG 3.46Å; E268-R271 PolarHBondContact O-N 2.93Å; E268-R271 IonicContact OE1-CZ 2.7Å; E268-R271 IonicContact OE1-NE 3.23Å; E268-R271 IonicContact OE1-NH2 3.48Å; E268-R271 PolarHBondContact OE1-NH2 3.38Å; E268-R271 VanDerWaalsContact OE1-NH2 3.13Å; E268-R271 IonicContact OE2-CZ 2.56Å; E268-R271 IonicContact OE2-NE 2.89Å; E268-R271 PolarHBondContact OE2-NE 2.87Å; E268-R271 IonicContact OE2-NH2 3.5Å; E268-R271 PolarHBondContact OE2-NH2 3.07Å; R271-L273 PolarHBondContact O-N 3.28Å; R271-G274 PolarHBondContact O-N 2.92Å; R271-G274 VanDerWaalsContact O-N 3.09Å
272	R	85.9	Confident	90.1	Very high	228 Å²	228	50.2 Å²	50.2	86%	0.86	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-60.9	-25	175.4	-63.4	-176.9	-177.9	-178.4	0.9	113.2	K113 Y270 G274	K113-R272 WeakPolarHBondContact CE-O 3.49Å; K113-R272 PolarHBondContact NZ-O 2.87Å; Y270-R272 PolarHBondContact O-N 3.12Å; R272-G274 VanDerWaalsContact C-N 3.29Å; R272-G274 PolarHBondContact O-N 3.47Å
273	L	86.6	Confident	90.1	Very high	81 Å²	81	51.7 Å²	51.7	42%	0.424	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-77	-12.9	177.6	-58.4	-175.8	0	0	0	113	Y270 R271 M276 R277 L280	Y270-L273 HydrophobicContact CG-CD1 4.5Å; Y270-L273 WeakPolarHBondContact O-CB 3.48Å; Y270-L273 PolarHBondContact O-N 3.02Å; R271-L273 PolarHBondContact O-N 3.28Å; L273-M276 HydrophobicContact CB-CB 4.29Å; L273-R277 HydrophobicContact CB-CB 4.49Å; L273-L280 HydrophobicContact CD1-CD2 3.67Å
274	G	86.6	Confident	90.2	Very high	10 Å²	10	54.3 Å²	54.3	10%	0.103	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	-142.5	-172	0	0	0	0	0	110.9	R271 R272 M276 R277	R271-G274 PolarHBondContact O-N 2.92Å; R271-G274 VanDerWaalsContact O-N 3.09Å; R272-G274 VanDerWaalsContact C-N 3.29Å; R272-G274 PolarHBondContact O-N 3.47Å; G274-M276 PolarHBondContact O-N 3.33Å; G274-R277 WeakPolarHBondContact O-CB 3.19Å; G274-R277 WeakPolarHBondContact O-CD 3.26Å; G274-R277 WeakPolarHBondContact O-CG 3.27Å; G274-R277 PolarHBondContact O-N 3.2Å
275	E	84.9	Confident	90.3	Very high	31 Å²	31	56.1 Å²	56.1	15%	0.145	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.3	-177.5	-74.7	171.3	167.2	0	0	113.2	S198 N200 R277 F278 S356	S198-E275 WeakPolarHBondContact O-CG 3.33Å; N200-E275 PolarHBondContact ND2-OE1 2.85Å; E275-R277 PolarHBondContact O-N 2.85Å; E275-F278 WeakPolarHBondContact O-CD2 3.28Å; E275-F278 PolarHBondContact O-N 3.41Å; E275-S356 PolarHBondContact OE1-OG 3.31Å; E275-S356 PolarHBondContact OE2-OG 3Å
276	M	88.1	Confident	90.5	Very high	45 Å²	45	53.3 Å²	53.3	22%	0.222	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-17.6	175.7	-73.2	-60.4	-64.5	0	0	114.4	Q4 L273 G274 F278 T279 L280	Q4-M276 HydrophobicContact CB-SD 4.47Å; Q4-M276 PolarHBondContact OE1-SD 2.9Å; L273-M276 HydrophobicContact CB-CB 4.29Å; G274-M276 PolarHBondContact O-N 3.33Å; M276-F278 PolarHBondContact O-N 3.37Å; M276-T279 HydrophobicContact CE-CG2 4.37Å; M276-T279 PolarHBondContact O-N 3.18Å; M276-L280 PolarHBondContact O-N 2.79Å
277	R	90.7	Very high	90.7	Very high	15 Å²	15	54.9 Å²	54.9	6%	0.057	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-34.5	174.1	74.1	-174.9	-172.3	121.1	-12.6	112.5	S267 E268 L273 G274 E275 G281	S267-R277 WeakPolarHBondContact CB-O 3.39Å; S267-R277 PolarHBondContact OG-NH1 3.06Å; E268-R277 IonicContact OE1-CZ 2.72Å; E268-R277 IonicContact OE1-NH1 2.88Å; E268-R277 PolarHBondContact OE1-NH1 2.96Å; E268-R277 IonicContact OE1-NH2 2.98Å; L273-R277 HydrophobicContact CB-CB 4.49Å; G274-R277 WeakPolarHBondContact O-CB 3.19Å; G274-R277 WeakPolarHBondContact O-CD 3.26Å; G274-R277 WeakPolarHBondContact O-CG 3.27Å; G274-R277 PolarHBondContact O-N 3.2Å; E275-R277 PolarHBondContact O-N 2.85Å; R277-G281 PolarHBondContact O-N 2.89Å
278	F	91.1	Very high	90.9	Very high	18 Å²	18	57.3 Å²	57.3	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-73.7	-38.9	-178.3	-63.4	-60.7	0	0	0	111.2	S198 V263 D264 E275 M276 G281 T282 M358	S198-F278 WeakPolarHBondContact O-CE2 3.28Å; V263-F278 HydrophobicContact CG1-CD1 4.44Å; D264-F278 WeakPolarHBondContact OD1-CE1 3.45Å; E275-F278 WeakPolarHBondContact O-CD2 3.28Å; E275-F278 PolarHBondContact O-N 3.41Å; M276-F278 PolarHBondContact O-N 3.37Å; F278-G281 PolarHBondContact O-N 3.29Å; F278-T282 VanDerWaalsContact O-CB 3.29Å; F278-T282 WeakPolarHBondContact O-CB 3.14Å; F278-T282 PolarHBondContact O-N 2.82Å; F278-T282 PolarHBondContact O-OG1 3.25Å; F278-M358 HydrophobicContact CB-CE 4.26Å; F278-M358 HydrophobicContact CD2-CE 4.16Å; F278-M358 HydrophobicContact CG-CE 4.36Å
279	T	92.8	Very high	91.1	Very high	22 Å²	22	56.3 Å²	56.3	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-46.6	173	-58.1	0	0	0	0	111.3	M276 T282 F283 F389	M276-T279 HydrophobicContact CE-CG2 4.37Å; M276-T279 PolarHBondContact O-N 3.18Å; T279-T282 PolarHBondContact O-N 2.79Å; T279-F283 HydrophobicContact CG2-CD2 4.14Å; T279-F283 HydrophobicContact CG2-CE2 3.52Å; T279-F283 HydrophobicContact CG2-CZ 4.07Å; T279-F283 VanDerWaalsContact O-CD2 3.27Å; T279-F283 WeakPolarHBondContact O-CD2 3.4Å; T279-F283 PolarHBondContact O-N 3.08Å; T279-F283 VanDerWaalsContact O-N 3.07Å; T279-F389 HydrophobicContact CG2-CE1 4.24Å; T279-F389 HydrophobicContact CG2-CZ 4.41Å
280	L	93.6	Very high	91.3	Very high	32 Å²	32	53.5 Å²	53.5	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-48.6	175.7	179	61.2	0	0	0	111.7	F8 Y270 L273 M276 T282 F283 L284	F8-L280 HydrophobicContact CE2-CD1 4.44Å; F8-L280 HydrophobicContact CZ-CD1 3.85Å; Y270-L280 HydrophobicContact CD1-CD2 3.85Å; Y270-L280 HydrophobicContact CD2-CD2 4.01Å; Y270-L280 HydrophobicContact CE1-CD2 4.01Å; Y270-L280 HydrophobicContact CE2-CD2 4.18Å; Y270-L280 HydrophobicContact CG-CD2 3.85Å; L273-L280 HydrophobicContact CD1-CD2 3.67Å; M276-L280 PolarHBondContact O-N 2.79Å; L280-T282 VanDerWaalsContact C-N 3.27Å; L280-T282 PolarHBondContact O-N 2.79Å; L280-F283 PolarHBondContact O-N 2.88Å; L280-L284 HydrophobicContact CD1-CD1 4.4Å; L280-L284 HydrophobicContact CD1-CG 4.38Å; L280-L284 HydrophobicContact CG-CD1 4.17Å; L280-L284 WeakPolarHBondContact O-CG 3.12Å; L280-L284 PolarHBondContact O-N 3Å
281	G	93.8	Very high	91.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.6	-41.4	177.2	0	0	0	0	0	112	R277 F278 L284 R285	R277-G281 PolarHBondContact O-N 2.89Å; F278-G281 PolarHBondContact O-N 3.29Å; G281-L284 PolarHBondContact O-N 3.26Å; G281-R285 WeakPolarHBondContact O-CB 3.35Å; G281-R285 WeakPolarHBondContact O-CG 3.25Å; G281-R285 PolarHBondContact O-N 3.41Å
282	T	94.3	Very high	91.9	Very high	11 Å²	11	47.3 Å²	47.3	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-47.7	175.4	-63.2	0	0	0	0	111.6	F259 F278 T279 L280 L284 R285 L286 F389	F259-T282 HydrophobicContact CE1-CG2 4Å; F259-T282 HydrophobicContact CZ-CG2 4.03Å; F278-T282 VanDerWaalsContact O-CB 3.29Å; F278-T282 WeakPolarHBondContact O-CB 3.14Å; F278-T282 PolarHBondContact O-N 2.82Å; F278-T282 PolarHBondContact O-OG1 3.25Å; T279-T282 PolarHBondContact O-N 2.79Å; L280-T282 VanDerWaalsContact C-N 3.27Å; L280-T282 PolarHBondContact O-N 2.79Å; T282-L284 PolarHBondContact O-N 2.82Å; T282-R285 PolarHBondContact O-N 3.2Å; T282-L286 WeakPolarHBondContact O-CB 3.32Å; T282-L286 PolarHBondContact O-N 2.91Å; T282-F389 HydrophobicContact CG2-CD1 3.89Å; T282-F389 HydrophobicContact CG2-CD2 3.81Å; T282-F389 HydrophobicContact CG2-CE1 4.01Å; T282-F389 HydrophobicContact CG2-CE2 3.94Å; T282-F389 HydrophobicContact CG2-CG 3.79Å; T282-F389 HydrophobicContact CG2-CZ 4.04Å
283	F	94.6	Very high	92.4	Very high	42 Å²	42	41.4 Å²	41.4	18%	0.184	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-42.2	177.4	-68.1	-45.2	0	0	0	112.6	T279 L280 L286 A287 L386	T279-F283 HydrophobicContact CG2-CD2 4.14Å; T279-F283 HydrophobicContact CG2-CE2 3.52Å; T279-F283 HydrophobicContact CG2-CZ 4.07Å; T279-F283 VanDerWaalsContact O-CD2 3.27Å; T279-F283 WeakPolarHBondContact O-CD2 3.4Å; T279-F283 PolarHBondContact O-N 3.08Å; T279-F283 VanDerWaalsContact O-N 3.07Å; L280-F283 PolarHBondContact O-N 2.88Å; F283-L286 PolarHBondContact O-N 2.98Å; F283-A287 PolarHBondContact O-N 3.1Å; F283-L386 HydrophobicContact CD1-CD1 4.28Å; F283-L386 HydrophobicContact CE1-CD1 3.64Å
284	L	94.3	Very high	92.8	Very high	63 Å²	63	37.5 Å²	37.5	33%	0.33	20%	0.198	S	C	.	.	H	α-helix	trans	-63.2	-42.9	177.6	-67.5	173.8	0	0	0	111.9	E266 Y270 L280 G281 T282 A288	E266-L284 HydrophobicContact CG-CD1 4.39Å; Y270-L284 HydrophobicContact CE2-CD1 3.91Å; L280-L284 HydrophobicContact CD1-CD1 4.4Å; L280-L284 HydrophobicContact CD1-CG 4.38Å; L280-L284 HydrophobicContact CG-CD1 4.17Å; L280-L284 WeakPolarHBondContact O-CG 3.12Å; L280-L284 PolarHBondContact O-N 3Å; G281-L284 PolarHBondContact O-N 3.26Å; T282-L284 PolarHBondContact O-N 2.82Å; L284-A288 PolarHBondContact O-N 2.89Å
285	R	94.2	Very high	93.3	Very high	61 Å²	61	43.2 Å²	43.2	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-72.5	-30.5	176.5	-67.1	-59.2	77.8	-179.5	0.4	112.9	F259 D262 V263 G281 T282 A288 L289	F259-R285 HydrophobicContact CD2-CB 4.18Å; F259-R285 HydrophobicContact CE2-CB 3.64Å; F259-R285 HydrophobicContact CZ-CB 3.89Å; D262-R285 HydrophobicContact CB-CG 4.34Å; D262-R285 IonicContact OD2-NH1 3.51Å; V263-R285 HydrophobicContact CG2-CB 3.95Å; V263-R285 HydrophobicContact CG2-CG 3.73Å; G281-R285 WeakPolarHBondContact O-CB 3.35Å; G281-R285 WeakPolarHBondContact O-CG 3.25Å; G281-R285 PolarHBondContact O-N 3.41Å; T282-R285 PolarHBondContact O-N 3.2Å; R285-A288 CarbonylContact O-C 3.58Å; R285-A288 PolarHBondContact O-N 3.43Å; R285-L289 VanDerWaalsContact O-CA 3.28Å; R285-L289 WeakPolarHBondContact O-CA 3.46Å; R285-L289 PolarHBondContact O-N 3.38Å
286	L	94.4	Very high	94	Very high	16 Å²	16	41.8 Å²	41.8	8%	0.084	21%	0.209	C	C	.	.	H	α-helix	trans	-70.7	-36.6	175.5	-167.2	69.1	0	0	0	112.1	F259 T282 F283 A288 L289 R382 L385 L386	F259-L286 HydrophobicContact CE2-CB 4.41Å; F259-L286 HydrophobicContact CE2-CD1 4.39Å; F259-L286 HydrophobicContact CZ-CB 4.29Å; F259-L286 HydrophobicContact CZ-CD1 4.47Å; T282-L286 WeakPolarHBondContact O-CB 3.32Å; T282-L286 PolarHBondContact O-N 2.91Å; F283-L286 PolarHBondContact O-N 2.98Å; L286-A288 VanDerWaalsContact C-N 3.28Å; L286-A288 PolarHBondContact O-N 2.88Å; L286-L289 PolarHBondContact O-N 2.95Å; L286-R382 HydrophobicContact CD1-CB 4.19Å; L286-R382 HydrophobicContact CD1-CG 4.46Å; L286-R382 HydrophobicContact CG-CB 4.26Å; L286-R382 WeakPolarHBondContact O-CD 3.41Å; L286-L385 HydrophobicContact CD1-CB 3.63Å; L286-L385 HydrophobicContact CD1-CD1 3.94Å; L286-L385 HydrophobicContact CD1-CG 4.47Å; L286-L386 HydrophobicContact CD2-CB 3.73Å; L286-L386 HydrophobicContact CD2-CD1 4.2Å; L286-L386 HydrophobicContact CD2-CG 4.4Å
287	A	93.6	Very high	94.5	Very high	68 Å²	68	40 Å²	40	56%	0.562	20%	0.202	S	C	*	.	H	α-helix	trans	-64.4	-34.3	173.2	0	0	0	0	0	112.3	F283 R382	F283-A287 PolarHBondContact O-N 3.1Å; A287-R382 VanDerWaalsContact O-CZ 3.29Å; A287-R382 PolarHBondContact O-NH1 3.28Å; A287-R382 PolarHBondContact O-NH2 3.26Å
288	A	93.4	Very high	94.8	Very high	51 Å²	51	39.9 Å²	39.9	42%	0.421	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	42.8	176.6	0	0	0	0	0	112.2	L284 R285 L286 R290	L284-A288 PolarHBondContact O-N 2.89Å; R285-A288 CarbonylContact O-C 3.58Å; R285-A288 PolarHBondContact O-N 3.43Å; L286-A288 VanDerWaalsContact C-N 3.28Å; L286-A288 PolarHBondContact O-N 2.88Å; A288-R290 PolarHBondContact O-N 3.06Å
289	L	94.5	Very high	95.1	Very high	39 Å²	39	39 Å²	39	20%	0.204	20%	0.198	C	C	.	.			trans	-58	131.4	-175.8	-176.2	67.8	0	0	0	111.3	F259 R285 L286 V344 R382 L385	F259-L289 HydrophobicContact CD2-CD1 3.71Å; F259-L289 HydrophobicContact CE2-CD1 3.89Å; R285-L289 VanDerWaalsContact O-CA 3.28Å; R285-L289 WeakPolarHBondContact O-CA 3.46Å; R285-L289 PolarHBondContact O-N 3.38Å; L286-L289 PolarHBondContact O-N 2.95Å; L289-V344 HydrophobicContact CD1-CG1 3.92Å; L289-R382 HydrophobicContact CB-CG 4.1Å; L289-R382 HydrophobicContact CD2-CG 3.75Å; L289-L385 HydrophobicContact CD1-CD1 3.66Å; L289-L385 HydrophobicContact CD2-CD1 3.68Å; L289-L385 HydrophobicContact CG-CD1 4.35Å
290	R	93.4	Very high	95.3	Very high	86 Å²	86	39 Å²	39	33%	0.325	20%	0.198	S	C	.	.			trans	-132.9	158.4	177.8	58.6	-175.2	-96.5	-155.1	2.2	110.1	D262 A288 Y292	D262-R290 IonicContact OD1-NH1 3.9Å; D262-R290 IonicContact OD2-CZ 2.7Å; D262-R290 IonicContact OD2-NE 2.94Å; D262-R290 IonicContact OD2-NH1 3.79Å; D262-R290 PolarHBondContact OD2-NH1 3.16Å; A288-R290 PolarHBondContact O-N 3.06Å; R290-Y292 HydrophobicContact CG-CE1 4.48Å; R290-Y292 HydrophobicContact CG-CE2 3.95Å; R290-Y292 WeakPolarHBondContact CG-OH 3.37Å; R290-Y292 VanDerWaalsContact NE-CE1 3.31Å; R290-Y292 PolarHBondContact NE-OH 2.83Å
291	T	95.1	Very high	95.2	Very high	71 Å²	71	40.2 Å²	40.2	44%	0.436	21%	0.207	S	C	.	.			trans	-102	164.9	169.2	54.5	0	0	0	0	110.1	F343 V344 A378	T291-F343 CarbonylContact C-O 3.54Å; T291-F343 VanDerWaalsContact CA-O 3.31Å; T291-F343 WeakPolarHBondContact CA-O 3.33Å; T291-V344 HydrophobicContact CG2-CG2 4.32Å; T291-A378 HydrophobicContact CG2-CB 3.76Å
292	Y	95.1	Very high	94.9	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.016	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.8	-177.3	-54.3	-102.1	0	0	0	107.5	W257 G258 D262 R290 F343 V344	W257-Y292 VanDerWaalsContact CH2-CB 3.44Å; W257-Y292 WeakPolarHBondContact CH2-O 3.32Å; W257-Y292 VanDerWaalsContact CZ2-CB 3.49Å; W257-Y292 HydrophobicContact CZ2-CG 4.46Å; G258-Y292 VanDerWaalsContact C-CZ 3.47Å; G258-Y292 VanDerWaalsContact CA-CD2 3.49Å; G258-Y292 VanDerWaalsContact CA-CZ 3.42Å; D262-Y292 PolarHBondContact OD2-OH 3.25Å; R290-Y292 HydrophobicContact CG-CE1 4.48Å; R290-Y292 HydrophobicContact CG-CE2 3.95Å; R290-Y292 WeakPolarHBondContact CG-OH 3.37Å; R290-Y292 VanDerWaalsContact NE-CE1 3.31Å; R290-Y292 PolarHBondContact NE-OH 2.83Å; Y292-F343 WeakPolarHBondContact CD2-O 3.35Å; Y292-F343 PolarHBondContact N-O 3.34Å; Y292-F343 PolarHBondContact O-N 2.76Å; Y292-V344 WeakPolarHBondContact CD2-O 3.41Å; Y292-V344 WeakPolarHBondContact CE2-O 3.24Å
293	R	95.9	Very high	94.3	Very high	103 Å²	103	49.7 Å²	49.7	39%	0.389	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	130.2	178.9	-163.3	179.9	171.3	147.8	11.3	110.8	Q341 E418 D419	R293-Q341 CarbonylContact C-O 3.43Å; R293-Q341 VanDerWaalsContact CA-O 3.23Å; R293-Q341 WeakPolarHBondContact CA-O 3.36Å; R293-E418 WeakPolarHBondContact CD-OE2 3.13Å; R293-E418 HydrophobicContact CG-CB 4.27Å; R293-E418 IonicContact CZ-OE2 2.88Å; R293-E418 IonicContact NE-OE2 3.68Å; R293-E418 PolarHBondContact NE-OE2 3.32Å; R293-E418 IonicContact NH2-OE2 2.78Å; R293-E418 PolarHBondContact O-N 3.26Å; R293-D419 VanDerWaalsContact CB-CG 3.45Å; R293-D419 WeakPolarHBondContact CB-OD2 3.17Å; R293-D419 WeakPolarHBondContact CD-OD1 3.45Å
294	G	95.6	Very high	93.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	172.5	178.9	0	0	0	0	0	112.4	Q341 F343 E416	G294-Q341 PolarHBondContact N-O 2.94Å; G294-Q341 CarbonylContact O-C 3.6Å; G294-Q341 WeakPolarHBondContact O-CA 3.4Å; G294-F343 WeakPolarHBondContact O-CE2 3.38Å; G294-E416 CarbonylContact C-O 3.51Å; G294-E416 WeakPolarHBondContact CA-O 3.3Å
295	R	96.9	Very high	91.9	Very high	129 Å²	129	49.8 Å²	49.8	49%	0.487	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.1	176	-58.5	179.2	-172.4	174.7	4.2	109.7	L415 E416 E418	R295-L415 CarbonylContact O-C 3.57Å; R295-L415 WeakPolarHBondContact O-CA 3.47Å; R295-L415 WeakPolarHBondContact O-CD1 3.42Å; R295-E416 HydrophobicContact CB-CB 4.32Å; R295-E416 PolarHBondContact N-O 3.41Å; R295-E416 PolarHBondContact O-N 3.04Å; R295-E418 IonicContact CZ-OE1 3.2Å; R295-E418 IonicContact NE-OE1 2.75Å; R295-E418 PolarHBondContact NE-OE1 2.84Å; R295-E418 IonicContact NH2-OE1 3.72Å; R295-E418 PolarHBondContact NH2-OE1 3.35Å
296	L	98.1	Very high	89.9	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.2	176.4	179	60.7	0	0	0	109.5	V338 F343 V346 L373 Y375 F413 L415	L296-V338 HydrophobicContact CB-CB 4.24Å; L296-V338 HydrophobicContact CB-CG2 4.09Å; L296-V338 HydrophobicContact CD2-CG2 4.1Å; L296-V338 HydrophobicContact CG-CG2 4.01Å; L296-V338 WeakPolarHBondContact O-CB 3.37Å; L296-V338 WeakPolarHBondContact O-CG2 3.24Å; L296-V338 PolarHBondContact O-N 3.41Å; L296-F343 HydrophobicContact CB-CE2 4.33Å; L296-F343 HydrophobicContact CB-CZ 3.89Å; L296-F343 HydrophobicContact CD2-CE1 4.32Å; L296-V346 HydrophobicContact CD1-CG1 4.08Å; L296-V346 HydrophobicContact CD2-CG1 3.96Å; L296-V346 HydrophobicContact CD2-CG2 4.11Å; L296-L373 HydrophobicContact CD2-CD2 4.48Å; L296-Y375 HydrophobicContact CD2-CD1 3.7Å; L296-Y375 HydrophobicContact CD2-CE1 4.27Å; L296-Y375 HydrophobicContact CD2-CG 3.92Å; L296-F413 HydrophobicContact CD1-CD2 4.45Å; L296-L415 HydrophobicContact CB-CD1 4.41Å; L296-L415 HydrophobicContact CD1-CB 4.37Å; L296-L415 HydrophobicContact CD1-CD1 4.44Å
297	A	98.4	Very high	88.2	Confident	7 Å²	7	57.9 Å²	57.9	6%	0.058	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.9	169	0	0	0	0	0	109.9	V331 W335 T336 V337 F413 R414	A297-V331 HydrophobicContact CB-CB 4.49Å; A297-V331 HydrophobicContact CB-CG1 4.05Å; A297-V331 HydrophobicContact CB-CG2 3.96Å; A297-W335 HydrophobicContact CB-CE3 4.21Å; A297-T336 CarbonylContact C-O 3.52Å; A297-T336 VanDerWaalsContact CA-O 3.26Å; A297-T336 WeakPolarHBondContact CA-O 3.46Å; A297-V337 HydrophobicContact CB-CG2 4.22Å; A297-F413 CarbonylContact O-C 3.55Å; A297-F413 VanDerWaalsContact O-CA 3.3Å; A297-F413 WeakPolarHBondContact O-CA 3.37Å; A297-R414 PolarHBondContact N-O 3.23Å; A297-R414 PolarHBondContact O-N 3.12Å
298	Y	98.3	Very high	86.7	Confident	13 Å²	13	58.6 Å²	58.6	5%	0.051	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	156.4	179.6	60.3	-97	0	0	0	113.3	P300 T336 V338 L373 Y375 M408 V410 A412	Y298-P300 HydrophobicContact CD2-CB 4.44Å; Y298-P300 HydrophobicContact CE2-CB 4.35Å; Y298-P300 HydrophobicContact CE2-CG 4.48Å; Y298-P300 WeakPolarHBondContact O-CD 3.46Å; Y298-T336 HydrophobicContact CE1-CG2 4.27Å; Y298-T336 HydrophobicContact CE2-CG2 4.14Å; Y298-T336 PolarHBondContact N-O 3.28Å; Y298-T336 PolarHBondContact O-N 3.19Å; Y298-V338 HydrophobicContact CD1-CG2 4.09Å; Y298-V338 HydrophobicContact CE1-CG2 3.59Å; Y298-L373 HydrophobicContact CD1-CD2 3.58Å; Y298-L373 HydrophobicContact CE1-CD2 4.38Å; Y298-L373 HydrophobicContact CG-CD2 3.67Å; Y298-Y375 HydrophobicContact CE1-CE1 4.26Å; Y298-M408 HydrophobicContact CE2-CB 4.18Å; Y298-M408 HydrophobicContact CE2-CG 4.04Å; Y298-V410 HydrophobicContact CD2-CG1 3.55Å; Y298-V410 HydrophobicContact CE2-CG1 4.35Å; Y298-V410 HydrophobicContact CG-CG1 3.93Å; Y298-A412 WeakPolarHBondContact CA-O 3.49Å
299	L	97.6	Very high	85.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	102.8	173.2	-178	54.9	0	0	0	109.5	R303 A304 H323 H334 W335 V410 V411 A412	L299-R303 HydrophobicContact CD1-CB 3.99Å; L299-A304 HydrophobicContact CD2-CB 4.4Å; L299-A304 HydrophobicContact CG-CB 4.44Å; L299-H323 HydrophobicContact CD2-CB 4.09Å; L299-H334 VanDerWaalsContact CD1-CD2 3.44Å; L299-H334 WeakPolarHBondContact CD1-CD2 3.39Å; L299-W335 HydrophobicContact CB-CD2 4.05Å; L299-W335 HydrophobicContact CB-CG 4.3Å; L299-W335 HydrophobicContact CB-CZ2 4.13Å; L299-V410 WeakPolarHBondContact O-CA 3.45Å; L299-V410 WeakPolarHBondContact O-CB 3.43Å; L299-V411 HydrophobicContact CB-CG2 4.02Å; L299-V411 HydrophobicContact CD2-CG2 3.58Å; L299-V411 HydrophobicContact CG-CG2 3.63Å; L299-V411 PolarHBondContact O-N 3.08Å; L299-A412 HydrophobicContact CB-CB 4.15Å; L299-A412 PolarHBondContact N-O 2.84Å
300	P	96.4	Very high	83.6	Confident	21 Å²	21	62.5 Å²	62.5	14%	0.136	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	149.5	177.7	29	-34	0	0	0	111	Y298 G302 R303 A304	Y298-P300 HydrophobicContact CD2-CB 4.44Å; Y298-P300 HydrophobicContact CE2-CB 4.35Å; Y298-P300 HydrophobicContact CE2-CG 4.48Å; Y298-P300 WeakPolarHBondContact O-CD 3.46Å; P300-G302 PolarHBondContact O-N 2.84Å; P300-G302 VanDerWaalsContact O-N 3.13Å; P300-R303 HydrophobicContact CG-CB 4.07Å; P300-R303 HydrophobicContact CG-CG 3.98Å; P300-R303 PolarHBondContact O-N 3.04Å; P300-A304 PolarHBondContact O-N 3.18Å
301	V	92.1	Very high	82.2	Confident	59 Å²	59	62 Å²	62	36%	0.358	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-52	-41.1	-177	179.4	0	0	0	0	112.5	R303 A304 V370 P409 V411	V301-R303 PolarHBondContact O-N 2.87Å; V301-A304 WeakPolarHBondContact O-CB 3.32Å; V301-A304 PolarHBondContact O-N 3.38Å; V301-V370 HydrophobicContact CG1-CG2 4.18Å; V301-V370 HydrophobicContact CG2-CB 4.15Å; V301-V370 HydrophobicContact CG2-CG1 3.55Å; V301-V370 HydrophobicContact CG2-CG2 3.55Å; V301-P409 HydrophobicContact CG2-CB 4.03Å; V301-P409 PolarHBondContact N-O 3.16Å; V301-V411 HydrophobicContact CG2-CG1 4Å
302	G	86	Confident	81.2	Confident	81 Å²	81	60.8 Å²	60.8	84%	0.835	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-66.1	-15.4	-179.7	0	0	0	0	0	115.4	P300	P300-G302 PolarHBondContact O-N 2.84Å; P300-G302 VanDerWaalsContact O-N 3.13Å
303	R	83.3	Confident	80.3	Confident	128 Å²	128	61.6 Å²	61.6	48%	0.483	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-105.9	-8.7	177.8	-67.7	-171	-178.8	177.5	1.3	113.7	L299 P300 V301 G305 S306 H334 T336	L299-R303 HydrophobicContact CD1-CB 3.99Å; P300-R303 HydrophobicContact CG-CB 4.07Å; P300-R303 HydrophobicContact CG-CG 3.98Å; P300-R303 PolarHBondContact O-N 3.04Å; V301-R303 PolarHBondContact O-N 2.87Å; R303-G305 PolarHBondContact O-N 2.9Å; R303-S306 WeakPolarHBondContact O-CB 3.46Å; R303-S306 PolarHBondContact O-N 3.03Å; R303-S306 PolarHBondContact O-OG 3.26Å; R303-H334 VanDerWaalsContact CD-O 3.29Å; R303-H334 WeakPolarHBondContact CD-O 3.5Å; R303-H334 PolarHBondContact NH1-O 2.84Å; R303-T336 PolarHBondContact NH1-OG1 3.25Å
304	A	72.9	Confident	79.3	Confident	24 Å²	24	63.3 Å²	63.3	20%	0.198	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.2	-177.3	0	0	0	0	0	113.9	L299 P300 V301 S306 V411	L299-A304 HydrophobicContact CD2-CB 4.4Å; L299-A304 HydrophobicContact CG-CB 4.44Å; P300-A304 PolarHBondContact O-N 3.18Å; V301-A304 WeakPolarHBondContact O-CB 3.32Å; V301-A304 PolarHBondContact O-N 3.38Å; A304-S306 PolarHBondContact O-N 3.39Å; A304-V411 HydrophobicContact CB-CG1 4.1Å; A304-V411 HydrophobicContact CB-CG2 3.75Å
305	G	63.8	Low	78.3	Confident	84 Å²	84	64.9 Å²	64.9	87%	0.866	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-4.7	173.5	0	0	0	0	0	114.9	R303	R303-G305 PolarHBondContact O-N 2.9Å
306	S	53.1	Low	76.7	Confident	47 Å²	47	68.6 Å²	68.6	33%	0.329	42%	0.415	S	S	.	.	S	Bend	trans	-78.6	144.8	171.2	64	0	0	0	0	110.5	R303 A304 T308 H334	R303-S306 WeakPolarHBondContact O-CB 3.46Å; R303-S306 PolarHBondContact O-N 3.03Å; R303-S306 PolarHBondContact O-OG 3.26Å; A304-S306 PolarHBondContact O-N 3.39Å; S306-T308 PolarHBondContact O-N 3.39Å; S306-H334 PolarHBondContact OG-CD2 3.47Å
307	K	57.9	Low	75.6	Confident	199 Å²	199	72.3 Å²	72.3	87%	0.865	43%	0.432	S	S	*	.			trans	-40.5	132.6	-168.9	-64	176.8	179.7	178.4	0	113.1
308	T	63.8	Low	74.4	Confident	84 Å²	84	73.1 Å²	73.1	52%	0.515	44%	0.441	S	S	.	.			trans	-59.6	143	171.3	47.6	0	0	0	0	110.7	S306 A322	S306-T308 PolarHBondContact O-N 3.39Å; T308-A322 HydrophobicContact CG2-CB 4.19Å
309	P	63.3	Low	73.9	Confident	23 Å²	23	73.1 Å²	73.1	15%	0.149	44%	0.443	C	S	.	.			trans	-45.2	142.4	172.3	-24.5	23.9	0	0	0	113.4	S311 A322 V325 P332	P309-S311 VanDerWaalsContact C-N 3.25Å; P309-S311 PolarHBondContact O-N 2.97Å; P309-A322 VanDerWaalsContact CD-O 3.24Å; P309-A322 WeakPolarHBondContact CD-O 3.29Å; P309-V325 HydrophobicContact CB-CG1 3.76Å; P309-V325 HydrophobicContact CG-CG1 3.96Å; P309-P332 HydrophobicContact CG-CG 4.06Å
310	T	58.8	Low	73.6	Confident	149 Å²	149	77.5 Å²	77.5	91%	0.914	47%	0.47	S	S	*	.	S	Bend	trans	-67	-23.4	178.3	16.9	0	0	0	0	113.7
311	S	64.1	Low	73.4	Confident	76 Å²	76	76.5 Å²	76.5	53%	0.531	46%	0.463	S	S	.	.	S	Bend	trans	-138.7	87	179.3	-60	0	0	0	0	109.9	P309	P309-S311 VanDerWaalsContact C-N 3.25Å; P309-S311 PolarHBondContact O-N 2.97Å
312	P	74.3	Confident	73.3	Confident	45 Å²	45	75.2 Å²	75.2	29%	0.292	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-69.2	164.2	175.3	29	-33.7	0	0	0	111.5	V314 V320 L324	P312-V314 PolarHBondContact O-N 3.17Å; P312-V320 HydrophobicContact CB-CG1 4.43Å; P312-V320 HydrophobicContact CG-CG1 4.2Å; P312-L324 CarbonylContact C-O 3.52Å; P312-L324 WeakPolarHBondContact CA-O 3.34Å
313	V	76.4	Confident	73.6	Confident	20 Å²	20	73 Å²	73	12%	0.121	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-49.9	129.2	174.8	177.8	0	0	0	0	110.3	V315 L324 V325	V313-V315 WeakPolarHBondContact O-CG2 3.44Å; V313-V315 PolarHBondContact O-N 2.96Å; V313-L324 HydrophobicContact CG2-CB 3.8Å; V313-L324 PolarHBondContact N-O 3.46Å; V313-V325 VanDerWaalsContact CG2-O 3.31Å; V313-V325 WeakPolarHBondContact CG2-O 3.32Å
314	V	74.4	Confident	74.2	Confident	139 Å²	139	66.9 Å²	66.9	84%	0.842	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-71	120.5	175	-179.7	0	0	0	0	108.7	P312	P312-V314 PolarHBondContact O-N 3.17Å
315	V	74.8	Confident	75.2	Confident	33 Å²	33	66.2 Å²	66.2	20%	0.2	40%	0.397	C	S	.	.			trans	-111	130.9	-179.3	-166.7	0	0	0	0	109.9	V313 Q317	V313-V315 WeakPolarHBondContact O-CG2 3.44Å; V313-V315 PolarHBondContact O-N 2.96Å; V315-Q317 WeakPolarHBondContact CG1-O 3.41Å
316	Q	64	Low	76.6	Confident	208 Å²	208	63.8 Å²	63.8	97%	0.972	37%	0.366	S	S	*	.	S	Bend	trans	-68.5	-33.3	176.9	-73.2	-177.4	-7	0	0	113.2
317	Q	73.3	Confident	78.6	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.364	36%	0.357	S	S	.	.	S	Bend	trans	-143.1	127.3	-179.1	-168.3	168.5	-7.1	0	0	108.2	E179 R180 R248 V315	E179-Q317 PolarHBondContact O-NE2 2.94Å; R180-Q317 PolarHBondContact O-NE2 3.24Å; R248-Q317 PolarHBondContact NH2-O 3.38Å; V315-Q317 WeakPolarHBondContact CG1-O 3.41Å
318	G	73.8	Confident	80.3	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	35%	0.35	C	S	.	.	S	Bend	trans	-55.2	174.2	-171.9	0	0	0	0	0	114.9	W183 R248	W183-G318 VanDerWaalsContact CZ2-C 3.43Å; R248-G318 VanDerWaalsContact NH2-C 3.31Å; R248-G318 PolarHBondContact NH2-O 3.38Å
319	P	87.4	Confident	81.8	Confident	13 Å²	13	61.2 Å²	61.2	8%	0.084	35%	0.347	C	S	.	.			cis	-71.9	161.2	-0.6	26.5	-34.3	0	0	0	114.6	W183 R248 Y444	W183-P319 HydrophobicContact CH2-CB 4.41Å; R248-P319 VanDerWaalsContact NH2-CD 3.31Å; R248-P319 PolarHBondContact NH2-O 3Å; P319-Y444 HydrophobicContact CB-CE2 4.38Å; P319-Y444 WeakPolarHBondContact CB-OH 3.2Å; P319-Y444 VanDerWaalsContact CD-OH 3.28Å; P319-Y444 WeakPolarHBondContact CD-OH 3.1Å; P319-Y444 HydrophobicContact CG-CE1 4.4Å; P319-Y444 HydrophobicContact CG-CE2 4.3Å; P319-Y444 WeakPolarHBondContact CG-OH 3.43Å
320	V	90.8	Very high	83.3	Confident	92 Å²	92	65.6 Å²	65.6	56%	0.558	38%	0.375	S	S	*	.			trans	-78.5	127.4	172.4	-178.6	0	0	0	0	109.2	P312 A322	P312-V320 HydrophobicContact CB-CG1 4.43Å; P312-V320 HydrophobicContact CG-CG1 4.2Å; V320-A322 VanDerWaalsContact C-N 3.34Å; V320-A322 PolarHBondContact O-N 3.07Å; V320-A322 VanDerWaalsContact O-N 3.15Å
321	D	93	Very high	85	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.34	C	S	.	.			trans	-88.5	75.7	175.2	-64.4	-61.5	0	0	0	110.2	S240 H242 R248 H323 L324 Q439 H441	S240-D321 WeakPolarHBondContact CB-OD1 3.45Å; S240-D321 PolarHBondContact OG-OD1 3.36Å; S240-D321 PolarHBondContact OG-OD2 3.18Å; H242-D321 IonicContact CD2-OD2 2.92Å; H242-D321 IonicContact CE1-OD2 2.7Å; H242-D321 IonicContact NE2-OD2 2.87Å; H242-D321 PolarHBondContact NE2-OD2 3.46Å; R248-D321 IonicContact CZ-OD2 3.96Å; R248-D321 IonicContact NH1-OD2 3.85Å; R248-D321 PolarHBondContact NH1-OD2 3.28Å; R248-D321 IonicContact NH2-OD2 3.64Å; D321-H323 PolarHBondContact O-N 2.88Å; D321-H323 VanDerWaalsContact O-N 3.1Å; D321-L324 HydrophobicContact CB-CB 4.16Å; D321-L324 HydrophobicContact CB-CD1 3.63Å; D321-L324 HydrophobicContact CB-CG 3.86Å; D321-L324 PolarHBondContact O-N 3.06Å; D321-Q439 HydrophobicContact CB-CB 4.38Å; D321-H441 IonicContact OD1-CD2 3.18Å; D321-H441 IonicContact OD1-CE1 3.64Å; D321-H441 PolarHBondContact OD1-CE1 3.19Å; D321-H441 IonicContact OD1-NE2 3.39Å; D321-H441 PolarHBondContact OD1-NE2 3.27Å
322	A	90.6	Very high	86.5	Confident	32 Å²	32	57.3 Å²	57.3	26%	0.264	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	-170.1	0	0	0	0	0	115.1	T308 P309 V320	T308-A322 HydrophobicContact CG2-CB 4.19Å; P309-A322 VanDerWaalsContact CD-O 3.24Å; P309-A322 WeakPolarHBondContact CD-O 3.29Å; V320-A322 VanDerWaalsContact C-N 3.34Å; V320-A322 PolarHBondContact O-N 3.07Å; V320-A322 VanDerWaalsContact O-N 3.15Å
323	H	92.6	Very high	87.4	Confident	34 Å²	34	61.3 Å²	61.3	16%	0.157	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-12.8	178	-61.9	-56.5	0	0	0	113.3	L299 D321 W335 A412 Q439	L299-H323 HydrophobicContact CD2-CB 4.09Å; D321-H323 PolarHBondContact O-N 2.88Å; D321-H323 VanDerWaalsContact O-N 3.1Å; H323-W335 VanDerWaalsContact O-CZ2 3.32Å; H323-W335 WeakPolarHBondContact O-CZ2 3.18Å; H323-A412 HydrophobicContact CB-CB 4.22Å; H323-Q439 VanDerWaalsContact CB-OE1 3.28Å; H323-Q439 PolarHBondContact CD2-OE1 2.95Å
324	L	94.3	Very high	88.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-96.4	133.9	-174.7	-54.4	-175.3	0	0	0	110.6	P312 V313 D321 W335 A412 Q437 Q439	P312-L324 CarbonylContact C-O 3.52Å; P312-L324 WeakPolarHBondContact CA-O 3.34Å; V313-L324 HydrophobicContact CG2-CB 3.8Å; V313-L324 PolarHBondContact N-O 3.46Å; D321-L324 HydrophobicContact CB-CB 4.16Å; D321-L324 HydrophobicContact CB-CD1 3.63Å; D321-L324 HydrophobicContact CB-CG 3.86Å; D321-L324 PolarHBondContact O-N 3.06Å; L324-W335 HydrophobicContact CD2-CH2 3.79Å; L324-W335 HydrophobicContact CD2-CZ2 4.14Å; L324-A412 HydrophobicContact CD2-CB 4.06Å; L324-Q437 HydrophobicContact CD1-CG 4.16Å; L324-Q437 HydrophobicContact CD2-CB 4.47Å; L324-Q439 HydrophobicContact CD1-CB 4.06Å; L324-Q439 HydrophobicContact CD2-CB 4.29Å; L324-Q439 HydrophobicContact CG-CB 4.05Å
325	V	94.4	Very high	89.2	Confident	10 Å²	10	56.2 Å²	56.2	6%	0.061	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-100.8	162.2	164.9	-60.8	0	0	0	0	109.1	P309 V313 E329 P332 R414 Q437	P309-V325 HydrophobicContact CB-CG1 3.76Å; P309-V325 HydrophobicContact CG-CG1 3.96Å; V313-V325 VanDerWaalsContact CG2-O 3.31Å; V313-V325 WeakPolarHBondContact CG2-O 3.32Å; V325-E329 HydrophobicContact CB-CB 4.49Å; V325-E329 HydrophobicContact CG2-CB 4.21Å; V325-P332 HydrophobicContact CG1-CG 4.03Å; V325-P332 HydrophobicContact CG2-CG 4.48Å; V325-R414 PolarHBondContact O-NH2 3.27Å; V325-Q437 PolarHBondContact O-NE2 3.42Å; V325-Q437 PolarHBondContact O-OE1 3.07Å
326	P	94.6	Very high	90.3	Very high	34 Å²	34	56.3 Å²	56.3	22%	0.221	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-49.7	150.3	175.4	-27.2	35.8	0	0	0	112.8	E328 E329 R414	P326-E328 VanDerWaalsContact CB-OE2 3.23Å; P326-E328 WeakPolarHBondContact CB-OE2 3.45Å; P326-E328 PolarHBondContact O-N 3.18Å; P326-E329 HydrophobicContact CB-CG 4.4Å; P326-E329 PolarHBondContact O-N 2.94Å; P326-E329 VanDerWaalsContact O-N 3.15Å; P326-R414 PolarHBondContact O-NH2 2.86Å
327	L	94.3	Very high	92	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.131	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.7	-177.6	-80.9	168.5	0	0	0	112	A244 E329 R414 A435 Q437	A244-L327 HydrophobicContact CB-CD1 4.21Å; A244-L327 VanDerWaalsContact N-CD1 3.33Å; L327-E329 VanDerWaalsContact C-N 3.32Å; L327-R414 HydrophobicContact CD2-CG 4.14Å; L327-A435 HydrophobicContact CD2-CB 4.29Å; L327-Q437 HydrophobicContact CD2-CB 4.1Å; L327-Q437 HydrophobicContact CD2-CG 3.77Å; L327-Q437 HydrophobicContact CG-CG 4.14Å
328	E	93.3	Very high	93.1	Very high	156 Å²	156	47.4 Å²	47.4	73%	0.729	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.8	177.3	-55.7	72.8	-158.7	0	0	112.6	P326	P326-E328 VanDerWaalsContact CB-OE2 3.23Å; P326-E328 WeakPolarHBondContact CB-OE2 3.45Å; P326-E328 PolarHBondContact O-N 3.18Å
329	E	94.5	Very high	94.2	Very high	95 Å²	95	51.9 Å²	51.9	44%	0.444	31%	0.306	S	S	.	.	S	Bend	trans	-91.3	147.6	178	-69.3	-175.6	-155.9	0	0	111	V325 P326 L327 R414	V325-E329 HydrophobicContact CB-CB 4.49Å; V325-E329 HydrophobicContact CG2-CB 4.21Å; P326-E329 HydrophobicContact CB-CG 4.4Å; P326-E329 PolarHBondContact O-N 2.94Å; P326-E329 VanDerWaalsContact O-N 3.15Å; L327-E329 VanDerWaalsContact C-N 3.32Å; E329-R414 PolarHBondContact O-NH1 3.47Å
330	P	95.3	Very high	94.5	Very high	115 Å²	115	53 Å²	53	75%	0.747	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-61.4	147	172.8	27.8	-34.7	0	0	0	111
331	V	95.7	Very high	94.6	Very high	28 Å²	28	52.3 Å²	52.3	17%	0.17	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-57	147.9	173.9	-66.2	0	0	0	0	110.9	A297 W335 V337 R414	A297-V331 HydrophobicContact CB-CB 4.49Å; A297-V331 HydrophobicContact CB-CG1 4.05Å; A297-V331 HydrophobicContact CB-CG2 3.96Å; V331-W335 HydrophobicContact CB-CB 4.43Å; V331-W335 HydrophobicContact CB-CD2 4.24Å; V331-W335 HydrophobicContact CB-CE3 4.07Å; V331-W335 HydrophobicContact CB-CG 4.41Å; V331-W335 HydrophobicContact CG1-CE3 3.98Å; V331-W335 HydrophobicContact CG1-CZ3 4.25Å; V331-W335 HydrophobicContact CG2-CB 4.34Å; V331-V337 HydrophobicContact CG2-CG2 3.89Å; V331-R414 HydrophobicContact CG1-CB 4.06Å; V331-R414 HydrophobicContact CG1-CG 4.45Å
332	P	94.8	Very high	94.7	Very high	23 Å²	23	55.6 Å²	55.6	15%	0.149	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-55	143.7	179.9	-26.4	34.7	0	0	0	112.6	P309 V325 H334 W335	P309-P332 HydrophobicContact CG-CG 4.06Å; V325-P332 HydrophobicContact CG1-CG 4.03Å; V325-P332 HydrophobicContact CG2-CG 4.48Å; P332-H334 WeakPolarHBondContact CB-CE1 3.46Å; P332-H334 WeakPolarHBondContact CB-ND1 3.41Å; P332-H334 PolarHBondContact O-N 3.23Å; P332-W335 VanDerWaalsContact O-CB 3.28Å; P332-W335 WeakPolarHBondContact O-CB 3.43Å; P332-W335 PolarHBondContact O-N 3.44Å
333	S	93.3	Very high	95	Very high	128 Å²	128	54 Å²	54	90%	0.895	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.1	-173.7	57.2	0	0	0	0	115.5
334	H	92.8	Very high	95.2	Very high	41 Å²	41	52.5 Å²	52.5	19%	0.19	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.9	177.3	65.5	-85.7	0	0	0	113.3	L299 R303 S306 P332	L299-H334 VanDerWaalsContact CD1-CD2 3.44Å; L299-H334 WeakPolarHBondContact CD1-CD2 3.39Å; R303-H334 VanDerWaalsContact CD-O 3.29Å; R303-H334 WeakPolarHBondContact CD-O 3.5Å; R303-H334 PolarHBondContact NH1-O 2.84Å; S306-H334 PolarHBondContact OG-CD2 3.47Å; P332-H334 WeakPolarHBondContact CB-CE1 3.46Å; P332-H334 WeakPolarHBondContact CB-ND1 3.41Å; P332-H334 PolarHBondContact O-N 3.23Å
335	W	96.8	Very high	95.4	Very high	11 Å²	11	53.4 Å²	53.4	4%	0.042	31%	0.305	C	S	.	.	S	Bend	trans	-69.7	155	173.3	-73.5	39.5	0	0	0	110.8	A297 L299 H323 L324 V331 P332 A412 R414	A297-W335 HydrophobicContact CB-CE3 4.21Å; L299-W335 HydrophobicContact CB-CD2 4.05Å; L299-W335 HydrophobicContact CB-CG 4.3Å; L299-W335 HydrophobicContact CB-CZ2 4.13Å; H323-W335 VanDerWaalsContact O-CZ2 3.32Å; H323-W335 WeakPolarHBondContact O-CZ2 3.18Å; L324-W335 HydrophobicContact CD2-CH2 3.79Å; L324-W335 HydrophobicContact CD2-CZ2 4.14Å; V331-W335 HydrophobicContact CB-CB 4.43Å; V331-W335 HydrophobicContact CB-CD2 4.24Å; V331-W335 HydrophobicContact CB-CE3 4.07Å; V331-W335 HydrophobicContact CB-CG 4.41Å; V331-W335 HydrophobicContact CG1-CE3 3.98Å; V331-W335 HydrophobicContact CG1-CZ3 4.25Å; V331-W335 HydrophobicContact CG2-CB 4.34Å; P332-W335 VanDerWaalsContact O-CB 3.28Å; P332-W335 WeakPolarHBondContact O-CB 3.43Å; P332-W335 PolarHBondContact O-N 3.44Å; W335-A412 HydrophobicContact CH2-CB 3.61Å; W335-A412 HydrophobicContact CZ2-CB 3.68Å; W335-R414 HydrophobicContact CZ3-CB 4.14Å
336	T	97.7	Very high	95.5	Very high	35 Å²	35	53 Å²	53	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.5	172.1	-59.1	0	0	0	0	108.6	A297 Y298 R303	A297-T336 CarbonylContact C-O 3.52Å; A297-T336 VanDerWaalsContact CA-O 3.26Å; A297-T336 WeakPolarHBondContact CA-O 3.46Å; Y298-T336 HydrophobicContact CE1-CG2 4.27Å; Y298-T336 HydrophobicContact CE2-CG2 4.14Å; Y298-T336 PolarHBondContact N-O 3.28Å; Y298-T336 PolarHBondContact O-N 3.19Å; R303-T336 PolarHBondContact NH1-OG1 3.25Å
337	V	98	Very high	95.7	Very high	91 Å²	91	51.7 Å²	51.7	55%	0.552	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.8	170.8	-177.1	0	0	0	0	108.3	A297 V331	A297-V337 HydrophobicContact CB-CG2 4.22Å; V331-V337 HydrophobicContact CG2-CG2 3.89Å
338	V	97.8	Very high	95.9	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.055	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.9	127.7	177.9	-179.5	0	0	0	0	108.6	L296 Y298 D340 F343 Y375	L296-V338 HydrophobicContact CB-CB 4.24Å; L296-V338 HydrophobicContact CB-CG2 4.09Å; L296-V338 HydrophobicContact CD2-CG2 4.1Å; L296-V338 HydrophobicContact CG-CG2 4.01Å; L296-V338 WeakPolarHBondContact O-CB 3.37Å; L296-V338 WeakPolarHBondContact O-CG2 3.24Å; L296-V338 PolarHBondContact O-N 3.41Å; Y298-V338 HydrophobicContact CD1-CG2 4.09Å; Y298-V338 HydrophobicContact CE1-CG2 3.59Å; V338-D340 VanDerWaalsContact C-N 3.32Å; V338-D340 HydrophobicContact CG1-CB 4.01Å; V338-F343 HydrophobicContact CB-CZ 4.35Å; V338-F343 HydrophobicContact CG1-CE1 4.06Å; V338-F343 HydrophobicContact CG1-CZ 3.83Å; V338-Y375 HydrophobicContact CG1-CE2 4.07Å; V338-Y375 HydrophobicContact CG2-CE1 4.3Å
339	P	96.1	Very high	96.2	Very high	118 Å²	118	43 Å²	43	77%	0.766	25%	0.252	S	S	*	.	S	Bend	trans	-71.8	-27.2	-178.6	28	-34.9	0	0	0	112.8
340	D	94.3	Very high	96.4	Very high	36 Å²	36	38.7 Å²	38.7	19%	0.193	23%	0.232	C	C	.	.			trans	-67.4	135.2	175.4	-55.9	-86.5	0	0	0	111.2	V338 F343 R377	V338-D340 VanDerWaalsContact C-N 3.32Å; V338-D340 HydrophobicContact CG1-CB 4.01Å; D340-F343 HydrophobicContact CB-CE1 4.41Å; D340-F343 HydrophobicContact CB-CZ 4.23Å; D340-F343 WeakPolarHBondContact O-CE2 3.48Å; D340-F343 WeakPolarHBondContact O-CZ 3.21Å; D340-R377 IonicContact OD1-CZ 2.89Å; D340-R377 VanDerWaalsContact OD1-CZ 3.23Å; D340-R377 IonicContact OD1-NE 2.86Å; D340-R377 PolarHBondContact OD1-NE 2.88Å; D340-R377 IonicContact OD1-NH2 3.58Å; D340-R377 PolarHBondContact OD1-NH2 2.84Å; D340-R377 IonicContact OD2-CZ 3.21Å; D340-R377 IonicContact OD2-NE 3.43Å; D340-R377 PolarHBondContact OD2-NE 3.18Å; D340-R377 IonicContact OD2-NH2 3.17Å; D340-R377 PolarHBondContact OD2-NH2 3.03Å
341	Q	93.3	Very high	96.5	Very high	77 Å²	77	33.5 Å²	33.5	36%	0.36	20%	0.197	S	C	.	.			trans	-104.9	-11.1	174.7	-64.2	-172.2	-8.4	0	0	113	R293 G294	R293-Q341 CarbonylContact C-O 3.43Å; R293-Q341 VanDerWaalsContact CA-O 3.23Å; R293-Q341 WeakPolarHBondContact CA-O 3.36Å; G294-Q341 PolarHBondContact N-O 2.94Å; G294-Q341 CarbonylContact O-C 3.6Å; G294-Q341 WeakPolarHBondContact O-CA 3.4Å
342	D	95.6	Very high	96.5	Very high	69 Å²	69	32.2 Å²	32.2	37%	0.369	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.9	-177.5	-71.6	-74.8	0	0	0	111.1	A378	D342-A378 HydrophobicContact CB-CB 3.64Å; D342-A378 WeakPolarHBondContact O-CB 3.35Å; D342-A378 PolarHBondContact O-N 3.14Å
343	F	96.8	Very high	96.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.7	-178.3	-60.3	-86.1	0	0	0	110.9	W257 T291 Y292 G294 L296 V338 D340 V346 Y375 V376	W257-F343 HydrophobicContact CZ3-CB 3.95Å; W257-F343 AromaticContact CZ3-CD2 3.95Å; W257-F343 HydrophobicContact CZ3-CD2 3.95Å; W257-F343 HydrophobicContact CZ3-CG 4.24Å; T291-F343 CarbonylContact C-O 3.54Å; T291-F343 VanDerWaalsContact CA-O 3.31Å; T291-F343 WeakPolarHBondContact CA-O 3.33Å; Y292-F343 WeakPolarHBondContact CD2-O 3.35Å; Y292-F343 PolarHBondContact N-O 3.34Å; Y292-F343 PolarHBondContact O-N 2.76Å; G294-F343 WeakPolarHBondContact O-CE2 3.38Å; L296-F343 HydrophobicContact CB-CE2 4.33Å; L296-F343 HydrophobicContact CB-CZ 3.89Å; L296-F343 HydrophobicContact CD2-CE1 4.32Å; V338-F343 HydrophobicContact CB-CZ 4.35Å; V338-F343 HydrophobicContact CG1-CE1 4.06Å; V338-F343 HydrophobicContact CG1-CZ 3.83Å; D340-F343 HydrophobicContact CB-CE1 4.41Å; D340-F343 HydrophobicContact CB-CZ 4.23Å; D340-F343 WeakPolarHBondContact O-CE2 3.48Å; D340-F343 WeakPolarHBondContact O-CZ 3.21Å; F343-V346 HydrophobicContact CB-CG2 4.25Å; F343-V346 HydrophobicContact CD1-CG2 4.05Å; F343-V346 HydrophobicContact CG-CG2 4.03Å; F343-Y375 AromaticContact CD1-CD2 3.94Å; F343-Y375 HydrophobicContact CD1-CD2 3.94Å; F343-Y375 HydrophobicContact CD1-CG 4.37Å; F343-Y375 AromaticContact CE1-CD2 3.6Å; F343-Y375 HydrophobicContact CE1-CD2 3.6Å; F343-Y375 HydrophobicContact CE1-CE2 4.16Å; F343-Y375 HydrophobicContact CE1-CG 4.13Å; F343-V376 CarbonylContact C-O 3.5Å; F343-V376 WeakPolarHBondContact CA-O 3.2Å
344	V	96.8	Very high	96.7	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-41.8	162.3	172.4	0	0	0	0	109.8	F259 L289 T291 Y292 V376 V380 L385	F259-V344 HydrophobicContact CB-CG1 3.86Å; F259-V344 VanDerWaalsContact CB-O 3.3Å; F259-V344 WeakPolarHBondContact CB-O 3.5Å; F259-V344 HydrophobicContact CD2-CG1 4.31Å; F259-V344 HydrophobicContact CG-CG1 4.3Å; F259-V344 PolarHBondContact N-O 3.13Å; L289-V344 HydrophobicContact CD1-CG1 3.92Å; T291-V344 HydrophobicContact CG2-CG2 4.32Å; Y292-V344 WeakPolarHBondContact CD2-O 3.41Å; Y292-V344 WeakPolarHBondContact CE2-O 3.24Å; V344-V376 HydrophobicContact CB-CB 4.13Å; V344-V376 HydrophobicContact CB-CG1 4.08Å; V344-V376 HydrophobicContact CG2-CG1 4.38Å; V344-V376 PolarHBondContact N-O 2.9Å; V344-V380 HydrophobicContact CG2-CG1 3.84Å; V344-L385 HydrophobicContact CG1-CD1 4.05Å
345	L	97	Very high	96.7	Very high	19 Å²	19	24.8 Å²	24.8	10%	0.099	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156.3	176.3	64.9	92.5	0	0	0	111.3	W257 F259 I260 L347 Y375 V376	W257-L345 VanDerWaalsContact O-CA 3.31Å; W257-L345 WeakPolarHBondContact O-CA 3.19Å; F259-L345 HydrophobicContact CB-CB 4.06Å; F259-L345 HydrophobicContact CB-CD2 4.33Å; I260-L345 HydrophobicContact CD1-CD1 4.09Å; I260-L345 HydrophobicContact CD1-CD2 4.19Å; I260-L345 HydrophobicContact CG1-CD2 4.18Å; L345-L347 HydrophobicContact CD1-CB 4.32Å; L345-Y375 VanDerWaalsContact O-CA 3.27Å; L345-Y375 WeakPolarHBondContact O-CA 3.21Å; L345-V376 HydrophobicContact CD1-CG2 4.02Å; L345-V376 HydrophobicContact CD2-CB 4.37Å; L345-V376 HydrophobicContact CD2-CG2 3.87Å; L345-V376 HydrophobicContact CG-CB 3.98Å; L345-V376 HydrophobicContact CG-CG2 3.76Å; L345-V376 PolarHBondContact O-N 3.1Å
346	V	98.1	Very high	96.5	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.1	162.9	-178.8	0	0	0	0	107.5	A256 W257 L296 F343 L373 F374 L415	A256-V346 WeakPolarHBondContact CA-O 3.34Å; W257-V346 HydrophobicContact CE3-CB 4.16Å; W257-V346 HydrophobicContact CE3-CG2 3.77Å; W257-V346 HydrophobicContact CZ3-CG2 4.12Å; W257-V346 PolarHBondContact N-O 3.14Å; W257-V346 PolarHBondContact O-N 3.22Å; L296-V346 HydrophobicContact CD1-CG1 4.08Å; L296-V346 HydrophobicContact CD2-CG1 3.96Å; L296-V346 HydrophobicContact CD2-CG2 4.11Å; F343-V346 HydrophobicContact CB-CG2 4.25Å; F343-V346 HydrophobicContact CD1-CG2 4.05Å; F343-V346 HydrophobicContact CG-CG2 4.03Å; V346-L373 HydrophobicContact CG1-CD1 4.02Å; V346-F374 CarbonylContact C-O 3.55Å; V346-F374 WeakPolarHBondContact CA-O 3.49Å; V346-L415 HydrophobicContact CB-CD2 3.93Å; V346-L415 HydrophobicContact CG1-CD2 3.97Å; V346-L415 HydrophobicContact CG2-CD1 4.4Å; V346-L415 HydrophobicContact CG2-CD2 4.34Å
347	L	98.5	Very high	96.2	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.031	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	114.8	-177.1	173.2	70.1	0	0	0	110	L255 A256 I260 L345 L349 L354 L373 F374	L255-L347 WeakPolarHBondContact O-CA 3.37Å; A256-L347 HydrophobicContact CB-CD1 3.91Å; I260-L347 HydrophobicContact CD1-CB 4.11Å; I260-L347 HydrophobicContact CD1-CD1 4.32Å; I260-L347 HydrophobicContact CD1-CD2 3.92Å; I260-L347 HydrophobicContact CD1-CG 4.34Å; L345-L347 HydrophobicContact CD1-CB 4.32Å; L347-L349 HydrophobicContact CD1-CB 4.48Å; L347-L349 HydrophobicContact CD2-CB 4.32Å; L347-L349 HydrophobicContact CD2-CD2 4.41Å; L347-L349 HydrophobicContact CG-CB 4.14Å; L347-L354 HydrophobicContact CD1-CD2 4.05Å; L347-L354 HydrophobicContact CD2-CD1 3.82Å; L347-L354 HydrophobicContact CD2-CD2 4.08Å; L347-L354 HydrophobicContact CD2-CG 4.35Å; L347-L373 WeakPolarHBondContact O-CA 3.26Å; L347-F374 HydrophobicContact CB-CB 4.31Å; L347-F374 HydrophobicContact CD2-CD2 4.17Å; L347-F374 PolarHBondContact N-O 3.37Å; L347-F374 PolarHBondContact O-N 2.9Å
348	A	98.5	Very high	96	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.7	161	0	0	0	0	0	108.4	S254 L255 M371 H372 L373 F413	S254-A348 CarbonylContact C-O 3.42Å; S254-A348 WeakPolarHBondContact CA-O 3.37Å; S254-A348 VanDerWaalsContact CB-O 3.31Å; S254-A348 WeakPolarHBondContact CB-O 3.49Å; L255-A348 HydrophobicContact CB-CB 4.35Å; L255-A348 PolarHBondContact N-O 3.44Å; L255-A348 PolarHBondContact O-N 3.21Å; A348-M371 HydrophobicContact CB-CE 3.86Å; A348-M371 HydrophobicContact CB-SD 3.91Å; A348-H372 CarbonylContact C-O 3.51Å; A348-H372 WeakPolarHBondContact CA-O 3.25Å; A348-L373 HydrophobicContact CB-CD1 4.47Å; A348-F413 HydrophobicContact CB-CE1 4.29Å; A348-F413 HydrophobicContact CB-CZ 4.44Å
349	L	98.5	Very high	95.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	125.5	-173.3	178.8	66.8	0	0	0	110.5	L253 L347 H351 L354 A360 A361 H372 F374	L253-L349 HydrophobicContact CD1-CD1 4.18Å; L253-L349 HydrophobicContact CG-CD1 4.47Å; L347-L349 HydrophobicContact CD1-CB 4.48Å; L347-L349 HydrophobicContact CD2-CB 4.32Å; L347-L349 HydrophobicContact CD2-CD2 4.41Å; L347-L349 HydrophobicContact CG-CB 4.14Å; L349-H351 WeakPolarHBondContact CD2-O 3.28Å; L349-H351 WeakPolarHBondContact CG-O 3.31Å; L349-L354 HydrophobicContact CD1-CD2 3.89Å; L349-L354 HydrophobicContact CD2-CD2 4.41Å; L349-L354 HydrophobicContact CD2-CG 4.37Å; L349-A360 HydrophobicContact CD2-CB 3.87Å; L349-A361 HydrophobicContact CD2-CB 4.22Å; L349-H372 HydrophobicContact CB-CB 4.37Å; L349-H372 PolarHBondContact N-O 2.94Å; L349-H372 WeakPolarHBondContact O-CB 3.33Å; L349-H372 PolarHBondContact O-N 3.17Å; L349-F374 HydrophobicContact CD2-CE2 4.4Å
350	L	98.2	Very high	96	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.016	9%	0.091	C	C	.	.	S	Bend	trans	-87.3	-20.4	-178.5	-77.3	75.1	0	0	0	112.7	N237 L239 L253 C366 M371	N237-L350 HydrophobicContact CB-CD2 4.22Å; N237-L350 WeakPolarHBondContact O-CD2 3.44Å; L239-L350 HydrophobicContact CB-CD1 3.86Å; L239-L350 HydrophobicContact CB-CD2 4.12Å; L239-L350 HydrophobicContact CD2-CD1 4Å; L253-L350 WeakPolarHBondContact O-CD1 3.4Å; L253-L350 PolarHBondContact O-N 3.03Å; L350-C366 PolarHBondContact O-SG 3.36Å; L350-M371 HydrophobicContact CD1-CB 4.45Å; L350-M371 HydrophobicContact CG-CB 4.33Å
351	H	97.5	Very high	96.1	Very high	6 Å²	6	16.2 Å²	16.2	3%	0.028	8%	0.082	C	C	.	.	S	Bend	trans	-127.6	173.8	-170.2	-66.7	-59.6	0	0	0	113.7	L202 S205 Y209 V252 L253 L349	L202-H351 VanDerWaalsContact CD1-CD2 3.45Å; L202-H351 WeakPolarHBondContact CD1-CD2 3.29Å; L202-H351 VanDerWaalsContact CD1-NE2 3.28Å; L202-H351 WeakPolarHBondContact CD1-NE2 3.41Å; S205-H351 WeakPolarHBondContact OG-CB 3.28Å; Y209-H351 AromaticContact CE2-ND1 3.85Å; Y209-H351 WeakPolarHBondContact OH-CA 3.25Å; V252-H351 PolarHBondContact O-CD2 2.9Å; V252-H351 VanDerWaalsContact O-CD2 3.28Å; V252-H351 PolarHBondContact O-NE2 2.91Å; L253-H351 HydrophobicContact CD1-CB 4.09Å; L349-H351 WeakPolarHBondContact CD2-O 3.28Å; L349-H351 WeakPolarHBondContact CG-O 3.31Å
352	S	97.1	Very high	96.3	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.007	7%	0.073	C	C	.	.	S	Bend	trans	-68.5	-34.6	-176	46.9	0	0	0	0	114.4	S205 Y209 F359 A360 A361	S205-S352 WeakPolarHBondContact CA-OG 3.23Å; S205-S352 VanDerWaalsContact CB-OG 3.24Å; S205-S352 WeakPolarHBondContact CB-OG 3.44Å; S205-S352 PolarHBondContact OG-N 3.46Å; S205-S352 PolarHBondContact OG-OG 3.47Å; S205-S352 VanDerWaalsContact OG-OG 3.06Å; Y209-S352 WeakPolarHBondContact CE1-OG 3.22Å; Y209-S352 PolarHBondContact OH-N 2.9Å; S352-F359 WeakPolarHBondContact O-CD2 3.24Å; S352-A360 PolarHBondContact O-N 3.24Å; S352-A361 PolarHBondContact O-N 2.97Å
353	H	97.3	Very high	96.1	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.009	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.2	-168	-70	68.1	0	0	0	112	A204 S205 H208 Q214 G355 M358 F359	A204-H353 HydrophobicContact CB-CB 4.03Å; S205-H353 WeakPolarHBondContact OG-CB 3.48Å; S205-H353 PolarHBondContact OG-N 3.03Å; H208-H353 AromaticContact CG-CE1 3.66Å; Q214-H353 PolarHBondContact OE1-NE2 2.96Å; H353-G355 WeakPolarHBondContact CB-O 3.46Å; H353-G355 PolarHBondContact CD2-O 3.39Å; H353-M358 CarbonylContact C-O 3.55Å; H353-M358 WeakPolarHBondContact CA-O 3.36Å; H353-F359 AromaticContact CE1-CD2 3.72Å
354	L	94.8	Very high	95.4	Very high	31 Å²	31	12.9 Å²	12.9	16%	0.162	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-6	165.5	-77.1	174.1	0	0	0	112.6	I260 L347 L349 M358 A360 M392	I260-L354 HydrophobicContact CD1-CD1 4.4Å; L347-L354 HydrophobicContact CD1-CD2 4.05Å; L347-L354 HydrophobicContact CD2-CD1 3.82Å; L347-L354 HydrophobicContact CD2-CD2 4.08Å; L347-L354 HydrophobicContact CD2-CG 4.35Å; L349-L354 HydrophobicContact CD1-CD2 3.89Å; L349-L354 HydrophobicContact CD2-CD2 4.41Å; L349-L354 HydrophobicContact CD2-CG 4.37Å; L354-M358 HydrophobicContact CB-CB 4.05Å; L354-M358 HydrophobicContact CB-CE 4.3Å; L354-M358 PolarHBondContact N-O 2.89Å; L354-A360 HydrophobicContact CB-CB 4.29Å; L354-A360 HydrophobicContact CD1-CB 3.7Å; L354-A360 HydrophobicContact CG-CB 3.65Å; L354-M392 HydrophobicContact CD1-SD 4.26Å
355	G	93.1	Very high	95.1	Very high	4 Å²	4	16.9 Å²	16.9	4%	0.041	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	169.8	179.9	0	0	0	0	0	109	H353 E357 M358	H353-G355 WeakPolarHBondContact CB-O 3.46Å; H353-G355 PolarHBondContact CD2-O 3.39Å; G355-E357 PolarHBondContact O-N 3.27Å; G355-E357 VanDerWaalsContact O-N 3.16Å; G355-M358 PolarHBondContact O-N 3Å
356	S	90.8	Very high	94.8	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.014	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-36	-179.1	63.2	0	0	0	0	113.8	Q214 E275	Q214-S356 WeakPolarHBondContact CG-O 3.28Å; E275-S356 PolarHBondContact OE1-OG 3.31Å; E275-S356 PolarHBondContact OE2-OG 3Å
357	E	91.4	Very high	94.5	Very high	51 Å²	51	19.8 Å²	19.8	24%	0.238	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	18	179.1	-59	-174	128.6	0	0	113.2	T216 G355 E393	T216-E357 HydrophobicContact CG2-CG 3.49Å; T216-E357 VanDerWaalsContact CG2-CG 3.49Å; G355-E357 PolarHBondContact O-N 3.27Å; G355-E357 VanDerWaalsContact O-N 3.16Å; E357-E393 WeakPolarHBondContact O-CA 3.33Å
358	M	93.8	Very high	94.1	Very high	32 Å²	32	22.1 Å²	22.1	16%	0.158	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	84.8	-176.5	-67.4	-171	-74.3	0	0	111	F278 H353 L354 G355 A360 F389 M392	F278-M358 HydrophobicContact CB-CE 4.26Å; F278-M358 HydrophobicContact CD2-CE 4.16Å; F278-M358 HydrophobicContact CG-CE 4.36Å; H353-M358 CarbonylContact C-O 3.55Å; H353-M358 WeakPolarHBondContact CA-O 3.36Å; L354-M358 HydrophobicContact CB-CB 4.05Å; L354-M358 HydrophobicContact CB-CE 4.3Å; L354-M358 PolarHBondContact N-O 2.89Å; G355-M358 PolarHBondContact O-N 3Å; M358-A360 PolarHBondContact O-N 3.31Å; M358-A360 VanDerWaalsContact O-N 3.1Å; M358-F389 HydrophobicContact SD-CE2 4.23Å; M358-M392 HydrophobicContact CB-CE 4.06Å; M358-M392 HydrophobicContact CG-CE 3.97Å; M358-M392 HydrophobicContact SD-CE 3.83Å
359	F	96.8	Very high	93.8	Very high	30 Å²	30	22.6 Å²	22.6	13%	0.132	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	86.2	175.9	-172.7	-164.7	0	0	0	110.5	H208 S352 H353 A361 P362 M392 G395 H397	H208-F359 AromaticContact CE1-CE1 3.97Å; H208-F359 AromaticContact CE1-CZ 3.66Å; H208-F359 AromaticContact NE2-CE2 3.89Å; H208-F359 AromaticContact NE2-CZ 3.43Å; H208-F359 WeakPolarHBondContact NE2-CZ 3.36Å; S352-F359 WeakPolarHBondContact O-CD2 3.24Å; H353-F359 AromaticContact CE1-CD2 3.72Å; F359-A361 WeakPolarHBondContact CE2-O 3.3Å; F359-P362 HydrophobicContact CE1-CB 4.09Å; F359-P362 HydrophobicContact CE2-CB 4.35Å; F359-P362 HydrophobicContact CZ-CB 4.03Å; F359-M392 CarbonylContact C-O 3.59Å; F359-M392 PolarHBondContact N-O 3.45Å; F359-G395 WeakPolarHBondContact O-CA 3.31Å; F359-H397 PolarHBondContact O-CE1 3.46Å
360	A	97.1	Very high	93.8	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.033	14%	0.143	C	C	.	.			trans	-84.4	-26.2	-169.7	0	0	0	0	0	114.5	L349 S352 L354 M358 P362 F374 M392 H397	L349-A360 HydrophobicContact CD2-CB 3.87Å; S352-A360 PolarHBondContact O-N 3.24Å; L354-A360 HydrophobicContact CB-CB 4.29Å; L354-A360 HydrophobicContact CD1-CB 3.7Å; L354-A360 HydrophobicContact CG-CB 3.65Å; M358-A360 PolarHBondContact O-N 3.31Å; M358-A360 VanDerWaalsContact O-N 3.1Å; A360-P362 WeakPolarHBondContact O-CD 2.96Å; A360-F374 WeakPolarHBondContact O-CZ 3.19Å; A360-M392 HydrophobicContact CB-CG 4.34Å; A360-M392 HydrophobicContact CB-SD 3.86Å; A360-H397 PolarHBondContact O-CE1 2.89Å; A360-H397 PolarHBondContact O-NE2 3.47Å
361	A	97.5	Very high	93.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.142	C	C	.	.			trans	-124.3	79.1	-179.8	0	0	0	0	0	111.4	L349 S352 F359 M363 H372 F374	L349-A361 HydrophobicContact CD2-CB 4.22Å; S352-A361 PolarHBondContact O-N 2.97Å; F359-A361 WeakPolarHBondContact CE2-O 3.3Å; A361-M363 VanDerWaalsContact C-N 3.26Å; A361-M363 VanDerWaalsContact C-SD 3.56Å; A361-M363 VanDerWaalsContact CA-SD 3.53Å; A361-M363 HydrophobicContact CB-SD 3.62Å; A361-M363 PolarHBondContact O-N 3.42Å; A361-H372 WeakPolarHBondContact CB-CD2 3.38Å; A361-F374 HydrophobicContact CB-CE2 4.28Å; A361-F374 HydrophobicContact CB-CZ 4.09Å
362	P	96.4	Very high	93.8	Very high	28 Å²	28	23.1 Å²	23.1	18%	0.182	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-10.4	-176	32.7	-38.6	0	0	0	114.3	F359 A360 G364 G395 M398	F359-P362 HydrophobicContact CE1-CB 4.09Å; F359-P362 HydrophobicContact CE2-CB 4.35Å; F359-P362 HydrophobicContact CZ-CB 4.03Å; A360-P362 WeakPolarHBondContact O-CD 2.96Å; P362-G364 PolarHBondContact O-N 2.97Å; P362-G395 VanDerWaalsContact CB-O 3.28Å; P362-G395 WeakPolarHBondContact CB-O 3.46Å; P362-G395 VanDerWaalsContact CG-O 3.25Å; P362-G395 WeakPolarHBondContact CG-O 3.49Å; P362-M398 HydrophobicContact CG-CG 3.89Å
363	M	92.1	Very high	93.9	Very high	24 Å²	24	23 Å²	23	12%	0.118	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.6	-179	63.1	-75	-65.7	0	0	114.1	A361 F374 M398 Y407 W458	A361-M363 VanDerWaalsContact C-N 3.26Å; A361-M363 VanDerWaalsContact C-SD 3.56Å; A361-M363 VanDerWaalsContact CA-SD 3.53Å; A361-M363 HydrophobicContact CB-SD 3.62Å; A361-M363 PolarHBondContact O-N 3.42Å; M363-F374 HydrophobicContact CE-CE1 3.89Å; M363-F374 HydrophobicContact CE-CZ 3.79Å; M363-F374 HydrophobicContact SD-CZ 4.15Å; M363-M398 HydrophobicContact CE-CE 4.27Å; M363-M398 HydrophobicContact CE-CG 4.38Å; M363-Y407 HydrophobicContact CE-CD1 3.86Å; M363-Y407 HydrophobicContact CE-CD2 3.57Å; M363-Y407 HydrophobicContact CE-CE1 3.85Å; M363-Y407 HydrophobicContact CE-CE2 3.52Å; M363-Y407 HydrophobicContact CE-CG 3.71Å; M363-Y407 HydrophobicContact CG-CE1 4.02Å; M363-Y407 HydrophobicContact CG-CE2 4.17Å; M363-Y407 VanDerWaalsContact CG-OH 3.26Å; M363-Y407 WeakPolarHBondContact CG-OH 3.49Å; M363-Y407 HydrophobicContact SD-CD2 4.34Å; M363-Y407 HydrophobicContact SD-CE1 4.45Å; M363-Y407 HydrophobicContact SD-CE2 3.72Å; M363-W458 HydrophobicContact CB-CB 4.19Å; M363-W458 HydrophobicContact CB-CG 4.42Å
364	G	83.3	Confident	93.9	Very high	25 Å²	25	23.3 Å²	23.3	26%	0.258	14%	0.143	S	C	.	.			trans	119.6	174.3	172.7	0	0	0	0	0	113.5	P362 H372	P362-G364 PolarHBondContact O-N 2.97Å; G364-H372 PolarHBondContact O-CE1 3.21Å; G364-H372 PolarHBondContact O-NE2 3.12Å
365	R	90	Very high	94.1	Very high	85 Å²	85	22.7 Å²	22.7	32%	0.321	14%	0.139	S	C	.	.	P	Polyproline II helix	trans	-64.2	139.9	176.9	-174.7	178.2	177.9	-163.4	1.7	110.4	Y209 P235 A367 C451	Y209-R365 HydrophobicContact CD1-CB 4.29Å; Y209-R365 HydrophobicContact CD1-CG 4.43Å; Y209-R365 HydrophobicContact CE1-CB 3.88Å; Y209-R365 HydrophobicContact CE1-CG 4Å; Y209-R365 HydrophobicContact CE2-CG 4.3Å; P235-R365 PolarHBondContact O-NH2 3.03Å; R365-A367 PolarHBondContact O-N 3.22Å; R365-C451 PolarHBondContact NH1-SG 3.1Å
366	C	89.4	Confident	94.4	Very high	17 Å²	17	22.7 Å²	22.7	12%	0.115	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-56.4	134.3	172	-71	0	0	0	0	111.6	L350 V370 H372	L350-C366 PolarHBondContact O-SG 3.36Å; C366-V370 VanDerWaalsContact CB-O 3.29Å; C366-V370 WeakPolarHBondContact CB-O 3.26Å; C366-H372 VanDerWaalsContact SG-CD2 3.58Å; C366-H372 PolarHBondContact SG-CE1 3.29Å; C366-H372 PolarHBondContact SG-NE2 2.9Å
367	A	91.9	Very high	94.7	Very high	65 Å²	65	26.9 Å²	26.9	54%	0.537	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-64	163	163.8	0	0	0	0	0	110.5	N237 R365 G369 V370	N237-A367 PolarHBondContact ND2-O 3.22Å; R365-A367 PolarHBondContact O-N 3.22Å; A367-G369 PolarHBondContact O-N 2.54Å; A367-V370 HydrophobicContact CB-CB 4.47Å; A367-V370 HydrophobicContact CB-CG2 4.04Å; A367-V370 PolarHBondContact O-N 3.34Å; A367-V370 VanDerWaalsContact O-N 3.13Å
368	A	90.8	Very high	94.9	Very high	55 Å²	55	26.2 Å²	26.2	46%	0.455	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	127.3	176.1	0	0	0	0	0	110.8	N237 V370 P442	N237-A368 WeakPolarHBondContact OD1-CA 3.42Å; A368-V370 VanDerWaalsContact C-N 3.32Å; A368-V370 PolarHBondContact O-N 3.21Å; A368-P442 HydrophobicContact CB-CB 4.07Å
369	G	93	Very high	94.9	Very high	9 Å²	9	27.5 Å²	27.5	9%	0.093	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	10.6	178.3	0	0	0	0	0	114.9	N237 A367 V411	N237-G369 PolarHBondContact ND2-N 3.03Å; N237-G369 PolarHBondContact OD1-N 3.16Å; A367-G369 PolarHBondContact O-N 2.54Å; G369-V411 WeakPolarHBondContact O-CG1 3.29Å
370	V	96.7	Very high	94.9	Very high	15 Å²	15	26.5 Å²	26.5	9%	0.091	17%	0.174	C	C	.	.			trans	-115.4	147.1	-179.5	-176.1	0	0	0	0	110.4	N237 V301 C366 A367 A368 P409	N237-V370 PolarHBondContact ND2-N 3.4Å; N237-V370 PolarHBondContact ND2-O 3.4Å; V301-V370 HydrophobicContact CG1-CG2 4.18Å; V301-V370 HydrophobicContact CG2-CB 4.15Å; V301-V370 HydrophobicContact CG2-CG1 3.55Å; V301-V370 HydrophobicContact CG2-CG2 3.55Å; C366-V370 VanDerWaalsContact CB-O 3.29Å; C366-V370 WeakPolarHBondContact CB-O 3.26Å; A367-V370 HydrophobicContact CB-CB 4.47Å; A367-V370 HydrophobicContact CB-CG2 4.04Å; A367-V370 PolarHBondContact O-N 3.34Å; A367-V370 VanDerWaalsContact O-N 3.13Å; A368-V370 VanDerWaalsContact C-N 3.32Å; A368-V370 PolarHBondContact O-N 3.21Å; V370-P409 HydrophobicContact CG1-CB 3.87Å
371	M	98.1	Very high	94.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	163.5	164.7	68.9	-177.5	-174.6	0	0	111.2	L239 A348 L350 V410 F413 V440	L239-M371 HydrophobicContact CD1-CE 4.4Å; L239-M371 HydrophobicContact CD1-SD 3.95Å; L239-M371 HydrophobicContact CD2-SD 4.03Å; A348-M371 HydrophobicContact CB-CE 3.86Å; A348-M371 HydrophobicContact CB-SD 3.91Å; L350-M371 HydrophobicContact CD1-CB 4.45Å; L350-M371 HydrophobicContact CG-CB 4.33Å; M371-V410 HydrophobicContact CE-CG2 3.54Å; M371-V410 HydrophobicContact CG-CG2 3.74Å; M371-V410 PolarHBondContact N-O 2.87Å; M371-V410 PolarHBondContact O-N 2.87Å; M371-F413 HydrophobicContact CE-CB 4.36Å; M371-F413 HydrophobicContact CE-CD1 3.31Å; M371-F413 HydrophobicContact CE-CE1 3.86Å; M371-F413 HydrophobicContact CE-CG 4.09Å; M371-V440 HydrophobicContact CB-CG2 3.68Å; M371-V440 HydrophobicContact CE-CG2 4.38Å; M371-V440 HydrophobicContact CG-CG2 3.47Å; M371-V440 VanDerWaalsContact CG-CG2 3.47Å; M371-V440 HydrophobicContact SD-CG2 3.48Å; M371-V440 WeakPolarHBondContact SD-CG2 3.39Å
372	H	98.5	Very high	94.8	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.9	172.4	-54.9	-45.1	0	0	0	110	A348 L349 A361 G364 C366 F374 Y407	A348-H372 CarbonylContact C-O 3.51Å; A348-H372 WeakPolarHBondContact CA-O 3.25Å; L349-H372 HydrophobicContact CB-CB 4.37Å; L349-H372 PolarHBondContact N-O 2.94Å; L349-H372 WeakPolarHBondContact O-CB 3.33Å; L349-H372 PolarHBondContact O-N 3.17Å; A361-H372 WeakPolarHBondContact CB-CD2 3.38Å; G364-H372 PolarHBondContact O-CE1 3.21Å; G364-H372 PolarHBondContact O-NE2 3.12Å; C366-H372 VanDerWaalsContact SG-CD2 3.58Å; C366-H372 PolarHBondContact SG-CE1 3.29Å; C366-H372 PolarHBondContact SG-NE2 2.9Å; H372-F374 HydrophobicContact CB-CD2 4.18Å; H372-F374 HydrophobicContact CB-CE2 3.51Å; H372-F374 HydrophobicContact CB-CZ 4.24Å; H372-Y407 HydrophobicContact CB-CE2 3.82Å; H372-Y407 AromaticContact CG-CE2 3.96Å; H372-Y407 AromaticContact ND1-CE2 3.63Å; H372-Y407 AromaticContact ND1-CZ 3.87Å; H372-Y407 PolarHBondContact ND1-OH 3.33Å; H372-Y407 VanDerWaalsContact ND1-OH 3.17Å
373	L	98.6	Very high	94.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.5	168.6	-177.4	66	0	0	0	109	L296 Y298 V346 L347 A348 Y407 M408 V410	L296-L373 HydrophobicContact CD2-CD2 4.48Å; Y298-L373 HydrophobicContact CD1-CD2 3.58Å; Y298-L373 HydrophobicContact CE1-CD2 4.38Å; Y298-L373 HydrophobicContact CG-CD2 3.67Å; V346-L373 HydrophobicContact CG1-CD1 4.02Å; L347-L373 WeakPolarHBondContact O-CA 3.26Å; A348-L373 HydrophobicContact CB-CD1 4.47Å; L373-Y407 CarbonylContact O-C 3.53Å; L373-Y407 WeakPolarHBondContact O-CA 3.43Å; L373-M408 WeakPolarHBondContact CB-O 3.38Å; L373-M408 PolarHBondContact N-O 3.42Å; L373-M408 PolarHBondContact O-N 2.92Å; L373-V410 HydrophobicContact CB-CG1 3.96Å; L373-V410 HydrophobicContact CB-CG2 3.74Å; L373-V410 HydrophobicContact CD2-CG1 3.99Å; L373-V410 HydrophobicContact CD2-CG2 4.37Å
374	F	98.6	Very high	95.1	Very high	7 Å²	7	37.7 Å²	37.7	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.2	171.9	-59.7	-92.7	0	0	0	109.6	V346 L347 L349 A360 A361 M363 H372 M398 L405 V406 Y407	V346-F374 CarbonylContact C-O 3.55Å; V346-F374 WeakPolarHBondContact CA-O 3.49Å; L347-F374 HydrophobicContact CB-CB 4.31Å; L347-F374 HydrophobicContact CD2-CD2 4.17Å; L347-F374 PolarHBondContact N-O 3.37Å; L347-F374 PolarHBondContact O-N 2.9Å; L349-F374 HydrophobicContact CD2-CE2 4.4Å; A360-F374 WeakPolarHBondContact O-CZ 3.19Å; A361-F374 HydrophobicContact CB-CE2 4.28Å; A361-F374 HydrophobicContact CB-CZ 4.09Å; M363-F374 HydrophobicContact CE-CE1 3.89Å; M363-F374 HydrophobicContact CE-CZ 3.79Å; M363-F374 HydrophobicContact SD-CZ 4.15Å; H372-F374 HydrophobicContact CB-CD2 4.18Å; H372-F374 HydrophobicContact CB-CE2 3.51Å; H372-F374 HydrophobicContact CB-CZ 4.24Å; F374-M398 HydrophobicContact CE1-SD 4.26Å; F374-L405 HydrophobicContact CD1-CD1 4.35Å; F374-V406 VanDerWaalsContact CA-O 3.31Å; F374-V406 WeakPolarHBondContact CA-O 3.46Å; F374-Y407 AromaticContact CD1-CD2 3.87Å; F374-Y407 HydrophobicContact CD1-CD2 3.87Å; F374-Y407 HydrophobicContact CD1-CG 4.38Å; F374-Y407 HydrophobicContact CD2-CD2 4.49Å; F374-Y407 AromaticContact CE1-CD2 3.39Å; F374-Y407 HydrophobicContact CE1-CD2 3.39Å; F374-Y407 HydrophobicContact CE1-CE2 4.25Å; F374-Y407 AromaticContact CE1-CG 3.98Å; F374-Y407 HydrophobicContact CE1-CG 3.98Å; F374-Y407 HydrophobicContact CE2-CD2 4.08Å; F374-Y407 HydrophobicContact CE2-CE2 4.37Å; F374-Y407 HydrophobicContact CG-CD2 4.41Å; F374-Y407 AromaticContact CZ-CD2 3.51Å; F374-Y407 HydrophobicContact CZ-CD2 3.51Å; F374-Y407 AromaticContact CZ-CE2 3.93Å; F374-Y407 HydrophobicContact CZ-CE2 3.93Å; F374-Y407 HydrophobicContact CZ-CG 4.47Å
375	Y	98.4	Very high	95.7	Very high	18 Å²	18	37.2 Å²	37.2	7%	0.071	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.9	164.4	61.5	-89.3	0	0	0	110.3	L296 Y298 V338 F343 L345 R377 V406	L296-Y375 HydrophobicContact CD2-CD1 3.7Å; L296-Y375 HydrophobicContact CD2-CE1 4.27Å; L296-Y375 HydrophobicContact CD2-CG 3.92Å; Y298-Y375 HydrophobicContact CE1-CE1 4.26Å; V338-Y375 HydrophobicContact CG1-CE2 4.07Å; V338-Y375 HydrophobicContact CG2-CE1 4.3Å; F343-Y375 AromaticContact CD1-CD2 3.94Å; F343-Y375 HydrophobicContact CD1-CD2 3.94Å; F343-Y375 HydrophobicContact CD1-CG 4.37Å; F343-Y375 AromaticContact CE1-CD2 3.6Å; F343-Y375 HydrophobicContact CE1-CD2 3.6Å; F343-Y375 HydrophobicContact CE1-CE2 4.16Å; F343-Y375 HydrophobicContact CE1-CG 4.13Å; L345-Y375 VanDerWaalsContact O-CA 3.27Å; L345-Y375 WeakPolarHBondContact O-CA 3.21Å; Y375-R377 HydrophobicContact CD2-CG 4.16Å; Y375-R377 HydrophobicContact CE2-CG 3.99Å; Y375-V406 HydrophobicContact CD1-CB 4.06Å; Y375-V406 HydrophobicContact CD1-CG1 4.39Å; Y375-V406 HydrophobicContact CD2-CB 4.08Å; Y375-V406 HydrophobicContact CD2-CG2 4.24Å; Y375-V406 HydrophobicContact CE1-CB 3.61Å; Y375-V406 HydrophobicContact CE1-CG1 3.56Å; Y375-V406 HydrophobicContact CE1-CG2 4.39Å; Y375-V406 HydrophobicContact CE2-CB 3.65Å; Y375-V406 HydrophobicContact CE2-CG1 4.26Å; Y375-V406 HydrophobicContact CE2-CG2 3.58Å; Y375-V406 HydrophobicContact CG-CB 4.29Å; Y375-V406 VanDerWaalsContact CZ-CG1 3.5Å; Y375-V406 PolarHBondContact N-O 2.94Å; Y375-V406 PolarHBondContact O-N 2.65Å; Y375-V406 WeakPolarHBondContact OH-CG1 3.39Å
376	V	98.3	Very high	96	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.9	175.6	-178.6	0	0	0	0	108.8	F343 V344 L345 V380 L385 Y404 L405	F343-V376 CarbonylContact C-O 3.5Å; F343-V376 WeakPolarHBondContact CA-O 3.2Å; V344-V376 HydrophobicContact CB-CB 4.13Å; V344-V376 HydrophobicContact CB-CG1 4.08Å; V344-V376 HydrophobicContact CG2-CG1 4.38Å; V344-V376 PolarHBondContact N-O 2.9Å; L345-V376 HydrophobicContact CD1-CG2 4.02Å; L345-V376 HydrophobicContact CD2-CB 4.37Å; L345-V376 HydrophobicContact CD2-CG2 3.87Å; L345-V376 HydrophobicContact CG-CB 3.98Å; L345-V376 HydrophobicContact CG-CG2 3.76Å; L345-V376 PolarHBondContact O-N 3.1Å; V376-V380 HydrophobicContact CG1-CB 4.2Å; V376-V380 HydrophobicContact CG1-CG1 3.66Å; V376-L385 HydrophobicContact CG1-CD2 4.21Å; V376-Y404 CarbonylContact C-O 3.51Å; V376-Y404 VanDerWaalsContact CA-O 3.29Å; V376-Y404 WeakPolarHBondContact CA-O 3.33Å; V376-L405 HydrophobicContact CG2-CB 4.45Å; V376-L405 HydrophobicContact CG2-CD1 3.69Å
377	R	97.3	Very high	96.3	Very high	91 Å²	91	40 Å²	40	34%	0.343	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	150.4	178.4	-59.1	171.1	69.2	-161.3	3.1	110.7	D340 Y375 Y404	D340-R377 IonicContact OD1-CZ 2.89Å; D340-R377 VanDerWaalsContact OD1-CZ 3.23Å; D340-R377 IonicContact OD1-NE 2.86Å; D340-R377 PolarHBondContact OD1-NE 2.88Å; D340-R377 IonicContact OD1-NH2 3.58Å; D340-R377 PolarHBondContact OD1-NH2 2.84Å; D340-R377 IonicContact OD2-CZ 3.21Å; D340-R377 IonicContact OD2-NE 3.43Å; D340-R377 PolarHBondContact OD2-NE 3.18Å; D340-R377 IonicContact OD2-NH2 3.17Å; D340-R377 PolarHBondContact OD2-NH2 3.03Å; Y375-R377 HydrophobicContact CD2-CG 4.16Å; Y375-R377 HydrophobicContact CE2-CG 3.99Å; R377-Y404 HydrophobicContact CB-CD1 4.28Å; R377-Y404 PolarHBondContact N-O 2.91Å
378	A	95.8	Very high	96.6	Very high	37 Å²	37	37.6 Å²	37.6	31%	0.306	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	152.2	168.6	0	0	0	0	0	111.9	T291 D342 Y404	T291-A378 HydrophobicContact CG2-CB 3.76Å; D342-A378 HydrophobicContact CB-CB 3.64Å; D342-A378 WeakPolarHBondContact O-CB 3.35Å; D342-A378 PolarHBondContact O-N 3.14Å; A378-Y404 WeakPolarHBondContact O-CD1 3.29Å; A378-Y404 WeakPolarHBondContact O-CE1 3.48Å
379	G	95.1	Very high	96.8	Very high	58 Å²	58	36.7 Å²	36.7	60%	0.598	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.4	-12.4	-179.1	0	0	0	0	0	115.1	Y404	G379-Y404 VanDerWaalsContact C-CE1 3.4Å
380	V	96.4	Very high	96.9	Very high	10 Å²	10	38.5 Å²	38.5	6%	0.061	21%	0.21	C	C	.	.			trans	-63.5	136.5	172.9	67.8	0	0	0	0	111.3	V344 V376 M384 L385 Y404	V344-V380 HydrophobicContact CG2-CG1 3.84Å; V376-V380 HydrophobicContact CG1-CB 4.2Å; V376-V380 HydrophobicContact CG1-CG1 3.66Å; V380-M384 HydrophobicContact CG2-CB 3.89Å; V380-M384 HydrophobicContact CG2-CG 3.94Å; V380-L385 HydrophobicContact CB-CG 4.48Å; V380-L385 HydrophobicContact CG1-CD1 3.73Å; V380-L385 HydrophobicContact CG1-CD2 3.95Å; V380-L385 HydrophobicContact CG1-CG 3.69Å; V380-L385 HydrophobicContact CG2-CD2 4.27Å; V380-L385 HydrophobicContact CG2-CG 3.95Å; V380-Y404 HydrophobicContact CB-CD1 4.25Å; V380-Y404 HydrophobicContact CB-CD2 3.95Å; V380-Y404 HydrophobicContact CB-CG 3.73Å; V380-Y404 HydrophobicContact CG2-CD2 4.12Å; V380-Y404 HydrophobicContact CG2-CG 4.28Å
381	S	96.5	Very high	96.9	Very high	64 Å²	64	38.5 Å²	38.5	45%	0.448	21%	0.211	S	C	.	.			trans	-76.9	149.9	177.2	73.2	0	0	0	0	111.8	A383 M384 L385	S381-A383 PolarHBondContact O-N 3.18Å; S381-M384 PolarHBondContact O-N 3.41Å; S381-M384 WeakPolarHBondContact OG-CB 3.37Å; S381-M384 PolarHBondContact OG-N 3Å; S381-L385 PolarHBondContact O-N 3.47Å
382	R	96.3	Very high	96.7	Very high	132 Å²	132	39.8 Å²	39.8	50%	0.498	22%	0.218	S	C	.	.	H	α-helix	trans	-54.5	-38.9	174	-64.6	175.2	-172.5	-169.9	-3.1	112.2	L286 A287 L289 M384 L385 L386	L286-R382 HydrophobicContact CD1-CB 4.19Å; L286-R382 HydrophobicContact CD1-CG 4.46Å; L286-R382 HydrophobicContact CG-CB 4.26Å; L286-R382 WeakPolarHBondContact O-CD 3.41Å; A287-R382 VanDerWaalsContact O-CZ 3.29Å; A287-R382 PolarHBondContact O-NH1 3.28Å; A287-R382 PolarHBondContact O-NH2 3.26Å; L289-R382 HydrophobicContact CB-CG 4.1Å; L289-R382 HydrophobicContact CD2-CG 3.75Å; R382-M384 VanDerWaalsContact C-N 3.34Å; R382-M384 PolarHBondContact O-N 2.88Å; R382-L385 PolarHBondContact O-N 2.91Å; R382-L386 WeakPolarHBondContact O-CB 3.44Å; R382-L386 PolarHBondContact O-N 2.97Å
383	A	96	Very high	96.5	Very high	60 Å²	60	41.9 Å²	41.9	50%	0.496	23%	0.228	S	C	.	.	H	α-helix	trans	-67.3	-33.1	178	0	0	0	0	0	112.9	S381 R387	S381-A383 PolarHBondContact O-N 3.18Å; A383-R387 WeakPolarHBondContact O-CG 3.33Å; A383-R387 PolarHBondContact O-N 2.62Å; A383-R387 PolarHBondContact O-NE 2.84Å
384	M	97.3	Very high	96.2	Very high	34 Å²	34	48.9 Å²	48.9	17%	0.167	26%	0.258	C	S	.	.	H	α-helix	trans	-72	-47.1	173.5	-177	57.8	86.7	0	0	111	V380 S381 R382 L386 R387 L388 C402	V380-M384 HydrophobicContact CG2-CB 3.89Å; V380-M384 HydrophobicContact CG2-CG 3.94Å; S381-M384 PolarHBondContact O-N 3.41Å; S381-M384 WeakPolarHBondContact OG-CB 3.37Å; S381-M384 PolarHBondContact OG-N 3Å; R382-M384 VanDerWaalsContact C-N 3.34Å; R382-M384 PolarHBondContact O-N 2.88Å; M384-L386 VanDerWaalsContact C-N 3.26Å; M384-L386 PolarHBondContact O-N 3.31Å; M384-R387 WeakPolarHBondContact O-CB 3.09Å; M384-R387 PolarHBondContact O-N 3.49Å; M384-L388 HydrophobicContact CG-CD1 4.33Å; M384-L388 HydrophobicContact CG-CG 4.46Å; M384-L388 WeakPolarHBondContact O-CG 3.47Å; M384-L388 PolarHBondContact O-N 3.09Å; M384-L388 HydrophobicContact SD-CG 4.47Å; M384-C402 HydrophobicContact CG-CB 4.49Å
385	L	96.9	Very high	96.1	Very high	16 Å²	16	49 Å²	49	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-56	-40.7	174.9	-78.6	175.3	0	0	0	112.5	L286 L289 V344 V376 V380 S381 R382 R387 L388 F389	L286-L385 HydrophobicContact CD1-CB 3.63Å; L286-L385 HydrophobicContact CD1-CD1 3.94Å; L286-L385 HydrophobicContact CD1-CG 4.47Å; L289-L385 HydrophobicContact CD1-CD1 3.66Å; L289-L385 HydrophobicContact CD2-CD1 3.68Å; L289-L385 HydrophobicContact CG-CD1 4.35Å; V344-L385 HydrophobicContact CG1-CD1 4.05Å; V376-L385 HydrophobicContact CG1-CD2 4.21Å; V380-L385 HydrophobicContact CB-CG 4.48Å; V380-L385 HydrophobicContact CG1-CD1 3.73Å; V380-L385 HydrophobicContact CG1-CD2 3.95Å; V380-L385 HydrophobicContact CG1-CG 3.69Å; V380-L385 HydrophobicContact CG2-CD2 4.27Å; V380-L385 HydrophobicContact CG2-CG 3.95Å; S381-L385 PolarHBondContact O-N 3.47Å; R382-L385 PolarHBondContact O-N 2.91Å; L385-R387 PolarHBondContact O-N 2.65Å; L385-L388 PolarHBondContact O-N 3.32Å; L385-F389 WeakPolarHBondContact O-CB 3.32Å; L385-F389 PolarHBondContact O-N 2.93Å
386	L	95.7	Very high	96.1	Very high	56 Å²	56	54.7 Å²	54.7	29%	0.293	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-44.7	174.1	-178.4	54.7	0	0	0	112.3	F283 L286 R382 M384 F389 L390	F283-L386 HydrophobicContact CD1-CD1 4.28Å; F283-L386 HydrophobicContact CE1-CD1 3.64Å; L286-L386 HydrophobicContact CD2-CB 3.73Å; L286-L386 HydrophobicContact CD2-CD1 4.2Å; L286-L386 HydrophobicContact CD2-CG 4.4Å; R382-L386 WeakPolarHBondContact O-CB 3.44Å; R382-L386 PolarHBondContact O-N 2.97Å; M384-L386 VanDerWaalsContact C-N 3.26Å; M384-L386 PolarHBondContact O-N 3.31Å; L386-F389 PolarHBondContact O-N 3.41Å; L386-L390 HydrophobicContact CD1-CD1 3.93Å; L386-L390 HydrophobicContact CD1-CG 4Å; L386-L390 HydrophobicContact CG-CD1 3.99Å; L386-L390 HydrophobicContact CG-CG 4.44Å; L386-L390 WeakPolarHBondContact O-CB 3.27Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.33Å; L386-L390 PolarHBondContact O-N 3.39Å
387	R	96.9	Very high	96	Very high	105 Å²	105	55.1 Å²	55.1	40%	0.396	28%	0.284	S	S	.	.	H	α-helix	trans	-63.4	-43.7	178.1	-78.4	-176.4	-76.3	155.5	-11	111.6	A383 M384 L385 L390 A391 Y400	A383-R387 WeakPolarHBondContact O-CG 3.33Å; A383-R387 PolarHBondContact O-N 2.62Å; A383-R387 PolarHBondContact O-NE 2.84Å; M384-R387 WeakPolarHBondContact O-CB 3.09Å; M384-R387 PolarHBondContact O-N 3.49Å; L385-R387 PolarHBondContact O-N 2.65Å; R387-L390 PolarHBondContact O-N 3.26Å; R387-A391 VanDerWaalsContact O-CB 3.25Å; R387-A391 WeakPolarHBondContact O-CB 3.22Å; R387-A391 PolarHBondContact O-N 3.05Å; R387-Y400 HydrophobicContact CB-CE1 4.39Å; R387-Y400 HydrophobicContact CB-CE2 4.36Å
388	L	97.3	Very high	96	Very high	14 Å²	14	52.2 Å²	52.2	7%	0.073	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-49.2	175	-65.3	174.3	0	0	0	110.8	M384 L385 L390 A391 M392 H397 Y400 C402 L405	M384-L388 HydrophobicContact CG-CD1 4.33Å; M384-L388 HydrophobicContact CG-CG 4.46Å; M384-L388 WeakPolarHBondContact O-CG 3.47Å; M384-L388 PolarHBondContact O-N 3.09Å; M384-L388 HydrophobicContact SD-CG 4.47Å; L385-L388 PolarHBondContact O-N 3.32Å; L388-L390 PolarHBondContact O-N 3.09Å; L388-A391 PolarHBondContact O-N 3.13Å; L388-M392 PolarHBondContact O-N 3.16Å; L388-H397 HydrophobicContact CB-CB 4.41Å; L388-H397 HydrophobicContact CD2-CB 4.18Å; L388-H397 VanDerWaalsContact CD2-O 3.24Å; L388-H397 WeakPolarHBondContact CD2-O 3.42Å; L388-H397 VanDerWaalsContact O-CB 3.31Å; L388-H397 WeakPolarHBondContact O-CB 3.14Å; L388-Y400 HydrophobicContact CD2-CD2 4.14Å; L388-Y400 HydrophobicContact CD2-CG 4.38Å; L388-C402 HydrophobicContact CD1-CB 4.24Å; L388-C402 HydrophobicContact CD2-CB 4.22Å; L388-L405 HydrophobicContact CD1-CB 4.48Å; L388-L405 HydrophobicContact CD1-CD2 4.39Å; L388-L405 HydrophobicContact CD2-CD2 4.3Å
389	F	95.2	Very high	96	Very high	35 Å²	35	56.1 Å²	56.1	15%	0.154	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-48.7	178.2	174.7	-106.3	0	0	0	112.5	T279 T282 M358 L385 L386 A391 M392	T279-F389 HydrophobicContact CG2-CE1 4.24Å; T279-F389 HydrophobicContact CG2-CZ 4.41Å; T282-F389 HydrophobicContact CG2-CD1 3.89Å; T282-F389 HydrophobicContact CG2-CD2 3.81Å; T282-F389 HydrophobicContact CG2-CE1 4.01Å; T282-F389 HydrophobicContact CG2-CE2 3.94Å; T282-F389 HydrophobicContact CG2-CG 3.79Å; T282-F389 HydrophobicContact CG2-CZ 4.04Å; M358-F389 HydrophobicContact SD-CE2 4.23Å; L385-F389 WeakPolarHBondContact O-CB 3.32Å; L385-F389 PolarHBondContact O-N 2.93Å; L386-F389 PolarHBondContact O-N 3.41Å; F389-A391 VanDerWaalsContact C-N 3.3Å; F389-A391 PolarHBondContact O-N 2.72Å; F389-M392 HydrophobicContact CD2-CE 3.84Å; F389-M392 HydrophobicContact CE2-CE 4.15Å; F389-M392 VanDerWaalsContact O-CB 3.26Å; F389-M392 WeakPolarHBondContact O-CB 3.06Å; F389-M392 PolarHBondContact O-N 2.93Å
390	L	94.3	Very high	96	Very high	48 Å²	48	58.1 Å²	58.1	25%	0.251	28%	0.277	S	S	.	.	H	α-helix	trans	-65.7	-32	179.4	-68.5	174.4	0	0	0	112.8	M1 L386 R387 L388 M392	M1-L390 HydrophobicContact CE-CD1 4.44Å; L386-L390 HydrophobicContact CD1-CD1 3.93Å; L386-L390 HydrophobicContact CD1-CG 4Å; L386-L390 HydrophobicContact CG-CD1 3.99Å; L386-L390 HydrophobicContact CG-CG 4.44Å; L386-L390 WeakPolarHBondContact O-CB 3.27Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.33Å; L386-L390 PolarHBondContact O-N 3.39Å; R387-L390 PolarHBondContact O-N 3.26Å; L388-L390 PolarHBondContact O-N 3.09Å; L390-M392 VanDerWaalsContact C-N 3.32Å
391	A	96.5	Very high	96	Very high	15 Å²	15	64.2 Å²	64.2	12%	0.124	31%	0.305	C	S	.	.	H	α-helix	trans	-77.6	-18.9	177.3	0	0	0	0	0	113.2	R387 L388 F389 E393 K394 G395 R396 H397 Y400	R387-A391 VanDerWaalsContact O-CB 3.25Å; R387-A391 WeakPolarHBondContact O-CB 3.22Å; R387-A391 PolarHBondContact O-N 3.05Å; L388-A391 PolarHBondContact O-N 3.13Å; F389-A391 VanDerWaalsContact C-N 3.3Å; F389-A391 PolarHBondContact O-N 2.72Å; A391-E393 PolarHBondContact O-N 2.86Å; A391-K394 PolarHBondContact O-N 3.19Å; A391-G395 PolarHBondContact O-N 3.16Å; A391-R396 HydrophobicContact CB-CB 4.27Å; A391-R396 PolarHBondContact O-N 3.46Å; A391-H397 HydrophobicContact CB-CB 4.1Å; A391-Y400 HydrophobicContact CB-CD2 4.35Å; A391-Y400 HydrophobicContact CB-CE2 3.7Å
392	M	95.6	Very high	96	Very high	27 Å²	27	61.6 Å²	61.6	13%	0.133	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-25.4	175.3	-166	169.1	57.2	0	0	112.8	L354 M358 F359 A360 L388 F389 L390 K394 G395	L354-M392 HydrophobicContact CD1-SD 4.26Å; M358-M392 HydrophobicContact CB-CE 4.06Å; M358-M392 HydrophobicContact CG-CE 3.97Å; M358-M392 HydrophobicContact SD-CE 3.83Å; F359-M392 CarbonylContact C-O 3.59Å; F359-M392 PolarHBondContact N-O 3.45Å; A360-M392 HydrophobicContact CB-CG 4.34Å; A360-M392 HydrophobicContact CB-SD 3.86Å; L388-M392 PolarHBondContact O-N 3.16Å; F389-M392 HydrophobicContact CD2-CE 3.84Å; F389-M392 HydrophobicContact CE2-CE 4.15Å; F389-M392 VanDerWaalsContact O-CB 3.26Å; F389-M392 WeakPolarHBondContact O-CB 3.06Å; F389-M392 PolarHBondContact O-N 2.93Å; L390-M392 VanDerWaalsContact C-N 3.32Å; M392-K394 PolarHBondContact O-N 3.17Å; M392-K394 VanDerWaalsContact O-N 3.1Å; M392-G395 PolarHBondContact O-N 2.98Å; M392-G395 VanDerWaalsContact O-N 3.12Å
393	E	93.1	Very high	96	Very high	49 Å²	49	59.9 Å²	59.9	23%	0.229	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.3	173.2	-171.9	-172.6	168	0	0	112.5	Q214 E357 A391	Q214-E393 PolarHBondContact NE2-O 3.48Å; Q214-E393 PolarHBondContact OE1-O 3.47Å; E357-E393 WeakPolarHBondContact O-CA 3.33Å; A391-E393 PolarHBondContact O-N 2.86Å
394	K	93.8	Very high	96.1	Very high	147 Å²	147	61 Å²	61	64%	0.639	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	12.4	-179.5	-62	-172.2	177.4	-171.2	0	113.3	A391 M392 R396	A391-K394 PolarHBondContact O-N 3.19Å; M392-K394 PolarHBondContact O-N 3.17Å; M392-K394 VanDerWaalsContact O-N 3.1Å; K394-R396 VanDerWaalsContact C-N 3.26Å; K394-R396 HydrophobicContact CB-CG 4.14Å; K394-R396 PolarHBondContact O-N 3.31Å
395	G	96.1	Very high	96.1	Very high	9 Å²	9	60.9 Å²	60.9	9%	0.093	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	24.7	-177	0	0	0	0	0	115	F359 P362 A391 M392	F359-G395 WeakPolarHBondContact O-CA 3.31Å; P362-G395 VanDerWaalsContact CB-O 3.28Å; P362-G395 WeakPolarHBondContact CB-O 3.46Å; P362-G395 VanDerWaalsContact CG-O 3.25Å; P362-G395 WeakPolarHBondContact CG-O 3.49Å; A391-G395 PolarHBondContact O-N 3.16Å; M392-G395 PolarHBondContact O-N 2.98Å; M392-G395 VanDerWaalsContact O-N 3.12Å
396	R	97.2	Very high	96.2	Very high	138 Å²	138	61.4 Å²	61.4	52%	0.521	29%	0.288	S	S	.	.			trans	-98.8	3.7	-176.5	-62.2	-163	178.5	-165.5	-4.1	114.6	A391 K394 M398 E399	A391-R396 HydrophobicContact CB-CB 4.27Å; A391-R396 PolarHBondContact O-N 3.46Å; K394-R396 VanDerWaalsContact C-N 3.26Å; K394-R396 HydrophobicContact CB-CG 4.14Å; K394-R396 PolarHBondContact O-N 3.31Å; R396-M398 PolarHBondContact O-N 3Å; R396-E399 HydrophobicContact CB-CG 4.33Å; R396-E399 WeakPolarHBondContact CD-OE1 3.32Å; R396-E399 VanDerWaalsContact CG-OE1 3.29Å; R396-E399 WeakPolarHBondContact CG-OE1 3.41Å; R396-E399 IonicContact NE-OE1 3.91Å; R396-E399 VanDerWaalsContact O-CB 3.31Å; R396-E399 WeakPolarHBondContact O-CB 3.33Å; R396-E399 PolarHBondContact O-N 3.17Å; R396-E399 VanDerWaalsContact O-N 3.08Å
397	H	97.2	Very high	96.3	Very high	12 Å²	12	61 Å²	61	6%	0.056	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-65	-25.9	-175.9	58.6	-83.9	0	0	0	112.8	F359 A360 L388 A391 E399	F359-H397 PolarHBondContact O-CE1 3.46Å; A360-H397 PolarHBondContact O-CE1 2.89Å; A360-H397 PolarHBondContact O-NE2 3.47Å; L388-H397 HydrophobicContact CB-CB 4.41Å; L388-H397 HydrophobicContact CD2-CB 4.18Å; L388-H397 VanDerWaalsContact CD2-O 3.24Å; L388-H397 WeakPolarHBondContact CD2-O 3.42Å; L388-H397 VanDerWaalsContact O-CB 3.31Å; L388-H397 WeakPolarHBondContact O-CB 3.14Å; A391-H397 HydrophobicContact CB-CB 4.1Å; H397-E399 VanDerWaalsContact C-N 3.32Å
398	M	96.6	Very high	96.3	Very high	30 Å²	30	58.4 Å²	58.4	15%	0.148	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-72.4	-22	174.9	-57.1	-54.7	-70	0	0	113.2	P362 M363 F374 R396 Y400 E401 L405 Y407	P362-M398 HydrophobicContact CG-CG 3.89Å; M363-M398 HydrophobicContact CE-CE 4.27Å; M363-M398 HydrophobicContact CE-CG 4.38Å; F374-M398 HydrophobicContact CE1-SD 4.26Å; R396-M398 PolarHBondContact O-N 3Å; M398-Y400 PolarHBondContact O-N 2.92Å; M398-E401 PolarHBondContact O-N 3.1Å; M398-L405 HydrophobicContact SD-CD2 3.85Å; M398-Y407 HydrophobicContact CE-CG 4.41Å
399	E	96.5	Very high	96.3	Very high	120 Å²	120	59.5 Å²	59.5	56%	0.561	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68	-18	178.2	-59	173.7	-171.2	0	0	112.7	R396 H397 E401	R396-E399 HydrophobicContact CB-CG 4.33Å; R396-E399 WeakPolarHBondContact CD-OE1 3.32Å; R396-E399 VanDerWaalsContact CG-OE1 3.29Å; R396-E399 WeakPolarHBondContact CG-OE1 3.41Å; R396-E399 IonicContact NE-OE1 3.91Å; R396-E399 VanDerWaalsContact O-CB 3.31Å; R396-E399 WeakPolarHBondContact O-CB 3.33Å; R396-E399 PolarHBondContact O-N 3.17Å; R396-E399 VanDerWaalsContact O-N 3.08Å; H397-E399 VanDerWaalsContact C-N 3.32Å; E399-E401 PolarHBondContact O-N 3.34Å
400	Y	95.5	Very high	96.5	Very high	99 Å²	99	57.9 Å²	57.9	39%	0.388	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-74.7	-12	177.7	-78.8	-76.2	0	0	0	114	R387 L388 A391 M398 C402	R387-Y400 HydrophobicContact CB-CE1 4.39Å; R387-Y400 HydrophobicContact CB-CE2 4.36Å; L388-Y400 HydrophobicContact CD2-CD2 4.14Å; L388-Y400 HydrophobicContact CD2-CG 4.38Å; A391-Y400 HydrophobicContact CB-CD2 4.35Å; A391-Y400 HydrophobicContact CB-CE2 3.7Å; M398-Y400 PolarHBondContact O-N 2.92Å; Y400-C402 PolarHBondContact O-N 3.26Å
401	E	95.7	Very high	96.6	Very high	138 Å²	138	56.2 Å²	56.2	65%	0.645	27%	0.268	S	S	*	.			trans	45.8	42.3	-177.3	-60.2	-171.5	149.1	0	0	112.3	M398 E399 P403	M398-E401 PolarHBondContact O-N 3.1Å; E399-E401 PolarHBondContact O-N 3.34Å; E401-P403 WeakPolarHBondContact O-CD 3.28Å
402	C	96.5	Very high	96.7	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.061	26%	0.262	C	S	.	.			trans	-66.2	119.2	-175.6	-178.5	0	0	0	0	109.7	M384 L388 Y400 Y404 L405	M384-C402 HydrophobicContact CG-CB 4.49Å; L388-C402 HydrophobicContact CD1-CB 4.24Å; L388-C402 HydrophobicContact CD2-CB 4.22Å; Y400-C402 PolarHBondContact O-N 3.26Å; C402-Y404 PolarHBondContact O-N 2.71Å; C402-L405 HydrophobicContact CB-CB 4.21Å; C402-L405 PolarHBondContact O-N 3.34Å
403	P	96.8	Very high	96.9	Very high	96 Å²	96	54.2 Å²	54.2	62%	0.623	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.5	-174.5	28.3	-36.6	0	0	0	113.6	E401	E401-P403 WeakPolarHBondContact O-CD 3.28Å
404	Y	97.8	Very high	97.1	Very high	85 Å²	85	52.2 Å²	52.2	33%	0.333	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-25.8	176.2	-59.4	-83.5	0	0	0	112.6	V376 R377 A378 G379 V380 C402	V376-Y404 CarbonylContact C-O 3.51Å; V376-Y404 VanDerWaalsContact CA-O 3.29Å; V376-Y404 WeakPolarHBondContact CA-O 3.33Å; R377-Y404 HydrophobicContact CB-CD1 4.28Å; R377-Y404 PolarHBondContact N-O 2.91Å; A378-Y404 WeakPolarHBondContact O-CD1 3.29Å; A378-Y404 WeakPolarHBondContact O-CE1 3.48Å; G379-Y404 VanDerWaalsContact C-CE1 3.4Å; V380-Y404 HydrophobicContact CB-CD1 4.25Å; V380-Y404 HydrophobicContact CB-CD2 3.95Å; V380-Y404 HydrophobicContact CB-CG 3.73Å; V380-Y404 HydrophobicContact CG2-CD2 4.12Å; V380-Y404 HydrophobicContact CG2-CG 4.28Å; C402-Y404 PolarHBondContact O-N 2.71Å
405	L	98.1	Very high	97.3	Very high	30 Å²	30	45.2 Å²	45.2	16%	0.157	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.5	178.9	173.9	63.3	0	0	0	108.6	F374 V376 L388 M398 C402	F374-L405 HydrophobicContact CD1-CD1 4.35Å; V376-L405 HydrophobicContact CG2-CB 4.45Å; V376-L405 HydrophobicContact CG2-CD1 3.69Å; L388-L405 HydrophobicContact CD1-CB 4.48Å; L388-L405 HydrophobicContact CD1-CD2 4.39Å; L388-L405 HydrophobicContact CD2-CD2 4.3Å; M398-L405 HydrophobicContact SD-CD2 3.85Å; C402-L405 HydrophobicContact CB-CB 4.21Å; C402-L405 PolarHBondContact O-N 3.34Å
406	V	98.1	Very high	97.3	Very high	28 Å²	28	47.4 Å²	47.4	17%	0.17	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137	176.7	-175.1	0	0	0	0	109.4	F374 Y375 M408	F374-V406 VanDerWaalsContact CA-O 3.31Å; F374-V406 WeakPolarHBondContact CA-O 3.46Å; Y375-V406 HydrophobicContact CD1-CB 4.06Å; Y375-V406 HydrophobicContact CD1-CG1 4.39Å; Y375-V406 HydrophobicContact CD2-CB 4.08Å; Y375-V406 HydrophobicContact CD2-CG2 4.24Å; Y375-V406 HydrophobicContact CE1-CB 3.61Å; Y375-V406 HydrophobicContact CE1-CG1 3.56Å; Y375-V406 HydrophobicContact CE1-CG2 4.39Å; Y375-V406 HydrophobicContact CE2-CB 3.65Å; Y375-V406 HydrophobicContact CE2-CG1 4.26Å; Y375-V406 HydrophobicContact CE2-CG2 3.58Å; Y375-V406 HydrophobicContact CG-CB 4.29Å; Y375-V406 VanDerWaalsContact CZ-CG1 3.5Å; Y375-V406 PolarHBondContact N-O 2.94Å; Y375-V406 PolarHBondContact O-N 2.65Å; Y375-V406 WeakPolarHBondContact OH-CG1 3.39Å; V406-M408 HydrophobicContact CG1-CG 4.4Å
407	Y	97.9	Very high	97.1	Very high	46 Å²	46	42 Å²	42	18%	0.18	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.9	173.2	163.9	-101.8	0	0	0	109.8	M363 H372 L373 F374 M398	M363-Y407 HydrophobicContact CE-CD1 3.86Å; M363-Y407 HydrophobicContact CE-CD2 3.57Å; M363-Y407 HydrophobicContact CE-CE1 3.85Å; M363-Y407 HydrophobicContact CE-CE2 3.52Å; M363-Y407 HydrophobicContact CE-CG 3.71Å; M363-Y407 HydrophobicContact CG-CE1 4.02Å; M363-Y407 HydrophobicContact CG-CE2 4.17Å; M363-Y407 VanDerWaalsContact CG-OH 3.26Å; M363-Y407 WeakPolarHBondContact CG-OH 3.49Å; M363-Y407 HydrophobicContact SD-CD2 4.34Å; M363-Y407 HydrophobicContact SD-CE1 4.45Å; M363-Y407 HydrophobicContact SD-CE2 3.72Å; H372-Y407 HydrophobicContact CB-CE2 3.82Å; H372-Y407 AromaticContact CG-CE2 3.96Å; H372-Y407 AromaticContact ND1-CE2 3.63Å; H372-Y407 AromaticContact ND1-CZ 3.87Å; H372-Y407 PolarHBondContact ND1-OH 3.33Å; H372-Y407 VanDerWaalsContact ND1-OH 3.17Å; L373-Y407 CarbonylContact O-C 3.53Å; L373-Y407 WeakPolarHBondContact O-CA 3.43Å; F374-Y407 AromaticContact CD1-CD2 3.87Å; F374-Y407 HydrophobicContact CD1-CD2 3.87Å; F374-Y407 HydrophobicContact CD1-CG 4.38Å; F374-Y407 HydrophobicContact CD2-CD2 4.49Å; F374-Y407 AromaticContact CE1-CD2 3.39Å; F374-Y407 HydrophobicContact CE1-CD2 3.39Å; F374-Y407 HydrophobicContact CE1-CE2 4.25Å; F374-Y407 AromaticContact CE1-CG 3.98Å; F374-Y407 HydrophobicContact CE1-CG 3.98Å; F374-Y407 HydrophobicContact CE2-CD2 4.08Å; F374-Y407 HydrophobicContact CE2-CE2 4.37Å; F374-Y407 HydrophobicContact CG-CD2 4.41Å; F374-Y407 AromaticContact CZ-CD2 3.51Å; F374-Y407 HydrophobicContact CZ-CD2 3.51Å; F374-Y407 AromaticContact CZ-CE2 3.93Å; F374-Y407 HydrophobicContact CZ-CE2 3.93Å; F374-Y407 HydrophobicContact CZ-CG 4.47Å; M398-Y407 HydrophobicContact CE-CG 4.41Å
408	M	97.4	Very high	96.8	Very high	52 Å²	52	44.7 Å²	44.7	26%	0.256	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.4	172.7	-73.4	-66	175.8	0	0	111.1	Y298 L373 V406 V410	Y298-M408 HydrophobicContact CE2-CB 4.18Å; Y298-M408 HydrophobicContact CE2-CG 4.04Å; L373-M408 WeakPolarHBondContact CB-O 3.38Å; L373-M408 PolarHBondContact N-O 3.42Å; L373-M408 PolarHBondContact O-N 2.92Å; V406-M408 HydrophobicContact CG1-CG 4.4Å; M408-V410 HydrophobicContact CB-CG1 4.06Å
409	P	97.5	Very high	95.6	Very high	37 Å²	37	47 Å²	47	24%	0.24	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126.2	165.5	30.8	-32	0	0	0	109.7	V301 V370	V301-P409 HydrophobicContact CG2-CB 4.03Å; V301-P409 PolarHBondContact N-O 3.16Å; V370-P409 HydrophobicContact CG1-CB 3.87Å
410	V	98	Very high	94.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	158.1	-174.3	-55.4	0	0	0	0	111.5	Y298 L299 M371 L373 M408	Y298-V410 HydrophobicContact CD2-CG1 3.55Å; Y298-V410 HydrophobicContact CE2-CG1 4.35Å; Y298-V410 HydrophobicContact CG-CG1 3.93Å; L299-V410 WeakPolarHBondContact O-CA 3.45Å; L299-V410 WeakPolarHBondContact O-CB 3.43Å; M371-V410 HydrophobicContact CE-CG2 3.54Å; M371-V410 HydrophobicContact CG-CG2 3.74Å; M371-V410 PolarHBondContact N-O 2.87Å; M371-V410 PolarHBondContact O-N 2.87Å; L373-V410 HydrophobicContact CB-CG1 3.96Å; L373-V410 HydrophobicContact CB-CG2 3.74Å; L373-V410 HydrophobicContact CD2-CG1 3.99Å; L373-V410 HydrophobicContact CD2-CG2 4.37Å; M408-V410 HydrophobicContact CB-CG1 4.06Å
411	V	97.6	Very high	92.7	Very high	13 Å²	13	48.3 Å²	48.3	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-21.7	172.7	-55.3	0	0	0	0	112.2	L299 V301 A304 G369 Q439 V440	L299-V411 HydrophobicContact CB-CG2 4.02Å; L299-V411 HydrophobicContact CD2-CG2 3.58Å; L299-V411 HydrophobicContact CG-CG2 3.63Å; L299-V411 PolarHBondContact O-N 3.08Å; V301-V411 HydrophobicContact CG2-CG1 4Å; A304-V411 HydrophobicContact CB-CG1 4.1Å; A304-V411 HydrophobicContact CB-CG2 3.75Å; G369-V411 WeakPolarHBondContact O-CG1 3.29Å; V411-Q439 WeakPolarHBondContact O-CA 3.08Å; V411-V440 PolarHBondContact O-N 3.1Å
412	A	98.2	Very high	91.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158	178	0	0	0	0	0	111.4	Y298 L299 H323 L324 W335 G438 Q439	Y298-A412 WeakPolarHBondContact CA-O 3.49Å; L299-A412 HydrophobicContact CB-CB 4.15Å; L299-A412 PolarHBondContact N-O 2.84Å; H323-A412 HydrophobicContact CB-CB 4.22Å; L324-A412 HydrophobicContact CD2-CB 4.06Å; W335-A412 HydrophobicContact CH2-CB 3.61Å; W335-A412 HydrophobicContact CZ2-CB 3.68Å; A412-G438 CarbonylContact C-O 3.57Å; A412-G438 WeakPolarHBondContact CA-O 3.31Å; A412-G438 WeakPolarHBondContact CB-O 3.25Å; A412-Q439 HydrophobicContact CB-CB 4.39Å
413	F	98.6	Very high	91.1	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	162.7	176.1	80.6	-69.5	0	0	0	111.8	L239 L241 L255 L296 A297 A348 M371 L415 V436 Q437 G438	L239-F413 HydrophobicContact CD1-CE1 4.3Å; L239-F413 HydrophobicContact CD2-CE1 4.41Å; L241-F413 HydrophobicContact CD2-CE1 4Å; L241-F413 HydrophobicContact CD2-CZ 4Å; L255-F413 HydrophobicContact CD1-CZ 4.08Å; L255-F413 HydrophobicContact CD2-CE2 3.98Å; L255-F413 HydrophobicContact CD2-CZ 3.87Å; L255-F413 HydrophobicContact CG-CZ 4.39Å; L296-F413 HydrophobicContact CD1-CD2 4.45Å; A297-F413 CarbonylContact O-C 3.55Å; A297-F413 VanDerWaalsContact O-CA 3.3Å; A297-F413 WeakPolarHBondContact O-CA 3.37Å; A348-F413 HydrophobicContact CB-CE1 4.29Å; A348-F413 HydrophobicContact CB-CZ 4.44Å; M371-F413 HydrophobicContact CE-CB 4.36Å; M371-F413 HydrophobicContact CE-CD1 3.31Å; M371-F413 HydrophobicContact CE-CE1 3.86Å; M371-F413 HydrophobicContact CE-CG 4.09Å; F413-L415 HydrophobicContact CD2-CB 4.21Å; F413-L415 HydrophobicContact CE2-CB 4.08Å; F413-V436 HydrophobicContact CE2-CG1 4.4Å; F413-Q437 CarbonylContact O-C 3.56Å; F413-Q437 VanDerWaalsContact O-CA 3.22Å; F413-Q437 WeakPolarHBondContact O-CA 3.44Å; F413-Q437 WeakPolarHBondContact O-CB 3.45Å; F413-G438 PolarHBondContact N-O 3.23Å; F413-G438 PolarHBondContact O-N 3.23Å
414	R	98.4	Very high	91	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.6	168.6	-178.3	178.5	-63.4	-173.6	-1.9	109	A297 V325 P326 L327 E329 V331 W335 E416 V436 Q437	A297-R414 PolarHBondContact N-O 3.23Å; A297-R414 PolarHBondContact O-N 3.12Å; V325-R414 PolarHBondContact O-NH2 3.27Å; P326-R414 PolarHBondContact O-NH2 2.86Å; L327-R414 HydrophobicContact CD2-CG 4.14Å; E329-R414 PolarHBondContact O-NH1 3.47Å; V331-R414 HydrophobicContact CG1-CB 4.06Å; V331-R414 HydrophobicContact CG1-CG 4.45Å; W335-R414 HydrophobicContact CZ3-CB 4.14Å; R414-E416 WeakPolarHBondContact CD-OE1 3.5Å; R414-E416 HydrophobicContact CG-CG 4.09Å; R414-V436 CarbonylContact C-O 3.59Å; R414-V436 WeakPolarHBondContact CA-O 3.32Å; R414-Q437 HydrophobicContact CB-CB 4Å; R414-Q437 HydrophobicContact CG-CB 4.08Å; R414-Q437 VanDerWaalsContact CZ-OE1 3.23Å
415	L	97.4	Very high	90.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	121.9	179.5	177.5	54.7	0	0	0	109.8	W257 R295 L296 V346 F413 F424 A435 V436	W257-L415 HydrophobicContact CB-CD2 3.75Å; W257-L415 HydrophobicContact CD2-CD1 4.5Å; W257-L415 HydrophobicContact CD2-CD2 4.01Å; W257-L415 HydrophobicContact CE3-CD1 3.95Å; W257-L415 HydrophobicContact CE3-CD2 3.89Å; W257-L415 HydrophobicContact CE3-CG 4.4Å; W257-L415 HydrophobicContact CG-CD2 3.98Å; W257-L415 HydrophobicContact CZ3-CD1 4.01Å; R295-L415 CarbonylContact O-C 3.57Å; R295-L415 WeakPolarHBondContact O-CA 3.47Å; R295-L415 WeakPolarHBondContact O-CD1 3.42Å; L296-L415 HydrophobicContact CB-CD1 4.41Å; L296-L415 HydrophobicContact CD1-CB 4.37Å; L296-L415 HydrophobicContact CD1-CD1 4.44Å; V346-L415 HydrophobicContact CB-CD2 3.93Å; V346-L415 HydrophobicContact CG1-CD2 3.97Å; V346-L415 HydrophobicContact CG2-CD1 4.4Å; V346-L415 HydrophobicContact CG2-CD2 4.34Å; F413-L415 HydrophobicContact CD2-CB 4.21Å; F413-L415 HydrophobicContact CE2-CB 4.08Å; L415-F424 HydrophobicContact CD2-CE1 3.64Å; L415-F424 HydrophobicContact CD2-CZ 4.18Å; L415-F424 HydrophobicContact CG-CE1 4.21Å; L415-F424 HydrophobicContact CG-CZ 4.26Å; L415-A435 WeakPolarHBondContact O-CA 3.26Å; L415-V436 HydrophobicContact CB-CG1 4.11Å; L415-V436 PolarHBondContact N-O 3.04Å; L415-V436 PolarHBondContact O-N 3.04Å
416	E	95.6	Very high	90.7	Very high	55 Å²	55	33.8 Å²	33.8	26%	0.257	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	96.8	-175.2	-58.4	175.3	149.5	0	0	109.6	G294 R295 R414 A435	G294-E416 CarbonylContact C-O 3.51Å; G294-E416 WeakPolarHBondContact CA-O 3.3Å; R295-E416 HydrophobicContact CB-CB 4.32Å; R295-E416 PolarHBondContact N-O 3.41Å; R295-E416 PolarHBondContact O-N 3.04Å; R414-E416 WeakPolarHBondContact CD-OE1 3.5Å; R414-E416 HydrophobicContact CG-CG 4.09Å; E416-A435 HydrophobicContact CB-CB 4.36Å; E416-A435 HydrophobicContact CG-CB 3.96Å
417	P	94.4	Very high	90.5	Very high	25 Å²	25	32.6 Å²	32.6	16%	0.162	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	132.6	174.2	-20.6	33.9	0	0	0	111.2	W257 F424 S433	W257-P417 HydrophobicContact CZ2-CB 3.85Å; W257-P417 HydrophobicContact CZ2-CG 4.17Å; P417-F424 HydrophobicContact CG-CE2 3.8Å; P417-F424 HydrophobicContact CG-CZ 3.55Å; P417-S433 WeakPolarHBondContact CB-OG 3.37Å; P417-S433 WeakPolarHBondContact CG-OG 3.36Å
418	E	90.1	Very high	89.9	Confident	67 Å²	67	31.9 Å²	31.9	31%	0.313	18%	0.183	S	C	.	.	S	Bend	trans	-95.9	-34.6	-178.1	-71.1	-172	162.6	0	0	112.9	R293 R295 G420	R293-E418 WeakPolarHBondContact CD-OE2 3.13Å; R293-E418 HydrophobicContact CG-CB 4.27Å; R293-E418 IonicContact CZ-OE2 2.88Å; R293-E418 IonicContact NE-OE2 3.68Å; R293-E418 PolarHBondContact NE-OE2 3.32Å; R293-E418 IonicContact NH2-OE2 2.78Å; R293-E418 PolarHBondContact O-N 3.26Å; R295-E418 IonicContact CZ-OE1 3.2Å; R295-E418 IonicContact NE-OE1 2.75Å; R295-E418 PolarHBondContact NE-OE1 2.84Å; R295-E418 IonicContact NH2-OE1 3.72Å; R295-E418 PolarHBondContact NH2-OE1 3.35Å; E418-G420 VanDerWaalsContact C-N 3.34Å; E418-G420 PolarHBondContact O-N 3.34Å
419	D	71.2	Confident	89.4	Confident	80 Å²	80	31.6 Å²	31.6	43%	0.428	18%	0.181	S	C	.	.	S	Bend	trans	-86.9	-0.1	-167.8	-69.6	-18.8	0	0	0	114.5	R293 R421	R293-D419 VanDerWaalsContact CB-CG 3.45Å; R293-D419 WeakPolarHBondContact CB-OD2 3.17Å; R293-D419 WeakPolarHBondContact CD-OD1 3.45Å; D419-R421 HydrophobicContact CB-CB 4.04Å; D419-R421 HydrophobicContact CB-CG 4.18Å; D419-R421 PolarHBondContact O-N 3.44Å
420	G	67.5	Low	89.1	Confident	66 Å²	66	33.2 Å²	33.2	68%	0.68	19%	0.188	S	C	*	.	S	Bend	trans	58.1	4	-167.2	0	0	0	0	0	114	E418	E418-G420 VanDerWaalsContact C-N 3.34Å; E418-G420 PolarHBondContact O-N 3.34Å
421	R	64.2	Low	88.6	Confident	179 Å²	179	34.4 Å²	34.4	68%	0.675	19%	0.194	S	C	*	.			trans	-95.9	126.9	-179	-71.6	-178.9	-174.4	-132.9	1.3	109.3	D419	D419-R421 HydrophobicContact CB-CB 4.04Å; D419-R421 HydrophobicContact CB-CG 4.18Å; D419-R421 PolarHBondContact O-N 3.44Å
422	G	70.7	Confident	87.9	Confident	17 Å²	17	39.1 Å²	39.1	18%	0.175	22%	0.222	C	C	.	.			trans	121.6	169.7	178.7	0	0	0	0	0	110.7	S433	G422-S433 WeakPolarHBondContact O-CB 3.41Å
423	V	87.8	Confident	87.1	Confident	34 Å²	34	40.1 Å²	40.1	21%	0.206	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155.2	172.4	-69	0	0	0	0	107.4	A261 L265 L430	A261-V423 HydrophobicContact CB-CG2 4.07Å; A261-V423 WeakPolarHBondContact CB-O 3.38Å; L265-V423 HydrophobicContact CB-CG2 4.45Å; L265-V423 HydrophobicContact CD2-CG2 4.26Å; V423-L430 HydrophobicContact CB-CD2 4.31Å; V423-L430 HydrophobicContact CG2-CD2 3.97Å
424	F	93.7	Very high	86.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	149.3	162.9	-71.1	-76.7	0	0	0	109.1	L255 A256 W257 L415 P417 M431 V432 E434 V436	L255-F424 HydrophobicContact CD1-CD1 4.41Å; L255-F424 HydrophobicContact CD2-CD1 3.86Å; L255-F424 HydrophobicContact CD2-CE1 4.07Å; L255-F424 HydrophobicContact CG-CD1 4.2Å; A256-F424 WeakPolarHBondContact O-CA 3.15Å; W257-F424 HydrophobicContact CB-CD1 3.69Å; W257-F424 HydrophobicContact CB-CE1 3.49Å; W257-F424 VanDerWaalsContact CB-CE1 3.49Å; W257-F424 HydrophobicContact CB-CZ 4.43Å; W257-F424 AromaticContact CD1-CD1 3.91Å; W257-F424 AromaticContact CD1-CE1 3.56Å; W257-F424 AromaticContact CD1-CZ 3.71Å; W257-F424 HydrophobicContact CG-CD1 4.1Å; W257-F424 AromaticContact CG-CE1 3.62Å; W257-F424 HydrophobicContact CG-CE1 3.62Å; W257-F424 HydrophobicContact CG-CZ 4.1Å; L415-F424 HydrophobicContact CD2-CE1 3.64Å; L415-F424 HydrophobicContact CD2-CZ 4.18Å; L415-F424 HydrophobicContact CG-CE1 4.21Å; L415-F424 HydrophobicContact CG-CZ 4.26Å; P417-F424 HydrophobicContact CG-CE2 3.8Å; P417-F424 HydrophobicContact CG-CZ 3.55Å; F424-M431 HydrophobicContact CB-CB 4.07Å; F424-M431 HydrophobicContact CB-CE 3.7Å; F424-M431 HydrophobicContact CD2-CE 3.95Å; F424-M431 HydrophobicContact CG-CE 3.89Å; F424-M431 PolarHBondContact N-O 3.01Å; F424-M431 PolarHBondContact O-N 3.41Å; F424-V432 WeakPolarHBondContact CD2-O 3.42Å; F424-E434 WeakPolarHBondContact CE2-O 3.49Å; F424-V436 HydrophobicContact CD1-CG1 4.34Å; F424-V436 HydrophobicContact CE1-CG1 3.66Å; F424-V436 HydrophobicContact CE2-CG1 4.16Å; F424-V436 HydrophobicContact CZ-CG1 3.58Å
425	T	94.3	Very high	86.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.3	157.9	52	0	0	0	0	109.7	L255 A256 A261 D264 E429 L430	L255-T425 CarbonylContact C-O 3.55Å; L255-T425 WeakPolarHBondContact CA-O 3.39Å; A256-T425 PolarHBondContact N-O 3.48Å; A256-T425 PolarHBondContact O-N 3.18Å; A261-T425 HydrophobicContact CB-CG2 4.08Å; D264-T425 HydrophobicContact CB-CG2 3.61Å; D264-T425 VanDerWaalsContact OD2-CB 3.32Å; D264-T425 WeakPolarHBondContact OD2-CB 3.48Å; D264-T425 WeakPolarHBondContact OD2-CG2 3.42Å; D264-T425 PolarHBondContact OD2-OG1 3.22Å; T425-E429 CarbonylContact C-O 3.57Å; T425-E429 VanDerWaalsContact CA-O 3.28Å; T425-E429 WeakPolarHBondContact CA-O 3.47Å; T425-L430 HydrophobicContact CG2-CD2 3.78Å; T425-L430 HydrophobicContact CG2-CG 4.44Å
426	V	95.6	Very high	86.5	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.5	176.8	-175.9	0	0	0	0	107.4	L241 L249 S254 L255 G428 E429 M431	L241-V426 HydrophobicContact CD1-CG1 3.69Å; L241-V426 HydrophobicContact CD1-CG2 4.04Å; L249-V426 HydrophobicContact CD1-CB 4.19Å; L249-V426 HydrophobicContact CD1-CG1 3.9Å; L249-V426 HydrophobicContact CD1-CG2 4.15Å; S254-V426 CarbonylContact O-C 3.48Å; S254-V426 WeakPolarHBondContact O-CA 3.45Å; L255-V426 HydrophobicContact CD1-CG2 4.02Å; L255-V426 HydrophobicContact CG-CG2 4.34Å; V426-G428 PolarHBondContact O-N 2.99Å; V426-G428 VanDerWaalsContact O-N 3.12Å; V426-E429 PolarHBondContact N-O 3.13Å; V426-E429 WeakPolarHBondContact O-CB 3.48Å; V426-E429 PolarHBondContact O-N 3.46Å; V426-M431 HydrophobicContact CG2-CB 4.46Å; V426-M431 HydrophobicContact CG2-CE 3.88Å; V426-M431 HydrophobicContact CG2-SD 4.13Å
427	D	93.6	Very high	86.6	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	31.9	-172.1	-51.5	-26.7	0	0	0	113	H171 S251 V252 L253 S254 E429	H171-D427 HydrophobicContact CB-CB 3.93Å; H171-D427 IonicContact CE1-OD2 3.6Å; H171-D427 IonicContact CG-OD2 2.7Å; H171-D427 IonicContact ND1-OD2 3.13Å; H171-D427 PolarHBondContact ND1-OD2 2.88Å; S251-D427 VanDerWaalsContact CA-OD2 3.27Å; S251-D427 WeakPolarHBondContact CA-OD2 3.49Å; S251-D427 PolarHBondContact OG-OD1 3.41Å; V252-D427 WeakPolarHBondContact CG2-OD2 3.43Å; V252-D427 PolarHBondContact N-OD1 3.44Å; V252-D427 PolarHBondContact N-OD2 2.93Å; L253-D427 WeakPolarHBondContact CA-OD1 3.16Å; L253-D427 HydrophobicContact CB-CB 4.42Å; L253-D427 WeakPolarHBondContact CB-OD1 3.39Å; L253-D427 PolarHBondContact N-OD1 3.47Å; S254-D427 PolarHBondContact N-OD1 3.41Å; S254-D427 PolarHBondContact O-N 3.5Å; D427-E429 VanDerWaalsContact C-N 3.34Å
428	G	85.4	Confident	86.8	Confident	31 Å²	31	39.2 Å²	39.2	32%	0.32	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-2.5	-176.1	0	0	0	0	0	115.4	V426	V426-G428 PolarHBondContact O-N 2.99Å; V426-G428 VanDerWaalsContact O-N 3.12Å
429	E	88.7	Confident	87.1	Confident	46 Å²	46	36.6 Å²	36.6	22%	0.215	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.4	176.1	-67.8	-66.8	131.2	0	0	111.4	R143 T425 V426 D427	R143-E429 IonicContact CZ-OE2 3.8Å; R143-E429 IonicContact NE-OE2 2.78Å; R143-E429 PolarHBondContact NE-OE2 3.02Å; R143-E429 IonicContact NH2-OE2 3.47Å; R143-E429 PolarHBondContact NH2-OE2 3Å; T425-E429 CarbonylContact C-O 3.57Å; T425-E429 VanDerWaalsContact CA-O 3.28Å; T425-E429 WeakPolarHBondContact CA-O 3.47Å; V426-E429 PolarHBondContact N-O 3.13Å; V426-E429 WeakPolarHBondContact O-CB 3.48Å; V426-E429 PolarHBondContact O-N 3.46Å; D427-E429 VanDerWaalsContact C-N 3.34Å
430	L	89.7	Confident	88.4	Confident	72 Å²	72	33 Å²	33	38%	0.377	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	134.1	-178.4	-70.4	162.4	0	0	0	112.2	L265 V423 T425	L265-L430 HydrophobicContact CB-CD2 4.01Å; L265-L430 HydrophobicContact CD1-CD1 3.5Å; L265-L430 HydrophobicContact CD1-CD2 3.9Å; L265-L430 HydrophobicContact CD1-CG 4.37Å; L265-L430 HydrophobicContact CG-CD2 4.47Å; V423-L430 HydrophobicContact CB-CD2 4.31Å; V423-L430 HydrophobicContact CG2-CD2 3.97Å; T425-L430 HydrophobicContact CG2-CD2 3.78Å; T425-L430 HydrophobicContact CG2-CG 4.44Å
431	M	88.4	Confident	89.7	Confident	24 Å²	24	30.5 Å²	30.5	12%	0.118	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	146.2	173.7	-176.6	176.7	76.2	0	0	110	T243 L249 L255 F424 V426 V436	T243-M431 HydrophobicContact CG2-CE 4.15Å; T243-M431 HydrophobicContact CG2-SD 3.87Å; L249-M431 HydrophobicContact CD1-SD 4.11Å; L249-M431 HydrophobicContact CD2-SD 3.94Å; L255-M431 HydrophobicContact CD1-CE 4.4Å; F424-M431 HydrophobicContact CB-CB 4.07Å; F424-M431 HydrophobicContact CB-CE 3.7Å; F424-M431 HydrophobicContact CD2-CE 3.95Å; F424-M431 HydrophobicContact CG-CE 3.89Å; F424-M431 PolarHBondContact N-O 3.01Å; F424-M431 PolarHBondContact O-N 3.41Å; V426-M431 HydrophobicContact CG2-CB 4.46Å; V426-M431 HydrophobicContact CG2-CE 3.88Å; V426-M431 HydrophobicContact CG2-SD 4.13Å; M431-V436 HydrophobicContact CE-CG2 4.31Å
432	V	82.3	Confident	91.2	Very high	113 Å²	113	24.6 Å²	24.6	69%	0.685	15%	0.151	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	140.6	179.7	179.3	0	0	0	0	109.9	F424 E434	F424-V432 WeakPolarHBondContact CD2-O 3.42Å; V432-E434 PolarHBondContact O-N 2.98Å; V432-E434 VanDerWaalsContact O-N 3.07Å
433	S	82.5	Confident	92.3	Very high	21 Å²	21	25.9 Å²	25.9	15%	0.147	15%	0.154	C	C	.	.			trans	-74.4	95.3	178	-178.8	0	0	0	0	111.6	P417 G422	P417-S433 WeakPolarHBondContact CB-OG 3.37Å; P417-S433 WeakPolarHBondContact CG-OG 3.36Å; G422-S433 WeakPolarHBondContact O-CB 3.41Å
434	E	90.6	Very high	92.5	Very high	43 Å²	43	25 Å²	25	20%	0.201	15%	0.147	C	C	.	.			trans	-129.9	172.3	170.3	60	178.3	153.9	0	0	111	T243 A244 S245 F424 V432 V436	T243-E434 VanDerWaalsContact CB-CD 3.43Å; T243-E434 WeakPolarHBondContact CB-OE1 3.21Å; T243-E434 HydrophobicContact CG2-CG 4.5Å; T243-E434 PolarHBondContact OG1-OE1 3Å; A244-E434 HydrophobicContact CB-CB 4.37Å; A244-E434 PolarHBondContact N-OE2 3.23Å; S245-E434 VanDerWaalsContact CB-OE2 3.27Å; S245-E434 WeakPolarHBondContact CB-OE2 3.45Å; S245-E434 PolarHBondContact N-OE2 3.22Å; S245-E434 PolarHBondContact OG-OE1 3.22Å; S245-E434 PolarHBondContact OG-OE2 2.91Å; F424-E434 WeakPolarHBondContact CE2-O 3.49Å; V432-E434 PolarHBondContact O-N 2.98Å; V432-E434 VanDerWaalsContact O-N 3.07Å; E434-V436 PolarHBondContact O-N 3.27Å
435	A	94.4	Very high	92.6	Very high	23 Å²	23	25 Å²	25	19%	0.19	15%	0.147	C	C	.	.			trans	-59.6	131.8	175.2	0	0	0	0	0	110.1	T243 A244 L327 L415 E416	T243-A435 CarbonylContact C-O 3.56Å; T243-A435 VanDerWaalsContact CA-O 3.32Å; T243-A435 WeakPolarHBondContact CA-O 3.19Å; A244-A435 HydrophobicContact CB-CB 4.2Å; A244-A435 PolarHBondContact N-O 3.05Å; L327-A435 HydrophobicContact CD2-CB 4.29Å; L415-A435 WeakPolarHBondContact O-CA 3.26Å; E416-A435 HydrophobicContact CB-CB 4.36Å; E416-A435 HydrophobicContact CG-CB 3.96Å
436	V	96.4	Very high	92.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.7	-177.6	65.2	0	0	0	0	110	L241 H242 T243 L255 F413 R414 L415 F424 M431 E434	L241-V436 HydrophobicContact CD2-CG2 4.19Å; H242-V436 CarbonylContact O-C 3.52Å; H242-V436 WeakPolarHBondContact O-CA 3.29Å; T243-V436 HydrophobicContact CG2-CG2 4.37Å; L255-V436 HydrophobicContact CD1-CG1 4.14Å; L255-V436 HydrophobicContact CD1-CG2 3.88Å; F413-V436 HydrophobicContact CE2-CG1 4.4Å; R414-V436 CarbonylContact C-O 3.59Å; R414-V436 WeakPolarHBondContact CA-O 3.32Å; L415-V436 HydrophobicContact CB-CG1 4.11Å; L415-V436 PolarHBondContact N-O 3.04Å; L415-V436 PolarHBondContact O-N 3.04Å; F424-V436 HydrophobicContact CD1-CG1 4.34Å; F424-V436 HydrophobicContact CE1-CG1 3.66Å; F424-V436 HydrophobicContact CE2-CG1 4.16Å; F424-V436 HydrophobicContact CZ-CG1 3.58Å; M431-V436 HydrophobicContact CE-CG2 4.31Å; E434-V436 PolarHBondContact O-N 3.27Å
437	Q	97.8	Very high	92.8	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155	170.3	60.4	179.1	6.8	0	0	110.3	L241 H242 L324 V325 L327 F413 R414	L241-Q437 WeakPolarHBondContact CA-O 3.34Å; H242-Q437 HydrophobicContact CB-CG 4.04Å; H242-Q437 PolarHBondContact N-O 3.42Å; H242-Q437 PolarHBondContact O-N 2.83Å; L324-Q437 HydrophobicContact CD1-CG 4.16Å; L324-Q437 HydrophobicContact CD2-CB 4.47Å; V325-Q437 PolarHBondContact O-NE2 3.42Å; V325-Q437 PolarHBondContact O-OE1 3.07Å; L327-Q437 HydrophobicContact CD2-CB 4.1Å; L327-Q437 HydrophobicContact CD2-CG 3.77Å; L327-Q437 HydrophobicContact CG-CG 4.14Å; F413-Q437 CarbonylContact O-C 3.56Å; F413-Q437 VanDerWaalsContact O-CA 3.22Å; F413-Q437 WeakPolarHBondContact O-CA 3.44Å; F413-Q437 WeakPolarHBondContact O-CB 3.45Å; R414-Q437 HydrophobicContact CB-CB 4Å; R414-Q437 HydrophobicContact CG-CB 4.08Å; R414-Q437 VanDerWaalsContact CZ-OE1 3.23Å
438	G	97.5	Very high	93	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	156.3	179.1	0	0	0	0	0	114.6	S240 A412 F413	S240-G438 CarbonylContact O-C 3.1Å; S240-G438 WeakPolarHBondContact O-CA 3.16Å; A412-G438 CarbonylContact C-O 3.57Å; A412-G438 WeakPolarHBondContact CA-O 3.31Å; A412-G438 WeakPolarHBondContact CB-O 3.25Å; F413-G438 PolarHBondContact N-O 3.23Å; F413-G438 PolarHBondContact O-N 3.23Å
439	Q	97.6	Very high	93.3	Very high	12 Å²	12	25 Å²	25	6%	0.056	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.1	177.4	174.9	-179.4	-49.2	0	0	109.9	S240 D321 H323 L324 V411 A412	S240-Q439 PolarHBondContact N-O 3.27Å; S240-Q439 PolarHBondContact O-N 3.45Å; D321-Q439 HydrophobicContact CB-CB 4.38Å; H323-Q439 VanDerWaalsContact CB-OE1 3.28Å; H323-Q439 PolarHBondContact CD2-OE1 2.95Å; L324-Q439 HydrophobicContact CD1-CB 4.06Å; L324-Q439 HydrophobicContact CD2-CB 4.29Å; L324-Q439 HydrophobicContact CG-CB 4.05Å; V411-Q439 WeakPolarHBondContact O-CA 3.08Å; A412-Q439 HydrophobicContact CB-CB 4.39Å
440	V	97.2	Very high	93	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.03	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.9	173.7	-171.4	0	0	0	0	109.9	N237 L239 M371 V411	N237-V440 HydrophobicContact CB-CG1 3.68Å; L239-V440 HydrophobicContact CD1-CG2 4.37Å; M371-V440 HydrophobicContact CB-CG2 3.68Å; M371-V440 HydrophobicContact CE-CG2 4.38Å; M371-V440 HydrophobicContact CG-CG2 3.47Å; M371-V440 VanDerWaalsContact CG-CG2 3.47Å; M371-V440 HydrophobicContact SD-CG2 3.48Å; M371-V440 WeakPolarHBondContact SD-CG2 3.39Å; V411-V440 PolarHBondContact O-N 3.1Å
441	H	95.9	Very high	92.2	Very high	13 Å²	13	22.5 Å²	22.5	6%	0.06	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.6	168.3	-68.6	-81.7	0	0	0	110.1	N237 L238 D321 Y444	N237-H441 WeakPolarHBondContact CA-O 3.49Å; L238-H441 PolarHBondContact N-O 3.12Å; L238-H441 PolarHBondContact O-N 3.07Å; D321-H441 IonicContact OD1-CD2 3.18Å; D321-H441 IonicContact OD1-CE1 3.64Å; D321-H441 PolarHBondContact OD1-CE1 3.19Å; D321-H441 IonicContact OD1-NE2 3.39Å; D321-H441 PolarHBondContact OD1-NE2 3.27Å; H441-Y444 HydrophobicContact CB-CD2 3.37Å; H441-Y444 HydrophobicContact CB-CE2 3.77Å; H441-Y444 HydrophobicContact CB-CG 3.93Å
442	P	94.4	Very high	91	Very high	55 Å²	55	25.7 Å²	25.7	36%	0.357	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	134.9	-175.9	28.6	-33.7	0	0	0	111.4	A368 Y444	A368-P442 HydrophobicContact CB-CB 4.07Å; P442-Y444 VanDerWaalsContact C-N 3.26Å; P442-Y444 PolarHBondContact O-N 3.21Å; P442-Y444 VanDerWaalsContact O-N 3.12Å
443	N	93.7	Very high	89.2	Confident	45 Å²	45	29.2 Å²	29.2	24%	0.241	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	49	45.1	165.5	-67.8	-13.1	0	0	0	114	A90 P235 M236 N237	A90-N443 HydrophobicContact CB-CB 4.29Å; A90-N443 VanDerWaalsContact CB-O 3.27Å; A90-N443 WeakPolarHBondContact CB-O 3.46Å; P235-N443 HydrophobicContact CB-CB 3.62Å; P235-N443 HydrophobicContact CG-CB 4.2Å; M236-N443 CarbonylContact O-C 3.51Å; M236-N443 WeakPolarHBondContact O-CA 3.39Å; N237-N443 PolarHBondContact OD1-N 3.04Å
444	Y	93.4	Very high	87.3	Confident	16 Å²	16	32.1 Å²	32.1	6%	0.063	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-30.1	-163.8	-145.5	-101.9	0	0	0	114.5	M87 M178 W183 I187 M236 L238 P319 H441 P442	M87-Y444 HydrophobicContact CE-CD2 4.08Å; M87-Y444 HydrophobicContact CE-CE2 3.37Å; M178-Y444 HydrophobicContact CE-CE1 3.76Å; M178-Y444 HydrophobicContact SD-CD1 4.5Å; M178-Y444 HydrophobicContact SD-CE1 4.01Å; W183-Y444 HydrophobicContact CE3-CE1 4.49Å; W183-Y444 WeakPolarHBondContact CH2-OH 3.45Å; W183-Y444 AromaticContact CZ3-CE1 3.97Å; W183-Y444 HydrophobicContact CZ3-CE1 3.97Å; W183-Y444 AromaticContact CZ3-CZ 3.78Å; W183-Y444 WeakPolarHBondContact CZ3-OH 3.42Å; I187-Y444 HydrophobicContact CG1-CD1 4.01Å; I187-Y444 HydrophobicContact CG1-CE1 4.4Å; I187-Y444 HydrophobicContact CG2-CD1 4.35Å; I187-Y444 HydrophobicContact CG2-CE1 4.23Å; M236-Y444 PolarHBondContact O-N 3.46Å; L238-Y444 HydrophobicContact CB-CD1 4.26Å; L238-Y444 HydrophobicContact CB-CG 4.14Å; L238-Y444 HydrophobicContact CD2-CD1 3.53Å; L238-Y444 HydrophobicContact CD2-CE1 4.13Å; L238-Y444 HydrophobicContact CD2-CG 4.24Å; P319-Y444 HydrophobicContact CB-CE2 4.38Å; P319-Y444 WeakPolarHBondContact CB-OH 3.2Å; P319-Y444 VanDerWaalsContact CD-OH 3.28Å; P319-Y444 WeakPolarHBondContact CD-OH 3.1Å; P319-Y444 HydrophobicContact CG-CE1 4.4Å; P319-Y444 HydrophobicContact CG-CE2 4.3Å; P319-Y444 WeakPolarHBondContact CG-OH 3.43Å; H441-Y444 HydrophobicContact CB-CD2 3.37Å; H441-Y444 HydrophobicContact CB-CE2 3.77Å; H441-Y444 HydrophobicContact CB-CG 3.93Å; P442-Y444 VanDerWaalsContact C-N 3.26Å; P442-Y444 PolarHBondContact O-N 3.21Å; P442-Y444 VanDerWaalsContact O-N 3.12Å
445	F	96.1	Very high	84.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161.1	177.5	69.9	-81.5	0	0	0	110.9	I187 L191 P235 M236 N237 L238 V252 M447	I187-F445 HydrophobicContact CD1-CB 4.01Å; I187-F445 HydrophobicContact CG1-CB 3.96Å; I187-F445 WeakPolarHBondContact O-CB 3.44Å; L191-F445 HydrophobicContact CD1-CD2 3.92Å; L191-F445 HydrophobicContact CD1-CE2 4.32Å; P235-F445 CarbonylContact C-O 3.5Å; P235-F445 WeakPolarHBondContact CA-O 3.31Å; M236-F445 HydrophobicContact CB-CD1 4.09Å; M236-F445 HydrophobicContact CB-CD2 4.28Å; M236-F445 HydrophobicContact CB-CE1 3.65Å; M236-F445 HydrophobicContact CB-CE2 3.87Å; M236-F445 HydrophobicContact CB-CG 4.39Å; M236-F445 HydrophobicContact CB-CZ 3.53Å; M236-F445 HydrophobicContact CG-CE2 4.21Å; M236-F445 HydrophobicContact CG-CZ 4.22Å; M236-F445 PolarHBondContact N-O 3.13Å; M236-F445 PolarHBondContact O-N 3.16Å; N237-F445 VanDerWaalsContact O-CE1 3.28Å; N237-F445 WeakPolarHBondContact O-CE1 3.45Å; L238-F445 HydrophobicContact CB-CD1 4.21Å; L238-F445 HydrophobicContact CB-CE1 4.31Å; L238-F445 HydrophobicContact CD1-CD1 4.21Å; L238-F445 HydrophobicContact CD1-CE1 4Å; V252-F445 HydrophobicContact CB-CZ 4.28Å; V252-F445 HydrophobicContact CG1-CE1 4.38Å; V252-F445 HydrophobicContact CG1-CZ 4.12Å; F445-M447 HydrophobicContact CD2-CG 3.84Å; F445-M447 HydrophobicContact CE2-CG 3.39Å; F445-M447 HydrophobicContact CE2-SD 3.7Å; F445-M447 HydrophobicContact CZ-CG 4.38Å; F445-M447 HydrophobicContact CZ-SD 4.3Å
446	W	96.4	Very high	81.7	Confident	30 Å²	30	42.2 Å²	42.2	11%	0.114	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.2	-177.6	-66.8	93.9	0	0	0	110.9	A90 P190 L191 L233 P235	A90-W446 HydrophobicContact CB-CH2 4.46Å; A90-W446 HydrophobicContact CB-CZ2 3.64Å; P190-W446 HydrophobicContact CB-CB 4.38Å; P190-W446 HydrophobicContact CG-CB 4.38Å; L191-W446 PolarHBondContact N-O 3.4Å; L233-W446 HydrophobicContact CB-CE3 3.92Å; L233-W446 HydrophobicContact CB-CZ3 4.48Å; P235-W446 HydrophobicContact CB-CE3 4.26Å; P235-W446 HydrophobicContact CB-CH2 4.44Å; P235-W446 HydrophobicContact CB-CZ3 4.18Å; P235-W446 HydrophobicContact CG-CZ3 4.27Å
447	M	97.1	Very high	79	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.9	169.6	-69	-160.9	81.2	0	0	111.8	M170 L191 L202 L206 L233 S234 M236 F445 S449	M170-M447 HydrophobicContact CE-CE 3.99Å; L191-M447 CarbonylContact O-C 3.56Å; L191-M447 VanDerWaalsContact O-CA 3.24Å; L191-M447 WeakPolarHBondContact O-CA 3.25Å; L202-M447 HydrophobicContact CD1-CE 4.41Å; L202-M447 HydrophobicContact CD1-SD 3.88Å; L202-M447 HydrophobicContact CD2-CE 3.68Å; L202-M447 HydrophobicContact CD2-SD 3.97Å; L202-M447 HydrophobicContact CG-CE 4.04Å; L202-M447 HydrophobicContact CG-SD 4.17Å; L206-M447 HydrophobicContact CD1-CE 3.58Å; L206-M447 HydrophobicContact CD1-SD 4.09Å; L206-M447 HydrophobicContact CD2-SD 4.36Å; L233-M447 WeakPolarHBondContact CA-O 3.4Å; S234-M447 PolarHBondContact N-O 2.95Å; S234-M447 PolarHBondContact O-N 3.33Å; M236-M447 HydrophobicContact CB-CG 4.49Å; M236-M447 HydrophobicContact CE-CB 3.86Å; M236-M447 HydrophobicContact CE-CG 4.49Å; M236-M447 HydrophobicContact CG-CB 3.87Å; M236-M447 HydrophobicContact CG-CG 3.59Å; M236-M447 HydrophobicContact CG-SD 3.92Å; F445-M447 HydrophobicContact CD2-CG 3.84Å; F445-M447 HydrophobicContact CE2-CG 3.39Å; F445-M447 HydrophobicContact CE2-SD 3.7Å; F445-M447 HydrophobicContact CZ-CG 4.38Å; F445-M447 HydrophobicContact CZ-SD 4.3Å; M447-S449 PolarHBondContact O-N 3.01Å; M447-S449 VanDerWaalsContact O-N 3.12Å
448	V	96.6	Very high	76.2	Confident	3 Å²	3	52 Å²	52	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	113	163.6	169.4	0	0	0	0	109	L97 L191 C192 L227 L228 L232 L233	L97-V448 HydrophobicContact CD1-CG2 3.94Å; L191-V448 PolarHBondContact O-N 3.24Å; C192-V448 HydrophobicContact CB-CB 3.94Å; C192-V448 HydrophobicContact CB-CG2 3.86Å; L227-V448 VanDerWaalsContact C-CG1 3.48Å; L227-V448 HydrophobicContact CB-CG1 4.19Å; L227-V448 WeakPolarHBondContact O-CG1 3.21Å; L228-V448 HydrophobicContact CB-CG1 4.07Å; L228-V448 HydrophobicContact CD1-CG1 4.36Å; L228-V448 HydrophobicContact CD1-CG2 3.98Å; L232-V448 CarbonylContact O-C 3.55Å; L232-V448 WeakPolarHBondContact O-CA 3.42Å; L233-V448 HydrophobicContact CD2-CB 4.46Å; L233-V448 HydrophobicContact CD2-CG2 3.76Å
449	S	91.8	Very high	73.1	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.007	33%	0.326	C	S	.	.			trans	-165.1	145.1	-178	-168.6	0	0	0	0	110.1	L232 M447 C451	L232-S449 CarbonylContact C-O 3.1Å; L232-S449 VanDerWaalsContact C-O 3.29Å; L232-S449 WeakPolarHBondContact CB-O 3.14Å; L232-S449 PolarHBondContact O-N 3.3Å; L232-S449 VanDerWaalsContact O-O 3.09Å; M447-S449 PolarHBondContact O-N 3.01Å; M447-S449 VanDerWaalsContact O-N 3.12Å; S449-C451 PolarHBondContact OG-SG 3Å
450	D	83.8	Confident	70.1	Confident	37 Å²	37	65.3 Å²	65.3	20%	0.198	35%	0.354	C	S	.	.			trans	-109.2	67.4	175.3	-171.2	3.6	0	0	0	108.3	A210 L227 R230 L232 V452	A210-D450 WeakPolarHBondContact CA-O 3.31Å; A210-D450 HydrophobicContact CB-CB 4.19Å; A210-D450 WeakPolarHBondContact CB-O 3.49Å; L227-D450 HydrophobicContact CD2-CB 3.6Å; R230-D450 WeakPolarHBondContact CD-OD2 3.34Å; R230-D450 IonicContact CZ-OD2 3.68Å; R230-D450 IonicContact NE-OD2 3.94Å; R230-D450 IonicContact NH1-OD2 2.72Å; R230-D450 PolarHBondContact NH1-OD2 3.49Å; L232-D450 HydrophobicContact CD1-CB 4.11Å; L232-D450 WeakPolarHBondContact CD1-OD1 3.37Å; D450-V452 PolarHBondContact O-N 3.47Å
451	C	72.4	Confident	67.3	Low	30 Å²	30	72.3 Å²	72.3	20%	0.203	39%	0.386	C	S	.	.			trans	-70.5	114.1	-174	-73.6	0	0	0	0	111	S234 R365 S449	S234-C451 PolarHBondContact OG-SG 3.2Å; R365-C451 PolarHBondContact NH1-SG 3.1Å; S449-C451 PolarHBondContact OG-SG 3Å
452	V	62.2	Low	64.2	Low	91 Å²	91	80.7 Å²	80.7	55%	0.552	43%	0.425	S	S	*	.			trans	-83.4	119.4	164.6	-174.5	0	0	0	0	106.4	Y209 D450 P454	Y209-V452 PolarHBondContact O-N 3.34Å; D450-V452 PolarHBondContact O-N 3.47Å; V452-P454 WeakPolarHBondContact O-CD 3.47Å; V452-P454 VanDerWaalsContact O-N 3.08Å
453	E	46.4	Very low	61.3	Low	187 Å²	187	83.5 Å²	83.5	87%	0.874	44%	0.442	S	S	*	.			trans	-57.6	114.7	173.7	-79.9	-169.2	161.4	0	0	109.4
454	P	40.8	Very low	58.4	Low	81 Å²	81	86.5 Å²	86.5	53%	0.526	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-80.7	141.9	175.1	-4.3	23.5	0	0	0	109.2	V452	V452-P454 WeakPolarHBondContact O-CD 3.47Å; V452-P454 VanDerWaalsContact O-N 3.08Å
455	L	32.3	Very low	55.6	Low	164 Å²	164	91 Å²	91	86%	0.859	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-61.2	129.9	164.9	-73.6	159.7	0	0	0	108.9	S457	L455-S457 PolarHBondContact O-N 3.03Å; L455-S457 VanDerWaalsContact O-N 3.14Å
456	P	37	Very low	52.7	Low	114 Å²	114	96.9 Å²	96.9	74%	0.74	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-64.4	117.7	179.8	22.7	-30.2	0	0	0	110.3
457	S	39.4	Very low	50.1	Low	101 Å²	101	104.5 Å²	104.5	71%	0.706	57%	0.57	S	S	*	*			trans	-86.1	-7.6	180	59.1	0	0	0	0	113.6	L455	L455-S457 PolarHBondContact O-N 3.03Å; L455-S457 VanDerWaalsContact O-N 3.14Å
458	W	38.2	Very low	47	Very low	107 Å²	107	113 Å²	113	41%	0.405	61%	0.61	S	S	.	*			trans	-133.7	128.7	-172.5	-166.2	-86.8	0	0	0	112.4	M363	M363-W458 HydrophobicContact CB-CB 4.19Å; M363-W458 HydrophobicContact CB-CG 4.42Å
459	K	31.9	Very low	44.8	Very low	193 Å²	193	119.2 Å²	119.2	84%	0.839	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-95.7	133.2	169.6	-71.4	-176.5	179.4	179.7	0	109.1
460	P	35.3	Very low	42.3	Very low	99 Å²	99	130.9 Å²	130.9	64%	0.643	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.2	139.9	177.4	-21.4	30.8	0	0	0	112	Q462	P460-Q462 PolarHBondContact O-N 3.27Å
461	Q	37.7	Very low	40.3	Very low	151 Å²	151	135.6 Å²	135.6	71%	0.706	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.9	120.3	167.2	-91.5	176.2	-14.3	0	0	108.8	T463	Q461-T463 PolarHBondContact O-N 3.15Å
462	Q	30.8	Very low	38.6	Very low	189 Å²	189	141.2 Å²	141.2	88%	0.883	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-66.2	123.6	169.1	-72.5	178.3	-12.1	0	0	108	P460	P460-Q462 PolarHBondContact O-N 3.27Å
463	T	33.8	Very low	37.3	Very low	114 Å²	114	143.9 Å²	143.9	70%	0.699	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63	132.2	167.5	-2.3	0	0	0	0	107.7	Q461	Q461-T463 PolarHBondContact O-N 3.15Å
464	P	33.3	Very low	36.7	Very low	109 Å²	109	141.4 Å²	141.4	71%	0.708	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.8	141.3	171.6	24.1	-30.3	0	0	0	109.1
465	P	34.1	Very low	36.5	Very low	111 Å²	111	145.2 Å²	145.2	72%	0.721	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.7	147.5	176.6	26.3	-32.6	0	0	0	109.7	E467	P465-E467 PolarHBondContact O-N 2.88Å
466	P	36.1	Very low	36.8	Very low	122 Å²	122	143.9 Å²	143.9	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-59.7	126.8	172.3	24.9	-30.9	0	0	0	108.8	E468	P466-E468 PolarHBondContact O-N 2.76Å
467	E	41	Very low	36.7	Very low	191 Å²	191	146.1 Å²	146.1	89%	0.893	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-58.7	124.3	171.1	-72.5	-178.9	158.1	0	0	108.7	P465	P465-E467 PolarHBondContact O-N 2.88Å
468	E	33.3	Very low	36.5	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.6	134.5	168.4	-77.2	-178.4	156.8	0	0	108.8	P466 L470	P466-E468 PolarHBondContact O-N 2.76Å; E468-L470 PolarHBondContact O-N 3.07Å
469	P	49.6	Very low	36.4	Very low	132 Å²	132	153.1 Å²	153.1	86%	0.857	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-68	121.1	174.5	26.5	-30.6	0	0	0	109.7
470	L	40.2	Very low	36.8	Very low	247 Å²	247	149.5 Å²	149.5	100%	1.293	82%	0.821	S	S	*	*			trans	-97.2	0	160.9	-84.6	169.2	0	0	0	110.3	E468	E468-L470 PolarHBondContact O-N 3.07Å

Retrieved 470 of 470 residues in 347.4 ms (Link to these results)

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