A0A087XWV3_POEFO Loading...

Vitamin K-dependent protein S

Anticoagulant plasma protein; it is a cofactor to activated protein C in the degradation of coagulation factors Va and VIIIa. It helps to prevent coagulation and stimulating fibrinolysis.

AlphaFold DB , UniProt , Accession A0A087XWV3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 676 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	32.7	Very low	31.4	Very low	230 Å²	230	164.7 Å²	164.7	100%	1.133	81%	0.806	S	S	*	*				0	98.4	0	-79.9	156.9	67.2	0	0	107.2
2	W	29.3	Very low	31.2	Very low	222 Å²	222	165.2 Å²	165.2	84%	0.841	81%	0.813	S	S	*	*				62.6	118.9	113.7	-83.1	55.1	0	0	0	112.9
3	R	29.5	Very low	31	Very low	178 Å²	178	159 Å²	159	67%	0.672	81%	0.805	S	S	*	*			cis	-169.5	131.9	-0.4	-129.1	-176.9	-176.6	-158.6	0.8	106.8
4	Q	31.1	Very low	30.8	Very low	144 Å²	144	155.8 Å²	155.8	67%	0.673	80%	0.802	S	S	*	*			trans	49.9	147.3	135	-74.4	-179.3	-38.4	0	0	121.5
5	K	31.4	Very low	30.7	Very low	160 Å²	160	156.1 Å²	156.1	70%	0.696	81%	0.805	S	S	*	*			cis	174.5	143.4	-15.8	-117.6	-176.4	-175.6	-179.8	0	105.2
6	R	30.5	Very low	30.6	Very low	222 Å²	222	152.8 Å²	152.8	84%	0.838	79%	0.794	S	S	*	*			trans	42.6	120.9	138.6	-70.2	-179	179.7	-175.1	-2.4	119.4
7	A	29.8	Very low	30.5	Very low	87 Å²	87	151.9 Å²	151.9	72%	0.719	79%	0.79	S	S	*	*				88.7	139.6	66.3	0	0	0	0	0	115.7
8	L	29.1	Very low	30.3	Very low	184 Å²	184	151.6 Å²	151.6	96%	0.963	79%	0.788	S	S	*	*			trans	88.6	130	152.2	-113.1	83.5	0	0	0	121.3
9	G	27.2	Very low	30.4	Very low	72 Å²	72	151.3 Å²	151.3	74%	0.742	79%	0.793	S	S	*	*			trans	126	106.8	134.3	0	0	0	0	0	118.5
10	K	32.3	Very low	30.3	Very low	204 Å²	204	147.4 Å²	147.4	89%	0.887	78%	0.784	S	S	*	*			trans	-64.8	174.8	149.4	-63.9	179.3	173	179.1	0	109.3
11	P	42.7	Very low	30.3	Very low	109 Å²	109	148.1 Å²	148.1	71%	0.708	79%	0.787	S	S	*	*			cis	-149.4	-176	16.2	39.7	-15.8	0	0	0	117.7
12	L	29.5	Very low	30.2	Very low	170 Å²	170	141.2 Å²	141.2	89%	0.89	77%	0.766	S	S	*	*			trans	58.4	135.4	145.2	-100.3	108.4	0	0	0	124.3
13	A	28.1	Very low	30.2	Very low	85 Å²	85	138.8 Å²	138.8	70%	0.702	77%	0.77	S	S	*	*			trans	109.7	111.3	136.4	0	0	0	0	0	119.9
14	C	27.6	Very low	30.2	Very low	114 Å²	114	134.2 Å²	134.2	77%	0.77	77%	0.771	S	S	*	*				48.8	149.9	127.4	-73.9	0	0	0	0	124.2
15	L	29.3	Very low	30.3	Very low	161 Å²	161	137.8 Å²	137.8	84%	0.843	78%	0.779	S	S	*	*			trans	81	138.9	160.6	-63.6	122.2	0	0	0	114.7
16	V	29.8	Very low	30.3	Very low	103 Å²	103	142 Å²	142	62%	0.624	79%	0.791	S	S	*	*			cis	-175.9	152.8	13.1	126.4	0	0	0	0	107.2
17	L	28.6	Very low	30.5	Very low	138 Å²	138	141.5 Å²	141.5	72%	0.723	80%	0.795	S	S	*	*			trans	20.8	139.1	151.8	-74.9	105	0	0	0	119.4
18	L	27.2	Very low	30.6	Very low	145 Å²	145	144.8 Å²	144.8	76%	0.759	80%	0.8	S	S	*	*			cis	-179.5	141	42.4	-107.4	141.7	0	0	0	105.5
19	V	31.2	Very low	31	Very low	146 Å²	146	141.3 Å²	141.3	89%	0.885	78%	0.782	S	S	*	*				-164.1	125.4	122.7	165.2	0	0	0	0	107.1
20	A	29.4	Very low	31.5	Very low	74 Å²	74	145.7 Å²	145.7	61%	0.612	78%	0.783	S	S	*	*			trans	-76.3	153.7	177	0	0	0	0	0	112.4
21	L	30.6	Very low	31.9	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	77%	0.772	S	S	*	*			trans	177.5	102.7	131.3	-90.1	159.8	0	0	0	105.8
22	A	29.3	Very low	31.8	Very low	84 Å²	84	140 Å²	140	69%	0.694	76%	0.759	S	S	*	*				62.4	110	107.6	0	0	0	0	0	111.4
23	D	31	Very low	32.1	Very low	171 Å²	171	134.5 Å²	134.5	91%	0.914	74%	0.738	S	S	*	*				-141	147.8	54.5	-91.8	-40.1	0	0	0	115.5
24	A	29.1	Very low	32.5	Very low	83 Å²	83	133.7 Å²	133.7	69%	0.686	73%	0.728	S	S	*	*			trans	-99.8	137.6	-179.5	0	0	0	0	0	111.8
25	Y	32.2	Very low	32.9	Very low	218 Å²	218	135.4 Å²	135.4	86%	0.855	72%	0.724	S	S	*	*				25.2	139.3	129.5	-67.5	-89.5	0	0	0	120
26	R	32.3	Very low	33.1	Very low	249 Å²	249	136.2 Å²	136.2	94%	0.94	72%	0.721	S	S	*	*				-148.4	98.5	129.1	-77	-158.7	173.6	168.2	-1.4	113.5
27	F	33.5	Very low	33.1	Very low	212 Å²	212	138.8 Å²	138.8	93%	0.93	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-94.6	142.5	138.1	-90.7	-84.3	0	0	0	107.8
28	L	32.5	Very low	33.4	Very low	156 Å²	156	136.1 Å²	136.1	82%	0.817	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-74.4	140.3	-178.8	-92.5	152	0	0	0	111.8
29	N	37.3	Very low	33.7	Very low	111 Å²	111	140 Å²	140	59%	0.594	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-86.4	147.9	-178	-167.3	2.9	0	0	0	112.1	N31 T32 A33	N29-N31 VanDerWaalsContact C-N 3.29Å; N29-N31 PolarHBondContact O-N 2.69Å; N29-T32 PolarHBondContact O-N 3.11Å; N29-T32 VanDerWaalsContact O-N 3.13Å; N29-T32 PolarHBondContact O-OG1 2.93Å; N29-A33 PolarHBondContact O-N 3.41Å
30	Q	37.4	Very low	33.8	Very low	164 Å²	164	142.2 Å²	142.2	77%	0.766	73%	0.729	S	S	*	*	H	α-helix	trans	-68.8	-19.6	-168.5	-156.2	166.9	1.9	0	0	114.3	S34	Q30-S34 PolarHBondContact O-OG 3.3Å
31	N	40.9	Very low	34.1	Very low	120 Å²	120	149.4 Å²	149.4	64%	0.642	74%	0.74	S	S	*	*	H	α-helix	trans	-87.1	-17.3	174.7	-75.2	-15	0	0	0	114.1	N29 S34	N29-N31 VanDerWaalsContact C-N 3.29Å; N29-N31 PolarHBondContact O-N 2.69Å; N31-S34 PolarHBondContact O-OG 3.17Å
32	T	41.6	Very low	34.2	Very low	73 Å²	73	153.1 Å²	153.1	45%	0.448	74%	0.743	S	S	.	*	H	α-helix	trans	-88.4	-26.1	169.7	17.3	0	0	0	0	111.9	N29 S34 F36	N29-T32 PolarHBondContact O-N 3.11Å; N29-T32 VanDerWaalsContact O-N 3.13Å; N29-T32 PolarHBondContact O-OG1 2.93Å; T32-S34 VanDerWaalsContact C-N 3.34Å; T32-F36 PolarHBondContact O-N 2.9Å
33	A	35.7	Very low	34.4	Very low	54 Å²	54	153.5 Å²	153.5	45%	0.446	75%	0.746	S	S	.	*	H	α-helix	trans	-68.2	-29.5	171.9	0	0	0	0	0	113.3	N29	N29-A33 PolarHBondContact O-N 3.41Å
34	S	36.2	Very low	34.6	Very low	69 Å²	69	152.5 Å²	152.5	48%	0.483	74%	0.741	S	S	.	*	H	α-helix	trans	-90.7	-15.9	178.9	42.9	0	0	0	0	114.5	Q30 N31 T32	Q30-S34 PolarHBondContact O-OG 3.3Å; N31-S34 PolarHBondContact O-OG 3.17Å; T32-S34 VanDerWaalsContact C-N 3.34Å
35	Q	36.3	Very low	35.1	Very low	150 Å²	150	153.8 Å²	153.8	70%	0.701	75%	0.745	S	S	*	*	H	α-helix	trans	-90.3	-12.3	170.7	-80.6	-176.3	-20	0	0	114.1
36	F	33	Very low	35.6	Very low	177 Å²	177	151 Å²	151	78%	0.776	74%	0.744	S	S	*	*	H	α-helix	trans	-85.5	-23.5	173.7	-164.4	-100.5	0	0	0	112.6	T32 S38	T32-F36 PolarHBondContact O-N 2.9Å; F36-S38 VanDerWaalsContact C-N 3.34Å; F36-S38 PolarHBondContact O-N 3.27Å
37	L	29.8	Very low	36.1	Very low	157 Å²	157	148.9 Å²	148.9	82%	0.822	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	8.9	178.7	-73.7	165.6	0	0	0	114.6
38	S	34.4	Very low	36.6	Very low	83 Å²	83	146.3 Å²	146.3	58%	0.58	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	14.2	-172.5	73.3	0	0	0	0	116.7	F36	F36-S38 VanDerWaalsContact C-N 3.34Å; F36-S38 PolarHBondContact O-N 3.27Å
39	R	33.4	Very low	37.3	Very low	227 Å²	227	144.9 Å²	144.9	86%	0.857	72%	0.722	S	S	*	*	S	Bend	trans	-148.4	75.6	176.7	-77.1	-167.5	177	169.3	-0.2	114.6
40	Q	33.8	Very low	37.7	Very low	192 Å²	192	145.3 Å²	145.3	90%	0.897	73%	0.733	S	S	*	*				-161.8	56.4	129.9	-118.6	-174	-19.9	0	0	111.6
41	R	36.7	Very low	37.9	Very low	224 Å²	224	146 Å²	146	85%	0.845	73%	0.734	S	S	*	*			trans	-108.3	98.8	155	-85.8	-173.6	-178.5	176.1	0.5	108.8
42	R	32.7	Very low	37.8	Very low	242 Å²	242	150.9 Å²	150.9	91%	0.913	75%	0.749	S	S	*	*			trans	-146.3	88.5	152.2	-82.4	-166.9	-173.2	-179.4	1.3	105.8
43	A	32.6	Very low	38.2	Very low	91 Å²	91	149.9 Å²	149.9	75%	0.752	75%	0.753	S	S	*	*				75.7	93	80.3	0	0	0	0	0	111.5
44	N	35.5	Very low	38.9	Very low	150 Å²	150	149.9 Å²	149.9	80%	0.802	75%	0.746	S	S	*	*	S	Bend	trans	-61.4	150	151.9	-80.5	-28.4	0	0	0	109.7	L46	N44-L46 PolarHBondContact O-N 3.28Å
45	S	39	Very low	39.6	Very low	110 Å²	110	149.7 Å²	149.7	77%	0.769	74%	0.739	S	S	*	*	S	Bend	trans	-12.7	92.4	167	173.4	0	0	0	0	116.7	F47	S45-F47 VanDerWaalsContact C-N 3.3Å; S45-F47 PolarHBondContact O-N 2.6Å
46	L	42.6	Very low	40.2	Very low	160 Å²	160	147.6 Å²	147.6	84%	0.838	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	31.8	-5.7	142.6	-98.3	150.5	0	0	0	124.6	N44	N44-L46 PolarHBondContact O-N 3.28Å
47	F	43.8	Very low	41	Very low	204 Å²	204	146 Å²	146	90%	0.895	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.9	5.4	-178.2	-96.4	-78.2	0	0	0	118.9	S45	S45-F47 VanDerWaalsContact C-N 3.3Å; S45-F47 PolarHBondContact O-N 2.6Å
48	E	43.4	Very low	42.1	Very low	158 Å²	158	142.2 Å²	142.2	74%	0.738	70%	0.696	S	S	*	*	S	Bend	trans	-112.9	7.8	-169.3	-151.1	153.5	-155.2	0	0	117.1	N54	E48-N54 PolarHBondContact O-ND2 3.32Å
49	E	47.3	Very low	42.9	Very low	126 Å²	126	139.2 Å²	139.2	59%	0.589	68%	0.675	S	S	*	*			trans	-132	50.8	-163.8	-135.1	-171.4	178.1	0	0	115.7	L55	E49-L55 WeakPolarHBondContact OE1-CD1 3.32Å
50	S	45.7	Very low	43.7	Very low	120 Å²	120	132.4 Å²	132.4	84%	0.839	65%	0.654	S	S	*	*			trans	-122.9	16.5	173.4	59.2	0	0	0	0	115.4
51	K	41.9	Very low	44.4	Very low	178 Å²	178	128.5 Å²	128.5	77%	0.774	64%	0.636	S	S	*	*	S	Bend	trans	-113.7	128.9	172.2	-75.6	-175	178.7	177.5	0	112.2	G53	K51-G53 PolarHBondContact O-N 3.39Å
52	K	38.5	Very low	44.9	Very low	224 Å²	224	125.4 Å²	125.4	97%	0.974	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	123	172.8	-149.5	178.2	-174.4	-175.7	0	108.9
53	G	50.6	Low	45.9	Very low	51 Å²	51	118.6 Å²	118.6	53%	0.526	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	109.1	2.7	-178.4	0	0	0	0	0	116.4	K51	K51-G53 PolarHBondContact O-N 3.39Å
54	N	50.7	Low	46.9	Very low	54 Å²	54	115.4 Å²	115.4	29%	0.289	59%	0.589	S	S	.	*	H	α-helix	trans	-81.2	-36.1	178.6	-118.5	13.7	0	0	0	113.9	E48 E56 R57 E58	E48-N54 PolarHBondContact O-ND2 3.32Å; N54-E56 PolarHBondContact O-N 2.77Å; N54-R57 PolarHBondContact O-N 3.37Å; N54-E58 PolarHBondContact O-N 3.46Å
55	L	49.9	Very low	47.8	Very low	66 Å²	66	112 Å²	112	35%	0.346	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-39.9	-179.8	-108.8	110.4	0	0	0	113.7	E49 R57 E58 C59	E49-L55 WeakPolarHBondContact OE1-CD1 3.32Å; L55-R57 VanDerWaalsContact C-N 3.26Å; L55-R57 PolarHBondContact O-N 3.2Å; L55-E58 PolarHBondContact O-N 3.44Å; L55-C59 PolarHBondContact O-N 3Å
56	E	48.3	Very low	48.5	Very low	106 Å²	106	111.9 Å²	111.9	50%	0.495	56%	0.556	S	S	.	*	H	α-helix	trans	-66.8	-34.2	177.6	-159.9	174.4	-169.5	0	0	110.5	N54 I60	N54-E56 PolarHBondContact O-N 2.77Å; E56-I60 VanDerWaalsContact O-CD1 3.27Å; E56-I60 WeakPolarHBondContact O-CD1 3.46Å; E56-I60 WeakPolarHBondContact O-CG1 3.4Å; E56-I60 PolarHBondContact O-N 2.94Å
57	R	50.1	Low	49.1	Very low	144 Å²	144	110 Å²	110	54%	0.543	54%	0.543	S	S	.	.	H	α-helix	trans	-73.7	-41.2	175.7	-167.6	175.4	-175.3	170.4	1.1	112.6	N54 L55 I60 E61	N54-R57 PolarHBondContact O-N 3.37Å; L55-R57 VanDerWaalsContact C-N 3.26Å; L55-R57 PolarHBondContact O-N 3.2Å; R57-I60 PolarHBondContact O-N 3.04Å; R57-E61 HydrophobicContact CG-CG 4.26Å; R57-E61 WeakPolarHBondContact CG-OE1 3.2Å; R57-E61 IonicContact CZ-OE1 3.8Å; R57-E61 IonicContact NE-OE1 2.75Å; R57-E61 PolarHBondContact NE-OE1 3.44Å; R57-E61 IonicContact NE-OE2 3.63Å; R57-E61 IonicContact NH2-OE1 3.64Å; R57-E61 PolarHBondContact NH2-OE1 2.78Å; R57-E61 WeakPolarHBondContact O-CB 3.4Å; R57-E61 WeakPolarHBondContact O-CG 3.4Å; R57-E61 PolarHBondContact O-N 3.01Å
58	E	52.4	Low	49.7	Very low	77 Å²	77	104 Å²	104	36%	0.36	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-40.9	173.3	-84.1	-178.5	153.3	0	0	112.1	N54 L55 I60 E61 E62	N54-E58 PolarHBondContact O-N 3.46Å; L55-E58 PolarHBondContact O-N 3.44Å; E58-I60 VanDerWaalsContact C-N 3.28Å; E58-I60 PolarHBondContact O-N 3.05Å; E58-E61 PolarHBondContact O-N 2.88Å; E58-E62 PolarHBondContact O-N 3.06Å
59	C	52.1	Low	50.2	Low	19 Å²	19	96.8 Å²	96.8	13%	0.128	49%	0.485	C	S	.	.	I	π-helix	trans	-60.5	-36.6	173.8	-98.4	0	0	0	0	112.8	L55 C64 I72	L55-C59 PolarHBondContact O-N 3Å; C59-C64 VanDerWaalsContact CA-SG 3.55Å; C59-C64 HydrophobicContact CB-CB 3.89Å; C59-C64 WeakPolarHBondContact CB-SG 3.49Å; C59-C64 WeakPolarHBondContact SG-CB 2.99Å; C59-C64 CovalentContact SG-SG 2.03Å; C59-C64 PolarHBondContact SG-SG 2.89Å; C59-I72 HydrophobicContact CB-CD1 4.21Å; C59-I72 VanDerWaalsContact SG-CD1 3.52Å
60	I	49.4	Very low	50.6	Low	84 Å²	84	96.6 Å²	96.6	43%	0.431	48%	0.479	S	S	.	.	I	π-helix	trans	-80.1	-38.9	-177.7	-68.4	167.2	0	0	0	111.4	E56 R57 E58	E56-I60 VanDerWaalsContact O-CD1 3.27Å; E56-I60 WeakPolarHBondContact O-CD1 3.46Å; E56-I60 WeakPolarHBondContact O-CG1 3.4Å; E56-I60 PolarHBondContact O-N 2.94Å; R57-I60 PolarHBondContact O-N 3.04Å; E58-I60 VanDerWaalsContact C-N 3.28Å; E58-I60 PolarHBondContact O-N 3.05Å
61	E	48.5	Very low	50.9	Low	111 Å²	111	96.9 Å²	96.9	52%	0.519	47%	0.467	S	S	.	.	I	π-helix	trans	-87.7	-41.4	-174.3	-67.3	-179.5	-178.8	0	0	112.2	R57 E58 R94	R57-E61 HydrophobicContact CG-CG 4.26Å; R57-E61 WeakPolarHBondContact CG-OE1 3.2Å; R57-E61 IonicContact CZ-OE1 3.8Å; R57-E61 IonicContact NE-OE1 2.75Å; R57-E61 PolarHBondContact NE-OE1 3.44Å; R57-E61 IonicContact NE-OE2 3.63Å; R57-E61 IonicContact NH2-OE1 3.64Å; R57-E61 PolarHBondContact NH2-OE1 2.78Å; R57-E61 WeakPolarHBondContact O-CB 3.4Å; R57-E61 WeakPolarHBondContact O-CG 3.4Å; R57-E61 PolarHBondContact O-N 3.01Å; E58-E61 PolarHBondContact O-N 2.88Å; E61-R94 PolarHBondContact O-NH2 2.83Å
62	E	48	Very low	51.4	Low	158 Å²	158	90.9 Å²	90.9	74%	0.738	44%	0.443	S	S	*	.	I	π-helix	trans	-114.5	-0.5	-169.4	-60.6	-154.2	158.4	0	0	116.1	E58	E58-E62 PolarHBondContact O-N 3.06Å
63	V	53.1	Low	52	Low	99 Å²	99	85.4 Å²	85.4	60%	0.6	42%	0.419	S	S	*	.	I	π-helix	trans	64.3	100.3	-175	-172.1	0	0	0	0	111.7	R94	V63-R94 VanDerWaalsContact CG2-NH1 3.29Å
64	C	54.2	Low	51.8	Low	25 Å²	25	90.7 Å²	90.7	17%	0.169	43%	0.43	C	S	.	.			trans	-75.2	156.4	175.3	54.7	0	0	0	0	112.8	C59 E68	C59-C64 VanDerWaalsContact CA-SG 3.55Å; C59-C64 HydrophobicContact CB-CB 3.89Å; C59-C64 WeakPolarHBondContact CB-SG 3.49Å; C59-C64 WeakPolarHBondContact SG-CB 2.99Å; C59-C64 CovalentContact SG-SG 2.03Å; C59-C64 PolarHBondContact SG-SG 2.89Å; C64-E68 VanDerWaalsContact CA-OE2 3.3Å; C64-E68 WeakPolarHBondContact CA-OE2 3.41Å; C64-E68 HydrophobicContact CB-CB 3.76Å; C64-E68 VanDerWaalsContact CB-OE2 3.26Å; C64-E68 WeakPolarHBondContact CB-OE2 3.48Å
65	N	53.5	Low	51.6	Low	78 Å²	78	92.6 Å²	92.6	42%	0.417	44%	0.44	S	S	.	.			trans	-73.3	166.1	172.7	65.4	48.1	0	0	0	111.2	E67 E68 A69	N65-E67 PolarHBondContact O-N 2.74Å; N65-E67 PolarHBondContact OD1-N 3.24Å; N65-E68 PolarHBondContact N-OE2 2.75Å; N65-E68 PolarHBondContact ND2-OE1 2.97Å; N65-E68 PolarHBondContact ND2-OE2 2.79Å; N65-E68 PolarHBondContact O-N 2.99Å; N65-E68 WeakPolarHBondContact OD1-CB 3.45Å; N65-E68 WeakPolarHBondContact OD1-CG 3.43Å; N65-E68 PolarHBondContact OD1-N 2.78Å; N65-A69 PolarHBondContact O-N 3.11Å; N65-A69 VanDerWaalsContact O-N 3.07Å
66	K	54.3	Low	51.7	Low	108 Å²	108	95.1 Å²	95.1	47%	0.47	45%	0.45	S	S	.	.	H	α-helix	trans	-59.6	-33.5	-174.2	-178.9	-175.7	179.1	-174.9	0	111.9	R70 Y83	K66-R70 WeakPolarHBondContact O-CB 3.43Å; K66-R70 PolarHBondContact O-N 3.27Å; K66-R70 VanDerWaalsContact O-N 3.09Å; K66-Y83 HydrophobicContact CG-CE1 4.31Å
67	E	55.6	Low	51.7	Low	119 Å²	119	95.4 Å²	95.4	56%	0.556	46%	0.461	S	S	*	.	H	α-helix	trans	-74.3	-36.3	-178.7	-78.1	57.7	-145.8	0	0	111.8	N65 R70 E71	N65-E67 PolarHBondContact O-N 2.74Å; N65-E67 PolarHBondContact OD1-N 3.24Å; E67-R70 WeakPolarHBondContact O-CB 3.34Å; E67-R70 PolarHBondContact O-N 3.4Å; E67-E71 PolarHBondContact O-N 3.44Å
68	E	55.5	Low	51.6	Low	80 Å²	80	94.6 Å²	94.6	37%	0.374	46%	0.464	S	S	.	.	H	α-helix	trans	-67.6	-41.9	172	-76.4	157.4	-171.7	0	0	112.2	C64 N65 R70 E71 I72	C64-E68 VanDerWaalsContact CA-OE2 3.3Å; C64-E68 WeakPolarHBondContact CA-OE2 3.41Å; C64-E68 HydrophobicContact CB-CB 3.76Å; C64-E68 VanDerWaalsContact CB-OE2 3.26Å; C64-E68 WeakPolarHBondContact CB-OE2 3.48Å; N65-E68 PolarHBondContact N-OE2 2.75Å; N65-E68 PolarHBondContact ND2-OE1 2.97Å; N65-E68 PolarHBondContact ND2-OE2 2.79Å; N65-E68 PolarHBondContact O-N 2.99Å; N65-E68 WeakPolarHBondContact OD1-CB 3.45Å; N65-E68 WeakPolarHBondContact OD1-CG 3.43Å; N65-E68 PolarHBondContact OD1-N 2.78Å; E68-R70 PolarHBondContact O-N 3.35Å; E68-E71 PolarHBondContact O-N 3.15Å; E68-I72 PolarHBondContact O-N 3.16Å
69	A	54.2	Low	51.6	Low	5 Å²	5	92.5 Å²	92.5	4%	0.041	46%	0.456	C	S	.	.	H	α-helix	trans	-62.2	-32.6	172.1	0	0	0	0	0	111.7	N65 E71 I72 F73 Y83	N65-A69 PolarHBondContact O-N 3.11Å; N65-A69 VanDerWaalsContact O-N 3.07Å; A69-E71 VanDerWaalsContact C-N 3.34Å; A69-I72 PolarHBondContact O-N 2.95Å; A69-F73 VanDerWaalsContact O-CD2 3.24Å; A69-F73 WeakPolarHBondContact O-CD2 3.48Å; A69-F73 PolarHBondContact O-N 2.8Å; A69-Y83 HydrophobicContact CB-CE2 4.02Å
70	R	56.2	Low	51.3	Low	122 Å²	122	99.1 Å²	99.1	46%	0.46	49%	0.485	S	S	.	.	H	α-helix	trans	-69.5	-30	178	-147.5	-178.3	83	131.7	7.1	113.1	K66 E67 E68 N75	K66-R70 WeakPolarHBondContact O-CB 3.43Å; K66-R70 PolarHBondContact O-N 3.27Å; K66-R70 VanDerWaalsContact O-N 3.09Å; E67-R70 WeakPolarHBondContact O-CB 3.34Å; E67-R70 PolarHBondContact O-N 3.4Å; E68-R70 PolarHBondContact O-N 3.35Å; R70-N75 PolarHBondContact NE-OD1 2.87Å; R70-N75 PolarHBondContact NH2-OD1 2.81Å
71	E	52.6	Low	51.5	Low	126 Å²	126	101.3 Å²	101.3	59%	0.589	49%	0.489	S	S	*	.	H	α-helix	trans	-74.1	-27.5	175.9	-71.9	-165.8	168.2	0	0	112.9	E67 E68 A69	E67-E71 PolarHBondContact O-N 3.44Å; E68-E71 PolarHBondContact O-N 3.15Å; A69-E71 VanDerWaalsContact C-N 3.34Å
72	I	52.6	Low	51.6	Low	53 Å²	53	99.4 Å²	99.4	27%	0.272	48%	0.479	S	S	.	.	H	α-helix	trans	-76.5	-34.8	177.3	-65.6	-179.9	0	0	0	112.3	C59 E68 A69	C59-I72 HydrophobicContact CB-CD1 4.21Å; C59-I72 VanDerWaalsContact SG-CD1 3.52Å; E68-I72 PolarHBondContact O-N 3.16Å; A69-I72 PolarHBondContact O-N 2.95Å
73	F	49.5	Very low	51.8	Low	108 Å²	108	95.1 Å²	95.1	47%	0.474	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	27.6	-173.8	-61.4	-70.7	0	0	0	114.6	A69 N75	A69-F73 VanDerWaalsContact O-CD2 3.24Å; A69-F73 WeakPolarHBondContact O-CD2 3.48Å; A69-F73 PolarHBondContact O-N 2.8Å; F73-N75 PolarHBondContact O-N 2.95Å
74	E	47.2	Very low	51.8	Low	163 Å²	163	93.8 Å²	93.8	76%	0.762	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	53.8	169.1	-66.3	-171	163.1	0	0	116.4	H76	E74-H76 VanDerWaalsContact C-N 3.31Å; E74-H76 PolarHBondContact O-N 2.95Å; E74-H76 PolarHBondContact O-ND1 2.81Å
75	N	46.1	Very low	51.7	Low	94 Å²	94	98 Å²	98	50%	0.503	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.2	42.7	162.1	-72.4	-32.5	0	0	0	116.3	R70 F73	R70-N75 PolarHBondContact NE-OD1 2.87Å; R70-N75 PolarHBondContact NH2-OD1 2.81Å; F73-N75 PolarHBondContact O-N 2.95Å
76	H	53.3	Low	51.7	Low	118 Å²	118	97 Å²	97	55%	0.546	46%	0.456	S	S	.	.			trans	-89.9	139.9	170.7	-85.6	8.4	0	0	0	112	E74 E78 T79	E74-H76 VanDerWaalsContact C-N 3.31Å; E74-H76 PolarHBondContact O-N 2.95Å; E74-H76 PolarHBondContact O-ND1 2.81Å; H76-E78 IonicContact CD2-OE2 2.72Å; H76-E78 PolarHBondContact O-N 2.73Å; H76-T79 PolarHBondContact O-N 3.2Å; H76-T79 VanDerWaalsContact O-N 3.13Å; H76-T79 PolarHBondContact O-OG1 2.82Å
77	P	47.7	Very low	51.6	Low	113 Å²	113	95.4 Å²	95.4	73%	0.734	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.9	178.3	23.9	-31.6	0	0	0	113.3	T79 E80	P77-T79 PolarHBondContact O-N 3.14Å; P77-E80 PolarHBondContact O-N 2.65Å
78	E	48.5	Very low	51.5	Low	127 Å²	127	95.6 Å²	95.6	59%	0.593	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.9	175.6	-69.7	142.5	174.8	0	0	113.9	H76 E80 Y81 F82	H76-E78 IonicContact CD2-OE2 2.72Å; H76-E78 PolarHBondContact O-N 2.73Å; E78-E80 PolarHBondContact O-N 2.98Å; E78-Y81 PolarHBondContact O-N 2.83Å; E78-Y81 VanDerWaalsContact O-N 3.16Å; E78-F82 PolarHBondContact O-N 3.47Å; E78-F82 VanDerWaalsContact O-N 3.1Å
79	T	50.9	Low	51.5	Low	32 Å²	32	93.5 Å²	93.5	20%	0.196	45%	0.453	C	S	.	.	H	α-helix	trans	-63.6	-26.4	174.5	-37.6	0	0	0	0	112.1	H76 P77 Y81 F82 Y83	H76-T79 PolarHBondContact O-N 3.2Å; H76-T79 VanDerWaalsContact O-N 3.13Å; H76-T79 PolarHBondContact O-OG1 2.82Å; P77-T79 PolarHBondContact O-N 3.14Å; T79-Y81 VanDerWaalsContact C-N 3.33Å; T79-Y81 PolarHBondContact O-N 3.35Å; T79-F82 PolarHBondContact O-N 3.06Å; T79-Y83 WeakPolarHBondContact O-CB 3.16Å; T79-Y83 PolarHBondContact O-N 3.08Å
80	E	47.3	Very low	51.4	Low	159 Å²	159	95.8 Å²	95.8	74%	0.743	46%	0.464	S	S	*	.	H	α-helix	trans	-65	-35.1	174.2	-84.9	-163.9	152	0	0	113.1	P77 E78 P84	P77-E80 PolarHBondContact O-N 2.65Å; E78-E80 PolarHBondContact O-N 2.98Å; E80-P84 VanDerWaalsContact O-CD 3.31Å; E80-P84 WeakPolarHBondContact O-CD 3.28Å
81	Y	53.1	Low	51.1	Low	129 Å²	129	91.9 Å²	91.9	51%	0.506	46%	0.462	S	S	.	.	H	α-helix	trans	-79.1	-36.3	176.2	-179.4	-98.6	0	0	0	112	E78 T79 K85	E78-Y81 PolarHBondContact O-N 2.83Å; E78-Y81 VanDerWaalsContact O-N 3.16Å; T79-Y81 VanDerWaalsContact C-N 3.33Å; T79-Y81 PolarHBondContact O-N 3.35Å; Y81-K85 VanDerWaalsContact CZ-NZ 3.33Å; Y81-K85 PolarHBondContact OH-NZ 3.38Å
82	F	49.2	Very low	51	Low	72 Å²	72	90.3 Å²	90.3	32%	0.316	47%	0.465	S	S	.	.	H	α-helix	trans	-84.4	-34.8	-173.1	-118.3	-89.6	0	0	0	114.2	E78 T79 K85 Y86	E78-F82 PolarHBondContact O-N 3.47Å; E78-F82 VanDerWaalsContact O-N 3.1Å; T79-F82 PolarHBondContact O-N 3.06Å; F82-K85 PolarHBondContact O-N 3.17Å; F82-Y86 WeakPolarHBondContact O-CB 3.34Å; F82-Y86 PolarHBondContact O-N 3.22Å
83	Y	52.7	Low	51	Low	67 Å²	67	95 Å²	95	26%	0.263	49%	0.485	S	S	.	.	H	α-helix	trans	-59.8	-42.5	-174.4	-171.4	-104.1	0	0	0	114.2	K66 A69 T79 K85 Y86 V87	K66-Y83 HydrophobicContact CG-CE1 4.31Å; A69-Y83 HydrophobicContact CB-CE2 4.02Å; T79-Y83 WeakPolarHBondContact O-CB 3.16Å; T79-Y83 PolarHBondContact O-N 3.08Å; Y83-K85 VanDerWaalsContact C-N 3.34Å; Y83-K85 PolarHBondContact O-N 3.31Å; Y83-Y86 PolarHBondContact O-N 2.95Å; Y83-V87 HydrophobicContact CD1-CG2 4.34Å; Y83-V87 HydrophobicContact CE1-CG2 4.11Å; Y83-V87 HydrophobicContact CE2-CG2 4.49Å; Y83-V87 VanDerWaalsContact O-CG2 3.29Å; Y83-V87 WeakPolarHBondContact O-CG2 3.26Å; Y83-V87 PolarHBondContact O-N 3.18Å
84	P	53.3	Low	51	Low	71 Å²	71	97.6 Å²	97.6	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-64.9	-36.5	176.7	-18.7	31.4	0	0	0	112.9	E80 L88	E80-P84 VanDerWaalsContact O-CD 3.31Å; E80-P84 WeakPolarHBondContact O-CD 3.28Å; P84-L88 WeakPolarHBondContact O-CB 3.25Å; P84-L88 PolarHBondContact O-N 2.85Å; P84-L88 VanDerWaalsContact O-N 3.09Å
85	K	53.5	Low	50.9	Low	113 Å²	113	94.5 Å²	94.5	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-71.9	-36.9	178.3	-70.7	-174.1	179	-177.7	0	112	Y81 F82 Y83 L88 C89	Y81-K85 VanDerWaalsContact CZ-NZ 3.33Å; Y81-K85 PolarHBondContact OH-NZ 3.38Å; F82-K85 PolarHBondContact O-N 3.17Å; Y83-K85 VanDerWaalsContact C-N 3.34Å; Y83-K85 PolarHBondContact O-N 3.31Å; K85-L88 PolarHBondContact O-N 3.2Å; K85-C89 WeakPolarHBondContact O-CB 3.45Å; K85-C89 PolarHBondContact O-N 2.85Å
86	Y	51.6	Low	51.1	Low	59 Å²	59	93.6 Å²	93.6	23%	0.231	50%	0.497	C	S	.	.	H	α-helix	trans	-64.2	-45.1	173.4	176.9	-105.4	0	0	0	112.2	F82 Y83 L88 C89 L90	F82-Y86 WeakPolarHBondContact O-CB 3.34Å; F82-Y86 PolarHBondContact O-N 3.22Å; Y83-Y86 PolarHBondContact O-N 2.95Å; Y86-L88 VanDerWaalsContact C-N 3.35Å; Y86-L88 PolarHBondContact O-N 2.87Å; Y86-C89 PolarHBondContact O-N 2.9Å; Y86-L90 HydrophobicContact CD1-CD1 3.92Å; Y86-L90 HydrophobicContact CE1-CD1 3.4Å; Y86-L90 VanDerWaalsContact CE1-CD1 3.4Å; Y86-L90 HydrophobicContact CE2-CD1 4.09Å; Y86-L90 HydrophobicContact CG-CD1 4.46Å; Y86-L90 PolarHBondContact O-N 3.01Å
87	V	53.8	Low	50.6	Low	74 Å²	74	95.2 Å²	95.2	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-37.2	176.2	174.3	0	0	0	0	111.9	Y83 L90 G91	Y83-V87 HydrophobicContact CD1-CG2 4.34Å; Y83-V87 HydrophobicContact CE1-CG2 4.11Å; Y83-V87 HydrophobicContact CE2-CG2 4.49Å; Y83-V87 VanDerWaalsContact O-CG2 3.29Å; Y83-V87 WeakPolarHBondContact O-CG2 3.26Å; Y83-V87 PolarHBondContact O-N 3.18Å; V87-L90 PolarHBondContact O-N 2.9Å; V87-G91 PolarHBondContact O-N 3.14Å
88	L	53.8	Low	50.2	Low	123 Å²	123	96.2 Å²	96.2	64%	0.644	51%	0.507	S	S	*	.	H	α-helix	trans	-65.4	-44.8	172.8	-94.6	154.8	0	0	0	112.5	P84 K85 Y86 L90 G91 S92	P84-L88 WeakPolarHBondContact O-CB 3.25Å; P84-L88 PolarHBondContact O-N 2.85Å; P84-L88 VanDerWaalsContact O-N 3.09Å; K85-L88 PolarHBondContact O-N 3.2Å; Y86-L88 VanDerWaalsContact C-N 3.35Å; Y86-L88 PolarHBondContact O-N 2.87Å; L88-L90 VanDerWaalsContact C-N 3.28Å; L88-L90 PolarHBondContact O-N 3.19Å; L88-G91 PolarHBondContact O-N 3.43Å; L88-S92 PolarHBondContact O-N 2.78Å; L88-S92 PolarHBondContact O-OG 2.95Å
89	C	53.7	Low	49.7	Very low	35 Å²	35	97.7 Å²	97.7	24%	0.236	52%	0.52	C	S	.	.	H	α-helix	trans	-57.8	-38.5	175.1	173.5	0	0	0	0	111.3	K85 Y86 C113	K85-C89 WeakPolarHBondContact O-CB 3.45Å; K85-C89 PolarHBondContact O-N 2.85Å; Y86-C89 PolarHBondContact O-N 2.9Å; C89-C113 HydrophobicContact CB-CB 4.41Å; C89-C113 WeakPolarHBondContact CB-SG 3.28Å; C89-C113 WeakPolarHBondContact SG-CB 3.31Å; C89-C113 CovalentContact SG-SG 2.1Å; C89-C113 PolarHBondContact SG-SG 3.18Å
90	L	52.3	Low	49.2	Very low	53 Å²	53	104.3 Å²	104.3	28%	0.277	55%	0.548	S	S	.	.	H	α-helix	trans	-74.1	-37.1	175.8	-83	161.8	0	0	0	114.4	Y86 V87 L88 H93 R94 L110	Y86-L90 HydrophobicContact CD1-CD1 3.92Å; Y86-L90 HydrophobicContact CE1-CD1 3.4Å; Y86-L90 VanDerWaalsContact CE1-CD1 3.4Å; Y86-L90 HydrophobicContact CE2-CD1 4.09Å; Y86-L90 HydrophobicContact CG-CD1 4.46Å; Y86-L90 PolarHBondContact O-N 3.01Å; V87-L90 PolarHBondContact O-N 2.9Å; L88-L90 VanDerWaalsContact C-N 3.28Å; L88-L90 PolarHBondContact O-N 3.19Å; L90-H93 PolarHBondContact O-N 3.09Å; L90-R94 PolarHBondContact O-N 2.84Å; L90-L110 HydrophobicContact CD2-CD2 3.72Å; L90-L110 HydrophobicContact CG-CD2 4.25Å
91	G	51.4	Low	49	Very low	41 Å²	41	104.6 Å²	104.6	42%	0.423	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-36.8	178.2	0	0	0	0	0	113.2	V87 L88 H93	V87-G91 PolarHBondContact O-N 3.14Å; L88-G91 PolarHBondContact O-N 3.43Å; G91-H93 VanDerWaalsContact C-N 3.27Å; G91-H93 PolarHBondContact O-N 3.03Å
92	S	50.6	Low	48.2	Very low	92 Å²	92	103.2 Å²	103.2	64%	0.643	56%	0.564	S	S	*	*	H	α-helix	trans	-69.2	-21.3	176.7	-56	0	0	0	0	113.8	L88	L88-S92 PolarHBondContact O-N 2.78Å; L88-S92 PolarHBondContact O-OG 2.95Å
93	H	51.4	Low	47.4	Very low	151 Å²	151	109 Å²	109	70%	0.699	59%	0.592	S	S	*	*	H	α-helix	trans	-90.7	-20.7	-179.8	-106.9	-81.9	0	0	0	114.2	L90 G91	L90-H93 PolarHBondContact O-N 3.09Å; G91-H93 VanDerWaalsContact C-N 3.27Å; G91-H93 PolarHBondContact O-N 3.03Å
94	R	49.5	Very low	46.8	Very low	164 Å²	164	110.1 Å²	110.1	62%	0.619	61%	0.609	S	S	*	*	H	α-helix	trans	-91.9	-19.8	-179.8	-89.6	-176.7	177.1	-178.3	-0.7	114.7	E61 V63 L90	E61-R94 PolarHBondContact O-NH2 2.83Å; V63-R94 VanDerWaalsContact CG2-NH1 3.29Å; L90-R94 PolarHBondContact O-N 2.84Å
95	V	46.5	Very low	46	Very low	97 Å²	97	114 Å²	114	59%	0.588	63%	0.626	S	S	*	*	S	Bend	trans	-108	89.8	177.2	-168.8	0	0	0	0	107.7	I97	V95-I97 HydrophobicContact CG1-CD1 4.39Å; V95-I97 HydrophobicContact CG1-CG1 4.21Å; V95-I97 PolarHBondContact O-N 3.25Å
96	G	49.8	Very low	45.2	Very low	76 Å²	76	115.7 Å²	115.7	78%	0.784	64%	0.639	S	S	*	*			trans	-60.2	76	-178.2	0	0	0	0	0	114	N98	G96-N98 PolarHBondContact O-N 2.9Å
97	I	42.8	Very low	44.6	Very low	151 Å²	151	118.1 Å²	118.1	77%	0.774	66%	0.662	S	S	*	*			trans	-87.6	88.5	166.6	-59.5	178.3	0	0	0	106.3	V95 N99	V95-I97 HydrophobicContact CG1-CD1 4.39Å; V95-I97 HydrophobicContact CG1-CG1 4.21Å; V95-I97 PolarHBondContact O-N 3.25Å; I97-N99 PolarHBondContact O-N 2.98Å
98	N	39	Very low	44.4	Very low	134 Å²	134	120.7 Å²	120.7	72%	0.717	68%	0.68	S	S	*	*			trans	-58.8	111.1	167.2	-91.6	-16.8	0	0	0	109.3	G96	G96-N98 PolarHBondContact O-N 2.9Å
99	N	37.3	Very low	44.1	Very low	159 Å²	159	120.3 Å²	120.3	85%	0.85	68%	0.679	S	S	*	*			trans	-83	112.4	155.1	-135.2	-2	0	0	0	107	I97 N101	I97-N99 PolarHBondContact O-N 2.98Å; N99-N101 VanDerWaalsContact C-N 3.34Å; N99-N101 PolarHBondContact O-N 3.1Å
100	H	40.4	Very low	43.9	Very low	170 Å²	170	122.4 Å²	122.4	79%	0.787	69%	0.687	S	S	*	*	S	Bend	trans	-64.1	88.1	-178.3	-92	-74.2	0	0	0	111.1
101	N	43.1	Very low	43.6	Very low	165 Å²	165	128.4 Å²	128.4	88%	0.882	71%	0.706	S	S	*	*			trans	-174.4	67.1	147.8	-97.7	-12.7	0	0	0	109.6	N99	N99-N101 VanDerWaalsContact C-N 3.34Å; N99-N101 PolarHBondContact O-N 3.1Å
102	S	37.5	Very low	43.6	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	72%	0.719	S	S	*	*			trans	-138.3	116	158.4	75.6	0	0	0	0	110.3	S104	S102-S104 PolarHBondContact O-N 3.11Å
103	Q	32.8	Very low	43.7	Very low	194 Å²	194	130.1 Å²	130.1	91%	0.907	71%	0.706	S	S	*	*			trans	-68.9	114.7	155.1	-76.8	177	-20.8	0	0	106.8
104	S	38.6	Very low	43.6	Very low	91 Å²	91	126.7 Å²	126.7	64%	0.636	70%	0.696	S	S	*	*	S	Bend	trans	31.5	100.5	145	56.9	0	0	0	0	118.3	S102	S102-S104 PolarHBondContact O-N 3.11Å
105	N	37.4	Very low	43.6	Very low	153 Å²	153	124.3 Å²	124.3	82%	0.818	70%	0.7	S	S	*	*				156	98.4	116.8	-79.3	-20.3	0	0	0	110	P107	N105-P107 WeakPolarHBondContact O-CD 3.37Å
106	I	36.3	Very low	43.7	Very low	147 Å²	147	128.2 Å²	128.2	75%	0.754	71%	0.712	S	S	*	*			trans	-88.1	122.6	175	-63.5	165.3	0	0	0	108.7
107	P	38.7	Very low	43.8	Very low	110 Å²	110	129.8 Å²	129.8	71%	0.714	70%	0.702	S	S	*	*			trans	-79	145	162.7	-11.6	29	0	0	0	111.4	N105	N105-P107 WeakPolarHBondContact O-CD 3.37Å
108	P	50.3	Low	44.5	Very low	128 Å²	128	125.6 Å²	125.6	83%	0.831	69%	0.685	S	S	*	*			trans	-103	90.7	-175.7	36.4	-25	0	0	0	111.1
109	D	46.9	Very low	45.7	Very low	115 Å²	115	123 Å²	123	62%	0.615	67%	0.671	S	S	*	*			trans	-149	129	164.6	-156.6	-6.6	0	0	0	112.7	T112	D109-T112 PolarHBondContact O-OG1 3.37Å
110	L	48.6	Very low	47.4	Very low	79 Å²	79	117.3 Å²	117.3	41%	0.414	64%	0.64	S	S	.	*	G	3₁₀ helix	trans	-85.6	1.6	-174.4	-100.5	114.6	0	0	0	113.5	L90 T112	L90-L110 HydrophobicContact CD2-CD2 3.72Å; L90-L110 HydrophobicContact CG-CD2 4.25Å; L110-T112 PolarHBondContact O-N 3.1Å
111	R	47.1	Very low	49	Very low	179 Å²	179	110 Å²	110	68%	0.675	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-68.7	-8.6	176.3	-82.7	-172.6	-170.6	-102.6	-7.3	115.3	C113	R111-C113 VanDerWaalsContact C-N 3.3Å; R111-C113 PolarHBondContact O-N 3.17Å
112	T	52	Low	50.5	Low	113 Å²	113	106.4 Å²	106.4	69%	0.693	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-73.8	-18.4	-180	-29.1	0	0	0	0	113.4	D109 L110 V114	D109-T112 PolarHBondContact O-OG1 3.37Å; L110-T112 PolarHBondContact O-N 3.1Å; T112-V114 VanDerWaalsContact C-N 3.33Å; T112-V114 PolarHBondContact O-N 3.39Å
113	C	51.4	Low	52.1	Low	56 Å²	56	107.3 Å²	107.3	38%	0.378	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-84.2	2.6	-179.8	-88.4	0	0	0	0	113.8	C89 R111	C89-C113 HydrophobicContact CB-CB 4.41Å; C89-C113 WeakPolarHBondContact CB-SG 3.28Å; C89-C113 WeakPolarHBondContact SG-CB 3.31Å; C89-C113 CovalentContact SG-SG 2.1Å; C89-C113 PolarHBondContact SG-SG 3.18Å; R111-C113 VanDerWaalsContact C-N 3.3Å; R111-C113 PolarHBondContact O-N 3.17Å
114	V	49.7	Very low	54.4	Low	80 Å²	80	102.6 Å²	102.6	49%	0.485	57%	0.57	S	S	.	*	S	Bend	trans	-120.6	-12.9	-176.8	-173.5	0	0	0	0	114.3	T112 E116	T112-V114 VanDerWaalsContact C-N 3.33Å; T112-V114 PolarHBondContact O-N 3.39Å; V114-E116 PolarHBondContact O-N 2.88Å
115	T	49.3	Very low	56.5	Low	113 Å²	113	99 Å²	99	69%	0.693	55%	0.545	S	S	*	.	S	Bend	trans	-90.9	11.2	-169.8	46.4	0	0	0	0	117.1
116	E	48.6	Very low	58.8	Low	180 Å²	180	92 Å²	92	84%	0.841	51%	0.508	S	S	*	.			trans	-117.4	93.4	166.3	-72.5	-135.2	162.2	0	0	110.8	V114 S118	V114-E116 PolarHBondContact O-N 2.88Å; E116-S118 PolarHBondContact O-N 2.83Å
117	L	51.7	Low	61.3	Low	109 Å²	109	89.2 Å²	89.2	57%	0.571	49%	0.488	S	S	*	.			trans	-63.6	103.4	166.8	-74.1	163.8	0	0	0	108.6	N119 Q120 A139	L117-N119 PolarHBondContact O-N 3.17Å; L117-Q120 PolarHBondContact O-NE2 2.75Å; L117-A139 HydrophobicContact CD1-CB 4.22Å
118	S	57.7	Low	63.4	Low	62 Å²	62	91.9 Å²	91.9	43%	0.434	49%	0.488	S	S	.	.			trans	-36.7	120.8	169.4	161.3	0	0	0	0	112.4	E116 Q120	E116-S118 PolarHBondContact O-N 2.83Å; S118-Q120 PolarHBondContact O-N 2.99Å; S118-Q120 VanDerWaalsContact O-N 3.11Å; S118-Q120 PolarHBondContact O-NE2 2.89Å
119	N	65.2	Low	65	Low	79 Å²	79	91.5 Å²	91.5	42%	0.422	48%	0.476	S	S	.	.			trans	-32.3	113.9	176.6	179.1	-12.9	0	0	0	112.3	L117 C121 T122	L117-N119 PolarHBondContact O-N 3.17Å; N119-C121 PolarHBondContact O-N 3.45Å; N119-C121 VanDerWaalsContact O-N 3.15Å; N119-C121 VanDerWaalsContact OD1-CB 3.27Å; N119-C121 WeakPolarHBondContact OD1-CB 3.39Å; N119-C121 PolarHBondContact OD1-N 2.84Å; N119-T122 PolarHBondContact O-N 2.83Å; N119-T122 VanDerWaalsContact O-N 3.13Å; N119-T122 PolarHBondContact O-OG1 2.82Å
120	Q	71.4	Confident	66.7	Low	41 Å²	41	86 Å²	86	19%	0.192	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-4.8	-172.5	-65.4	85.3	85.9	0	0	112.8	L117 S118 T122 D136 Q138 F141	L117-Q120 PolarHBondContact O-NE2 2.75Å; S118-Q120 PolarHBondContact O-N 2.99Å; S118-Q120 VanDerWaalsContact O-N 3.11Å; S118-Q120 PolarHBondContact O-NE2 2.89Å; Q120-T122 VanDerWaalsContact C-N 3.29Å; Q120-D136 VanDerWaalsContact CB-OD1 3.31Å; Q120-D136 WeakPolarHBondContact CB-OD1 3.14Å; Q120-D136 PolarHBondContact N-OD1 3.09Å; Q120-D136 PolarHBondContact NE2-OD1 2.8Å; Q120-D136 PolarHBondContact OE1-OD1 2.93Å; Q120-Q138 VanDerWaalsContact OE1-CA 3.29Å; Q120-Q138 VanDerWaalsContact OE1-N 3.12Å; Q120-F141 HydrophobicContact CB-CB 4.29Å
121	C	75	Confident	68.6	Low	15 Å²	15	82.5 Å²	82.5	10%	0.101	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	9.5	170.4	-60.9	0	0	0	0	113.7	N119 P123 Y124 C134	N119-C121 PolarHBondContact O-N 3.45Å; N119-C121 VanDerWaalsContact O-N 3.15Å; N119-C121 VanDerWaalsContact OD1-CB 3.27Å; N119-C121 WeakPolarHBondContact OD1-CB 3.39Å; N119-C121 PolarHBondContact OD1-N 2.84Å; C121-P123 CarbonylContact O-C 3.43Å; C121-Y124 VanDerWaalsContact O-CA 3.25Å; C121-Y124 WeakPolarHBondContact O-CA 3.3Å; C121-Y124 PolarHBondContact O-N 2.95Å; C121-C134 VanDerWaalsContact CA-SG 3.58Å; C121-C134 HydrophobicContact CB-CB 3.69Å; C121-C134 WeakPolarHBondContact CB-SG 3.49Å; C121-C134 WeakPolarHBondContact SG-CB 3.33Å; C121-C134 CovalentContact SG-SG 2.04Å; C121-C134 PolarHBondContact SG-SG 2.93Å
122	T	73.4	Confident	70.5	Confident	90 Å²	90	79.3 Å²	79.3	55%	0.552	42%	0.421	S	S	*	.	S	Bend	trans	-130.2	109.4	177.3	28.7	0	0	0	0	111.7	N119 Q120	N119-T122 PolarHBondContact O-N 2.83Å; N119-T122 VanDerWaalsContact O-N 3.13Å; N119-T122 PolarHBondContact O-OG1 2.82Å; Q120-T122 VanDerWaalsContact C-N 3.29Å
123	P	71.9	Confident	72.1	Confident	120 Å²	120	80.7 Å²	80.7	78%	0.779	41%	0.413	S	S	*	.	S	Bend	cis	-70.4	150.1	3.3	30.4	-35.2	0	0	0	112.9	C121 P125	C121-P123 CarbonylContact O-C 3.43Å; P123-P125 WeakPolarHBondContact O-CD 3.41Å
124	Y	81.7	Confident	73.7	Confident	94 Å²	94	79.1 Å²	79.1	37%	0.369	40%	0.403	S	S	.	.			trans	-56	109	-173.9	-168.1	-101.2	0	0	0	111.4	C121 C126 K128 S131 R133 C134	C121-Y124 VanDerWaalsContact O-CA 3.25Å; C121-Y124 WeakPolarHBondContact O-CA 3.3Å; C121-Y124 PolarHBondContact O-N 2.95Å; Y124-C126 HydrophobicContact CD1-CB 4.21Å; Y124-C126 VanDerWaalsContact CD1-O 3.26Å; Y124-C126 WeakPolarHBondContact CD1-O 3.24Å; Y124-C126 HydrophobicContact CE1-CB 3.54Å; Y124-C126 WeakPolarHBondContact CE1-O 3.39Å; Y124-K128 HydrophobicContact CD1-CG 4.31Å; Y124-S131 WeakPolarHBondContact CE1-OG 3.34Å; Y124-S131 PolarHBondContact OH-OG 2.97Å; Y124-R133 WeakPolarHBondContact OH-CA 3.38Å; Y124-C134 HydrophobicContact CD2-CB 4.08Å; Y124-C134 HydrophobicContact CE2-CB 3.55Å
125	P	81.5	Confident	75.4	Confident	17 Å²	17	78.4 Å²	78.4	11%	0.11	40%	0.398	C	S	.	.			trans	-85.1	-15.7	-169.1	33.4	-35.3	0	0	0	112.2	P123 F141 R153	P123-P125 WeakPolarHBondContact O-CD 3.41Å; P125-F141 HydrophobicContact CB-CD1 4.45Å; P125-F141 HydrophobicContact CB-CD2 4.11Å; P125-F141 HydrophobicContact CB-CE1 4.24Å; P125-F141 HydrophobicContact CB-CE2 3.9Å; P125-F141 HydrophobicContact CB-CG 4.39Å; P125-F141 HydrophobicContact CB-CZ 3.97Å; P125-F141 HydrophobicContact CG-CB 4.39Å; P125-F141 HydrophobicContact CG-CD1 4.3Å; P125-F141 HydrophobicContact CG-CD2 3.64Å; P125-F141 HydrophobicContact CG-CE2 3.95Å; P125-F141 HydrophobicContact CG-CG 3.85Å; P125-F141 HydrophobicContact CG-CZ 4.4Å; P125-R153 PolarHBondContact O-NE 2.83Å; P125-R153 PolarHBondContact O-NH2 2.02Å
126	C	87.1	Confident	76.8	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.034	38%	0.382	C	S	.	.	S	Bend	trans	-82.7	154	-178.6	-45.6	0	0	0	0	112.2	Y124 K128 S131 C134 C143	Y124-C126 HydrophobicContact CD1-CB 4.21Å; Y124-C126 VanDerWaalsContact CD1-O 3.26Å; Y124-C126 WeakPolarHBondContact CD1-O 3.24Å; Y124-C126 HydrophobicContact CE1-CB 3.54Å; Y124-C126 WeakPolarHBondContact CE1-O 3.39Å; C126-K128 PolarHBondContact O-N 2.89Å; C126-S131 VanDerWaalsContact CB-CB 3.45Å; C126-S131 WeakPolarHBondContact CB-OG 3.21Å; C126-C134 VanDerWaalsContact SG-CB 3.55Å; C126-C143 WeakPolarHBondContact CA-SG 3.42Å; C126-C143 HydrophobicContact CB-CB 3.7Å; C126-C143 WeakPolarHBondContact CB-SG 3.36Å; C126-C143 VanDerWaalsContact SG-CA 3.52Å; C126-C143 WeakPolarHBondContact SG-CB 3.12Å; C126-C143 CovalentContact SG-SG 2.01Å; C126-C143 PolarHBondContact SG-SG 2.87Å
127	Y	87.8	Confident	77.7	Confident	89 Å²	89	69.5 Å²	69.5	35%	0.349	36%	0.362	S	S	.	.			trans	-64.5	121.1	174.4	-176.2	-123	0	0	0	109.9	E129 G130 S131 W149 R153 C154	Y127-E129 VanDerWaalsContact C-N 3.27Å; Y127-E129 HydrophobicContact CD1-CB 4.24Å; Y127-E129 HydrophobicContact CE1-CB 3.6Å; Y127-E129 HydrophobicContact CE1-CG 4.43Å; Y127-E129 PolarHBondContact O-N 3.45Å; Y127-E129 PolarHBondContact OH-OE2 2.96Å; Y127-G130 VanDerWaalsContact CD1-N 3.35Å; Y127-G130 PolarHBondContact O-N 3.15Å; Y127-S131 VanDerWaalsContact O-CB 3.27Å; Y127-S131 WeakPolarHBondContact O-CB 3.4Å; Y127-S131 PolarHBondContact O-N 2.74Å; Y127-S131 PolarHBondContact O-OG 3.49Å; Y127-W149 HydrophobicContact CD1-CE3 4.14Å; Y127-W149 HydrophobicContact CD1-CH2 4.27Å; Y127-W149 AromaticContact CD1-CZ3 3.78Å; Y127-W149 HydrophobicContact CD1-CZ3 3.78Å; Y127-W149 HydrophobicContact CE1-CE3 4.3Å; Y127-W149 AromaticContact CE1-CH2 3.62Å; Y127-W149 HydrophobicContact CE1-CH2 3.62Å; Y127-W149 HydrophobicContact CE1-CZ2 4.45Å; Y127-W149 AromaticContact CE1-CZ3 3.52Å; Y127-W149 HydrophobicContact CE1-CZ3 3.52Å; Y127-R153 WeakPolarHBondContact CB-O 3.45Å; Y127-R153 PolarHBondContact N-O 2.87Å; Y127-C154 WeakPolarHBondContact CB-O 3.37Å; Y127-C154 WeakPolarHBondContact CD1-O 3.5Å
128	K	82.7	Confident	78.3	Confident	165 Å²	165	72.4 Å²	72.4	72%	0.717	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-31.6	-167.5	-70.4	-175.7	177.6	179.9	0	113.7	Y124 C126	Y124-K128 HydrophobicContact CD1-CG 4.31Å; C126-K128 PolarHBondContact O-N 2.89Å
129	E	83.4	Confident	78.3	Confident	121 Å²	121	73.3 Å²	73.3	57%	0.565	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-39	-177.5	-64	170.6	-179.4	0	0	111.5	Y127 K146	Y127-E129 VanDerWaalsContact C-N 3.27Å; Y127-E129 HydrophobicContact CD1-CB 4.24Å; Y127-E129 HydrophobicContact CE1-CB 3.6Å; Y127-E129 HydrophobicContact CE1-CG 4.43Å; Y127-E129 PolarHBondContact O-N 3.45Å; Y127-E129 PolarHBondContact OH-OE2 2.96Å; E129-K146 WeakPolarHBondContact O-CD 3.44Å; E129-K146 WeakPolarHBondContact O-CE 3.48Å; E129-K146 PolarHBondContact O-NZ 2.75Å
130	G	84.1	Confident	78.5	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-14.4	-178.2	0	0	0	0	0	116.7	Y127 K146	Y127-G130 VanDerWaalsContact CD1-N 3.35Å; Y127-G130 PolarHBondContact O-N 3.15Å; G130-K146 WeakPolarHBondContact O-CB 3.42Å; G130-K146 PolarHBondContact O-N 3.12Å
131	S	87.3	Confident	78.8	Confident	4 Å²	4	74.5 Å²	74.5	3%	0.028	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.2	179.1	64.6	0	0	0	0	113.1	Y124 C126 Y127 K146	Y124-S131 WeakPolarHBondContact CE1-OG 3.34Å; Y124-S131 PolarHBondContact OH-OG 2.97Å; C126-S131 VanDerWaalsContact CB-CB 3.45Å; C126-S131 WeakPolarHBondContact CB-OG 3.21Å; Y127-S131 VanDerWaalsContact O-CB 3.27Å; Y127-S131 WeakPolarHBondContact O-CB 3.4Å; Y127-S131 PolarHBondContact O-N 2.74Å; Y127-S131 PolarHBondContact O-OG 3.49Å; S131-K146 VanDerWaalsContact O-CE 3.25Å; S131-K146 WeakPolarHBondContact O-CE 3.36Å
132	E	87	Confident	79.3	Confident	112 Å²	112	77.8 Å²	77.8	52%	0.523	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-47.2	172.6	-172.1	-170.2	148.1	0	0	110.7	V144 K146	E132-V144 HydrophobicContact CB-CG1 4.44Å; E132-V144 PolarHBondContact N-O 2.83Å; E132-K146 HydrophobicContact CB-CG 4.09Å
133	R	86.6	Confident	80	Confident	142 Å²	142	74 Å²	74	54%	0.536	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	158.7	177	61.6	-179.8	-176.7	-118.8	4.1	112.5	Y124 V144	Y124-R133 WeakPolarHBondContact OH-CA 3.38Å; R133-V144 HydrophobicContact CG-CB 3.98Å; R133-V144 HydrophobicContact CG-CG2 4.1Å; R133-V144 PolarHBondContact N-O 3.31Å; R133-V144 PolarHBondContact O-N 3.09Å
134	C	85.2	Confident	80.8	Confident	23 Å²	23	70.5 Å²	70.5	16%	0.155	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.6	170.9	179	0	0	0	0	110	C121 Y124 C126	C121-C134 VanDerWaalsContact CA-SG 3.58Å; C121-C134 HydrophobicContact CB-CB 3.69Å; C121-C134 WeakPolarHBondContact CB-SG 3.49Å; C121-C134 WeakPolarHBondContact SG-CB 3.33Å; C121-C134 CovalentContact SG-SG 2.04Å; C121-C134 PolarHBondContact SG-SG 2.93Å; Y124-C134 HydrophobicContact CD2-CB 4.08Å; Y124-C134 HydrophobicContact CE2-CB 3.55Å; C126-C134 VanDerWaalsContact SG-CB 3.55Å
135	V	85.8	Confident	81.1	Confident	65 Å²	65	67.8 Å²	67.8	39%	0.394	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.3	176.1	-176.7	0	0	0	0	108.8	F141 T142 V144	V135-F141 WeakPolarHBondContact O-CA 3.42Å; V135-T142 PolarHBondContact N-O 3.04Å; V135-T142 PolarHBondContact O-N 3.16Å; V135-V144 HydrophobicContact CG2-CG2 4.02Å
136	D	77.3	Confident	81.4	Confident	66 Å²	66	71 Å²	71	35%	0.353	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	129.7	178.7	-168.7	35.9	0	0	0	110.5	Q120	Q120-D136 VanDerWaalsContact CB-OD1 3.31Å; Q120-D136 WeakPolarHBondContact CB-OD1 3.14Å; Q120-D136 PolarHBondContact N-OD1 3.09Å; Q120-D136 PolarHBondContact NE2-OD1 2.8Å; Q120-D136 PolarHBondContact OE1-OD1 2.93Å
137	G	67.1	Low	81.3	Confident	41 Å²	41	76.5 Å²	76.5	42%	0.423	41%	0.409	S	S	.	.			trans	-122.4	16.5	-167.7	0	0	0	0	0	114.8	S140	G137-S140 CarbonylContact C-O 2.97Å; G137-S140 WeakPolarHBondContact CA-O 3.43Å; G137-S140 PolarHBondContact N-O 3.09Å
138	Q	64.3	Low	81.1	Confident	169 Å²	169	72.9 Å²	72.9	79%	0.79	40%	0.399	S	S	*	.	S	Bend	trans	53.6	73.2	177.1	-62.2	-179.1	-8.9	0	0	112.6	Q120	Q120-Q138 VanDerWaalsContact OE1-CA 3.29Å; Q120-Q138 VanDerWaalsContact OE1-N 3.12Å
139	A	57.8	Low	81.4	Confident	81 Å²	81	66.5 Å²	66.5	67%	0.669	37%	0.371	S	S	*	.	S	Bend	trans	92.7	5.1	-171.2	0	0	0	0	0	115.7	L117	L117-A139 HydrophobicContact CD1-CB 4.22Å
140	S	69.3	Low	81.6	Confident	72 Å²	72	64.7 Å²	64.7	50%	0.503	36%	0.361	S	S	.	.			trans	-147.8	160.6	171.1	-177.5	0	0	0	0	109.7	G137	G137-S140 CarbonylContact C-O 2.97Å; G137-S140 WeakPolarHBondContact CA-O 3.43Å; G137-S140 PolarHBondContact N-O 3.09Å
141	F	79.4	Confident	81.6	Confident	73 Å²	73	66.2 Å²	66.2	32%	0.32	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.8	172.3	67.8	-90.5	0	0	0	109.8	Q120 P125 V135 R153	Q120-F141 HydrophobicContact CB-CB 4.29Å; P125-F141 HydrophobicContact CB-CD1 4.45Å; P125-F141 HydrophobicContact CB-CD2 4.11Å; P125-F141 HydrophobicContact CB-CE1 4.24Å; P125-F141 HydrophobicContact CB-CE2 3.9Å; P125-F141 HydrophobicContact CB-CG 4.39Å; P125-F141 HydrophobicContact CB-CZ 3.97Å; P125-F141 HydrophobicContact CG-CB 4.39Å; P125-F141 HydrophobicContact CG-CD1 4.3Å; P125-F141 HydrophobicContact CG-CD2 3.64Å; P125-F141 HydrophobicContact CG-CE2 3.95Å; P125-F141 HydrophobicContact CG-CG 3.85Å; P125-F141 HydrophobicContact CG-CZ 4.4Å; V135-F141 WeakPolarHBondContact O-CA 3.42Å; F141-R153 HydrophobicContact CE2-CG 4.17Å; F141-R153 HydrophobicContact CZ-CG 4.27Å
142	T	84.6	Confident	81.5	Confident	84 Å²	84	73 Å²	73	52%	0.515	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.9	173.9	-53.2	0	0	0	0	109.8	V135	V135-T142 PolarHBondContact N-O 3.04Å; V135-T142 PolarHBondContact O-N 3.16Å
143	C	88.6	Confident	81.4	Confident	12 Å²	12	73.4 Å²	73.4	8%	0.081	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.1	175.6	-61.9	0	0	0	0	109.5	C126 C154	C126-C143 WeakPolarHBondContact CA-SG 3.42Å; C126-C143 HydrophobicContact CB-CB 3.7Å; C126-C143 WeakPolarHBondContact CB-SG 3.36Å; C126-C143 VanDerWaalsContact SG-CA 3.52Å; C126-C143 WeakPolarHBondContact SG-CB 3.12Å; C126-C143 CovalentContact SG-SG 2.01Å; C126-C143 PolarHBondContact SG-SG 2.87Å; C143-C154 VanDerWaalsContact CB-SG 3.59Å
144	V	88.6	Confident	81.5	Confident	46 Å²	46	66.7 Å²	66.7	28%	0.279	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114	170.5	179.8	0	0	0	0	107.2	E132 R133 V135	E132-V144 HydrophobicContact CB-CG1 4.44Å; E132-V144 PolarHBondContact N-O 2.83Å; R133-V144 HydrophobicContact CG-CB 3.98Å; R133-V144 HydrophobicContact CG-CG2 4.1Å; R133-V144 PolarHBondContact N-O 3.31Å; R133-V144 PolarHBondContact O-N 3.09Å; V135-V144 HydrophobicContact CG2-CG2 4.02Å
145	C	88.9	Confident	81.5	Confident	36 Å²	36	69.4 Å²	69.4	24%	0.243	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.1	-177	-52.6	0	0	0	0	111.5	W149 C154	C145-W149 HydrophobicContact CB-CB 4.18Å; C145-W149 VanDerWaalsContact CB-O 3.3Å; C145-W149 WeakPolarHBondContact CB-O 3.46Å; C145-C154 WeakPolarHBondContact CA-SG 3.23Å; C145-C154 HydrophobicContact CB-CB 3.7Å; C145-C154 WeakPolarHBondContact CB-SG 3.49Å; C145-C154 PolarHBondContact N-SG 3.34Å; C145-C154 WeakPolarHBondContact SG-CA 3.25Å; C145-C154 WeakPolarHBondContact SG-CB 3.38Å; C145-C154 CovalentContact SG-SG 2.04Å; C145-C154 PolarHBondContact SG-SG 2.93Å
146	K	87.6	Confident	81.6	Confident	85 Å²	85	70.3 Å²	70.3	37%	0.37	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-65.4	155.9	166.9	-67.4	-179.9	-171.6	159	0	109	E129 G130 S131 E132 G148 W149	E129-K146 WeakPolarHBondContact O-CD 3.44Å; E129-K146 WeakPolarHBondContact O-CE 3.48Å; E129-K146 PolarHBondContact O-NZ 2.75Å; G130-K146 WeakPolarHBondContact O-CB 3.42Å; G130-K146 PolarHBondContact O-N 3.12Å; S131-K146 VanDerWaalsContact O-CE 3.25Å; S131-K146 WeakPolarHBondContact O-CE 3.36Å; E132-K146 HydrophobicContact CB-CG 4.09Å; K146-G148 PolarHBondContact O-N 2.86Å; K146-W149 PolarHBondContact O-N 3.4Å; K146-W149 VanDerWaalsContact O-N 3.16Å
147	P	84.6	Confident	82.1	Confident	120 Å²	120	69.2 Å²	69.2	78%	0.779	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	137.3	169.2	-24	33.9	0	0	0	110.8
148	G	83.5	Confident	83.1	Confident	13 Å²	13	67.7 Å²	67.7	13%	0.134	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	0.8	-175.9	0	0	0	0	0	115.3	K146 I158	K146-G148 PolarHBondContact O-N 2.86Å; G148-I158 WeakPolarHBondContact O-CB 3.28Å; G148-I158 WeakPolarHBondContact O-CG1 3.45Å; G148-I158 PolarHBondContact O-N 3.44Å
149	W	88.9	Confident	84.2	Confident	32 Å²	32	62.2 Å²	62.2	12%	0.121	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.8	179.9	-62.8	81.8	0	0	0	112.3	Y127 C145 K146 C154 D156 D157 P178 G179	Y127-W149 HydrophobicContact CD1-CE3 4.14Å; Y127-W149 HydrophobicContact CD1-CH2 4.27Å; Y127-W149 AromaticContact CD1-CZ3 3.78Å; Y127-W149 HydrophobicContact CD1-CZ3 3.78Å; Y127-W149 HydrophobicContact CE1-CE3 4.3Å; Y127-W149 AromaticContact CE1-CH2 3.62Å; Y127-W149 HydrophobicContact CE1-CH2 3.62Å; Y127-W149 HydrophobicContact CE1-CZ2 4.45Å; Y127-W149 AromaticContact CE1-CZ3 3.52Å; Y127-W149 HydrophobicContact CE1-CZ3 3.52Å; C145-W149 HydrophobicContact CB-CB 4.18Å; C145-W149 VanDerWaalsContact CB-O 3.3Å; C145-W149 WeakPolarHBondContact CB-O 3.46Å; K146-W149 PolarHBondContact O-N 3.4Å; K146-W149 VanDerWaalsContact O-N 3.16Å; W149-C154 HydrophobicContact CB-CB 4.45Å; W149-D156 CarbonylContact C-O 3.51Å; W149-D156 WeakPolarHBondContact CA-O 3.48Å; W149-D157 HydrophobicContact CE3-CB 4.4Å; W149-D157 HydrophobicContact CH2-CB 4.46Å; W149-D157 HydrophobicContact CZ3-CB 4.13Å; W149-P178 HydrophobicContact CH2-CB 4.13Å; W149-P178 HydrophobicContact CZ2-CB 4.09Å; W149-G179 VanDerWaalsContact NE1-CA 3.29Å
150	K	86.6	Confident	85.6	Confident	82 Å²	82	59.2 Å²	59.2	36%	0.357	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	178.8	177.7	67.6	178.6	174.9	-177	0	111.6	C154 E155 D156 I158 D163	K150-C154 CarbonylContact O-C 3.44Å; K150-C154 VanDerWaalsContact O-CA 3.29Å; K150-C154 WeakPolarHBondContact O-CA 3.45Å; K150-E155 PolarHBondContact O-N 2.72Å; K150-D156 HydrophobicContact CG-CB 3.93Å; K150-D156 PolarHBondContact N-O 2.83Å; K150-D156 WeakPolarHBondContact O-CB 3.35Å; K150-D156 PolarHBondContact O-N 3.06Å; K150-D156 VanDerWaalsContact O-N 3.08Å; K150-I158 HydrophobicContact CB-CD1 4.3Å; K150-I158 HydrophobicContact CB-CG1 3.94Å; K150-I158 HydrophobicContact CD-CG1 4.02Å; K150-I158 HydrophobicContact CG-CG1 3.85Å; K150-D163 IonicContact NZ-OD2 2.81Å; K150-D163 PolarHBondContact NZ-OD2 2.78Å
151	G	85.6	Confident	86.4	Confident	32 Å²	32	57.7 Å²	57.7	33%	0.33	31%	0.31	S	S	.	.	S	Bend	trans	98.7	162	-176.6	0	0	0	0	0	112.9	R153 C154	G151-R153 PolarHBondContact O-N 2.86Å; G151-C154 PolarHBondContact O-N 3Å; G151-C154 VanDerWaalsContact O-N 3.16Å
152	N	83.8	Confident	86.6	Confident	146 Å²	146	58.3 Å²	58.3	78%	0.781	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.9	-173.6	-69.7	-21.9	0	0	0	112.9	E155	N152-E155 PolarHBondContact N-OE2 3.27Å
153	R	85.8	Confident	86.6	Confident	122 Å²	122	55.3 Å²	55.3	46%	0.46	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	8.8	176.8	-51.6	176.1	64.3	-176	-2.4	112	P125 Y127 F141 G151 E155	P125-R153 PolarHBondContact O-NE 2.83Å; P125-R153 PolarHBondContact O-NH2 2.02Å; Y127-R153 WeakPolarHBondContact CB-O 3.45Å; Y127-R153 PolarHBondContact N-O 2.87Å; F141-R153 HydrophobicContact CE2-CG 4.17Å; F141-R153 HydrophobicContact CZ-CG 4.27Å; G151-R153 PolarHBondContact O-N 2.86Å; R153-E155 WeakPolarHBondContact CA-OE2 3.45Å; R153-E155 VanDerWaalsContact CB-OE2 3.29Å; R153-E155 WeakPolarHBondContact CB-OE2 3.19Å; R153-E155 PolarHBondContact N-OE2 3.17Å; R153-E155 PolarHBondContact O-N 3.42Å
154	C	88.5	Confident	86.2	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	58.9	32	-172.6	-44.8	0	0	0	0	113.2	Y127 C143 C145 W149 K150 G151	Y127-C154 WeakPolarHBondContact CB-O 3.37Å; Y127-C154 WeakPolarHBondContact CD1-O 3.5Å; C143-C154 VanDerWaalsContact CB-SG 3.59Å; C145-C154 WeakPolarHBondContact CA-SG 3.23Å; C145-C154 HydrophobicContact CB-CB 3.7Å; C145-C154 WeakPolarHBondContact CB-SG 3.49Å; C145-C154 PolarHBondContact N-SG 3.34Å; C145-C154 WeakPolarHBondContact SG-CA 3.25Å; C145-C154 WeakPolarHBondContact SG-CB 3.38Å; C145-C154 CovalentContact SG-SG 2.04Å; C145-C154 PolarHBondContact SG-SG 2.93Å; W149-C154 HydrophobicContact CB-CB 4.45Å; K150-C154 CarbonylContact O-C 3.44Å; K150-C154 VanDerWaalsContact O-CA 3.29Å; K150-C154 WeakPolarHBondContact O-CA 3.45Å; G151-C154 PolarHBondContact O-N 3Å; G151-C154 VanDerWaalsContact O-N 3.16Å
155	E	85.6	Confident	85.8	Confident	81 Å²	81	65.3 Å²	65.3	38%	0.379	36%	0.356	S	S	.	.			trans	-81.9	-19.4	-177.9	64.6	-90.2	-116.7	0	0	113.3	K150 N152 R153	K150-E155 PolarHBondContact O-N 2.72Å; N152-E155 PolarHBondContact N-OE2 3.27Å; R153-E155 WeakPolarHBondContact CA-OE2 3.45Å; R153-E155 VanDerWaalsContact CB-OE2 3.29Å; R153-E155 WeakPolarHBondContact CB-OE2 3.19Å; R153-E155 PolarHBondContact N-OE2 3.17Å; R153-E155 PolarHBondContact O-N 3.42Å
156	D	87.5	Confident	85.3	Confident	83 Å²	83	68 Å²	68	44%	0.444	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.9	-174.9	-60	-42.7	0	0	0	109.9	W149 K150	W149-D156 CarbonylContact C-O 3.51Å; W149-D156 WeakPolarHBondContact CA-O 3.48Å; K150-D156 HydrophobicContact CG-CB 3.93Å; K150-D156 PolarHBondContact N-O 2.83Å; K150-D156 WeakPolarHBondContact O-CB 3.35Å; K150-D156 PolarHBondContact O-N 3.06Å; K150-D156 VanDerWaalsContact O-N 3.08Å
157	D	88.1	Confident	85	Confident	43 Å²	43	69.6 Å²	69.6	23%	0.23	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.1	168.8	-175.1	51.8	0	0	0	110	W149 D159 N176 G179	W149-D157 HydrophobicContact CE3-CB 4.4Å; W149-D157 HydrophobicContact CH2-CB 4.46Å; W149-D157 HydrophobicContact CZ3-CB 4.13Å; D157-D159 PolarHBondContact O-N 3.01Å; D157-N176 PolarHBondContact OD2-ND2 3.03Å; D157-G179 PolarHBondContact OD1-N 3.04Å
158	I	87.7	Confident	84.7	Confident	10 Å²	10	64.4 Å²	64.4	5%	0.051	34%	0.343	C	S	.	.			trans	-79.4	110.9	173.8	-61.2	176.5	0	0	0	107	G148 K150 E160 D163 F166 N176	G148-I158 WeakPolarHBondContact O-CB 3.28Å; G148-I158 WeakPolarHBondContact O-CG1 3.45Å; G148-I158 PolarHBondContact O-N 3.44Å; K150-I158 HydrophobicContact CB-CD1 4.3Å; K150-I158 HydrophobicContact CB-CG1 3.94Å; K150-I158 HydrophobicContact CD-CG1 4.02Å; K150-I158 HydrophobicContact CG-CG1 3.85Å; I158-E160 HydrophobicContact CG2-CG 4.13Å; I158-E160 PolarHBondContact O-N 2.75Å; I158-E160 VanDerWaalsContact O-OE2 3.06Å; I158-D163 HydrophobicContact CG2-CB 4.48Å; I158-F166 HydrophobicContact CD1-CD2 4.4Å; I158-F166 HydrophobicContact CD1-CG 4.41Å; I158-F166 HydrophobicContact CG2-CB 3.52Å; I158-F166 HydrophobicContact CG2-CD2 3.93Å; I158-F166 HydrophobicContact CG2-CG 3.81Å; I158-N176 PolarHBondContact O-OD1 3.22Å
159	D	86.6	Confident	84.5	Confident	53 Å²	53	66.1 Å²	66.1	28%	0.283	36%	0.361	S	S	.	.			trans	-75.3	90.3	172.9	-178.9	-5	0	0	0	110.2	D157 C161 S162 D163 N176	D157-D159 PolarHBondContact O-N 3.01Å; D159-C161 PolarHBondContact O-N 3.04Å; D159-C161 WeakPolarHBondContact OD1-CA 3.35Å; D159-C161 VanDerWaalsContact OD1-CB 3.26Å; D159-C161 WeakPolarHBondContact OD1-CB 3.4Å; D159-C161 PolarHBondContact OD1-N 3.45Å; D159-S162 PolarHBondContact O-N 2.96Å; D159-S162 VanDerWaalsContact O-N 3.07Å; D159-S162 PolarHBondContact OD1-N 2.93Å; D159-S162 VanDerWaalsContact OD2-CB 3.25Å; D159-S162 WeakPolarHBondContact OD2-CB 3.48Å; D159-S162 PolarHBondContact OD2-OG 2.91Å; D159-D163 WeakPolarHBondContact O-CB 3.33Å; D159-D163 PolarHBondContact O-N 3.34Å; D159-N176 WeakPolarHBondContact CA-ND2 3.35Å; D159-N176 WeakPolarHBondContact OD1-CB 3.39Å
160	E	87.7	Confident	84.2	Confident	19 Å²	19	66 Å²	66	9%	0.089	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-9.5	-178.3	-56.8	95.9	164	0	0	113.3	I158 F166 L167 A168 N176 F181	I158-E160 HydrophobicContact CG2-CG 4.13Å; I158-E160 PolarHBondContact O-N 2.75Å; I158-E160 VanDerWaalsContact O-OE2 3.06Å; E160-F166 WeakPolarHBondContact CA-O 3.3Å; E160-F166 WeakPolarHBondContact CB-O 3.45Å; E160-F166 WeakPolarHBondContact CG-O 3.42Å; E160-L167 CarbonylContact O-C 3.58Å; E160-L167 WeakPolarHBondContact O-CA 3.35Å; E160-A168 HydrophobicContact CB-CB 3.85Å; E160-A168 VanDerWaalsContact O-CB 3.31Å; E160-A168 WeakPolarHBondContact O-CB 3.4Å; E160-A168 PolarHBondContact O-N 3.09Å; E160-N176 PolarHBondContact OE2-OD1 2.89Å; E160-F181 HydrophobicContact CB-CB 4.25Å; E160-F181 HydrophobicContact CB-CD1 3.69Å; E160-F181 HydrophobicContact CB-CE1 4.37Å; E160-F181 HydrophobicContact CB-CG 4.14Å; E160-F181 HydrophobicContact CG-CD1 3.81Å; E160-F181 HydrophobicContact CG-CE1 4.39Å
161	C	85.9	Confident	83.9	Confident	40 Å²	40	66.6 Å²	66.6	27%	0.27	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-25	174.6	-53.8	0	0	0	0	113.1	D159 C174 H175 N176	D159-C161 PolarHBondContact O-N 3.04Å; D159-C161 WeakPolarHBondContact OD1-CA 3.35Å; D159-C161 VanDerWaalsContact OD1-CB 3.26Å; D159-C161 WeakPolarHBondContact OD1-CB 3.4Å; D159-C161 PolarHBondContact OD1-N 3.45Å; C161-C174 WeakPolarHBondContact CA-SG 3.35Å; C161-C174 HydrophobicContact CB-CB 3.67Å; C161-C174 WeakPolarHBondContact CB-SG 3.44Å; C161-C174 WeakPolarHBondContact SG-CB 3.4Å; C161-C174 CovalentContact SG-SG 2.03Å; C161-C174 PolarHBondContact SG-SG 2.89Å; C161-H175 VanDerWaalsContact SG-C 3.58Å; C161-H175 PolarHBondContact SG-N 2.82Å; C161-H175 VanDerWaalsContact SG-N 3.42Å; C161-N176 PolarHBondContact SG-N 2.68Å; C161-N176 VanDerWaalsContact SG-N 3.39Å
162	S	84.7	Confident	83.8	Confident	85 Å²	85	68.1 Å²	68.1	59%	0.594	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-24.2	-174.4	-52.1	0	0	0	0	113.5	D159 P164	D159-S162 PolarHBondContact O-N 2.96Å; D159-S162 VanDerWaalsContact O-N 3.07Å; D159-S162 PolarHBondContact OD1-N 2.93Å; D159-S162 VanDerWaalsContact OD2-CB 3.25Å; D159-S162 WeakPolarHBondContact OD2-CB 3.48Å; D159-S162 PolarHBondContact OD2-OG 2.91Å; S162-P164 WeakPolarHBondContact O-CD 2.99Å
163	D	84.1	Confident	83.9	Confident	22 Å²	22	66.5 Å²	66.5	12%	0.118	36%	0.356	C	S	.	.			trans	-79.6	115.5	-174.8	-163.5	-42.1	0	0	0	111	K150 I158 D159 E165 F166 L167	K150-D163 IonicContact NZ-OD2 2.81Å; K150-D163 PolarHBondContact NZ-OD2 2.78Å; I158-D163 HydrophobicContact CG2-CB 4.48Å; D159-D163 WeakPolarHBondContact O-CB 3.33Å; D159-D163 PolarHBondContact O-N 3.34Å; D163-E165 PolarHBondContact O-N 2.73Å; D163-E165 PolarHBondContact OD1-N 2.94Å; D163-F166 CarbonylContact O-C 3.19Å; D163-F166 PolarHBondContact O-N 2.85Å; D163-L167 VanDerWaalsContact O-CD2 3.31Å; D163-L167 WeakPolarHBondContact O-CD2 3.04Å; D163-L167 WeakPolarHBondContact O-CG 3.49Å; D163-L167 PolarHBondContact O-N 2.83Å
164	P	79.3	Confident	84	Confident	110 Å²	110	62.8 Å²	62.8	71%	0.714	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.3	-176.3	27.6	-34.2	0	0	0	113.9	S162	S162-P164 WeakPolarHBondContact O-CD 2.99Å
165	E	81.1	Confident	84	Confident	158 Å²	158	68 Å²	68	74%	0.738	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-24.4	178.3	-166.9	171.9	-172.6	0	0	111.9	D163	D163-E165 PolarHBondContact O-N 2.73Å; D163-E165 PolarHBondContact OD1-N 2.94Å
166	F	79.1	Confident	84.1	Confident	93 Å²	93	66 Å²	66	41%	0.408	36%	0.364	S	S	.	.	S	Bend	trans	-131	49.8	-174.5	-62	-82	0	0	0	112.1	I158 E160 D163 A168	I158-F166 HydrophobicContact CD1-CD2 4.4Å; I158-F166 HydrophobicContact CD1-CG 4.41Å; I158-F166 HydrophobicContact CG2-CB 3.52Å; I158-F166 HydrophobicContact CG2-CD2 3.93Å; I158-F166 HydrophobicContact CG2-CG 3.81Å; E160-F166 WeakPolarHBondContact CA-O 3.3Å; E160-F166 WeakPolarHBondContact CB-O 3.45Å; E160-F166 WeakPolarHBondContact CG-O 3.42Å; D163-F166 CarbonylContact O-C 3.19Å; D163-F166 PolarHBondContact O-N 2.85Å; F166-A168 PolarHBondContact O-N 2.9Å
167	L	80.6	Confident	84.1	Confident	117 Å²	117	64.4 Å²	64.4	61%	0.613	36%	0.355	S	S	*	.			trans	-66.1	129.9	-177.8	-69.2	170.5	0	0	0	112.7	E160 D163 G169	E160-L167 CarbonylContact O-C 3.58Å; E160-L167 WeakPolarHBondContact O-CA 3.35Å; D163-L167 VanDerWaalsContact O-CD2 3.31Å; D163-L167 WeakPolarHBondContact O-CD2 3.04Å; D163-L167 WeakPolarHBondContact O-CG 3.49Å; D163-L167 PolarHBondContact O-N 2.83Å; L167-G169 PolarHBondContact O-N 3.04Å
168	A	79.3	Confident	84	Confident	11 Å²	11	67.4 Å²	67.4	9%	0.091	38%	0.377	C	S	.	.			trans	-61.3	-24	178.1	0	0	0	0	0	114.4	E160 F166 C170 F181	E160-A168 HydrophobicContact CB-CB 3.85Å; E160-A168 VanDerWaalsContact O-CB 3.31Å; E160-A168 WeakPolarHBondContact O-CB 3.4Å; E160-A168 PolarHBondContact O-N 3.09Å; F166-A168 PolarHBondContact O-N 2.9Å; A168-C170 VanDerWaalsContact C-N 3.27Å; A168-C170 PolarHBondContact O-N 2.65Å; A168-F181 HydrophobicContact CB-CB 4.45Å; A168-F181 HydrophobicContact CB-CD1 4.04Å; A168-F181 HydrophobicContact CB-CD2 3.47Å; A168-F181 VanDerWaalsContact CB-CD2 3.47Å; A168-F181 HydrophobicContact CB-CE1 4.12Å; A168-F181 HydrophobicContact CB-CE2 3.55Å; A168-F181 HydrophobicContact CB-CG 3.72Å; A168-F181 HydrophobicContact CB-CZ 3.88Å
169	G	78.6	Confident	83.8	Confident	49 Å²	49	68 Å²	68	51%	0.505	39%	0.386	S	S	.	.			trans	70.7	14.7	-178.3	0	0	0	0	0	115	L167 I195	L167-G169 PolarHBondContact O-N 3.04Å; G169-I195 WeakPolarHBondContact O-CG2 3.45Å
170	C	81.3	Confident	83.8	Confident	29 Å²	29	67.9 Å²	67.9	20%	0.196	39%	0.39	C	S	.	.			trans	-61	135.7	177.5	-57.2	0	0	0	0	111.9	A168 C174 C183	A168-C170 VanDerWaalsContact C-N 3.27Å; A168-C170 PolarHBondContact O-N 2.65Å; C170-C174 HydrophobicContact CB-CB 4Å; C170-C174 VanDerWaalsContact SG-CB 3.57Å; C170-C183 VanDerWaalsContact CA-SG 3.56Å; C170-C183 HydrophobicContact CB-CB 3.72Å; C170-C183 WeakPolarHBondContact CB-SG 3.45Å; C170-C183 VanDerWaalsContact SG-CA 3.59Å; C170-C183 WeakPolarHBondContact SG-CB 3.46Å; C170-C183 CovalentContact SG-SG 2.02Å; C170-C183 PolarHBondContact SG-SG 3.15Å
171	N	80.6	Confident	83.8	Confident	95 Å²	95	69.5 Å²	69.5	51%	0.508	40%	0.396	S	S	.	.	S	Bend	trans	-75.7	-31	-179.1	-72.4	-10.7	0	0	0	114.6	I195 N196	N171-I195 PolarHBondContact N-O 2.92Å; N171-N196 WeakPolarHBondContact ND2-CA 3.36Å; N171-N196 PolarHBondContact ND2-OD1 3.07Å
172	Q	83.7	Confident	83.7	Confident	64 Å²	64	72.3 Å²	72.3	30%	0.299	41%	0.405	S	S	.	.	S	Bend	trans	-123.4	-81	-174.5	-73.5	179.6	-20	0	0	112.2	C197	Q172-C197 HydrophobicContact CG-CB 4.11Å; Q172-C197 PolarHBondContact OE1-SG 3.34Å
173	K	86.3	Confident	83.8	Confident	113 Å²	113	69 Å²	69	49%	0.491	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.2	-179.1	-71.8	171	171.8	158.7	0	110.9	C183 F184 D186	K173-C183 CarbonylContact O-C 3.38Å; K173-C183 VanDerWaalsContact O-CA 3.27Å; K173-C183 WeakPolarHBondContact O-CA 3.42Å; K173-F184 HydrophobicContact CB-CB 4.15Å; K173-F184 WeakPolarHBondContact CB-O 3.4Å; K173-F184 PolarHBondContact N-O 3.21Å; K173-F184 VanDerWaalsContact N-O 3.1Å; K173-F184 PolarHBondContact O-N 3.45Å; K173-D186 WeakPolarHBondContact CE-OD1 3.29Å; K173-D186 IonicContact NZ-OD1 3.32Å; K173-D186 PolarHBondContact NZ-OD1 2.77Å
174	C	88.5	Confident	83.8	Confident	44 Å²	44	73.1 Å²	73.1	30%	0.297	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.1	175.6	-174.6	0	0	0	0	109.2	C161 C170	C161-C174 WeakPolarHBondContact CA-SG 3.35Å; C161-C174 HydrophobicContact CB-CB 3.67Å; C161-C174 WeakPolarHBondContact CB-SG 3.44Å; C161-C174 WeakPolarHBondContact SG-CB 3.4Å; C161-C174 CovalentContact SG-SG 2.03Å; C161-C174 PolarHBondContact SG-SG 2.89Å; C170-C174 HydrophobicContact CB-CB 4Å; C170-C174 VanDerWaalsContact SG-CB 3.57Å
175	H	88.5	Confident	84.2	Confident	109 Å²	109	69.4 Å²	69.4	51%	0.505	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118.2	172.8	-173.6	55.2	0	0	0	109.6	C161 H182 F184	C161-H175 VanDerWaalsContact SG-C 3.58Å; C161-H175 PolarHBondContact SG-N 2.82Å; C161-H175 VanDerWaalsContact SG-N 3.42Å; H175-H182 PolarHBondContact N-O 3.02Å; H175-H182 PolarHBondContact O-N 3.26Å; H175-F184 HydrophobicContact CB-CD2 4.03Å; H175-F184 HydrophobicContact CB-CE2 3.58Å
176	N	86.7	Confident	84.5	Confident	39 Å²	39	64.7 Å²	64.7	21%	0.209	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	137.6	177.5	-175	40.2	0	0	0	111.1	D157 I158 D159 E160 C161 S180	D157-N176 PolarHBondContact OD2-ND2 3.03Å; I158-N176 PolarHBondContact O-OD1 3.22Å; D159-N176 WeakPolarHBondContact CA-ND2 3.35Å; D159-N176 WeakPolarHBondContact OD1-CB 3.39Å; E160-N176 PolarHBondContact OE2-OD1 2.89Å; C161-N176 PolarHBondContact SG-N 2.68Å; C161-N176 VanDerWaalsContact SG-N 3.39Å; N176-S180 PolarHBondContact OD1-O 2.83Å
177	I	88.6	Confident	84.8	Confident	49 Å²	49	69.2 Å²	69.2	25%	0.251	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.5	174.2	57.5	164.4	0	0	0	109.6	G179 S180 H182	I177-G179 PolarHBondContact O-N 3.42Å; I177-S180 CarbonylContact C-O 3.08Å; I177-S180 WeakPolarHBondContact CA-O 3.49Å; I177-S180 WeakPolarHBondContact CG1-O 3.43Å; I177-S180 PolarHBondContact N-O 3.46Å; I177-S180 CarbonylContact O-C 3.46Å; I177-S180 PolarHBondContact O-N 2.89Å; I177-H182 VanDerWaalsContact CD1-CD2 3.44Å; I177-H182 WeakPolarHBondContact CD1-CD2 3.35Å; I177-H182 WeakPolarHBondContact CD1-NE2 3.44Å
178	P	85.6	Confident	84.9	Confident	106 Å²	106	64.7 Å²	64.7	69%	0.688	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	112.7	-178.8	-28.2	36	0	0	0	113.4	W149	W149-P178 HydrophobicContact CH2-CB 4.13Å; W149-P178 HydrophobicContact CZ2-CB 4.09Å
179	G	83.2	Confident	85.3	Confident	24 Å²	24	66.6 Å²	66.6	25%	0.247	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	7.7	-179.9	0	0	0	0	0	116.7	W149 D157 I177	W149-G179 VanDerWaalsContact NE1-CA 3.29Å; D157-G179 PolarHBondContact OD1-N 3.04Å; I177-G179 PolarHBondContact O-N 3.42Å
180	S	86.3	Confident	85.6	Confident	50 Å²	50	66.3 Å²	66.3	35%	0.35	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	177.7	-179.9	-175.2	0	0	0	0	111.9	N176 I177	N176-S180 PolarHBondContact OD1-O 2.83Å; I177-S180 CarbonylContact C-O 3.08Å; I177-S180 WeakPolarHBondContact CA-O 3.49Å; I177-S180 WeakPolarHBondContact CG1-O 3.43Å; I177-S180 PolarHBondContact N-O 3.46Å; I177-S180 CarbonylContact O-C 3.46Å; I177-S180 PolarHBondContact O-N 2.89Å
181	F	87.1	Confident	85.7	Confident	53 Å²	53	68.1 Å²	68.1	23%	0.232	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	164.4	168.7	62.3	-83.3	0	0	0	112.4	E160 A168 I195	E160-F181 HydrophobicContact CB-CB 4.25Å; E160-F181 HydrophobicContact CB-CD1 3.69Å; E160-F181 HydrophobicContact CB-CE1 4.37Å; E160-F181 HydrophobicContact CB-CG 4.14Å; E160-F181 HydrophobicContact CG-CD1 3.81Å; E160-F181 HydrophobicContact CG-CE1 4.39Å; A168-F181 HydrophobicContact CB-CB 4.45Å; A168-F181 HydrophobicContact CB-CD1 4.04Å; A168-F181 HydrophobicContact CB-CD2 3.47Å; A168-F181 VanDerWaalsContact CB-CD2 3.47Å; A168-F181 HydrophobicContact CB-CE1 4.12Å; A168-F181 HydrophobicContact CB-CE2 3.55Å; A168-F181 HydrophobicContact CB-CG 3.72Å; A168-F181 HydrophobicContact CB-CZ 3.88Å; F181-I195 HydrophobicContact CE2-CG1 4.48Å
182	H	85.3	Confident	85.6	Confident	99 Å²	99	67.2 Å²	67.2	46%	0.458	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.3	166.8	-78.5	-57.4	0	0	0	110.5	H175 I177 F184	H175-H182 PolarHBondContact N-O 3.02Å; H175-H182 PolarHBondContact O-N 3.26Å; I177-H182 VanDerWaalsContact CD1-CD2 3.44Å; I177-H182 WeakPolarHBondContact CD1-CD2 3.35Å; I177-H182 WeakPolarHBondContact CD1-NE2 3.44Å; H182-F184 HydrophobicContact CB-CE2 3.98Å; H182-F184 HydrophobicContact CB-CZ 4.01Å
183	C	86.4	Confident	85.4	Confident	15 Å²	15	70.2 Å²	70.2	10%	0.101	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138.9	167.3	-50.5	0	0	0	0	110	C170 K173 K194	C170-C183 VanDerWaalsContact CA-SG 3.56Å; C170-C183 HydrophobicContact CB-CB 3.72Å; C170-C183 WeakPolarHBondContact CB-SG 3.45Å; C170-C183 VanDerWaalsContact SG-CA 3.59Å; C170-C183 WeakPolarHBondContact SG-CB 3.46Å; C170-C183 CovalentContact SG-SG 2.02Å; C170-C183 PolarHBondContact SG-SG 3.15Å; K173-C183 CarbonylContact O-C 3.38Å; K173-C183 VanDerWaalsContact O-CA 3.27Å; K173-C183 WeakPolarHBondContact O-CA 3.42Å; C183-K194 WeakPolarHBondContact CB-O 3.38Å
184	F	84.3	Confident	84.9	Confident	108 Å²	108	73 Å²	73	47%	0.474	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.2	172.6	-62.5	-77.1	0	0	0	109.7	K173 H175 H182	K173-F184 HydrophobicContact CB-CB 4.15Å; K173-F184 WeakPolarHBondContact CB-O 3.4Å; K173-F184 PolarHBondContact N-O 3.21Å; K173-F184 VanDerWaalsContact N-O 3.1Å; K173-F184 PolarHBondContact O-N 3.45Å; H175-F184 HydrophobicContact CB-CD2 4.03Å; H175-F184 HydrophobicContact CB-CE2 3.58Å; H182-F184 HydrophobicContact CB-CE2 3.98Å; H182-F184 HydrophobicContact CB-CZ 4.01Å
185	C	87.5	Confident	84.4	Confident	32 Å²	32	73.8 Å²	73.8	22%	0.216	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-101.4	150.5	173.2	-54.3	0	0	0	0	110.1	F189 T191 C197	C185-F189 HydrophobicContact CB-CB 3.69Å; C185-T191 PolarHBondContact SG-OG1 2.83Å; C185-C197 WeakPolarHBondContact CA-SG 3.45Å; C185-C197 HydrophobicContact CB-CB 3.74Å; C185-C197 WeakPolarHBondContact CB-SG 3.27Å; C185-C197 WeakPolarHBondContact SG-CA 3.47Å; C185-C197 WeakPolarHBondContact SG-CB 3.35Å; C185-C197 CovalentContact SG-SG 2.04Å; C185-C197 PolarHBondContact SG-SG 2.9Å
186	D	86.9	Confident	84.1	Confident	60 Å²	60	71.7 Å²	71.7	32%	0.321	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-64.3	161	168.9	-71	-42.7	0	0	0	110.7	K173 G188 F189	K173-D186 WeakPolarHBondContact CE-OD1 3.29Å; K173-D186 IonicContact NZ-OD1 3.32Å; K173-D186 PolarHBondContact NZ-OD1 2.77Å; D186-G188 PolarHBondContact O-N 3.29Å; D186-F189 HydrophobicContact CB-CD2 4.16Å; D186-F189 WeakPolarHBondContact O-CB 3.3Å; D186-F189 PolarHBondContact O-N 2.6Å; D186-F189 VanDerWaalsContact O-N 3.09Å
187	E	84.9	Confident	84.1	Confident	187 Å²	187	70.6 Å²	70.6	87%	0.874	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	138.5	175.1	-68	-174.5	169.8	0	0	110.3
188	G	83.8	Confident	84	Confident	23 Å²	23	72.1 Å²	72.1	24%	0.237	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-0.8	-173.4	0	0	0	0	0	115.1	D186 V200	D186-G188 PolarHBondContact O-N 3.29Å; G188-V200 VanDerWaalsContact O-CB 3.3Å; G188-V200 WeakPolarHBondContact O-CB 3.43Å; G188-V200 WeakPolarHBondContact O-CG2 3.39Å; G188-V200 PolarHBondContact O-N 2.8Å
189	F	88	Confident	84.2	Confident	51 Å²	51	69.2 Å²	69.2	22%	0.224	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144	177.5	-66	-97.7	0	0	0	112.3	C185 D186 C197 I198 D199 P220	C185-F189 HydrophobicContact CB-CB 3.69Å; D186-F189 HydrophobicContact CB-CD2 4.16Å; D186-F189 WeakPolarHBondContact O-CB 3.3Å; D186-F189 PolarHBondContact O-N 2.6Å; D186-F189 VanDerWaalsContact O-N 3.09Å; F189-C197 HydrophobicContact CB-CB 4.23Å; F189-I198 CarbonylContact C-O 3.3Å; F189-I198 VanDerWaalsContact CA-O 3.23Å; F189-I198 WeakPolarHBondContact CA-O 3.05Å; F189-I198 WeakPolarHBondContact CB-O 3.42Å; F189-D199 HydrophobicContact CD1-CB 4.15Å; F189-D199 HydrophobicContact CE1-CB 3.89Å; F189-P220 HydrophobicContact CZ-CB 4.17Å
190	A	84.9	Confident	84.6	Confident	42 Å²	42	69.9 Å²	69.9	35%	0.347	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.8	176.7	0	0	0	0	0	111.3	I198 V200	A190-I198 PolarHBondContact N-O 3.13Å; A190-I198 WeakPolarHBondContact O-CG1 3.4Å; A190-I198 PolarHBondContact O-N 3.36Å; A190-V200 HydrophobicContact CB-CG2 3.6Å
191	T	82	Confident	84.8	Confident	67 Å²	67	70.4 Å²	70.4	41%	0.411	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.6	177.7	-114.7	0	0	0	0	110.8	C185 N196	C185-T191 PolarHBondContact SG-OG1 2.83Å; T191-N196 CarbonylContact C-O 3.58Å; T191-N196 VanDerWaalsContact CA-O 3.3Å; T191-N196 WeakPolarHBondContact CA-O 3.48Å
192	I	78.9	Confident	85	Confident	76 Å²	76	69 Å²	69	39%	0.39	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124	165.2	-68.1	-178.8	0	0	0	106.3	K194 N196 I198	I192-K194 PolarHBondContact O-N 2.93Å; I192-N196 PolarHBondContact N-O 3.06Å; I192-N196 WeakPolarHBondContact O-CB 3.28Å; I192-N196 PolarHBondContact O-N 2.93Å; I192-I198 HydrophobicContact CD1-CB 4.33Å; I192-I198 HydrophobicContact CD1-CD1 3.22Å; I192-I198 HydrophobicContact CD1-CG1 3.49Å; I192-I198 VanDerWaalsContact CD1-CG1 3.49Å; I192-I198 HydrophobicContact CD1-CG2 3.94Å; I192-I198 HydrophobicContact CG1-CD1 4.04Å; I192-I198 HydrophobicContact CG1-CG1 3.84Å; I192-I198 HydrophobicContact CG1-CG2 4.48Å
193	D	78.8	Confident	85.2	Confident	127 Å²	127	65.5 Å²	65.5	68%	0.679	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	28.7	179.1	-49	-36	0	0	0	116.3	I195	D193-I195 PolarHBondContact O-N 2.96Å
194	K	76.2	Confident	85.4	Confident	173 Å²	173	70 Å²	70	75%	0.752	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-2.9	177.5	-57.2	-179.8	179.2	179.4	0	116.2	C183 I192	C183-K194 WeakPolarHBondContact CB-O 3.38Å; I192-K194 PolarHBondContact O-N 2.93Å
195	I	78.7	Confident	85.6	Confident	59 Å²	59	69.9 Å²	69.9	30%	0.303	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-38.9	-173.8	-59.7	174.9	0	0	0	111.3	G169 N171 F181 D193	G169-I195 WeakPolarHBondContact O-CG2 3.45Å; N171-I195 PolarHBondContact N-O 2.92Å; F181-I195 HydrophobicContact CE2-CG1 4.48Å; D193-I195 PolarHBondContact O-N 2.96Å
196	N	81.9	Confident	85.6	Confident	65 Å²	65	74.9 Å²	74.9	35%	0.348	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	130.2	-175.5	-64.3	-60.6	0	0	0	111.6	N171 T191 I192	N171-N196 WeakPolarHBondContact ND2-CA 3.36Å; N171-N196 PolarHBondContact ND2-OD1 3.07Å; T191-N196 CarbonylContact C-O 3.58Å; T191-N196 VanDerWaalsContact CA-O 3.3Å; T191-N196 WeakPolarHBondContact CA-O 3.48Å; I192-N196 PolarHBondContact N-O 3.06Å; I192-N196 WeakPolarHBondContact O-CB 3.28Å; I192-N196 PolarHBondContact O-N 2.93Å
197	C	86.3	Confident	85.4	Confident	17 Å²	17	77.2 Å²	77.2	12%	0.115	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.3	170.9	-63	0	0	0	0	109.6	Q172 C185 F189	Q172-C197 HydrophobicContact CG-CB 4.11Å; Q172-C197 PolarHBondContact OE1-SG 3.34Å; C185-C197 WeakPolarHBondContact CA-SG 3.45Å; C185-C197 HydrophobicContact CB-CB 3.74Å; C185-C197 WeakPolarHBondContact CB-SG 3.27Å; C185-C197 WeakPolarHBondContact SG-CA 3.47Å; C185-C197 WeakPolarHBondContact SG-CB 3.35Å; C185-C197 CovalentContact SG-SG 2.04Å; C185-C197 PolarHBondContact SG-SG 2.9Å; F189-C197 HydrophobicContact CB-CB 4.23Å
198	I	87.4	Confident	85.4	Confident	81 Å²	81	73.5 Å²	73.5	42%	0.415	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	147.7	170.7	63.8	145.1	0	0	0	110.1	F189 A190 I192 V200	F189-I198 CarbonylContact C-O 3.3Å; F189-I198 VanDerWaalsContact CA-O 3.23Å; F189-I198 WeakPolarHBondContact CA-O 3.05Å; F189-I198 WeakPolarHBondContact CB-O 3.42Å; A190-I198 PolarHBondContact N-O 3.13Å; A190-I198 WeakPolarHBondContact O-CG1 3.4Å; A190-I198 PolarHBondContact O-N 3.36Å; I192-I198 HydrophobicContact CD1-CB 4.33Å; I192-I198 HydrophobicContact CD1-CD1 3.22Å; I192-I198 HydrophobicContact CD1-CG1 3.49Å; I192-I198 VanDerWaalsContact CD1-CG1 3.49Å; I192-I198 HydrophobicContact CD1-CG2 3.94Å; I192-I198 HydrophobicContact CG1-CD1 4.04Å; I192-I198 HydrophobicContact CG1-CG1 3.84Å; I192-I198 HydrophobicContact CG1-CG2 4.48Å; I198-V200 PolarHBondContact O-N 3.05Å
199	D	89.8	Confident	85.5	Confident	44 Å²	44	74.1 Å²	74.1	24%	0.235	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	131.6	176.3	-176.1	54.9	0	0	0	110.9	F189 N201 N218 P220 G221	F189-D199 HydrophobicContact CD1-CB 4.15Å; F189-D199 HydrophobicContact CE1-CB 3.89Å; D199-N201 PolarHBondContact O-N 3.11Å; D199-N218 PolarHBondContact OD2-ND2 2.79Å; D199-P220 WeakPolarHBondContact OD1-CA 3.32Å; D199-G221 PolarHBondContact OD1-N 3.28Å
200	V	90.9	Very high	85.5	Confident	38 Å²	38	72.2 Å²	72.2	23%	0.23	40%	0.396	C	S	.	.			trans	-83.1	115.7	175.8	177	0	0	0	0	107.7	G188 A190 I198 E202	G188-V200 VanDerWaalsContact O-CB 3.3Å; G188-V200 WeakPolarHBondContact O-CB 3.43Å; G188-V200 WeakPolarHBondContact O-CG2 3.39Å; G188-V200 PolarHBondContact O-N 2.8Å; A190-V200 HydrophobicContact CB-CG2 3.6Å; I198-V200 PolarHBondContact O-N 3.05Å; V200-E202 PolarHBondContact O-N 2.86Å
201	N	90.1	Very high	85.6	Confident	61 Å²	61	74.9 Å²	74.9	33%	0.326	40%	0.401	S	S	.	.			trans	-78.6	93.1	176.8	-169.9	-31.2	0	0	0	111.1	D199 C203 V204 L205 N218	D199-N201 PolarHBondContact O-N 3.11Å; N201-C203 PolarHBondContact O-N 2.86Å; N201-C203 VanDerWaalsContact OD1-CB 3.28Å; N201-C203 WeakPolarHBondContact OD1-CB 3.24Å; N201-C203 PolarHBondContact OD1-N 3.38Å; N201-C203 VanDerWaalsContact OD1-N 3.16Å; N201-V204 HydrophobicContact CB-CB 4.37Å; N201-V204 HydrophobicContact CB-CG2 4.27Å; N201-V204 PolarHBondContact O-N 3.02Å; N201-V204 VanDerWaalsContact O-N 3.12Å; N201-V204 PolarHBondContact OD1-N 2.77Å; N201-L205 PolarHBondContact O-N 2.92Å; N201-L205 VanDerWaalsContact O-N 3.08Å; N201-N218 WeakPolarHBondContact CA-OD1 3.14Å
202	E	91.6	Very high	85.6	Confident	23 Å²	23	80.8 Å²	80.8	11%	0.107	43%	0.425	C	S	.	.	H	α-helix	trans	-65.6	-25.9	-178.8	-57.2	89.1	169.1	0	0	112.3	V200 V204 L205 Y206 I209 N218 Y223	V200-E202 PolarHBondContact O-N 2.86Å; E202-V204 VanDerWaalsContact C-N 3.25Å; E202-V204 PolarHBondContact O-N 3.34Å; E202-L205 PolarHBondContact O-N 3.47Å; E202-Y206 HydrophobicContact CB-CD2 4.32Å; E202-Y206 WeakPolarHBondContact O-CA 3.31Å; E202-Y206 PolarHBondContact O-N 3.34Å; E202-I209 HydrophobicContact CB-CD1 4.04Å; E202-N218 PolarHBondContact OE2-OD1 3.25Å; E202-Y223 HydrophobicContact CB-CD1 3.84Å; E202-Y223 HydrophobicContact CB-CG 4.24Å; E202-Y223 HydrophobicContact CG-CD1 4.03Å
203	C	90.7	Very high	86	Confident	27 Å²	27	81.1 Å²	81.1	18%	0.182	43%	0.432	C	S	.	.	H	α-helix	trans	-65.3	-29.8	175.8	-55.2	0	0	0	0	112.6	N201 C216 V217 N218	N201-C203 PolarHBondContact O-N 2.86Å; N201-C203 VanDerWaalsContact OD1-CB 3.28Å; N201-C203 WeakPolarHBondContact OD1-CB 3.24Å; N201-C203 PolarHBondContact OD1-N 3.38Å; N201-C203 VanDerWaalsContact OD1-N 3.16Å; C203-C216 WeakPolarHBondContact CA-SG 3.36Å; C203-C216 HydrophobicContact CB-CB 3.65Å; C203-C216 WeakPolarHBondContact CB-SG 3.2Å; C203-C216 WeakPolarHBondContact SG-CB 3.47Å; C203-C216 CovalentContact SG-SG 2.03Å; C203-C216 PolarHBondContact SG-SG 3.4Å; C203-V217 VanDerWaalsContact SG-C 3.6Å; C203-N218 PolarHBondContact SG-N 2.91Å
204	V	89.3	Confident	86.5	Confident	110 Å²	110	75.5 Å²	75.5	67%	0.667	40%	0.403	S	S	*	.	H	α-helix	trans	-84.7	-39.4	174.8	176	0	0	0	0	110.6	N201 E202	N201-V204 HydrophobicContact CB-CB 4.37Å; N201-V204 HydrophobicContact CB-CG2 4.27Å; N201-V204 PolarHBondContact O-N 3.02Å; N201-V204 VanDerWaalsContact O-N 3.12Å; N201-V204 PolarHBondContact OD1-N 2.77Å; E202-V204 VanDerWaalsContact C-N 3.25Å; E202-V204 PolarHBondContact O-N 3.34Å
205	L	88.5	Confident	87.3	Confident	104 Å²	104	74.6 Å²	74.6	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-69.6	-36.9	-177.5	-149.8	94.2	0	0	0	112.2	N201 E202	N201-L205 PolarHBondContact O-N 2.92Å; N201-L205 VanDerWaalsContact O-N 3.08Å; E202-L205 PolarHBondContact O-N 3.47Å
206	Y	88.6	Confident	87.9	Confident	138 Å²	138	73.1 Å²	73.1	54%	0.541	39%	0.393	S	S	.	.			trans	-129	81.7	-178.3	-55.6	-63.2	0	0	0	110.3	E202 S208 I209	E202-Y206 HydrophobicContact CB-CD2 4.32Å; E202-Y206 WeakPolarHBondContact O-CA 3.31Å; E202-Y206 PolarHBondContact O-N 3.34Å; Y206-S208 PolarHBondContact O-N 2.89Å; Y206-I209 HydrophobicContact CD2-CD1 4.06Å; Y206-I209 VanDerWaalsContact O-CB 3.23Å; Y206-I209 WeakPolarHBondContact O-CB 3.24Å; Y206-I209 VanDerWaalsContact O-CG2 3.25Å; Y206-I209 WeakPolarHBondContact O-CG2 3.01Å; Y206-I209 PolarHBondContact O-N 2.68Å
207	P	82.1	Confident	88.4	Confident	109 Å²	109	72 Å²	72	71%	0.708	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.2	-176	-27.3	35.7	0	0	0	115.2
208	S	84.1	Confident	88.7	Confident	109 Å²	109	73.4 Å²	73.4	76%	0.762	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	19.1	178.9	-50.8	0	0	0	0	113.4	Y206 C210	Y206-S208 PolarHBondContact O-N 2.89Å; S208-C210 VanDerWaalsContact C-N 3.28Å; S208-C210 PolarHBondContact O-N 2.87Å
209	I	86.4	Confident	88.8	Confident	35 Å²	35	71.1 Å²	71.1	18%	0.179	39%	0.385	C	S	.	.	S	Bend	trans	-67.2	-30.3	-179.2	-160.1	165.5	0	0	0	112.7	E202 Y206 C216 Y223	E202-I209 HydrophobicContact CB-CD1 4.04Å; Y206-I209 HydrophobicContact CD2-CD1 4.06Å; Y206-I209 VanDerWaalsContact O-CB 3.23Å; Y206-I209 WeakPolarHBondContact O-CB 3.24Å; Y206-I209 VanDerWaalsContact O-CG2 3.25Å; Y206-I209 WeakPolarHBondContact O-CG2 3.01Å; Y206-I209 PolarHBondContact O-N 2.68Å; I209-C216 HydrophobicContact CG2-CB 4.18Å; I209-C216 VanDerWaalsContact CG2-SG 3.51Å; I209-Y223 HydrophobicContact CB-CE2 4.47Å; I209-Y223 HydrophobicContact CD1-CD1 3.79Å; I209-Y223 HydrophobicContact CD1-CD2 4.08Å; I209-Y223 HydrophobicContact CD1-CE1 3.31Å; I209-Y223 HydrophobicContact CD1-CE2 3.63Å; I209-Y223 HydrophobicContact CD1-CG 4.16Å; I209-Y223 HydrophobicContact CG1-CD2 4.31Å; I209-Y223 HydrophobicContact CG1-CE1 4.14Å; I209-Y223 HydrophobicContact CG1-CE2 3.59Å; I209-Y223 VanDerWaalsContact CG1-CZ 3.5Å; I209-Y223 HydrophobicContact CG2-CD2 4.17Å; I209-Y223 HydrophobicContact CG2-CE2 4.17Å
210	C	87.7	Confident	88.8	Confident	11 Å²	11	74.3 Å²	74.3	7%	0.074	41%	0.408	C	S	.	.	S	Bend	trans	-111.9	125.1	168.5	-52.1	0	0	0	0	108.6	S208 A214 C216 C225	S208-C210 VanDerWaalsContact C-N 3.28Å; S208-C210 PolarHBondContact O-N 2.87Å; C210-A214 HydrophobicContact CB-CB 4.03Å; C210-C216 HydrophobicContact CB-CB 4.33Å; C210-C216 VanDerWaalsContact SG-CA 3.57Å; C210-C216 WeakPolarHBondContact SG-CB 3.48Å; C210-C225 HydrophobicContact CB-CB 3.84Å; C210-C225 WeakPolarHBondContact CB-SG 3.37Å; C210-C225 WeakPolarHBondContact SG-CA 3.19Å; C210-C225 WeakPolarHBondContact SG-CB 3.33Å; C210-C225 CovalentContact SG-SG 2.03Å; C210-C225 PolarHBondContact SG-SG 3.36Å
211	E	86.6	Confident	88.6	Confident	98 Å²	98	73.4 Å²	73.4	46%	0.458	41%	0.407	S	S	.	.			trans	-74.5	145.2	173.9	-64.2	-173.3	-167.2	0	0	110.6	A214 R238	E211-A214 WeakPolarHBondContact O-CB 3.41Å; E211-A214 PolarHBondContact O-N 2.72Å; E211-R238 HydrophobicContact CG-CB 4.37Å
212	Q	82.4	Confident	88.7	Confident	192 Å²	192	75.5 Å²	75.5	90%	0.897	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	136.5	176.3	-65.9	-171.2	2.6	0	0	109.7
213	P	87.5	Confident	88.6	Confident	83 Å²	83	77.5 Å²	77.5	54%	0.539	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.8	8.3	17.8	36.6	-36.9	0	0	0	116.2	P228 C240	P213-P228 HydrophobicContact CB-CG 3.94Å; P213-P228 HydrophobicContact CG-CG 4.1Å; P213-C240 HydrophobicContact CG-CB 4.15Å
214	A	90.3	Very high	88.6	Confident	9 Å²	9	80 Å²	80	7%	0.074	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-69.7	138.1	179.4	0	0	0	0	0	112	C210 E211 C225 R226 Y233	C210-A214 HydrophobicContact CB-CB 4.03Å; E211-A214 WeakPolarHBondContact O-CB 3.41Å; E211-A214 PolarHBondContact O-N 2.72Å; A214-C225 HydrophobicContact CB-CB 4.18Å; A214-R226 CarbonylContact C-O 3.57Å; A214-R226 WeakPolarHBondContact CA-O 3.37Å; A214-Y233 HydrophobicContact CB-CD2 3.74Å; A214-Y233 HydrophobicContact CB-CE2 3.86Å
215	K	91.5	Very high	88.8	Confident	154 Å²	154	75.1 Å²	75.1	67%	0.67	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.5	173.4	-173.9	176.3	179.8	-179.7	0	109.8	V217 R226	K215-V217 PolarHBondContact O-N 2.75Å; K215-R226 PolarHBondContact N-O 2.96Å; K215-R226 PolarHBondContact O-N 2.79Å
216	C	91.9	Very high	88.9	Confident	28 Å²	28	76.3 Å²	76.3	19%	0.189	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	127.9	172.1	-168.7	0	0	0	0	110.2	C203 I209 C210	C203-C216 WeakPolarHBondContact CA-SG 3.36Å; C203-C216 HydrophobicContact CB-CB 3.65Å; C203-C216 WeakPolarHBondContact CB-SG 3.2Å; C203-C216 WeakPolarHBondContact SG-CB 3.47Å; C203-C216 CovalentContact SG-SG 2.03Å; C203-C216 PolarHBondContact SG-SG 3.4Å; I209-C216 HydrophobicContact CG2-CB 4.18Å; I209-C216 VanDerWaalsContact CG2-SG 3.51Å; C210-C216 HydrophobicContact CB-CB 4.33Å; C210-C216 VanDerWaalsContact SG-CA 3.57Å; C210-C216 WeakPolarHBondContact SG-CB 3.48Å
217	V	92.7	Very high	89.1	Confident	40 Å²	40	71 Å²	71	24%	0.242	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120	173.5	-179.5	0	0	0	0	107.8	C203 K215 E224 R226	C203-V217 VanDerWaalsContact SG-C 3.6Å; K215-V217 PolarHBondContact O-N 2.75Å; V217-E224 PolarHBondContact N-O 2.89Å; V217-E224 PolarHBondContact O-N 3.4Å; V217-R226 HydrophobicContact CB-CG 4.49Å; V217-R226 HydrophobicContact CG2-CB 4.4Å; V217-R226 HydrophobicContact CG2-CG 3.98Å
218	N	91.9	Very high	89.5	Confident	47 Å²	47	68.5 Å²	68.5	25%	0.251	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136	177.8	-170.1	51.9	0	0	0	110.6	D199 N201 E202 C203	D199-N218 PolarHBondContact OD2-ND2 2.79Å; N201-N218 WeakPolarHBondContact CA-OD1 3.14Å; E202-N218 PolarHBondContact OE2-OD1 3.25Å; C203-N218 PolarHBondContact SG-N 2.91Å
219	T	90.6	Very high	89.8	Confident	34 Å²	34	71.3 Å²	71.3	21%	0.209	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.6	178.1	52.4	0	0	0	0	109.5	G221 M222	T219-G221 PolarHBondContact O-N 3.26Å; T219-M222 CarbonylContact C-O 3.52Å; T219-M222 VanDerWaalsContact C-O 3.27Å; T219-M222 WeakPolarHBondContact CA-O 3.31Å; T219-M222 PolarHBondContact N-O 3.38Å; T219-M222 CarbonylContact O-C 3.5Å; T219-M222 PolarHBondContact O-N 2.75Å; T219-M222 VanDerWaalsContact O-N 3.13Å; T219-M222 VanDerWaalsContact OG1-CG 3.23Å; T219-M222 WeakPolarHBondContact OG1-CG 3.47Å; T219-M222 PolarHBondContact OG1-O 2.87Å
220	P	89.7	Confident	89.8	Confident	110 Å²	110	70.6 Å²	70.6	71%	0.714	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	115.1	-178.4	-25	35.3	0	0	0	112.7	F189 D199	F189-P220 HydrophobicContact CZ-CB 4.17Å; D199-P220 WeakPolarHBondContact OD1-CA 3.32Å
221	G	86.9	Confident	89.9	Confident	20 Å²	20	72.8 Å²	72.8	21%	0.206	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	0.7	178.8	0	0	0	0	0	115.9	D199 T219	D199-G221 PolarHBondContact OD1-N 3.28Å; T219-G221 PolarHBondContact O-N 3.26Å
222	M	90.8	Very high	90.2	Very high	104 Å²	104	75.4 Å²	75.4	51%	0.512	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	179.4	179	66.1	174.4	-78.6	0	0	112.4	T219	T219-M222 CarbonylContact C-O 3.52Å; T219-M222 VanDerWaalsContact C-O 3.27Å; T219-M222 WeakPolarHBondContact CA-O 3.31Å; T219-M222 PolarHBondContact N-O 3.38Å; T219-M222 CarbonylContact O-C 3.5Å; T219-M222 PolarHBondContact O-N 2.75Å; T219-M222 VanDerWaalsContact O-N 3.13Å; T219-M222 VanDerWaalsContact OG1-CG 3.23Å; T219-M222 WeakPolarHBondContact OG1-CG 3.47Å; T219-M222 PolarHBondContact OG1-O 2.87Å
223	Y	91.1	Very high	90.6	Very high	65 Å²	65	67.5 Å²	67.5	26%	0.255	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.2	171.5	68.6	-77.7	0	0	0	111.8	E202 I209	E202-Y223 HydrophobicContact CB-CD1 3.84Å; E202-Y223 HydrophobicContact CB-CG 4.24Å; E202-Y223 HydrophobicContact CG-CD1 4.03Å; I209-Y223 HydrophobicContact CB-CE2 4.47Å; I209-Y223 HydrophobicContact CD1-CD1 3.79Å; I209-Y223 HydrophobicContact CD1-CD2 4.08Å; I209-Y223 HydrophobicContact CD1-CE1 3.31Å; I209-Y223 HydrophobicContact CD1-CE2 3.63Å; I209-Y223 HydrophobicContact CD1-CG 4.16Å; I209-Y223 HydrophobicContact CG1-CD2 4.31Å; I209-Y223 HydrophobicContact CG1-CE1 4.14Å; I209-Y223 HydrophobicContact CG1-CE2 3.59Å; I209-Y223 VanDerWaalsContact CG1-CZ 3.5Å; I209-Y223 HydrophobicContact CG2-CD2 4.17Å; I209-Y223 HydrophobicContact CG2-CE2 4.17Å
224	E	90.7	Very high	90.7	Very high	81 Å²	81	66 Å²	66	38%	0.379	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.8	172.6	-172.5	-175.2	-164.2	0	0	109.8	V217 R226	V217-E224 PolarHBondContact N-O 2.89Å; V217-E224 PolarHBondContact O-N 3.4Å; E224-R226 HydrophobicContact CG-CG 4.15Å; E224-R226 IonicContact OE2-CZ 3.21Å; E224-R226 IonicContact OE2-NE 3.55Å; E224-R226 PolarHBondContact OE2-NE 2.79Å; E224-R226 IonicContact OE2-NH2 3.71Å; E224-R226 PolarHBondContact OE2-NH2 3.38Å
225	C	91.9	Very high	90.5	Very high	6 Å²	6	71.9 Å²	71.9	4%	0.041	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.3	169	-64.2	0	0	0	0	109.4	C210 A214 Y233	C210-C225 HydrophobicContact CB-CB 3.84Å; C210-C225 WeakPolarHBondContact CB-SG 3.37Å; C210-C225 WeakPolarHBondContact SG-CA 3.19Å; C210-C225 WeakPolarHBondContact SG-CB 3.33Å; C210-C225 CovalentContact SG-SG 2.03Å; C210-C225 PolarHBondContact SG-SG 3.36Å; A214-C225 HydrophobicContact CB-CB 4.18Å; C225-Y233 HydrophobicContact CB-CD1 3.54Å; C225-Y233 HydrophobicContact CB-CD2 3.74Å; C225-Y233 HydrophobicContact CB-CE1 3.65Å; C225-Y233 HydrophobicContact CB-CE2 3.87Å; C225-Y233 HydrophobicContact CB-CG 3.57Å; C225-Y233 WeakPolarHBondContact O-CB 3.39Å
226	R	92.4	Very high	90.2	Very high	130 Å²	130	71 Å²	71	49%	0.491	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	117.1	178.7	-65.2	-164.8	-179	169.1	-0	111.3	A214 K215 V217 E224	A214-R226 CarbonylContact C-O 3.57Å; A214-R226 WeakPolarHBondContact CA-O 3.37Å; K215-R226 PolarHBondContact N-O 2.96Å; K215-R226 PolarHBondContact O-N 2.79Å; V217-R226 HydrophobicContact CB-CG 4.49Å; V217-R226 HydrophobicContact CG2-CB 4.4Å; V217-R226 HydrophobicContact CG2-CG 3.98Å; E224-R226 HydrophobicContact CG-CG 4.15Å; E224-R226 IonicContact OE2-CZ 3.21Å; E224-R226 IonicContact OE2-NE 3.55Å; E224-R226 PolarHBondContact OE2-NE 2.79Å; E224-R226 IonicContact OE2-NH2 3.71Å; E224-R226 PolarHBondContact OE2-NH2 3.38Å
227	C	92.6	Very high	90	Very high	27 Å²	27	72.3 Å²	72.3	18%	0.182	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-76.9	163.4	173	-70	0	0	0	0	112.2	F231 Y233 C240	C227-F231 HydrophobicContact CB-CB 3.7Å; C227-Y233 VanDerWaalsContact SG-CA 3.52Å; C227-Y233 PolarHBondContact SG-N 3.43Å; C227-Y233 VanDerWaalsContact SG-N 3.45Å; C227-C240 VanDerWaalsContact CA-SG 3.59Å; C227-C240 HydrophobicContact CB-CB 3.81Å; C227-C240 WeakPolarHBondContact CB-SG 3.38Å; C227-C240 WeakPolarHBondContact SG-CA 3.21Å; C227-C240 WeakPolarHBondContact SG-CB 3.3Å; C227-C240 CovalentContact SG-SG 2.03Å; C227-C240 PolarHBondContact SG-SG 2.76Å
228	P	90.6	Very high	89.6	Confident	55 Å²	55	77.5 Å²	77.5	36%	0.357	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-54.2	160.6	165.6	-22.9	34.1	0	0	0	112.2	P213 F231	P213-P228 HydrophobicContact CB-CG 3.94Å; P213-P228 HydrophobicContact CG-CG 4.1Å; P228-F231 HydrophobicContact CB-CD2 4.13Å; P228-F231 PolarHBondContact O-N 3.07Å
229	L	88.7	Confident	89.4	Confident	169 Å²	169	78 Å²	78	89%	0.885	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	140.7	174.5	-67.8	170.9	0	0	0	110.7	F231	L229-F231 VanDerWaalsContact C-N 3.32Å; L229-F231 VanDerWaalsContact O-CD2 3.32Å; L229-F231 WeakPolarHBondContact O-CD2 3.11Å
230	G	87.2	Confident	89.4	Confident	19 Å²	19	77.3 Å²	77.3	20%	0.196	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	0.7	-175.9	0	0	0	0	0	114.7	V243	G230-V243 WeakPolarHBondContact O-CB 3.46Å; G230-V243 PolarHBondContact O-N 2.9Å
231	F	90.8	Very high	89.5	Confident	58 Å²	58	75 Å²	75	25%	0.254	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.5	-180	-62.6	-95	0	0	0	112.4	C227 P228 L229 C240 D241 D242 V259	C227-F231 HydrophobicContact CB-CB 3.7Å; P228-F231 HydrophobicContact CB-CD2 4.13Å; P228-F231 PolarHBondContact O-N 3.07Å; L229-F231 VanDerWaalsContact C-N 3.32Å; L229-F231 VanDerWaalsContact O-CD2 3.32Å; L229-F231 WeakPolarHBondContact O-CD2 3.11Å; F231-C240 HydrophobicContact CB-CB 3.97Å; F231-C240 HydrophobicContact CD1-CB 4.27Å; F231-C240 HydrophobicContact CG-CB 4.35Å; F231-D241 CarbonylContact C-O 3.43Å; F231-D241 VanDerWaalsContact CA-O 3.27Å; F231-D241 WeakPolarHBondContact CA-O 3.42Å; F231-D242 HydrophobicContact CD1-CB 4.42Å; F231-D242 HydrophobicContact CE1-CB 4.29Å; F231-V259 HydrophobicContact CE1-CG1 4.08Å; F231-V259 HydrophobicContact CZ-CG1 3.74Å
232	K	91.3	Very high	89.8	Confident	152 Å²	152	76.8 Å²	76.8	66%	0.661	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.7	175.8	-174.9	175.9	-179.6	-178.9	0	110.2	N234 D241 V243	K232-N234 PolarHBondContact O-N 3.16Å; K232-D241 PolarHBondContact N-O 3.39Å; K232-D241 PolarHBondContact O-N 3Å; K232-V243 HydrophobicContact CB-CG2 3.64Å
233	Y	90.9	Very high	89.8	Confident	26 Å²	26	74.4 Å²	74.4	10%	0.102	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.2	178.9	-167.7	-105.7	0	0	0	110.9	A214 C225 C227 F235 R238	A214-Y233 HydrophobicContact CB-CD2 3.74Å; A214-Y233 HydrophobicContact CB-CE2 3.86Å; C225-Y233 HydrophobicContact CB-CD1 3.54Å; C225-Y233 HydrophobicContact CB-CD2 3.74Å; C225-Y233 HydrophobicContact CB-CE1 3.65Å; C225-Y233 HydrophobicContact CB-CE2 3.87Å; C225-Y233 HydrophobicContact CB-CG 3.57Å; C225-Y233 WeakPolarHBondContact O-CB 3.39Å; C227-Y233 VanDerWaalsContact SG-CA 3.52Å; C227-Y233 PolarHBondContact SG-N 3.43Å; C227-Y233 VanDerWaalsContact SG-N 3.45Å; Y233-F235 AromaticContact CD1-CD1 3.93Å; Y233-F235 HydrophobicContact CD1-CD1 3.93Å; Y233-F235 HydrophobicContact CD1-CD2 4.29Å; Y233-F235 AromaticContact CD1-CE1 3.9Å; Y233-F235 HydrophobicContact CD1-CE1 3.9Å; Y233-F235 HydrophobicContact CD1-CE2 4.27Å; Y233-F235 HydrophobicContact CD1-CG 4.13Å; Y233-F235 HydrophobicContact CD1-CZ 4.08Å; Y233-F235 AromaticContact CE1-CD1 3.7Å; Y233-F235 HydrophobicContact CE1-CD1 3.7Å; Y233-F235 AromaticContact CE1-CE1 3.93Å; Y233-F235 HydrophobicContact CE1-CE1 3.93Å; Y233-F235 HydrophobicContact CE1-CG 4.16Å; Y233-R238 WeakPolarHBondContact CE2-O 3.46Å; Y233-R238 WeakPolarHBondContact OH-CA 3.17Å; Y233-R238 PolarHBondContact OH-O 2.81Å
234	N	89.9	Confident	89.8	Confident	52 Å²	52	74.3 Å²	74.3	28%	0.278	38%	0.38	S	S	.	.			trans	-105.7	110	175.8	-177.7	-20.4	0	0	0	109.7	K232 T236 S237 R238 T239 D241	K232-N234 PolarHBondContact O-N 3.16Å; N234-T236 PolarHBondContact O-N 2.78Å; N234-T236 WeakPolarHBondContact OD1-CB 3.4Å; N234-T236 PolarHBondContact OD1-N 3.21Å; N234-S237 VanDerWaalsContact CB-OG 3.27Å; N234-S237 WeakPolarHBondContact CB-OG 3.38Å; N234-S237 PolarHBondContact ND2-OG 2.85Å; N234-S237 PolarHBondContact OD1-N 2.96Å; N234-R238 WeakPolarHBondContact O-CA 3.13Å; N234-R238 PolarHBondContact O-N 3.46Å; N234-T239 PolarHBondContact N-O 3.42Å; N234-D241 WeakPolarHBondContact CB-OD2 3.26Å; N234-D241 PolarHBondContact ND2-OD2 2.79Å
235	F	85.9	Confident	89.8	Confident	132 Å²	132	72 Å²	72	58%	0.579	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.2	-178.4	-68.6	-83.2	0	0	0	113.8	Y233	Y233-F235 AromaticContact CD1-CD1 3.93Å; Y233-F235 HydrophobicContact CD1-CD1 3.93Å; Y233-F235 HydrophobicContact CD1-CD2 4.29Å; Y233-F235 AromaticContact CD1-CE1 3.9Å; Y233-F235 HydrophobicContact CD1-CE1 3.9Å; Y233-F235 HydrophobicContact CD1-CE2 4.27Å; Y233-F235 HydrophobicContact CD1-CG 4.13Å; Y233-F235 HydrophobicContact CD1-CZ 4.08Å; Y233-F235 AromaticContact CE1-CD1 3.7Å; Y233-F235 HydrophobicContact CE1-CD1 3.7Å; Y233-F235 AromaticContact CE1-CE1 3.93Å; Y233-F235 HydrophobicContact CE1-CE1 3.93Å; Y233-F235 HydrophobicContact CE1-CG 4.16Å
236	T	86.8	Confident	89.8	Confident	136 Å²	136	73.2 Å²	73.2	83%	0.834	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-49.4	179.6	-51.1	0	0	0	0	111.3	N234	N234-T236 PolarHBondContact O-N 2.78Å; N234-T236 WeakPolarHBondContact OD1-CB 3.4Å; N234-T236 PolarHBondContact OD1-N 3.21Å
237	S	85.6	Confident	89.6	Confident	55 Å²	55	74.7 Å²	74.7	39%	0.385	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-13.1	179.4	55	0	0	0	0	113.1	N234 T239	N234-S237 VanDerWaalsContact CB-OG 3.27Å; N234-S237 WeakPolarHBondContact CB-OG 3.38Å; N234-S237 PolarHBondContact ND2-OG 2.85Å; N234-S237 PolarHBondContact OD1-N 2.96Å; S237-T239 WeakPolarHBondContact CB-OG1 3.22Å; S237-T239 PolarHBondContact O-N 3.37Å; S237-T239 PolarHBondContact OG-OG1 2.99Å
238	R	85.5	Confident	89.2	Confident	150 Å²	150	78.3 Å²	78.3	57%	0.566	41%	0.411	S	S	*	.			trans	59.5	18.1	-172.3	-60.6	179.7	172.5	175.5	-4	114.1	E211 Y233 N234	E211-R238 HydrophobicContact CG-CB 4.37Å; Y233-R238 WeakPolarHBondContact CE2-O 3.46Å; Y233-R238 WeakPolarHBondContact OH-CA 3.17Å; Y233-R238 PolarHBondContact OH-O 2.81Å; N234-R238 WeakPolarHBondContact O-CA 3.13Å; N234-R238 PolarHBondContact O-N 3.46Å
239	T	88.3	Confident	88.4	Confident	58 Å²	58	84 Å²	84	36%	0.356	43%	0.433	S	S	.	.	S	Bend	trans	-106	161.1	-178.6	53.3	0	0	0	0	112.3	N234 S237 D241	N234-T239 PolarHBondContact N-O 3.42Å; S237-T239 WeakPolarHBondContact CB-OG1 3.22Å; S237-T239 PolarHBondContact O-N 3.37Å; S237-T239 PolarHBondContact OG-OG1 2.99Å; T239-D241 PolarHBondContact OG1-OD1 2.71Å
240	C	90.7	Very high	88.2	Confident	19 Å²	19	77.5 Å²	77.5	13%	0.128	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	107.8	164.8	-71.3	0	0	0	0	108.4	P213 C227 F231	P213-C240 HydrophobicContact CG-CB 4.15Å; C227-C240 VanDerWaalsContact CA-SG 3.59Å; C227-C240 HydrophobicContact CB-CB 3.81Å; C227-C240 WeakPolarHBondContact CB-SG 3.38Å; C227-C240 WeakPolarHBondContact SG-CA 3.21Å; C227-C240 WeakPolarHBondContact SG-CB 3.3Å; C227-C240 CovalentContact SG-SG 2.03Å; C227-C240 PolarHBondContact SG-SG 2.76Å; F231-C240 HydrophobicContact CB-CB 3.97Å; F231-C240 HydrophobicContact CD1-CB 4.27Å; F231-C240 HydrophobicContact CG-CB 4.35Å
241	D	91.3	Very high	88.2	Confident	62 Å²	62	77.6 Å²	77.6	33%	0.332	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	141.6	179.2	-61.3	-13.3	0	0	0	108.8	F231 K232 N234 T239	F231-D241 CarbonylContact C-O 3.43Å; F231-D241 VanDerWaalsContact CA-O 3.27Å; F231-D241 WeakPolarHBondContact CA-O 3.42Å; K232-D241 PolarHBondContact N-O 3.39Å; K232-D241 PolarHBondContact O-N 3Å; N234-D241 WeakPolarHBondContact CB-OD2 3.26Å; N234-D241 PolarHBondContact ND2-OD2 2.79Å; T239-D241 PolarHBondContact OG1-OD1 2.71Å
242	D	92.4	Very high	88.1	Confident	57 Å²	57	80 Å²	80	31%	0.305	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	135.6	178.2	-172.6	60.1	0	0	0	110.8	F231 N257 G260	F231-D242 HydrophobicContact CD1-CB 4.42Å; F231-D242 HydrophobicContact CE1-CB 4.29Å; D242-N257 PolarHBondContact OD2-ND2 2.77Å; D242-G260 PolarHBondContact OD1-N 3.24Å
243	V	91.6	Very high	87.8	Confident	54 Å²	54	74.3 Å²	74.3	33%	0.327	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-91.8	116.1	175.3	176.3	0	0	0	0	107.9	G230 K232 E245	G230-V243 WeakPolarHBondContact O-CB 3.46Å; G230-V243 PolarHBondContact O-N 2.9Å; K232-V243 HydrophobicContact CB-CG2 3.64Å; V243-E245 HydrophobicContact CG1-CG 4.43Å; V243-E245 PolarHBondContact O-N 3.28Å; V243-E245 VanDerWaalsContact O-OE2 3.09Å
244	D	91.2	Very high	87.8	Confident	63 Å²	63	76.6 Å²	76.6	34%	0.337	42%	0.415	S	S	.	.			trans	-74.1	95.6	172.7	-169.3	-22.8	0	0	0	110.3	C246 E247	D244-C246 PolarHBondContact O-N 3.06Å; D244-C246 WeakPolarHBondContact OD1-CA 3.3Å; D244-C246 WeakPolarHBondContact OD1-CB 3.3Å; D244-C246 PolarHBondContact OD1-N 2.86Å; D244-E247 HydrophobicContact CB-CG 4.12Å; D244-E247 PolarHBondContact O-N 3.19Å
245	E	90.6	Very high	87.9	Confident	32 Å²	32	75.7 Å²	75.7	15%	0.15	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-68.8	-15	179.2	-60.1	96.4	166.3	0	0	113.1	V243 E247 T248 S250 N257 S261 Y262	V243-E245 HydrophobicContact CG1-CG 4.43Å; V243-E245 PolarHBondContact O-N 3.28Å; V243-E245 VanDerWaalsContact O-OE2 3.09Å; E245-E247 VanDerWaalsContact C-N 3.31Å; E245-E247 PolarHBondContact O-N 2.94Å; E245-T248 PolarHBondContact O-N 3.01Å; E245-T248 PolarHBondContact O-OG1 3.19Å; E245-S250 PolarHBondContact O-OG 3.25Å; E245-N257 PolarHBondContact OE2-OD1 3.26Å; E245-S261 VanDerWaalsContact OE2-C 3.29Å; E245-Y262 HydrophobicContact CB-CD1 3.38Å; E245-Y262 HydrophobicContact CB-CE1 3.81Å; E245-Y262 HydrophobicContact CB-CG 3.87Å; E245-Y262 HydrophobicContact CG-CD1 3.64Å; E245-Y262 HydrophobicContact CG-CE1 3.99Å; E245-Y262 WeakPolarHBondContact OE2-CD1 3.31Å
246	C	90.7	Very high	88.1	Confident	31 Å²	31	73.8 Å²	73.8	21%	0.209	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-72.9	-22.6	178.7	-59.4	0	0	0	0	112.9	D244 T248 H249 C255 N257	D244-C246 PolarHBondContact O-N 3.06Å; D244-C246 WeakPolarHBondContact OD1-CA 3.3Å; D244-C246 WeakPolarHBondContact OD1-CB 3.3Å; D244-C246 PolarHBondContact OD1-N 2.86Å; C246-T248 PolarHBondContact O-N 2.86Å; C246-H249 PolarHBondContact O-N 2.98Å; C246-C255 WeakPolarHBondContact CA-SG 3.49Å; C246-C255 HydrophobicContact CB-CB 3.59Å; C246-C255 WeakPolarHBondContact CB-SG 2.9Å; C246-C255 WeakPolarHBondContact SG-CB 3.3Å; C246-C255 CovalentContact SG-SG 2.03Å; C246-C255 PolarHBondContact SG-SG 3.04Å; C246-N257 PolarHBondContact SG-N 2.91Å; C246-N257 VanDerWaalsContact SG-N 3.37Å
247	E	89.3	Confident	88.2	Confident	161 Å²	161	69.2 Å²	69.2	75%	0.752	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-63.9	-20.3	174.5	-67.2	-167	156.8	0	0	112.8	D244 E245	D244-E247 HydrophobicContact CB-CG 4.12Å; D244-E247 PolarHBondContact O-N 3.19Å; E245-E247 VanDerWaalsContact C-N 3.31Å; E245-E247 PolarHBondContact O-N 2.94Å
248	T	83.1	Confident	88.4	Confident	104 Å²	104	69.2 Å²	69.2	64%	0.638	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-100.8	14.3	-176.2	56.9	0	0	0	0	114.8	E245 C246 S250	E245-T248 PolarHBondContact O-N 3.01Å; E245-T248 PolarHBondContact O-OG1 3.19Å; C246-T248 PolarHBondContact O-N 2.86Å; T248-S250 PolarHBondContact OG1-OG 3.41Å
249	H	74.9	Confident	88.7	Confident	175 Å²	175	68.1 Å²	68.1	81%	0.81	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	47.6	-178.7	-66	-74.2	0	0	0	114	C246 C251	C246-H249 PolarHBondContact O-N 2.98Å; H249-C251 VanDerWaalsContact C-N 3.26Å; H249-C251 PolarHBondContact O-N 2.83Å
250	S	84	Confident	88.7	Confident	32 Å²	32	66.3 Å²	66.3	22%	0.224	38%	0.376	C	S	.	.			trans	-71.4	-13.1	-177.6	-60.4	0	0	0	0	115.2	E245 T248	E245-S250 PolarHBondContact O-OG 3.25Å; T248-S250 PolarHBondContact OG1-OG 3.41Å
251	C	88.6	Confident	88.7	Confident	20 Å²	20	68.2 Å²	68.2	14%	0.135	39%	0.39	C	S	.	.			trans	-123.4	146.9	-177.2	-53.9	0	0	0	0	111.4	H249 C255 C264	H249-C251 VanDerWaalsContact C-N 3.26Å; H249-C251 PolarHBondContact O-N 2.83Å; C251-C255 HydrophobicContact CB-CB 4.09Å; C251-C255 VanDerWaalsContact SG-CB 3.53Å; C251-C264 HydrophobicContact CB-CB 3.69Å; C251-C264 WeakPolarHBondContact CB-SG 3.38Å; C251-C264 WeakPolarHBondContact SG-CA 3.04Å; C251-C264 WeakPolarHBondContact SG-CB 3.11Å; C251-C264 CovalentContact SG-SG 2.02Å; C251-C264 PolarHBondContact SG-SG 2.85Å
252	D	87.3	Confident	88.7	Confident	109 Å²	109	67.5 Å²	67.5	58%	0.583	38%	0.383	S	S	*	.	S	Bend	trans	-72.6	-34.6	168.3	-172.7	43.1	0	0	0	111.7	R279 Y280 C281	D252-R279 PolarHBondContact N-O 3.27Å; D252-R279 VanDerWaalsContact N-O 3.07Å; D252-Y280 HydrophobicContact CB-CD1 4.34Å; D252-C281 PolarHBondContact OD2-N 3.28Å
253	G	86.4	Confident	88.6	Confident	33 Å²	33	66.7 Å²	66.7	34%	0.34	38%	0.381	S	S	.	.	S	Bend	trans	-93.3	-148.2	177.6	0	0	0	0	0	114.7	H265	G253-H265 CarbonylContact C-O 3.56Å; G253-H265 WeakPolarHBondContact CA-O 3.46Å
254	T	89.3	Confident	88.6	Confident	73 Å²	73	64.5 Å²	64.5	45%	0.448	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	126.2	174.3	-58.5	0	0	0	0	110	H265	T254-H265 PolarHBondContact N-O 2.92Å; T254-H265 PolarHBondContact O-N 3.37Å
255	C	91.6	Very high	88.6	Confident	33 Å²	33	63.5 Å²	63.5	22%	0.223	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.7	174.2	-171.8	0	0	0	0	110.2	C246 C251	C246-C255 WeakPolarHBondContact CA-SG 3.49Å; C246-C255 HydrophobicContact CB-CB 3.59Å; C246-C255 WeakPolarHBondContact CB-SG 2.9Å; C246-C255 WeakPolarHBondContact SG-CB 3.3Å; C246-C255 CovalentContact SG-SG 2.03Å; C246-C255 PolarHBondContact SG-SG 3.04Å; C251-C255 HydrophobicContact CB-CB 4.09Å; C251-C255 VanDerWaalsContact SG-CB 3.53Å
256	H	90.4	Very high	88.8	Confident	92 Å²	92	62.7 Å²	62.7	43%	0.426	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	111.6	172.7	179.3	-79.6	0	0	0	109.8	Y262 S263	H256-Y262 WeakPolarHBondContact O-CA 3.32Å; H256-S263 PolarHBondContact N-O 3.26Å; H256-S263 PolarHBondContact O-N 3.3Å; H256-S263 PolarHBondContact O-OG 2.91Å
257	N	90.2	Very high	88.9	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.219	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	138.8	177.2	-172.4	40.4	0	0	0	110.9	D242 E245 C246 S261	D242-N257 PolarHBondContact OD2-ND2 2.77Å; E245-N257 PolarHBondContact OE2-OD1 3.26Å; C246-N257 PolarHBondContact SG-N 2.91Å; C246-N257 VanDerWaalsContact SG-N 3.37Å; N257-S261 PolarHBondContact OD1-O 3.42Å
258	T	89.9	Confident	89.1	Confident	54 Å²	54	55.9 Å²	55.9	33%	0.331	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.9	179.4	59.3	0	0	0	0	108.9	G260 S261	T258-G260 PolarHBondContact O-N 3.08Å; T258-S261 CarbonylContact C-O 3.49Å; T258-S261 VanDerWaalsContact C-O 3.27Å; T258-S261 VanDerWaalsContact CA-O 3.3Å; T258-S261 WeakPolarHBondContact CA-O 3.28Å; T258-S261 PolarHBondContact N-O 3.12Å; T258-S261 CarbonylContact O-C 3.47Å; T258-S261 PolarHBondContact O-N 3.01Å; T258-S261 PolarHBondContact OG1-O 2.85Å
259	V	90.4	Very high	89.6	Confident	128 Å²	128	53.1 Å²	53.1	78%	0.776	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	111.3	-177.6	179.4	0	0	0	0	110.2	F231	F231-V259 HydrophobicContact CE1-CG1 4.08Å; F231-V259 HydrophobicContact CZ-CG1 3.74Å
260	G	88.4	Confident	90.5	Very high	19 Å²	19	54 Å²	54	20%	0.196	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	7.7	-178.8	0	0	0	0	0	115.7	D242 T258	D242-G260 PolarHBondContact OD1-N 3.24Å; T258-G260 PolarHBondContact O-N 3.08Å
261	S	90.9	Very high	91	Very high	60 Å²	60	53.1 Å²	53.1	42%	0.42	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	-174.4	-179.4	-156.6	0	0	0	0	112.6	E245 N257 T258	E245-S261 VanDerWaalsContact OE2-C 3.29Å; N257-S261 PolarHBondContact OD1-O 3.42Å; T258-S261 CarbonylContact C-O 3.49Å; T258-S261 VanDerWaalsContact C-O 3.27Å; T258-S261 VanDerWaalsContact CA-O 3.3Å; T258-S261 WeakPolarHBondContact CA-O 3.28Å; T258-S261 PolarHBondContact N-O 3.12Å; T258-S261 CarbonylContact O-C 3.47Å; T258-S261 PolarHBondContact O-N 3.01Å; T258-S261 PolarHBondContact OG1-O 2.85Å
262	Y	91.2	Very high	91.2	Very high	47 Å²	47	54.3 Å²	54.3	18%	0.184	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	162.4	173.4	65.2	-77.3	0	0	0	110.8	E245 H256 R279	E245-Y262 HydrophobicContact CB-CD1 3.38Å; E245-Y262 HydrophobicContact CB-CE1 3.81Å; E245-Y262 HydrophobicContact CB-CG 3.87Å; E245-Y262 HydrophobicContact CG-CD1 3.64Å; E245-Y262 HydrophobicContact CG-CE1 3.99Å; E245-Y262 WeakPolarHBondContact OE2-CD1 3.31Å; H256-Y262 WeakPolarHBondContact O-CA 3.32Å; Y262-R279 PolarHBondContact OH-NE 3.31Å; Y262-R279 PolarHBondContact OH-NH2 2.86Å
263	S	90.3	Very high	91.4	Very high	39 Å²	39	50.2 Å²	50.2	27%	0.273	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136	173.7	59.6	0	0	0	0	110.9	H256 H265	H256-S263 PolarHBondContact N-O 3.26Å; H256-S263 PolarHBondContact O-N 3.3Å; H256-S263 PolarHBondContact O-OG 2.91Å; S263-H265 PolarHBondContact OG-NE2 2.85Å
264	C	92.1	Very high	91.6	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.061	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.1	174.4	-58.5	0	0	0	0	110.3	C251 L274 E278	C251-C264 HydrophobicContact CB-CB 3.69Å; C251-C264 WeakPolarHBondContact CB-SG 3.38Å; C251-C264 WeakPolarHBondContact SG-CA 3.04Å; C251-C264 WeakPolarHBondContact SG-CB 3.11Å; C251-C264 CovalentContact SG-SG 2.02Å; C251-C264 PolarHBondContact SG-SG 2.85Å; C264-L274 HydrophobicContact CB-CD1 3.89Å; C264-L274 WeakPolarHBondContact O-CD2 3.45Å; C264-E278 VanDerWaalsContact CB-O 3.32Å; C264-E278 WeakPolarHBondContact CB-O 3.43Å; C264-E278 PolarHBondContact SG-O 2.9Å; C264-E278 VanDerWaalsContact SG-O 3.41Å
265	H	91.9	Very high	91.6	Very high	42 Å²	42	48.9 Å²	48.9	19%	0.194	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.4	-179.9	-62.5	-90.4	0	0	0	110	G253 T254 S263 L622	G253-H265 CarbonylContact C-O 3.56Å; G253-H265 WeakPolarHBondContact CA-O 3.46Å; T254-H265 PolarHBondContact N-O 2.92Å; T254-H265 PolarHBondContact O-N 3.37Å; S263-H265 PolarHBondContact OG-NE2 2.85Å; H265-L622 HydrophobicContact CB-CB 4.22Å
266	C	93	Very high	91.4	Very high	14 Å²	14	52.6 Å²	52.6	10%	0.095	30%	0.296	C	S	.	.			trans	-99.1	142	173.2	-62.7	0	0	0	0	110	G268 L272 C281	C266-G268 PolarHBondContact O-N 2.68Å; C266-L272 HydrophobicContact CB-CB 4.27Å; C266-C281 HydrophobicContact CB-CB 3.9Å; C266-C281 WeakPolarHBondContact CB-SG 3.44Å; C266-C281 WeakPolarHBondContact SG-CA 3.3Å; C266-C281 WeakPolarHBondContact SG-CB 3Å; C266-C281 CovalentContact SG-SG 2.03Å; C266-C281 PolarHBondContact SG-SG 3.46Å
267	D	93.4	Very high	91.2	Very high	46 Å²	46	52.1 Å²	52.1	25%	0.246	30%	0.297	C	S	.	.			trans	-76.9	95.5	178.1	-173.9	1.7	0	0	0	110.6	R269 R270 L622	D267-R269 PolarHBondContact O-N 3.19Å; D267-R269 WeakPolarHBondContact OD1-CB 3.33Å; D267-R269 WeakPolarHBondContact OD1-CG 3.36Å; D267-R269 PolarHBondContact OD1-N 2.98Å; D267-R270 HydrophobicContact CB-CG 4.3Å; D267-R270 WeakPolarHBondContact O-CB 3.46Å; D267-R270 PolarHBondContact O-N 3.48Å; D267-R270 WeakPolarHBondContact OD2-CD 3.41Å; D267-R270 WeakPolarHBondContact OD2-CG 3.36Å; D267-L622 HydrophobicContact CB-CD1 4.01Å; D267-L622 HydrophobicContact CB-CD2 4.36Å
268	G	93.7	Very high	91.1	Very high	4 Å²	4	57 Å²	57	4%	0.041	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-59.8	-25.9	177.7	0	0	0	0	0	113.5	C266 R270 G271 L272 S628 A629	C266-G268 PolarHBondContact O-N 2.68Å; G268-R270 PolarHBondContact O-N 2.9Å; G268-R270 VanDerWaalsContact O-N 3.1Å; G268-G271 WeakPolarHBondContact O-CA 3.28Å; G268-G271 PolarHBondContact O-N 2.02Å; G268-L272 WeakPolarHBondContact CA-O 3.42Å; G268-S628 WeakPolarHBondContact CA-OG 3.43Å; G268-S628 PolarHBondContact N-OG 3.35Å; G268-A629 VanDerWaalsContact O-CA 3.3Å; G268-A629 WeakPolarHBondContact O-CA 3.39Å; G268-A629 WeakPolarHBondContact O-CB 3.27Å
269	R	93.9	Very high	91.1	Very high	45 Å²	45	60.6 Å²	60.6	17%	0.17	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-64	-18.4	177.7	-55.7	171.3	-176.7	144.9	3.4	111.9	D267 P617 P618 I620 S628 F630	D267-R269 PolarHBondContact O-N 3.19Å; D267-R269 WeakPolarHBondContact OD1-CB 3.33Å; D267-R269 WeakPolarHBondContact OD1-CG 3.36Å; D267-R269 PolarHBondContact OD1-N 2.98Å; R269-P617 VanDerWaalsContact CZ-O 3.3Å; R269-P617 PolarHBondContact NH2-O 2.03Å; R269-P618 VanDerWaalsContact CZ-CA 3.49Å; R269-P618 PolarHBondContact NH1-O 3.24Å; R269-I620 PolarHBondContact NH1-O 3.43Å; R269-I620 PolarHBondContact NH2-O 3.47Å; R269-S628 WeakPolarHBondContact CG-O 3.47Å; R269-F630 HydrophobicContact CB-CD2 4.24Å; R269-F630 HydrophobicContact CB-CE2 3.63Å; R269-F630 HydrophobicContact CB-CZ 4.13Å; R269-F630 HydrophobicContact CG-CE2 4.05Å; R269-F630 HydrophobicContact CG-CZ 4.07Å
270	R	93.9	Very high	91.1	Very high	194 Å²	194	61.4 Å²	61.4	73%	0.732	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-95.1	6.8	174.7	-58.7	179.1	66.3	-178.3	-2.2	113.1	D267 G268 L272	D267-R270 HydrophobicContact CB-CG 4.3Å; D267-R270 WeakPolarHBondContact O-CB 3.46Å; D267-R270 PolarHBondContact O-N 3.48Å; D267-R270 WeakPolarHBondContact OD2-CD 3.41Å; D267-R270 WeakPolarHBondContact OD2-CG 3.36Å; G268-R270 PolarHBondContact O-N 2.9Å; G268-R270 VanDerWaalsContact O-N 3.1Å; R270-L272 HydrophobicContact CB-CD1 4.37Å; R270-L272 HydrophobicContact CB-CG 4.42Å
271	G	93.5	Very high	91.4	Very high	14 Å²	14	61.7 Å²	61.7	14%	0.144	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	29.6	-177.7	0	0	0	0	0	113.5	G268 R283 I284	G268-G271 WeakPolarHBondContact O-CA 3.28Å; G268-G271 PolarHBondContact O-N 2.02Å; G271-R283 WeakPolarHBondContact O-CA 3.37Å; G271-I284 PolarHBondContact O-N 3.21Å
272	L	93.6	Very high	91.5	Very high	45 Å²	45	62.9 Å²	62.9	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	148	-179.8	-60.3	173.6	0	0	0	111.4	C266 G268 R270 C281 E282 R283	C266-L272 HydrophobicContact CB-CB 4.27Å; G268-L272 WeakPolarHBondContact CA-O 3.42Å; R270-L272 HydrophobicContact CB-CD1 4.37Å; R270-L272 HydrophobicContact CB-CG 4.42Å; L272-C281 HydrophobicContact CB-CB 4.41Å; L272-C281 HydrophobicContact CD1-CB 4.35Å; L272-E282 CarbonylContact C-O 3.48Å; L272-E282 WeakPolarHBondContact CA-O 2.96Å; L272-R283 HydrophobicContact CD2-CG 4.11Å
273	Q	91.7	Very high	91.6	Very high	23 Å²	23	70.5 Å²	70.5	11%	0.107	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	161.4	169.2	65.9	-178.8	11.8	0	0	110.1	C281 E282 I284 T515 T535	Q273-C281 WeakPolarHBondContact O-CA 3.27Å; Q273-E282 HydrophobicContact CG-CG 3.71Å; Q273-E282 PolarHBondContact N-O 2.67Å; Q273-E282 PolarHBondContact NE2-OE1 2.92Å; Q273-E282 PolarHBondContact O-N 3.01Å; Q273-I284 HydrophobicContact CB-CG1 4.01Å; Q273-I284 HydrophobicContact CG-CG1 4.23Å; Q273-T515 PolarHBondContact OE1-OG1 2.88Å; Q273-T535 PolarHBondContact NE2-OG1 3.48Å; Q273-T535 PolarHBondContact OE1-OG1 2.89Å
274	L	90.8	Very high	91.7	Very high	61 Å²	61	69.2 Å²	69.2	32%	0.319	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.4	174.2	-165	68.9	0	0	0	109.2	C264 E278	C264-L274 HydrophobicContact CB-CD1 3.89Å; C264-L274 WeakPolarHBondContact O-CD2 3.45Å; L274-E278 HydrophobicContact CD2-CB 4.08Å; L274-E278 HydrophobicContact CD2-CG 4.41Å
275	A	89.5	Confident	91.7	Very high	16 Å²	16	70.4 Å²	70.4	13%	0.132	34%	0.34	C	S	.	.			trans	-71.5	169.5	177.8	0	0	0	0	0	111.6	D277 E278 Y280 E282	A275-D277 PolarHBondContact O-N 3.06Å; A275-E278 PolarHBondContact O-N 3.35Å; A275-Y280 WeakPolarHBondContact CB-O 3.23Å; A275-Y280 PolarHBondContact N-O 2.83Å; A275-E282 HydrophobicContact CB-CG 4.28Å
276	A	86.8	Confident	91.7	Very high	111 Å²	111	72.1 Å²	72.1	92%	0.917	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.9	-177.8	0	0	0	0	0	114.9	E278	A276-E278 VanDerWaalsContact C-N 3.31Å
277	D	87.1	Confident	91.5	Very high	83 Å²	83	72.9 Å²	72.9	44%	0.444	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	3.4	176	64.6	11.2	0	0	0	114.2	A275 R279 Y280	A275-D277 PolarHBondContact O-N 3.06Å; D277-R279 PolarHBondContact O-N 2.6Å; D277-R279 VanDerWaalsContact O-N 3.12Å; D277-R279 PolarHBondContact OD1-N 3.49Å; D277-Y280 PolarHBondContact OD1-N 2.99Å; D277-Y280 WeakPolarHBondContact OD2-CD2 3.37Å; D277-Y280 WeakPolarHBondContact OD2-CE2 3.36Å
278	E	87.9	Confident	91.4	Very high	144 Å²	144	71.1 Å²	71.1	67%	0.673	35%	0.349	S	S	*	.	S	Bend	trans	58.5	19.2	179.2	-59.4	-178.3	177	0	0	114.5	C264 L274 A275 A276	C264-E278 VanDerWaalsContact CB-O 3.32Å; C264-E278 WeakPolarHBondContact CB-O 3.43Å; C264-E278 PolarHBondContact SG-O 2.9Å; C264-E278 VanDerWaalsContact SG-O 3.41Å; L274-E278 HydrophobicContact CD2-CB 4.08Å; L274-E278 HydrophobicContact CD2-CG 4.41Å; A275-E278 PolarHBondContact O-N 3.35Å; A276-E278 VanDerWaalsContact C-N 3.31Å
279	R	88.9	Confident	91.3	Very high	129 Å²	129	77.1 Å²	77.1	49%	0.487	38%	0.38	S	S	.	.	S	Bend	trans	-127.5	-37.1	-176.5	-70.5	-178.1	-177.1	-176.6	1.7	114.6	D252 Y262 D277	D252-R279 PolarHBondContact N-O 3.27Å; D252-R279 VanDerWaalsContact N-O 3.07Å; Y262-R279 PolarHBondContact OH-NE 3.31Å; Y262-R279 PolarHBondContact OH-NH2 2.86Å; D277-R279 PolarHBondContact O-N 2.6Å; D277-R279 VanDerWaalsContact O-N 3.12Å; D277-R279 PolarHBondContact OD1-N 3.49Å
280	Y	91.4	Very high	91.2	Very high	144 Å²	144	76.1 Å²	76.1	57%	0.565	38%	0.378	S	S	*	.	S	Bend	trans	-101.3	153.5	-176.2	-64.7	-94.5	0	0	0	111.9	D252 A275 D277	D252-Y280 HydrophobicContact CB-CD1 4.34Å; A275-Y280 WeakPolarHBondContact CB-O 3.23Å; A275-Y280 PolarHBondContact N-O 2.83Å; D277-Y280 PolarHBondContact OD1-N 2.99Å; D277-Y280 WeakPolarHBondContact OD2-CD2 3.37Å; D277-Y280 WeakPolarHBondContact OD2-CE2 3.36Å
281	C	93.5	Very high	91	Very high	25 Å²	25	67.8 Å²	67.8	17%	0.169	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.6	174.2	-60.6	0	0	0	0	110.6	D252 C266 L272 Q273	D252-C281 PolarHBondContact OD2-N 3.28Å; C266-C281 HydrophobicContact CB-CB 3.9Å; C266-C281 WeakPolarHBondContact CB-SG 3.44Å; C266-C281 WeakPolarHBondContact SG-CA 3.3Å; C266-C281 WeakPolarHBondContact SG-CB 3Å; C266-C281 CovalentContact SG-SG 2.03Å; C266-C281 PolarHBondContact SG-SG 3.46Å; L272-C281 HydrophobicContact CB-CB 4.41Å; L272-C281 HydrophobicContact CD1-CB 4.35Å; Q273-C281 WeakPolarHBondContact O-CA 3.27Å
282	E	93	Very high	90.8	Very high	85 Å²	85	71 Å²	71	40%	0.397	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	163.3	173.5	63.4	176.8	-157.8	0	0	110.8	L272 Q273 A275	L272-E282 CarbonylContact C-O 3.48Å; L272-E282 WeakPolarHBondContact CA-O 2.96Å; Q273-E282 HydrophobicContact CG-CG 3.71Å; Q273-E282 PolarHBondContact N-O 2.67Å; Q273-E282 PolarHBondContact NE2-OE1 2.92Å; Q273-E282 PolarHBondContact O-N 3.01Å; A275-E282 HydrophobicContact CB-CG 4.28Å
283	R	93.4	Very high	90.7	Very high	207 Å²	207	75.4 Å²	75.4	78%	0.781	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	139.1	175.2	-68.5	-143.2	-63.1	-91.7	0.5	110	G271 L272 P285	G271-R283 WeakPolarHBondContact O-CA 3.37Å; L272-R283 HydrophobicContact CD2-CG 4.11Å; R283-P285 VanDerWaalsContact O-CD 3.31Å; R283-P285 WeakPolarHBondContact O-CD 3.33Å
284	I	93.3	Very high	90.7	Very high	13 Å²	13	78 Å²	78	7%	0.067	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-60.6	122.7	174.9	-61.6	169.5	0	0	0	109	G271 Q273 R513 T515 A629	G271-I284 PolarHBondContact O-N 3.21Å; Q273-I284 HydrophobicContact CB-CG1 4.01Å; Q273-I284 HydrophobicContact CG-CG1 4.23Å; I284-R513 HydrophobicContact CG2-CB 3.95Å; I284-T515 HydrophobicContact CD1-CG2 4.27Å; I284-A629 HydrophobicContact CD1-CB 3.42Å; I284-A629 VanDerWaalsContact CD1-CB 3.42Å
285	P	91.4	Very high	90.7	Very high	34 Å²	34	78.5 Å²	78.5	22%	0.221	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-57.8	143	177.8	-26	33.5	0	0	0	113.3	R283 R513 S514	R283-P285 VanDerWaalsContact O-CD 3.31Å; R283-P285 WeakPolarHBondContact O-CD 3.33Å; P285-R513 WeakPolarHBondContact O-CA 2.93Å; P285-S514 WeakPolarHBondContact CD-OG 3.34Å; P285-S514 PolarHBondContact O-N 3.48Å
286	V	91.5	Very high	90.7	Very high	78 Å²	78	80.2 Å²	80.2	47%	0.473	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-90.2	122.9	164.8	178.6	0	0	0	0	106.3	S512 R513	V286-S512 WeakPolarHBondContact CA-O 3.45Å; V286-S512 WeakPolarHBondContact CG1-O 3.31Å; V286-R513 HydrophobicContact CG2-CG 4.24Å
287	C	90	Very high	90.8	Very high	30 Å²	30	78.8 Å²	78.8	20%	0.203	38%	0.376	C	S	.	.			trans	-112.2	-17.3	-177.2	66	0	0	0	0	113.1	S512 C561	C287-S512 PolarHBondContact N-O 3.43Å; C287-C561 HydrophobicContact CB-CB 3.44Å; C287-C561 VanDerWaalsContact CB-CB 3.44Å; C287-C561 WeakPolarHBondContact CB-SG 3.32Å; C287-C561 WeakPolarHBondContact SG-CB 3.02Å; C287-C561 CovalentContact SG-SG 2.04Å; C287-C561 PolarHBondContact SG-SG 2.73Å
288	V	90.8	Very high	91.1	Very high	8 Å²	8	75.6 Å²	75.6	5%	0.048	36%	0.359	C	S	.	.	S	Bend	trans	-134.1	119	170.1	-176.7	0	0	0	0	108.9	L290 S512 C561 V664	V288-L290 HydrophobicContact CG1-CD2 4.47Å; V288-S512 PolarHBondContact N-O 2.8Å; V288-S512 WeakPolarHBondContact O-CB 3.32Å; V288-S512 PolarHBondContact O-OG 3.15Å; V288-C561 VanDerWaalsContact CG2-C 3.44Å; V288-V664 HydrophobicContact CG1-CB 4.44Å; V288-V664 HydrophobicContact CG1-CG1 3.78Å; V288-V664 HydrophobicContact CG1-CG2 3.78Å
289	D	90.7	Very high	91.4	Very high	130 Å²	130	68.9 Å²	68.9	70%	0.695	33%	0.327	S	S	*	.			trans	-75.6	135.8	173.5	-71.2	-44.4	0	0	0	110.7
290	L	91.6	Very high	91.7	Very high	25 Å²	25	63 Å²	63	13%	0.131	31%	0.305	C	S	.	.			trans	-111.6	142.1	179.4	-59.1	175	0	0	0	109.5	V288 D292 F482 P662 V664	V288-L290 HydrophobicContact CG1-CD2 4.47Å; L290-D292 VanDerWaalsContact C-N 3.3Å; L290-D292 PolarHBondContact O-N 2.84Å; L290-F482 HydrophobicContact CD1-CD2 4.48Å; L290-F482 HydrophobicContact CD1-CE2 3.59Å; L290-F482 HydrophobicContact CD1-CZ 4.24Å; L290-P662 HydrophobicContact CB-CB 4.39Å; L290-P662 HydrophobicContact CB-CG 4.15Å; L290-P662 HydrophobicContact CD1-CG 4.05Å; L290-V664 HydrophobicContact CD2-CG2 3.97Å
291	T	90.7	Very high	91.8	Very high	19 Å²	19	56.5 Å²	56.5	12%	0.117	28%	0.28	C	S	.	.			trans	-82.7	76.9	172.9	61.6	0	0	0	0	109.9	F293 P663	T291-F293 VanDerWaalsContact C-N 3.3Å; T291-F293 HydrophobicContact CG2-CE2 4.49Å; T291-F293 PolarHBondContact O-N 2.69Å; T291-P663 PolarHBondContact N-O 2.82Å; T291-P663 WeakPolarHBondContact OG1-CD 3.29Å; T291-P663 WeakPolarHBondContact OG1-CG 3.38Å; T291-P663 PolarHBondContact OG1-O 2.04Å
292	D	89.3	Confident	91.7	Very high	82 Å²	82	55.9 Å²	55.9	44%	0.439	28%	0.278	S	S	.	.			trans	-92.6	22.7	-174.7	73	-17.4	0	0	0	113.8	L290 K294 F474 P662	L290-D292 VanDerWaalsContact C-N 3.3Å; L290-D292 PolarHBondContact O-N 2.84Å; D292-K294 PolarHBondContact O-N 2.89Å; D292-F474 HydrophobicContact CB-CD1 4.28Å; D292-F474 HydrophobicContact CB-CE1 3.79Å; D292-F474 HydrophobicContact CB-CZ 4.49Å; D292-F474 VanDerWaalsContact O-CD1 3.24Å; D292-F474 WeakPolarHBondContact O-CD1 3.42Å; D292-F474 WeakPolarHBondContact O-CE1 3.23Å; D292-P662 HydrophobicContact CB-CB 4.17Å; D292-P662 HydrophobicContact CB-CG 4.39Å
293	F	90.9	Very high	91.5	Very high	136 Å²	136	52.9 Å²	52.9	60%	0.596	26%	0.264	S	S	*	.			trans	-56.7	132.5	179.2	-60.2	-67.1	0	0	0	112.1	T291 F474 V475	T291-F293 VanDerWaalsContact C-N 3.3Å; T291-F293 HydrophobicContact CG2-CE2 4.49Å; T291-F293 PolarHBondContact O-N 2.69Å; F293-F474 CarbonylContact O-C 3.57Å; F293-F474 WeakPolarHBondContact O-CA 3.45Å; F293-V475 HydrophobicContact CB-CG2 4.4Å; F293-V475 PolarHBondContact O-N 3.46Å
294	K	92.4	Very high	91.2	Very high	78 Å²	78	46.9 Å²	46.9	34%	0.339	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.6	177.3	-61.6	174.7	-165.4	156.7	0	111.4	D292 E469 H472 C473 F474	D292-K294 PolarHBondContact O-N 2.89Å; K294-E469 HydrophobicContact CD-CG 4.25Å; K294-E469 IonicContact NZ-OE1 2.91Å; K294-E469 PolarHBondContact NZ-OE1 3.46Å; K294-H472 HydrophobicContact CB-CB 3.65Å; K294-H472 HydrophobicContact CD-CB 4.12Å; K294-H472 HydrophobicContact CG-CB 4.37Å; K294-C473 WeakPolarHBondContact CA-O 3.48Å; K294-F474 HydrophobicContact CG-CD1 3.88Å; K294-F474 HydrophobicContact CG-CE1 4.16Å
295	H	91.4	Very high	91	Very high	71 Å²	71	47.3 Å²	47.3	33%	0.329	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.8	-179	-166	-86.6	0	0	0	112.7	E297 M298 C473 V475	H295-E297 PolarHBondContact ND1-N 3.47Å; H295-E297 PolarHBondContact O-N 2.71Å; H295-M298 HydrophobicContact CB-CB 4.16Å; H295-M298 HydrophobicContact CB-CE 4.04Å; H295-M298 HydrophobicContact CB-CG 3.79Å; H295-M298 HydrophobicContact CB-SD 3.79Å; H295-M298 PolarHBondContact O-N 2.81Å; H295-M298 VanDerWaalsContact O-N 3.09Å; H295-C473 PolarHBondContact N-O 2.98Å; H295-V475 HydrophobicContact CB-CG2 4.01Å
296	P	89.1	Confident	90.8	Very high	53 Å²	53	48.4 Å²	48.4	34%	0.344	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-10	-173.1	28.8	-36.4	0	0	0	115.7	I465 Q466	P296-I465 WeakPolarHBondContact O-CG2 3.22Å; P296-Q466 HydrophobicContact CB-CG 4.23Å
297	E	89.1	Confident	90.4	Very high	81 Å²	81	45.1 Å²	45.1	38%	0.379	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	6.8	172.9	-57.9	-164.4	133.5	0	0	113.5	H295 K462	H295-E297 PolarHBondContact ND1-N 3.47Å; H295-E297 PolarHBondContact O-N 2.71Å; E297-K462 IonicContact OE1-NZ 3.16Å; E297-K462 PolarHBondContact OE1-NZ 2.87Å
298	M	92.8	Very high	90.2	Very high	16 Å²	16	48.1 Å²	48.1	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110.2	-179.3	-65.6	-172.3	-169.6	0	0	110.1	H295 W382 R449 H472 C473	H295-M298 HydrophobicContact CB-CB 4.16Å; H295-M298 HydrophobicContact CB-CE 4.04Å; H295-M298 HydrophobicContact CB-CG 3.79Å; H295-M298 HydrophobicContact CB-SD 3.79Å; H295-M298 PolarHBondContact O-N 2.81Å; H295-M298 VanDerWaalsContact O-N 3.09Å; M298-W382 HydrophobicContact CE-CZ2 4.43Å; M298-W382 HydrophobicContact SD-CH2 4.45Å; M298-W382 HydrophobicContact SD-CZ2 3.92Å; M298-R449 HydrophobicContact CG-CB 4.24Å; M298-H472 WeakPolarHBondContact O-CA 3.48Å; M298-C473 VanDerWaalsContact CB-SG 3.56Å; M298-C473 PolarHBondContact O-N 2.94Å; M298-C473 VanDerWaalsContact O-N 3.14Å
299	L	93.6	Very high	90.1	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.8	-177.6	178.7	66.3	0	0	0	111.1	L301 V310 I311 I426 C447 I448 W451 I465 K471	L299-L301 HydrophobicContact CD2-CD2 4.03Å; L299-L301 HydrophobicContact CG-CD2 4.15Å; L299-V310 HydrophobicContact CD1-CG1 3.9Å; L299-I311 HydrophobicContact CD1-CD1 3.9Å; L299-I311 HydrophobicContact CD1-CG1 4.34Å; L299-I311 HydrophobicContact CD2-CD1 3.46Å; L299-I311 VanDerWaalsContact CD2-CD1 3.46Å; L299-I311 HydrophobicContact CD2-CG1 4.04Å; L299-I311 HydrophobicContact CG-CD1 4.31Å; L299-I426 HydrophobicContact CD2-CG2 3.99Å; L299-C447 VanDerWaalsContact O-CA 3.3Å; L299-C447 WeakPolarHBondContact O-CA 3.21Å; L299-C447 PolarHBondContact O-SG 2.87Å; L299-C447 VanDerWaalsContact O-SG 3.34Å; L299-I448 PolarHBondContact N-O 3.37Å; L299-I448 PolarHBondContact O-N 2.79Å; L299-W451 HydrophobicContact CB-CH2 3.98Å; L299-W451 HydrophobicContact CB-CZ3 3.63Å; L299-W451 HydrophobicContact CD2-CH2 4.26Å; L299-W451 HydrophobicContact CD2-CZ3 4.08Å; L299-I465 HydrophobicContact CB-CG1 4.49Å; L299-I465 HydrophobicContact CD1-CG1 4.42Å; L299-K471 CarbonylContact C-O 3.27Å; L299-K471 WeakPolarHBondContact CA-O 3.49Å; L299-K471 HydrophobicContact CD1-CB 4.22Å
300	Y	95.2	Very high	89.9	Confident	7 Å²	7	43.8 Å²	43.8	3%	0.027	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.1	169.6	-176.4	-124.2	0	0	0	111.2	G302 E303 D445 G446 K471 C473 K657	Y300-G302 VanDerWaalsContact CE1-CA 3.43Å; Y300-G302 WeakPolarHBondContact CE1-O 3.29Å; Y300-G302 VanDerWaalsContact CZ-CA 3.42Å; Y300-E303 HydrophobicContact CD1-CB 4.28Å; Y300-E303 VanDerWaalsContact CE1-N 3.32Å; Y300-D445 WeakPolarHBondContact CE2-OD1 3.41Å; Y300-D445 PolarHBondContact OH-OD1 3.07Å; Y300-G446 WeakPolarHBondContact CD2-O 3.31Å; Y300-K471 WeakPolarHBondContact CB-O 3.33Å; Y300-K471 PolarHBondContact N-O 3.48Å; Y300-C473 HydrophobicContact CD2-CB 4.1Å; Y300-C473 HydrophobicContact CG-CB 4.45Å; Y300-K657 HydrophobicContact CE1-CD 3.86Å; Y300-K657 HydrophobicContact CE2-CD 4.1Å; Y300-K657 VanDerWaalsContact CZ-CD 3.44Å; Y300-K657 WeakPolarHBondContact OH-CD 3.26Å
301	L	94.5	Very high	89.8	Confident	6 Å²	6	42.9 Å²	42.9	3%	0.031	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-24.7	-175.6	-55.9	-172.7	0	0	0	113.1	L299 E303 V310 F329 I426 A427 L444 G446 I448	L299-L301 HydrophobicContact CD2-CD2 4.03Å; L299-L301 HydrophobicContact CG-CD2 4.15Å; L301-E303 VanDerWaalsContact C-N 3.32Å; L301-E303 PolarHBondContact O-N 2.83Å; L301-V310 WeakPolarHBondContact O-CG2 3.46Å; L301-F329 HydrophobicContact CD1-CD2 4.22Å; L301-F329 HydrophobicContact CD1-CE2 3.7Å; L301-I426 HydrophobicContact CD2-CG2 4.04Å; L301-A427 HydrophobicContact CB-CB 3.52Å; L301-A427 HydrophobicContact CD1-CB 4.48Å; L301-A427 HydrophobicContact CD2-CB 3.75Å; L301-A427 HydrophobicContact CG-CB 4.06Å; L301-A427 WeakPolarHBondContact O-CB 3.15Å; L301-L444 CarbonylContact C-O 3.53Å; L301-L444 VanDerWaalsContact C-O 3.3Å; L301-L444 HydrophobicContact CB-CG 4.47Å; L301-L444 WeakPolarHBondContact CB-O 3.38Å; L301-L444 HydrophobicContact CD1-CD2 3.57Å; L301-L444 HydrophobicContact CD1-CG 4.1Å; L301-G446 WeakPolarHBondContact CB-O 3.43Å; L301-G446 WeakPolarHBondContact CG-O 3.38Å; L301-G446 PolarHBondContact N-O 3Å; L301-I448 HydrophobicContact CD1-CD1 3.73Å; L301-I448 HydrophobicContact CD1-CG1 3.81Å; L301-I448 HydrophobicContact CD2-CB 4.29Å; L301-I448 HydrophobicContact CD2-CD1 3.44Å; L301-I448 VanDerWaalsContact CD2-CD1 3.44Å; L301-I448 HydrophobicContact CD2-CG1 3.69Å; L301-I448 HydrophobicContact CG-CD1 4.14Å; L301-I448 HydrophobicContact CG-CG1 4.1Å
302	G	91.6	Very high	89.8	Confident	13 Å²	13	47.3 Å²	47.3	13%	0.134	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	22	-177.9	0	0	0	0	0	114.5	Y300 Q304 L444	Y300-G302 VanDerWaalsContact CE1-CA 3.43Å; Y300-G302 WeakPolarHBondContact CE1-O 3.29Å; Y300-G302 VanDerWaalsContact CZ-CA 3.42Å; G302-Q304 PolarHBondContact O-N 3.43Å; G302-Q304 VanDerWaalsContact O-N 3.13Å; G302-L444 WeakPolarHBondContact CA-O 3.14Å; G302-L444 PolarHBondContact N-O 3.46Å
303	E	88.9	Confident	89.9	Confident	22 Å²	22	44.7 Å²	44.7	10%	0.103	23%	0.225	C	C	.	.	S	Bend	trans	-54.7	-36.3	-171.7	-173.6	-170.8	-168.7	0	0	112.3	Y300 L301 V310 S470 K471 N654	Y300-E303 HydrophobicContact CD1-CB 4.28Å; Y300-E303 VanDerWaalsContact CE1-N 3.32Å; L301-E303 VanDerWaalsContact C-N 3.32Å; L301-E303 PolarHBondContact O-N 2.83Å; E303-V310 HydrophobicContact CB-CG1 4.43Å; E303-V310 HydrophobicContact CB-CG2 4.18Å; E303-S470 PolarHBondContact OE1-OG 3.4Å; E303-K471 WeakPolarHBondContact OE2-CG 3.33Å; E303-N654 WeakPolarHBondContact O-CB 3.04Å
304	Q	86.8	Confident	89.9	Confident	81 Å²	81	45.7 Å²	45.7	38%	0.379	23%	0.225	S	C	.	.			trans	-124.5	126.5	-176.5	-61.5	-171.8	-3.1	0	0	111.7	G302 A306 G307	G302-Q304 PolarHBondContact O-N 3.43Å; G302-Q304 VanDerWaalsContact O-N 3.13Å; Q304-A306 PolarHBondContact O-N 2.9Å; Q304-G307 PolarHBondContact O-N 2.9Å
305	F	89.7	Confident	89.7	Confident	21 Å²	21	43.4 Å²	43.4	9%	0.092	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-22.6	176.6	-177.6	-113.2	0	0	0	114	G307 R443 A649 K652 N654	F305-G307 PolarHBondContact O-N 2.86Å; F305-R443 PolarHBondContact O-NE 3.09Å; F305-A649 HydrophobicContact CZ-CB 4.13Å; F305-A649 VanDerWaalsContact CZ-O 3.27Å; F305-A649 WeakPolarHBondContact CZ-O 3.46Å; F305-K652 HydrophobicContact CD1-CB 4.15Å; F305-K652 HydrophobicContact CD2-CB 3.64Å; F305-K652 HydrophobicContact CD2-CD 4.15Å; F305-K652 HydrophobicContact CD2-CG 4.44Å; F305-K652 HydrophobicContact CE1-CB 4.26Å; F305-K652 HydrophobicContact CE2-CB 3.72Å; F305-K652 HydrophobicContact CE2-CD 4.34Å; F305-K652 HydrophobicContact CG-CB 3.83Å; F305-K652 HydrophobicContact CZ-CB 4.03Å; F305-N654 PolarHBondContact N-OD1 2.88Å
306	A	87.3	Confident	89.7	Confident	58 Å²	58	47.6 Å²	47.6	48%	0.479	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-11	-179.4	0	0	0	0	0	114	Q304 F308	Q304-A306 PolarHBondContact O-N 2.9Å; A306-F308 HydrophobicContact CB-CD2 3.39Å; A306-F308 HydrophobicContact CB-CE2 3.42Å; A306-F308 VanDerWaalsContact CB-CE2 3.42Å; A306-F308 HydrophobicContact CB-CG 4.18Å; A306-F308 HydrophobicContact CB-CZ 4.23Å; A306-F308 PolarHBondContact O-N 3.48Å
307	G	81.8	Confident	89.8	Confident	8 Å²	8	45.8 Å²	45.8	8%	0.082	22%	0.215	C	C	.	.			trans	73.5	13.5	-178.5	0	0	0	0	0	113.4	Q304 F305 G428 L429	Q304-G307 PolarHBondContact O-N 2.9Å; F305-G307 PolarHBondContact O-N 2.86Å; G307-G428 WeakPolarHBondContact O-CA 3.44Å; G307-L429 PolarHBondContact O-N 2.86Å
308	F	86.2	Confident	89.8	Confident	93 Å²	93	46.2 Å²	46.2	41%	0.408	23%	0.225	S	C	.	.			trans	-72.3	147.3	172.7	-63.5	-49.2	0	0	0	110.6	A306 V310 N431	A306-F308 HydrophobicContact CB-CD2 3.39Å; A306-F308 HydrophobicContact CB-CE2 3.42Å; A306-F308 VanDerWaalsContact CB-CE2 3.42Å; A306-F308 HydrophobicContact CB-CG 4.18Å; A306-F308 HydrophobicContact CB-CZ 4.23Å; A306-F308 PolarHBondContact O-N 3.48Å; F308-V310 PolarHBondContact O-N 2.96Å; F308-N431 WeakPolarHBondContact CE1-OD1 3.44Å
309	P	88.5	Confident	89.5	Confident	31 Å²	31	49.9 Å²	49.9	20%	0.201	24%	0.242	C	C	.	.			trans	-57	129.4	176.8	-25.8	36.3	0	0	0	112.4	Y425 I426 L429	P309-Y425 HydrophobicContact CB-CD1 3.95Å; P309-Y425 HydrophobicContact CB-CG 4.37Å; P309-Y425 HydrophobicContact CG-CD1 3.62Å; P309-Y425 HydrophobicContact CG-CG 4.05Å; P309-I426 CarbonylContact C-O 3.5Å; P309-I426 WeakPolarHBondContact CA-O 3.16Å; P309-L429 WeakPolarHBondContact CD-O 3.46Å
310	V	87.8	Confident	89.1	Confident	16 Å²	16	57 Å²	57	10%	0.097	28%	0.28	C	S	.	.	S	Bend	trans	-70.5	-37.9	176.9	179.5	0	0	0	0	111.1	L299 L301 E303 F308 I426 A427	L299-V310 HydrophobicContact CD1-CG1 3.9Å; L301-V310 WeakPolarHBondContact O-CG2 3.46Å; E303-V310 HydrophobicContact CB-CG1 4.43Å; E303-V310 HydrophobicContact CB-CG2 4.18Å; F308-V310 PolarHBondContact O-N 2.96Å; V310-I426 PolarHBondContact N-O 2.95Å; V310-A427 HydrophobicContact CB-CB 4.26Å; V310-A427 HydrophobicContact CG2-CB 3.81Å
311	I	88.9	Confident	88.8	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.6	177.1	-55	-170.8	0	0	0	109.5	L299 L313 Y425 I426 V461 V464	L299-I311 HydrophobicContact CD1-CD1 3.9Å; L299-I311 HydrophobicContact CD1-CG1 4.34Å; L299-I311 HydrophobicContact CD2-CD1 3.46Å; L299-I311 VanDerWaalsContact CD2-CD1 3.46Å; L299-I311 HydrophobicContact CD2-CG1 4.04Å; L299-I311 HydrophobicContact CG-CD1 4.31Å; I311-L313 HydrophobicContact CG2-CD1 4.46Å; I311-L313 HydrophobicContact CG2-CD2 3.8Å; I311-L313 HydrophobicContact CG2-CG 3.88Å; I311-Y425 WeakPolarHBondContact O-CA 3.34Å; I311-I426 HydrophobicContact CB-CB 4.14Å; I311-I426 HydrophobicContact CB-CG1 4.26Å; I311-I426 PolarHBondContact O-N 3.48Å; I311-V461 HydrophobicContact CD1-CG1 3.47Å; I311-V461 VanDerWaalsContact CD1-CG1 3.47Å; I311-V461 HydrophobicContact CG2-CG1 4.23Å; I311-V464 HydrophobicContact CD1-CG1 4.43Å; I311-V464 HydrophobicContact CG1-CG1 4.47Å
312	Y	90.6	Very high	88.6	Confident	112 Å²	112	61.6 Å²	61.6	44%	0.439	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.4	171.7	168.1	-105.6	0	0	0	109.8	K423 Y425	Y312-K423 HydrophobicContact CE2-CB 3.91Å; Y312-K423 HydrophobicContact CE2-CD 4.12Å; Y312-K423 HydrophobicContact CE2-CG 3.99Å; Y312-Y425 AromaticContact CD2-CD1 3.58Å; Y312-Y425 HydrophobicContact CD2-CD1 3.58Å; Y312-Y425 AromaticContact CD2-CE1 3.27Å; Y312-Y425 HydrophobicContact CD2-CE1 3.27Å; Y312-Y425 HydrophobicContact CD2-CG 4.36Å; Y312-Y425 AromaticContact CD2-CZ 3.84Å; Y312-Y425 HydrophobicContact CE2-CD1 4.32Å; Y312-Y425 AromaticContact CE2-CE1 3.61Å; Y312-Y425 HydrophobicContact CE2-CE1 3.61Å; Y312-Y425 HydrophobicContact CE2-CE2 4.45Å; Y312-Y425 AromaticContact CE2-CZ 3.72Å; Y312-Y425 HydrophobicContact CG-CD1 4.48Å; Y312-Y425 HydrophobicContact CG-CE1 4.33Å
313	L	89.9	Confident	88.6	Confident	28 Å²	28	61.1 Å²	61.1	15%	0.147	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.8	177.9	-56.7	176.2	0	0	0	109.9	I311 F315 K423 V424 L453 V461	I311-L313 HydrophobicContact CG2-CD1 4.46Å; I311-L313 HydrophobicContact CG2-CD2 3.8Å; I311-L313 HydrophobicContact CG2-CG 3.88Å; L313-F315 HydrophobicContact CB-CD2 4.37Å; L313-F315 HydrophobicContact CB-CE2 3.63Å; L313-F315 HydrophobicContact CB-CZ 4.08Å; L313-F315 HydrophobicContact CD1-CE2 4.14Å; L313-F315 HydrophobicContact CD1-CZ 3.97Å; L313-K423 CarbonylContact O-C 3.6Å; L313-K423 WeakPolarHBondContact O-CA 3.33Å; L313-V424 HydrophobicContact CB-CB 4.44Å; L313-V424 PolarHBondContact N-O 2.03Å; L313-V424 PolarHBondContact O-N 3.1Å; L313-L453 HydrophobicContact CD1-CD1 3.78Å; L313-V461 HydrophobicContact CD1-CG2 3.8Å; L313-V461 HydrophobicContact CD2-CG2 3.99Å
314	R	91.3	Very high	88.9	Confident	156 Å²	156	60.4 Å²	60.4	59%	0.589	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.9	173.4	-174.4	179.7	179.2	179.5	0.4	109.5	E421	R314-E421 IonicContact CZ-OE2 3.07Å; R314-E421 IonicContact NE-OE2 3.73Å; R314-E421 IonicContact NH2-OE2 3.39Å; R314-E421 PolarHBondContact NH2-OE2 3.01Å
315	F	89.5	Confident	89.2	Confident	31 Å²	31	56.7 Å²	56.7	14%	0.136	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.1	177.7	-63.6	-84.7	0	0	0	110.5	L313 L317 E421 T422 V424 L453 M454 Q456	L313-F315 HydrophobicContact CB-CD2 4.37Å; L313-F315 HydrophobicContact CB-CE2 3.63Å; L313-F315 HydrophobicContact CB-CZ 4.08Å; L313-F315 HydrophobicContact CD1-CE2 4.14Å; L313-F315 HydrophobicContact CD1-CZ 3.97Å; F315-L317 HydrophobicContact CB-CD1 3.92Å; F315-L317 HydrophobicContact CB-CG 4.1Å; F315-L317 HydrophobicContact CD1-CD1 4.42Å; F315-L317 HydrophobicContact CG-CD1 4.44Å; F315-E421 WeakPolarHBondContact O-CA 3.45Å; F315-T422 PolarHBondContact N-O 2.9Å; F315-T422 PolarHBondContact O-N 3.05Å; F315-V424 HydrophobicContact CD2-CG2 3.89Å; F315-V424 HydrophobicContact CE2-CB 4.16Å; F315-V424 HydrophobicContact CE2-CG2 3.75Å; F315-L453 HydrophobicContact CZ-CB 4.12Å; F315-M454 HydrophobicContact CD1-CB 4.24Å; F315-M454 HydrophobicContact CD1-CG 4.28Å; F315-M454 HydrophobicContact CD2-CG 4.07Å; F315-M454 HydrophobicContact CE1-CB 4.33Å; F315-M454 HydrophobicContact CE1-CG 4.45Å; F315-M454 HydrophobicContact CE2-CG 4.24Å; F315-M454 HydrophobicContact CG-CG 4.08Å; F315-M454 HydrophobicContact CZ-CG 4.43Å; F315-Q456 HydrophobicContact CD1-CG 4.05Å; F315-Q456 HydrophobicContact CE1-CB 4.19Å; F315-Q456 HydrophobicContact CE1-CG 3.98Å
316	R	91.1	Very high	89.5	Confident	159 Å²	159	60 Å²	60	60%	0.6	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	97.3	172.1	-172.8	174.2	-166.7	-164.1	-0.6	108.7	K419 L420 E421	R316-K419 HydrophobicContact CG-CD 4.02Å; R316-L420 WeakPolarHBondContact CA-O 3.37Å; R316-E421 HydrophobicContact CG-CG 4.2Å; R316-E421 IonicContact CZ-OE1 3.87Å; R316-E421 IonicContact NE-OE1 3.32Å; R316-E421 PolarHBondContact NE-OE1 3.2Å
317	L	90.2	Very high	89.9	Confident	15 Å²	15	57.5 Å²	57.5	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	165.5	-165.7	-61.8	171.3	0	0	0	111.2	F315 T321 L420 M454 Q456	F315-L317 HydrophobicContact CB-CD1 3.92Å; F315-L317 HydrophobicContact CB-CG 4.1Å; F315-L317 HydrophobicContact CD1-CD1 4.42Å; F315-L317 HydrophobicContact CG-CD1 4.44Å; L317-T321 HydrophobicContact CB-CG2 4.32Å; L317-T321 HydrophobicContact CD1-CG2 3.98Å; L317-L420 PolarHBondContact N-O 3.05Å; L317-L420 PolarHBondContact O-N 2.95Å; L317-M454 HydrophobicContact CD1-CB 3.67Å; L317-M454 HydrophobicContact CD1-CE 3.63Å; L317-M454 HydrophobicContact CD1-CG 4.09Å; L317-Q456 HydrophobicContact CD2-CG 4.17Å
318	P	90.4	Very high	90.5	Very high	90 Å²	90	58.9 Å²	58.9	58%	0.584	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.2	148.3	170.9	-23.7	34.5	0	0	0	111.9	N320 T321	P318-N320 VanDerWaalsContact C-N 3.26Å; P318-N320 PolarHBondContact O-N 2.92Å; P318-T321 WeakPolarHBondContact O-CB 3.42Å; P318-T321 PolarHBondContact O-N 2.74Å; P318-T321 VanDerWaalsContact O-N 3.11Å; P318-T321 PolarHBondContact O-OG1 2.87Å
319	E	85.6	Confident	91	Very high	92 Å²	92	54.5 Å²	54.5	43%	0.43	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.8	-175.2	174.2	161.8	-143.2	0	0	114.7	T321 S415	E319-T321 PolarHBondContact O-N 2.82Å; E319-S415 WeakPolarHBondContact OE1-CB 3.46Å; E319-S415 PolarHBondContact OE1-OG 3.03Å
320	N	84.6	Confident	91.4	Very high	152 Å²	152	53.9 Å²	53.9	81%	0.813	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	11	-177.8	-60.1	-17.4	0	0	0	113.7	P318 K322	P318-N320 VanDerWaalsContact C-N 3.26Å; P318-N320 PolarHBondContact O-N 2.92Å; N320-K322 PolarHBondContact O-N 2.84Å
321	T	89.8	Confident	91.9	Very high	34 Å²	34	53.3 Å²	53.3	21%	0.209	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-76.1	122.4	-177.4	-50.9	0	0	0	0	110	L317 P318 E319 L420 M454	L317-T321 HydrophobicContact CB-CG2 4.32Å; L317-T321 HydrophobicContact CD1-CG2 3.98Å; P318-T321 WeakPolarHBondContact O-CB 3.42Å; P318-T321 PolarHBondContact O-N 2.74Å; P318-T321 VanDerWaalsContact O-N 3.11Å; P318-T321 PolarHBondContact O-OG1 2.87Å; E319-T321 PolarHBondContact O-N 2.82Å; T321-L420 WeakPolarHBondContact O-CD2 3.43Å; T321-M454 HydrophobicContact CG2-CE 4.06Å
322	K	90.6	Very high	92.3	Very high	76 Å²	76	54 Å²	54	33%	0.33	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-85.1	150.3	174.4	-62.7	-166.1	-178.9	-170.5	0	111.2	N320 A324 E389 L390	N320-K322 PolarHBondContact O-N 2.84Å; K322-A324 PolarHBondContact O-N 3.17Å; K322-E389 WeakPolarHBondContact CA-OE2 3.27Å; K322-E389 HydrophobicContact CB-CB 4.16Å; K322-E389 HydrophobicContact CB-CG 4.35Å; K322-E389 HydrophobicContact CD-CG 4.45Å; K322-E389 WeakPolarHBondContact CD-O 3.35Å; K322-L390 PolarHBondContact NZ-O 3.36Å
323	F	92.3	Very high	92.6	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.009	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-65.6	129.8	174	-177.5	-109.8	0	0	0	110.8	A325 L339 A341 F349 V387 E389 L412 F413 M454	F323-A325 HydrophobicContact CE1-CB 4.29Å; F323-A325 HydrophobicContact CZ-CB 3.97Å; F323-L339 HydrophobicContact CE2-CD2 4.48Å; F323-L339 HydrophobicContact CZ-CD2 3.79Å; F323-A341 HydrophobicContact CE2-CB 4.13Å; F323-F349 AromaticContact CE1-CD1 3.7Å; F323-F349 HydrophobicContact CE1-CD1 3.7Å; F323-F349 AromaticContact CE1-CE1 3.6Å; F323-F349 HydrophobicContact CE1-CE1 3.6Å; F323-F349 HydrophobicContact CE1-CG 4.31Å; F323-F349 HydrophobicContact CE1-CZ 4.13Å; F323-F349 AromaticContact CZ-CD1 3.9Å; F323-F349 HydrophobicContact CZ-CD1 3.9Å; F323-F349 HydrophobicContact CZ-CE1 4.02Å; F323-V387 HydrophobicContact CD1-CG1 4.12Å; F323-V387 HydrophobicContact CE1-CB 4.24Å; F323-V387 HydrophobicContact CE1-CG1 3.87Å; F323-E389 HydrophobicContact CB-CB 4.11Å; F323-E389 PolarHBondContact N-OE2 3.36Å; F323-E389 WeakPolarHBondContact O-CB 3.07Å; F323-E389 PolarHBondContact O-N 2.92Å; F323-L412 HydrophobicContact CB-CD2 3.92Å; F323-L412 HydrophobicContact CD1-CD2 3.96Å; F323-L412 HydrophobicContact CG-CD2 4.03Å; F323-F413 HydrophobicContact CB-CD2 4.22Å; F323-F413 HydrophobicContact CB-CE2 3.75Å; F323-F413 AromaticContact CD2-CE2 3.49Å; F323-F413 HydrophobicContact CD2-CE2 3.49Å; F323-F413 VanDerWaalsContact CD2-CE2 3.49Å; F323-F413 HydrophobicContact CD2-CZ 4.11Å; F323-F413 HydrophobicContact CE2-CE2 4.29Å; F323-F413 AromaticContact CG-CE2 3.77Å; F323-F413 HydrophobicContact CG-CE2 3.77Å; F323-F413 HydrophobicContact CG-CZ 4.44Å; F323-M454 HydrophobicContact CD2-SD 3.51Å; F323-M454 VanDerWaalsContact CD2-SD 3.51Å; F323-M454 HydrophobicContact CE2-SD 4.15Å; F323-M454 HydrophobicContact CG-SD 4.44Å
324	A	93.7	Very high	92.9	Very high	8 Å²	8	49.4 Å²	49.4	7%	0.066	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	134.5	173.9	0	0	0	0	0	109.2	K322 V387 M454	K322-A324 PolarHBondContact O-N 3.17Å; A324-V387 CarbonylContact C-O 3.58Å; A324-V387 VanDerWaalsContact CA-O 3.31Å; A324-V387 WeakPolarHBondContact CA-O 3.49Å; A324-M454 PolarHBondContact O-N 3.19Å
325	A	94.3	Very high	93.1	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.017	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	127	174.1	0	0	0	0	0	109.4	F323 F327 L339 S386 V387 L453	F323-A325 HydrophobicContact CE1-CB 4.29Å; F323-A325 HydrophobicContact CZ-CB 3.97Å; A325-F327 HydrophobicContact CB-CE1 4.39Å; A325-L339 HydrophobicContact CB-CD1 4.41Å; A325-S386 CarbonylContact O-C 3.58Å; A325-S386 VanDerWaalsContact O-CA 3.28Å; A325-S386 WeakPolarHBondContact O-CA 3.34Å; A325-V387 PolarHBondContact N-O 2.83Å; A325-V387 PolarHBondContact O-N 3Å; A325-L453 HydrophobicContact CB-CD2 3.59Å
326	E	95.3	Very high	93.4	Very high	91 Å²	91	43 Å²	43	43%	0.425	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.3	174.7	-176.5	178.1	-177	0	0	109.1	V384 I385 W451 N452	E326-V384 HydrophobicContact CG-CG1 4.34Å; E326-I385 WeakPolarHBondContact CA-O 2.98Å; E326-W451 CarbonylContact O-C 3.37Å; E326-W451 VanDerWaalsContact O-CA 3.26Å; E326-W451 WeakPolarHBondContact O-CA 3.43Å; E326-N452 PolarHBondContact N-O 3.45Å; E326-N452 PolarHBondContact O-N 2.84Å
327	F	94.9	Very high	93.5	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.026	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	156.2	177	51.2	-94.9	0	0	0	111.9	A325 F329 V338 L351 I385 I448 W451	A325-F327 HydrophobicContact CB-CE1 4.39Å; F327-F329 HydrophobicContact CD2-CB 3.94Å; F327-F329 HydrophobicContact CE2-CB 3.9Å; F327-F329 HydrophobicContact CE2-CG 4.47Å; F327-V338 HydrophobicContact CE2-CG1 3.73Å; F327-V338 HydrophobicContact CZ-CG1 3.61Å; F327-L351 HydrophobicContact CE1-CD2 4.3Å; F327-L351 HydrophobicContact CZ-CD2 3.71Å; F327-I385 HydrophobicContact CD2-CB 4.31Å; F327-I385 HydrophobicContact CE2-CB 3.88Å; F327-I385 HydrophobicContact CE2-CG1 4.25Å; F327-I385 HydrophobicContact CE2-CG2 4.31Å; F327-I385 HydrophobicContact CZ-CB 4.2Å; F327-I385 HydrophobicContact CZ-CG2 4.17Å; F327-I385 PolarHBondContact N-O 2.84Å; F327-I385 PolarHBondContact O-N 2.8Å; F327-I448 HydrophobicContact CB-CG2 3.69Å; F327-I448 HydrophobicContact CD2-CD1 4.34Å; F327-I448 HydrophobicContact CD2-CG1 4.37Å; F327-I448 HydrophobicContact CD2-CG2 3.93Å; F327-I448 HydrophobicContact CE2-CD1 4.4Å; F327-I448 HydrophobicContact CG-CG2 3.99Å; F327-W451 HydrophobicContact CB-CB 3.93Å
328	D	96	Very high	93.8	Very high	36 Å²	36	34.8 Å²	34.8	19%	0.193	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.3	167.9	-78.7	2	0	0	0	108.9	W382 V384 I448 R449	D328-W382 HydrophobicContact CB-CE3 3.74Å; D328-W382 HydrophobicContact CB-CZ3 4.03Å; D328-V384 WeakPolarHBondContact OD1-CG2 3.01Å; D328-I448 VanDerWaalsContact O-CA 3.25Å; D328-I448 WeakPolarHBondContact O-CA 3.32Å; D328-I448 WeakPolarHBondContact O-CG2 3.46Å; D328-R449 HydrophobicContact CB-CG 3.51Å; D328-R449 PolarHBondContact N-O 2.97Å; D328-R449 PolarHBondContact O-N 3.39Å; D328-R449 IonicContact OD2-CZ 2.75Å; D328-R449 IonicContact OD2-NE 3.9Å; D328-R449 PolarHBondContact OD2-NE 2.81Å; D328-R449 IonicContact OD2-NH2 2.74Å; D328-R449 PolarHBondContact OD2-NH2 2.87Å
329	F	96.6	Very high	94	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.4	-179	175.3	-105.1	0	0	0	111.9	L301 F327 T331 V338 L353 I377 H383 I385 L444 C447 I448	L301-F329 HydrophobicContact CD1-CD2 4.22Å; L301-F329 HydrophobicContact CD1-CE2 3.7Å; F327-F329 HydrophobicContact CD2-CB 3.94Å; F327-F329 HydrophobicContact CE2-CB 3.9Å; F327-F329 HydrophobicContact CE2-CG 4.47Å; F329-T331 HydrophobicContact CE1-CG2 3.5Å; F329-T331 HydrophobicContact CZ-CG2 3.47Å; F329-T331 VanDerWaalsContact CZ-CG2 3.47Å; F329-V338 HydrophobicContact CE2-CG2 4.17Å; F329-V338 HydrophobicContact CZ-CG2 4.19Å; F329-L353 HydrophobicContact CE1-CD1 3.71Å; F329-L353 HydrophobicContact CZ-CD1 3.63Å; F329-I377 HydrophobicContact CD1-CD1 3.85Å; F329-I377 HydrophobicContact CE1-CD1 4Å; F329-H383 PolarHBondContact N-O 2.02Å; F329-H383 PolarHBondContact O-N 3.38Å; F329-I385 HydrophobicContact CB-CG1 3.99Å; F329-L444 HydrophobicContact CE2-CD2 4.05Å; F329-L444 HydrophobicContact CZ-CD1 4.45Å; F329-L444 HydrophobicContact CZ-CD2 4.15Å; F329-C447 WeakPolarHBondContact CA-O 3.42Å; F329-I448 HydrophobicContact CD2-CG1 3.85Å
330	R	96.7	Very high	94.4	Very high	19 Å²	19	26.6 Å²	26.6	7%	0.072	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	137.4	176.5	175.8	-179.8	66.5	176	3.1	110.3	G380 Q381 W382 G446 C447 F474 V475	R330-G380 WeakPolarHBondContact CD-O 3.28Å; R330-G380 WeakPolarHBondContact CG-O 3.46Å; R330-Q381 WeakPolarHBondContact CA-O 3.24Å; R330-Q381 WeakPolarHBondContact CB-O 3.08Å; R330-Q381 WeakPolarHBondContact CG-O 3.21Å; R330-W382 HydrophobicContact CB-CD2 3.84Å; R330-W382 HydrophobicContact CB-CE3 3.73Å; R330-W382 HydrophobicContact CB-CG 4.38Å; R330-W382 HydrophobicContact CB-CH2 4.42Å; R330-W382 HydrophobicContact CB-CZ2 4.49Å; R330-W382 HydrophobicContact CB-CZ3 4.04Å; R330-G446 WeakPolarHBondContact O-CA 3.41Å; R330-C447 PolarHBondContact N-O 2.81Å; R330-C447 PolarHBondContact O-N 2.83Å; R330-F474 PolarHBondContact NH2-O 2.97Å; R330-V475 PolarHBondContact NH1-O 2.93Å; R330-V475 PolarHBondContact NH2-O 2.84Å
331	T	97.5	Very high	94.8	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.025	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	162.5	173.5	-169.5	0	0	0	0	112	F329 D333 L353 N378 D379 G380 D445	F329-T331 HydrophobicContact CE1-CG2 3.5Å; F329-T331 HydrophobicContact CZ-CG2 3.47Å; F329-T331 VanDerWaalsContact CZ-CG2 3.47Å; T331-D333 WeakPolarHBondContact OG1-CB 3.4Å; T331-D333 PolarHBondContact OG1-N 3.06Å; T331-L353 HydrophobicContact CG2-CD1 3.61Å; T331-N378 HydrophobicContact CG2-CB 4.02Å; T331-N378 CarbonylContact O-C 3.56Å; T331-N378 WeakPolarHBondContact O-CA 3.28Å; T331-D379 PolarHBondContact O-N 3.42Å; T331-G380 PolarHBondContact O-N 2.93Å; T331-D445 PolarHBondContact OG1-O 2.9Å
332	F	97.6	Very high	94.9	Very high	20 Å²	20	19.3 Å²	19.3	9%	0.088	10%	0.095	C	C	.	.			trans	-107.2	-11.4	159.4	-75.1	-64.7	0	0	0	112.7	N378 D379 G380 V477 R479 H659	F332-N378 PolarHBondContact O-ND2 2.86Å; F332-D379 VanDerWaalsContact CE1-O 3.31Å; F332-D379 WeakPolarHBondContact CE1-O 3.17Å; F332-G380 VanDerWaalsContact CZ-CA 3.47Å; F332-V477 HydrophobicContact CE2-CB 4.33Å; F332-V477 HydrophobicContact CE2-CG2 3.96Å; F332-R479 HydrophobicContact CD1-CB 4.22Å; F332-R479 HydrophobicContact CE1-CB 4.16Å; F332-R479 HydrophobicContact CG-CB 4.39Å; F332-R479 HydrophobicContact CZ-CB 4.3Å; F332-H659 HydrophobicContact CB-CB 4.14Å; F332-H659 VanDerWaalsContact CB-O 3.28Å; F332-H659 WeakPolarHBondContact CB-O 3.29Å
333	D	96.9	Very high	94.9	Very high	2 Å²	2	17 Å²	17	1%	0.011	9%	0.088	C	C	.	.			trans	-65.4	127.7	-178.6	-157.5	-31.3	0	0	0	111.1	T331 E335 N378 L444 D445 H659	T331-D333 WeakPolarHBondContact OG1-CB 3.4Å; T331-D333 PolarHBondContact OG1-N 3.06Å; D333-E335 PolarHBondContact OD1-N 3.19Å; D333-E335 VanDerWaalsContact OD1-N 3.16Å; D333-N378 VanDerWaalsContact O-CB 3.32Å; D333-N378 WeakPolarHBondContact O-CB 3.47Å; D333-L444 HydrophobicContact CB-CD1 3.78Å; D333-D445 HydrophobicContact CB-CB 4.42Å; D333-D445 PolarHBondContact OD2-N 2.81Å; D333-H659 HydrophobicContact CB-CB 4.27Å; D333-H659 IonicContact OD1-CE1 3.93Å; D333-H659 PolarHBondContact OD1-CE1 2.98Å; D333-H659 IonicContact OD1-ND1 2.87Å; D333-H659 PolarHBondContact OD1-ND1 3.06Å; D333-H659 IonicContact OD2-CE1 3.31Å; D333-H659 IonicContact OD2-ND1 3.22Å; D333-H659 PolarHBondContact OD2-ND1 3.37Å
334	P	95.8	Very high	94.5	Very high	42 Å²	42	18.2 Å²	18.2	27%	0.273	10%	0.099	S	C	.	.	S	Bend	trans	-78	-19.7	178.2	31.5	-36.8	0	0	0	114.4	R354 A355 G356	P334-R354 CarbonylContact O-C 3.59Å; P334-R354 WeakPolarHBondContact O-CA 3.06Å; P334-A355 PolarHBondContact O-N 2.71Å; P334-G356 PolarHBondContact O-N 2.7Å
335	E	95.8	Very high	93.9	Very high	52 Å²	52	22.6 Å²	22.6	24%	0.243	13%	0.126	C	C	.	.	S	Bend	trans	-136	154.9	-175.9	-175	156	160.9	0	0	111.1	D333 L353 R354 I440 N441	D333-E335 PolarHBondContact OD1-N 3.19Å; D333-E335 VanDerWaalsContact OD1-N 3.16Å; E335-L353 WeakPolarHBondContact CA-O 3.35Å; E335-R354 IonicContact OE1-CZ 2.74Å; E335-R354 IonicContact OE1-NH1 2.84Å; E335-R354 PolarHBondContact OE1-NH1 2.99Å; E335-R354 IonicContact OE2-NH1 2.86Å; E335-R354 PolarHBondContact OE2-NH1 3.4Å; E335-I440 HydrophobicContact CG-CD1 4.3Å; E335-I440 HydrophobicContact CG-CG1 3.69Å; E335-I440 WeakPolarHBondContact OE1-CA 3.42Å; E335-I440 VanDerWaalsContact OE1-CG1 3.28Å; E335-I440 WeakPolarHBondContact OE1-CG1 3.4Å; E335-N441 HydrophobicContact CG-CB 4.39Å; E335-N441 PolarHBondContact OE1-N 3.43Å
336	G	95.2	Very high	93.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.7	163.9	176.7	0	0	0	0	0	114.1	G352 L353 N441 R443	G336-G352 CarbonylContact O-C 3.14Å; G336-G352 WeakPolarHBondContact O-CA 3.31Å; G336-L353 PolarHBondContact N-O 2.87Å; G336-L353 PolarHBondContact O-N 2.82Å; G336-N441 VanDerWaalsContact CA-O 3.3Å; G336-N441 WeakPolarHBondContact CA-O 3.44Å; G336-R443 WeakPolarHBondContact CA-O 3.27Å
337	V	94.9	Very high	93.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.9	176.4	173.9	0	0	0	0	109.5	M350 A427 L429 I440 P442	V337-M350 HydrophobicContact CG1-CG 4.15Å; V337-M350 HydrophobicContact CG1-SD 4.43Å; V337-M350 HydrophobicContact CG2-CG 4.44Å; V337-M350 HydrophobicContact CG2-SD 4.17Å; V337-A427 WeakPolarHBondContact O-CA 3.29Å; V337-L429 HydrophobicContact CG1-CD2 3.99Å; V337-L429 HydrophobicContact CG1-CG 4.43Å; V337-L429 HydrophobicContact CG2-CD1 4.25Å; V337-L429 HydrophobicContact CG2-CD2 4.11Å; V337-L429 HydrophobicContact CG2-CG 4.06Å; V337-I440 HydrophobicContact CG2-CD1 4.28Å; V337-I440 HydrophobicContact CG2-CG2 3.59Å; V337-P442 HydrophobicContact CB-CB 4.4Å; V337-P442 HydrophobicContact CG2-CB 4.18Å; V337-P442 PolarHBondContact N-O 2.82Å
338	V	95.2	Very high	93	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.012	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-48.9	177.4	-176.8	0	0	0	0	109.8	F327 F329 L351 A427 L444 I448	F327-V338 HydrophobicContact CE2-CG1 3.73Å; F327-V338 HydrophobicContact CZ-CG1 3.61Å; F329-V338 HydrophobicContact CE2-CG2 4.17Å; F329-V338 HydrophobicContact CZ-CG2 4.19Å; V338-L351 WeakPolarHBondContact CB-O 3.23Å; V338-L351 PolarHBondContact N-O 2.91Å; V338-A427 PolarHBondContact O-N 2.84Å; V338-L444 HydrophobicContact CB-CD2 4.4Å; V338-L444 HydrophobicContact CG2-CD2 3.67Å; V338-I448 HydrophobicContact CG1-CD1 3.86Å
339	L	94.5	Very high	92.9	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	134.9	-173.8	179.5	148.4	0	0	0	110.8	F323 A325 A341 F349 M350 L351 V424 Y425 I426 L453	F323-L339 HydrophobicContact CE2-CD2 4.48Å; F323-L339 HydrophobicContact CZ-CD2 3.79Å; A325-L339 HydrophobicContact CB-CD1 4.41Å; L339-A341 HydrophobicContact CD2-CB 4.17Å; L339-F349 HydrophobicContact CD2-CD1 3.99Å; L339-F349 HydrophobicContact CD2-CE1 4.12Å; L339-M350 WeakPolarHBondContact O-CA 3.3Å; L339-L351 HydrophobicContact CB-CB 4.4Å; L339-L351 PolarHBondContact N-O 3.17Å; L339-L351 PolarHBondContact O-N 3.31Å; L339-V424 HydrophobicContact CD1-CG1 3.84Å; L339-V424 HydrophobicContact CD2-CG1 4.47Å; L339-V424 HydrophobicContact CG-CG1 3.96Å; L339-Y425 WeakPolarHBondContact CA-O 3.49Å; L339-I426 HydrophobicContact CB-CD1 4.3Å; L339-I426 HydrophobicContact CD1-CD1 3.63Å; L339-I426 HydrophobicContact CG-CD1 3.99Å; L339-L453 HydrophobicContact CD1-CD2 3.78Å
340	Y	94.2	Very high	92.8	Very high	8 Å²	8	20.4 Å²	20.4	3%	0.031	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130	169.9	-178.2	-91.6	0	0	0	109.4	E342 W348 F349 M350 V424 Y425 L429 P430	Y340-E342 HydrophobicContact CE1-CB 4Å; Y340-E342 HydrophobicContact CE1-CG 4.33Å; Y340-W348 HydrophobicContact CE2-CB 4.24Å; Y340-W348 HydrophobicContact CE2-CD2 4.19Å; Y340-W348 AromaticContact CE2-CE3 3.88Å; Y340-W348 HydrophobicContact CE2-CE3 3.88Å; Y340-W348 HydrophobicContact CE2-CG 4.36Å; Y340-W348 WeakPolarHBondContact OH-CB 3.03Å; Y340-F349 CarbonylContact C-O 3.58Å; Y340-F349 WeakPolarHBondContact CA-O 3.46Å; Y340-M350 HydrophobicContact CD2-CB 3.9Å; Y340-M350 HydrophobicContact CD2-CG 4.08Å; Y340-M350 HydrophobicContact CE2-CB 4.49Å; Y340-V424 CarbonylContact O-C 3.47Å; Y340-V424 WeakPolarHBondContact O-CA 3.07Å; Y340-Y425 AromaticContact CD1-CD2 3.74Å; Y340-Y425 HydrophobicContact CD1-CD2 3.74Å; Y340-Y425 HydrophobicContact CD1-CE2 4.24Å; Y340-Y425 HydrophobicContact CE1-CD2 4.47Å; Y340-Y425 PolarHBondContact N-O 3.25Å; Y340-Y425 PolarHBondContact O-N 3.05Å; Y340-L429 HydrophobicContact CD2-CD2 3.69Å; Y340-L429 HydrophobicContact CE2-CD2 4.43Å; Y340-L429 HydrophobicContact CG-CD2 3.95Å; Y340-P430 HydrophobicContact CD1-CG 3.81Å; Y340-P430 HydrophobicContact CE1-CG 3.6Å
341	A	93.3	Very high	92.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.1	179.8	0	0	0	0	0	110.8	F323 L339 W348 F349 F413 T422 K423 V424	F323-A341 HydrophobicContact CE2-CB 4.13Å; L339-A341 HydrophobicContact CD2-CB 4.17Å; A341-W348 CarbonylContact O-C 3.58Å; A341-W348 WeakPolarHBondContact O-CA 3.35Å; A341-W348 WeakPolarHBondContact O-CB 3.38Å; A341-F349 PolarHBondContact N-O 2.98Å; A341-F349 PolarHBondContact O-N 3.07Å; A341-F413 HydrophobicContact CB-CE1 4.33Å; A341-F413 HydrophobicContact CB-CZ 3.65Å; A341-T422 HydrophobicContact CB-CG2 4.38Å; A341-K423 CarbonylContact C-O 3.03Å; A341-K423 VanDerWaalsContact CA-O 3.23Å; A341-K423 WeakPolarHBondContact CA-O 3.27Å; A341-V424 HydrophobicContact CB-CG2 4.09Å
342	E	91.6	Very high	92.7	Very high	34 Å²	34	19.3 Å²	19.3	16%	0.159	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.1	178.9	67.2	179.4	176.9	0	0	110.9	Y340 S347 W348 T422 K423 Y425	Y340-E342 HydrophobicContact CE1-CB 4Å; Y340-E342 HydrophobicContact CE1-CG 4.33Å; E342-S347 WeakPolarHBondContact CA-O 3.19Å; E342-W348 HydrophobicContact CB-CB 4.16Å; E342-T422 WeakPolarHBondContact O-CA 3.48Å; E342-K423 HydrophobicContact CG-CB 3.9Å; E342-K423 HydrophobicContact CG-CD 4.22Å; E342-K423 PolarHBondContact N-O 2.78Å; E342-K423 PolarHBondContact O-N 3.33Å; E342-K423 WeakPolarHBondContact OE1-CD 3.35Å; E342-K423 IonicContact OE1-NZ 3.94Å; E342-Y425 HydrophobicContact CG-CE2 3.96Å; E342-Y425 WeakPolarHBondContact OE1-CE2 3.47Å; E342-Y425 PolarHBondContact OE1-OH 2.89Å
343	S	90.1	Very high	92.6	Very high	26 Å²	26	18.4 Å²	18.4	18%	0.182	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-33.7	166	71.7	0	0	0	0	111.9	S347 T414 E421	S343-S347 PolarHBondContact N-O 3.12Å; S343-S347 WeakPolarHBondContact OG-CB 3.22Å; S343-T414 PolarHBondContact OG-N 3.39Å; S343-T414 PolarHBondContact OG-OG1 3.13Å; S343-E421 WeakPolarHBondContact CA-O 3.44Å; S343-E421 WeakPolarHBondContact CB-O 3.32Å
344	A	84.7	Confident	92.5	Very high	29 Å²	29	20.5 Å²	20.5	24%	0.24	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	164.5	179.2	0	0	0	0	0	109.7	D346 S347	A344-D346 PolarHBondContact O-N 2.85Å; A344-D346 VanDerWaalsContact O-N 3.09Å; A344-S347 PolarHBondContact N-O 3.23Å; A344-S347 CarbonylContact O-C 3.56Å; A344-S347 PolarHBondContact O-N 3.33Å; A344-S347 VanDerWaalsContact O-O 3.11Å
345	P	81.4	Confident	92.4	Very high	99 Å²	99	22 Å²	22	64%	0.643	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-31.5	-178.8	-28.1	36.1	0	0	0	115
346	D	83.5	Confident	92.4	Very high	85 Å²	85	19.6 Å²	19.6	46%	0.455	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	18.8	178	-64.7	-51.9	0	0	0	113.1	A344 K363 N364	A344-D346 PolarHBondContact O-N 2.85Å; A344-D346 VanDerWaalsContact O-N 3.09Å; D346-K363 WeakPolarHBondContact OD1-CE 3.3Å; D346-K363 IonicContact OD1-NZ 3.17Å; D346-K363 PolarHBondContact OD1-NZ 3.15Å; D346-N364 CarbonylContact O-C 3.58Å
347	S	89.6	Confident	92.4	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	90.4	179.7	-56.7	0	0	0	0	109.7	E342 S343 A344 K363 T414	E342-S347 WeakPolarHBondContact CA-O 3.19Å; S343-S347 PolarHBondContact N-O 3.12Å; S343-S347 WeakPolarHBondContact OG-CB 3.22Å; A344-S347 PolarHBondContact N-O 3.23Å; A344-S347 CarbonylContact O-C 3.56Å; A344-S347 PolarHBondContact O-N 3.33Å; A344-S347 VanDerWaalsContact O-O 3.11Å; S347-K363 CarbonylContact C-O 3.55Å; S347-K363 VanDerWaalsContact CA-O 3.28Å; S347-K363 WeakPolarHBondContact CA-O 3.47Å; S347-T414 WeakPolarHBondContact OG-CG2 3.37Å; S347-T414 PolarHBondContact OG-OG1 3.16Å
348	W	91.9	Very high	92.4	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.011	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	157.5	-175.2	61.1	-101.1	0	0	0	112.8	Y340 A341 E342 M350 Q361 F362 K363 N435	Y340-W348 HydrophobicContact CE2-CB 4.24Å; Y340-W348 HydrophobicContact CE2-CD2 4.19Å; Y340-W348 AromaticContact CE2-CE3 3.88Å; Y340-W348 HydrophobicContact CE2-CE3 3.88Å; Y340-W348 HydrophobicContact CE2-CG 4.36Å; Y340-W348 WeakPolarHBondContact OH-CB 3.03Å; A341-W348 CarbonylContact O-C 3.58Å; A341-W348 WeakPolarHBondContact O-CA 3.35Å; A341-W348 WeakPolarHBondContact O-CB 3.38Å; E342-W348 HydrophobicContact CB-CB 4.16Å; W348-M350 HydrophobicContact CE3-CB 4.42Å; W348-M350 HydrophobicContact CZ3-CB 4.17Å; W348-Q361 HydrophobicContact CH2-CB 4.09Å; W348-Q361 HydrophobicContact CZ3-CB 3.84Å; W348-Q361 WeakPolarHBondContact CZ3-O 3.45Å; W348-F362 VanDerWaalsContact O-CA 3.29Å; W348-F362 WeakPolarHBondContact O-CA 3.4Å; W348-F362 WeakPolarHBondContact O-CB 3.4Å; W348-K363 HydrophobicContact CD2-CB 4.06Å; W348-K363 VanDerWaalsContact CE2-CB 3.48Å; W348-K363 HydrophobicContact CG-CB 4.33Å; W348-K363 HydrophobicContact CZ2-CB 3.8Å; W348-K363 PolarHBondContact N-O 2.9Å; W348-K363 PolarHBondContact O-N 3.37Å; W348-N435 WeakPolarHBondContact CZ2-O 3.31Å
349	F	93.8	Very high	92.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138	-179.3	174.9	-90.9	0	0	0	109.8	F323 L339 Y340 A341 L351 V360 Q361 F362 V387 I394 L412 F413	F323-F349 AromaticContact CE1-CD1 3.7Å; F323-F349 HydrophobicContact CE1-CD1 3.7Å; F323-F349 AromaticContact CE1-CE1 3.6Å; F323-F349 HydrophobicContact CE1-CE1 3.6Å; F323-F349 HydrophobicContact CE1-CG 4.31Å; F323-F349 HydrophobicContact CE1-CZ 4.13Å; F323-F349 AromaticContact CZ-CD1 3.9Å; F323-F349 HydrophobicContact CZ-CD1 3.9Å; F323-F349 HydrophobicContact CZ-CE1 4.02Å; L339-F349 HydrophobicContact CD2-CD1 3.99Å; L339-F349 HydrophobicContact CD2-CE1 4.12Å; Y340-F349 CarbonylContact C-O 3.58Å; Y340-F349 WeakPolarHBondContact CA-O 3.46Å; A341-F349 PolarHBondContact N-O 2.98Å; A341-F349 PolarHBondContact O-N 3.07Å; F349-L351 HydrophobicContact CE1-CB 3.85Å; F349-L351 HydrophobicContact CZ-CB 4.24Å; F349-V360 HydrophobicContact CD2-CG1 4.18Å; F349-V360 HydrophobicContact CE2-CG1 3.44Å; F349-V360 VanDerWaalsContact CE2-CG1 3.44Å; F349-V360 HydrophobicContact CE2-CG2 4.47Å; F349-V360 HydrophobicContact CZ-CG1 4Å; F349-V360 HydrophobicContact CZ-CG2 4.27Å; F349-Q361 CarbonylContact C-O 3.49Å; F349-F362 HydrophobicContact CB-CB 4.45Å; F349-F362 HydrophobicContact CD2-CB 4.01Å; F349-V387 HydrophobicContact CE1-CG1 4.37Å; F349-V387 HydrophobicContact CE2-CG1 4.19Å; F349-V387 HydrophobicContact CZ-CG1 3.69Å; F349-V387 HydrophobicContact CZ-CG2 4.34Å; F349-I394 HydrophobicContact CD2-CD1 4.49Å; F349-I394 HydrophobicContact CE2-CG2 4.29Å; F349-L412 HydrophobicContact CB-CD1 4.11Å; F349-L412 HydrophobicContact CB-CD2 3.75Å; F349-L412 HydrophobicContact CB-CG 4.14Å; F349-L412 HydrophobicContact CD2-CD1 4.17Å; F349-L412 HydrophobicContact CD2-CD2 3.77Å; F349-L412 HydrophobicContact CG-CD2 3.9Å; F349-F413 HydrophobicContact CB-CE1 4.37Å; F349-F413 HydrophobicContact CB-CZ 4.1Å
350	M	94.5	Very high	92.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	132.2	177.6	-171.5	-82.9	-77.9	0	0	109.3	V337 L339 Y340 W348 G352 V360 Q361 I440	V337-M350 HydrophobicContact CG1-CG 4.15Å; V337-M350 HydrophobicContact CG1-SD 4.43Å; V337-M350 HydrophobicContact CG2-CG 4.44Å; V337-M350 HydrophobicContact CG2-SD 4.17Å; L339-M350 WeakPolarHBondContact O-CA 3.3Å; Y340-M350 HydrophobicContact CD2-CB 3.9Å; Y340-M350 HydrophobicContact CD2-CG 4.08Å; Y340-M350 HydrophobicContact CE2-CB 4.49Å; W348-M350 HydrophobicContact CE3-CB 4.42Å; W348-M350 HydrophobicContact CZ3-CB 4.17Å; M350-G352 PolarHBondContact SD-N 3.07Å; M350-V360 WeakPolarHBondContact O-CA 3.37Å; M350-Q361 HydrophobicContact CB-CB 4.37Å; M350-Q361 HydrophobicContact CE-CB 3.98Å; M350-Q361 HydrophobicContact CE-CG 3.55Å; M350-Q361 PolarHBondContact N-O 3.3Å; M350-Q361 PolarHBondContact O-N 2.74Å; M350-I440 HydrophobicContact CE-CD1 4.41Å; M350-I440 HydrophobicContact CE-CG2 4.28Å
351	L	95.7	Very high	92.5	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.9	170.5	179.5	72.7	0	0	0	108.2	F327 V338 L339 F349 I358 V360 I385 V387	F327-L351 HydrophobicContact CE1-CD2 4.3Å; F327-L351 HydrophobicContact CZ-CD2 3.71Å; V338-L351 WeakPolarHBondContact CB-O 3.23Å; V338-L351 PolarHBondContact N-O 2.91Å; L339-L351 HydrophobicContact CB-CB 4.4Å; L339-L351 PolarHBondContact N-O 3.17Å; L339-L351 PolarHBondContact O-N 3.31Å; F349-L351 HydrophobicContact CE1-CB 3.85Å; F349-L351 HydrophobicContact CZ-CB 4.24Å; L351-I358 HydrophobicContact CD1-CD1 4.44Å; L351-I358 HydrophobicContact CD1-CG2 3.39Å; L351-V360 HydrophobicContact CD1-CG2 3.71Å; L351-I385 HydrophobicContact CD2-CG2 4.23Å; L351-V387 HydrophobicContact CD1-CG2 4.37Å; L351-V387 HydrophobicContact CD2-CG2 4.06Å
352	G	95.5	Very high	92.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	-172.5	-179.5	0	0	0	0	0	112.3	G336 M350 I358 E359	G336-G352 CarbonylContact O-C 3.14Å; G336-G352 WeakPolarHBondContact O-CA 3.31Å; M350-G352 PolarHBondContact SD-N 3.07Å; G352-I358 WeakPolarHBondContact O-CA 3.41Å; G352-E359 PolarHBondContact N-O 2.84Å; G352-E359 PolarHBondContact O-N 2.83Å
353	L	96.1	Very high	92.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.5	176.2	-70.5	170.6	0	0	0	110.4	F329 T331 E335 G336 R357 I358 I377 I440 L444	F329-L353 HydrophobicContact CE1-CD1 3.71Å; F329-L353 HydrophobicContact CZ-CD1 3.63Å; T331-L353 HydrophobicContact CG2-CD1 3.61Å; E335-L353 WeakPolarHBondContact CA-O 3.35Å; G336-L353 PolarHBondContact N-O 2.87Å; G336-L353 PolarHBondContact O-N 2.82Å; L353-R357 CarbonylContact C-O 3.6Å; L353-R357 VanDerWaalsContact CA-O 3.31Å; L353-R357 WeakPolarHBondContact CA-O 3.12Å; L353-I358 HydrophobicContact CD2-CD1 3.94Å; L353-I377 HydrophobicContact CD2-CD1 4Å; L353-I377 HydrophobicContact CD2-CG1 3.86Å; L353-I440 WeakPolarHBondContact O-CD1 3.02Å; L353-L444 HydrophobicContact CD1-CD1 4.03Å
354	R	95.1	Very high	92.2	Very high	46 Å²	46	24.9 Å²	24.9	17%	0.174	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	128.3	166.8	-168.4	179	-59.5	-78.6	5.4	110	P334 E335 G356 R357 E359 K438 P439	P334-R354 CarbonylContact O-C 3.59Å; P334-R354 WeakPolarHBondContact O-CA 3.06Å; E335-R354 IonicContact OE1-CZ 2.74Å; E335-R354 IonicContact OE1-NH1 2.84Å; E335-R354 PolarHBondContact OE1-NH1 2.99Å; E335-R354 IonicContact OE2-NH1 2.86Å; E335-R354 PolarHBondContact OE2-NH1 3.4Å; R354-G356 PolarHBondContact O-N 3.23Å; R354-R357 PolarHBondContact N-O 2.88Å; R354-R357 PolarHBondContact O-N 3.29Å; R354-E359 HydrophobicContact CB-CB 4.44Å; R354-E359 WeakPolarHBondContact CD-OE2 3.4Å; R354-E359 IonicContact CZ-OE1 2.93Å; R354-E359 IonicContact CZ-OE2 2.77Å; R354-E359 IonicContact NE-OE1 2.84Å; R354-E359 PolarHBondContact NE-OE1 2.97Å; R354-E359 IonicContact NE-OE2 3.35Å; R354-E359 PolarHBondContact NE-OE2 2.84Å; R354-E359 IonicContact NH2-OE1 2.62Å; R354-E359 PolarHBondContact NH2-OE1 3.42Å; R354-K438 VanDerWaalsContact CD-NZ 3.29Å; R354-P439 PolarHBondContact NH2-O 2.85Å
355	A	94.2	Very high	92.1	Very high	75 Å²	75	29.6 Å²	29.6	62%	0.62	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	38.5	-171.5	0	0	0	0	0	112	P334 R357	P334-A355 PolarHBondContact O-N 2.71Å; A355-R357 PolarHBondContact O-N 3.46Å
356	G	94.9	Very high	92	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-1	179.5	0	0	0	0	0	115.8	P334 R354 A376 I377 N378	P334-G356 PolarHBondContact O-N 2.7Å; R354-G356 PolarHBondContact O-N 3.23Å; G356-A376 CarbonylContact O-C 3.53Å; G356-A376 VanDerWaalsContact O-CA 3.24Å; G356-A376 WeakPolarHBondContact O-CA 3.26Å; G356-I377 PolarHBondContact O-N 3.15Å; G356-N378 VanDerWaalsContact CA-CG 3.48Å; G356-N378 VanDerWaalsContact CA-OD1 3.31Å; G356-N378 WeakPolarHBondContact CA-OD1 3.35Å
357	R	95.8	Very high	92.2	Very high	118 Å²	118	28.4 Å²	28.4	45%	0.445	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	151	-179.2	-61.2	177.8	-169.2	-91.9	-2.2	110.7	L353 R354 A355 E359 G374 A376	L353-R357 CarbonylContact C-O 3.6Å; L353-R357 VanDerWaalsContact CA-O 3.31Å; L353-R357 WeakPolarHBondContact CA-O 3.12Å; R354-R357 PolarHBondContact N-O 2.88Å; R354-R357 PolarHBondContact O-N 3.29Å; A355-R357 PolarHBondContact O-N 3.46Å; R357-E359 PolarHBondContact O-N 2.84Å; R357-G374 PolarHBondContact NH1-O 3.41Å; R357-A376 HydrophobicContact CG-CB 4.3Å
358	I	95.8	Very high	92.1	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.2	175.4	-62.3	-71.8	0	0	0	109.5	L351 G352 L353 V360 S372 G373 I377 I385 V396 I398 M404	L351-I358 HydrophobicContact CD1-CD1 4.44Å; L351-I358 HydrophobicContact CD1-CG2 3.39Å; G352-I358 WeakPolarHBondContact O-CA 3.41Å; L353-I358 HydrophobicContact CD2-CD1 3.94Å; I358-V360 HydrophobicContact CG2-CG2 4.3Å; I358-S372 VanDerWaalsContact O-CA 3.32Å; I358-S372 WeakPolarHBondContact O-CA 3.33Å; I358-G373 PolarHBondContact O-N 3.46Å; I358-G373 VanDerWaalsContact O-N 3.07Å; I358-I377 HydrophobicContact CD1-CD1 3.57Å; I358-I377 HydrophobicContact CG1-CD1 3.95Å; I358-I385 HydrophobicContact CD1-CD1 4.4Å; I358-V396 HydrophobicContact CG2-CG1 4.32Å; I358-I398 HydrophobicContact CG1-CD1 4.03Å; I358-M404 HydrophobicContact CB-CE 3.94Å; I358-M404 HydrophobicContact CG2-CE 3.47Å; I358-M404 VanDerWaalsContact CG2-CE 3.47Å
359	E	95.8	Very high	92.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.6	169.4	-177.4	171.3	97.8	0	0	108.5	G352 R354 R357 Q361 V370 S372 K438	G352-E359 PolarHBondContact N-O 2.84Å; G352-E359 PolarHBondContact O-N 2.83Å; R354-E359 HydrophobicContact CB-CB 4.44Å; R354-E359 WeakPolarHBondContact CD-OE2 3.4Å; R354-E359 IonicContact CZ-OE1 2.93Å; R354-E359 IonicContact CZ-OE2 2.77Å; R354-E359 IonicContact NE-OE1 2.84Å; R354-E359 PolarHBondContact NE-OE1 2.97Å; R354-E359 IonicContact NE-OE2 3.35Å; R354-E359 PolarHBondContact NE-OE2 2.84Å; R354-E359 IonicContact NH2-OE1 2.62Å; R354-E359 PolarHBondContact NH2-OE1 3.42Å; R357-E359 PolarHBondContact O-N 2.84Å; E359-Q361 HydrophobicContact CG-CG 4.28Å; E359-Q361 PolarHBondContact OE1-NE2 2.91Å; E359-V370 HydrophobicContact CG-CG1 4.23Å; E359-S372 WeakPolarHBondContact CG-OG 3.19Å; E359-S372 PolarHBondContact OE2-OG 3.22Å; E359-S372 VanDerWaalsContact OE2-OG 3.11Å; E359-K438 IonicContact OE2-NZ 3.12Å; E359-K438 PolarHBondContact OE2-NZ 3.18Å
360	V	95.2	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.2	171.4	171.2	0	0	0	0	108.8	F349 M350 L351 I358 F362 V370 T371 V396 M404 I406	F349-V360 HydrophobicContact CD2-CG1 4.18Å; F349-V360 HydrophobicContact CE2-CG1 3.44Å; F349-V360 VanDerWaalsContact CE2-CG1 3.44Å; F349-V360 HydrophobicContact CE2-CG2 4.47Å; F349-V360 HydrophobicContact CZ-CG1 4Å; F349-V360 HydrophobicContact CZ-CG2 4.27Å; M350-V360 WeakPolarHBondContact O-CA 3.37Å; L351-V360 HydrophobicContact CD1-CG2 3.71Å; I358-V360 HydrophobicContact CG2-CG2 4.3Å; V360-F362 HydrophobicContact CG1-CD1 4.48Å; V360-V370 CarbonylContact O-C 3.03Å; V360-V370 WeakPolarHBondContact O-CA 3.35Å; V360-T371 PolarHBondContact N-O 3.15Å; V360-T371 PolarHBondContact O-N 3.22Å; V360-V396 HydrophobicContact CG2-CG2 3.89Å; V360-M404 HydrophobicContact CG2-CE 4.09Å; V360-I406 HydrophobicContact CB-CD1 3.75Å; V360-I406 HydrophobicContact CG1-CD1 3.69Å; V360-I406 HydrophobicContact CG2-CD1 4.32Å
361	Q	93.5	Very high	92	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.5	168.7	-52.7	-169.2	29.1	0	0	108.5	W348 F349 M350 E359 K369 V370 K438	W348-Q361 HydrophobicContact CH2-CB 4.09Å; W348-Q361 HydrophobicContact CZ3-CB 3.84Å; W348-Q361 WeakPolarHBondContact CZ3-O 3.45Å; F349-Q361 CarbonylContact C-O 3.49Å; M350-Q361 HydrophobicContact CB-CB 4.37Å; M350-Q361 HydrophobicContact CE-CB 3.98Å; M350-Q361 HydrophobicContact CE-CG 3.55Å; M350-Q361 PolarHBondContact N-O 3.3Å; M350-Q361 PolarHBondContact O-N 2.74Å; E359-Q361 HydrophobicContact CG-CG 4.28Å; E359-Q361 PolarHBondContact OE1-NE2 2.91Å; Q361-K369 WeakPolarHBondContact CA-O 3.38Å; Q361-V370 HydrophobicContact CB-CG2 4.25Å; Q361-V370 HydrophobicContact CG-CB 4.3Å; Q361-V370 HydrophobicContact CG-CG1 3.92Å; Q361-V370 HydrophobicContact CG-CG2 3.82Å; Q361-K438 PolarHBondContact NE2-O 2.98Å
362	F	92.8	Very high	91.9	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	158.3	172.8	78.2	-86.4	0	0	0	111.9	W348 F349 V360 Y368 K369 I394 I406 L412	W348-F362 VanDerWaalsContact O-CA 3.29Å; W348-F362 WeakPolarHBondContact O-CA 3.4Å; W348-F362 WeakPolarHBondContact O-CB 3.4Å; F349-F362 HydrophobicContact CB-CB 4.45Å; F349-F362 HydrophobicContact CD2-CB 4.01Å; V360-F362 HydrophobicContact CG1-CD1 4.48Å; F362-Y368 VanDerWaalsContact O-CA 3.3Å; F362-Y368 WeakPolarHBondContact O-CA 3.3Å; F362-K369 HydrophobicContact CD1-CB 4.33Å; F362-K369 HydrophobicContact CE1-CB 3.71Å; F362-K369 HydrophobicContact CE1-CD 4.47Å; F362-K369 HydrophobicContact CE1-CG 4.39Å; F362-K369 HydrophobicContact CZ-CB 4.17Å; F362-K369 HydrophobicContact CZ-CD 4.42Å; F362-K369 HydrophobicContact CZ-CG 4.4Å; F362-K369 PolarHBondContact N-O 3.17Å; F362-K369 PolarHBondContact O-N 2.8Å; F362-K369 VanDerWaalsContact O-N 3.09Å; F362-I394 HydrophobicContact CD1-CD1 3.87Å; F362-I394 HydrophobicContact CD2-CD1 4.36Å; F362-I394 HydrophobicContact CE1-CD1 3.91Å; F362-I394 HydrophobicContact CE2-CD1 4.41Å; F362-I394 HydrophobicContact CG-CD1 4.1Å; F362-I394 HydrophobicContact CZ-CD1 4.19Å; F362-I406 HydrophobicContact CE1-CG2 3.73Å; F362-I406 HydrophobicContact CZ-CG2 4.49Å; F362-L412 HydrophobicContact CB-CD1 3.73Å; F362-L412 HydrophobicContact CD2-CD1 3.61Å; F362-L412 HydrophobicContact CE2-CD1 4.49Å; F362-L412 HydrophobicContact CG-CD1 3.86Å
363	K	90	Very high	91.5	Very high	55 Å²	55	47.1 Å²	47.1	24%	0.239	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.4	172.6	-173.2	-179.3	-175.4	-173.6	0	108.3	D346 S347 W348	D346-K363 WeakPolarHBondContact OD1-CE 3.3Å; D346-K363 IonicContact OD1-NZ 3.17Å; D346-K363 PolarHBondContact OD1-NZ 3.15Å; S347-K363 CarbonylContact C-O 3.55Å; S347-K363 VanDerWaalsContact CA-O 3.28Å; S347-K363 WeakPolarHBondContact CA-O 3.47Å; W348-K363 HydrophobicContact CD2-CB 4.06Å; W348-K363 VanDerWaalsContact CE2-CB 3.48Å; W348-K363 HydrophobicContact CG-CB 4.33Å; W348-K363 HydrophobicContact CZ2-CB 3.8Å; W348-K363 PolarHBondContact N-O 2.9Å; W348-K363 PolarHBondContact O-N 3.37Å
364	N	87.4	Confident	91.1	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.027	25%	0.251	C	S	.	.			trans	-118.3	-175	165.2	67.3	16.2	0	0	0	109.3	D346 H366 T367 S408	D346-N364 CarbonylContact O-C 3.58Å; N364-H366 PolarHBondContact O-N 2.89Å; N364-H366 VanDerWaalsContact O-N 3.09Å; N364-H366 PolarHBondContact OD1-N 2.84Å; N364-H366 VanDerWaalsContact OD1-N 3.15Å; N364-T367 PolarHBondContact N-O 2.8Å; N364-T367 PolarHBondContact ND2-OG1 2.91Å; N364-T367 WeakPolarHBondContact OD1-CA 3.36Å; N364-T367 PolarHBondContact OD1-N 2.99Å; N364-T367 PolarHBondContact OD1-O 3Å; N364-T367 PolarHBondContact OD1-OG1 2.84Å; N364-S408 PolarHBondContact ND2-OG 2.88Å
365	Q	81.7	Confident	90.9	Very high	128 Å²	128	53.9 Å²	53.9	60%	0.598	28%	0.277	S	S	*	.	S	Bend	trans	-60.6	-21.6	-176.1	-67.3	-174.4	-14.9	0	0	114.3	T414	Q365-T414 HydrophobicContact CG-CG2 3.89Å
366	H	80.3	Confident	90.9	Very high	121 Å²	121	52.4 Å²	52.4	56%	0.56	27%	0.265	S	S	*	.	S	Bend	trans	-118.4	-28.4	-170.4	-68.4	87.2	0	0	0	114.2	N364 E410	N364-H366 PolarHBondContact O-N 2.89Å; N364-H366 VanDerWaalsContact O-N 3.09Å; N364-H366 PolarHBondContact OD1-N 2.84Å; N364-H366 VanDerWaalsContact OD1-N 3.15Å; H366-E410 IonicContact CE1-OE1 2.79Å; H366-E410 PolarHBondContact CE1-OE1 2.96Å; H366-E410 IonicContact CE1-OE2 3.43Å; H366-E410 PolarHBondContact CE1-OE2 3.26Å; H366-E410 IonicContact CG-OE1 3.06Å; H366-E410 IonicContact CG-OE2 3.42Å; H366-E410 IonicContact ND1-OE1 3.98Å; H366-E410 PolarHBondContact ND1-OE1 2.92Å; H366-E410 IonicContact ND1-OE2 3.66Å; H366-E410 PolarHBondContact ND1-OE2 3.33Å; H366-E410 IonicContact NE2-OE1 2.86Å
367	T	86.6	Confident	90.9	Very high	39 Å²	39	52.6 Å²	52.6	24%	0.239	27%	0.265	C	S	.	.			trans	-143.5	151	-170.1	59.3	0	0	0	0	111.2	N364 P409	N364-T367 PolarHBondContact N-O 2.8Å; N364-T367 PolarHBondContact ND2-OG1 2.91Å; N364-T367 WeakPolarHBondContact OD1-CA 3.36Å; N364-T367 PolarHBondContact OD1-N 2.99Å; N364-T367 PolarHBondContact OD1-O 3Å; N364-T367 PolarHBondContact OD1-OG1 2.84Å; T367-P409 HydrophobicContact CG2-CG 4.17Å
368	Y	88.3	Confident	90.9	Very high	151 Å²	151	48.3 Å²	48.3	59%	0.592	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.2	165.8	74.6	-84.8	0	0	0	107.8	F362 M437	F362-Y368 VanDerWaalsContact O-CA 3.3Å; F362-Y368 WeakPolarHBondContact O-CA 3.3Å; Y368-M437 HydrophobicContact CD2-CG 4.17Å
369	K	91.6	Very high	90.9	Very high	69 Å²	69	51.4 Å²	51.4	30%	0.3	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.4	174.1	-69.2	-175.1	179.7	168.3	0	110.9	Q361 F362 I406 N407	Q361-K369 WeakPolarHBondContact CA-O 3.38Å; F362-K369 HydrophobicContact CD1-CB 4.33Å; F362-K369 HydrophobicContact CE1-CB 3.71Å; F362-K369 HydrophobicContact CE1-CD 4.47Å; F362-K369 HydrophobicContact CE1-CG 4.39Å; F362-K369 HydrophobicContact CZ-CB 4.17Å; F362-K369 HydrophobicContact CZ-CD 4.42Å; F362-K369 HydrophobicContact CZ-CG 4.4Å; F362-K369 PolarHBondContact N-O 3.17Å; F362-K369 PolarHBondContact O-N 2.8Å; F362-K369 VanDerWaalsContact O-N 3.09Å; K369-I406 HydrophobicContact CB-CG2 4.31Å; K369-I406 HydrophobicContact CD-CG2 3.91Å; K369-N407 PolarHBondContact NZ-O 2.77Å
370	V	93	Very high	90.9	Very high	55 Å²	55	52 Å²	52	33%	0.333	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.5	167.1	177.6	0	0	0	0	106.6	E359 V360 Q361 K438	E359-V370 HydrophobicContact CG-CG1 4.23Å; V360-V370 CarbonylContact O-C 3.03Å; V360-V370 WeakPolarHBondContact O-CA 3.35Å; Q361-V370 HydrophobicContact CB-CG2 4.25Å; Q361-V370 HydrophobicContact CG-CB 4.3Å; Q361-V370 HydrophobicContact CG-CG1 3.92Å; Q361-V370 HydrophobicContact CG-CG2 3.82Å; V370-K438 HydrophobicContact CG1-CD 4.33Å
371	T	93.8	Very high	90.9	Very high	45 Å²	45	58 Å²	58	28%	0.276	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	123.6	178.4	-55	0	0	0	0	109	V360 M404 I406	V360-T371 PolarHBondContact N-O 3.15Å; V360-T371 PolarHBondContact O-N 3.22Å; T371-M404 HydrophobicContact CG2-SD 3.9Å; T371-I406 HydrophobicContact CG2-CD1 4.33Å; T371-I406 HydrophobicContact CG2-CG1 4.1Å
372	S	92.8	Very high	91	Very high	62 Å²	62	61 Å²	61	43%	0.434	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.5	171.8	-44	0	0	0	0	108.5	I358 E359	I358-S372 VanDerWaalsContact O-CA 3.32Å; I358-S372 WeakPolarHBondContact O-CA 3.33Å; E359-S372 WeakPolarHBondContact CG-OG 3.19Å; E359-S372 PolarHBondContact OE2-OG 3.22Å; E359-S372 VanDerWaalsContact OE2-OG 3.11Å
373	G	87.4	Confident	91.1	Very high	16 Å²	16	62 Å²	62	17%	0.165	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	177.7	-174	0	0	0	0	0	113.2	I358 M404	I358-G373 PolarHBondContact O-N 3.46Å; I358-G373 VanDerWaalsContact O-N 3.07Å; G373-M404 PolarHBondContact N-SD 2.88Å; G373-M404 VanDerWaalsContact N-SD 3.42Å
374	G	87.3	Confident	91.4	Very high	24 Å²	24	61.4 Å²	61.4	25%	0.247	32%	0.319	C	S	.	.	S	Bend	trans	79.5	-178.6	-174.8	0	0	0	0	0	114	R357	R357-G374 PolarHBondContact NH1-O 3.41Å
375	K	91.5	Very high	91.8	Very high	165 Å²	165	61.2 Å²	61.2	72%	0.717	32%	0.318	S	S	*	.			trans	-77.4	159.7	173.6	-66.3	178.6	-177.6	171.2	0	109.8
376	A	94.3	Very high	92.5	Very high	44 Å²	44	55.7 Å²	55.7	36%	0.364	29%	0.294	S	S	.	.			trans	-66.6	136	169.7	0	0	0	0	0	109.1	G356 R357	G356-A376 CarbonylContact O-C 3.53Å; G356-A376 VanDerWaalsContact O-CA 3.24Å; G356-A376 WeakPolarHBondContact O-CA 3.26Å; R357-A376 HydrophobicContact CG-CB 4.3Å
377	I	95	Very high	93.2	Very high	3 Å²	3	50 Å²	50	2%	0.015	27%	0.267	C	S	.	.			trans	-119.6	8.9	-176.6	64.6	168.3	0	0	0	112.8	F329 L353 G356 I358 D379 I385 I398	F329-I377 HydrophobicContact CD1-CD1 3.85Å; F329-I377 HydrophobicContact CE1-CD1 4Å; L353-I377 HydrophobicContact CD2-CD1 4Å; L353-I377 HydrophobicContact CD2-CG1 3.86Å; G356-I377 PolarHBondContact O-N 3.15Å; I358-I377 HydrophobicContact CD1-CD1 3.57Å; I358-I377 HydrophobicContact CG1-CD1 3.95Å; I377-D379 PolarHBondContact O-N 2.82Å; I377-D379 VanDerWaalsContact O-N 3.15Å; I377-I385 HydrophobicContact CD1-CD1 3.89Å; I377-I398 HydrophobicContact CG2-CD1 3.93Å; I377-I398 HydrophobicContact CG2-CG2 4.21Å
378	N	96	Very high	93.6	Very high	29 Å²	29	50.2 Å²	50.2	16%	0.155	27%	0.267	C	S	.	.			trans	-87.1	47.3	176.6	69	-43	0	0	0	111.8	T331 F332 D333 G356 R479	T331-N378 HydrophobicContact CG2-CB 4.02Å; T331-N378 CarbonylContact O-C 3.56Å; T331-N378 WeakPolarHBondContact O-CA 3.28Å; F332-N378 PolarHBondContact O-ND2 2.86Å; D333-N378 VanDerWaalsContact O-CB 3.32Å; D333-N378 WeakPolarHBondContact O-CB 3.47Å; G356-N378 VanDerWaalsContact CA-CG 3.48Å; G356-N378 VanDerWaalsContact CA-OD1 3.31Å; G356-N378 WeakPolarHBondContact CA-OD1 3.35Å; N378-R479 PolarHBondContact O-NH2 3.17Å
379	D	95.6	Very high	93.8	Very high	65 Å²	65	43.8 Å²	43.8	35%	0.348	24%	0.242	S	C	.	.	S	Bend	trans	-101.1	1.6	-176.7	60.6	6.6	0	0	0	113.2	T331 F332 I377 Q381 H383	T331-D379 PolarHBondContact O-N 3.42Å; F332-D379 VanDerWaalsContact CE1-O 3.31Å; F332-D379 WeakPolarHBondContact CE1-O 3.17Å; I377-D379 PolarHBondContact O-N 2.82Å; I377-D379 VanDerWaalsContact O-N 3.15Å; D379-Q381 VanDerWaalsContact C-N 3.26Å; D379-Q381 PolarHBondContact O-N 2.77Å; D379-Q381 WeakPolarHBondContact OD1-CB 3.34Å; D379-Q381 PolarHBondContact OD1-N 2.87Å; D379-H383 IonicContact OD1-CD2 3.19Å; D379-H383 IonicContact OD1-CE1 2.98Å; D379-H383 IonicContact OD1-NE2 2.65Å; D379-H383 PolarHBondContact OD1-NE2 3.16Å; D379-H383 IonicContact OD2-CE1 3.8Å; D379-H383 PolarHBondContact OD2-CE1 2.81Å; D379-H383 IonicContact OD2-NE2 3.08Å; D379-H383 PolarHBondContact OD2-NE2 3.35Å; D379-H383 VanDerWaalsContact OD2-NE2 3.12Å
380	G	94.3	Very high	93.8	Very high	14 Å²	14	44.2 Å²	44.2	14%	0.144	25%	0.248	C	C	.	.	S	Bend	trans	74.1	11.8	-176.2	0	0	0	0	0	114.4	R330 T331 F332	R330-G380 WeakPolarHBondContact CD-O 3.28Å; R330-G380 WeakPolarHBondContact CG-O 3.46Å; T331-G380 PolarHBondContact O-N 2.93Å; F332-G380 VanDerWaalsContact CZ-CA 3.47Å
381	Q	95.1	Very high	93.5	Very high	124 Å²	124	49.7 Å²	49.7	58%	0.579	27%	0.27	S	S	*	.	S	Bend	trans	-99.6	160.8	173.6	-57.3	-170.3	4.1	0	0	111.5	R330 D379 H383	R330-Q381 WeakPolarHBondContact CA-O 3.24Å; R330-Q381 WeakPolarHBondContact CB-O 3.08Å; R330-Q381 WeakPolarHBondContact CG-O 3.21Å; D379-Q381 VanDerWaalsContact C-N 3.26Å; D379-Q381 PolarHBondContact O-N 2.77Å; D379-Q381 WeakPolarHBondContact OD1-CB 3.34Å; D379-Q381 PolarHBondContact OD1-N 2.87Å; Q381-H383 PolarHBondContact O-CD2 2.99Å; Q381-H383 VanDerWaalsContact O-CD2 3.27Å
382	W	95.6	Very high	93.1	Very high	64 Å²	64	51.2 Å²	51.2	24%	0.242	28%	0.282	C	S	.	.			trans	-81.2	123.3	174.7	-73.4	104.1	0	0	0	110.2	M298 D328 R330 C447 R449	M298-W382 HydrophobicContact CE-CZ2 4.43Å; M298-W382 HydrophobicContact SD-CH2 4.45Å; M298-W382 HydrophobicContact SD-CZ2 3.92Å; D328-W382 HydrophobicContact CB-CE3 3.74Å; D328-W382 HydrophobicContact CB-CZ3 4.03Å; R330-W382 HydrophobicContact CB-CD2 3.84Å; R330-W382 HydrophobicContact CB-CE3 3.73Å; R330-W382 HydrophobicContact CB-CG 4.38Å; R330-W382 HydrophobicContact CB-CH2 4.42Å; R330-W382 HydrophobicContact CB-CZ2 4.49Å; R330-W382 HydrophobicContact CB-CZ3 4.04Å; W382-C447 HydrophobicContact CH2-CB 4.06Å; W382-C447 WeakPolarHBondContact CZ3-O 3.41Å; W382-R449 HydrophobicContact CE3-CG 4.26Å; W382-R449 HydrophobicContact CH2-CB 4.23Å; W382-R449 HydrophobicContact CH2-CG 3.81Å; W382-R449 HydrophobicContact CZ2-CG 4.42Å; W382-R449 HydrophobicContact CZ3-CB 4.42Å; W382-R449 HydrophobicContact CZ3-CG 3.73Å
383	H	95.9	Very high	93.1	Very high	25 Å²	25	48.9 Å²	48.9	12%	0.116	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.4	174.8	-61.5	-82.2	0	0	0	109.7	F329 D379 Q381 I385 I398	F329-H383 PolarHBondContact N-O 2.02Å; F329-H383 PolarHBondContact O-N 3.38Å; D379-H383 IonicContact OD1-CD2 3.19Å; D379-H383 IonicContact OD1-CE1 2.98Å; D379-H383 IonicContact OD1-NE2 2.65Å; D379-H383 PolarHBondContact OD1-NE2 3.16Å; D379-H383 IonicContact OD2-CE1 3.8Å; D379-H383 PolarHBondContact OD2-CE1 2.81Å; D379-H383 IonicContact OD2-NE2 3.08Å; D379-H383 PolarHBondContact OD2-NE2 3.35Å; D379-H383 VanDerWaalsContact OD2-NE2 3.12Å; Q381-H383 PolarHBondContact O-CD2 2.99Å; Q381-H383 VanDerWaalsContact O-CD2 3.27Å; H383-I385 HydrophobicContact CB-CD1 4.17Å; H383-I385 PolarHBondContact O-N 2.85Å; H383-I398 HydrophobicContact CB-CG2 4.26Å
384	V	95.9	Very high	93.4	Very high	41 Å²	41	48.1 Å²	48.1	25%	0.248	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.7	173.1	-173.3	0	0	0	0	108	E326 D328 I398 S399	E326-V384 HydrophobicContact CG-CG1 4.34Å; D328-V384 WeakPolarHBondContact OD1-CG2 3.01Å; V384-I398 CarbonylContact O-C 3.46Å; V384-I398 WeakPolarHBondContact O-CA 3.48Å; V384-S399 PolarHBondContact O-N 3.25Å
385	I	96.1	Very high	93.7	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127	177.8	-52.7	-59.7	0	0	0	108.4	E326 F327 F329 L351 I358 I377 H383 I398	E326-I385 WeakPolarHBondContact CA-O 2.98Å; F327-I385 HydrophobicContact CD2-CB 4.31Å; F327-I385 HydrophobicContact CE2-CB 3.88Å; F327-I385 HydrophobicContact CE2-CG1 4.25Å; F327-I385 HydrophobicContact CE2-CG2 4.31Å; F327-I385 HydrophobicContact CZ-CB 4.2Å; F327-I385 HydrophobicContact CZ-CG2 4.17Å; F327-I385 PolarHBondContact N-O 2.84Å; F327-I385 PolarHBondContact O-N 2.8Å; F329-I385 HydrophobicContact CB-CG1 3.99Å; L351-I385 HydrophobicContact CD2-CG2 4.23Å; I358-I385 HydrophobicContact CD1-CD1 4.4Å; I377-I385 HydrophobicContact CD1-CD1 3.89Å; H383-I385 HydrophobicContact CB-CD1 4.17Å; H383-I385 PolarHBondContact O-N 2.85Å; I385-I398 HydrophobicContact CD1-CB 4.38Å; I385-I398 HydrophobicContact CD1-CG1 3.87Å; I385-I398 HydrophobicContact CD1-CG2 4.13Å
386	S	95.4	Very high	93.9	Very high	13 Å²	13	39.7 Å²	39.7	9%	0.091	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.5	172.2	88.7	0	0	0	0	111.5	A325 V396 K397	A325-S386 CarbonylContact O-C 3.58Å; A325-S386 VanDerWaalsContact O-CA 3.28Å; A325-S386 WeakPolarHBondContact O-CA 3.34Å; S386-V396 CarbonylContact O-C 3.59Å; S386-V396 WeakPolarHBondContact O-CA 3.04Å; S386-K397 PolarHBondContact N-O 3.11Å; S386-K397 PolarHBondContact O-N 2.94Å; S386-K397 WeakPolarHBondContact OG-CB 3.26Å
387	V	95.6	Very high	94	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.1	173.7	-176.8	0	0	0	0	107.8	F323 A324 A325 F349 L351 I394 S395 V396	F323-V387 HydrophobicContact CD1-CG1 4.12Å; F323-V387 HydrophobicContact CE1-CB 4.24Å; F323-V387 HydrophobicContact CE1-CG1 3.87Å; A324-V387 CarbonylContact C-O 3.58Å; A324-V387 VanDerWaalsContact CA-O 3.31Å; A324-V387 WeakPolarHBondContact CA-O 3.49Å; A325-V387 PolarHBondContact N-O 2.83Å; A325-V387 PolarHBondContact O-N 3Å; F349-V387 HydrophobicContact CE1-CG1 4.37Å; F349-V387 HydrophobicContact CE2-CG1 4.19Å; F349-V387 HydrophobicContact CZ-CG1 3.69Å; F349-V387 HydrophobicContact CZ-CG2 4.34Å; L351-V387 HydrophobicContact CD1-CG2 4.37Å; L351-V387 HydrophobicContact CD2-CG2 4.06Å; V387-I394 HydrophobicContact CG1-CG2 3.8Å; V387-S395 WeakPolarHBondContact CA-O 3.47Å; V387-V396 HydrophobicContact CG2-CG1 4.36Å; V387-V396 HydrophobicContact CG2-CG2 4.31Å
388	D	94.2	Very high	93.9	Very high	44 Å²	44	41 Å²	41	24%	0.235	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.9	-179.7	-60.6	-62	0	0	0	109.7	L390 S395 K397	D388-L390 HydrophobicContact CB-CD2 4.36Å; D388-S395 PolarHBondContact N-O 3.01Å; D388-S395 PolarHBondContact O-N 3.37Å; D388-K397 IonicContact OD2-NZ 2.77Å; D388-K397 PolarHBondContact OD2-NZ 3.38Å
389	E	93.5	Very high	93.7	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.075	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.4	166.2	178.1	-178.8	-161.1	0	0	109.8	K322 F323 N411 L412	K322-E389 WeakPolarHBondContact CA-OE2 3.27Å; K322-E389 HydrophobicContact CB-CB 4.16Å; K322-E389 HydrophobicContact CB-CG 4.35Å; K322-E389 HydrophobicContact CD-CG 4.45Å; K322-E389 WeakPolarHBondContact CD-O 3.35Å; F323-E389 HydrophobicContact CB-CB 4.11Å; F323-E389 PolarHBondContact N-OE2 3.36Å; F323-E389 WeakPolarHBondContact O-CB 3.07Å; F323-E389 PolarHBondContact O-N 2.92Å; E389-N411 WeakPolarHBondContact OE1-CA 3.44Å; E389-L412 WeakPolarHBondContact OE1-CB 3.41Å; E389-L412 PolarHBondContact OE1-N 3.19Å
390	L	91.3	Very high	93.3	Very high	79 Å²	79	48 Å²	48	41%	0.414	25%	0.248	S	C	.	.			trans	-95.7	-163.8	177.4	-54.9	-179.5	0	0	0	110.2	K322 D388 S393	K322-L390 PolarHBondContact NZ-O 3.36Å; D388-L390 HydrophobicContact CB-CD2 4.36Å; L390-S393 WeakPolarHBondContact CA-O 3.24Å; L390-S393 VanDerWaalsContact CB-O 3.28Å; L390-S393 WeakPolarHBondContact CB-O 3.45Å; L390-S393 PolarHBondContact N-O 3.24Å
391	E	86.1	Confident	93.1	Very high	170 Å²	170	54 Å²	54	79%	0.794	27%	0.272	S	S	*	.	S	Bend	trans	-74.9	-35.1	179.4	-71.4	-176.3	173.5	0	0	113.5
392	S	86.6	Confident	92.9	Very high	76 Å²	76	51.5 Å²	51.5	53%	0.531	27%	0.273	S	S	.	.	S	Bend	trans	-136.5	10.1	-176.1	67.7	0	0	0	0	113.5	S408	S392-S408 CarbonylContact C-O 3.59Å; S392-S408 VanDerWaalsContact CA-O 3.24Å; S392-S408 WeakPolarHBondContact CA-O 3.34Å; S392-S408 CarbonylContact O-C 3.48Å; S392-S408 PolarHBondContact O-N 2.93Å; S392-S408 VanDerWaalsContact O-O 3.11Å
393	S	92	Very high	92.7	Very high	14 Å²	14	50.6 Å²	50.6	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	160.6	-178.3	61.2	0	0	0	0	112.2	L390 I406	L390-S393 WeakPolarHBondContact CA-O 3.24Å; L390-S393 VanDerWaalsContact CB-O 3.28Å; L390-S393 WeakPolarHBondContact CB-O 3.45Å; L390-S393 PolarHBondContact N-O 3.24Å; S393-I406 CarbonylContact C-O 3.47Å; S393-I406 WeakPolarHBondContact CA-O 3.1Å; S393-I406 WeakPolarHBondContact CB-O 3.35Å
394	I	93.8	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	169.3	-57.7	166.6	0	0	0	106.7	F349 F362 V387 S405 I406 L412	F349-I394 HydrophobicContact CD2-CD1 4.49Å; F349-I394 HydrophobicContact CE2-CG2 4.29Å; F362-I394 HydrophobicContact CD1-CD1 3.87Å; F362-I394 HydrophobicContact CD2-CD1 4.36Å; F362-I394 HydrophobicContact CE1-CD1 3.91Å; F362-I394 HydrophobicContact CE2-CD1 4.41Å; F362-I394 HydrophobicContact CG-CD1 4.1Å; F362-I394 HydrophobicContact CZ-CD1 4.19Å; V387-I394 HydrophobicContact CG1-CG2 3.8Å; I394-S405 WeakPolarHBondContact O-CA 3.4Å; I394-I406 PolarHBondContact N-O 3.48Å; I394-I406 PolarHBondContact O-N 2.03Å; I394-L412 HydrophobicContact CD1-CD1 3.97Å; I394-L412 HydrophobicContact CD1-CD2 4.5Å
395	S	94.8	Very high	92.4	Very high	11 Å²	11	52 Å²	52	8%	0.077	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.8	176.3	-173.7	0	0	0	0	109.6	V387 D388	V387-S395 WeakPolarHBondContact CA-O 3.47Å; D388-S395 PolarHBondContact N-O 3.01Å; D388-S395 PolarHBondContact O-N 3.37Å
396	V	95.6	Very high	92.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128	170.8	-174.9	0	0	0	0	108.4	I358 V360 S386 V387 V403 M404	I358-V396 HydrophobicContact CG2-CG1 4.32Å; V360-V396 HydrophobicContact CG2-CG2 3.89Å; S386-V396 CarbonylContact O-C 3.59Å; S386-V396 WeakPolarHBondContact O-CA 3.04Å; V387-V396 HydrophobicContact CG2-CG1 4.36Å; V387-V396 HydrophobicContact CG2-CG2 4.31Å; V396-V403 HydrophobicContact CB-CG2 4.4Å; V396-V403 HydrophobicContact CG1-CG2 4.23Å; V396-V403 WeakPolarHBondContact O-CG2 3.47Å; V396-V403 PolarHBondContact O-N 2.85Å; V396-M404 HydrophobicContact CB-CB 4.19Å; V396-M404 HydrophobicContact CB-CE 3.89Å; V396-M404 HydrophobicContact CG1-CE 3.93Å; V396-M404 HydrophobicContact CG2-CB 4.45Å; V396-M404 HydrophobicContact CG2-CE 3.96Å; V396-M404 PolarHBondContact N-O 2.89Å; V396-M404 PolarHBondContact O-N 3.08Å
397	K	94.8	Very high	91.9	Very high	61 Å²	61	56.5 Å²	56.5	27%	0.265	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.7	179.7	-48.6	177.7	-174.2	130.7	0	110.7	S386 D388 E401 A402	S386-K397 PolarHBondContact N-O 3.11Å; S386-K397 PolarHBondContact O-N 2.94Å; S386-K397 WeakPolarHBondContact OG-CB 3.26Å; D388-K397 IonicContact OD2-NZ 2.77Å; D388-K397 PolarHBondContact OD2-NZ 3.38Å; K397-E401 CarbonylContact C-O 3.51Å; K397-E401 WeakPolarHBondContact CA-O 3.37Å; K397-E401 WeakPolarHBondContact CB-O 2.95Å; K397-A402 HydrophobicContact CG-CB 4.31Å
398	I	94.1	Very high	91.4	Very high	15 Å²	15	56.7 Å²	56.7	8%	0.077	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123	171.3	-58	178.7	0	0	0	106.4	I358 I377 H383 V384 I385 K400 E401 V403	I358-I398 HydrophobicContact CG1-CD1 4.03Å; I377-I398 HydrophobicContact CG2-CD1 3.93Å; I377-I398 HydrophobicContact CG2-CG2 4.21Å; H383-I398 HydrophobicContact CB-CG2 4.26Å; V384-I398 CarbonylContact O-C 3.46Å; V384-I398 WeakPolarHBondContact O-CA 3.48Å; I385-I398 HydrophobicContact CD1-CB 4.38Å; I385-I398 HydrophobicContact CD1-CG1 3.87Å; I385-I398 HydrophobicContact CD1-CG2 4.13Å; I398-K400 PolarHBondContact O-N 3.21Å; I398-E401 PolarHBondContact N-O 2.86Å; I398-E401 PolarHBondContact O-N 2.85Å; I398-V403 HydrophobicContact CB-CG1 4.01Å; I398-V403 HydrophobicContact CD1-CB 4.39Å; I398-V403 HydrophobicContact CD1-CG1 3.97Å; I398-V403 HydrophobicContact CD1-CG2 3.82Å; I398-V403 HydrophobicContact CG1-CB 4.46Å; I398-V403 HydrophobicContact CG1-CG1 3.94Å; I398-V403 HydrophobicContact CG1-CG2 3.71Å
399	S	90.8	Very high	90.4	Very high	63 Å²	63	58.7 Å²	58.7	44%	0.441	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	40.9	-178.1	-61.1	0	0	0	0	112.7	V384 E401	V384-S399 PolarHBondContact O-N 3.25Å; S399-E401 PolarHBondContact O-N 2.84Å
400	K	87.8	Confident	89.9	Confident	176 Å²	176	61.6 Å²	61.6	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	-0.9	-177.2	-51.8	176.1	179.4	176.9	0	115.9	I398	I398-K400 PolarHBondContact O-N 3.21Å
401	E	90.6	Very high	89.6	Confident	140 Å²	140	62.4 Å²	62.4	65%	0.654	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.4	174	-62	-174.7	169.5	0	0	110.6	K397 I398 S399 V403	K397-E401 CarbonylContact C-O 3.51Å; K397-E401 WeakPolarHBondContact CA-O 3.37Å; K397-E401 WeakPolarHBondContact CB-O 2.95Å; I398-E401 PolarHBondContact N-O 2.86Å; I398-E401 PolarHBondContact O-N 2.85Å; S399-E401 PolarHBondContact O-N 2.84Å; E401-V403 PolarHBondContact O-N 3.09Å
402	A	89.6	Confident	89.6	Confident	73 Å²	73	54.3 Å²	54.3	60%	0.603	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	111.8	176.9	0	0	0	0	0	110.7	K397	K397-A402 HydrophobicContact CG-CB 4.31Å
403	V	92.8	Very high	89.7	Confident	44 Å²	44	51.3 Å²	51.3	27%	0.267	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-23.5	-178.8	-64.9	0	0	0	0	112.8	V396 I398 E401	V396-V403 HydrophobicContact CB-CG2 4.4Å; V396-V403 HydrophobicContact CG1-CG2 4.23Å; V396-V403 WeakPolarHBondContact O-CG2 3.47Å; V396-V403 PolarHBondContact O-N 2.85Å; I398-V403 HydrophobicContact CB-CG1 4.01Å; I398-V403 HydrophobicContact CD1-CB 4.39Å; I398-V403 HydrophobicContact CD1-CG1 3.97Å; I398-V403 HydrophobicContact CD1-CG2 3.82Å; I398-V403 HydrophobicContact CG1-CB 4.46Å; I398-V403 HydrophobicContact CG1-CG1 3.94Å; I398-V403 HydrophobicContact CG1-CG2 3.71Å; E401-V403 PolarHBondContact O-N 3.09Å
404	M	92.6	Very high	89.4	Confident	13 Å²	13	51.9 Å²	51.9	6%	0.064	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.4	176.5	-62.5	-175.7	-76.7	0	0	110.7	I358 V360 T371 G373 V396 I406	I358-M404 HydrophobicContact CB-CE 3.94Å; I358-M404 HydrophobicContact CG2-CE 3.47Å; I358-M404 VanDerWaalsContact CG2-CE 3.47Å; V360-M404 HydrophobicContact CG2-CE 4.09Å; T371-M404 HydrophobicContact CG2-SD 3.9Å; G373-M404 PolarHBondContact N-SD 2.88Å; G373-M404 VanDerWaalsContact N-SD 3.42Å; V396-M404 HydrophobicContact CB-CB 4.19Å; V396-M404 HydrophobicContact CB-CE 3.89Å; V396-M404 HydrophobicContact CG1-CE 3.93Å; V396-M404 HydrophobicContact CG2-CB 4.45Å; V396-M404 HydrophobicContact CG2-CE 3.96Å; V396-M404 PolarHBondContact N-O 2.89Å; V396-M404 PolarHBondContact O-N 3.08Å; M404-I406 HydrophobicContact CB-CG1 4.38Å
405	S	92	Very high	88.9	Confident	82 Å²	82	54.1 Å²	54.1	57%	0.573	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	106.2	168.4	175.9	0	0	0	0	107.7	I394	I394-S405 WeakPolarHBondContact O-CA 3.4Å
406	I	91.3	Very high	88.3	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.4	-171.6	-48.3	167	0	0	0	108.2	V360 F362 K369 T371 S393 I394 M404 S408	V360-I406 HydrophobicContact CB-CD1 3.75Å; V360-I406 HydrophobicContact CG1-CD1 3.69Å; V360-I406 HydrophobicContact CG2-CD1 4.32Å; F362-I406 HydrophobicContact CE1-CG2 3.73Å; F362-I406 HydrophobicContact CZ-CG2 4.49Å; K369-I406 HydrophobicContact CB-CG2 4.31Å; K369-I406 HydrophobicContact CD-CG2 3.91Å; T371-I406 HydrophobicContact CG2-CD1 4.33Å; T371-I406 HydrophobicContact CG2-CG1 4.1Å; S393-I406 CarbonylContact C-O 3.47Å; S393-I406 WeakPolarHBondContact CA-O 3.1Å; S393-I406 WeakPolarHBondContact CB-O 3.35Å; I394-I406 PolarHBondContact N-O 3.48Å; I394-I406 PolarHBondContact O-N 2.03Å; M404-I406 HydrophobicContact CB-CG1 4.38Å; I406-S408 PolarHBondContact O-N 2.85Å; I406-S408 VanDerWaalsContact O-N 3.17Å
407	N	89.2	Confident	87.6	Confident	104 Å²	104	64.9 Å²	64.9	56%	0.556	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	121	-179.3	-63.9	-11	0	0	0	110.6	K369	K369-N407 PolarHBondContact NZ-O 2.77Å
408	S	86	Confident	87	Confident	4 Å²	4	64 Å²	64	3%	0.028	37%	0.371	C	S	.	.			trans	-128.4	98.7	174.8	-173.6	0	0	0	0	107.3	N364 S392 I406 E410	N364-S408 PolarHBondContact ND2-OG 2.88Å; S392-S408 CarbonylContact C-O 3.59Å; S392-S408 VanDerWaalsContact CA-O 3.24Å; S392-S408 WeakPolarHBondContact CA-O 3.34Å; S392-S408 CarbonylContact O-C 3.48Å; S392-S408 PolarHBondContact O-N 2.93Å; S392-S408 VanDerWaalsContact O-O 3.11Å; I406-S408 PolarHBondContact O-N 2.85Å; I406-S408 VanDerWaalsContact O-N 3.17Å; S408-E410 PolarHBondContact O-N 2.91Å; S408-E410 PolarHBondContact OG-O 3.36Å
409	P	72.9	Confident	86.7	Confident	85 Å²	85	67.7 Å²	67.7	55%	0.552	39%	0.387	S	S	*	.	S	Bend	trans	-69.5	-12.1	-173.1	27.2	-33.8	0	0	0	113.8	T367	T367-P409 HydrophobicContact CG2-CG 4.17Å
410	E	82.6	Confident	86.6	Confident	78 Å²	78	65 Å²	65	36%	0.364	37%	0.367	S	S	.	.	S	Bend	trans	-135.4	170.5	176.7	-67.7	-162.9	168.2	0	0	111.1	H366 S408	H366-E410 IonicContact CE1-OE1 2.79Å; H366-E410 PolarHBondContact CE1-OE1 2.96Å; H366-E410 IonicContact CE1-OE2 3.43Å; H366-E410 PolarHBondContact CE1-OE2 3.26Å; H366-E410 IonicContact CG-OE1 3.06Å; H366-E410 IonicContact CG-OE2 3.42Å; H366-E410 IonicContact ND1-OE1 3.98Å; H366-E410 PolarHBondContact ND1-OE1 2.92Å; H366-E410 IonicContact ND1-OE2 3.66Å; H366-E410 PolarHBondContact ND1-OE2 3.33Å; H366-E410 IonicContact NE2-OE1 2.86Å; S408-E410 PolarHBondContact O-N 2.91Å; S408-E410 PolarHBondContact OG-O 3.36Å
411	N	85.4	Confident	86.7	Confident	95 Å²	95	59.3 Å²	59.3	51%	0.508	34%	0.343	S	S	.	.			trans	-56	140	173.7	-65.2	-16.2	0	0	0	110.9	E389 F413	E389-N411 WeakPolarHBondContact OE1-CA 3.44Å; N411-F413 VanDerWaalsContact C-N 3.28Å; N411-F413 PolarHBondContact O-N 2.9Å
412	L	85.6	Confident	86.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.312	C	S	.	.	S	Bend	trans	-65	-35.6	178.6	-173.7	61.7	0	0	0	111.6	F323 F349 F362 E389 I394	F323-L412 HydrophobicContact CB-CD2 3.92Å; F323-L412 HydrophobicContact CD1-CD2 3.96Å; F323-L412 HydrophobicContact CG-CD2 4.03Å; F349-L412 HydrophobicContact CB-CD1 4.11Å; F349-L412 HydrophobicContact CB-CD2 3.75Å; F349-L412 HydrophobicContact CB-CG 4.14Å; F349-L412 HydrophobicContact CD2-CD1 4.17Å; F349-L412 HydrophobicContact CD2-CD2 3.77Å; F349-L412 HydrophobicContact CG-CD2 3.9Å; F362-L412 HydrophobicContact CB-CD1 3.73Å; F362-L412 HydrophobicContact CD2-CD1 3.61Å; F362-L412 HydrophobicContact CE2-CD1 4.49Å; F362-L412 HydrophobicContact CG-CD1 3.86Å; E389-L412 WeakPolarHBondContact OE1-CB 3.41Å; E389-L412 PolarHBondContact OE1-N 3.19Å; I394-L412 HydrophobicContact CD1-CD1 3.97Å; I394-L412 HydrophobicContact CD1-CD2 4.5Å
413	F	89.2	Confident	86.8	Confident	13 Å²	13	52.9 Å²	52.9	6%	0.057	30%	0.3	C	S	.	.	S	Bend	trans	-120.8	152.2	-178.2	-59.5	-50.1	0	0	0	112.9	F323 A341 F349 N411 L420 T422	F323-F413 HydrophobicContact CB-CD2 4.22Å; F323-F413 HydrophobicContact CB-CE2 3.75Å; F323-F413 AromaticContact CD2-CE2 3.49Å; F323-F413 HydrophobicContact CD2-CE2 3.49Å; F323-F413 VanDerWaalsContact CD2-CE2 3.49Å; F323-F413 HydrophobicContact CD2-CZ 4.11Å; F323-F413 HydrophobicContact CE2-CE2 4.29Å; F323-F413 AromaticContact CG-CE2 3.77Å; F323-F413 HydrophobicContact CG-CE2 3.77Å; F323-F413 HydrophobicContact CG-CZ 4.44Å; A341-F413 HydrophobicContact CB-CE1 4.33Å; A341-F413 HydrophobicContact CB-CZ 3.65Å; F349-F413 HydrophobicContact CB-CE1 4.37Å; F349-F413 HydrophobicContact CB-CZ 4.1Å; N411-F413 VanDerWaalsContact C-N 3.28Å; N411-F413 PolarHBondContact O-N 2.9Å; F413-L420 HydrophobicContact CB-CD1 3.54Å; F413-L420 HydrophobicContact CG-CD1 4.48Å; F413-T422 HydrophobicContact CD2-CG2 4.28Å; F413-T422 HydrophobicContact CE2-CG2 3.97Å; F413-T422 HydrophobicContact CZ-CG2 4.14Å
414	T	85.2	Confident	86.8	Confident	26 Å²	26	50.8 Å²	50.8	16%	0.16	29%	0.287	C	S	.	.			trans	-104.1	135.2	-177.5	45.2	0	0	0	0	110.3	S343 S347 Q365	S343-T414 PolarHBondContact OG-N 3.39Å; S343-T414 PolarHBondContact OG-OG1 3.13Å; S347-T414 WeakPolarHBondContact OG-CG2 3.37Å; S347-T414 PolarHBondContact OG-OG1 3.16Å; Q365-T414 HydrophobicContact CG-CG2 3.89Å
415	S	84.1	Confident	86.8	Confident	48 Å²	48	51.5 Å²	51.5	34%	0.336	29%	0.289	S	S	.	.			trans	-83.2	146	175.1	55.6	0	0	0	0	110.9	E319 K419	E319-S415 WeakPolarHBondContact OE1-CB 3.46Å; E319-S415 PolarHBondContact OE1-OG 3.03Å; S415-K419 WeakPolarHBondContact CA-O 3.4Å
416	V	81.4	Confident	86.8	Confident	77 Å²	77	48.2 Å²	48.2	47%	0.467	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-126.3	124.8	174.3	-176.4	0	0	0	0	107.9	G418 K419	V416-G418 VanDerWaalsContact C-N 3.34Å; V416-G418 PolarHBondContact O-N 3.31Å; V416-K419 PolarHBondContact N-O 3.18Å; V416-K419 PolarHBondContact O-N 2.89Å; V416-K419 VanDerWaalsContact O-O 3.05Å
417	N	81.7	Confident	86.7	Confident	159 Å²	159	48.2 Å²	48.2	85%	0.85	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	40.5	-178.5	-56.9	-34.7	0	0	0	114.1	K419	N417-K419 PolarHBondContact O-N 3.28Å
418	G	82.8	Confident	86.6	Confident	43 Å²	43	43.2 Å²	43.2	44%	0.443	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	17	178.4	0	0	0	0	0	114.5	V416	V416-G418 VanDerWaalsContact C-N 3.34Å; V416-G418 PolarHBondContact O-N 3.31Å
419	K	87.2	Confident	86.7	Confident	93 Å²	93	43.8 Å²	43.8	40%	0.404	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.1	172.7	-67.2	-169	177.6	-170.8	0	110.2	R316 S415 V416 N417	R316-K419 HydrophobicContact CG-CD 4.02Å; S415-K419 WeakPolarHBondContact CA-O 3.4Å; V416-K419 PolarHBondContact N-O 3.18Å; V416-K419 PolarHBondContact O-N 2.89Å; V416-K419 VanDerWaalsContact O-O 3.05Å; N417-K419 PolarHBondContact O-N 3.28Å
420	L	88	Confident	87.3	Confident	5 Å²	5	40.5 Å²	40.5	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114.2	169.8	179.1	64.8	0	0	0	108.5	R316 L317 T321 F413 T422 M454	R316-L420 WeakPolarHBondContact CA-O 3.37Å; L317-L420 PolarHBondContact N-O 3.05Å; L317-L420 PolarHBondContact O-N 2.95Å; T321-L420 WeakPolarHBondContact O-CD2 3.43Å; F413-L420 HydrophobicContact CB-CD1 3.54Å; F413-L420 HydrophobicContact CG-CD1 4.48Å; L420-T422 WeakPolarHBondContact CG-OG1 3.4Å; L420-M454 HydrophobicContact CD2-CE 3.95Å
421	E	91.1	Very high	86.9	Confident	57 Å²	57	43.2 Å²	43.2	27%	0.266	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.7	169.3	-66.5	-162.8	-177.7	0	0	109.1	R314 F315 R316 S343	R314-E421 IonicContact CZ-OE2 3.07Å; R314-E421 IonicContact NE-OE2 3.73Å; R314-E421 IonicContact NH2-OE2 3.39Å; R314-E421 PolarHBondContact NH2-OE2 3.01Å; F315-E421 WeakPolarHBondContact O-CA 3.45Å; R316-E421 HydrophobicContact CG-CG 4.2Å; R316-E421 IonicContact CZ-OE1 3.87Å; R316-E421 IonicContact NE-OE1 3.32Å; R316-E421 PolarHBondContact NE-OE1 3.2Å; S343-E421 WeakPolarHBondContact CA-O 3.44Å; S343-E421 WeakPolarHBondContact CB-O 3.32Å
422	T	90.6	Very high	86.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.2	-177.8	-52.4	0	0	0	0	109.6	F315 A341 E342 F413 L420 V424	F315-T422 PolarHBondContact N-O 2.9Å; F315-T422 PolarHBondContact O-N 3.05Å; A341-T422 HydrophobicContact CB-CG2 4.38Å; E342-T422 WeakPolarHBondContact O-CA 3.48Å; F413-T422 HydrophobicContact CD2-CG2 4.28Å; F413-T422 HydrophobicContact CE2-CG2 3.97Å; F413-T422 HydrophobicContact CZ-CG2 4.14Å; L420-T422 WeakPolarHBondContact CG-OG1 3.4Å; T422-V424 HydrophobicContact CG2-CG2 4.14Å
423	K	92.1	Very high	84.9	Confident	78 Å²	78	50.5 Å²	50.5	34%	0.339	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.7	170.9	-63.8	174	-169.9	169.3	0	108.3	Y312 L313 A341 E342 Y425	Y312-K423 HydrophobicContact CE2-CB 3.91Å; Y312-K423 HydrophobicContact CE2-CD 4.12Å; Y312-K423 HydrophobicContact CE2-CG 3.99Å; L313-K423 CarbonylContact O-C 3.6Å; L313-K423 WeakPolarHBondContact O-CA 3.33Å; A341-K423 CarbonylContact C-O 3.03Å; A341-K423 VanDerWaalsContact CA-O 3.23Å; A341-K423 WeakPolarHBondContact CA-O 3.27Å; E342-K423 HydrophobicContact CG-CB 3.9Å; E342-K423 HydrophobicContact CG-CD 4.22Å; E342-K423 PolarHBondContact N-O 2.78Å; E342-K423 PolarHBondContact O-N 3.33Å; E342-K423 WeakPolarHBondContact OE1-CD 3.35Å; E342-K423 IonicContact OE1-NZ 3.94Å; K423-Y425 HydrophobicContact CB-CE2 3.83Å
424	V	91.9	Very high	83.5	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.2	177.9	-176.5	0	0	0	0	108.4	L313 F315 L339 Y340 A341 T422 I426 L453	L313-V424 HydrophobicContact CB-CB 4.44Å; L313-V424 PolarHBondContact N-O 2.03Å; L313-V424 PolarHBondContact O-N 3.1Å; F315-V424 HydrophobicContact CD2-CG2 3.89Å; F315-V424 HydrophobicContact CE2-CB 4.16Å; F315-V424 HydrophobicContact CE2-CG2 3.75Å; L339-V424 HydrophobicContact CD1-CG1 3.84Å; L339-V424 HydrophobicContact CD2-CG1 4.47Å; L339-V424 HydrophobicContact CG-CG1 3.96Å; Y340-V424 CarbonylContact O-C 3.47Å; Y340-V424 WeakPolarHBondContact O-CA 3.07Å; A341-V424 HydrophobicContact CB-CG2 4.09Å; T422-V424 HydrophobicContact CG2-CG2 4.14Å; V424-I426 HydrophobicContact CG1-CD1 3.85Å; V424-L453 HydrophobicContact CG1-CD1 4.35Å
425	Y	92.8	Very high	82.6	Confident	28 Å²	28	59.5 Å²	59.5	11%	0.11	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.5	178.8	-57	-91.8	0	0	0	107.2	P309 I311 Y312 L339 Y340 E342 K423 P430	P309-Y425 HydrophobicContact CB-CD1 3.95Å; P309-Y425 HydrophobicContact CB-CG 4.37Å; P309-Y425 HydrophobicContact CG-CD1 3.62Å; P309-Y425 HydrophobicContact CG-CG 4.05Å; I311-Y425 WeakPolarHBondContact O-CA 3.34Å; Y312-Y425 AromaticContact CD2-CD1 3.58Å; Y312-Y425 HydrophobicContact CD2-CD1 3.58Å; Y312-Y425 AromaticContact CD2-CE1 3.27Å; Y312-Y425 HydrophobicContact CD2-CE1 3.27Å; Y312-Y425 HydrophobicContact CD2-CG 4.36Å; Y312-Y425 AromaticContact CD2-CZ 3.84Å; Y312-Y425 HydrophobicContact CE2-CD1 4.32Å; Y312-Y425 AromaticContact CE2-CE1 3.61Å; Y312-Y425 HydrophobicContact CE2-CE1 3.61Å; Y312-Y425 HydrophobicContact CE2-CE2 4.45Å; Y312-Y425 AromaticContact CE2-CZ 3.72Å; Y312-Y425 HydrophobicContact CG-CD1 4.48Å; Y312-Y425 HydrophobicContact CG-CE1 4.33Å; L339-Y425 WeakPolarHBondContact CA-O 3.49Å; Y340-Y425 AromaticContact CD1-CD2 3.74Å; Y340-Y425 HydrophobicContact CD1-CD2 3.74Å; Y340-Y425 HydrophobicContact CD1-CE2 4.24Å; Y340-Y425 HydrophobicContact CE1-CD2 4.47Å; Y340-Y425 PolarHBondContact N-O 3.25Å; Y340-Y425 PolarHBondContact O-N 3.05Å; E342-Y425 HydrophobicContact CG-CE2 3.96Å; E342-Y425 WeakPolarHBondContact OE1-CE2 3.47Å; E342-Y425 PolarHBondContact OE1-OH 2.89Å; K423-Y425 HydrophobicContact CB-CE2 3.83Å; Y425-P430 HydrophobicContact CD1-CB 4.49Å; Y425-P430 HydrophobicContact CD2-CG 4.38Å; Y425-P430 HydrophobicContact CE1-CB 4.05Å; Y425-P430 HydrophobicContact CE2-CB 4.24Å; Y425-P430 HydrophobicContact CE2-CG 4.11Å
426	I	92	Very high	82.2	Confident	13 Å²	13	58.1 Å²	58.1	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136	179.2	-54.9	-60.2	0	0	0	108.5	L299 L301 P309 V310 I311 L339 V424 I448 L453	L299-I426 HydrophobicContact CD2-CG2 3.99Å; L301-I426 HydrophobicContact CD2-CG2 4.04Å; P309-I426 CarbonylContact C-O 3.5Å; P309-I426 WeakPolarHBondContact CA-O 3.16Å; V310-I426 PolarHBondContact N-O 2.95Å; I311-I426 HydrophobicContact CB-CB 4.14Å; I311-I426 HydrophobicContact CB-CG1 4.26Å; I311-I426 PolarHBondContact O-N 3.48Å; L339-I426 HydrophobicContact CB-CD1 4.3Å; L339-I426 HydrophobicContact CD1-CD1 3.63Å; L339-I426 HydrophobicContact CG-CD1 3.99Å; V424-I426 HydrophobicContact CG1-CD1 3.85Å; I426-I448 HydrophobicContact CG2-CD1 4.21Å; I426-L453 HydrophobicContact CD1-CD1 4.13Å
427	A	88.1	Confident	82.1	Confident	5 Å²	5	59.2 Å²	59.2	4%	0.041	30%	0.299	C	S	.	.	S	Bend	trans	55	63.7	176.2	0	0	0	0	0	113.8	L301 V310 V337 V338	L301-A427 HydrophobicContact CB-CB 3.52Å; L301-A427 HydrophobicContact CD1-CB 4.48Å; L301-A427 HydrophobicContact CD2-CB 3.75Å; L301-A427 HydrophobicContact CG-CB 4.06Å; L301-A427 WeakPolarHBondContact O-CB 3.15Å; V310-A427 HydrophobicContact CB-CB 4.26Å; V310-A427 HydrophobicContact CG2-CB 3.81Å; V337-A427 WeakPolarHBondContact O-CA 3.29Å; V338-A427 PolarHBondContact O-N 2.84Å
428	G	87.7	Confident	82.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	148.1	-178.2	178	0	0	0	0	0	113	G307	G307-G428 WeakPolarHBondContact O-CA 3.44Å
429	L	88.2	Confident	82.8	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.084	29%	0.287	C	S	.	.			trans	-125.7	143	-177.5	-70.2	176.4	0	0	0	110.7	G307 P309 V337 Y340 T433 I436 I440 P442	G307-L429 PolarHBondContact O-N 2.86Å; P309-L429 WeakPolarHBondContact CD-O 3.46Å; V337-L429 HydrophobicContact CG1-CD2 3.99Å; V337-L429 HydrophobicContact CG1-CG 4.43Å; V337-L429 HydrophobicContact CG2-CD1 4.25Å; V337-L429 HydrophobicContact CG2-CD2 4.11Å; V337-L429 HydrophobicContact CG2-CG 4.06Å; Y340-L429 HydrophobicContact CD2-CD2 3.69Å; Y340-L429 HydrophobicContact CE2-CD2 4.43Å; Y340-L429 HydrophobicContact CG-CD2 3.95Å; L429-T433 HydrophobicContact CB-CG2 3.79Å; L429-T433 HydrophobicContact CD1-CG2 4.42Å; L429-T433 HydrophobicContact CD2-CG2 4.15Å; L429-T433 HydrophobicContact CG-CG2 4.34Å; L429-I436 HydrophobicContact CD1-CD1 3.29Å; L429-I436 HydrophobicContact CD2-CD1 3.66Å; L429-I436 HydrophobicContact CG-CD1 4.1Å; L429-I440 HydrophobicContact CD1-CG2 4.46Å; L429-P442 HydrophobicContact CB-CB 4.42Å; L429-P442 HydrophobicContact CD1-CB 3.94Å; L429-P442 HydrophobicContact CD1-CG 4.49Å; L429-P442 HydrophobicContact CG-CB 3.94Å
430	P	86.4	Confident	83	Confident	15 Å²	15	54.9 Å²	54.9	10%	0.097	27%	0.272	C	S	.	.			trans	-66.8	155.8	173.4	27.5	-33.6	0	0	0	111.5	Y340 Y425 R432 T433	Y340-P430 HydrophobicContact CD1-CG 3.81Å; Y340-P430 HydrophobicContact CE1-CG 3.6Å; Y425-P430 HydrophobicContact CD1-CB 4.49Å; Y425-P430 HydrophobicContact CD2-CG 4.38Å; Y425-P430 HydrophobicContact CE1-CB 4.05Å; Y425-P430 HydrophobicContact CE2-CB 4.24Å; Y425-P430 HydrophobicContact CE2-CG 4.11Å; P430-R432 PolarHBondContact O-N 3.24Å; P430-T433 HydrophobicContact CG-CG2 3.79Å; P430-T433 VanDerWaalsContact O-CG2 3.26Å; P430-T433 WeakPolarHBondContact O-CG2 3.46Å; P430-T433 PolarHBondContact O-N 3.13Å; P430-T433 PolarHBondContact O-OG1 3.23Å
431	N	74	Confident	83.2	Confident	135 Å²	135	56.3 Å²	56.3	72%	0.722	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-4.6	-176.6	-70.6	6.2	0	0	0	116.5	F308	F308-N431 WeakPolarHBondContact CE1-OD1 3.44Å
432	R	67.5	Low	83.3	Confident	215 Å²	215	55.1 Å²	55.1	81%	0.811	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	41.8	-176	-63.9	-175.6	178.5	-179.5	-1.2	112.3	P430	P430-R432 PolarHBondContact O-N 3.24Å
433	T	61.8	Low	83.5	Confident	33 Å²	33	58 Å²	58	20%	0.202	29%	0.288	C	S	.	.			trans	-97.6	21.1	-175.2	50.2	0	0	0	0	115.9	L429 P430 N435 I436	L429-T433 HydrophobicContact CB-CG2 3.79Å; L429-T433 HydrophobicContact CD1-CG2 4.42Å; L429-T433 HydrophobicContact CD2-CG2 4.15Å; L429-T433 HydrophobicContact CG-CG2 4.34Å; P430-T433 HydrophobicContact CG-CG2 3.79Å; P430-T433 VanDerWaalsContact O-CG2 3.26Å; P430-T433 WeakPolarHBondContact O-CG2 3.46Å; P430-T433 PolarHBondContact O-N 3.13Å; P430-T433 PolarHBondContact O-OG1 3.23Å; T433-N435 PolarHBondContact O-N 2.98Å; T433-I436 HydrophobicContact CG2-CD1 4.09Å; T433-I436 HydrophobicContact CG2-CG1 4.44Å; T433-I436 PolarHBondContact O-N 3Å
434	D	59.7	Low	83.7	Confident	158 Å²	158	54.4 Å²	54.4	85%	0.845	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-11.8	168.7	-57.7	-31	0	0	0	112.8
435	N	65.6	Low	83.9	Confident	71 Å²	71	54.6 Å²	54.6	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-0.9	178.4	-64.4	-21.9	0	0	0	114.7	W348 T433 M437	W348-N435 WeakPolarHBondContact CZ2-O 3.31Å; T433-N435 PolarHBondContact O-N 2.98Å; N435-M437 WeakPolarHBondContact O-CE 3.49Å; N435-M437 PolarHBondContact O-N 2.88Å
436	I	75.8	Confident	84	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.092	27%	0.27	C	S	.	.			trans	-74.1	121.5	174.4	-65.9	179.5	0	0	0	109.1	L429 T433 K438	L429-I436 HydrophobicContact CD1-CD1 3.29Å; L429-I436 HydrophobicContact CD2-CD1 3.66Å; L429-I436 HydrophobicContact CG-CD1 4.1Å; T433-I436 HydrophobicContact CG2-CD1 4.09Å; T433-I436 HydrophobicContact CG2-CG1 4.44Å; T433-I436 PolarHBondContact O-N 3Å; I436-K438 VanDerWaalsContact CG2-O 3.27Å; I436-K438 WeakPolarHBondContact CG2-O 3.15Å
437	M	80.2	Confident	84.2	Confident	100 Å²	100	53 Å²	53	49%	0.493	27%	0.268	S	S	.	.	S	Bend	trans	-70.5	-41.1	-172.7	-64.2	-68.2	100.5	0	0	112.5	Y368 N435	Y368-M437 HydrophobicContact CD2-CG 4.17Å; N435-M437 WeakPolarHBondContact O-CE 3.49Å; N435-M437 PolarHBondContact O-N 2.88Å
438	K	89	Confident	84.6	Confident	83 Å²	83	53.1 Å²	53.1	36%	0.361	27%	0.267	S	S	.	.	S	Bend	trans	-114.1	102.4	174.7	-175.2	-176	178.7	-167.5	0	108.6	R354 E359 Q361 V370 I436	R354-K438 VanDerWaalsContact CD-NZ 3.29Å; E359-K438 IonicContact OE2-NZ 3.12Å; E359-K438 PolarHBondContact OE2-NZ 3.18Å; Q361-K438 PolarHBondContact NE2-O 2.98Å; V370-K438 HydrophobicContact CG1-CD 4.33Å; I436-K438 VanDerWaalsContact CG2-O 3.27Å; I436-K438 WeakPolarHBondContact CG2-O 3.15Å
439	P	90.1	Very high	84.8	Confident	104 Å²	104	57 Å²	57	68%	0.675	28%	0.282	S	S	*	.			trans	-51.9	145.2	-179.5	-27.4	35	0	0	0	112	R354	R354-P439 PolarHBondContact NH2-O 2.85Å
440	I	90.9	Very high	84.8	Confident	17 Å²	17	59.2 Å²	59.2	9%	0.087	31%	0.309	C	S	.	.			trans	-142.8	142.1	-178.5	-166.6	175.4	0	0	0	107.5	E335 V337 M350 L353 L429 P442	E335-I440 HydrophobicContact CG-CD1 4.3Å; E335-I440 HydrophobicContact CG-CG1 3.69Å; E335-I440 WeakPolarHBondContact OE1-CA 3.42Å; E335-I440 VanDerWaalsContact OE1-CG1 3.28Å; E335-I440 WeakPolarHBondContact OE1-CG1 3.4Å; V337-I440 HydrophobicContact CG2-CD1 4.28Å; V337-I440 HydrophobicContact CG2-CG2 3.59Å; M350-I440 HydrophobicContact CE-CD1 4.41Å; M350-I440 HydrophobicContact CE-CG2 4.28Å; L353-I440 WeakPolarHBondContact O-CD1 3.02Å; L429-I440 HydrophobicContact CD1-CG2 4.46Å; I440-P442 VanDerWaalsContact O-CD 3.3Å; I440-P442 WeakPolarHBondContact O-CD 3.43Å
441	N	92.3	Very high	84.9	Confident	35 Å²	35	59.7 Å²	59.7	19%	0.187	31%	0.308	C	S	.	.			trans	-68.2	118.4	166.9	-170.9	-13.8	0	0	0	107.9	E335 G336 R443 D647	E335-N441 HydrophobicContact CG-CB 4.39Å; E335-N441 PolarHBondContact OE1-N 3.43Å; G336-N441 VanDerWaalsContact CA-O 3.3Å; G336-N441 WeakPolarHBondContact CA-O 3.44Å; N441-R443 VanDerWaalsContact C-N 3.27Å; N441-R443 PolarHBondContact O-N 3.26Å; N441-R443 WeakPolarHBondContact OD1-CB 3.37Å; N441-R443 WeakPolarHBondContact OD1-CD 3.24Å; N441-R443 WeakPolarHBondContact OD1-CG 3.03Å; N441-R443 PolarHBondContact OD1-N 2.9Å; N441-D647 PolarHBondContact ND2-O 3.39Å
442	P	93.1	Very high	85.7	Confident	32 Å²	32	55.4 Å²	55.4	21%	0.208	29%	0.286	C	S	.	.			trans	-75.4	-16.7	-175.5	29.8	-35.4	0	0	0	113.8	V337 L429 I440	V337-P442 HydrophobicContact CB-CB 4.4Å; V337-P442 HydrophobicContact CG2-CB 4.18Å; V337-P442 PolarHBondContact N-O 2.82Å; L429-P442 HydrophobicContact CB-CB 4.42Å; L429-P442 HydrophobicContact CD1-CB 3.94Å; L429-P442 HydrophobicContact CD1-CG 4.49Å; L429-P442 HydrophobicContact CG-CB 3.94Å; I440-P442 VanDerWaalsContact O-CD 3.3Å; I440-P442 WeakPolarHBondContact O-CD 3.43Å
443	R	94.6	Very high	86.8	Confident	62 Å²	62	45.6 Å²	45.6	23%	0.234	25%	0.249	C	C	.	.			trans	-62.2	136.5	-179.4	-62.9	164.2	-178.2	146.8	1.6	109.3	F305 G336 N441 D647	F305-R443 PolarHBondContact O-NE 3.09Å; G336-R443 WeakPolarHBondContact CA-O 3.27Å; N441-R443 VanDerWaalsContact C-N 3.27Å; N441-R443 PolarHBondContact O-N 3.26Å; N441-R443 WeakPolarHBondContact OD1-CB 3.37Å; N441-R443 WeakPolarHBondContact OD1-CD 3.24Å; N441-R443 WeakPolarHBondContact OD1-CG 3.03Å; N441-R443 PolarHBondContact OD1-N 2.9Å; R443-D647 HydrophobicContact CB-CB 3.9Å; R443-D647 VanDerWaalsContact CD-O 3.23Å; R443-D647 WeakPolarHBondContact CD-O 3.31Å; R443-D647 PolarHBondContact NH1-O 3.42Å
444	L	95.3	Very high	88	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.24	C	C	.	.			trans	-148.4	110.3	-176.2	-179.9	56.3	0	0	0	111	L301 G302 F329 D333 V338 L353 G446	L301-L444 CarbonylContact C-O 3.53Å; L301-L444 VanDerWaalsContact C-O 3.3Å; L301-L444 HydrophobicContact CB-CG 4.47Å; L301-L444 WeakPolarHBondContact CB-O 3.38Å; L301-L444 HydrophobicContact CD1-CD2 3.57Å; L301-L444 HydrophobicContact CD1-CG 4.1Å; G302-L444 WeakPolarHBondContact CA-O 3.14Å; G302-L444 PolarHBondContact N-O 3.46Å; F329-L444 HydrophobicContact CE2-CD2 4.05Å; F329-L444 HydrophobicContact CZ-CD1 4.45Å; F329-L444 HydrophobicContact CZ-CD2 4.15Å; D333-L444 HydrophobicContact CB-CD1 3.78Å; V338-L444 HydrophobicContact CB-CD2 4.4Å; V338-L444 HydrophobicContact CG2-CD2 3.67Å; L353-L444 HydrophobicContact CD1-CD1 4.03Å; L444-G446 PolarHBondContact O-N 3.26Å
445	D	96.7	Very high	89.3	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	23%	0.228	C	C	.	.			trans	-79.7	67	171.7	-170	32.3	0	0	0	111.4	Y300 T331 D333 S658 H659 S660	Y300-D445 WeakPolarHBondContact CE2-OD1 3.41Å; Y300-D445 PolarHBondContact OH-OD1 3.07Å; T331-D445 PolarHBondContact OG1-O 2.9Å; D333-D445 HydrophobicContact CB-CB 4.42Å; D333-D445 PolarHBondContact OD2-N 2.81Å; D445-S658 PolarHBondContact OD2-N 3.45Å; D445-H659 HydrophobicContact CB-CB 4.1Å; D445-H659 WeakPolarHBondContact OD2-CA 3.5Å; D445-H659 PolarHBondContact OD2-N 2.88Å; D445-S660 PolarHBondContact OD1-OG 2.71Å; D445-S660 WeakPolarHBondContact OD2-CB 3.47Å; D445-S660 PolarHBondContact OD2-N 3.47Å; D445-S660 PolarHBondContact OD2-OG 2.98Å
446	G	95.8	Very high	90.3	Very high	4 Å²	4	43.5 Å²	43.5	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	172.1	-177.4	0	0	0	0	0	113.7	Y300 L301 R330 L444	Y300-G446 WeakPolarHBondContact CD2-O 3.31Å; L301-G446 WeakPolarHBondContact CB-O 3.43Å; L301-G446 WeakPolarHBondContact CG-O 3.38Å; L301-G446 PolarHBondContact N-O 3Å; R330-G446 WeakPolarHBondContact O-CA 3.41Å; L444-G446 PolarHBondContact O-N 3.26Å
447	C	96.4	Very high	90.6	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.034	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.9	174.3	-167.7	0	0	0	0	112.4	L299 F329 R330 W382 C473	L299-C447 VanDerWaalsContact O-CA 3.3Å; L299-C447 WeakPolarHBondContact O-CA 3.21Å; L299-C447 PolarHBondContact O-SG 2.87Å; L299-C447 VanDerWaalsContact O-SG 3.34Å; F329-C447 WeakPolarHBondContact CA-O 3.42Å; R330-C447 PolarHBondContact N-O 2.81Å; R330-C447 PolarHBondContact O-N 2.83Å; W382-C447 HydrophobicContact CH2-CB 4.06Å; W382-C447 WeakPolarHBondContact CZ3-O 3.41Å; C447-C473 HydrophobicContact CB-CB 3.58Å; C447-C473 WeakPolarHBondContact CB-SG 3.45Å; C447-C473 WeakPolarHBondContact SG-CB 3.4Å; C447-C473 CovalentContact SG-SG 2.02Å; C447-C473 PolarHBondContact SG-SG 3.22Å
448	I	95.2	Very high	90.3	Very high	6 Å²	6	41 Å²	41	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.7	177.5	-60.4	175.9	0	0	0	110.4	L299 L301 F327 D328 F329 V338 I426 W451	L299-I448 PolarHBondContact N-O 3.37Å; L299-I448 PolarHBondContact O-N 2.79Å; L301-I448 HydrophobicContact CD1-CD1 3.73Å; L301-I448 HydrophobicContact CD1-CG1 3.81Å; L301-I448 HydrophobicContact CD2-CB 4.29Å; L301-I448 HydrophobicContact CD2-CD1 3.44Å; L301-I448 VanDerWaalsContact CD2-CD1 3.44Å; L301-I448 HydrophobicContact CD2-CG1 3.69Å; L301-I448 HydrophobicContact CG-CD1 4.14Å; L301-I448 HydrophobicContact CG-CG1 4.1Å; F327-I448 HydrophobicContact CB-CG2 3.69Å; F327-I448 HydrophobicContact CD2-CD1 4.34Å; F327-I448 HydrophobicContact CD2-CG1 4.37Å; F327-I448 HydrophobicContact CD2-CG2 3.93Å; F327-I448 HydrophobicContact CE2-CD1 4.4Å; F327-I448 HydrophobicContact CG-CG2 3.99Å; D328-I448 VanDerWaalsContact O-CA 3.25Å; D328-I448 WeakPolarHBondContact O-CA 3.32Å; D328-I448 WeakPolarHBondContact O-CG2 3.46Å; F329-I448 HydrophobicContact CD2-CG1 3.85Å; V338-I448 HydrophobicContact CG1-CD1 3.86Å; I426-I448 HydrophobicContact CG2-CD1 4.21Å; I448-W451 HydrophobicContact CG2-CE3 3.85Å; I448-W451 HydrophobicContact CG2-CZ3 4.39Å
449	R	93.1	Very high	89.2	Confident	82 Å²	82	42.3 Å²	42.3	31%	0.309	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	172.7	166.2	69.8	-177.2	-172.1	-171.6	-2.2	111.2	M298 D328 W382 W451	M298-R449 HydrophobicContact CG-CB 4.24Å; D328-R449 HydrophobicContact CB-CG 3.51Å; D328-R449 PolarHBondContact N-O 2.97Å; D328-R449 PolarHBondContact O-N 3.39Å; D328-R449 IonicContact OD2-CZ 2.75Å; D328-R449 IonicContact OD2-NE 3.9Å; D328-R449 PolarHBondContact OD2-NE 2.81Å; D328-R449 IonicContact OD2-NH2 2.74Å; D328-R449 PolarHBondContact OD2-NH2 2.87Å; W382-R449 HydrophobicContact CE3-CG 4.26Å; W382-R449 HydrophobicContact CH2-CB 4.23Å; W382-R449 HydrophobicContact CH2-CG 3.81Å; W382-R449 HydrophobicContact CZ2-CG 4.42Å; W382-R449 HydrophobicContact CZ3-CB 4.42Å; W382-R449 HydrophobicContact CZ3-CG 3.73Å; R449-W451 VanDerWaalsContact C-N 3.32Å; R449-W451 PolarHBondContact O-N 2.79Å
450	G	87.8	Confident	88.3	Confident	62 Å²	62	39.3 Å²	39.3	64%	0.639	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	59.3	36.6	168.8	0	0	0	0	0	114.7
451	W	87.7	Confident	87.6	Confident	25 Å²	25	39 Å²	39	10%	0.095	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	150.5	-175.4	55.9	71.5	0	0	0	114.2	L299 E326 F327 I448 R449 V461 I465	L299-W451 HydrophobicContact CB-CH2 3.98Å; L299-W451 HydrophobicContact CB-CZ3 3.63Å; L299-W451 HydrophobicContact CD2-CH2 4.26Å; L299-W451 HydrophobicContact CD2-CZ3 4.08Å; E326-W451 CarbonylContact O-C 3.37Å; E326-W451 VanDerWaalsContact O-CA 3.26Å; E326-W451 WeakPolarHBondContact O-CA 3.43Å; F327-W451 HydrophobicContact CB-CB 3.93Å; I448-W451 HydrophobicContact CG2-CE3 3.85Å; I448-W451 HydrophobicContact CG2-CZ3 4.39Å; R449-W451 VanDerWaalsContact C-N 3.32Å; R449-W451 PolarHBondContact O-N 2.79Å; W451-V461 HydrophobicContact CH2-CB 4.48Å; W451-V461 HydrophobicContact CH2-CG1 3.7Å; W451-V461 HydrophobicContact CZ2-CB 3.41Å; W451-V461 VanDerWaalsContact CZ2-CB 3.41Å; W451-V461 HydrophobicContact CZ2-CG1 3.05Å; W451-I465 HydrophobicContact CH2-CD1 2.98Å; W451-I465 HydrophobicContact CH2-CG1 3.5Å; W451-I465 VanDerWaalsContact CH2-CG1 3.5Å; W451-I465 HydrophobicContact CZ2-CD1 3.46Å; W451-I465 VanDerWaalsContact CZ2-CD1 3.46Å; W451-I465 HydrophobicContact CZ2-CG1 4.02Å; W451-I465 HydrophobicContact CZ3-CD1 3.9Å
452	N	90.4	Very high	87	Confident	45 Å²	45	41.3 Å²	41.3	24%	0.241	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	107.9	167.6	177.7	22.9	0	0	0	108.3	E326 N455 G457	E326-N452 PolarHBondContact N-O 3.45Å; E326-N452 PolarHBondContact O-N 2.84Å; N452-N455 WeakPolarHBondContact OD1-CA 3.49Å; N452-G457 WeakPolarHBondContact OD1-CA 3.12Å; N452-G457 PolarHBondContact OD1-N 2.77Å
453	L	90.5	Very high	86.3	Confident	10 Å²	10	44.4 Å²	44.4	5%	0.052	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.5	-179.3	-64.4	174.6	0	0	0	110	L313 F315 A325 L339 V424 I426 N455 Q456	L313-L453 HydrophobicContact CD1-CD1 3.78Å; F315-L453 HydrophobicContact CZ-CB 4.12Å; A325-L453 HydrophobicContact CB-CD2 3.59Å; L339-L453 HydrophobicContact CD1-CD2 3.78Å; V424-L453 HydrophobicContact CG1-CD1 4.35Å; I426-L453 HydrophobicContact CD1-CD1 4.13Å; L453-N455 PolarHBondContact O-N 2.99Å; L453-Q456 PolarHBondContact O-N 2.72Å
454	M	88.5	Confident	85.7	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	26.1	179.8	-57.8	-59.6	-70.8	0	0	113.9	F315 L317 T321 F323 A324 L420 Q456	F315-M454 HydrophobicContact CD1-CB 4.24Å; F315-M454 HydrophobicContact CD1-CG 4.28Å; F315-M454 HydrophobicContact CD2-CG 4.07Å; F315-M454 HydrophobicContact CE1-CB 4.33Å; F315-M454 HydrophobicContact CE1-CG 4.45Å; F315-M454 HydrophobicContact CE2-CG 4.24Å; F315-M454 HydrophobicContact CG-CG 4.08Å; F315-M454 HydrophobicContact CZ-CG 4.43Å; L317-M454 HydrophobicContact CD1-CB 3.67Å; L317-M454 HydrophobicContact CD1-CE 3.63Å; L317-M454 HydrophobicContact CD1-CG 4.09Å; T321-M454 HydrophobicContact CG2-CE 4.06Å; F323-M454 HydrophobicContact CD2-SD 3.51Å; F323-M454 VanDerWaalsContact CD2-SD 3.51Å; F323-M454 HydrophobicContact CE2-SD 4.15Å; F323-M454 HydrophobicContact CG-SD 4.44Å; A324-M454 PolarHBondContact O-N 3.19Å; L420-M454 HydrophobicContact CD2-CE 3.95Å; M454-Q456 HydrophobicContact CB-CG 4.09Å; M454-Q456 WeakPolarHBondContact O-CG 3.12Å; M454-Q456 PolarHBondContact O-N 2.93Å; M454-Q456 PolarHBondContact O-NE2 2.86Å
455	N	86.9	Confident	85	Confident	110 Å²	110	43.4 Å²	43.4	59%	0.588	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	29.5	-172.5	-60.3	-44.7	0	0	0	114.1	N452 L453	N452-N455 WeakPolarHBondContact OD1-CA 3.49Å; L453-N455 PolarHBondContact O-N 2.99Å
456	Q	86.1	Confident	84.4	Confident	106 Å²	106	48.2 Å²	48.2	50%	0.495	28%	0.284	S	S	.	.			trans	-98.6	1.1	178.3	-56.6	-53.3	-67.5	0	0	113.1	F315 L317 L453 M454	F315-Q456 HydrophobicContact CD1-CG 4.05Å; F315-Q456 HydrophobicContact CE1-CB 4.19Å; F315-Q456 HydrophobicContact CE1-CG 3.98Å; L317-Q456 HydrophobicContact CD2-CG 4.17Å; L453-Q456 PolarHBondContact O-N 2.72Å; M454-Q456 HydrophobicContact CB-CG 4.09Å; M454-Q456 WeakPolarHBondContact O-CG 3.12Å; M454-Q456 PolarHBondContact O-N 2.93Å; M454-Q456 PolarHBondContact O-NE2 2.86Å
457	G	82.3	Confident	83.9	Confident	37 Å²	37	55 Å²	55	38%	0.381	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	-151.2	-175.8	0	0	0	0	0	113.1	N452	N452-G457 WeakPolarHBondContact OD1-CA 3.12Å; N452-G457 PolarHBondContact OD1-N 2.77Å
458	A	73.8	Confident	83.4	Confident	29 Å²	29	60.3 Å²	60.3	24%	0.24	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	3.7	-172.7	0	0	0	0	0	114.8	G460 V461 K462	A458-G460 PolarHBondContact O-N 2.74Å; A458-V461 PolarHBondContact O-N 3.19Å; A458-K462 HydrophobicContact CB-CD 4.48Å; A458-K462 HydrophobicContact CB-CG 4.3Å
459	S	66.6	Low	83.1	Confident	110 Å²	110	66 Å²	66	77%	0.769	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	131.2	-173.1	-166.3	0	0	0	0	111.9	V461	S459-V461 VanDerWaalsContact C-N 3.31Å; S459-V461 PolarHBondContact O-N 3.17Å
460	G	71.1	Confident	82.9	Confident	40 Å²	40	64.8 Å²	64.8	41%	0.412	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	-18.5	177.5	0	0	0	0	0	114.8	A458 E463 V464	A458-G460 PolarHBondContact O-N 2.74Å; G460-E463 WeakPolarHBondContact CA-OE2 3.31Å; G460-E463 PolarHBondContact N-OE2 3.5Å; G460-V464 VanDerWaalsContact O-CG2 3.3Å; G460-V464 WeakPolarHBondContact O-CG2 3.4Å
461	V	76.7	Confident	83	Confident	11 Å²	11	62.8 Å²	62.8	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-94.9	-33.8	179.3	-160.5	0	0	0	0	111.2	I311 L313 W451 A458 S459 E463 V464 I465	I311-V461 HydrophobicContact CD1-CG1 3.47Å; I311-V461 VanDerWaalsContact CD1-CG1 3.47Å; I311-V461 HydrophobicContact CG2-CG1 4.23Å; L313-V461 HydrophobicContact CD1-CG2 3.8Å; L313-V461 HydrophobicContact CD2-CG2 3.99Å; W451-V461 HydrophobicContact CH2-CB 4.48Å; W451-V461 HydrophobicContact CH2-CG1 3.7Å; W451-V461 HydrophobicContact CZ2-CB 3.41Å; W451-V461 VanDerWaalsContact CZ2-CB 3.41Å; W451-V461 HydrophobicContact CZ2-CG1 3.05Å; A458-V461 PolarHBondContact O-N 3.19Å; S459-V461 VanDerWaalsContact C-N 3.31Å; S459-V461 PolarHBondContact O-N 3.17Å; V461-E463 VanDerWaalsContact C-N 3.3Å; V461-E463 PolarHBondContact O-N 3.22Å; V461-V464 PolarHBondContact O-N 2.99Å; V461-V464 VanDerWaalsContact O-N 3.16Å; V461-I465 WeakPolarHBondContact O-CG1 3.23Å; V461-I465 PolarHBondContact O-N 3.07Å; V461-I465 VanDerWaalsContact O-N 3.15Å
462	K	77.9	Confident	83.3	Confident	83 Å²	83	62.7 Å²	62.7	36%	0.361	34%	0.342	S	S	.	.	H	α-helix	trans	-58.6	-43.1	177.5	-75.5	-168.8	171.3	-147.9	0	111.7	E297 A458 V464 I465 Q466	E297-K462 IonicContact OE1-NZ 3.16Å; E297-K462 PolarHBondContact OE1-NZ 2.87Å; A458-K462 HydrophobicContact CB-CD 4.48Å; A458-K462 HydrophobicContact CB-CG 4.3Å; K462-V464 VanDerWaalsContact C-N 3.31Å; K462-V464 PolarHBondContact O-N 3.15Å; K462-I465 PolarHBondContact O-N 3.45Å; K462-Q466 VanDerWaalsContact O-CG 3.25Å; K462-Q466 WeakPolarHBondContact O-CG 3.44Å; K462-Q466 PolarHBondContact O-N 3.36Å; K462-Q466 VanDerWaalsContact O-N 3.11Å
463	E	79.7	Confident	83.4	Confident	98 Å²	98	60.9 Å²	60.9	46%	0.458	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-42.4	177.6	-59.9	81.6	-178.5	0	0	110.7	G460 V461 I465 Q466 E467	G460-E463 WeakPolarHBondContact CA-OE2 3.31Å; G460-E463 PolarHBondContact N-OE2 3.5Å; V461-E463 VanDerWaalsContact C-N 3.3Å; V461-E463 PolarHBondContact O-N 3.22Å; E463-I465 VanDerWaalsContact C-N 3.34Å; E463-I465 PolarHBondContact O-N 3.34Å; E463-Q466 PolarHBondContact O-N 3.36Å; E463-E467 WeakPolarHBondContact O-CG 3.49Å; E463-E467 PolarHBondContact O-N 3.12Å; E463-E467 VanDerWaalsContact O-N 3.1Å
464	V	81.5	Confident	83.6	Confident	42 Å²	42	61 Å²	61	26%	0.255	33%	0.333	S	S	.	.	H	α-helix	trans	-66.8	-30.9	-178.9	174.7	0	0	0	0	113.3	I311 G460 V461 K462 K471	I311-V464 HydrophobicContact CD1-CG1 4.43Å; I311-V464 HydrophobicContact CG1-CG1 4.47Å; G460-V464 VanDerWaalsContact O-CG2 3.3Å; G460-V464 WeakPolarHBondContact O-CG2 3.4Å; V461-V464 PolarHBondContact O-N 2.99Å; V461-V464 VanDerWaalsContact O-N 3.16Å; K462-V464 VanDerWaalsContact C-N 3.31Å; K462-V464 PolarHBondContact O-N 3.15Å; V464-K471 WeakPolarHBondContact O-CD 3.15Å; V464-K471 PolarHBondContact O-NZ 3.32Å
465	I	81.3	Confident	83.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-71	-53.8	172	-51.2	164.9	0	0	0	109.3	P296 L299 W451 V461 K462 E463 E467 K468 K471 H472	P296-I465 WeakPolarHBondContact O-CG2 3.22Å; L299-I465 HydrophobicContact CB-CG1 4.49Å; L299-I465 HydrophobicContact CD1-CG1 4.42Å; W451-I465 HydrophobicContact CH2-CD1 2.98Å; W451-I465 HydrophobicContact CH2-CG1 3.5Å; W451-I465 VanDerWaalsContact CH2-CG1 3.5Å; W451-I465 HydrophobicContact CZ2-CD1 3.46Å; W451-I465 VanDerWaalsContact CZ2-CD1 3.46Å; W451-I465 HydrophobicContact CZ2-CG1 4.02Å; W451-I465 HydrophobicContact CZ3-CD1 3.9Å; V461-I465 WeakPolarHBondContact O-CG1 3.23Å; V461-I465 PolarHBondContact O-N 3.07Å; V461-I465 VanDerWaalsContact O-N 3.15Å; K462-I465 PolarHBondContact O-N 3.45Å; E463-I465 VanDerWaalsContact C-N 3.34Å; E463-I465 PolarHBondContact O-N 3.34Å; I465-E467 PolarHBondContact O-N 3.04Å; I465-E467 VanDerWaalsContact O-N 3.11Å; I465-K468 PolarHBondContact O-N 3.44Å; I465-K468 VanDerWaalsContact O-N 3.1Å; I465-K471 HydrophobicContact CG2-CB 4.46Å; I465-H472 VanDerWaalsContact CG2-CD2 3.48Å; I465-H472 WeakPolarHBondContact CG2-CD2 3.4Å; I465-H472 PolarHBondContact O-NE2 3.49Å
466	Q	83.5	Confident	84.1	Confident	105 Å²	105	61.1 Å²	61.1	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-62.7	-23.6	-170.3	-71.5	176	-2.2	0	0	113	P296 K462 E463 K468	P296-Q466 HydrophobicContact CB-CG 4.23Å; K462-Q466 VanDerWaalsContact O-CG 3.25Å; K462-Q466 WeakPolarHBondContact O-CG 3.44Å; K462-Q466 PolarHBondContact O-N 3.36Å; K462-Q466 VanDerWaalsContact O-N 3.11Å; E463-Q466 PolarHBondContact O-N 3.36Å; Q466-K468 VanDerWaalsContact C-N 3.28Å; Q466-K468 PolarHBondContact O-N 3.05Å
467	E	84.3	Confident	84.5	Confident	145 Å²	145	57.7 Å²	57.7	68%	0.678	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.3	175	-82.8	174.5	-172.5	0	0	114.3	E463 I465	E463-E467 WeakPolarHBondContact O-CG 3.49Å; E463-E467 PolarHBondContact O-N 3.12Å; E463-E467 VanDerWaalsContact O-N 3.1Å; I465-E467 PolarHBondContact O-N 3.04Å; I465-E467 VanDerWaalsContact O-N 3.11Å
468	K	87.2	Confident	85.1	Confident	117 Å²	117	58.2 Å²	58.2	51%	0.509	31%	0.309	S	S	.	.			trans	-139.6	120.7	-172.8	-71.5	-168.3	179.1	-176	0	113.1	I465 Q466 S470 K471	I465-K468 PolarHBondContact O-N 3.44Å; I465-K468 VanDerWaalsContact O-N 3.1Å; Q466-K468 VanDerWaalsContact C-N 3.28Å; Q466-K468 PolarHBondContact O-N 3.05Å; K468-S470 PolarHBondContact O-N 3.1Å; K468-K471 HydrophobicContact CB-CD 4.24Å; K468-K471 HydrophobicContact CB-CG 4.16Å; K468-K471 WeakPolarHBondContact O-CB 3.25Å; K468-K471 PolarHBondContact O-N 3.41Å
469	E	87.9	Confident	86.1	Confident	126 Å²	126	63.3 Å²	63.3	59%	0.589	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63.1	-24.2	175.5	-155.2	-153.8	129.7	0	0	113.8	K294 K471 H472	K294-E469 HydrophobicContact CD-CG 4.25Å; K294-E469 IonicContact NZ-OE1 2.91Å; K294-E469 PolarHBondContact NZ-OE1 3.46Å; E469-K471 PolarHBondContact O-N 3.08Å; E469-H472 WeakPolarHBondContact O-CB 3.21Å; E469-H472 PolarHBondContact O-N 2.96Å
470	S	89.1	Confident	87.4	Confident	57 Å²	57	58.1 Å²	58.1	40%	0.399	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-61.2	-23.3	173.3	56.1	0	0	0	0	113.3	E303 K468	E303-S470 PolarHBondContact OE1-OG 3.4Å; K468-S470 PolarHBondContact O-N 3.1Å
471	K	90.8	Very high	88.7	Confident	20 Å²	20	56.4 Å²	56.4	9%	0.087	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-87.2	-5.9	177.1	-64.7	-178	179.6	-179	0	113.3	L299 Y300 E303 V464 I465 K468 E469	L299-K471 CarbonylContact C-O 3.27Å; L299-K471 WeakPolarHBondContact CA-O 3.49Å; L299-K471 HydrophobicContact CD1-CB 4.22Å; Y300-K471 WeakPolarHBondContact CB-O 3.33Å; Y300-K471 PolarHBondContact N-O 3.48Å; E303-K471 WeakPolarHBondContact OE2-CG 3.33Å; V464-K471 WeakPolarHBondContact O-CD 3.15Å; V464-K471 PolarHBondContact O-NZ 3.32Å; I465-K471 HydrophobicContact CG2-CB 4.46Å; K468-K471 HydrophobicContact CB-CD 4.24Å; K468-K471 HydrophobicContact CB-CG 4.16Å; K468-K471 WeakPolarHBondContact O-CB 3.25Å; K468-K471 PolarHBondContact O-N 3.41Å; E469-K471 PolarHBondContact O-N 3.08Å
472	H	93.6	Very high	89.7	Confident	22 Å²	22	56.3 Å²	56.3	10%	0.102	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.3	-179.8	-55.4	166.2	0	0	0	109.8	K294 M298 I465 E469	K294-H472 HydrophobicContact CB-CB 3.65Å; K294-H472 HydrophobicContact CD-CB 4.12Å; K294-H472 HydrophobicContact CG-CB 4.37Å; M298-H472 WeakPolarHBondContact O-CA 3.48Å; I465-H472 VanDerWaalsContact CG2-CD2 3.48Å; I465-H472 WeakPolarHBondContact CG2-CD2 3.4Å; I465-H472 PolarHBondContact O-NE2 3.49Å; E469-H472 WeakPolarHBondContact O-CB 3.21Å; E469-H472 PolarHBondContact O-N 2.96Å
473	C	93.3	Very high	90.6	Very high	7 Å²	7	52.3 Å²	52.3	5%	0.047	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	160.6	173.3	85.1	0	0	0	0	111.5	K294 H295 M298 Y300 C447	K294-C473 WeakPolarHBondContact CA-O 3.48Å; H295-C473 PolarHBondContact N-O 2.98Å; M298-C473 VanDerWaalsContact CB-SG 3.56Å; M298-C473 PolarHBondContact O-N 2.94Å; M298-C473 VanDerWaalsContact O-N 3.14Å; Y300-C473 HydrophobicContact CD2-CB 4.1Å; Y300-C473 HydrophobicContact CG-CB 4.45Å; C447-C473 HydrophobicContact CB-CB 3.58Å; C447-C473 WeakPolarHBondContact CB-SG 3.45Å; C447-C473 WeakPolarHBondContact SG-CB 3.4Å; C447-C473 CovalentContact SG-SG 2.02Å; C447-C473 PolarHBondContact SG-SG 3.22Å
474	F	94.6	Very high	91.4	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	140.4	174.7	-61.6	-52.6	0	0	0	111.5	D292 F293 K294 R330 Y476 V477 F482 K657 P662	D292-F474 HydrophobicContact CB-CD1 4.28Å; D292-F474 HydrophobicContact CB-CE1 3.79Å; D292-F474 HydrophobicContact CB-CZ 4.49Å; D292-F474 VanDerWaalsContact O-CD1 3.24Å; D292-F474 WeakPolarHBondContact O-CD1 3.42Å; D292-F474 WeakPolarHBondContact O-CE1 3.23Å; F293-F474 CarbonylContact O-C 3.57Å; F293-F474 WeakPolarHBondContact O-CA 3.45Å; K294-F474 HydrophobicContact CG-CD1 3.88Å; K294-F474 HydrophobicContact CG-CE1 4.16Å; R330-F474 PolarHBondContact NH2-O 2.97Å; F474-Y476 WeakPolarHBondContact CB-O 3.28Å; F474-V477 HydrophobicContact CB-CG1 3.81Å; F474-V477 HydrophobicContact CD2-CG1 4.42Å; F474-F482 AromaticContact CE2-CD1 3.95Å; F474-F482 HydrophobicContact CE2-CD1 3.95Å; F474-F482 HydrophobicContact CE2-CE1 4.35Å; F474-F482 AromaticContact CZ-CD1 3.93Å; F474-F482 HydrophobicContact CZ-CD1 3.93Å; F474-F482 AromaticContact CZ-CE1 3.86Å; F474-F482 HydrophobicContact CZ-CE1 3.86Å; F474-K657 HydrophobicContact CE2-CG 4.14Å; F474-P662 HydrophobicContact CE2-CG 4.42Å; F474-P662 HydrophobicContact CZ-CG 4.48Å
475	V	92.9	Very high	92	Very high	40 Å²	40	47.9 Å²	47.9	24%	0.242	23%	0.233	C	C	.	.	S	Bend	trans	-64	-48.3	175.8	176.9	0	0	0	0	109.7	F293 H295 R330	F293-V475 HydrophobicContact CB-CG2 4.4Å; F293-V475 PolarHBondContact O-N 3.46Å; H295-V475 HydrophobicContact CB-CG2 4.01Å; R330-V475 PolarHBondContact NH1-O 2.93Å; R330-V475 PolarHBondContact NH2-O 2.84Å
476	Y	92.6	Very high	92.7	Very high	75 Å²	75	50.2 Å²	50.2	29%	0.294	25%	0.252	S	S	.	.	S	Bend	trans	-111.8	137.3	179.4	-55.1	-71.4	0	0	0	110.4	F474 P663 D666 P667	F474-Y476 WeakPolarHBondContact CB-O 3.28Å; Y476-P663 WeakPolarHBondContact O-CD 3.43Å; Y476-D666 WeakPolarHBondContact CE2-OD1 3.47Å; Y476-D666 PolarHBondContact OH-OD1 3.27Å; Y476-D666 VanDerWaalsContact OH-OD1 3.09Å; Y476-P667 HydrophobicContact CD1-CG 3.91Å; Y476-P667 HydrophobicContact CE1-CG 4.28Å; Y476-P667 HydrophobicContact CG-CG 4.32Å
477	V	94.1	Very high	93.2	Very high	34 Å²	34	45.5 Å²	45.5	21%	0.206	23%	0.232	C	C	.	.			trans	-140.6	144.4	-179.8	-66	0	0	0	0	110.6	F332 F474 C661	F332-V477 HydrophobicContact CE2-CB 4.33Å; F332-V477 HydrophobicContact CE2-CG2 3.96Å; F474-V477 HydrophobicContact CB-CG1 3.81Å; F474-V477 HydrophobicContact CD2-CG1 4.42Å; V477-C661 CarbonylContact C-O 3.58Å; V477-C661 VanDerWaalsContact CA-O 3.27Å; V477-C661 WeakPolarHBondContact CA-O 3.27Å
478	E	94.6	Very high	93.8	Very high	48 Å²	48	39.7 Å²	39.7	22%	0.224	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	165.7	166.4	55	168.2	-130.4	0	0	109.6	R510 R565 C661	E478-R510 VanDerWaalsContact CD-NH2 3.28Å; E478-R510 IonicContact OE1-CZ 3.27Å; E478-R510 IonicContact OE1-NH1 3.9Å; E478-R510 PolarHBondContact OE1-NH1 3.02Å; E478-R510 IonicContact OE1-NH2 3.71Å; E478-R510 PolarHBondContact OE1-NH2 2.85Å; E478-R510 IonicContact OE2-CZ 3.08Å; E478-R510 IonicContact OE2-NH1 3.44Å; E478-R510 PolarHBondContact OE2-NH1 2.84Å; E478-R510 VanDerWaalsContact OE2-NH1 3.08Å; E478-R510 IonicContact OE2-NH2 3.95Å; E478-R565 IonicContact OE1-CZ 3.01Å; E478-R565 IonicContact OE1-NE 3.49Å; E478-R565 IonicContact OE1-NH2 2.85Å; E478-R565 PolarHBondContact OE1-NH2 3.38Å; E478-C661 HydrophobicContact CG-CB 3.75Å; E478-C661 VanDerWaalsContact CG-O 3.3Å; E478-C661 WeakPolarHBondContact CG-O 3.25Å; E478-C661 PolarHBondContact N-O 3.09Å; E478-C661 PolarHBondContact O-N 3.18Å
479	R	94.6	Very high	94.3	Very high	135 Å²	135	34.1 Å²	34.1	51%	0.509	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	133.7	-178.4	178.1	179.4	-66.5	-77.4	-3.6	110.8	F332 N378 R565	F332-R479 HydrophobicContact CD1-CB 4.22Å; F332-R479 HydrophobicContact CE1-CB 4.16Å; F332-R479 HydrophobicContact CG-CB 4.39Å; F332-R479 HydrophobicContact CZ-CB 4.3Å; N378-R479 PolarHBondContact O-NH2 3.17Å; R479-R565 PolarHBondContact O-NH1 2.83Å; R479-R565 PolarHBondContact O-NH2 3.43Å
480	G	95.1	Very high	94.8	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.01	16%	0.16	C	C	.	.	S	Bend	trans	137.3	173.1	168.2	0	0	0	0	0	111.9	D636 H659 S660	G480-D636 WeakPolarHBondContact CA-OD1 3.47Å; G480-H659 PolarHBondContact N-O 3.29Å; G480-H659 CarbonylContact O-C 3.54Å; G480-S660 CarbonylContact O-C 3.55Å; G480-S660 VanDerWaalsContact O-CA 3.3Å; G480-S660 WeakPolarHBondContact O-CA 3.31Å; G480-S660 PolarHBondContact O-N 2.82Å
481	S	97.5	Very high	95.2	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.035	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.6	-176.3	-39.7	0	0	0	0	111.8	C634 M635 F646 K657 S658 C661	S481-C634 WeakPolarHBondContact O-CA 3.09Å; S481-M635 VanDerWaalsContact CB-O 3.23Å; S481-M635 WeakPolarHBondContact CB-O 3.5Å; S481-M635 PolarHBondContact N-O 3.5Å; S481-M635 PolarHBondContact O-N 3.32Å; S481-M635 PolarHBondContact OG-O 3.45Å; S481-F646 VanDerWaalsContact CB-CE2 3.44Å; S481-F646 WeakPolarHBondContact OG-CD2 3.33Å; S481-F646 WeakPolarHBondContact OG-CE2 3.3Å; S481-K657 CarbonylContact C-O 3.59Å; S481-K657 VanDerWaalsContact CA-O 3.23Å; S481-K657 WeakPolarHBondContact CA-O 3.44Å; S481-K657 WeakPolarHBondContact CB-O 3.37Å; S481-S658 VanDerWaalsContact CB-O 3.29Å; S481-S658 WeakPolarHBondContact CB-O 3.43Å; S481-S658 PolarHBondContact OG-O 3.39Å; S481-C661 VanDerWaalsContact C-SG 3.57Å; S481-C661 PolarHBondContact O-SG 3.39Å
482	F	97.5	Very high	95.3	Very high	8 Å²	8	32.4 Å²	32.4	4%	0.035	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.5	-178.9	-179.7	-120	0	0	0	112.2	L290 F474 G633 I656 K657 S660 P662	L290-F482 HydrophobicContact CD1-CD2 4.48Å; L290-F482 HydrophobicContact CD1-CE2 3.59Å; L290-F482 HydrophobicContact CD1-CZ 4.24Å; F474-F482 AromaticContact CE2-CD1 3.95Å; F474-F482 HydrophobicContact CE2-CD1 3.95Å; F474-F482 HydrophobicContact CE2-CE1 4.35Å; F474-F482 AromaticContact CZ-CD1 3.93Å; F474-F482 HydrophobicContact CZ-CD1 3.93Å; F474-F482 AromaticContact CZ-CE1 3.86Å; F474-F482 HydrophobicContact CZ-CE1 3.86Å; F482-G633 WeakPolarHBondContact CD2-O 3.07Å; F482-I656 WeakPolarHBondContact O-CA 3.49Å; F482-K657 HydrophobicContact CB-CB 4.12Å; F482-K657 HydrophobicContact CB-CG 4.29Å; F482-K657 HydrophobicContact CD1-CG 4.29Å; F482-K657 PolarHBondContact N-O 3.27Å; F482-K657 PolarHBondContact O-N 2.1Å; F482-S660 VanDerWaalsContact CB-O 3.3Å; F482-S660 WeakPolarHBondContact CB-O 3.4Å; F482-P662 HydrophobicContact CD1-CG 4.41Å; F482-P662 HydrophobicContact CD2-CG 3.91Å; F482-P662 HydrophobicContact CE1-CG 4.32Å; F482-P662 HydrophobicContact CE2-CG 3.82Å; F482-P662 HydrophobicContact CG-CG 4.22Å; F482-P662 HydrophobicContact CZ-CG 4.03Å
483	F	97.8	Very high	95.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.5	171.1	-67.3	-103.6	0	0	0	109	G485 I613 Y631 H632 G633 M635 F646 I656	F483-G485 VanDerWaalsContact C-N 3.34Å; F483-I613 HydrophobicContact CE1-CG2 4.19Å; F483-I613 HydrophobicContact CZ-CG2 3.74Å; F483-Y631 HydrophobicContact CB-CD1 3.64Å; F483-Y631 HydrophobicContact CB-CE1 4.3Å; F483-Y631 VanDerWaalsContact CB-O 3.31Å; F483-Y631 WeakPolarHBondContact CB-O 3.09Å; F483-Y631 AromaticContact CD2-CD1 3.93Å; F483-Y631 HydrophobicContact CD2-CD1 3.93Å; F483-Y631 HydrophobicContact CD2-CE1 4.21Å; F483-Y631 AromaticContact CG-CD1 3.79Å; F483-Y631 HydrophobicContact CG-CD1 3.79Å; F483-Y631 HydrophobicContact CG-CE1 4.46Å; F483-H632 CarbonylContact O-C 3.6Å; F483-H632 WeakPolarHBondContact O-CA 3.26Å; F483-G633 PolarHBondContact N-O 2.77Å; F483-G633 PolarHBondContact O-N 3.48Å; F483-M635 HydrophobicContact CD2-CB 4.35Å; F483-M635 HydrophobicContact CD2-CE 4.01Å; F483-M635 HydrophobicContact CE1-CE 4.3Å; F483-M635 HydrophobicContact CE2-CB 4.21Å; F483-M635 HydrophobicContact CE2-CE 3.43Å; F483-M635 VanDerWaalsContact CE2-CE 3.43Å; F483-M635 HydrophobicContact CZ-CE 3.6Å; F483-F646 HydrophobicContact CE1-CE1 4.49Å; F483-F646 HydrophobicContact CE2-CE1 4.4Å; F483-F646 HydrophobicContact CE2-CE2 4.31Å; F483-F646 AromaticContact CE2-CZ 3.93Å; F483-F646 HydrophobicContact CE2-CZ 3.93Å; F483-F646 HydrophobicContact CZ-CD1 4.36Å; F483-F646 AromaticContact CZ-CE1 3.6Å; F483-F646 HydrophobicContact CZ-CE1 3.6Å; F483-F646 HydrophobicContact CZ-CE2 4.29Å; F483-F646 AromaticContact CZ-CZ 3.55Å; F483-F646 HydrophobicContact CZ-CZ 3.55Å; F483-I656 HydrophobicContact CD1-CD1 3.89Å; F483-I656 HydrophobicContact CD1-CG1 3.96Å; F483-I656 HydrophobicContact CD1-CG2 4.33Å; F483-I656 HydrophobicContact CE1-CD1 3.76Å; F483-I656 HydrophobicContact CE1-CG1 4.21Å; F483-I656 HydrophobicContact CE1-CG2 4.15Å; F483-I656 HydrophobicContact CZ-CG2 4.23Å
484	S	95.3	Very high	95.3	Very high	32 Å²	32	38.2 Å²	38.2	22%	0.224	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	9.5	-177.8	44.3	0	0	0	0	113.8	A486 H632 S655	S484-A486 VanDerWaalsContact C-N 3.28Å; S484-A486 PolarHBondContact O-N 3.47Å; S484-H632 PolarHBondContact O-CD2 2.81Å; S484-H632 VanDerWaalsContact O-CD2 3.24Å; S484-S655 WeakPolarHBondContact OG-CB 3.39Å; S484-S655 PolarHBondContact OG-O 2.85Å; S484-S655 PolarHBondContact OG-OG 3.44Å
485	G	95.5	Very high	95.3	Very high	14 Å²	14	38.1 Å²	38.1	14%	0.144	20%	0.201	C	C	.	.	S	Bend	trans	69	20.7	-179.1	0	0	0	0	0	115.1	F483 F630 Y631	F483-G485 VanDerWaalsContact C-N 3.34Å; G485-F630 VanDerWaalsContact C-CB 3.48Å; G485-F630 WeakPolarHBondContact O-CB 3.41Å; G485-Y631 WeakPolarHBondContact CA-O 2.91Å; G485-Y631 PolarHBondContact N-O 2.85Å
486	A	94.4	Very high	95.3	Very high	50 Å²	50	39.9 Å²	39.9	41%	0.413	22%	0.215	S	C	.	.	S	Bend	trans	-116.3	-5.7	-178.2	0	0	0	0	0	114.2	S484	S484-A486 VanDerWaalsContact C-N 3.28Å; S484-A486 PolarHBondContact O-N 3.47Å
487	G	94.9	Very high	95.1	Very high	6 Å²	6	39.8 Å²	39.8	6%	0.062	22%	0.22	C	C	.	.			trans	-177	-171.4	-179.2	0	0	0	0	0	112.7
488	L	97.2	Very high	94.5	Very high	23 Å²	23	44.1 Å²	44.1	12%	0.12	25%	0.251	C	S	.	.			trans	-134.7	171.7	-171.6	59.9	70.3	0	0	0	112	Y612 I613 I616 P617 F630 H653 I656	L488-Y612 HydrophobicContact CD1-CD1 3.68Å; L488-Y612 HydrophobicContact CD1-CE1 4.16Å; L488-Y612 HydrophobicContact CD2-CD1 4.03Å; L488-Y612 HydrophobicContact CG-CD1 4.46Å; L488-I613 WeakPolarHBondContact CA-O 3.23Å; L488-I613 WeakPolarHBondContact CB-O 3.38Å; L488-I616 WeakPolarHBondContact CD2-O 3.48Å; L488-P617 HydrophobicContact CD2-CG 4.45Å; L488-F630 HydrophobicContact CB-CD1 4.49Å; L488-F630 HydrophobicContact CB-CE1 4.35Å; L488-F630 HydrophobicContact CD2-CE1 4.21Å; L488-F630 HydrophobicContact CG-CE1 4.36Å; L488-H653 PolarHBondContact O-N 3.11Å; L488-I656 WeakPolarHBondContact O-CD1 3.25Å
489	A	98	Very high	93.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.9	168.2	0	0	0	0	0	110.6	F491 Y612 I613 F646 S651 K652 I656	A489-F491 HydrophobicContact CB-CE2 3.97Å; A489-Y612 CarbonylContact O-C 3.58Å; A489-Y612 WeakPolarHBondContact O-CA 3.32Å; A489-I613 PolarHBondContact N-O 3.48Å; A489-I613 PolarHBondContact O-N 3.03Å; A489-F646 HydrophobicContact CB-CD1 3.7Å; A489-F646 HydrophobicContact CB-CE1 3.98Å; A489-S651 CarbonylContact C-O 3.56Å; A489-S651 WeakPolarHBondContact CA-O 3.3Å; A489-K652 HydrophobicContact CB-CB 4.48Å; A489-K652 HydrophobicContact CB-CG 4.27Å; A489-I656 HydrophobicContact CB-CD1 4.31Å
490	H	97.6	Very high	93.7	Very high	31 Å²	31	42.6 Å²	42.6	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.3	-177.4	177.4	-141.6	0	0	0	110.8	S610 T611 Y612 L650 S651	H490-S610 WeakPolarHBondContact NE2-CB 3.42Å; H490-S610 PolarHBondContact NE2-OG 3.45Å; H490-T611 WeakPolarHBondContact CA-O 3.3Å; H490-T611 PolarHBondContact CD2-O 3.01Å; H490-Y612 HydrophobicContact CB-CD1 3.85Å; H490-Y612 HydrophobicContact CB-CE1 3.6Å; H490-Y612 AromaticContact CD2-CD1 3.94Å; H490-Y612 AromaticContact CD2-CE1 3.47Å; H490-Y612 VanDerWaalsContact CD2-CE1 3.47Å; H490-Y612 WeakPolarHBondContact CD2-CE1 3.49Å; H490-Y612 AromaticContact CD2-CZ 3.53Å; H490-Y612 AromaticContact CG-CE1 3.5Å; H490-Y612 VanDerWaalsContact CG-CE1 3.5Å; H490-Y612 AromaticContact CG-CZ 3.93Å; H490-Y612 AromaticContact NE2-CZ 3.89Å; H490-L650 PolarHBondContact O-N 3.17Å; H490-S651 VanDerWaalsContact CB-OG 3.3Å; H490-S651 WeakPolarHBondContact CB-OG 3.38Å; H490-S651 PolarHBondContact N-O 3.43Å
491	F	97.2	Very high	93.7	Very high	16 Å²	16	43.4 Å²	43.4	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151	176.8	-65.5	-96	0	0	0	110.6	A489 I493 T611 I613 L644 D645 F646 A649	A489-F491 HydrophobicContact CB-CE2 3.97Å; F491-I493 HydrophobicContact CB-CD1 4.02Å; F491-I493 HydrophobicContact CB-CG1 3.89Å; F491-T611 PolarHBondContact N-O 2.72Å; F491-T611 WeakPolarHBondContact O-CB 3.47Å; F491-T611 PolarHBondContact O-N 2.8Å; F491-I613 HydrophobicContact CD2-CG1 4.06Å; F491-I613 HydrophobicContact CE2-CG1 4.16Å; F491-L644 HydrophobicContact CD2-CD1 4.32Å; F491-L644 HydrophobicContact CE2-CD1 4.23Å; F491-L644 HydrophobicContact CZ-CB 4.32Å; F491-L644 HydrophobicContact CZ-CD1 4.37Å; F491-D645 WeakPolarHBondContact CE1-O 2.99Å; F491-F646 AromaticContact CE2-CD1 3.78Å; F491-F646 HydrophobicContact CE2-CD1 3.78Å; F491-F646 AromaticContact CE2-CE1 3.86Å; F491-F646 HydrophobicContact CE2-CE1 3.86Å; F491-F646 AromaticContact CZ-CD1 3.81Å; F491-F646 HydrophobicContact CZ-CD1 3.81Å; F491-F646 HydrophobicContact CZ-CE1 4.21Å; F491-F646 HydrophobicContact CZ-CG 4.46Å; F491-A649 HydrophobicContact CD1-CB 4.32Å; F491-A649 HydrophobicContact CD2-CB 4.46Å; F491-A649 HydrophobicContact CE1-CB 3.82Å; F491-A649 HydrophobicContact CE2-CB 3.98Å; F491-A649 HydrophobicContact CZ-CB 3.66Å
492	D	93.9	Very high	93.5	Very high	121 Å²	121	45.5 Å²	45.5	65%	0.647	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.3	166.6	-172.6	15.6	0	0	0	107.5	L650	D492-L650 HydrophobicContact CB-CD1 3.68Å
493	I	94.4	Very high	93.5	Very high	31 Å²	31	45.1 Å²	45.1	16%	0.159	29%	0.291	C	S	.	.			trans	-125.4	128.5	-172.6	-60.1	-179.4	0	0	0	108.2	F491 Y495 T611 I639 L644	F491-I493 HydrophobicContact CB-CD1 4.02Å; F491-I493 HydrophobicContact CB-CG1 3.89Å; I493-Y495 HydrophobicContact CB-CE2 4.02Å; I493-Y495 HydrophobicContact CG2-CD1 4.45Å; I493-Y495 HydrophobicContact CG2-CE1 4.07Å; I493-Y495 HydrophobicContact CG2-CE2 4.16Å; I493-Y495 WeakPolarHBondContact O-CD2 3.01Å; I493-T611 HydrophobicContact CD1-CG2 4.11Å; I493-I639 HydrophobicContact CD1-CB 4.4Å; I493-I639 HydrophobicContact CD1-CD1 3.69Å; I493-I639 HydrophobicContact CD1-CG2 4.42Å; I493-I639 HydrophobicContact CG2-CG2 4.18Å; I493-L644 HydrophobicContact CD1-CD1 4.19Å; I493-L644 HydrophobicContact CD1-CD2 4.02Å
494	D	92.3	Very high	93.4	Very high	120 Å²	120	47.5 Å²	47.5	64%	0.642	30%	0.304	S	S	*	.			trans	-82	118.1	172.8	-172.5	0	0	0	0	110	S496	D494-S496 WeakPolarHBondContact OD1-CB 3.27Å; D494-S496 PolarHBondContact OD1-N 2.92Å; D494-S496 PolarHBondContact OD1-OG 2.03Å; D494-S496 PolarHBondContact OD2-OG 3.44Å; D494-S496 VanDerWaalsContact OD2-OG 3.05Å
495	Y	94.4	Very high	93.5	Very high	11 Å²	11	46 Å²	46	4%	0.043	29%	0.293	C	S	.	.			trans	-96.7	5.3	178.3	-67.1	-76	0	0	0	113.1	I493 W501 K502 V503 L521 M605 T611 I639	I493-Y495 HydrophobicContact CB-CE2 4.02Å; I493-Y495 HydrophobicContact CG2-CD1 4.45Å; I493-Y495 HydrophobicContact CG2-CE1 4.07Å; I493-Y495 HydrophobicContact CG2-CE2 4.16Å; I493-Y495 WeakPolarHBondContact O-CD2 3.01Å; Y495-W501 CarbonylContact O-C 3.58Å; Y495-W501 WeakPolarHBondContact O-CA 3.01Å; Y495-W501 WeakPolarHBondContact O-CB 3.45Å; Y495-K502 PolarHBondContact O-N 2.8Å; Y495-V503 HydrophobicContact CD1-CB 4.27Å; Y495-V503 HydrophobicContact CD1-CG1 4.36Å; Y495-V503 HydrophobicContact CD1-CG2 3.7Å; Y495-V503 HydrophobicContact CE1-CB 4.4Å; Y495-V503 HydrophobicContact CE1-CG1 3.99Å; Y495-V503 HydrophobicContact CE1-CG2 4.06Å; Y495-V503 HydrophobicContact CG-CG2 4.2Å; Y495-L521 HydrophobicContact CE2-CD1 4.49Å; Y495-L521 HydrophobicContact CE2-CD2 3.89Å; Y495-L521 WeakPolarHBondContact OH-CD2 3.44Å; Y495-M605 HydrophobicContact CD2-CE 4.12Å; Y495-M605 HydrophobicContact CG-CE 3.97Å; Y495-T611 WeakPolarHBondContact CE2-OG1 3.45Å; Y495-T611 WeakPolarHBondContact OH-CG2 3.3Å; Y495-T611 PolarHBondContact OH-OG1 2.75Å; Y495-I639 HydrophobicContact CD1-CG2 4.47Å; Y495-I639 HydrophobicContact CE1-CG2 3.6Å
496	S	91.7	Very high	93.5	Very high	77 Å²	77	47.4 Å²	47.4	54%	0.538	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	134.5	178.5	66.4	0	0	0	0	111.9	D494 S500	D494-S496 WeakPolarHBondContact OD1-CB 3.27Å; D494-S496 PolarHBondContact OD1-N 2.92Å; D494-S496 PolarHBondContact OD1-OG 2.03Å; D494-S496 PolarHBondContact OD2-OG 3.44Å; D494-S496 VanDerWaalsContact OD2-OG 3.05Å; S496-S500 WeakPolarHBondContact CA-O 3.36Å
497	D	88.6	Confident	93.6	Very high	73 Å²	73	45.1 Å²	45.1	39%	0.39	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	120	178.4	-179.9	24.1	0	0	0	110.6	G499 S500 K502	D497-G499 PolarHBondContact O-N 2.71Å; D497-S500 PolarHBondContact N-O 3.39Å; D497-S500 CarbonylContact O-C 3.54Å; D497-S500 VanDerWaalsContact O-C 3.3Å; D497-S500 WeakPolarHBondContact O-CA 3.5Å; D497-S500 PolarHBondContact O-N 2.91Å; D497-K502 HydrophobicContact CB-CB 3.88Å
498	S	82.6	Confident	93.6	Very high	124 Å²	124	46.9 Å²	46.9	87%	0.867	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	34.1	167.1	-55.5	0	0	0	0	115.7
499	G	81.4	Confident	93.4	Very high	91 Å²	91	45.8 Å²	45.8	94%	0.938	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	5.7	-178.4	0	0	0	0	0	115	D497	D497-G499 PolarHBondContact O-N 2.71Å
500	S	90.7	Very high	93.2	Very high	61 Å²	61	46.3 Å²	46.3	43%	0.427	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	-151.9	170.6	-165.3	0	0	0	0	109.3	S496 D497 P574	S496-S500 WeakPolarHBondContact CA-O 3.36Å; D497-S500 PolarHBondContact N-O 3.39Å; D497-S500 CarbonylContact O-C 3.54Å; D497-S500 VanDerWaalsContact O-C 3.3Å; D497-S500 WeakPolarHBondContact O-CA 3.5Å; D497-S500 PolarHBondContact O-N 2.91Å; S500-P574 VanDerWaalsContact OG-CG 3.3Å; S500-P574 WeakPolarHBondContact OG-CG 3.34Å
501	W	94	Very high	93.1	Very high	17 Å²	17	44.9 Å²	44.9	6%	0.064	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.1	171.9	59.9	-94.2	0	0	0	110.7	Y495 V503 V572 T573 P574 L601 N602 M605	Y495-W501 CarbonylContact O-C 3.58Å; Y495-W501 WeakPolarHBondContact O-CA 3.01Å; Y495-W501 WeakPolarHBondContact O-CB 3.45Å; W501-V503 HydrophobicContact CE3-CG2 4.05Å; W501-V503 HydrophobicContact CZ3-CG2 4.01Å; W501-V572 HydrophobicContact CH2-CG1 4.13Å; W501-V572 HydrophobicContact CZ3-CB 4.35Å; W501-V572 HydrophobicContact CZ3-CG1 4.11Å; W501-T573 VanDerWaalsContact CH2-C 3.47Å; W501-T573 WeakPolarHBondContact CH2-O 3Å; W501-P574 HydrophobicContact CD2-CG 4.36Å; W501-P574 HydrophobicContact CZ2-CB 4.2Å; W501-P574 HydrophobicContact CZ2-CG 4.02Å; W501-L601 HydrophobicContact CH2-CD2 3.57Å; W501-L601 HydrophobicContact CH2-CG 3.89Å; W501-L601 HydrophobicContact CZ2-CD2 4.28Å; W501-L601 HydrophobicContact CZ2-CG 4.14Å; W501-L601 HydrophobicContact CZ3-CD2 4.35Å; W501-N602 HydrophobicContact CZ2-CB 4.17Å; W501-N602 PolarHBondContact NE1-OD1 2.94Å; W501-M605 HydrophobicContact CB-CE 4.44Å; W501-M605 HydrophobicContact CD2-CB 3.77Å; W501-M605 HydrophobicContact CD2-CE 3.94Å; W501-M605 HydrophobicContact CD2-CG 3.83Å; W501-M605 HydrophobicContact CE3-CE 3.69Å; W501-M605 HydrophobicContact CE3-CG 4.12Å; W501-M605 HydrophobicContact CG-CB 3.85Å; W501-M605 HydrophobicContact CG-CE 4.27Å; W501-M605 HydrophobicContact CG-CG 4.41Å; W501-M605 HydrophobicContact CH2-CG 4.1Å; W501-M605 HydrophobicContact CZ2-CB 4.15Å; W501-M605 HydrophobicContact CZ2-CG 3.8Å; W501-M605 HydrophobicContact CZ3-CE 4.28Å; W501-M605 HydrophobicContact CZ3-CG 4.24Å
502	K	94.8	Very high	92.9	Very high	49 Å²	49	44.3 Å²	44.3	21%	0.213	28%	0.275	C	S	.	.			trans	-141.2	133.3	175.7	-172.6	-171.3	-178.1	-155.6	0	109.7	Y495 D497 D504 N571 T573 N640	Y495-K502 PolarHBondContact O-N 2.8Å; D497-K502 HydrophobicContact CB-CB 3.88Å; K502-D504 HydrophobicContact CD-CB 4.35Å; K502-D504 IonicContact NZ-OD2 3.64Å; K502-D504 PolarHBondContact NZ-OD2 2.72Å; K502-N571 WeakPolarHBondContact CE-OD1 3.27Å; K502-T573 HydrophobicContact CG-CG2 4.5Å; K502-N640 PolarHBondContact O-ND2 2.9Å; K502-N640 PolarHBondContact O-OD1 2.04Å
503	V	96.2	Very high	92.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	102.1	170.8	-177.1	0	0	0	0	107.8	Y495 W501 I505 L521 L529 N571 V572 M605	Y495-V503 HydrophobicContact CD1-CB 4.27Å; Y495-V503 HydrophobicContact CD1-CG1 4.36Å; Y495-V503 HydrophobicContact CD1-CG2 3.7Å; Y495-V503 HydrophobicContact CE1-CB 4.4Å; Y495-V503 HydrophobicContact CE1-CG1 3.99Å; Y495-V503 HydrophobicContact CE1-CG2 4.06Å; Y495-V503 HydrophobicContact CG-CG2 4.2Å; W501-V503 HydrophobicContact CE3-CG2 4.05Å; W501-V503 HydrophobicContact CZ3-CG2 4.01Å; V503-I505 HydrophobicContact CG1-CD1 3.4Å; V503-I505 HydrophobicContact CG1-CG1 3.79Å; V503-L521 HydrophobicContact CG2-CD1 4.43Å; V503-L529 HydrophobicContact CG1-CD2 4.23Å; V503-N571 CarbonylContact O-C 3.58Å; V503-N571 WeakPolarHBondContact O-CA 3.27Å; V503-V572 HydrophobicContact CB-CB 4.08Å; V503-V572 HydrophobicContact CB-CG2 4.36Å; V503-V572 PolarHBondContact N-O 3.33Å; V503-V572 PolarHBondContact O-N 3.45Å; V503-M605 HydrophobicContact CG2-CE 3.81Å
504	D	96.2	Very high	92.8	Very high	50 Å²	50	40.2 Å²	40.2	27%	0.267	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	106.6	178.6	-167.8	-11.9	0	0	0	109.3	K502 I639 N640	K502-D504 HydrophobicContact CD-CB 4.35Å; K502-D504 IonicContact NZ-OD2 3.64Å; K502-D504 PolarHBondContact NZ-OD2 2.72Å; D504-I639 CarbonylContact O-C 3.27Å; D504-I639 WeakPolarHBondContact O-CA 3.49Å; D504-N640 WeakPolarHBondContact CB-OD1 3.22Å; D504-N640 PolarHBondContact N-OD1 2.01Å; D504-N640 PolarHBondContact O-N 3.3Å
505	I	97	Very high	92.9	Very high	0 Å²	0	35 Å²	35	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.8	-172.9	-64.4	160.5	0	0	0	108.9	V503 M507 L519 I531 Q569 L570 I637 S638 I639	V503-I505 HydrophobicContact CG1-CD1 3.4Å; V503-I505 HydrophobicContact CG1-CG1 3.79Å; I505-M507 HydrophobicContact CG2-CE 3.87Å; I505-M507 HydrophobicContact CG2-CG 3.6Å; I505-M507 HydrophobicContact CG2-SD 3.92Å; I505-L519 HydrophobicContact CD1-CD1 3.72Å; I505-L519 HydrophobicContact CD1-CD2 4.09Å; I505-L519 HydrophobicContact CG1-CD1 4.34Å; I505-I531 HydrophobicContact CD1-CD1 3.94Å; I505-Q569 CarbonylContact O-C 3.46Å; I505-Q569 WeakPolarHBondContact O-CA 3.33Å; I505-L570 HydrophobicContact CB-CB 4.35Å; I505-L570 HydrophobicContact CD1-CD2 4.21Å; I505-L570 PolarHBondContact N-O 3Å; I505-L570 PolarHBondContact O-N 3.39Å; I505-I637 HydrophobicContact CG2-CD1 4.02Å; I505-I637 HydrophobicContact CG2-CG1 4.18Å; I505-S638 WeakPolarHBondContact CA-O 3.05Å; I505-I639 HydrophobicContact CG1-CG1 4.29Å
506	T	96.6	Very high	93	Very high	45 Å²	45	34.5 Å²	34.5	28%	0.276	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.9	165.6	-59.6	0	0	0	0	108.6	M567 V568 Q569 S638	T506-M567 HydrophobicContact CG2-CG 4.37Å; T506-V568 CarbonylContact C-O 3.59Å; T506-V568 WeakPolarHBondContact CA-O 3.47Å; T506-Q569 HydrophobicContact CG2-CG 4.25Å; T506-S638 PolarHBondContact N-O 3.34Å; T506-S638 PolarHBondContact O-N 3Å
507	M	95.3	Very high	93.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.4	178.7	-65.6	174.4	-68.4	0	0	110.4	I505 I509 L518 I531 M567 V568 M635 D636 I637	I505-M507 HydrophobicContact CG2-CE 3.87Å; I505-M507 HydrophobicContact CG2-CG 3.6Å; I505-M507 HydrophobicContact CG2-SD 3.92Å; M507-I509 HydrophobicContact CB-CG2 3.92Å; M507-L518 HydrophobicContact CE-CD1 4.16Å; M507-L518 HydrophobicContact SD-CB 4.14Å; M507-L518 HydrophobicContact SD-CD1 4.17Å; M507-I531 HydrophobicContact CE-CD1 3.86Å; M507-I531 HydrophobicContact CE-CG2 4.34Å; M507-M567 CarbonylContact O-C 3.51Å; M507-M567 WeakPolarHBondContact O-CA 3.07Å; M507-V568 HydrophobicContact CE-CB 4.49Å; M507-V568 HydrophobicContact CE-CG1 4.26Å; M507-V568 PolarHBondContact N-O 3.49Å; M507-V568 PolarHBondContact O-N 3.24Å; M507-M635 HydrophobicContact SD-SD 4.26Å; M507-D636 CarbonylContact C-O 3.3Å; M507-D636 VanDerWaalsContact CA-O 3.29Å; M507-D636 WeakPolarHBondContact CA-O 3.5Å; M507-I637 HydrophobicContact CG-CB 4.03Å; M507-I637 HydrophobicContact CG-CD1 3.75Å; M507-I637 HydrophobicContact CG-CG1 3.64Å; M507-I637 HydrophobicContact SD-CD1 3.89Å; M507-I637 HydrophobicContact SD-CG1 4.45Å
508	N	94.6	Very high	93.7	Very high	44 Å²	44	27.4 Å²	27.4	24%	0.235	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	101.3	169.3	-173.7	29.9	0	0	0	107.7	R565 L566 M635 D636	N508-R565 WeakPolarHBondContact ND2-CD 3.31Å; N508-R565 WeakPolarHBondContact OD1-CB 3.04Å; N508-L566 WeakPolarHBondContact CA-O 3.41Å; N508-M635 WeakPolarHBondContact O-CA 3.48Å; N508-D636 HydrophobicContact CB-CB 4.31Å; N508-D636 PolarHBondContact N-O 3.32Å; N508-D636 PolarHBondContact O-N 3.01Å
509	I	94.5	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.1	-167.9	61.3	176.2	0	0	0	112.1	M507 L518 L560 R565 L566 V568 C634 M635	M507-I509 HydrophobicContact CB-CG2 3.92Å; I509-L518 HydrophobicContact CD1-CD1 3.84Å; I509-L518 HydrophobicContact CG2-CD1 4.38Å; I509-L518 HydrophobicContact CG2-CD2 4.07Å; I509-L560 HydrophobicContact CD1-CD2 3.78Å; I509-R565 CarbonylContact O-C 3.55Å; I509-R565 WeakPolarHBondContact O-CA 3.43Å; I509-L566 HydrophobicContact CG1-CB 4.2Å; I509-L566 PolarHBondContact N-O 3.25Å; I509-L566 PolarHBondContact O-N 2.88Å; I509-V568 HydrophobicContact CD1-CG2 4.05Å; I509-V568 HydrophobicContact CG1-CG2 4.32Å; I509-C634 CarbonylContact C-O 3.51Å; I509-C634 WeakPolarHBondContact CA-O 3.39Å; I509-M635 HydrophobicContact CG2-CB 4.14Å; I509-M635 HydrophobicContact CG2-CG 3.85Å; I509-M635 HydrophobicContact CG2-SD 4.1Å
510	R	94.1	Very high	95.3	Very high	10 Å²	10	17.1 Å²	17.1	4%	0.038	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	91.4	163.4	-176.9	179.6	69.7	-153.2	-4.6	107.9	E478 P563 R565 Y631 G633 C634 P662	E478-R510 VanDerWaalsContact CD-NH2 3.28Å; E478-R510 IonicContact OE1-CZ 3.27Å; E478-R510 IonicContact OE1-NH1 3.9Å; E478-R510 PolarHBondContact OE1-NH1 3.02Å; E478-R510 IonicContact OE1-NH2 3.71Å; E478-R510 PolarHBondContact OE1-NH2 2.85Å; E478-R510 IonicContact OE2-CZ 3.08Å; E478-R510 IonicContact OE2-NH1 3.44Å; E478-R510 PolarHBondContact OE2-NH1 2.84Å; E478-R510 VanDerWaalsContact OE2-NH1 3.08Å; E478-R510 IonicContact OE2-NH2 3.95Å; R510-P563 WeakPolarHBondContact CD-O 3.5Å; R510-R565 HydrophobicContact CB-CG 4.2Å; R510-Y631 PolarHBondContact O-OH 3.35Å; R510-G633 WeakPolarHBondContact O-CA 3.31Å; R510-C634 HydrophobicContact CB-CB 4.37Å; R510-C634 PolarHBondContact N-O 3.25Å; R510-C634 PolarHBondContact O-N 3.13Å; R510-P662 PolarHBondContact NH2-O 3.22Å
511	P	94.6	Very high	95.6	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.006	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	149.4	175.2	24.1	-27.1	0	0	0	110.1	V533 L560 Y631	P511-V533 HydrophobicContact CB-CG2 4.47Å; P511-L560 VanDerWaalsContact CD-O 3.24Å; P511-L560 WeakPolarHBondContact CD-O 3.49Å; P511-L560 HydrophobicContact CG-CB 4.34Å; P511-L560 HydrophobicContact CG-CD2 4.37Å; P511-L560 WeakPolarHBondContact CG-O 3.06Å; P511-Y631 HydrophobicContact CB-CE2 3.91Å
512	S	93.7	Very high	95.7	Very high	4 Å²	4	14 Å²	14	3%	0.028	7%	0.069	C	C	.	.	S	Bend	trans	-114.1	-14.1	171.3	154.2	0	0	0	0	111.8	V286 C287 V288 H632	V286-S512 WeakPolarHBondContact CA-O 3.45Å; V286-S512 WeakPolarHBondContact CG1-O 3.31Å; C287-S512 PolarHBondContact N-O 3.43Å; V288-S512 PolarHBondContact N-O 2.8Å; V288-S512 WeakPolarHBondContact O-CB 3.32Å; V288-S512 PolarHBondContact O-OG 3.15Å; S512-H632 WeakPolarHBondContact CB-ND1 3.43Å; S512-H632 PolarHBondContact N-O 2.81Å; S512-H632 PolarHBondContact OG-CE1 2.62Å; S512-H632 VanDerWaalsContact OG-CE1 3.3Å; S512-H632 PolarHBondContact OG-ND1 2.86Å; S512-H632 VanDerWaalsContact OG-ND1 3.12Å
513	R	93.5	Very high	95.7	Very high	66 Å²	66	15.2 Å²	15.2	25%	0.249	7%	0.073	C	C	.	.	B	Isolated β-bridge	trans	-118.8	149.3	168.6	-68.6	-175	-174.6	171.7	1.1	110.7	I284 P285 V286 T515 H632	I284-R513 HydrophobicContact CG2-CB 3.95Å; P285-R513 WeakPolarHBondContact O-CA 2.93Å; V286-R513 HydrophobicContact CG2-CG 4.24Å; R513-T515 VanDerWaalsContact C-N 3.28Å; R513-T515 PolarHBondContact O-N 3.07Å; R513-H632 HydrophobicContact CB-CB 4.07Å; R513-H632 HydrophobicContact CG-CB 3.78Å; R513-H632 PolarHBondContact N-O 2.8Å
514	S	92.3	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-75.4	-11.9	-175.3	60.1	0	0	0	0	114.4	P285 V533 V534 T535	P285-S514 WeakPolarHBondContact CD-OG 3.34Å; P285-S514 PolarHBondContact O-N 3.48Å; S514-V533 WeakPolarHBondContact O-CG1 3.38Å; S514-V534 CarbonylContact O-C 3.27Å; S514-V534 PolarHBondContact O-N 3.22Å; S514-T535 WeakPolarHBondContact CB-OG1 3.46Å; S514-T535 PolarHBondContact O-N 3.35Å; S514-T535 PolarHBondContact OG-OG1 3.05Å
515	T	94.6	Very high	95.1	Very high	12 Å²	12	23.2 Å²	23.2	7%	0.074	12%	0.116	C	C	.	.			trans	-133.4	134.4	176.4	-64.2	0	0	0	0	111.8	Q273 I284 R513 V533 T535 V627 A629	Q273-T515 PolarHBondContact OE1-OG1 2.88Å; I284-T515 HydrophobicContact CD1-CG2 4.27Å; R513-T515 VanDerWaalsContact C-N 3.28Å; R513-T515 PolarHBondContact O-N 3.07Å; T515-V533 CarbonylContact C-O 3.57Å; T515-V533 VanDerWaalsContact CA-O 3.27Å; T515-V533 WeakPolarHBondContact CA-O 3.41Å; T515-T535 PolarHBondContact OG1-N 3.38Å; T515-T535 PolarHBondContact OG1-OG1 2.87Å; T515-V627 HydrophobicContact CG2-CG1 3.61Å; T515-A629 HydrophobicContact CG2-CB 4.11Å
516	G	96.3	Very high	94.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.7	144.4	174.1	0	0	0	0	0	114.3	A532 V533	G516-A532 WeakPolarHBondContact O-CA 3.39Å; G516-V533 PolarHBondContact N-O 2.75Å; G516-V533 PolarHBondContact O-N 2.79Å
517	V	97.9	Very high	94.9	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	120.1	179.2	179.8	0	0	0	0	110.7	A520 A532 G614 G615 I616 V627 A629 Y631	V517-A520 HydrophobicContact CG1-CB 4Å; V517-A532 HydrophobicContact CG2-CB 4.36Å; V517-G614 CarbonylContact O-C 3.38Å; V517-G614 WeakPolarHBondContact O-CA 3.42Å; V517-G615 PolarHBondContact O-N 3.26Å; V517-I616 HydrophobicContact CG1-CG2 4.33Å; V517-I616 HydrophobicContact CG2-CG2 4.4Å; V517-V627 HydrophobicContact CG2-CB 4.13Å; V517-V627 HydrophobicContact CG2-CG1 3.86Å; V517-V627 WeakPolarHBondContact CG2-O 3.15Å; V517-A629 PolarHBondContact N-O 2.81Å; V517-Y631 VanDerWaalsContact O-CB 3.31Å; V517-Y631 WeakPolarHBondContact O-CB 3.24Å
518	L	97.7	Very high	95	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-49.4	174.8	-64.8	174.4	0	0	0	111.2	M507 I509 I531 V533 L543 I613 G614 Y631 M635	M507-L518 HydrophobicContact CE-CD1 4.16Å; M507-L518 HydrophobicContact SD-CB 4.14Å; M507-L518 HydrophobicContact SD-CD1 4.17Å; I509-L518 HydrophobicContact CD1-CD1 3.84Å; I509-L518 HydrophobicContact CG2-CD1 4.38Å; I509-L518 HydrophobicContact CG2-CD2 4.07Å; L518-I531 HydrophobicContact CD1-CG2 4.29Å; L518-I531 PolarHBondContact N-O 2.93Å; L518-V533 HydrophobicContact CD1-CG2 4.24Å; L518-V533 HydrophobicContact CD2-CG2 4.3Å; L518-V533 HydrophobicContact CG-CG2 4.2Å; L518-L543 HydrophobicContact CD1-CD1 3.51Å; L518-I613 WeakPolarHBondContact O-CA 3.25Å; L518-G614 PolarHBondContact O-N 3.36Å; L518-Y631 HydrophobicContact CD2-CD1 4.2Å; L518-Y631 HydrophobicContact CD2-CD2 3.4Å; L518-Y631 VanDerWaalsContact CD2-CD2 3.4Å; L518-Y631 HydrophobicContact CD2-CE1 4.14Å; L518-Y631 HydrophobicContact CD2-CE2 3.28Å; L518-Y631 HydrophobicContact CD2-CG 3.87Å; L518-Y631 HydrophobicContact CG-CD2 4.46Å; L518-M635 HydrophobicContact CB-SD 4.29Å; L518-M635 HydrophobicContact CD2-SD 3.85Å
519	L	98	Very high	95.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	140.3	-178.3	179.1	148.7	0	0	0	109.7	I505 L521 S530 I531 T611 Y612 I613 I637 I639	I505-L519 HydrophobicContact CD1-CD1 3.72Å; I505-L519 HydrophobicContact CD1-CD2 4.09Å; I505-L519 HydrophobicContact CG1-CD1 4.34Å; L519-L521 HydrophobicContact CD2-CD2 4.22Å; L519-L521 HydrophobicContact CD2-CG 4.33Å; L519-S530 CarbonylContact O-C 3.57Å; L519-S530 VanDerWaalsContact O-CA 3.27Å; L519-S530 WeakPolarHBondContact O-CA 3.06Å; L519-I531 HydrophobicContact CB-CD1 4.36Å; L519-I531 HydrophobicContact CD2-CD1 4.46Å; L519-I531 PolarHBondContact N-O 3.42Å; L519-I531 PolarHBondContact O-N 2.93Å; L519-T611 HydrophobicContact CD1-CG2 4.32Å; L519-Y612 CarbonylContact C-O 3.52Å; L519-Y612 WeakPolarHBondContact CA-O 3.26Å; L519-I613 HydrophobicContact CB-CD1 4.11Å; L519-I613 HydrophobicContact CD1-CD1 3.56Å; L519-I613 HydrophobicContact CG-CD1 3.82Å; L519-I637 HydrophobicContact CD1-CD1 3.74Å; L519-I639 HydrophobicContact CD1-CD1 3.69Å
520	A	97.9	Very high	95.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	131.4	172.5	0	0	0	0	0	110.6	V517 V527 L529 Y612 I616	V517-A520 HydrophobicContact CG1-CB 4Å; A520-V527 HydrophobicContact CB-CG1 4.1Å; A520-L529 WeakPolarHBondContact CA-O 3.45Å; A520-Y612 PolarHBondContact N-O 2.88Å; A520-Y612 PolarHBondContact O-N 2.68Å; A520-I616 HydrophobicContact CB-CG2 3.71Å
521	L	97.6	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133	164.9	-62.6	-166.1	0	0	0	108	Y495 V503 L519 V527 P528 L529 M605 I609 T611	Y495-L521 HydrophobicContact CE2-CD1 4.49Å; Y495-L521 HydrophobicContact CE2-CD2 3.89Å; Y495-L521 WeakPolarHBondContact OH-CD2 3.44Å; V503-L521 HydrophobicContact CG2-CD1 4.43Å; L519-L521 HydrophobicContact CD2-CD2 4.22Å; L519-L521 HydrophobicContact CD2-CG 4.33Å; L521-V527 WeakPolarHBondContact O-CA 3.07Å; L521-P528 HydrophobicContact CB-CG 4.21Å; L521-P528 WeakPolarHBondContact O-CD 3.46Å; L521-L529 HydrophobicContact CB-CB 4.15Å; L521-L529 HydrophobicContact CD1-CB 4.03Å; L521-L529 HydrophobicContact CD1-CD2 3.8Å; L521-L529 HydrophobicContact CD1-CG 4.42Å; L521-L529 HydrophobicContact CG-CB 4.11Å; L521-L529 HydrophobicContact CG-CD2 4.22Å; L521-L529 HydrophobicContact CG-CG 4.47Å; L521-L529 PolarHBondContact N-O 3.21Å; L521-M605 HydrophobicContact CD1-CE 4.31Å; L521-M605 HydrophobicContact CD1-SD 3.8Å; L521-I609 HydrophobicContact CB-CG2 3.67Å; L521-I609 HydrophobicContact CD1-CG2 4.27Å; L521-I609 HydrophobicContact CD2-CG2 4.03Å; L521-I609 HydrophobicContact CG-CG2 4.19Å; L521-T611 HydrophobicContact CD2-CG2 4.08Å
522	V	96.6	Very high	95.5	Very high	11 Å²	11	21.4 Å²	21.4	7%	0.067	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.4	-174.6	174	0	0	0	0	110.3	T526 V527 S610 Y612 I620	V522-T526 WeakPolarHBondContact CA-O 3.23Å; V522-V527 HydrophobicContact CG2-CG2 4.48Å; V522-S610 PolarHBondContact N-O 3.31Å; V522-S610 PolarHBondContact O-N 3.1Å; V522-S610 VanDerWaalsContact O-N 3.11Å; V522-Y612 HydrophobicContact CB-CD2 3.85Å; V522-Y612 HydrophobicContact CB-CE2 3.76Å; V522-Y612 HydrophobicContact CG1-CE2 4.24Å; V522-Y612 HydrophobicContact CG2-CD2 3.53Å; V522-Y612 HydrophobicContact CG2-CE2 3.89Å; V522-I620 HydrophobicContact CG1-CD1 3.56Å; V522-I620 HydrophobicContact CG1-CG1 4.25Å
523	Y	94.8	Very high	95.5	Very high	75 Å²	75	21.2 Å²	21.2	29%	0.294	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	123.1	175.7	177.6	-104.6	0	0	0	110.3	N525 T526 T604 N607	Y523-N525 PolarHBondContact O-N 2.03Å; Y523-T526 PolarHBondContact N-O 3.45Å; Y523-T526 VanDerWaalsContact N-O 3.08Å; Y523-T526 PolarHBondContact O-N 2.96Å; Y523-T526 PolarHBondContact O-OG1 2.74Å; Y523-T604 HydrophobicContact CD1-CG2 3.69Å; Y523-T604 HydrophobicContact CG-CG2 3.87Å; Y523-N607 HydrophobicContact CD2-CB 3.92Å; Y523-N607 HydrophobicContact CE2-CB 3.33Å; Y523-N607 PolarHBondContact OH-OD1 2.68Å
524	N	89.4	Confident	95.5	Very high	131 Å²	131	19.5 Å²	19.5	70%	0.701	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.1	53.4	173.3	-163.2	30.6	0	0	0	114.8	T526	N524-T526 PolarHBondContact O-N 2.63Å
525	N	89.7	Confident	95.4	Very high	88 Å²	88	21 Å²	21	47%	0.471	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	6.2	-177.2	-56.6	-15.5	0	0	0	116.7	Y523 I620	Y523-N525 PolarHBondContact O-N 2.03Å; N525-I620 HydrophobicContact CB-CD1 4.46Å
526	T	93.5	Very high	94.9	Very high	59 Å²	59	23.9 Å²	23.9	36%	0.362	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	159.8	172.2	74.2	0	0	0	0	111.4	V522 Y523 N524 P528	V522-T526 WeakPolarHBondContact CA-O 3.23Å; Y523-T526 PolarHBondContact N-O 3.45Å; Y523-T526 VanDerWaalsContact N-O 3.08Å; Y523-T526 PolarHBondContact O-N 2.96Å; Y523-T526 PolarHBondContact O-OG1 2.74Å; N524-T526 PolarHBondContact O-N 2.63Å; T526-P528 VanDerWaalsContact C-CD 3.47Å; T526-P528 VanDerWaalsContact O-CD 3.31Å; T526-P528 WeakPolarHBondContact O-CD 3.08Å
527	V	96.8	Very high	93.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	79.7	177.5	-172.5	0	0	0	0	108.5	A520 L521 V522 L529 I620 A624 T625	A520-V527 HydrophobicContact CB-CG1 4.1Å; L521-V527 WeakPolarHBondContact O-CA 3.07Å; V522-V527 HydrophobicContact CG2-CG2 4.48Å; V527-L529 VanDerWaalsContact C-N 3.29Å; V527-L529 PolarHBondContact O-N 3.24Å; V527-I620 HydrophobicContact CG2-CG2 3.72Å; V527-A624 HydrophobicContact CG2-CB 4.18Å; V527-T625 HydrophobicContact CG2-CG2 4.13Å
528	P	96.3	Very high	92.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	-33.7	-175.5	21	-36.2	0	0	0	114.3	L521 T526 L547 D548 L601 T604	L521-P528 HydrophobicContact CB-CG 4.21Å; L521-P528 WeakPolarHBondContact O-CD 3.46Å; T526-P528 VanDerWaalsContact C-CD 3.47Å; T526-P528 VanDerWaalsContact O-CD 3.31Å; T526-P528 WeakPolarHBondContact O-CD 3.08Å; P528-L547 VanDerWaalsContact O-CA 3.31Å; P528-L547 WeakPolarHBondContact O-CA 3.48Å; P528-D548 PolarHBondContact O-N 3.42Å; P528-D548 VanDerWaalsContact O-N 3.16Å; P528-L601 HydrophobicContact CB-CD1 3.86Å; P528-T604 HydrophobicContact CB-CG2 3.92Å; P528-T604 HydrophobicContact CG-CG2 3.9Å
529	L	97.3	Very high	91	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	129.7	175.8	170.9	65.9	0	0	0	109	V503 A520 L521 V527 V545 F546 L547 V572 L601	V503-L529 HydrophobicContact CG1-CD2 4.23Å; A520-L529 WeakPolarHBondContact CA-O 3.45Å; L521-L529 HydrophobicContact CB-CB 4.15Å; L521-L529 HydrophobicContact CD1-CB 4.03Å; L521-L529 HydrophobicContact CD1-CD2 3.8Å; L521-L529 HydrophobicContact CD1-CG 4.42Å; L521-L529 HydrophobicContact CG-CB 4.11Å; L521-L529 HydrophobicContact CG-CD2 4.22Å; L521-L529 HydrophobicContact CG-CG 4.47Å; L521-L529 PolarHBondContact N-O 3.21Å; V527-L529 VanDerWaalsContact C-N 3.29Å; V527-L529 PolarHBondContact O-N 3.24Å; L529-V545 HydrophobicContact CD1-CG1 3.61Å; L529-F546 WeakPolarHBondContact CA-O 3Å; L529-L547 HydrophobicContact CB-CD2 4.18Å; L529-L547 HydrophobicContact CD1-CD2 3.52Å; L529-L547 HydrophobicContact CG-CD2 4.44Å; L529-V572 HydrophobicContact CD2-CG2 4.27Å; L529-L601 HydrophobicContact CB-CD1 4.22Å
530	S	97.7	Very high	90.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	152.4	166.9	58.6	0	0	0	0	112.2	L519 V545 F546 T625	L519-S530 CarbonylContact O-C 3.57Å; L519-S530 VanDerWaalsContact O-CA 3.27Å; L519-S530 WeakPolarHBondContact O-CA 3.06Å; S530-V545 WeakPolarHBondContact O-CA 3.19Å; S530-F546 PolarHBondContact N-O 2.81Å; S530-F546 PolarHBondContact O-N 3.22Å; S530-T625 PolarHBondContact OG-OG1 2.98Å
531	I	96.9	Very high	89.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	125.6	174.9	-46.9	164.5	0	0	0	106.4	I505 M507 L518 L519 L543 Q544 V545 L570	I505-I531 HydrophobicContact CD1-CD1 3.94Å; M507-I531 HydrophobicContact CE-CD1 3.86Å; M507-I531 HydrophobicContact CE-CG2 4.34Å; L518-I531 HydrophobicContact CD1-CG2 4.29Å; L518-I531 PolarHBondContact N-O 2.93Å; L519-I531 HydrophobicContact CB-CD1 4.36Å; L519-I531 HydrophobicContact CD2-CD1 4.46Å; L519-I531 PolarHBondContact N-O 3.42Å; L519-I531 PolarHBondContact O-N 2.93Å; I531-L543 HydrophobicContact CG2-CD1 3.87Å; I531-L543 HydrophobicContact CG2-CD2 4.34Å; I531-L543 HydrophobicContact CG2-CG 4.1Å; I531-Q544 WeakPolarHBondContact CA-O 3.21Å; I531-V545 HydrophobicContact CG1-CG1 4.46Å; I531-V545 HydrophobicContact CG2-CG2 4.45Å; I531-L570 HydrophobicContact CD1-CD2 3.24Å; I531-L570 HydrophobicContact CD1-CG 4.49Å; I531-L570 HydrophobicContact CG1-CD2 3.74Å
532	A	96.8	Very high	89.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.7	-178.9	0	0	0	0	0	111.8	G516 V517 Q544 F546 V627	G516-A532 WeakPolarHBondContact O-CA 3.39Å; V517-A532 HydrophobicContact CG2-CB 4.36Å; A532-Q544 PolarHBondContact N-O 3.46Å; A532-Q544 PolarHBondContact O-N 3.34Å; A532-F546 HydrophobicContact CB-CE2 4.15Å; A532-V627 HydrophobicContact CB-CB 3.85Å; A532-V627 HydrophobicContact CB-CG1 3.98Å; A532-V627 HydrophobicContact CB-CG2 3.89Å
533	V	94.9	Very high	89.1	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	134	162.5	-168.6	0	0	0	0	106.8	P511 S514 T515 G516 L518 A541 N542 L543 Y631	P511-V533 HydrophobicContact CB-CG2 4.47Å; S514-V533 WeakPolarHBondContact O-CG1 3.38Å; T515-V533 CarbonylContact C-O 3.57Å; T515-V533 VanDerWaalsContact CA-O 3.27Å; T515-V533 WeakPolarHBondContact CA-O 3.41Å; G516-V533 PolarHBondContact N-O 2.75Å; G516-V533 PolarHBondContact O-N 2.79Å; L518-V533 HydrophobicContact CD1-CG2 4.24Å; L518-V533 HydrophobicContact CD2-CG2 4.3Å; L518-V533 HydrophobicContact CG-CG2 4.2Å; V533-A541 HydrophobicContact CG1-CB 3.61Å; V533-N542 WeakPolarHBondContact CA-O 3.47Å; V533-L543 HydrophobicContact CG2-CD1 4.19Å; V533-Y631 HydrophobicContact CG2-CE2 4.39Å
534	V	93.5	Very high	89.1	Confident	29 Å²	29	48 Å²	48	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.5	-175.8	-175.4	0	0	0	0	108.8	S514 K536 A541 N542 Q544 F546 V627	S514-V534 CarbonylContact O-C 3.27Å; S514-V534 PolarHBondContact O-N 3.22Å; V534-K536 PolarHBondContact O-N 2.8Å; V534-A541 CarbonylContact O-C 3.6Å; V534-A541 WeakPolarHBondContact O-CA 3.35Å; V534-N542 PolarHBondContact N-O 2.03Å; V534-N542 PolarHBondContact O-N 3.46Å; V534-Q544 HydrophobicContact CB-CG 4.44Å; V534-Q544 HydrophobicContact CG2-CB 4.06Å; V534-Q544 HydrophobicContact CG2-CG 4.01Å; V534-F546 HydrophobicContact CG2-CE2 4.24Å; V534-F546 HydrophobicContact CG2-CZ 4.05Å; V534-V627 HydrophobicContact CG2-CG2 3.85Å
535	T	90	Very high	89.4	Confident	33 Å²	33	41.7 Å²	41.7	20%	0.202	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	135.9	177.6	-57.4	0	0	0	0	111.5	Q273 S514 T515 E537	Q273-T535 PolarHBondContact NE2-OG1 3.48Å; Q273-T535 PolarHBondContact OE1-OG1 2.89Å; S514-T535 WeakPolarHBondContact CB-OG1 3.46Å; S514-T535 PolarHBondContact O-N 3.35Å; S514-T535 PolarHBondContact OG-OG1 3.05Å; T515-T535 PolarHBondContact OG1-N 3.38Å; T515-T535 PolarHBondContact OG1-OG1 2.87Å; T535-E537 WeakPolarHBondContact CG2-O 3.44Å
536	K	83.8	Confident	89.8	Confident	71 Å²	71	37.8 Å²	37.8	31%	0.309	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	116.9	171.1	177.6	-176.6	-174.6	174.4	0	107.7	V534 D540 N542 D556	V534-K536 PolarHBondContact O-N 2.8Å; K536-D540 HydrophobicContact CB-CB 4.49Å; K536-D540 PolarHBondContact N-O 3.25Å; K536-D540 CarbonylContact O-C 3.5Å; K536-D540 VanDerWaalsContact O-C 3.27Å; K536-D540 WeakPolarHBondContact O-CA 3.22Å; K536-D540 VanDerWaalsContact O-CB 3.3Å; K536-D540 WeakPolarHBondContact O-CB 3.43Å; K536-D540 PolarHBondContact O-N 2.74Å; K536-N542 WeakPolarHBondContact CD-OD1 2.97Å; K536-D556 IonicContact NZ-OD1 3.75Å; K536-D556 PolarHBondContact NZ-OD1 3.49Å
537	E	74.8	Confident	89.9	Confident	166 Å²	166	35 Å²	35	78%	0.776	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	-166.4	-174.2	-55.8	177.2	-169.9	0	0	111.3	T535 E539	T535-E537 WeakPolarHBondContact CG2-O 3.44Å; E537-E539 PolarHBondContact O-N 2.66Å
538	E	68.3	Low	89.7	Confident	176 Å²	176	37.1 Å²	37.1	82%	0.822	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.5	-167.9	-71.4	-174.7	168.8	0	0	114.8
539	E	66.3	Low	89.4	Confident	156 Å²	156	38 Å²	38	73%	0.729	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.1	-0.1	-174.5	-65.9	-172	171.5	0	0	115.3	E537	E537-E539 PolarHBondContact O-N 2.66Å
540	D	79.2	Confident	89.1	Confident	43 Å²	43	41.2 Å²	41.2	23%	0.23	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	167.7	178.9	-155	2	0	0	0	111.1	K536	K536-D540 HydrophobicContact CB-CB 4.49Å; K536-D540 PolarHBondContact N-O 3.25Å; K536-D540 CarbonylContact O-C 3.5Å; K536-D540 VanDerWaalsContact O-C 3.27Å; K536-D540 WeakPolarHBondContact O-CA 3.22Å; K536-D540 VanDerWaalsContact O-CB 3.3Å; K536-D540 WeakPolarHBondContact O-CB 3.43Å; K536-D540 PolarHBondContact O-N 2.74Å
541	A	86.4	Confident	89	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.5	178	0	0	0	0	0	111.3	V533 V534 L560	V533-A541 HydrophobicContact CG1-CB 3.61Å; V534-A541 CarbonylContact O-C 3.6Å; V534-A541 WeakPolarHBondContact O-CA 3.35Å; A541-L560 HydrophobicContact CB-CB 4.26Å; A541-L560 VanDerWaalsContact O-CD1 3.28Å; A541-L560 WeakPolarHBondContact O-CD1 3.36Å
542	N	91.3	Very high	88.9	Confident	14 Å²	14	43.1 Å²	43.1	8%	0.075	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	156.8	169.7	-81.3	-7.9	0	0	0	110.5	V533 V534 K536 T554 D556 L560	V533-N542 WeakPolarHBondContact CA-O 3.47Å; V534-N542 PolarHBondContact N-O 2.03Å; V534-N542 PolarHBondContact O-N 3.46Å; K536-N542 WeakPolarHBondContact CD-OD1 2.97Å; N542-T554 HydrophobicContact CB-CG2 4.21Å; N542-D556 VanDerWaalsContact CG-OD1 3.3Å; N542-D556 PolarHBondContact ND2-OD1 2.86Å; N542-D556 PolarHBondContact OD1-OD1 3.46Å; N542-L560 VanDerWaalsContact C-CD1 3.47Å
543	L	93.4	Very high	88.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.5	168	-172.5	75.6	0	0	0	108.7	L518 I531 V533 L555 L560 V568 I579	L518-L543 HydrophobicContact CD1-CD1 3.51Å; I531-L543 HydrophobicContact CG2-CD1 3.87Å; I531-L543 HydrophobicContact CG2-CD2 4.34Å; I531-L543 HydrophobicContact CG2-CG 4.1Å; V533-L543 HydrophobicContact CG2-CD1 4.19Å; L543-L555 HydrophobicContact CB-CB 4.24Å; L543-L555 HydrophobicContact CB-CD2 4.15Å; L543-L555 HydrophobicContact CD2-CD2 4.45Å; L543-L555 PolarHBondContact N-O 3.09Å; L543-L555 VanDerWaalsContact N-O 3.15Å; L543-L555 PolarHBondContact O-N 3.43Å; L543-L560 HydrophobicContact CB-CD1 3.89Å; L543-V568 HydrophobicContact CD2-CB 4.41Å; L543-V568 HydrophobicContact CD2-CG1 3.6Å; L543-V568 HydrophobicContact CD2-CG2 3.99Å; L543-I579 HydrophobicContact CD2-CD1 3.73Å; L543-I579 HydrophobicContact CG-CD1 4.42Å
544	Q	94.9	Very high	88.7	Confident	37 Å²	37	44.5 Å²	44.5	17%	0.173	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.3	-179.7	-64	-168.6	13.2	0	0	111.1	I531 A532 V534 F546 S551 A553 T554	I531-Q544 WeakPolarHBondContact CA-O 3.21Å; A532-Q544 PolarHBondContact N-O 3.46Å; A532-Q544 PolarHBondContact O-N 3.34Å; V534-Q544 HydrophobicContact CB-CG 4.44Å; V534-Q544 HydrophobicContact CG2-CB 4.06Å; V534-Q544 HydrophobicContact CG2-CG 4.01Å; Q544-F546 HydrophobicContact CB-CD2 4.38Å; Q544-F546 HydrophobicContact CB-CE1 4.35Å; Q544-F546 HydrophobicContact CB-CE2 3.56Å; Q544-F546 HydrophobicContact CB-CZ 3.55Å; Q544-F546 HydrophobicContact CG-CZ 4.36Å; Q544-S551 PolarHBondContact OE1-OG 2.99Å; Q544-A553 WeakPolarHBondContact CA-O 3.47Å; Q544-T554 HydrophobicContact CG-CG2 4.13Å
545	V	96.6	Very high	88.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.1	170.7	-170	0	0	0	0	108.5	L529 S530 I531 V552 A553 L570 I577 I579	L529-V545 HydrophobicContact CD1-CG1 3.61Å; S530-V545 WeakPolarHBondContact O-CA 3.19Å; I531-V545 HydrophobicContact CG1-CG1 4.46Å; I531-V545 HydrophobicContact CG2-CG2 4.45Å; V545-V552 HydrophobicContact CB-CG2 4.29Å; V545-V552 HydrophobicContact CG1-CG2 4.3Å; V545-V552 WeakPolarHBondContact O-CG2 3.11Å; V545-V552 PolarHBondContact O-N 3.39Å; V545-A553 HydrophobicContact CB-CB 4.26Å; V545-A553 HydrophobicContact CG2-CB 4.34Å; V545-A553 PolarHBondContact N-O 3.48Å; V545-L570 HydrophobicContact CG1-CD2 4.49Å; V545-L570 HydrophobicContact CG2-CD1 4.1Å; V545-I577 HydrophobicContact CB-CD1 4.19Å; V545-I577 HydrophobicContact CG1-CD1 3.59Å; V545-I579 HydrophobicContact CG2-CD1 3.67Å
546	F	96.5	Very high	88.2	Confident	5 Å²	5	44.1 Å²	44.1	2%	0.022	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.4	-179.1	-56.1	-88.5	0	0	0	110.5	L529 S530 A532 V534 Q544 V550 P626 V627	L529-F546 WeakPolarHBondContact CA-O 3Å; S530-F546 PolarHBondContact N-O 2.81Å; S530-F546 PolarHBondContact O-N 3.22Å; A532-F546 HydrophobicContact CB-CE2 4.15Å; V534-F546 HydrophobicContact CG2-CE2 4.24Å; V534-F546 HydrophobicContact CG2-CZ 4.05Å; Q544-F546 HydrophobicContact CB-CD2 4.38Å; Q544-F546 HydrophobicContact CB-CE1 4.35Å; Q544-F546 HydrophobicContact CB-CE2 3.56Å; Q544-F546 HydrophobicContact CB-CZ 3.55Å; Q544-F546 HydrophobicContact CG-CZ 4.36Å; F546-V550 CarbonylContact C-O 3.55Å; F546-V550 VanDerWaalsContact CA-O 3.23Å; F546-V550 WeakPolarHBondContact CA-O 3.23Å; F546-P626 HydrophobicContact CD1-CB 4.42Å; F546-P626 HydrophobicContact CD1-CG 3.71Å; F546-P626 HydrophobicContact CE1-CB 3.92Å; F546-P626 HydrophobicContact CE1-CG 3.63Å; F546-P626 HydrophobicContact CZ-CB 4.26Å; F546-P626 HydrophobicContact CZ-CG 4.4Å; F546-V627 HydrophobicContact CE2-CG2 4.25Å; F546-V627 HydrophobicContact CZ-CG2 4.33Å
547	L	96.1	Very high	87.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.3	167.3	-62	-173.5	0	0	0	108.8	P528 L529 G549 V550 V552 A597 L598 L601	P528-L547 VanDerWaalsContact O-CA 3.31Å; P528-L547 WeakPolarHBondContact O-CA 3.48Å; L529-L547 HydrophobicContact CB-CD2 4.18Å; L529-L547 HydrophobicContact CD1-CD2 3.52Å; L529-L547 HydrophobicContact CG-CD2 4.44Å; L547-G549 PolarHBondContact O-N 2.99Å; L547-G549 VanDerWaalsContact O-N 3.13Å; L547-V550 PolarHBondContact N-O 2.86Å; L547-V550 WeakPolarHBondContact O-CB 3.5Å; L547-V550 PolarHBondContact O-N 3.14Å; L547-V552 HydrophobicContact CB-CG1 4Å; L547-V552 HydrophobicContact CD1-CG1 4.01Å; L547-V552 HydrophobicContact CD1-CG2 4.1Å; L547-V552 HydrophobicContact CG-CB 4.47Å; L547-V552 HydrophobicContact CG-CG1 3.93Å; L547-V552 HydrophobicContact CG-CG2 3.75Å; L547-A597 HydrophobicContact CB-CB 4.04Å; L547-A597 HydrophobicContact CD1-CB 3.9Å; L547-L598 HydrophobicContact CD1-CD2 3.85Å; L547-L598 HydrophobicContact CD1-CG 4.19Å; L547-L601 HydrophobicContact CD1-CD2 4.42Å; L547-L601 HydrophobicContact CD2-CD2 3.79Å
548	D	92.3	Very high	86.9	Confident	45 Å²	45	39.2 Å²	39.2	24%	0.241	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	41.1	-174.6	-68.1	-58.8	0	0	0	112.9	P528 V550 Q600	P528-D548 PolarHBondContact O-N 3.42Å; P528-D548 VanDerWaalsContact O-N 3.16Å; D548-V550 VanDerWaalsContact C-N 3.29Å; D548-V550 PolarHBondContact O-N 2.02Å; D548-Q600 VanDerWaalsContact OD2-CG 3.28Å; D548-Q600 WeakPolarHBondContact OD2-CG 3.47Å; D548-Q600 PolarHBondContact OD2-NE2 2.03Å
549	G	90.5	Very high	87.1	Confident	20 Å²	20	35 Å²	35	21%	0.206	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-3.5	-178.7	0	0	0	0	0	116.1	L547 P626	L547-G549 PolarHBondContact O-N 2.99Å; L547-G549 VanDerWaalsContact O-N 3.13Å; G549-P626 WeakPolarHBondContact O-CD 3.44Å; G549-P626 WeakPolarHBondContact O-CG 3.43Å
550	V	92	Very high	87.8	Confident	68 Å²	68	27.6 Å²	27.6	41%	0.412	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.9	176.1	-177.2	0	0	0	0	110.2	F546 L547 D548 V552 I589	F546-V550 CarbonylContact C-O 3.55Å; F546-V550 VanDerWaalsContact CA-O 3.23Å; F546-V550 WeakPolarHBondContact CA-O 3.23Å; L547-V550 PolarHBondContact N-O 2.86Å; L547-V550 WeakPolarHBondContact O-CB 3.5Å; L547-V550 PolarHBondContact O-N 3.14Å; D548-V550 VanDerWaalsContact C-N 3.29Å; D548-V550 PolarHBondContact O-N 2.02Å; V550-V552 PolarHBondContact O-N 2.04Å; V550-I589 HydrophobicContact CG1-CD1 4.15Å
551	S	94.2	Very high	88.1	Confident	38 Å²	38	26.2 Å²	26.2	27%	0.266	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	111	175	-167.6	0	0	0	0	110.2	Q544	Q544-S551 PolarHBondContact OE1-OG 2.99Å
552	V	95.4	Very high	88.1	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-27.4	-175.4	-68	0	0	0	0	113.5	V545 L547 V550 I577 I589 L594 A597	V545-V552 HydrophobicContact CB-CG2 4.29Å; V545-V552 HydrophobicContact CG1-CG2 4.3Å; V545-V552 WeakPolarHBondContact O-CG2 3.11Å; V545-V552 PolarHBondContact O-N 3.39Å; L547-V552 HydrophobicContact CB-CG1 4Å; L547-V552 HydrophobicContact CD1-CG1 4.01Å; L547-V552 HydrophobicContact CD1-CG2 4.1Å; L547-V552 HydrophobicContact CG-CB 4.47Å; L547-V552 HydrophobicContact CG-CG1 3.93Å; L547-V552 HydrophobicContact CG-CG2 3.75Å; V550-V552 PolarHBondContact O-N 2.04Å; V552-I577 HydrophobicContact CG2-CD1 3.95Å; V552-I589 HydrophobicContact CB-CG2 4.23Å; V552-I589 HydrophobicContact CG1-CG2 4.31Å; V552-I589 PolarHBondContact O-N 3.06Å; V552-L594 HydrophobicContact CB-CD1 3.82Å; V552-L594 HydrophobicContact CG1-CD1 4.08Å; V552-L594 HydrophobicContact CG2-CD1 4.48Å; V552-A597 HydrophobicContact CG1-CB 4.24Å
553	A	93.7	Very high	87.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	131.9	177.4	0	0	0	0	0	109	Q544 V545 I579 G587 Y588	Q544-A553 WeakPolarHBondContact CA-O 3.47Å; V545-A553 HydrophobicContact CB-CB 4.26Å; V545-A553 HydrophobicContact CG2-CB 4.34Å; V545-A553 PolarHBondContact N-O 3.48Å; A553-I579 HydrophobicContact CB-CG2 4Å; A553-G587 WeakPolarHBondContact CA-O 3.32Å; A553-Y588 HydrophobicContact CB-CD1 3.83Å; A553-Y588 HydrophobicContact CB-CE1 3.82Å
554	T	93.6	Very high	87.6	Confident	31 Å²	31	40.2 Å²	40.2	19%	0.19	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.8	173.1	-61.4	0	0	0	0	108	N542 Q544 V586 G587	N542-T554 HydrophobicContact CB-CG2 4.21Å; Q544-T554 HydrophobicContact CG-CG2 4.13Å; T554-V586 WeakPolarHBondContact O-CA 3.29Å; T554-G587 PolarHBondContact N-O 3.3Å; T554-G587 PolarHBondContact O-N 3.13Å
555	L	90	Very high	87.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	102.6	172.8	-178.2	138.4	0	0	0	107.3	L543 S557 I579 A581 V586	L543-L555 HydrophobicContact CB-CB 4.24Å; L543-L555 HydrophobicContact CB-CD2 4.15Å; L543-L555 HydrophobicContact CD2-CD2 4.45Å; L543-L555 PolarHBondContact N-O 3.09Å; L543-L555 VanDerWaalsContact N-O 3.15Å; L543-L555 PolarHBondContact O-N 3.43Å; L555-S557 PolarHBondContact O-N 3.38Å; L555-I579 HydrophobicContact CB-CD1 4.29Å; L555-I579 HydrophobicContact CB-CG2 4.49Å; L555-I579 HydrophobicContact CD1-CD1 4.31Å; L555-I579 HydrophobicContact CD1-CG1 3.94Å; L555-I579 HydrophobicContact CD1-CG2 4.42Å; L555-A581 HydrophobicContact CD1-CB 3.78Å; L555-A581 HydrophobicContact CD2-CB 4Å; L555-A581 HydrophobicContact CG-CB 4.49Å; L555-V586 HydrophobicContact CB-CG2 4.44Å; L555-V586 HydrophobicContact CD1-CG2 3.86Å; L555-V586 HydrophobicContact CG-CG2 4.25Å
556	D	83	Confident	87.1	Confident	53 Å²	53	41.6 Å²	41.6	28%	0.283	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	104	172.7	-73.7	-68.4	0	0	0	107.5	K536 N542 S584 T585	K536-D556 IonicContact NZ-OD1 3.75Å; K536-D556 PolarHBondContact NZ-OD1 3.49Å; N542-D556 VanDerWaalsContact CG-OD1 3.3Å; N542-D556 PolarHBondContact ND2-OD1 2.86Å; N542-D556 PolarHBondContact OD1-OD1 3.46Å; D556-S584 WeakPolarHBondContact O-CB 3.16Å; D556-T585 PolarHBondContact N-O 3.02Å; D556-T585 PolarHBondContact O-N 2.85Å
557	S	68.6	Low	86.9	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.021	25%	0.245	C	C	.	.			trans	-114.1	130.4	177.6	-175.7	0	0	0	0	109.7	L555 M559 S584	L555-S557 PolarHBondContact O-N 3.38Å; S557-M559 PolarHBondContact O-N 3.08Å; S557-M559 VanDerWaalsContact O-N 3.17Å; S557-M559 PolarHBondContact OG-N 3.45Å; S557-S584 VanDerWaalsContact CB-OG 3.26Å; S557-S584 WeakPolarHBondContact CB-OG 3.4Å; S557-S584 PolarHBondContact OG-OG 2.73Å
558	L	62.5	Low	86.7	Confident	132 Å²	132	45.9 Å²	45.9	69%	0.691	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	1.6	175.1	-69.9	163.7	0	0	0	113.1	Y562	L558-Y562 WeakPolarHBondContact O-CD2 3.28Å; L558-Y562 WeakPolarHBondContact O-CE2 3.47Å
559	M	72.2	Confident	86.8	Confident	86 Å²	86	48.2 Å²	48.2	42%	0.424	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	26.5	-168.1	-61.3	-159.5	-173.9	0	0	115.5	S557 Y562	S557-M559 PolarHBondContact O-N 3.08Å; S557-M559 VanDerWaalsContact O-N 3.17Å; S557-M559 PolarHBondContact OG-N 3.45Å; M559-Y562 HydrophobicContact CB-CD2 4.3Å; M559-Y562 HydrophobicContact CB-CG 4.44Å; M559-Y562 HydrophobicContact CG-CD2 4.44Å
560	L	82	Confident	87.1	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-48	173.1	-80.9	161.8	0	0	0	110.9	I509 P511 A541 N542 L543 Y562 L566	I509-L560 HydrophobicContact CD1-CD2 3.78Å; P511-L560 VanDerWaalsContact CD-O 3.24Å; P511-L560 WeakPolarHBondContact CD-O 3.49Å; P511-L560 HydrophobicContact CG-CB 4.34Å; P511-L560 HydrophobicContact CG-CD2 4.37Å; P511-L560 WeakPolarHBondContact CG-O 3.06Å; A541-L560 HydrophobicContact CB-CB 4.26Å; A541-L560 VanDerWaalsContact O-CD1 3.28Å; A541-L560 WeakPolarHBondContact O-CD1 3.36Å; N542-L560 VanDerWaalsContact C-CD1 3.47Å; L543-L560 HydrophobicContact CB-CD1 3.89Å; L560-Y562 VanDerWaalsContact C-N 3.27Å; L560-Y562 PolarHBondContact O-N 3.23Å; L560-Y562 VanDerWaalsContact O-N 3.15Å; L560-L566 HydrophobicContact CD2-CD2 3.52Å; L560-L566 HydrophobicContact CG-CD2 3.97Å
561	C	85.3	Confident	87.3	Confident	14 Å²	14	45.9 Å²	45.9	10%	0.095	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	48.2	178.2	-79.4	0	0	0	0	113.4	C287 V288	C287-C561 HydrophobicContact CB-CB 3.44Å; C287-C561 VanDerWaalsContact CB-CB 3.44Å; C287-C561 WeakPolarHBondContact CB-SG 3.32Å; C287-C561 WeakPolarHBondContact SG-CB 3.02Å; C287-C561 CovalentContact SG-SG 2.04Å; C287-C561 PolarHBondContact SG-SG 2.73Å; V288-C561 VanDerWaalsContact CG2-C 3.44Å
562	Y	86.6	Confident	87.4	Confident	120 Å²	120	44 Å²	44	47%	0.471	22%	0.222	S	C	.	.	S	Bend	trans	-127.2	160.9	-179.7	-82.4	-102.4	0	0	0	112.3	L558 M559 L560 D564	L558-Y562 WeakPolarHBondContact O-CD2 3.28Å; L558-Y562 WeakPolarHBondContact O-CE2 3.47Å; M559-Y562 HydrophobicContact CB-CD2 4.3Å; M559-Y562 HydrophobicContact CB-CG 4.44Å; M559-Y562 HydrophobicContact CG-CD2 4.44Å; L560-Y562 VanDerWaalsContact C-N 3.27Å; L560-Y562 PolarHBondContact O-N 3.23Å; L560-Y562 VanDerWaalsContact O-N 3.15Å; Y562-D564 PolarHBondContact O-N 2.83Å
563	P	86.5	Confident	87.4	Confident	70 Å²	70	45 Å²	45	46%	0.455	23%	0.227	S	C	.	.	S	Bend	trans	-63.3	-24.9	-178.8	-25.3	35.5	0	0	0	115	R510 V664	R510-P563 WeakPolarHBondContact CD-O 3.5Å; P563-V664 HydrophobicContact CB-CB 4.27Å; P563-V664 HydrophobicContact CB-CG1 3.94Å; P563-V664 HydrophobicContact CB-CG2 4.21Å; P563-V664 HydrophobicContact CG-CG1 4.1Å
564	D	87.9	Confident	87.3	Confident	118 Å²	118	46.3 Å²	46.3	63%	0.631	24%	0.236	S	C	*	.	S	Bend	trans	-79.1	150.7	-179.3	-70.4	-30.8	0	0	0	111.4	Y562	Y562-D564 PolarHBondContact O-N 2.83Å
565	R	89.6	Confident	87.2	Confident	62 Å²	62	50.6 Å²	50.6	23%	0.234	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-82.8	138	177.4	-58.2	-170.6	169.3	-155.3	-0.3	111.2	E478 R479 N508 I509 R510 D636	E478-R565 IonicContact OE1-CZ 3.01Å; E478-R565 IonicContact OE1-NE 3.49Å; E478-R565 IonicContact OE1-NH2 2.85Å; E478-R565 PolarHBondContact OE1-NH2 3.38Å; R479-R565 PolarHBondContact O-NH1 2.83Å; R479-R565 PolarHBondContact O-NH2 3.43Å; N508-R565 WeakPolarHBondContact ND2-CD 3.31Å; N508-R565 WeakPolarHBondContact OD1-CB 3.04Å; I509-R565 CarbonylContact O-C 3.55Å; I509-R565 WeakPolarHBondContact O-CA 3.43Å; R510-R565 HydrophobicContact CB-CG 4.2Å; R565-D636 IonicContact NH1-OD2 2.63Å; R565-D636 PolarHBondContact NH1-OD2 2.72Å
566	L	90.8	Very high	87.4	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.3	175.4	-173.1	68.4	0	0	0	110.4	N508 I509 L560 V568 A581 N582	N508-L566 WeakPolarHBondContact CA-O 3.41Å; I509-L566 HydrophobicContact CG1-CB 4.2Å; I509-L566 PolarHBondContact N-O 3.25Å; I509-L566 PolarHBondContact O-N 2.88Å; L560-L566 HydrophobicContact CD2-CD2 3.52Å; L560-L566 HydrophobicContact CG-CD2 3.97Å; L566-V568 HydrophobicContact CD2-CG2 3.92Å; L566-V568 HydrophobicContact CG-CG2 4.03Å; L566-A581 HydrophobicContact CD1-CB 4.09Å; L566-A581 HydrophobicContact CD2-CB 4.36Å; L566-A581 HydrophobicContact CG-CB 4.31Å; L566-N582 VanDerWaalsContact CD1-OD1 3.28Å; L566-N582 WeakPolarHBondContact CD1-OD1 3.29Å
567	M	92.1	Very high	87.9	Confident	95 Å²	95	52.4 Å²	52.4	47%	0.468	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.4	170	-172.1	177.3	-68.4	0	0	109.9	T506 M507 A581	T506-M567 HydrophobicContact CG2-CG 4.37Å; M507-M567 CarbonylContact O-C 3.51Å; M507-M567 WeakPolarHBondContact O-CA 3.07Å; M567-A581 WeakPolarHBondContact O-CA 3.09Å
568	V	92.9	Very high	89.1	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.6	-179.5	-178.5	0	0	0	0	108.9	T506 M507 I509 L543 L566 I579 A581	T506-V568 CarbonylContact C-O 3.59Å; T506-V568 WeakPolarHBondContact CA-O 3.47Å; M507-V568 HydrophobicContact CE-CB 4.49Å; M507-V568 HydrophobicContact CE-CG1 4.26Å; M507-V568 PolarHBondContact N-O 3.49Å; M507-V568 PolarHBondContact O-N 3.24Å; I509-V568 HydrophobicContact CD1-CG2 4.05Å; I509-V568 HydrophobicContact CG1-CG2 4.32Å; L543-V568 HydrophobicContact CD2-CB 4.41Å; L543-V568 HydrophobicContact CD2-CG1 3.6Å; L543-V568 HydrophobicContact CD2-CG2 3.99Å; L566-V568 HydrophobicContact CD2-CG2 3.92Å; L566-V568 HydrophobicContact CG-CG2 4.03Å; V568-I579 HydrophobicContact CG1-CD1 4.24Å; V568-I579 HydrophobicContact CG1-CG1 4.21Å; V568-A581 HydrophobicContact CG2-CB 4.48Å
569	Q	94.6	Very high	90.5	Very high	94 Å²	94	51 Å²	51	44%	0.439	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.3	172.1	-67.6	179.4	-12.1	0	0	109.2	I505 T506 I579 S580	I505-Q569 CarbonylContact O-C 3.46Å; I505-Q569 WeakPolarHBondContact O-CA 3.33Å; T506-Q569 HydrophobicContact CG2-CG 4.25Å; Q569-I579 CarbonylContact O-C 3.58Å; Q569-I579 WeakPolarHBondContact O-CA 3.25Å; Q569-S580 PolarHBondContact N-O 3.19Å; Q569-S580 PolarHBondContact O-N 3.07Å
570	L	95.8	Very high	91.4	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.9	173.8	176.6	72.7	0	0	0	109	I505 I531 V545 V572 I577 Q578 I579	I505-L570 HydrophobicContact CB-CB 4.35Å; I505-L570 HydrophobicContact CD1-CD2 4.21Å; I505-L570 PolarHBondContact N-O 3Å; I505-L570 PolarHBondContact O-N 3.39Å; I531-L570 HydrophobicContact CD1-CD2 3.24Å; I531-L570 HydrophobicContact CD1-CG 4.49Å; I531-L570 HydrophobicContact CG1-CD2 3.74Å; V545-L570 HydrophobicContact CG1-CD2 4.49Å; V545-L570 HydrophobicContact CG2-CD1 4.1Å; L570-V572 HydrophobicContact CD1-CG2 4.03Å; L570-V572 HydrophobicContact CD2-CG2 3.8Å; L570-V572 HydrophobicContact CG-CG2 3.75Å; L570-I577 HydrophobicContact CD1-CD1 4.15Å; L570-I577 HydrophobicContact CD1-CG1 3.91Å; L570-Q578 WeakPolarHBondContact CA-O 3.3Å; L570-I579 HydrophobicContact CD1-CB 3.82Å; L570-I579 HydrophobicContact CD1-CD1 4.43Å; L570-I579 HydrophobicContact CD1-CG1 4.21Å
571	N	96.1	Very high	91.7	Very high	37 Å²	37	50.3 Å²	50.3	20%	0.198	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.6	171.3	-176	5.4	0	0	0	108.8	K502 V503 I577 Q578	K502-N571 WeakPolarHBondContact CE-OD1 3.27Å; V503-N571 CarbonylContact O-C 3.58Å; V503-N571 WeakPolarHBondContact O-CA 3.27Å; N571-I577 WeakPolarHBondContact O-CA 3.48Å; N571-Q578 PolarHBondContact N-O 3.33Å; N571-Q578 PolarHBondContact O-N 3.23Å
572	V	96.3	Very high	91.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129	176.9	-161.5	0	0	0	0	109.2	W501 V503 L529 L570 I577 L598 L601	W501-V572 HydrophobicContact CH2-CG1 4.13Å; W501-V572 HydrophobicContact CZ3-CB 4.35Å; W501-V572 HydrophobicContact CZ3-CG1 4.11Å; V503-V572 HydrophobicContact CB-CB 4.08Å; V503-V572 HydrophobicContact CB-CG2 4.36Å; V503-V572 PolarHBondContact N-O 3.33Å; V503-V572 PolarHBondContact O-N 3.45Å; L529-V572 HydrophobicContact CD2-CG2 4.27Å; L570-V572 HydrophobicContact CD1-CG2 4.03Å; L570-V572 HydrophobicContact CD2-CG2 3.8Å; L570-V572 HydrophobicContact CG-CG2 3.75Å; V572-I577 HydrophobicContact CG1-CB 4.49Å; V572-I577 HydrophobicContact CG2-CD1 4.2Å; V572-I577 HydrophobicContact CG2-CG1 4.2Å; V572-L598 HydrophobicContact CG1-CD2 4.36Å; V572-L601 HydrophobicContact CG1-CD2 3.88Å
573	T	94.7	Very high	90	Very high	21 Å²	21	52.9 Å²	52.9	13%	0.129	29%	0.29	C	S	.	.			trans	-127.4	174.9	174.6	72.3	0	0	0	0	108.9	W501 K502 T575 E576	W501-T573 VanDerWaalsContact CH2-C 3.47Å; W501-T573 WeakPolarHBondContact CH2-O 3Å; K502-T573 HydrophobicContact CG-CG2 4.5Å; T573-T575 PolarHBondContact O-N 3.33Å; T573-T575 VanDerWaalsContact O-N 3.09Å; T573-T575 PolarHBondContact OG1-N 3.42Å; T573-E576 HydrophobicContact CG2-CG 4.26Å; T573-E576 PolarHBondContact N-O 2.97Å; T573-E576 WeakPolarHBondContact OG1-CG 3.49Å; T573-E576 PolarHBondContact OG1-N 3.48Å; T573-E576 VanDerWaalsContact OG1-N 3.1Å; T573-E576 PolarHBondContact OG1-O 3.23Å
574	P	93.3	Very high	89.4	Confident	28 Å²	28	50.8 Å²	50.8	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-59.9	-20.3	176.5	-23.9	32.6	0	0	0	115.1	S500 W501 N602	S500-P574 VanDerWaalsContact OG-CG 3.3Å; S500-P574 WeakPolarHBondContact OG-CG 3.34Å; W501-P574 HydrophobicContact CD2-CG 4.36Å; W501-P574 HydrophobicContact CZ2-CB 4.2Å; W501-P574 HydrophobicContact CZ2-CG 4.02Å; P574-N602 HydrophobicContact CB-CB 4.27Å
575	T	91	Very high	89.2	Confident	122 Å²	122	50 Å²	50	75%	0.748	28%	0.276	S	S	*	.	S	Bend	trans	-119.3	-19.2	-172.1	53.2	0	0	0	0	114.3	T573	T573-T575 PolarHBondContact O-N 3.33Å; T573-T575 VanDerWaalsContact O-N 3.09Å; T573-T575 PolarHBondContact OG1-N 3.42Å
576	E	93	Very high	89	Confident	81 Å²	81	49.1 Å²	49.1	38%	0.379	28%	0.278	S	S	.	.			trans	-143.2	151.1	-177.1	57.6	168.2	-172.3	0	0	112.4	T573 Q578	T573-E576 HydrophobicContact CG2-CG 4.26Å; T573-E576 PolarHBondContact N-O 2.97Å; T573-E576 WeakPolarHBondContact OG1-CG 3.49Å; T573-E576 PolarHBondContact OG1-N 3.48Å; T573-E576 VanDerWaalsContact OG1-N 3.1Å; T573-E576 PolarHBondContact OG1-O 3.23Å; E576-Q578 PolarHBondContact OE2-NE2 3.26Å
577	I	94.8	Very high	88.8	Confident	9 Å²	9	50.6 Å²	50.6	5%	0.046	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.8	168.9	-177.6	161	0	0	0	108	V545 V552 L570 N571 V572 Y588 L594	V545-I577 HydrophobicContact CB-CD1 4.19Å; V545-I577 HydrophobicContact CG1-CD1 3.59Å; V552-I577 HydrophobicContact CG2-CD1 3.95Å; L570-I577 HydrophobicContact CD1-CD1 4.15Å; L570-I577 HydrophobicContact CD1-CG1 3.91Å; N571-I577 WeakPolarHBondContact O-CA 3.48Å; V572-I577 HydrophobicContact CG1-CB 4.49Å; V572-I577 HydrophobicContact CG2-CD1 4.2Å; V572-I577 HydrophobicContact CG2-CG1 4.2Å; I577-Y588 HydrophobicContact CG2-CD1 4.33Å; I577-Y588 HydrophobicContact CG2-CE1 4.17Å; I577-Y588 WeakPolarHBondContact O-CE1 3.47Å; I577-L594 HydrophobicContact CG2-CD1 3.73Å; I577-L594 HydrophobicContact CG2-CD2 4.18Å; I577-L594 HydrophobicContact CG2-CG 4.49Å
578	Q	93.5	Very high	88.8	Confident	99 Å²	99	50.8 Å²	50.8	46%	0.463	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	118.5	178.2	-63.8	-175.1	1.7	0	0	108.9	L570 N571 E576	L570-Q578 WeakPolarHBondContact CA-O 3.3Å; N571-Q578 PolarHBondContact N-O 3.33Å; N571-Q578 PolarHBondContact O-N 3.23Å; E576-Q578 PolarHBondContact OE2-NE2 3.26Å
579	I	92.6	Very high	88.6	Confident	7 Å²	7	53.4 Å²	53.4	4%	0.036	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.3	171.8	-167.9	169.9	0	0	0	109.6	L543 V545 A553 L555 V568 Q569 L570 V586 Y588	L543-I579 HydrophobicContact CD2-CD1 3.73Å; L543-I579 HydrophobicContact CG-CD1 4.42Å; V545-I579 HydrophobicContact CG2-CD1 3.67Å; A553-I579 HydrophobicContact CB-CG2 4Å; L555-I579 HydrophobicContact CB-CD1 4.29Å; L555-I579 HydrophobicContact CB-CG2 4.49Å; L555-I579 HydrophobicContact CD1-CD1 4.31Å; L555-I579 HydrophobicContact CD1-CG1 3.94Å; L555-I579 HydrophobicContact CD1-CG2 4.42Å; V568-I579 HydrophobicContact CG1-CD1 4.24Å; V568-I579 HydrophobicContact CG1-CG1 4.21Å; Q569-I579 CarbonylContact O-C 3.58Å; Q569-I579 WeakPolarHBondContact O-CA 3.25Å; L570-I579 HydrophobicContact CD1-CB 3.82Å; L570-I579 HydrophobicContact CD1-CD1 4.43Å; L570-I579 HydrophobicContact CD1-CG1 4.21Å; I579-V586 HydrophobicContact CG2-CG1 3.46Å; I579-V586 VanDerWaalsContact CG2-CG1 3.46Å; I579-V586 HydrophobicContact CG2-CG2 4.22Å; I579-V586 WeakPolarHBondContact O-CG2 3.5Å; I579-Y588 PolarHBondContact N-OH 3.09Å; I579-Y588 VanDerWaalsContact N-OH 3.09Å
580	S	91.1	Very high	88.4	Confident	55 Å²	55	57.1 Å²	57.1	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.4	176	66.5	0	0	0	0	111.6	Q569	Q569-S580 PolarHBondContact N-O 3.19Å; Q569-S580 PolarHBondContact O-N 3.07Å
581	A	86.9	Confident	88	Confident	18 Å²	18	61.3 Å²	61.3	15%	0.149	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	155.3	169.4	0	0	0	0	0	108.4	L555 L566 M567 V568 S583	L555-A581 HydrophobicContact CD1-CB 3.78Å; L555-A581 HydrophobicContact CD2-CB 4Å; L555-A581 HydrophobicContact CG-CB 4.49Å; L566-A581 HydrophobicContact CD1-CB 4.09Å; L566-A581 HydrophobicContact CD2-CB 4.36Å; L566-A581 HydrophobicContact CG-CB 4.31Å; M567-A581 WeakPolarHBondContact O-CA 3.09Å; V568-A581 HydrophobicContact CG2-CB 4.48Å; A581-S583 PolarHBondContact O-N 2.89Å
582	N	72.4	Confident	87.7	Confident	122 Å²	122	66.9 Å²	66.9	65%	0.652	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-10.4	-169.6	60.8	1	0	0	0	116.4	L566	L566-N582 VanDerWaalsContact CD1-OD1 3.28Å; L566-N582 WeakPolarHBondContact CD1-OD1 3.29Å
583	S	64.3	Low	87.4	Confident	65 Å²	65	70 Å²	70	46%	0.455	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.8	19.3	-172.9	54	0	0	0	0	114.7	A581	A581-S583 PolarHBondContact O-N 2.89Å
584	S	74.9	Confident	87.3	Confident	27 Å²	27	70.1 Å²	70.1	19%	0.189	39%	0.392	C	S	.	.			trans	-121.2	150.5	-164.8	-46.8	0	0	0	0	114.1	D556 S557	D556-S584 WeakPolarHBondContact O-CB 3.16Å; S557-S584 VanDerWaalsContact CB-OG 3.26Å; S557-S584 WeakPolarHBondContact CB-OG 3.4Å; S557-S584 PolarHBondContact OG-OG 2.73Å
585	T	81.9	Confident	87.2	Confident	100 Å²	100	74.2 Å²	74.2	61%	0.613	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	143.6	168.9	48.2	0	0	0	0	110.1	D556	D556-T585 PolarHBondContact N-O 3.02Å; D556-T585 PolarHBondContact O-N 2.85Å
586	V	86.7	Confident	87.3	Confident	45 Å²	45	75.3 Å²	75.3	27%	0.273	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.1	-177.4	-172.7	0	0	0	0	110.4	T554 L555 I579 Y588	T554-V586 WeakPolarHBondContact O-CA 3.29Å; L555-V586 HydrophobicContact CB-CG2 4.44Å; L555-V586 HydrophobicContact CD1-CG2 3.86Å; L555-V586 HydrophobicContact CG-CG2 4.25Å; I579-V586 HydrophobicContact CG2-CG1 3.46Å; I579-V586 VanDerWaalsContact CG2-CG1 3.46Å; I579-V586 HydrophobicContact CG2-CG2 4.22Å; I579-V586 WeakPolarHBondContact O-CG2 3.5Å; V586-Y588 HydrophobicContact CB-CE2 4.06Å; V586-Y588 HydrophobicContact CG1-CD2 4.02Å; V586-Y588 HydrophobicContact CG1-CE1 4.22Å; V586-Y588 HydrophobicContact CG1-CE2 3.42Å; V586-Y588 VanDerWaalsContact CG1-CE2 3.42Å
587	G	87.1	Confident	87.3	Confident	36 Å²	36	72.1 Å²	72.1	37%	0.371	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.3	169.2	0	0	0	0	0	110.6	A553 T554	A553-G587 WeakPolarHBondContact CA-O 3.32Å; T554-G587 PolarHBondContact N-O 3.3Å; T554-G587 PolarHBondContact O-N 3.13Å
588	Y	90.4	Very high	87.3	Confident	98 Å²	98	71.9 Å²	71.9	38%	0.384	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	148.2	172.6	-65.9	-87.8	0	0	0	110.3	A553 I577 I579 V586	A553-Y588 HydrophobicContact CB-CD1 3.83Å; A553-Y588 HydrophobicContact CB-CE1 3.82Å; I577-Y588 HydrophobicContact CG2-CD1 4.33Å; I577-Y588 HydrophobicContact CG2-CE1 4.17Å; I577-Y588 WeakPolarHBondContact O-CE1 3.47Å; I579-Y588 PolarHBondContact N-OH 3.09Å; I579-Y588 VanDerWaalsContact N-OH 3.09Å; V586-Y588 HydrophobicContact CB-CE2 4.06Å; V586-Y588 HydrophobicContact CG1-CD2 4.02Å; V586-Y588 HydrophobicContact CG1-CE1 4.22Å; V586-Y588 HydrophobicContact CG1-CE2 3.42Å; V586-Y588 VanDerWaalsContact CG1-CE2 3.42Å
589	I	90.4	Very high	87.3	Confident	56 Å²	56	72.7 Å²	72.7	29%	0.287	39%	0.393	S	S	.	.			trans	-63.7	164.9	170.9	-162.4	166.2	0	0	0	110.9	V550 V552 S591 T593 L594	V550-I589 HydrophobicContact CG1-CD1 4.15Å; V552-I589 HydrophobicContact CB-CG2 4.23Å; V552-I589 HydrophobicContact CG1-CG2 4.31Å; V552-I589 PolarHBondContact O-N 3.06Å; I589-S591 PolarHBondContact O-N 3.31Å; I589-T593 HydrophobicContact CD1-CG2 3.9Å; I589-L594 HydrophobicContact CG2-CB 3.81Å; I589-L594 HydrophobicContact CG2-CD1 4.34Å
590	K	89	Confident	87.3	Confident	172 Å²	172	77.3 Å²	77.3	75%	0.748	42%	0.415	S	S	*	.			trans	-50.9	134	175.7	-65.7	-178.6	-177.8	176.2	0	111.2	E592 T593 L594	K590-E592 VanDerWaalsContact C-N 3.26Å; K590-E592 PolarHBondContact O-N 2.87Å; K590-E592 VanDerWaalsContact O-N 3.12Å; K590-T593 PolarHBondContact O-N 2.9Å; K590-L594 PolarHBondContact O-N 3.25Å
591	S	88.3	Confident	87.5	Confident	90 Å²	90	74.7 Å²	74.7	63%	0.629	40%	0.396	S	S	*	.	H	α-helix	trans	-53.1	-37.7	-173.4	-168.4	0	0	0	0	114.2	I589 L594 Q595	I589-S591 PolarHBondContact O-N 3.31Å; S591-L594 PolarHBondContact O-N 3.45Å; S591-Q595 WeakPolarHBondContact O-CB 3.35Å; S591-Q595 PolarHBondContact O-N 3.2Å
592	E	89.9	Confident	87.9	Confident	153 Å²	153	76.2 Å²	76.2	72%	0.715	40%	0.402	S	S	*	.	H	α-helix	trans	-66.6	-41.2	179.7	-65.7	177.6	-174.1	0	0	112.8	K590 K596	K590-E592 VanDerWaalsContact C-N 3.26Å; K590-E592 PolarHBondContact O-N 2.87Å; K590-E592 VanDerWaalsContact O-N 3.12Å; E592-K596 WeakPolarHBondContact O-CG 3.3Å; E592-K596 PolarHBondContact O-N 3.12Å
593	T	90	Very high	88.9	Confident	66 Å²	66	74.6 Å²	74.6	41%	0.405	40%	0.396	S	S	.	.	H	α-helix	trans	-71	-39.3	177.6	-51.3	0	0	0	0	110.5	I589 K590 Q595 K596 A597	I589-T593 HydrophobicContact CD1-CG2 3.9Å; K590-T593 PolarHBondContact O-N 2.9Å; T593-Q595 VanDerWaalsContact C-N 3.35Å; T593-Q595 PolarHBondContact O-N 3.19Å; T593-K596 PolarHBondContact O-N 2.92Å; T593-A597 PolarHBondContact O-N 2.8Å; T593-A597 VanDerWaalsContact O-N 3.08Å
594	L	92.1	Very high	90.3	Very high	24 Å²	24	72.3 Å²	72.3	13%	0.126	38%	0.38	C	S	.	.	H	α-helix	trans	-59.4	-46	176	179.7	59.7	0	0	0	111.6	V552 I577 I589 K590 S591 K596 A597 L598	V552-L594 HydrophobicContact CB-CD1 3.82Å; V552-L594 HydrophobicContact CG1-CD1 4.08Å; V552-L594 HydrophobicContact CG2-CD1 4.48Å; I577-L594 HydrophobicContact CG2-CD1 3.73Å; I577-L594 HydrophobicContact CG2-CD2 4.18Å; I577-L594 HydrophobicContact CG2-CG 4.49Å; I589-L594 HydrophobicContact CG2-CB 3.81Å; I589-L594 HydrophobicContact CG2-CD1 4.34Å; K590-L594 PolarHBondContact O-N 3.25Å; S591-L594 PolarHBondContact O-N 3.45Å; L594-K596 PolarHBondContact O-N 3.48Å; L594-A597 PolarHBondContact O-N 3.16Å; L594-L598 HydrophobicContact CD1-CD1 4.18Å; L594-L598 HydrophobicContact CD1-CG 4.35Å; L594-L598 HydrophobicContact CG-CD1 4Å; L594-L598 WeakPolarHBondContact O-CG 3.48Å; L594-L598 PolarHBondContact O-N 3.28Å
595	Q	91.9	Very high	91.2	Very high	114 Å²	114	71.9 Å²	71.9	53%	0.533	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-41.2	-178.5	-165.4	166.7	5.1	0	0	111.9	S591 T593 A597 L598 E599	S591-Q595 WeakPolarHBondContact O-CB 3.35Å; S591-Q595 PolarHBondContact O-N 3.2Å; T593-Q595 VanDerWaalsContact C-N 3.35Å; T593-Q595 PolarHBondContact O-N 3.19Å; Q595-A597 PolarHBondContact O-N 3.08Å; Q595-L598 PolarHBondContact O-N 2.04Å; Q595-E599 WeakPolarHBondContact O-CG 3.3Å; Q595-E599 PolarHBondContact O-N 3.21Å
596	K	92.1	Very high	91.6	Very high	144 Å²	144	74 Å²	74	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-61.4	-42.4	173.4	-71.3	176.3	-178.8	177.6	0	112.6	E592 T593 L594 L598 E599 Q600	E592-K596 WeakPolarHBondContact O-CG 3.3Å; E592-K596 PolarHBondContact O-N 3.12Å; T593-K596 PolarHBondContact O-N 2.92Å; L594-K596 PolarHBondContact O-N 3.48Å; K596-L598 VanDerWaalsContact C-N 3.35Å; K596-E599 PolarHBondContact O-N 3.36Å; K596-Q600 PolarHBondContact O-N 3.21Å
597	A	93.2	Very high	91.8	Very high	14 Å²	14	74.8 Å²	74.8	12%	0.116	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-39.8	177.7	0	0	0	0	0	111.8	L547 V552 T593 L594 Q595 Q600 L601	L547-A597 HydrophobicContact CB-CB 4.04Å; L547-A597 HydrophobicContact CD1-CB 3.9Å; V552-A597 HydrophobicContact CG1-CB 4.24Å; T593-A597 PolarHBondContact O-N 2.8Å; T593-A597 VanDerWaalsContact O-N 3.08Å; L594-A597 PolarHBondContact O-N 3.16Å; Q595-A597 PolarHBondContact O-N 3.08Å; A597-Q600 PolarHBondContact O-N 2.78Å; A597-L601 PolarHBondContact O-N 3.41Å
598	L	94.7	Very high	91.9	Very high	4 Å²	4	78.5 Å²	78.5	2%	0.021	40%	0.399	C	S	.	.	H	α-helix	trans	-68	-36.2	176.1	-71.6	169	0	0	0	112.8	L547 V572 L594 Q595 K596 Q600 L601 N602	L547-L598 HydrophobicContact CD1-CD2 3.85Å; L547-L598 HydrophobicContact CD1-CG 4.19Å; V572-L598 HydrophobicContact CG1-CD2 4.36Å; L594-L598 HydrophobicContact CD1-CD1 4.18Å; L594-L598 HydrophobicContact CD1-CG 4.35Å; L594-L598 HydrophobicContact CG-CD1 4Å; L594-L598 WeakPolarHBondContact O-CG 3.48Å; L594-L598 PolarHBondContact O-N 3.28Å; Q595-L598 PolarHBondContact O-N 2.04Å; K596-L598 VanDerWaalsContact C-N 3.35Å; L598-Q600 VanDerWaalsContact C-N 3.34Å; L598-Q600 PolarHBondContact O-N 3.16Å; L598-L601 HydrophobicContact CD2-CD2 4.4Å; L598-L601 PolarHBondContact O-N 3.32Å; L598-N602 VanDerWaalsContact O-CB 3.3Å; L598-N602 WeakPolarHBondContact O-CB 3.4Å; L598-N602 PolarHBondContact O-N 3.42Å
599	E	93.8	Very high	92.1	Very high	116 Å²	116	74.3 Å²	74.3	54%	0.542	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-41.4	173.4	-76.2	172.5	-170.9	0	0	112	Q595 K596 N602 T603	Q595-E599 WeakPolarHBondContact O-CG 3.3Å; Q595-E599 PolarHBondContact O-N 3.21Å; K596-E599 PolarHBondContact O-N 3.36Å; E599-N602 PolarHBondContact O-N 2.8Å; E599-T603 PolarHBondContact O-N 3.35Å; E599-T603 PolarHBondContact O-OG1 3.16Å
600	Q	93.2	Very high	92.4	Very high	105 Å²	105	73.6 Å²	73.6	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-67.5	-44.4	176.1	-173.4	171.8	-29.5	0	0	111.6	D548 K596 A597 L598 N602 T603 T604	D548-Q600 VanDerWaalsContact OD2-CG 3.28Å; D548-Q600 WeakPolarHBondContact OD2-CG 3.47Å; D548-Q600 PolarHBondContact OD2-NE2 2.03Å; K596-Q600 PolarHBondContact O-N 3.21Å; A597-Q600 PolarHBondContact O-N 2.78Å; L598-Q600 VanDerWaalsContact C-N 3.34Å; L598-Q600 PolarHBondContact O-N 3.16Å; Q600-N602 VanDerWaalsContact C-N 3.34Å; Q600-N602 PolarHBondContact O-N 2.72Å; Q600-T603 WeakPolarHBondContact O-CB 3.41Å; Q600-T603 PolarHBondContact O-N 2.87Å; Q600-T604 PolarHBondContact O-N 2.85Å; Q600-T604 VanDerWaalsContact O-N 3.15Å; Q600-T604 PolarHBondContact O-OG1 2.87Å
601	L	94.8	Very high	92.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57.7	-47	173.8	177.4	64.4	0	0	0	111.1	W501 P528 L529 L547 V572 A597 L598 T603 T604 M605	W501-L601 HydrophobicContact CH2-CD2 3.57Å; W501-L601 HydrophobicContact CH2-CG 3.89Å; W501-L601 HydrophobicContact CZ2-CD2 4.28Å; W501-L601 HydrophobicContact CZ2-CG 4.14Å; W501-L601 HydrophobicContact CZ3-CD2 4.35Å; P528-L601 HydrophobicContact CB-CD1 3.86Å; L529-L601 HydrophobicContact CB-CD1 4.22Å; L547-L601 HydrophobicContact CD1-CD2 4.42Å; L547-L601 HydrophobicContact CD2-CD2 3.79Å; V572-L601 HydrophobicContact CG1-CD2 3.88Å; A597-L601 PolarHBondContact O-N 3.41Å; L598-L601 HydrophobicContact CD2-CD2 4.4Å; L598-L601 PolarHBondContact O-N 3.32Å; L601-T603 PolarHBondContact O-N 2.8Å; L601-T604 PolarHBondContact O-N 2.99Å; L601-M605 HydrophobicContact CD1-CG 3.81Å; L601-M605 HydrophobicContact CD1-SD 4.12Å; L601-M605 HydrophobicContact CG-CG 3.95Å; L601-M605 VanDerWaalsContact O-CG 3.27Å; L601-M605 WeakPolarHBondContact O-CG 3.43Å; L601-M605 PolarHBondContact O-N 3.02Å
602	N	94.6	Very high	93.3	Very high	49 Å²	49	62.7 Å²	62.7	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-59.3	-35.5	179.6	-177.5	41.2	0	0	0	112.7	W501 P574 L598 E599 Q600 Q606	W501-N602 HydrophobicContact CZ2-CB 4.17Å; W501-N602 PolarHBondContact NE1-OD1 2.94Å; P574-N602 HydrophobicContact CB-CB 4.27Å; L598-N602 VanDerWaalsContact O-CB 3.3Å; L598-N602 WeakPolarHBondContact O-CB 3.4Å; L598-N602 PolarHBondContact O-N 3.42Å; E599-N602 PolarHBondContact O-N 2.8Å; Q600-N602 VanDerWaalsContact C-N 3.34Å; Q600-N602 PolarHBondContact O-N 2.72Å; N602-Q606 WeakPolarHBondContact O-CG 3Å
603	T	93.4	Very high	93.7	Very high	88 Å²	88	55.4 Å²	55.4	54%	0.54	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-39.9	174.8	-55.3	0	0	0	0	111.3	E599 Q600 L601 N607	E599-T603 PolarHBondContact O-N 3.35Å; E599-T603 PolarHBondContact O-OG1 3.16Å; Q600-T603 WeakPolarHBondContact O-CB 3.41Å; Q600-T603 PolarHBondContact O-N 2.87Å; L601-T603 PolarHBondContact O-N 2.8Å; T603-N607 PolarHBondContact O-ND2 2.92Å
604	T	93.3	Very high	94	Very high	18 Å²	18	52.2 Å²	52.2	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-71.6	-41.1	-179.5	-53.6	0	0	0	0	112	Y523 P528 Q600 L601 Q606 N607 I609	Y523-T604 HydrophobicContact CD1-CG2 3.69Å; Y523-T604 HydrophobicContact CG-CG2 3.87Å; P528-T604 HydrophobicContact CB-CG2 3.92Å; P528-T604 HydrophobicContact CG-CG2 3.9Å; Q600-T604 PolarHBondContact O-N 2.85Å; Q600-T604 VanDerWaalsContact O-N 3.15Å; Q600-T604 PolarHBondContact O-OG1 2.87Å; L601-T604 PolarHBondContact O-N 2.99Å; T604-Q606 PolarHBondContact O-N 2.97Å; T604-N607 WeakPolarHBondContact O-CB 3.02Å; T604-N607 PolarHBondContact O-N 2.81Å; T604-N607 PolarHBondContact O-ND2 3.44Å; T604-I609 HydrophobicContact CG2-CD1 4.34Å
605	M	93.4	Very high	94.3	Very high	18 Å²	18	51.1 Å²	51.1	9%	0.089	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-9.2	179.3	-67.8	-66.4	-61.7	0	0	114.7	Y495 W501 V503 L521 L601 N607 I609	Y495-M605 HydrophobicContact CD2-CE 4.12Å; Y495-M605 HydrophobicContact CG-CE 3.97Å; W501-M605 HydrophobicContact CB-CE 4.44Å; W501-M605 HydrophobicContact CD2-CB 3.77Å; W501-M605 HydrophobicContact CD2-CE 3.94Å; W501-M605 HydrophobicContact CD2-CG 3.83Å; W501-M605 HydrophobicContact CE3-CE 3.69Å; W501-M605 HydrophobicContact CE3-CG 4.12Å; W501-M605 HydrophobicContact CG-CB 3.85Å; W501-M605 HydrophobicContact CG-CE 4.27Å; W501-M605 HydrophobicContact CG-CG 4.41Å; W501-M605 HydrophobicContact CH2-CG 4.1Å; W501-M605 HydrophobicContact CZ2-CB 4.15Å; W501-M605 HydrophobicContact CZ2-CG 3.8Å; W501-M605 HydrophobicContact CZ3-CE 4.28Å; W501-M605 HydrophobicContact CZ3-CG 4.24Å; V503-M605 HydrophobicContact CG2-CE 3.81Å; L521-M605 HydrophobicContact CD1-CE 4.31Å; L521-M605 HydrophobicContact CD1-SD 3.8Å; L601-M605 HydrophobicContact CD1-CG 3.81Å; L601-M605 HydrophobicContact CD1-SD 4.12Å; L601-M605 HydrophobicContact CG-CG 3.95Å; L601-M605 VanDerWaalsContact O-CG 3.27Å; L601-M605 WeakPolarHBondContact O-CG 3.43Å; L601-M605 PolarHBondContact O-N 3.02Å; M605-N607 PolarHBondContact O-N 3.21Å; M605-I609 HydrophobicContact CB-CD1 4.43Å; M605-I609 HydrophobicContact CE-CD1 4.35Å; M605-I609 HydrophobicContact CG-CD1 4.17Å; M605-I609 HydrophobicContact SD-CD1 3.25Å; M605-I609 WeakPolarHBondContact SD-CD1 3.14Å
606	Q	90.3	Very high	94.5	Very high	143 Å²	143	45.7 Å²	45.7	67%	0.668	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.8	170.6	-67	173.6	24.8	0	0	113.1	N602 T604	N602-Q606 WeakPolarHBondContact O-CG 3Å; T604-Q606 PolarHBondContact O-N 2.97Å
607	N	91	Very high	94.6	Very high	62 Å²	62	39 Å²	39	33%	0.332	21%	0.21	S	C	.	.	S	Bend	trans	-101.2	160.5	178.6	-58.7	-79.1	0	0	0	110.8	Y523 T603 T604 M605 I609	Y523-N607 HydrophobicContact CD2-CB 3.92Å; Y523-N607 HydrophobicContact CE2-CB 3.33Å; Y523-N607 PolarHBondContact OH-OD1 2.68Å; T603-N607 PolarHBondContact O-ND2 2.92Å; T604-N607 WeakPolarHBondContact O-CB 3.02Å; T604-N607 PolarHBondContact O-N 2.81Å; T604-N607 PolarHBondContact O-ND2 3.44Å; M605-N607 PolarHBondContact O-N 3.21Å; N607-I609 PolarHBondContact O-N 3.46Å
608	P	90.8	Very high	94.5	Very high	115 Å²	115	43.2 Å²	43.2	75%	0.747	24%	0.236	S	C	*	.			trans	-64	125.7	170.7	26.9	-34.5	0	0	0	110.4
609	I	94.3	Very high	94.4	Very high	9 Å²	9	47.8 Å²	47.8	5%	0.046	26%	0.261	C	S	.	.			trans	-116.4	138.1	-175.8	-74.7	172.9	0	0	0	109.8	L521 T604 M605 N607	L521-I609 HydrophobicContact CB-CG2 3.67Å; L521-I609 HydrophobicContact CD1-CG2 4.27Å; L521-I609 HydrophobicContact CD2-CG2 4.03Å; L521-I609 HydrophobicContact CG-CG2 4.19Å; T604-I609 HydrophobicContact CG2-CD1 4.34Å; M605-I609 HydrophobicContact CB-CD1 4.43Å; M605-I609 HydrophobicContact CE-CD1 4.35Å; M605-I609 HydrophobicContact CG-CD1 4.17Å; M605-I609 HydrophobicContact SD-CD1 3.25Å; M605-I609 WeakPolarHBondContact SD-CD1 3.14Å; N607-I609 PolarHBondContact O-N 3.46Å
610	S	96	Very high	94.4	Very high	41 Å²	41	42.3 Å²	42.3	29%	0.287	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	134.2	173.3	-66.7	0	0	0	0	110.8	H490 V522 Y612	H490-S610 WeakPolarHBondContact NE2-CB 3.42Å; H490-S610 PolarHBondContact NE2-OG 3.45Å; V522-S610 PolarHBondContact N-O 3.31Å; V522-S610 PolarHBondContact O-N 3.1Å; V522-S610 VanDerWaalsContact O-N 3.11Å; S610-Y612 VanDerWaalsContact CB-CE2 3.46Å
611	T	97.6	Very high	94.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120	179.2	-54.3	0	0	0	0	110.4	H490 F491 I493 Y495 L519 L521 I613 I639	H490-T611 WeakPolarHBondContact CA-O 3.3Å; H490-T611 PolarHBondContact CD2-O 3.01Å; F491-T611 PolarHBondContact N-O 2.72Å; F491-T611 WeakPolarHBondContact O-CB 3.47Å; F491-T611 PolarHBondContact O-N 2.8Å; I493-T611 HydrophobicContact CD1-CG2 4.11Å; Y495-T611 WeakPolarHBondContact CE2-OG1 3.45Å; Y495-T611 WeakPolarHBondContact OH-CG2 3.3Å; Y495-T611 PolarHBondContact OH-OG1 2.75Å; L519-T611 HydrophobicContact CD1-CG2 4.32Å; L521-T611 HydrophobicContact CD2-CG2 4.08Å; T611-I613 HydrophobicContact CG2-CD1 3.97Å; T611-I639 HydrophobicContact CG2-CD1 4.33Å
612	Y	98.1	Very high	94	Very high	33 Å²	33	41.6 Å²	41.6	13%	0.129	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.7	177.8	-66.5	-82.4	0	0	0	110.8	L488 A489 H490 L519 A520 V522 S610 P617	L488-Y612 HydrophobicContact CD1-CD1 3.68Å; L488-Y612 HydrophobicContact CD1-CE1 4.16Å; L488-Y612 HydrophobicContact CD2-CD1 4.03Å; L488-Y612 HydrophobicContact CG-CD1 4.46Å; A489-Y612 CarbonylContact O-C 3.58Å; A489-Y612 WeakPolarHBondContact O-CA 3.32Å; H490-Y612 HydrophobicContact CB-CD1 3.85Å; H490-Y612 HydrophobicContact CB-CE1 3.6Å; H490-Y612 AromaticContact CD2-CD1 3.94Å; H490-Y612 AromaticContact CD2-CE1 3.47Å; H490-Y612 VanDerWaalsContact CD2-CE1 3.47Å; H490-Y612 WeakPolarHBondContact CD2-CE1 3.49Å; H490-Y612 AromaticContact CD2-CZ 3.53Å; H490-Y612 AromaticContact CG-CE1 3.5Å; H490-Y612 VanDerWaalsContact CG-CE1 3.5Å; H490-Y612 AromaticContact CG-CZ 3.93Å; H490-Y612 AromaticContact NE2-CZ 3.89Å; L519-Y612 CarbonylContact C-O 3.52Å; L519-Y612 WeakPolarHBondContact CA-O 3.26Å; A520-Y612 PolarHBondContact N-O 2.88Å; A520-Y612 PolarHBondContact O-N 2.68Å; V522-Y612 HydrophobicContact CB-CD2 3.85Å; V522-Y612 HydrophobicContact CB-CE2 3.76Å; V522-Y612 HydrophobicContact CG1-CE2 4.24Å; V522-Y612 HydrophobicContact CG2-CD2 3.53Å; V522-Y612 HydrophobicContact CG2-CE2 3.89Å; S610-Y612 VanDerWaalsContact CB-CE2 3.46Å; Y612-P617 HydrophobicContact CD1-CG 3.79Å; Y612-P617 HydrophobicContact CD2-CG 3.73Å; Y612-P617 HydrophobicContact CE1-CG 3.51Å; Y612-P617 HydrophobicContact CE2-CG 3.43Å; Y612-P617 VanDerWaalsContact CE2-CG 3.43Å; Y612-P617 HydrophobicContact CG-CG 3.88Å
613	I	98.4	Very high	93.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.5	-178.9	-51.1	-58.9	0	0	0	109.3	F483 L488 A489 F491 L518 L519 T611 M635 I637 I639 L644 F646	F483-I613 HydrophobicContact CE1-CG2 4.19Å; F483-I613 HydrophobicContact CZ-CG2 3.74Å; L488-I613 WeakPolarHBondContact CA-O 3.23Å; L488-I613 WeakPolarHBondContact CB-O 3.38Å; A489-I613 PolarHBondContact N-O 3.48Å; A489-I613 PolarHBondContact O-N 3.03Å; F491-I613 HydrophobicContact CD2-CG1 4.06Å; F491-I613 HydrophobicContact CE2-CG1 4.16Å; L518-I613 WeakPolarHBondContact O-CA 3.25Å; L519-I613 HydrophobicContact CB-CD1 4.11Å; L519-I613 HydrophobicContact CD1-CD1 3.56Å; L519-I613 HydrophobicContact CG-CD1 3.82Å; T611-I613 HydrophobicContact CG2-CD1 3.97Å; I613-M635 HydrophobicContact CG2-CE 3.28Å; I613-M635 HydrophobicContact CG2-SD 4.48Å; I613-I637 HydrophobicContact CD1-CD1 3.97Å; I613-I639 HydrophobicContact CD1-CD1 4.5Å; I613-L644 HydrophobicContact CD1-CD1 4.48Å; I613-L644 HydrophobicContact CG1-CD1 4.36Å; I613-F646 HydrophobicContact CB-CE1 4.07Å; I613-F646 HydrophobicContact CG1-CE1 4.44Å; I613-F646 HydrophobicContact CG2-CE1 3.82Å; I613-F646 HydrophobicContact CG2-CZ 3.91Å
614	G	97.6	Very high	93.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	80.1	8.6	177.8	0	0	0	0	0	115.5	V517 L518 F630 Y631	V517-G614 CarbonylContact O-C 3.38Å; V517-G614 WeakPolarHBondContact O-CA 3.42Å; L518-G614 PolarHBondContact O-N 3.36Å; G614-F630 CarbonylContact O-C 3.6Å; G614-F630 VanDerWaalsContact O-CA 3.31Å; G614-F630 WeakPolarHBondContact O-CA 3.18Å; G614-Y631 PolarHBondContact O-N 2.93Å
615	G	97.1	Very high	93.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	170.1	-178.9	-178.7	0	0	0	0	0	114.1	V517	V517-G615 PolarHBondContact O-N 3.26Å
616	I	96	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.242	C	C	.	.			trans	-115.6	147.7	168.1	59.5	171.1	0	0	0	111.1	L488 V517 A520 I620 T625	L488-I616 WeakPolarHBondContact CD2-O 3.48Å; V517-I616 HydrophobicContact CG1-CG2 4.33Å; V517-I616 HydrophobicContact CG2-CG2 4.4Å; A520-I616 HydrophobicContact CB-CG2 3.71Å; I616-I620 HydrophobicContact CD1-CG2 4.32Å; I616-T625 HydrophobicContact CD1-CG2 3.67Å; I616-T625 HydrophobicContact CG2-CG2 4.35Å
617	P	95.2	Very high	93.5	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.032	21%	0.212	C	C	.	.			trans	-59.4	149.2	179	-22.5	33.1	0	0	0	112.9	R269 L488 Y612 D619 I620	R269-P617 VanDerWaalsContact CZ-O 3.3Å; R269-P617 PolarHBondContact NH2-O 2.03Å; L488-P617 HydrophobicContact CD2-CG 4.45Å; Y612-P617 HydrophobicContact CD1-CG 3.79Å; Y612-P617 HydrophobicContact CD2-CG 3.73Å; Y612-P617 HydrophobicContact CE1-CG 3.51Å; Y612-P617 HydrophobicContact CE2-CG 3.43Å; Y612-P617 VanDerWaalsContact CE2-CG 3.43Å; Y612-P617 HydrophobicContact CG-CG 3.88Å; P617-D619 WeakPolarHBondContact CB-OD1 3.01Å; P617-D619 PolarHBondContact O-N 3.28Å; P617-I620 HydrophobicContact CB-CG1 4.12Å; P617-I620 HydrophobicContact CG-CG1 4.19Å; P617-I620 PolarHBondContact O-N 3.47Å
618	P	91.7	Very high	93.7	Very high	101 Å²	101	32 Å²	32	66%	0.656	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-24	-176.5	27	-34.7	0	0	0	114.3	R269 I620	R269-P618 VanDerWaalsContact CZ-CA 3.49Å; R269-P618 PolarHBondContact NH1-O 3.24Å; P618-I620 VanDerWaalsContact C-N 3.3Å
619	D	91.9	Very high	94	Very high	101 Å²	101	26.6 Å²	26.6	54%	0.54	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.5	177.9	51.3	-60.6	0	0	0	113.7	P617	P617-D619 WeakPolarHBondContact CB-OD1 3.01Å; P617-D619 PolarHBondContact O-N 3.28Å
620	I	93.4	Very high	94.2	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	17%	0.168	C	C	.	.	S	Bend	trans	-71.9	130.7	175.1	-55.9	-54	0	0	0	109.6	R269 V522 N525 V527 I616 P617 P618 A624	R269-I620 PolarHBondContact NH1-O 3.43Å; R269-I620 PolarHBondContact NH2-O 3.47Å; V522-I620 HydrophobicContact CG1-CD1 3.56Å; V522-I620 HydrophobicContact CG1-CG1 4.25Å; N525-I620 HydrophobicContact CB-CD1 4.46Å; V527-I620 HydrophobicContact CG2-CG2 3.72Å; I616-I620 HydrophobicContact CD1-CG2 4.32Å; P617-I620 HydrophobicContact CB-CG1 4.12Å; P617-I620 HydrophobicContact CG-CG1 4.19Å; P617-I620 PolarHBondContact O-N 3.47Å; P618-I620 VanDerWaalsContact C-N 3.3Å; I620-A624 HydrophobicContact CG2-CB 3.6Å
621	P	91.3	Very high	94.3	Very high	67 Å²	67	25.7 Å²	25.7	44%	0.435	16%	0.155	S	C	.	.			trans	-69.8	144.8	178.1	29.6	-33.7	0	0	0	110.5	P623 A624	P621-P623 VanDerWaalsContact C-CD 3.43Å; P621-P623 VanDerWaalsContact C-N 3.32Å; P621-A624 HydrophobicContact CG-CB 4.12Å; P621-A624 VanDerWaalsContact O-CB 3.24Å; P621-A624 WeakPolarHBondContact O-CB 3.46Å; P621-A624 PolarHBondContact O-N 3.31Å
622	L	88.3	Confident	94.2	Very high	23 Å²	23	26.9 Å²	26.9	12%	0.12	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-54.4	-39.1	-178.1	-62.2	176.2	0	0	0	113.8	H265 D267 A624	H265-L622 HydrophobicContact CB-CB 4.22Å; D267-L622 HydrophobicContact CB-CD1 4.01Å; D267-L622 HydrophobicContact CB-CD2 4.36Å; L622-A624 PolarHBondContact O-N 2.91Å; L622-A624 VanDerWaalsContact O-N 3.16Å
623	P	87.4	Confident	94.1	Very high	59 Å²	59	25.3 Å²	25.3	38%	0.383	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-69	-7.9	177.9	-21.4	34.7	0	0	0	115.3	P621 T625	P621-P623 VanDerWaalsContact C-CD 3.43Å; P621-P623 VanDerWaalsContact C-N 3.32Å; P623-T625 PolarHBondContact O-N 3.1Å
624	A	90.3	Very high	94	Very high	21 Å²	21	25.3 Å²	25.3	17%	0.174	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-68.7	-22.1	-179	0	0	0	0	0	113.1	V527 I620 P621 L622	V527-A624 HydrophobicContact CG2-CB 4.18Å; I620-A624 HydrophobicContact CG2-CB 3.6Å; P621-A624 HydrophobicContact CG-CB 4.12Å; P621-A624 VanDerWaalsContact O-CB 3.24Å; P621-A624 WeakPolarHBondContact O-CB 3.46Å; P621-A624 PolarHBondContact O-N 3.31Å; L622-A624 PolarHBondContact O-N 2.91Å; L622-A624 VanDerWaalsContact O-N 3.16Å
625	T	91.6	Very high	94	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.018	15%	0.154	C	C	.	.	S	Bend	trans	-152.4	144.4	174.9	177.5	0	0	0	0	110.4	V527 S530 I616 P623 V627	V527-T625 HydrophobicContact CG2-CG2 4.13Å; S530-T625 PolarHBondContact OG-OG1 2.98Å; I616-T625 HydrophobicContact CD1-CG2 3.67Å; I616-T625 HydrophobicContact CG2-CG2 4.35Å; P623-T625 PolarHBondContact O-N 3.1Å; T625-V627 VanDerWaalsContact CG2-O 3.26Å; T625-V627 WeakPolarHBondContact CG2-O 3.48Å; T625-V627 PolarHBondContact O-N 3.16Å; T625-V627 VanDerWaalsContact O-N 3.15Å
626	P	91	Very high	94	Very high	78 Å²	78	26.8 Å²	26.8	51%	0.506	16%	0.162	S	C	.	.	S	Bend	trans	-58.5	-26.2	178.6	-28.7	37.1	0	0	0	114.6	F546 G549	F546-P626 HydrophobicContact CD1-CB 4.42Å; F546-P626 HydrophobicContact CD1-CG 3.71Å; F546-P626 HydrophobicContact CE1-CB 3.92Å; F546-P626 HydrophobicContact CE1-CG 3.63Å; F546-P626 HydrophobicContact CZ-CB 4.26Å; F546-P626 HydrophobicContact CZ-CG 4.4Å; G549-P626 WeakPolarHBondContact O-CD 3.44Å; G549-P626 WeakPolarHBondContact O-CG 3.43Å
627	V	95.1	Very high	94	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.042	16%	0.162	C	C	.	.			trans	-120.8	115.5	-178.5	-171.7	0	0	0	0	110.2	T515 V517 A532 V534 F546 T625 A629	T515-V627 HydrophobicContact CG2-CG1 3.61Å; V517-V627 HydrophobicContact CG2-CB 4.13Å; V517-V627 HydrophobicContact CG2-CG1 3.86Å; V517-V627 WeakPolarHBondContact CG2-O 3.15Å; A532-V627 HydrophobicContact CB-CB 3.85Å; A532-V627 HydrophobicContact CB-CG1 3.98Å; A532-V627 HydrophobicContact CB-CG2 3.89Å; V534-V627 HydrophobicContact CG2-CG2 3.85Å; F546-V627 HydrophobicContact CE2-CG2 4.25Å; F546-V627 HydrophobicContact CZ-CG2 4.33Å; T625-V627 VanDerWaalsContact CG2-O 3.26Å; T625-V627 WeakPolarHBondContact CG2-O 3.48Å; T625-V627 PolarHBondContact O-N 3.16Å; T625-V627 VanDerWaalsContact O-N 3.15Å; V627-A629 HydrophobicContact CG1-CB 4.3Å
628	S	95.3	Very high	94.1	Very high	8 Å²	8	28.2 Å²	28.2	6%	0.056	17%	0.172	C	C	.	.			trans	-107.4	-1	175.6	56.2	0	0	0	0	113.5	G268 R269	G268-S628 WeakPolarHBondContact CA-OG 3.43Å; G268-S628 PolarHBondContact N-OG 3.35Å; R269-S628 WeakPolarHBondContact CG-O 3.47Å
629	A	96.9	Very high	94.3	Very high	2 Å²	2	23.6 Å²	23.6	2%	0.017	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-72.7	140.6	-175	0	0	0	0	0	113.6	G268 I284 T515 V517 V627	G268-A629 VanDerWaalsContact O-CA 3.3Å; G268-A629 WeakPolarHBondContact O-CA 3.39Å; G268-A629 WeakPolarHBondContact O-CB 3.27Å; I284-A629 HydrophobicContact CD1-CB 3.42Å; I284-A629 VanDerWaalsContact CD1-CB 3.42Å; T515-A629 HydrophobicContact CG2-CB 4.11Å; V517-A629 PolarHBondContact N-O 2.81Å; V627-A629 HydrophobicContact CG1-CB 4.3Å
630	F	98	Very high	94.4	Very high	28 Å²	28	21.7 Å²	21.7	12%	0.123	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-69	136.6	170.8	-64.2	-60.9	0	0	0	110.2	R269 G485 L488 G614	R269-F630 HydrophobicContact CB-CD2 4.24Å; R269-F630 HydrophobicContact CB-CE2 3.63Å; R269-F630 HydrophobicContact CB-CZ 4.13Å; R269-F630 HydrophobicContact CG-CE2 4.05Å; R269-F630 HydrophobicContact CG-CZ 4.07Å; G485-F630 VanDerWaalsContact C-CB 3.48Å; G485-F630 WeakPolarHBondContact O-CB 3.41Å; L488-F630 HydrophobicContact CB-CD1 4.49Å; L488-F630 HydrophobicContact CB-CE1 4.35Å; L488-F630 HydrophobicContact CD2-CE1 4.21Å; L488-F630 HydrophobicContact CG-CE1 4.36Å; G614-F630 CarbonylContact O-C 3.6Å; G614-F630 VanDerWaalsContact O-CA 3.31Å; G614-F630 WeakPolarHBondContact O-CA 3.18Å
631	Y	97.8	Very high	94.3	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.008	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-63.5	137.4	175	178	-114.1	0	0	0	111.2	F483 G485 R510 P511 V517 L518 V533 G614 C634 M635	F483-Y631 HydrophobicContact CB-CD1 3.64Å; F483-Y631 HydrophobicContact CB-CE1 4.3Å; F483-Y631 VanDerWaalsContact CB-O 3.31Å; F483-Y631 WeakPolarHBondContact CB-O 3.09Å; F483-Y631 AromaticContact CD2-CD1 3.93Å; F483-Y631 HydrophobicContact CD2-CD1 3.93Å; F483-Y631 HydrophobicContact CD2-CE1 4.21Å; F483-Y631 AromaticContact CG-CD1 3.79Å; F483-Y631 HydrophobicContact CG-CD1 3.79Å; F483-Y631 HydrophobicContact CG-CE1 4.46Å; G485-Y631 WeakPolarHBondContact CA-O 2.91Å; G485-Y631 PolarHBondContact N-O 2.85Å; R510-Y631 PolarHBondContact O-OH 3.35Å; P511-Y631 HydrophobicContact CB-CE2 3.91Å; V517-Y631 VanDerWaalsContact O-CB 3.31Å; V517-Y631 WeakPolarHBondContact O-CB 3.24Å; L518-Y631 HydrophobicContact CD2-CD1 4.2Å; L518-Y631 HydrophobicContact CD2-CD2 3.4Å; L518-Y631 VanDerWaalsContact CD2-CD2 3.4Å; L518-Y631 HydrophobicContact CD2-CE1 4.14Å; L518-Y631 HydrophobicContact CD2-CE2 3.28Å; L518-Y631 HydrophobicContact CD2-CG 3.87Å; L518-Y631 HydrophobicContact CG-CD2 4.46Å; V533-Y631 HydrophobicContact CG2-CE2 4.39Å; G614-Y631 PolarHBondContact O-N 2.93Å; Y631-C634 PolarHBondContact OH-O 2.8Å; Y631-M635 HydrophobicContact CD1-CE 4.19Å; Y631-M635 HydrophobicContact CE1-CB 3.77Å; Y631-M635 HydrophobicContact CE1-CE 4.4Å
632	H	96.9	Very high	94.5	Very high	25 Å²	25	29.5 Å²	29.5	12%	0.116	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.2	173.8	-173.7	-74.8	0	0	0	109.3	F483 S484 S512 R513	F483-H632 CarbonylContact O-C 3.6Å; F483-H632 WeakPolarHBondContact O-CA 3.26Å; S484-H632 PolarHBondContact O-CD2 2.81Å; S484-H632 VanDerWaalsContact O-CD2 3.24Å; S512-H632 WeakPolarHBondContact CB-ND1 3.43Å; S512-H632 PolarHBondContact N-O 2.81Å; S512-H632 PolarHBondContact OG-CE1 2.62Å; S512-H632 VanDerWaalsContact OG-CE1 3.3Å; S512-H632 PolarHBondContact OG-ND1 2.86Å; S512-H632 VanDerWaalsContact OG-ND1 3.12Å; R513-H632 HydrophobicContact CB-CB 4.07Å; R513-H632 HydrophobicContact CG-CB 3.78Å; R513-H632 PolarHBondContact N-O 2.8Å
633	G	95.9	Very high	94.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.8	-172.5	-176.6	0	0	0	0	0	113	F482 F483 R510	F482-G633 WeakPolarHBondContact CD2-O 3.07Å; F483-G633 PolarHBondContact N-O 2.77Å; F483-G633 PolarHBondContact O-N 3.48Å; R510-G633 WeakPolarHBondContact O-CA 3.31Å
634	C	96.4	Very high	95.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	138.7	177.4	-73.9	0	0	0	0	110.5	S481 I509 R510 Y631 C661	S481-C634 WeakPolarHBondContact O-CA 3.09Å; I509-C634 CarbonylContact C-O 3.51Å; I509-C634 WeakPolarHBondContact CA-O 3.39Å; R510-C634 HydrophobicContact CB-CB 4.37Å; R510-C634 PolarHBondContact N-O 3.25Å; R510-C634 PolarHBondContact O-N 3.13Å; Y631-C634 PolarHBondContact OH-O 2.8Å; C634-C661 VanDerWaalsContact CA-SG 3.5Å; C634-C661 HydrophobicContact CB-CB 4.15Å; C634-C661 WeakPolarHBondContact CB-SG 3.08Å; C634-C661 WeakPolarHBondContact SG-CB 3.02Å; C634-C661 CovalentContact SG-SG 2.02Å; C634-C661 PolarHBondContact SG-SG 3.19Å
635	M	96.7	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	130.3	178.9	173.4	168.1	59.8	0	0	110.7	S481 F483 M507 N508 I509 L518 I613 Y631 I637	S481-M635 VanDerWaalsContact CB-O 3.23Å; S481-M635 WeakPolarHBondContact CB-O 3.5Å; S481-M635 PolarHBondContact N-O 3.5Å; S481-M635 PolarHBondContact O-N 3.32Å; S481-M635 PolarHBondContact OG-O 3.45Å; F483-M635 HydrophobicContact CD2-CB 4.35Å; F483-M635 HydrophobicContact CD2-CE 4.01Å; F483-M635 HydrophobicContact CE1-CE 4.3Å; F483-M635 HydrophobicContact CE2-CB 4.21Å; F483-M635 HydrophobicContact CE2-CE 3.43Å; F483-M635 VanDerWaalsContact CE2-CE 3.43Å; F483-M635 HydrophobicContact CZ-CE 3.6Å; M507-M635 HydrophobicContact SD-SD 4.26Å; N508-M635 WeakPolarHBondContact O-CA 3.48Å; I509-M635 HydrophobicContact CG2-CB 4.14Å; I509-M635 HydrophobicContact CG2-CG 3.85Å; I509-M635 HydrophobicContact CG2-SD 4.1Å; L518-M635 HydrophobicContact CB-SD 4.29Å; L518-M635 HydrophobicContact CD2-SD 3.85Å; I613-M635 HydrophobicContact CG2-CE 3.28Å; I613-M635 HydrophobicContact CG2-SD 4.48Å; Y631-M635 HydrophobicContact CD1-CE 4.19Å; Y631-M635 HydrophobicContact CE1-CB 3.77Å; Y631-M635 HydrophobicContact CE1-CE 4.4Å; M635-I637 HydrophobicContact CG-CB 4.45Å
636	D	96.3	Very high	95.7	Very high	31 Å²	31	33 Å²	33	17%	0.166	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.1	159.4	-62	-64.1	0	0	0	108.1	G480 M507 N508 R565	G480-D636 WeakPolarHBondContact CA-OD1 3.47Å; M507-D636 CarbonylContact C-O 3.3Å; M507-D636 VanDerWaalsContact CA-O 3.29Å; M507-D636 WeakPolarHBondContact CA-O 3.5Å; N508-D636 HydrophobicContact CB-CB 4.31Å; N508-D636 PolarHBondContact N-O 3.32Å; N508-D636 PolarHBondContact O-N 3.01Å; R565-D636 IonicContact NH1-OD2 2.63Å; R565-D636 PolarHBondContact NH1-OD2 2.72Å
637	I	97.4	Very high	95.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.5	-177.6	-175.7	167.6	0	0	0	111.4	I505 M507 L519 I613 M635 I639 L644 F646	I505-I637 HydrophobicContact CG2-CD1 4.02Å; I505-I637 HydrophobicContact CG2-CG1 4.18Å; M507-I637 HydrophobicContact CG-CB 4.03Å; M507-I637 HydrophobicContact CG-CD1 3.75Å; M507-I637 HydrophobicContact CG-CG1 3.64Å; M507-I637 HydrophobicContact SD-CD1 3.89Å; M507-I637 HydrophobicContact SD-CG1 4.45Å; L519-I637 HydrophobicContact CD1-CD1 3.74Å; I613-I637 HydrophobicContact CD1-CD1 3.97Å; M635-I637 HydrophobicContact CG-CB 4.45Å; I637-I639 HydrophobicContact CD1-CD1 4.12Å; I637-I639 HydrophobicContact CD1-CG1 4.16Å; I637-I639 HydrophobicContact CG1-CG1 4.04Å; I637-L644 HydrophobicContact CG2-CB 4.12Å; I637-L644 HydrophobicContact CG2-CD1 3.88Å; I637-L644 HydrophobicContact CG2-CG 4.16Å; I637-L644 PolarHBondContact O-N 2.79Å; I637-F646 HydrophobicContact CG2-CE2 4.46Å; I637-F646 HydrophobicContact CG2-CZ 3.92Å
638	S	97.1	Very high	95.9	Very high	33 Å²	33	34.2 Å²	34.2	23%	0.231	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.3	170.9	-63.2	0	0	0	0	109.3	I505 T506 R642 Q643	I505-S638 WeakPolarHBondContact CA-O 3.05Å; T506-S638 PolarHBondContact N-O 3.34Å; T506-S638 PolarHBondContact O-N 3Å; S638-R642 CarbonylContact C-O 3.55Å; S638-R642 VanDerWaalsContact CA-O 3.24Å; S638-R642 WeakPolarHBondContact CA-O 3.31Å; S638-Q643 WeakPolarHBondContact OG-CA 2.97Å
639	I	96.4	Very high	96	Very high	4 Å²	4	34 Å²	34	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.6	178.3	-55.8	-170.2	0	0	0	108.3	I493 Y495 D504 I505 L519 T611 I613 I637 G641 R642 L644	I493-I639 HydrophobicContact CD1-CB 4.4Å; I493-I639 HydrophobicContact CD1-CD1 3.69Å; I493-I639 HydrophobicContact CD1-CG2 4.42Å; I493-I639 HydrophobicContact CG2-CG2 4.18Å; Y495-I639 HydrophobicContact CD1-CG2 4.47Å; Y495-I639 HydrophobicContact CE1-CG2 3.6Å; D504-I639 CarbonylContact O-C 3.27Å; D504-I639 WeakPolarHBondContact O-CA 3.49Å; I505-I639 HydrophobicContact CG1-CG1 4.29Å; L519-I639 HydrophobicContact CD1-CD1 3.69Å; T611-I639 HydrophobicContact CG2-CD1 4.33Å; I613-I639 HydrophobicContact CD1-CD1 4.5Å; I637-I639 HydrophobicContact CD1-CD1 4.12Å; I637-I639 HydrophobicContact CD1-CG1 4.16Å; I637-I639 HydrophobicContact CG1-CG1 4.04Å; I639-G641 PolarHBondContact O-N 2.62Å; I639-G641 VanDerWaalsContact O-N 3.17Å; I639-R642 PolarHBondContact N-O 3.39Å; I639-R642 PolarHBondContact O-N 2.89Å; I639-L644 HydrophobicContact CD1-CD1 3.82Å; I639-L644 HydrophobicContact CG1-CD1 4.13Å; I639-L644 HydrophobicContact CG1-CG 4.35Å
640	N	93.3	Very high	95.9	Very high	62 Å²	62	39.1 Å²	39.1	33%	0.332	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	38.9	-178	-64.8	-7.3	0	0	0	112.7	K502 D504 R642	K502-N640 PolarHBondContact O-ND2 2.9Å; K502-N640 PolarHBondContact O-OD1 2.04Å; D504-N640 WeakPolarHBondContact CB-OD1 3.22Å; D504-N640 PolarHBondContact N-OD1 2.01Å; D504-N640 PolarHBondContact O-N 3.3Å; N640-R642 VanDerWaalsContact C-N 3.29Å; N640-R642 PolarHBondContact O-N 2.91Å
641	G	91.3	Very high	95.8	Very high	76 Å²	76	40.3 Å²	40.3	78%	0.784	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	-3.7	-179.9	0	0	0	0	0	115.7	I639	I639-G641 PolarHBondContact O-N 2.62Å; I639-G641 VanDerWaalsContact O-N 3.17Å
642	R	94.5	Very high	95.7	Very high	156 Å²	156	41.1 Å²	41.1	59%	0.589	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.3	174.4	-178.7	178.9	176.2	-176.7	-1.5	110.2	S638 I639 N640 L644 E648	S638-R642 CarbonylContact C-O 3.55Å; S638-R642 VanDerWaalsContact CA-O 3.24Å; S638-R642 WeakPolarHBondContact CA-O 3.31Å; I639-R642 PolarHBondContact N-O 3.39Å; I639-R642 PolarHBondContact O-N 2.89Å; N640-R642 VanDerWaalsContact C-N 3.29Å; N640-R642 PolarHBondContact O-N 2.91Å; R642-L644 PolarHBondContact O-N 3.27Å; R642-E648 IonicContact CZ-OE2 3.74Å; R642-E648 IonicContact NH2-OE2 3.53Å; R642-E648 PolarHBondContact NH2-OE2 3.23Å
643	Q	95.1	Very high	95.7	Very high	126 Å²	126	43.9 Å²	43.9	59%	0.589	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	129.3	169.2	-174.1	166.7	5.3	0	0	109.4	S638	S638-Q643 WeakPolarHBondContact OG-CA 2.97Å
644	L	96.4	Very high	95.6	Very high	18 Å²	18	47.6 Å²	47.6	9%	0.094	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-77.7	132.1	178.3	-60.4	-169.4	0	0	0	110.2	F491 I493 I613 I637 I639 R642	F491-L644 HydrophobicContact CD2-CD1 4.32Å; F491-L644 HydrophobicContact CE2-CD1 4.23Å; F491-L644 HydrophobicContact CZ-CB 4.32Å; F491-L644 HydrophobicContact CZ-CD1 4.37Å; I493-L644 HydrophobicContact CD1-CD1 4.19Å; I493-L644 HydrophobicContact CD1-CD2 4.02Å; I613-L644 HydrophobicContact CD1-CD1 4.48Å; I613-L644 HydrophobicContact CG1-CD1 4.36Å; I637-L644 HydrophobicContact CG2-CB 4.12Å; I637-L644 HydrophobicContact CG2-CD1 3.88Å; I637-L644 HydrophobicContact CG2-CG 4.16Å; I637-L644 PolarHBondContact O-N 2.79Å; I639-L644 HydrophobicContact CD1-CD1 3.82Å; I639-L644 HydrophobicContact CG1-CD1 4.13Å; I639-L644 HydrophobicContact CG1-CG 4.35Å; R642-L644 PolarHBondContact O-N 3.27Å
645	D	95.7	Very high	95.5	Very high	33 Å²	33	48.9 Å²	48.9	18%	0.176	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-100.1	118.1	166.5	-176.8	-12.6	0	0	0	108.3	F491 D647 E648 H659	F491-D645 WeakPolarHBondContact CE1-O 2.99Å; D645-D647 PolarHBondContact O-N 3.29Å; D645-D647 WeakPolarHBondContact OD1-CB 3.27Å; D645-D647 PolarHBondContact OD1-N 3.02Å; D645-E648 HydrophobicContact CB-CB 4.45Å; D645-E648 HydrophobicContact CB-CG 4.1Å; D645-E648 PolarHBondContact O-N 3.43Å; D645-H659 IonicContact OD1-CE1 2.65Å; D645-H659 PolarHBondContact OD1-CE1 3.29Å; D645-H659 VanDerWaalsContact OD1-CE1 3.27Å; D645-H659 IonicContact OD1-NE2 2.83Å; D645-H659 PolarHBondContact OD1-NE2 3.46Å
646	F	96.6	Very high	95.5	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-68.9	-16.4	-179.7	-69.3	-76.6	0	0	0	113.4	S481 F483 A489 F491 I613 I637 E648 A649 K652	S481-F646 VanDerWaalsContact CB-CE2 3.44Å; S481-F646 WeakPolarHBondContact OG-CD2 3.33Å; S481-F646 WeakPolarHBondContact OG-CE2 3.3Å; F483-F646 HydrophobicContact CE1-CE1 4.49Å; F483-F646 HydrophobicContact CE2-CE1 4.4Å; F483-F646 HydrophobicContact CE2-CE2 4.31Å; F483-F646 AromaticContact CE2-CZ 3.93Å; F483-F646 HydrophobicContact CE2-CZ 3.93Å; F483-F646 HydrophobicContact CZ-CD1 4.36Å; F483-F646 AromaticContact CZ-CE1 3.6Å; F483-F646 HydrophobicContact CZ-CE1 3.6Å; F483-F646 HydrophobicContact CZ-CE2 4.29Å; F483-F646 AromaticContact CZ-CZ 3.55Å; F483-F646 HydrophobicContact CZ-CZ 3.55Å; A489-F646 HydrophobicContact CB-CD1 3.7Å; A489-F646 HydrophobicContact CB-CE1 3.98Å; F491-F646 AromaticContact CE2-CD1 3.78Å; F491-F646 HydrophobicContact CE2-CD1 3.78Å; F491-F646 AromaticContact CE2-CE1 3.86Å; F491-F646 HydrophobicContact CE2-CE1 3.86Å; F491-F646 AromaticContact CZ-CD1 3.81Å; F491-F646 HydrophobicContact CZ-CD1 3.81Å; F491-F646 HydrophobicContact CZ-CE1 4.21Å; F491-F646 HydrophobicContact CZ-CG 4.46Å; I613-F646 HydrophobicContact CB-CE1 4.07Å; I613-F646 HydrophobicContact CG1-CE1 4.44Å; I613-F646 HydrophobicContact CG2-CE1 3.82Å; I613-F646 HydrophobicContact CG2-CZ 3.91Å; I637-F646 HydrophobicContact CG2-CE2 4.46Å; I637-F646 HydrophobicContact CG2-CZ 3.92Å; F646-E648 VanDerWaalsContact C-N 3.26Å; F646-A649 WeakPolarHBondContact O-CB 3.21Å; F646-A649 PolarHBondContact O-N 3.23Å; F646-K652 HydrophobicContact CB-CD 3.89Å
647	D	95.1	Very high	95.5	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.027	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-79	-8.8	170	-66.3	-47.6	0	0	0	113.2	N441 R443 D645 K652 S658 H659	N441-D647 PolarHBondContact ND2-O 3.39Å; R443-D647 HydrophobicContact CB-CB 3.9Å; R443-D647 VanDerWaalsContact CD-O 3.23Å; R443-D647 WeakPolarHBondContact CD-O 3.31Å; R443-D647 PolarHBondContact NH1-O 3.42Å; D645-D647 PolarHBondContact O-N 3.29Å; D645-D647 WeakPolarHBondContact OD1-CB 3.27Å; D645-D647 PolarHBondContact OD1-N 3.02Å; D647-K652 IonicContact OD1-NZ 3.76Å; D647-K652 PolarHBondContact OD1-NZ 3.47Å; D647-S658 PolarHBondContact OD1-OG 2.96Å; D647-S658 WeakPolarHBondContact OD2-CB 3.5Å; D647-S658 PolarHBondContact OD2-OG 3.19Å; D647-H659 IonicContact OD2-CE1 3.85Å; D647-H659 PolarHBondContact OD2-CE1 2.97Å; D647-H659 VanDerWaalsContact OD2-CE1 3.31Å; D647-H659 IonicContact OD2-ND1 3.5Å; D647-H659 PolarHBondContact OD2-ND1 3.46Å
648	E	94.9	Very high	95.5	Very high	106 Å²	106	48.6 Å²	48.6	50%	0.495	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-96.7	0.2	170.1	-63.2	-168.4	154.8	0	0	113.5	R642 D645 F646	R642-E648 IonicContact CZ-OE2 3.74Å; R642-E648 IonicContact NH2-OE2 3.53Å; R642-E648 PolarHBondContact NH2-OE2 3.23Å; D645-E648 HydrophobicContact CB-CB 4.45Å; D645-E648 HydrophobicContact CB-CG 4.1Å; D645-E648 PolarHBondContact O-N 3.43Å; F646-E648 VanDerWaalsContact C-N 3.26Å
649	A	96.5	Very high	95.5	Very high	4 Å²	4	48.5 Å²	48.5	3%	0.033	26%	0.258	C	S	.	.			trans	-57.4	154.1	179	0	0	0	0	0	112.3	F305 F491 F646 K652	F305-A649 HydrophobicContact CZ-CB 4.13Å; F305-A649 VanDerWaalsContact CZ-O 3.27Å; F305-A649 WeakPolarHBondContact CZ-O 3.46Å; F491-A649 HydrophobicContact CD1-CB 4.32Å; F491-A649 HydrophobicContact CD2-CB 4.46Å; F491-A649 HydrophobicContact CE1-CB 3.82Å; F491-A649 HydrophobicContact CE2-CB 3.98Å; F491-A649 HydrophobicContact CZ-CB 3.66Å; F646-A649 WeakPolarHBondContact O-CB 3.21Å; F646-A649 PolarHBondContact O-N 3.23Å; A649-K652 HydrophobicContact CB-CB 4.38Å
650	L	95.6	Very high	95.5	Very high	110 Å²	110	48.9 Å²	48.9	58%	0.576	26%	0.261	S	S	*	.	S	Bend	trans	-69.5	-40.5	170.4	-67.5	179.7	0	0	0	110.6	H490 D492	H490-L650 PolarHBondContact O-N 3.17Å; D492-L650 HydrophobicContact CB-CD1 3.68Å
651	S	96.1	Very high	95.6	Very high	53 Å²	53	46 Å²	46	37%	0.371	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	147.2	170	69.7	0	0	0	0	110.4	A489 H490	A489-S651 CarbonylContact C-O 3.56Å; A489-S651 WeakPolarHBondContact CA-O 3.3Å; H490-S651 VanDerWaalsContact CB-OG 3.3Å; H490-S651 WeakPolarHBondContact CB-OG 3.38Å; H490-S651 PolarHBondContact N-O 3.43Å
652	K	96.2	Very high	95.7	Very high	18 Å²	18	42.3 Å²	42.3	8%	0.078	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	133.2	176.9	-174.9	-174.9	77.3	-170.4	0	108.8	F305 A489 F646 D647 A649 I656 S658	F305-K652 HydrophobicContact CD1-CB 4.15Å; F305-K652 HydrophobicContact CD2-CB 3.64Å; F305-K652 HydrophobicContact CD2-CD 4.15Å; F305-K652 HydrophobicContact CD2-CG 4.44Å; F305-K652 HydrophobicContact CE1-CB 4.26Å; F305-K652 HydrophobicContact CE2-CB 3.72Å; F305-K652 HydrophobicContact CE2-CD 4.34Å; F305-K652 HydrophobicContact CG-CB 3.83Å; F305-K652 HydrophobicContact CZ-CB 4.03Å; A489-K652 HydrophobicContact CB-CB 4.48Å; A489-K652 HydrophobicContact CB-CG 4.27Å; F646-K652 HydrophobicContact CB-CD 3.89Å; D647-K652 IonicContact OD1-NZ 3.76Å; D647-K652 PolarHBondContact OD1-NZ 3.47Å; A649-K652 HydrophobicContact CB-CB 4.38Å; K652-I656 HydrophobicContact CD-CB 4.16Å; K652-I656 HydrophobicContact CD-CG2 4.1Å; K652-I656 HydrophobicContact CG-CB 3.96Å; K652-I656 HydrophobicContact CG-CD1 4.08Å; K652-I656 HydrophobicContact CG-CG2 4.23Å; K652-S658 PolarHBondContact NZ-OG 3.04Å
653	H	96.8	Very high	95.6	Very high	84 Å²	84	35.6 Å²	35.6	39%	0.389	19%	0.185	S	C	.	.			trans	-66.2	136.2	172.5	-168.6	-100.5	0	0	0	110.9	L488 S655 I656	L488-H653 PolarHBondContact O-N 3.11Å; H653-S655 PolarHBondContact CE1-OG 3.13Å; H653-S655 VanDerWaalsContact ND1-CB 3.33Å; H653-S655 WeakPolarHBondContact ND1-CB 3.14Å; H653-S655 PolarHBondContact ND1-N 3.31Å; H653-S655 PolarHBondContact ND1-OG 2.81Å; H653-S655 PolarHBondContact O-N 2.9Å; H653-I656 HydrophobicContact CB-CD1 4.12Å; H653-I656 HydrophobicContact CB-CG1 4.4Å; H653-I656 WeakPolarHBondContact O-CB 3.48Å; H653-I656 PolarHBondContact O-N 3.15Å
654	N	94.4	Very high	95.3	Very high	78 Å²	78	31.3 Å²	31.3	42%	0.417	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.9	-175	-70.3	-21.1	0	0	0	114.4	E303 F305 I656	E303-N654 WeakPolarHBondContact O-CB 3.04Å; F305-N654 PolarHBondContact N-OD1 2.88Å; N654-I656 VanDerWaalsContact C-N 3.29Å
655	S	93.9	Very high	94.4	Very high	27 Å²	27	34.1 Å²	34.1	19%	0.189	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.4	177.6	80	0	0	0	0	113.6	S484 H653	S484-S655 WeakPolarHBondContact OG-CB 3.39Å; S484-S655 PolarHBondContact OG-O 2.85Å; S484-S655 PolarHBondContact OG-OG 3.44Å; H653-S655 PolarHBondContact CE1-OG 3.13Å; H653-S655 VanDerWaalsContact ND1-CB 3.33Å; H653-S655 WeakPolarHBondContact ND1-CB 3.14Å; H653-S655 PolarHBondContact ND1-N 3.31Å; H653-S655 PolarHBondContact ND1-OG 2.81Å; H653-S655 PolarHBondContact O-N 2.9Å
656	I	96.7	Very high	92.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.194	C	C	.	.			trans	-86.2	128.8	176.8	-59.8	168.8	0	0	0	108.8	F482 F483 L488 A489 K652 H653 N654	F482-I656 WeakPolarHBondContact O-CA 3.49Å; F483-I656 HydrophobicContact CD1-CD1 3.89Å; F483-I656 HydrophobicContact CD1-CG1 3.96Å; F483-I656 HydrophobicContact CD1-CG2 4.33Å; F483-I656 HydrophobicContact CE1-CD1 3.76Å; F483-I656 HydrophobicContact CE1-CG1 4.21Å; F483-I656 HydrophobicContact CE1-CG2 4.15Å; F483-I656 HydrophobicContact CZ-CG2 4.23Å; L488-I656 WeakPolarHBondContact O-CD1 3.25Å; A489-I656 HydrophobicContact CB-CD1 4.31Å; K652-I656 HydrophobicContact CD-CB 4.16Å; K652-I656 HydrophobicContact CD-CG2 4.1Å; K652-I656 HydrophobicContact CG-CB 3.96Å; K652-I656 HydrophobicContact CG-CD1 4.08Å; K652-I656 HydrophobicContact CG-CG2 4.23Å; H653-I656 HydrophobicContact CB-CD1 4.12Å; H653-I656 HydrophobicContact CB-CG1 4.4Å; H653-I656 WeakPolarHBondContact O-CB 3.48Å; H653-I656 PolarHBondContact O-N 3.15Å; N654-I656 VanDerWaalsContact C-N 3.29Å
657	K	96.3	Very high	90.9	Very high	25 Å²	25	39.8 Å²	39.8	11%	0.109	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-99.8	125.3	174.5	-48.1	-61.5	171.5	-164.5	0	108.5	Y300 F474 S481 F482 S660	Y300-K657 HydrophobicContact CE1-CD 3.86Å; Y300-K657 HydrophobicContact CE2-CD 4.1Å; Y300-K657 VanDerWaalsContact CZ-CD 3.44Å; Y300-K657 WeakPolarHBondContact OH-CD 3.26Å; F474-K657 HydrophobicContact CE2-CG 4.14Å; S481-K657 CarbonylContact C-O 3.59Å; S481-K657 VanDerWaalsContact CA-O 3.23Å; S481-K657 WeakPolarHBondContact CA-O 3.44Å; S481-K657 WeakPolarHBondContact CB-O 3.37Å; F482-K657 HydrophobicContact CB-CB 4.12Å; F482-K657 HydrophobicContact CB-CG 4.29Å; F482-K657 HydrophobicContact CD1-CG 4.29Å; F482-K657 PolarHBondContact N-O 3.27Å; F482-K657 PolarHBondContact O-N 2.1Å; K657-S660 WeakPolarHBondContact CB-O 3.27Å
658	S	96.2	Very high	88.9	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.007	25%	0.247	C	C	.	.	S	Bend	trans	-72.9	-34.3	-170.3	-54.1	0	0	0	0	113.6	D445 S481 D647 K652	D445-S658 PolarHBondContact OD2-N 3.45Å; S481-S658 VanDerWaalsContact CB-O 3.29Å; S481-S658 WeakPolarHBondContact CB-O 3.43Å; S481-S658 PolarHBondContact OG-O 3.39Å; D647-S658 PolarHBondContact OD1-OG 2.96Å; D647-S658 WeakPolarHBondContact OD2-CB 3.5Å; D647-S658 PolarHBondContact OD2-OG 3.19Å; K652-S658 PolarHBondContact NZ-OG 3.04Å
659	H	96.9	Very high	86.5	Confident	31 Å²	31	43.1 Å²	43.1	14%	0.144	25%	0.252	C	S	.	.	S	Bend	trans	-134.9	-6.1	-164.2	-63.1	111.1	0	0	0	113.6	F332 D333 D445 G480 D645 D647	F332-H659 HydrophobicContact CB-CB 4.14Å; F332-H659 VanDerWaalsContact CB-O 3.28Å; F332-H659 WeakPolarHBondContact CB-O 3.29Å; D333-H659 HydrophobicContact CB-CB 4.27Å; D333-H659 IonicContact OD1-CE1 3.93Å; D333-H659 PolarHBondContact OD1-CE1 2.98Å; D333-H659 IonicContact OD1-ND1 2.87Å; D333-H659 PolarHBondContact OD1-ND1 3.06Å; D333-H659 IonicContact OD2-CE1 3.31Å; D333-H659 IonicContact OD2-ND1 3.22Å; D333-H659 PolarHBondContact OD2-ND1 3.37Å; D445-H659 HydrophobicContact CB-CB 4.1Å; D445-H659 WeakPolarHBondContact OD2-CA 3.5Å; D445-H659 PolarHBondContact OD2-N 2.88Å; G480-H659 PolarHBondContact N-O 3.29Å; G480-H659 CarbonylContact O-C 3.54Å; D645-H659 IonicContact OD1-CE1 2.65Å; D645-H659 PolarHBondContact OD1-CE1 3.29Å; D645-H659 VanDerWaalsContact OD1-CE1 3.27Å; D645-H659 IonicContact OD1-NE2 2.83Å; D645-H659 PolarHBondContact OD1-NE2 3.46Å; D647-H659 IonicContact OD2-CE1 3.85Å; D647-H659 PolarHBondContact OD2-CE1 2.97Å; D647-H659 VanDerWaalsContact OD2-CE1 3.31Å; D647-H659 IonicContact OD2-ND1 3.5Å; D647-H659 PolarHBondContact OD2-ND1 3.46Å
660	S	96.1	Very high	83.9	Confident	12 Å²	12	48.5 Å²	48.5	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.6	-179.9	60.2	0	0	0	0	114	D445 G480 F482 K657	D445-S660 PolarHBondContact OD1-OG 2.71Å; D445-S660 WeakPolarHBondContact OD2-CB 3.47Å; D445-S660 PolarHBondContact OD2-N 3.47Å; D445-S660 PolarHBondContact OD2-OG 2.98Å; G480-S660 CarbonylContact O-C 3.55Å; G480-S660 VanDerWaalsContact O-CA 3.3Å; G480-S660 WeakPolarHBondContact O-CA 3.31Å; G480-S660 PolarHBondContact O-N 2.82Å; F482-S660 VanDerWaalsContact CB-O 3.3Å; F482-S660 WeakPolarHBondContact CB-O 3.4Å; K657-S660 WeakPolarHBondContact CB-O 3.27Å
661	C	95.9	Very high	81.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	-179.3	-105.7	0	0	0	0	111.8	V477 E478 S481 C634	V477-C661 CarbonylContact C-O 3.58Å; V477-C661 VanDerWaalsContact CA-O 3.27Å; V477-C661 WeakPolarHBondContact CA-O 3.27Å; E478-C661 HydrophobicContact CG-CB 3.75Å; E478-C661 VanDerWaalsContact CG-O 3.3Å; E478-C661 WeakPolarHBondContact CG-O 3.25Å; E478-C661 PolarHBondContact N-O 3.09Å; E478-C661 PolarHBondContact O-N 3.18Å; S481-C661 VanDerWaalsContact C-SG 3.57Å; S481-C661 PolarHBondContact O-SG 3.39Å; C634-C661 VanDerWaalsContact CA-SG 3.5Å; C634-C661 HydrophobicContact CB-CB 4.15Å; C634-C661 WeakPolarHBondContact CB-SG 3.08Å; C634-C661 WeakPolarHBondContact SG-CB 3.02Å; C634-C661 CovalentContact SG-SG 2.02Å; C634-C661 PolarHBondContact SG-SG 3.19Å
662	P	94.7	Very high	78.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.301	C	S	.	.			trans	-71.1	138.6	169.4	30.2	-32.8	0	0	0	110	L290 D292 F474 F482 R510	L290-P662 HydrophobicContact CB-CB 4.39Å; L290-P662 HydrophobicContact CB-CG 4.15Å; L290-P662 HydrophobicContact CD1-CG 4.05Å; D292-P662 HydrophobicContact CB-CB 4.17Å; D292-P662 HydrophobicContact CB-CG 4.39Å; F474-P662 HydrophobicContact CE2-CG 4.42Å; F474-P662 HydrophobicContact CZ-CG 4.48Å; F482-P662 HydrophobicContact CD1-CG 4.41Å; F482-P662 HydrophobicContact CD2-CG 3.91Å; F482-P662 HydrophobicContact CE1-CG 4.32Å; F482-P662 HydrophobicContact CE2-CG 3.82Å; F482-P662 HydrophobicContact CG-CG 4.22Å; F482-P662 HydrophobicContact CZ-CG 4.03Å; R510-P662 PolarHBondContact NH2-O 3.22Å
663	P	92.6	Very high	75.9	Confident	14 Å²	14	58.3 Å²	58.3	9%	0.091	34%	0.335	C	S	.	.			trans	-76.7	170.9	176.7	28.5	-28.1	0	0	0	112.1	T291 Y476	T291-P663 PolarHBondContact N-O 2.82Å; T291-P663 WeakPolarHBondContact OG1-CD 3.29Å; T291-P663 WeakPolarHBondContact OG1-CG 3.38Å; T291-P663 PolarHBondContact OG1-O 2.04Å; Y476-P663 WeakPolarHBondContact O-CD 3.43Å
664	V	88.4	Confident	72.8	Confident	36 Å²	36	64.1 Å²	64.1	22%	0.218	35%	0.353	C	S	.	.	S	Bend	trans	-85	-36.5	178.6	179.4	0	0	0	0	112	V288 L290 P563	V288-V664 HydrophobicContact CG1-CB 4.44Å; V288-V664 HydrophobicContact CG1-CG1 3.78Å; V288-V664 HydrophobicContact CG1-CG2 3.78Å; L290-V664 HydrophobicContact CD2-CG2 3.97Å; P563-V664 HydrophobicContact CB-CB 4.27Å; P563-V664 HydrophobicContact CB-CG1 3.94Å; P563-V664 HydrophobicContact CB-CG2 4.21Å; P563-V664 HydrophobicContact CG-CG1 4.1Å
665	S	76.3	Confident	70.1	Confident	78 Å²	78	66.3 Å²	66.3	55%	0.545	37%	0.371	S	S	.	.	S	Bend	trans	-119.6	143.5	-178.1	58.5	0	0	0	0	111.5	P667	S665-P667 VanDerWaalsContact O-CD 3.28Å; S665-P667 WeakPolarHBondContact O-CD 3.47Å
666	D	63	Low	67.4	Low	56 Å²	56	73.3 Å²	73.3	30%	0.299	43%	0.431	S	S	.	.			trans	-64.2	117.6	174	-174.8	-4.7	0	0	0	110.4	Y476 G668 H669	Y476-D666 WeakPolarHBondContact CE2-OD1 3.47Å; Y476-D666 PolarHBondContact OH-OD1 3.27Å; Y476-D666 VanDerWaalsContact OH-OD1 3.09Å; D666-G668 PolarHBondContact O-N 2.7Å; D666-G668 PolarHBondContact OD1-N 3.18Å; D666-H669 PolarHBondContact O-N 3.29Å; D666-H669 VanDerWaalsContact O-N 3.16Å
667	P	56.8	Low	66	Low	96 Å²	96	77 Å²	77	62%	0.623	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.2	175.5	-20.5	32.2	0	0	0	113.9	Y476 S665	Y476-P667 HydrophobicContact CD1-CG 3.91Å; Y476-P667 HydrophobicContact CE1-CG 4.28Å; Y476-P667 HydrophobicContact CG-CG 4.32Å; S665-P667 VanDerWaalsContact O-CD 3.28Å; S665-P667 WeakPolarHBondContact O-CD 3.47Å
668	G	52.3	Low	64.4	Low	49 Å²	49	79.7 Å²	79.7	51%	0.505	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.8	178.9	0	0	0	0	0	116	D666	D666-G668 PolarHBondContact O-N 2.7Å; D666-G668 PolarHBondContact OD1-N 3.18Å
669	H	45.4	Very low	62.6	Low	133 Å²	133	84.1 Å²	84.1	62%	0.616	50%	0.497	S	S	*	.			trans	-142.9	94.4	179.9	-108.8	16.9	0	0	0	111.2	D666 D671	D666-H669 PolarHBondContact O-N 3.29Å; D666-H669 VanDerWaalsContact O-N 3.16Å; H669-D671 PolarHBondContact O-N 3.39Å
670	P	41.6	Very low	60.6	Low	117 Å²	117	87.2 Å²	87.2	76%	0.76	52%	0.517	S	S	*	.			trans	-68.7	119.2	171.1	27.4	-29.2	0	0	0	109.4
671	D	41.8	Very low	58.3	Low	104 Å²	104	91.9 Å²	91.9	56%	0.556	54%	0.544	S	S	*	.			trans	37.5	96.2	162.6	-73.5	-12	0	0	0	117.8	H669 R674	H669-D671 PolarHBondContact O-N 3.39Å; D671-R674 IonicContact OD2-CZ 3.56Å; D671-R674 IonicContact OD2-NE 3.01Å; D671-R674 PolarHBondContact OD2-NE 2.84Å; D671-R674 IonicContact OD2-NH2 3.19Å
672	V	38.7	Very low	55.8	Low	114 Å²	114	98 Å²	98	69%	0.691	58%	0.581	S	S	*	*	S	Bend	trans	-93.4	-4.7	156.7	177.2	0	0	0	0	112.2
673	H	39.2	Very low	53.1	Low	169 Å²	169	105 Å²	105	78%	0.782	62%	0.622	S	S	*	*			trans	-125.2	75.2	179	-69	-55.1	0	0	0	112.6
674	R	30.6	Very low	50	Low	206 Å²	206	112 Å²	112	78%	0.777	66%	0.663	S	S	*	*			trans	-115.3	104.7	145.2	-74.4	-175.3	-170.3	-158.8	-4.6	108.1	D671	D671-R674 IonicContact OD2-CZ 3.56Å; D671-R674 IonicContact OD2-NE 3.01Å; D671-R674 PolarHBondContact OD2-NE 2.84Å; D671-R674 IonicContact OD2-NH2 3.19Å
675	P	37.9	Very low	46.8	Very low	123 Å²	123	118.3 Å²	118.3	80%	0.799	70%	0.7	S	S	*	*			trans	-68.1	131.8	159.8	25.2	-22	0	0	0	108.2
676	A	38.4	Very low	44.1	Very low	175 Å²	175	122 Å²	122	100%	1.446	71%	0.714	S	S	*	*			trans	-68.1	0	-179.9	0	0	0	0	0	113.2

Retrieved 676 of 676 residues in 630.1 ms (Link to these results)

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