A0A087XVB7_POEFO Loading...

Cell division cycle 20 homolog

AlphaFold DB , UniProt , Accession A0A087XVB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 471 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.6	Low	52.9	Low	246 Å²	246	125.3 Å²	125.3	100%	1.212	65%	0.648	S	S	*	*				0	59.6	0	-63.8	169.3	170.4	0	0	110.6
2	A	51.1	Low	53.1	Low	94 Å²	94	122.6 Å²	122.6	78%	0.777	64%	0.636	S	S	*	*			trans	-110.6	-22.3	-178	0	0	0	0	0	113.7
3	Q	46.9	Very low	53.5	Low	167 Å²	167	124.2 Å²	124.2	78%	0.78	64%	0.643	S	S	*	*	H	α-helix	trans	-78.4	-34.2	-169.5	-159.4	164.4	-4.5	0	0	113.4	G5	Q3-G5 VanDerWaalsContact C-N 3.29Å; Q3-G5 PolarHBondContact O-N 2.84Å
4	F	45.3	Very low	53.5	Low	171 Å²	171	125.1 Å²	125.1	75%	0.75	65%	0.649	S	S	*	*	H	α-helix	trans	-72.8	-10.1	-179.7	-74.6	-72.6	0	0	0	115.6
5	G	50.1	Low	53.4	Low	38 Å²	38	125.9 Å²	125.9	39%	0.392	65%	0.645	S	S	.	*	H	α-helix	trans	-73.4	-46.1	174	0	0	0	0	0	111.7	Q3 E7 N8 D9	Q3-G5 VanDerWaalsContact C-N 3.29Å; Q3-G5 PolarHBondContact O-N 2.84Å; G5-E7 PolarHBondContact O-N 2.84Å; G5-N8 WeakPolarHBondContact O-CB 3.31Å; G5-N8 PolarHBondContact O-N 3.37Å; G5-N8 VanDerWaalsContact O-N 3.1Å; G5-D9 PolarHBondContact O-N 2.84Å
6	F	54.6	Low	53.3	Low	144 Å²	144	128.3 Å²	128.3	63%	0.632	66%	0.658	S	S	*	*	H	α-helix	trans	-66.2	-40.1	-168.8	-170.7	-111.3	0	0	0	113.9	N8 D9 I10	F6-N8 VanDerWaalsContact C-N 3.3Å; F6-N8 PolarHBondContact O-N 3.46Å; F6-D9 PolarHBondContact O-N 2.97Å; F6-I10 HydrophobicContact CD1-CD1 3.86Å; F6-I10 HydrophobicContact CE1-CD1 3.55Å; F6-I10 HydrophobicContact CZ-CD1 3.96Å; F6-I10 WeakPolarHBondContact O-CG1 3.46Å; F6-I10 PolarHBondContact O-N 3.29Å; F6-I10 VanDerWaalsContact O-N 3.08Å
7	E	52	Low	53.2	Low	116 Å²	116	130.2 Å²	130.2	54%	0.542	67%	0.67	S	S	.	*	H	α-helix	trans	-65.4	-35	173.8	-74.3	176.4	132.5	0	0	112.1	G5 I10 H11	G5-E7 PolarHBondContact O-N 2.84Å; E7-I10 PolarHBondContact O-N 2.92Å; E7-H11 PolarHBondContact O-CD2 2.91Å; E7-H11 PolarHBondContact O-N 2.91Å
8	N	55.2	Low	53.4	Low	103 Å²	103	130.7 Å²	130.7	55%	0.551	67%	0.671	S	S	*	*	H	α-helix	trans	-71.3	-37.7	179.1	-138.2	10.3	0	0	0	111.2	G5 F6 H11 N12	G5-N8 WeakPolarHBondContact O-CB 3.31Å; G5-N8 PolarHBondContact O-N 3.37Å; G5-N8 VanDerWaalsContact O-N 3.1Å; F6-N8 VanDerWaalsContact C-N 3.3Å; F6-N8 PolarHBondContact O-N 3.46Å; N8-H11 PolarHBondContact O-N 3.14Å; N8-N12 PolarHBondContact O-N 2.98Å; N8-N12 PolarHBondContact O-ND2 3.19Å
9	D	58.3	Low	53.4	Low	103 Å²	103	129.1 Å²	129.1	55%	0.551	67%	0.67	S	S	*	*	H	α-helix	trans	-64.8	-43.4	173.5	-69.6	-30.4	0	0	0	111.5	G5 F6 H11 N12 I13	G5-D9 PolarHBondContact O-N 2.84Å; F6-D9 PolarHBondContact O-N 2.97Å; D9-H11 PolarHBondContact O-N 3.05Å; D9-N12 PolarHBondContact O-N 3.48Å; D9-I13 WeakPolarHBondContact O-CG1 3.39Å; D9-I13 PolarHBondContact O-N 3.04Å
10	I	61.2	Low	53.4	Low	78 Å²	78	129.9 Å²	129.9	40%	0.4	67%	0.674	S	S	.	*	H	α-helix	trans	-60.5	-45.1	175.4	-72.4	170.6	0	0	0	111.5	F6 E7 N12 I13	F6-I10 HydrophobicContact CD1-CD1 3.86Å; F6-I10 HydrophobicContact CE1-CD1 3.55Å; F6-I10 HydrophobicContact CZ-CD1 3.96Å; F6-I10 WeakPolarHBondContact O-CG1 3.46Å; F6-I10 PolarHBondContact O-N 3.29Å; F6-I10 VanDerWaalsContact O-N 3.08Å; E7-I10 PolarHBondContact O-N 2.92Å; I10-N12 VanDerWaalsContact C-N 3.26Å; I10-N12 PolarHBondContact O-N 3.48Å; I10-I13 PolarHBondContact O-N 2.99Å
11	H	56.8	Low	53.2	Low	118 Å²	118	129.8 Å²	129.8	55%	0.546	68%	0.679	S	S	.	*	H	α-helix	trans	-68.5	-20.6	179.4	-79.2	-53.2	0	0	0	114.4	E7 N8 D9	E7-H11 PolarHBondContact O-CD2 2.91Å; E7-H11 PolarHBondContact O-N 2.91Å; N8-H11 PolarHBondContact O-N 3.14Å; D9-H11 PolarHBondContact O-N 3.05Å
12	N	55.7	Low	53.4	Low	93 Å²	93	125.3 Å²	125.3	50%	0.497	66%	0.66	S	S	.	*	H	α-helix	trans	-83.2	-31.2	173.9	-75.7	-52.2	0	0	0	112.9	N8 D9 I10 L14 K15	N8-N12 PolarHBondContact O-N 2.98Å; N8-N12 PolarHBondContact O-ND2 3.19Å; D9-N12 PolarHBondContact O-N 3.48Å; I10-N12 VanDerWaalsContact C-N 3.26Å; I10-N12 PolarHBondContact O-N 3.48Å; N12-L14 PolarHBondContact O-N 2.87Å; N12-K15 PolarHBondContact O-N 3.32Å
13	I	57.3	Low	53.5	Low	143 Å²	143	123.9 Å²	123.9	73%	0.733	65%	0.648	S	S	*	*	H	α-helix	trans	-63.9	-24.7	176.9	-70.9	166.1	0	0	0	112.4	D9 I10 K15	D9-I13 WeakPolarHBondContact O-CG1 3.39Å; D9-I13 PolarHBondContact O-N 3.04Å; I10-I13 PolarHBondContact O-N 2.99Å; I13-K15 VanDerWaalsContact C-N 3.35Å; I13-K15 PolarHBondContact O-N 3.26Å
14	L	54.6	Low	53.9	Low	137 Å²	137	121.7 Å²	121.7	72%	0.717	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	4.3	179.1	-79.2	162.2	0	0	0	115.1	N12	N12-L14 PolarHBondContact O-N 2.87Å
15	K	51.1	Low	54.8	Low	138 Å²	138	119 Å²	119	60%	0.6	64%	0.639	S	S	*	*			trans	-116.7	96.1	-178.6	-67	179.8	-176.6	173.3	0	111.5	N12 I13 D17	N12-K15 PolarHBondContact O-N 3.32Å; I13-K15 VanDerWaalsContact C-N 3.35Å; I13-K15 PolarHBondContact O-N 3.26Å; K15-D17 VanDerWaalsContact C-N 3.33Å; K15-D17 PolarHBondContact O-N 3.02Å
16	L	52.6	Low	55.2	Low	163 Å²	163	118.9 Å²	118.9	85%	0.853	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-21.2	-170.7	-82.4	159.7	0	0	0	115.7
17	D	51.8	Low	54.9	Low	161 Å²	161	122.8 Å²	122.8	86%	0.861	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	17	-166.3	-58.1	-56.6	0	0	0	115.8	K15	K15-D17 VanDerWaalsContact C-N 3.33Å; K15-D17 PolarHBondContact O-N 3.02Å
18	M	55.9	Low	54.9	Low	139 Å²	139	126.1 Å²	126.1	69%	0.685	65%	0.653	S	S	*	*	S	Bend	trans	-94.9	132.2	176.5	-75.2	-112.1	59.3	0	0	112.3	I20	M18-I20 PolarHBondContact O-N 3.08Å
19	P	54.3	Low	55.2	Low	101 Å²	101	125.1 Å²	125.1	66%	0.656	65%	0.646	S	S	*	*			trans	-60.9	128.7	175.3	-24.8	34.9	0	0	0	112.7	T21	P19-T21 PolarHBondContact O-N 3.42Å
20	I	52.9	Low	55.2	Low	144 Å²	144	127.5 Å²	127.5	74%	0.738	65%	0.647	S	S	*	*			trans	-74.8	93.3	-177.7	-51.2	173.5	0	0	0	110.1	M18 N22 A23	M18-I20 PolarHBondContact O-N 3.08Å; I20-N22 VanDerWaalsContact C-N 3.27Å; I20-N22 PolarHBondContact O-N 3.14Å; I20-A23 HydrophobicContact CB-CB 4.44Å; I20-A23 HydrophobicContact CG2-CB 3.92Å
21	T	48.9	Very low	54.6	Low	128 Å²	128	131.8 Å²	131.8	79%	0.785	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-13.5	-170.7	49.8	0	0	0	0	115.9	P19	P19-T21 PolarHBondContact O-N 3.42Å
22	N	54.7	Low	54	Low	153 Å²	153	129.6 Å²	129.6	82%	0.818	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	26.3	-176.4	-81.9	-48.3	0	0	0	114.3	I20	I20-N22 VanDerWaalsContact C-N 3.27Å; I20-N22 PolarHBondContact O-N 3.14Å
23	A	52.5	Low	53.7	Low	64 Å²	64	129.9 Å²	129.9	53%	0.529	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-76.7	134.1	173.5	0	0	0	0	0	112.1	I20 M25	I20-A23 HydrophobicContact CB-CB 4.44Å; I20-A23 HydrophobicContact CG2-CB 3.92Å; A23-M25 PolarHBondContact O-N 3.27Å
24	P	57	Low	53	Low	120 Å²	120	127.4 Å²	127.4	78%	0.779	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.9	177.6	26.5	-33.6	0	0	0	111.7	A26	P24-A26 PolarHBondContact O-N 2.92Å
25	M	63.3	Low	52.4	Low	114 Å²	114	124.8 Å²	124.8	56%	0.562	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-51.9	131.6	-166.4	-164.7	-174.8	-74.1	0	0	114.5	A23 Q29 R30	A23-M25 PolarHBondContact O-N 3.27Å; M25-Q29 HydrophobicContact CG-CB 4.01Å; M25-Q29 HydrophobicContact SD-CB 4.2Å; M25-R30 PolarHBondContact O-NE 2.94Å; M25-R30 PolarHBondContact O-NH2 3.3Å; M25-R30 HydrophobicContact SD-CG 4.38Å
26	A	58.9	Low	51.7	Low	37 Å²	37	126 Å²	126	31%	0.306	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-60.4	145.9	-170.2	0	0	0	0	0	112.9	P24 W28 Q29 R30	P24-A26 PolarHBondContact O-N 2.92Å; A26-W28 PolarHBondContact O-N 3.43Å; A26-Q29 PolarHBondContact O-N 2.97Å; A26-Q29 VanDerWaalsContact O-N 3.11Å; A26-R30 PolarHBondContact O-N 3.36Å
27	R	48	Very low	50.8	Low	225 Å²	225	125.6 Å²	125.6	85%	0.849	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-24	-172.7	-166.7	179.5	-177.4	-148.7	2.8	113.9
28	W	52.8	Low	49.9	Very low	186 Å²	186	124 Å²	124	71%	0.705	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-38.4	177.5	61.7	-95	0	0	0	112.9	A26 R30 K31 A32	A26-W28 PolarHBondContact O-N 3.43Å; W28-R30 PolarHBondContact O-N 3.44Å; W28-K31 WeakPolarHBondContact O-CB 3.18Å; W28-K31 PolarHBondContact O-N 3.48Å; W28-A32 PolarHBondContact O-N 3.48Å
29	Q	60.6	Low	48.7	Very low	83 Å²	83	120.8 Å²	120.8	39%	0.388	69%	0.685	S	S	.	*	G	3₁₀ helix	trans	-61.6	-44.1	175	-70.9	173.9	-53.7	0	0	111.2	M25 A26 K31 A32 S33	M25-Q29 HydrophobicContact CG-CB 4.01Å; M25-Q29 HydrophobicContact SD-CB 4.2Å; A26-Q29 PolarHBondContact O-N 2.97Å; A26-Q29 VanDerWaalsContact O-N 3.11Å; Q29-K31 PolarHBondContact O-N 3.47Å; Q29-A32 PolarHBondContact O-N 2.89Å; Q29-S33 PolarHBondContact O-N 3.46Å
30	R	58.3	Low	47.5	Very low	153 Å²	153	123.5 Å²	123.5	58%	0.577	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-60.3	-9.6	172.8	-84.7	-173.5	-80.6	166.7	-10.4	115	M25 A26 W28	M25-R30 PolarHBondContact O-NE 2.94Å; M25-R30 PolarHBondContact O-NH2 3.3Å; M25-R30 HydrophobicContact SD-CG 4.38Å; A26-R30 PolarHBondContact O-N 3.36Å; W28-R30 PolarHBondContact O-N 3.44Å
31	K	48	Very low	46.4	Very low	167 Å²	167	123.1 Å²	123.1	73%	0.726	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-102.8	-9.1	175.5	-151	-174.2	178.8	-169.2	0	113.3	W28 Q29	W28-K31 WeakPolarHBondContact O-CB 3.18Å; W28-K31 PolarHBondContact O-N 3.48Å; Q29-K31 PolarHBondContact O-N 3.47Å
32	A	45.8	Very low	45.4	Very low	73 Å²	73	122.1 Å²	122.1	60%	0.603	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-28.1	173.3	0	0	0	0	0	112.2	W28 Q29 S34	W28-A32 PolarHBondContact O-N 3.48Å; Q29-A32 PolarHBondContact O-N 2.89Å; A32-S34 VanDerWaalsContact C-N 3.27Å; A32-S34 PolarHBondContact O-N 2.91Å
33	S	48.3	Very low	44.2	Very low	99 Å²	99	122.7 Å²	122.7	69%	0.692	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	5.9	-178.7	60.3	0	0	0	0	115.1	Q29	Q29-S33 PolarHBondContact O-N 3.46Å
34	S	43.2	Very low	43	Very low	90 Å²	90	124.8 Å²	124.8	63%	0.629	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	21.4	-174.3	68.8	0	0	0	0	113.9	A32	A32-S34 VanDerWaalsContact C-N 3.27Å; A32-S34 PolarHBondContact O-N 2.91Å
35	S	42.2	Very low	42.4	Very low	82 Å²	82	125.3 Å²	125.3	57%	0.573	70%	0.702	S	S	*	*	S	Bend	trans	-154.2	72.7	-178.3	59.8	0	0	0	0	113.2
36	N	36.6	Very low	40.8	Very low	163 Å²	163	123.4 Å²	123.4	87%	0.872	71%	0.712	S	S	*	*			trans	179.2	95.8	145.9	-96.3	-12.6	0	0	0	112.4
37	T	33	Very low	39.5	Very low	156 Å²	156	131.2 Å²	131.2	96%	0.957	74%	0.739	S	S	*	*			trans	-160.9	102.2	148.9	27.4	0	0	0	0	109
38	S	31.7	Very low	38.6	Very low	126 Å²	126	125.9 Å²	125.9	88%	0.881	74%	0.736	S	S	*	*			trans	-112.9	117.3	170.8	55.9	0	0	0	0	109.4
39	G	31	Very low	37.6	Very low	73 Å²	73	121.9 Å²	121.9	75%	0.753	74%	0.743	S	S	*	*			trans	-146.8	134.7	178.7	0	0	0	0	0	111
40	L	29.8	Very low	36.2	Very low	158 Å²	158	124.6 Å²	124.6	83%	0.827	76%	0.76	S	S	*	*			trans	-76.6	168.9	177.2	-66.7	66.7	0	0	0	109
41	N	29.1	Very low	35	Very low	135 Å²	135	124.1 Å²	124.1	72%	0.722	77%	0.768	S	S	*	*			cis	-164.6	-175.5	22.3	-148.6	-11	0	0	0	113.4
42	T	29.8	Very low	34.2	Very low	107 Å²	107	120.8 Å²	120.8	66%	0.656	77%	0.765	S	S	*	*			trans	79.8	117.2	153.6	51	0	0	0	0	123.3
43	L	29.4	Very low	33.7	Very low	166 Å²	166	124.6 Å²	124.6	87%	0.869	78%	0.775	S	S	*	*			trans	80.5	156.7	131.3	-65.2	169.2	0	0	0	122
44	S	26.4	Very low	33	Very low	107 Å²	107	124 Å²	124	75%	0.748	77%	0.77	S	S	*	*			trans	-133.3	-167.4	-159.4	-12.1	0	0	0	0	110.3
45	P	44.8	Very low	32.4	Very low	131 Å²	131	125.1 Å²	125.1	85%	0.851	78%	0.779	S	S	*	*			cis	-128.2	168.8	-37.9	36.6	-21.9	0	0	0	112.5
46	G	28.9	Very low	32	Very low	75 Å²	75	125.4 Å²	125.4	77%	0.773	78%	0.781	S	S	*	*			trans	-175.8	120.4	170.8	0	0	0	0	0	120.3
47	K	32	Very low	31.9	Very low	201 Å²	201	127 Å²	127	87%	0.874	78%	0.779	S	S	*	*			trans	51.6	92.4	145.8	-63.3	-175.3	178.8	179.6	0	121.3
48	S	28.3	Very low	32	Very low	112 Å²	112	125.9 Å²	125.9	78%	0.783	77%	0.773	S	S	*	*				24.2	118.3	116.3	61.5	0	0	0	0	121
49	A	32.5	Very low	32.5	Very low	103 Å²	103	124.9 Å²	124.9	85%	0.851	76%	0.763	S	S	*	*			trans	164.1	157.8	132.8	0	0	0	0	0	111.1
50	N	30.9	Very low	33	Very low	139 Å²	139	127.6 Å²	127.6	74%	0.743	77%	0.765	S	S	*	*			cis	-168	152.4	-40.2	-158.4	4.7	0	0	0	107.6
51	I	32.8	Very low	33.1	Very low	144 Å²	144	130 Å²	130	74%	0.738	77%	0.769	S	S	*	*			trans	64.2	137.2	164.5	-63.5	154.7	0	0	0	115.6
52	S	31.8	Very low	33.6	Very low	96 Å²	96	130.3 Å²	130.3	67%	0.671	78%	0.776	S	S	*	*			cis	-163.8	-165.1	-18	59.8	0	0	0	0	107.2
53	L	35.2	Very low	33.8	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	79%	0.785	S	S	*	*			cis	-156.9	-161	7.1	-137.2	169.9	0	0	0	109
54	S	33	Very low	34	Very low	86 Å²	86	127.1 Å²	127.1	60%	0.601	78%	0.782	S	S	*	*			trans	-1.8	113.3	162.7	51.2	0	0	0	0	119.4
55	S	31.8	Very low	34.9	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	79%	0.788	S	S	*	*				91.9	153.1	64.3	81.2	0	0	0	0	113.5
56	S	33.8	Very low	34.7	Very low	88 Å²	88	133 Å²	133	62%	0.615	79%	0.788	S	S	*	*			cis	-155.9	167.7	17.2	73.7	0	0	0	0	115
57	K	33.8	Very low	35.1	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	80%	0.796	S	S	*	*			trans	70.3	88.6	152.6	-67.8	168.6	-178	174.8	0	121
58	T	35.3	Very low	35.5	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	80%	0.795	S	S	*	*				-81.2	174.8	129.3	43.7	0	0	0	0	109.3
59	P	42.8	Very low	36	Very low	104 Å²	104	139.9 Å²	139.9	68%	0.675	79%	0.793	S	S	*	*			cis	-146.3	170.7	22.9	44.6	-24.3	0	0	0	120
60	T	40	Very low	36.6	Very low	130 Å²	130	140.9 Å²	140.9	80%	0.798	79%	0.79	S	S	*	*			trans	42.5	117.4	146.6	55.3	0	0	0	0	122
61	K	33.6	Very low	37.5	Very low	208 Å²	208	139.7 Å²	139.7	90%	0.904	79%	0.793	S	S	*	*			trans	-150.7	124.4	135.8	-106.9	177	-175	177.7	0	110.4
62	T	38.4	Very low	38.3	Very low	142 Å²	142	142 Å²	142	87%	0.871	80%	0.798	S	S	*	*			trans	-96.5	144.7	169.2	43.6	0	0	0	0	110.7
63	P	35.2	Very low	39.5	Very low	129 Å²	129	146.9 Å²	146.9	84%	0.838	81%	0.812	S	S	*	*			trans	-139.8	158.6	145.8	37.4	-24.7	0	0	0	114.1
64	G	32.9	Very low	40.7	Very low	78 Å²	78	142.4 Å²	142.4	80%	0.804	80%	0.803	S	S	*	*			trans	93.9	94.7	152.3	0	0	0	0	0	118.1	N66	G64-N66 PolarHBondContact O-N 3.39Å
65	K	45	Very low	42.2	Very low	203 Å²	203	140 Å²	140	88%	0.883	79%	0.792	S	S	*	*			trans	-68.3	119.9	150.9	-72.8	179.1	177.9	176.9	0	108.6
66	N	40.7	Very low	44.1	Very low	159 Å²	159	137.8 Å²	137.8	85%	0.85	77%	0.771	S	S	*	*			trans	175.6	70.3	141.4	-92.6	-20.2	0	0	0	112.3	G64	G64-N66 PolarHBondContact O-N 3.39Å
67	K	38.5	Very low	46	Very low	214 Å²	214	140.9 Å²	140.9	93%	0.93	77%	0.769	S	S	*	*			trans	-99.4	94.2	156.2	-76.8	-171.3	176.2	-178.5	0	108.9	T69	K67-T69 PolarHBondContact O-N 3.18Å
68	K	40.3	Very low	48	Very low	199 Å²	199	139.5 Å²	139.5	87%	0.865	76%	0.764	S	S	*	*			trans	-59.5	126.5	156.9	-73.7	-178.9	176.2	178.3	0	106.8
69	T	38.6	Very low	50	Low	119 Å²	119	138.4 Å²	138.4	73%	0.73	75%	0.752	S	S	*	*			trans	-58.7	132.9	158.7	34.2	0	0	0	0	107.7	K67 S71	K67-T69 PolarHBondContact O-N 3.18Å; T69-S71 VanDerWaalsContact C-N 3.33Å; T69-S71 PolarHBondContact O-N 2.99Å
70	P	45.1	Very low	51.6	Low	124 Å²	124	135.9 Å²	135.9	81%	0.805	74%	0.735	S	S	*	*			trans	-71.3	90.1	-178.1	27.5	-33.4	0	0	0	109.9	K72	P70-K72 PolarHBondContact O-N 3.1Å
71	S	49.8	Very low	53.5	Low	113 Å²	113	132.5 Å²	132.5	79%	0.79	71%	0.714	S	S	*	*			trans	-77	53.2	-174.4	51.6	0	0	0	0	113.7	T69	T69-S71 VanDerWaalsContact C-N 3.33Å; T69-S71 PolarHBondContact O-N 2.99Å
72	K	50	Low	55.5	Low	194 Å²	194	134.1 Å²	134.1	84%	0.843	72%	0.715	S	S	*	*	S	Bend	trans	-170.9	116.2	156.6	-106.3	159.8	-173.6	-179.6	0	108.2	P70 G74	P70-K72 PolarHBondContact O-N 3.1Å; K72-G74 PolarHBondContact O-N 3.09Å
73	M	55.7	Low	57.4	Low	197 Å²	197	131.2 Å²	131.2	97%	0.97	69%	0.694	S	S	*	*			trans	-74.4	83.1	170	-170.2	166	69.8	0	0	108.3
74	G	61	Low	59.4	Low	60 Å²	60	131.3 Å²	131.3	62%	0.619	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-63.5	158.1	169.8	0	0	0	0	0	110.9	K72	K72-G74 PolarHBondContact O-N 3.09Å
75	G	64.9	Low	61.5	Low	36 Å²	36	135.5 Å²	135.5	37%	0.371	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-57.2	148.5	177.1	0	0	0	0	0	112.6	G133 G134	G75-G133 CarbonylContact C-O 2.99Å; G75-G133 VanDerWaalsContact O-O 3.14Å; G75-G134 VanDerWaalsContact O-CA 3.27Å; G75-G134 WeakPolarHBondContact O-CA 3.44Å
76	D	71.8	Confident	63.2	Low	68 Å²	68	127.5 Å²	127.5	36%	0.364	65%	0.649	S	S	.	*	B	Isolated β-bridge	trans	-98.4	135.2	174.6	-177	-6.5	0	0	0	109.9	F78 I79 G133	D76-F78 PolarHBondContact O-N 3.4Å; D76-F78 VanDerWaalsContact O-N 3.12Å; D76-F78 PolarHBondContact OD1-N 2.98Å; D76-I79 HydrophobicContact CB-CB 4.11Å; D76-I79 HydrophobicContact CB-CG1 4.42Å; D76-I79 PolarHBondContact O-N 3.4Å; D76-G133 CarbonylContact C-O 3.06Å; D76-G133 PolarHBondContact N-O 2.99Å; D76-G133 VanDerWaalsContact O-O 3.12Å
77	R	73.6	Confident	65.3	Low	153 Å²	153	124.7 Å²	124.7	58%	0.577	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-23.9	173.6	176.7	173.6	175.4	127.3	4.4	112.7	L132 G133	R77-L132 WeakPolarHBondContact O-CD1 3.21Å; R77-L132 WeakPolarHBondContact O-CD2 3.24Å; R77-G133 PolarHBondContact N-O 3.26Å
78	F	74.4	Confident	67.6	Low	165 Å²	165	119.5 Å²	119.5	72%	0.724	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-9.4	-175.4	-56.9	-75.9	0	0	0	114.6	D76	D76-F78 PolarHBondContact O-N 3.4Å; D76-F78 VanDerWaalsContact O-N 3.12Å; D76-F78 PolarHBondContact OD1-N 2.98Å
79	I	77.8	Confident	69.7	Low	112 Å²	112	110.9 Å²	110.9	57%	0.574	58%	0.579	S	S	*	*	B	Isolated β-bridge	trans	-123.1	108.2	-178.5	-55.9	177.2	0	0	0	109.2	D76	D76-I79 HydrophobicContact CB-CB 4.11Å; D76-I79 HydrophobicContact CB-CG1 4.42Å; D76-I79 PolarHBondContact O-N 3.4Å
80	P	77.6	Confident	71.9	Confident	51 Å²	51	105.5 Å²	105.5	33%	0.331	55%	0.547	S	S	.	.			trans	-55.4	141	178.2	-25	32.5	0	0	0	113.2	R82 L130 L132	P80-R82 PolarHBondContact O-N 2.97Å; P80-R82 VanDerWaalsContact O-N 3.14Å; P80-L130 HydrophobicContact CB-CD2 4.27Å; P80-L130 HydrophobicContact CG-CD1 4.34Å; P80-L130 HydrophobicContact CG-CD2 3.93Å; P80-L132 HydrophobicContact CB-CD2 4.35Å; P80-L132 HydrophobicContact CG-CD2 3.76Å
81	T	78.2	Confident	73.9	Confident	58 Å²	58	103.8 Å²	103.8	36%	0.356	53%	0.531	S	S	.	.			trans	-68.1	110.5	173.8	48.7	0	0	0	0	110.1	N83 H131	T81-N83 PolarHBondContact O-N 3.41Å; T81-N83 VanDerWaalsContact O-N 3.08Å; T81-H131 PolarHBondContact N-O 3.3Å; T81-H131 PolarHBondContact OG1-ND1 2.82Å; T81-H131 PolarHBondContact OG1-O 3.33Å
82	R	75.3	Confident	75.7	Confident	242 Å²	242	103 Å²	103	91%	0.913	51%	0.513	S	S	*	.			trans	-60.4	111.8	178.4	-87.4	-175.2	157.6	141.4	-3.2	111.5	P80	P80-R82 PolarHBondContact O-N 2.97Å; P80-R82 VanDerWaalsContact O-N 3.14Å
83	N	78.4	Confident	77.4	Confident	81 Å²	81	94.8 Å²	94.8	43%	0.433	48%	0.478	S	S	.	.			trans	-141.7	116.5	175.2	172.2	13.1	0	0	0	107.8	T81 K85 Q86 M87	T81-N83 PolarHBondContact O-N 3.41Å; T81-N83 VanDerWaalsContact O-N 3.08Å; N83-K85 VanDerWaalsContact C-N 3.3Å; N83-K85 PolarHBondContact O-N 3.32Å; N83-K85 PolarHBondContact OD1-N 3.41Å; N83-Q86 HydrophobicContact CB-CB 4.2Å; N83-Q86 WeakPolarHBondContact O-CB 3.33Å; N83-Q86 PolarHBondContact O-N 2.89Å; N83-M87 PolarHBondContact O-N 2.85Å
84	N	76.9	Confident	78.9	Confident	131 Å²	131	89.2 Å²	89.2	70%	0.701	45%	0.452	S	S	*	.	H	α-helix	trans	-58.2	-43	-175.9	-67.5	17.6	0	0	0	111.5	Q86 M87 D88	N84-Q86 PolarHBondContact O-N 3.22Å; N84-M87 WeakPolarHBondContact O-CA 3.24Å; N84-M87 WeakPolarHBondContact O-CB 3.17Å; N84-M87 PolarHBondContact O-N 3.27Å; N84-D88 PolarHBondContact O-N 3.43Å; N84-D88 VanDerWaalsContact O-N 3.14Å
85	K	77.7	Confident	80.1	Confident	167 Å²	167	90.1 Å²	90.1	73%	0.726	45%	0.445	S	S	*	.	H	α-helix	trans	-58	-24	176.9	-65.1	-168.6	175	-167.8	0	113.8	N83 V89	N83-K85 VanDerWaalsContact C-N 3.3Å; N83-K85 PolarHBondContact O-N 3.32Å; N83-K85 PolarHBondContact OD1-N 3.41Å; K85-V89 VanDerWaalsContact O-CG2 3.27Å; K85-V89 WeakPolarHBondContact O-CG2 3.3Å
86	Q	81.7	Confident	80.9	Confident	35 Å²	35	93 Å²	93	16%	0.164	45%	0.448	C	S	.	.	H	α-helix	trans	-84.8	-34.9	173.2	-177.8	170.7	14.8	0	0	112.1	N83 N84 D88 V89 A90 K128 H131	N83-Q86 HydrophobicContact CB-CB 4.2Å; N83-Q86 WeakPolarHBondContact O-CB 3.33Å; N83-Q86 PolarHBondContact O-N 2.89Å; N84-Q86 PolarHBondContact O-N 3.22Å; Q86-D88 VanDerWaalsContact C-N 3.31Å; Q86-D88 PolarHBondContact O-N 3.23Å; Q86-V89 PolarHBondContact O-N 2.91Å; Q86-A90 VanDerWaalsContact O-CB 3.26Å; Q86-A90 WeakPolarHBondContact O-CB 3.49Å; Q86-A90 PolarHBondContact O-N 3.17Å; Q86-K128 PolarHBondContact NE2-O 3.31Å; Q86-H131 VanDerWaalsContact NE2-CB 3.27Å; Q86-H131 VanDerWaalsContact OE1-CB 3.26Å
87	M	84.8	Confident	81.1	Confident	99 Å²	99	96.9 Å²	96.9	49%	0.488	46%	0.464	S	S	.	.	H	α-helix	trans	-61.6	-42.2	178.6	-163.5	64.3	60.2	0	0	111.2	N83 N84 V89 A90 N91	N83-M87 PolarHBondContact O-N 2.85Å; N84-M87 WeakPolarHBondContact O-CA 3.24Å; N84-M87 WeakPolarHBondContact O-CB 3.17Å; N84-M87 PolarHBondContact O-N 3.27Å; M87-V89 PolarHBondContact O-N 3.34Å; M87-A90 PolarHBondContact O-N 3.12Å; M87-N91 WeakPolarHBondContact O-CB 3.41Å; M87-N91 VanDerWaalsContact O-CG 3.27Å; M87-N91 PolarHBondContact O-N 2.65Å; M87-N91 PolarHBondContact O-ND2 3.28Å
88	D	85.6	Confident	81.3	Confident	106 Å²	106	96.1 Å²	96.1	57%	0.567	47%	0.471	S	S	*	.	H	α-helix	trans	-63.8	-41.8	178.8	-51.5	-36	0	0	0	111.2	N84 Q86 F92	N84-D88 PolarHBondContact O-N 3.43Å; N84-D88 VanDerWaalsContact O-N 3.14Å; Q86-D88 VanDerWaalsContact C-N 3.31Å; Q86-D88 PolarHBondContact O-N 3.23Å; D88-F92 WeakPolarHBondContact O-CB 3.44Å; D88-F92 PolarHBondContact O-N 3.31Å
89	V	85.6	Confident	81.4	Confident	17 Å²	17	94.7 Å²	94.7	10%	0.103	47%	0.467	C	S	.	.	H	α-helix	trans	-68.9	-39	175.6	174.5	0	0	0	0	112	K85 Q86 M87 F92 L93 Y122 I124 A127	K85-V89 VanDerWaalsContact O-CG2 3.27Å; K85-V89 WeakPolarHBondContact O-CG2 3.3Å; Q86-V89 PolarHBondContact O-N 2.91Å; M87-V89 PolarHBondContact O-N 3.34Å; V89-F92 PolarHBondContact O-N 2.9Å; V89-L93 HydrophobicContact CG1-CD1 4.01Å; V89-L93 HydrophobicContact CG1-CG 4.4Å; V89-L93 WeakPolarHBondContact O-CB 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.38Å; V89-L93 PolarHBondContact O-N 3Å; V89-Y122 VanDerWaalsContact CG2-OH 3.24Å; V89-Y122 WeakPolarHBondContact CG2-OH 3.44Å; V89-I124 HydrophobicContact CG1-CD1 4.32Å; V89-I124 HydrophobicContact CG1-CG1 4.04Å; V89-A127 HydrophobicContact CG1-CB 3.86Å
90	A	85.1	Confident	80.7	Confident	7 Å²	7	94.3 Å²	94.3	6%	0.058	47%	0.471	C	S	.	.	H	α-helix	trans	-63.2	-44.8	176.9	0	0	0	0	0	111.3	Q86 M87 L94 I129	Q86-A90 VanDerWaalsContact O-CB 3.26Å; Q86-A90 WeakPolarHBondContact O-CB 3.49Å; Q86-A90 PolarHBondContact O-N 3.17Å; M87-A90 PolarHBondContact O-N 3.12Å; A90-L94 WeakPolarHBondContact O-CB 3.48Å; A90-L94 VanDerWaalsContact O-CG 3.31Å; A90-L94 WeakPolarHBondContact O-CG 3.31Å; A90-L94 PolarHBondContact O-N 3.32Å; A90-L94 VanDerWaalsContact O-N 3.1Å; A90-I129 HydrophobicContact CB-CG2 3.84Å; A90-I129 VanDerWaalsContact CB-O 3.25Å; A90-I129 WeakPolarHBondContact CB-O 3.47Å
91	N	86.8	Confident	79.9	Confident	88 Å²	88	96.7 Å²	96.7	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-47.6	173.5	-69.9	-17.5	0	0	0	111.2	M87 L93 L94 T95	M87-N91 WeakPolarHBondContact O-CB 3.41Å; M87-N91 VanDerWaalsContact O-CG 3.27Å; M87-N91 PolarHBondContact O-N 2.65Å; M87-N91 PolarHBondContact O-ND2 3.28Å; N91-L93 PolarHBondContact O-N 3.16Å; N91-L94 PolarHBondContact O-N 2.85Å; N91-T95 PolarHBondContact O-N 3.48Å; N91-T95 PolarHBondContact O-OG1 3.1Å
92	F	86.8	Confident	78.7	Confident	95 Å²	95	100.7 Å²	100.7	42%	0.417	52%	0.515	S	S	.	.	H	α-helix	trans	-58.6	-43.8	178.3	170.6	-96.7	0	0	0	113.1	D88 V89 T95 K96 I124	D88-F92 WeakPolarHBondContact O-CB 3.44Å; D88-F92 PolarHBondContact O-N 3.31Å; V89-F92 PolarHBondContact O-N 2.9Å; F92-T95 WeakPolarHBondContact CA-OG1 3.49Å; F92-T95 PolarHBondContact O-N 3.36Å; F92-T95 PolarHBondContact O-OG1 3.07Å; F92-K96 HydrophobicContact CE1-CD 4.25Å; F92-K96 HydrophobicContact CZ-CB 4.48Å; F92-K96 HydrophobicContact CZ-CD 4.36Å; F92-K96 WeakPolarHBondContact O-CB 3.33Å; F92-K96 PolarHBondContact O-N 2.92Å; F92-I124 HydrophobicContact CD1-CD1 3.47Å; F92-I124 VanDerWaalsContact CD1-CD1 3.47Å; F92-I124 HydrophobicContact CD1-CG1 4.15Å; F92-I124 HydrophobicContact CE1-CD1 3.62Å; F92-I124 HydrophobicContact CE1-CG1 4.2Å; F92-I124 HydrophobicContact CE1-CG2 4.26Å; F92-I124 HydrophobicContact CG-CD1 4.39Å
93	L	86.1	Confident	77.5	Confident	23 Å²	23	93.8 Å²	93.8	12%	0.12	51%	0.509	C	S	.	.	H	α-helix	trans	-64.5	-43.4	177.9	-73.3	170.8	0	0	0	111.4	V89 N91 T95 K96 E97 I124 A127 I129	V89-L93 HydrophobicContact CG1-CD1 4.01Å; V89-L93 HydrophobicContact CG1-CG 4.4Å; V89-L93 WeakPolarHBondContact O-CB 3.27Å; V89-L93 WeakPolarHBondContact O-CG 3.38Å; V89-L93 PolarHBondContact O-N 3Å; N91-L93 PolarHBondContact O-N 3.16Å; L93-T95 PolarHBondContact O-N 2.9Å; L93-K96 PolarHBondContact O-N 3.42Å; L93-E97 PolarHBondContact O-N 2.74Å; L93-E97 VanDerWaalsContact O-N 3.07Å; L93-I124 HydrophobicContact CD2-CG1 4.47Å; L93-A127 HydrophobicContact CD1-CB 4.46Å; L93-A127 WeakPolarHBondContact CD1-O 3.48Å; L93-I129 HydrophobicContact CB-CG1 4.17Å; L93-I129 HydrophobicContact CD1-CG1 4.05Å
94	L	86.4	Confident	76.2	Confident	79 Å²	79	95.1 Å²	95.1	41%	0.414	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-37.3	175.7	-71.9	167.8	0	0	0	112.2	A90 N91 N98 I129	A90-L94 WeakPolarHBondContact O-CB 3.48Å; A90-L94 VanDerWaalsContact O-CG 3.31Å; A90-L94 WeakPolarHBondContact O-CG 3.31Å; A90-L94 PolarHBondContact O-N 3.32Å; A90-L94 VanDerWaalsContact O-N 3.1Å; N91-L94 PolarHBondContact O-N 2.85Å; L94-N98 PolarHBondContact O-ND2 2.94Å; L94-I129 HydrophobicContact CD1-CG2 4.19Å; L94-I129 HydrophobicContact CD2-CD1 4.13Å; L94-I129 HydrophobicContact CG-CD1 4.39Å; L94-I129 HydrophobicContact CG-CG2 4.3Å
95	T	85.7	Confident	75.1	Confident	79 Å²	79	95 Å²	95	49%	0.485	52%	0.523	S	S	.	.	H	α-helix	trans	-70.5	-43.7	173.1	49.1	0	0	0	0	111.8	N91 F92 L93 E97 N98 E99	N91-T95 PolarHBondContact O-N 3.48Å; N91-T95 PolarHBondContact O-OG1 3.1Å; F92-T95 WeakPolarHBondContact CA-OG1 3.49Å; F92-T95 PolarHBondContact O-N 3.36Å; F92-T95 PolarHBondContact O-OG1 3.07Å; L93-T95 PolarHBondContact O-N 2.9Å; T95-E97 PolarHBondContact O-N 3.26Å; T95-N98 PolarHBondContact O-N 3.47Å; T95-E99 PolarHBondContact O-N 3.3Å
96	K	82.8	Confident	73.9	Confident	96 Å²	96	91.2 Å²	91.2	42%	0.417	52%	0.523	S	S	.	.	H	α-helix	trans	-57.3	-34.5	178.6	-179.3	-173.1	170.3	-170.3	0	112.4	F92 L93 E125	F92-K96 HydrophobicContact CE1-CD 4.25Å; F92-K96 HydrophobicContact CZ-CB 4.48Å; F92-K96 HydrophobicContact CZ-CD 4.36Å; F92-K96 WeakPolarHBondContact O-CB 3.33Å; F92-K96 PolarHBondContact O-N 2.92Å; L93-K96 PolarHBondContact O-N 3.42Å; K96-E125 IonicContact NZ-OE1 2.74Å; K96-E125 PolarHBondContact NZ-OE1 3.3Å
97	E	76.6	Confident	72.8	Confident	151 Å²	151	94 Å²	94	71%	0.706	54%	0.538	S	S	*	.	H	α-helix	trans	-80.5	-14.8	179.2	-167.7	167.9	-155.7	0	0	113.7	L93 T95	L93-E97 PolarHBondContact O-N 2.74Å; L93-E97 VanDerWaalsContact O-N 3.07Å; T95-E97 PolarHBondContact O-N 3.26Å
98	N	76.8	Confident	72.2	Confident	137 Å²	137	92.8 Å²	92.8	73%	0.733	54%	0.54	S	S	*	.	H	α-helix	trans	-104.3	-16.4	177.5	-75.5	-81.2	0	0	0	114.1	L94 T95	L94-N98 PolarHBondContact O-ND2 2.94Å; T95-N98 PolarHBondContact O-N 3.47Å
99	E	76	Confident	71.8	Confident	135 Å²	135	91.6 Å²	91.6	63%	0.631	54%	0.536	S	S	*	.	S	Bend	trans	-64	143.9	165.4	-68.9	-61.2	156.4	0	0	110.2	T95	T95-E99 PolarHBondContact O-N 3.3Å
100	P	63.2	Low	71.3	Confident	103 Å²	103	97.7 Å²	97.7	67%	0.669	56%	0.563	S	S	*	*			trans	-60.6	145	173.2	27.9	-34.2	0	0	0	110.1	D102	P100-D102 PolarHBondContact O-N 3.3Å
101	A	61.4	Low	71	Confident	102 Å²	102	98.8 Å²	98.8	84%	0.843	57%	0.57	S	S	*	*			trans	-67.1	94	-177.1	0	0	0	0	0	111.3	A103	A101-A103 VanDerWaalsContact C-N 3.27Å; A101-A103 PolarHBondContact O-N 3.35Å
102	D	52.8	Low	70.5	Confident	142 Å²	142	98.8 Å²	98.8	76%	0.759	57%	0.568	S	S	*	*			trans	-67.2	85.7	176.8	-138	22.3	0	0	0	109	P100 N104	P100-D102 PolarHBondContact O-N 3.3Å; D102-N104 PolarHBondContact O-N 3.26Å
103	A	51.3	Low	70.3	Confident	96 Å²	96	97.7 Å²	97.7	79%	0.793	56%	0.563	S	S	*	*			trans	-74.3	63	-174.5	0	0	0	0	0	111	A101 P105	A101-A103 VanDerWaalsContact C-N 3.27Å; A101-A103 PolarHBondContact O-N 3.35Å; A103-P105 VanDerWaalsContact O-CD 3.25Å; A103-P105 WeakPolarHBondContact O-CD 3.48Å
104	N	50	Low	70.2	Confident	109 Å²	109	99.3 Å²	99.3	58%	0.583	58%	0.579	S	S	*	*			trans	-88.8	99.7	-174.9	-138.2	-38.8	0	0	0	108.8	D102 A106	D102-N104 PolarHBondContact O-N 3.26Å; N104-A106 PolarHBondContact O-N 3.06Å; N104-A106 VanDerWaalsContact O-N 3.09Å
105	P	53.5	Low	70	Confident	129 Å²	129	103 Å²	103	84%	0.838	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-1.7	-161.6	33.1	-37.3	0	0	0	114	A103 L107	A103-P105 VanDerWaalsContact O-CD 3.25Å; A103-P105 WeakPolarHBondContact O-CD 3.48Å; P105-L107 VanDerWaalsContact C-N 3.31Å; P105-L107 PolarHBondContact O-N 3Å
106	A	53.4	Low	69.8	Low	87 Å²	87	100 Å²	100	72%	0.719	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-15.1	-170.7	0	0	0	0	0	115.1	N104	N104-A106 PolarHBondContact O-N 3.06Å; N104-A106 VanDerWaalsContact O-N 3.09Å
107	L	58.4	Low	70	Confident	94 Å²	94	98.8 Å²	98.8	49%	0.492	57%	0.57	S	S	.	*	S	Bend	trans	-129.2	117.2	-176.5	-71.4	173.9	0	0	0	111.7	P105 Q112	P105-L107 VanDerWaalsContact C-N 3.31Å; P105-L107 PolarHBondContact O-N 3Å; L107-Q112 HydrophobicContact CB-CG 4.06Å; L107-Q112 PolarHBondContact O-NE2 3.01Å; L107-Q112 VanDerWaalsContact O-NE2 3.12Å
108	S	71.7	Confident	70.5	Confident	74 Å²	74	96.9 Å²	96.9	52%	0.517	57%	0.569	S	S	.	*			trans	-61.8	145.9	174.4	66.4	0	0	0	0	111.9	E110 S111 Q112	S108-E110 PolarHBondContact O-N 3.48Å; S108-E110 VanDerWaalsContact O-N 3.16Å; S108-S111 PolarHBondContact N-OG 3.34Å; S108-S111 WeakPolarHBondContact O-CA 3.26Å; S108-S111 WeakPolarHBondContact O-CB 3.25Å; S108-S111 PolarHBondContact O-N 3.32Å; S108-S111 PolarHBondContact O-OG 3.22Å; S108-S111 WeakPolarHBondContact OG-CB 3.34Å; S108-S111 PolarHBondContact OG-N 3.27Å; S108-S111 PolarHBondContact OG-OG 3.21Å; S108-Q112 PolarHBondContact O-N 3.11Å
109	V	76.8	Confident	70.9	Confident	81 Å²	81	96.3 Å²	96.3	49%	0.491	57%	0.566	S	S	.	*	H	α-helix	trans	-53.9	-37	177.2	177.9	0	0	0	0	111.8	S111 Q112 K113	V109-S111 PolarHBondContact O-N 2.84Å; V109-Q112 PolarHBondContact O-N 2.76Å; V109-K113 HydrophobicContact CG1-CD 4.1Å; V109-K113 WeakPolarHBondContact O-CG 3.46Å; V109-K113 PolarHBondContact O-N 3.15Å
110	E	75.4	Confident	71.2	Confident	145 Å²	145	93.5 Å²	93.5	68%	0.678	56%	0.555	S	S	*	*	H	α-helix	trans	-62.2	-40.1	175	-131.7	64.1	-153.2	0	0	112.5	S108 A114	S108-E110 PolarHBondContact O-N 3.48Å; S108-E110 VanDerWaalsContact O-N 3.16Å; E110-A114 PolarHBondContact O-N 2.91Å
111	S	78.2	Confident	72.1	Confident	29 Å²	29	91.7 Å²	91.7	20%	0.203	56%	0.555	C	S	.	*	H	α-helix	trans	-68.9	-41.1	174.5	70.8	0	0	0	0	112	S108 V109 K113 A114 W115	S108-S111 PolarHBondContact N-OG 3.34Å; S108-S111 WeakPolarHBondContact O-CA 3.26Å; S108-S111 WeakPolarHBondContact O-CB 3.25Å; S108-S111 PolarHBondContact O-N 3.32Å; S108-S111 PolarHBondContact O-OG 3.22Å; S108-S111 WeakPolarHBondContact OG-CB 3.34Å; S108-S111 PolarHBondContact OG-N 3.27Å; S108-S111 PolarHBondContact OG-OG 3.21Å; V109-S111 PolarHBondContact O-N 2.84Å; S111-K113 VanDerWaalsContact C-N 3.3Å; S111-K113 PolarHBondContact O-N 3.06Å; S111-A114 WeakPolarHBondContact O-CB 3.49Å; S111-A114 PolarHBondContact O-N 3.35Å; S111-W115 PolarHBondContact O-N 3.33Å
112	Q	78.4	Confident	73	Confident	88 Å²	88	91.7 Å²	91.7	41%	0.411	53%	0.534	S	S	.	.	H	α-helix	trans	-62	-38.4	176.5	-62.6	-178.8	10.5	0	0	111.6	L107 S108 V109 W115 S116	L107-Q112 HydrophobicContact CB-CG 4.06Å; L107-Q112 PolarHBondContact O-NE2 3.01Å; L107-Q112 VanDerWaalsContact O-NE2 3.12Å; S108-Q112 PolarHBondContact O-N 3.11Å; V109-Q112 PolarHBondContact O-N 2.76Å; Q112-W115 PolarHBondContact O-N 3.09Å; Q112-S116 WeakPolarHBondContact O-CB 3.27Å; Q112-S116 PolarHBondContact O-N 2.99Å
113	K	82.6	Confident	74.4	Confident	73 Å²	73	85.8 Å²	85.8	32%	0.317	50%	0.502	S	S	.	.	H	α-helix	trans	-68.9	-37.2	173.3	-73	172.8	-179.3	175.9	0	113.1	V109 S111 S116 V117 E125	V109-K113 HydrophobicContact CG1-CD 4.1Å; V109-K113 WeakPolarHBondContact O-CG 3.46Å; V109-K113 PolarHBondContact O-N 3.15Å; S111-K113 VanDerWaalsContact C-N 3.3Å; S111-K113 PolarHBondContact O-N 3.06Å; K113-S116 PolarHBondContact O-N 2.99Å; K113-S116 PolarHBondContact O-OG 3.49Å; K113-S116 VanDerWaalsContact O-OG 3.09Å; K113-V117 VanDerWaalsContact O-CG2 3.31Å; K113-V117 WeakPolarHBondContact O-CG2 3.39Å; K113-V117 PolarHBondContact O-N 2.92Å; K113-V117 VanDerWaalsContact O-N 3.1Å; K113-E125 WeakPolarHBondContact CE-OE2 3.37Å
114	A	82.4	Confident	75.9	Confident	56 Å²	56	82.2 Å²	82.2	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-48.5	171.8	0	0	0	0	0	111	E110 S111 S116 V117 T118	E110-A114 PolarHBondContact O-N 2.91Å; S111-A114 WeakPolarHBondContact O-CB 3.49Å; S111-A114 PolarHBondContact O-N 3.35Å; A114-S116 PolarHBondContact O-N 3.2Å; A114-V117 PolarHBondContact O-N 3.34Å; A114-T118 WeakPolarHBondContact O-CB 3.31Å; A114-T118 PolarHBondContact O-N 3.12Å; A114-T118 PolarHBondContact O-OG1 3.36Å; A114-T118 VanDerWaalsContact O-OG1 3.05Å
115	W	82.2	Confident	77.2	Confident	156 Å²	156	81.1 Å²	81.1	59%	0.591	46%	0.461	S	S	*	.	H	α-helix	trans	-60.5	-42.5	175.7	-77.6	110.3	0	0	0	112.8	S111 Q112 V117 T118 L119	S111-W115 PolarHBondContact O-N 3.33Å; Q112-W115 PolarHBondContact O-N 3.09Å; W115-V117 PolarHBondContact O-N 2.78Å; W115-T118 PolarHBondContact O-N 3.46Å; W115-L119 WeakPolarHBondContact O-CB 3.5Å; W115-L119 VanDerWaalsContact O-CG 3.31Å; W115-L119 WeakPolarHBondContact O-CG 3.37Å; W115-L119 PolarHBondContact O-N 2.82Å
116	S	82.2	Confident	78.6	Confident	17 Å²	17	81 Å²	81	12%	0.119	45%	0.454	C	S	.	.	H	α-helix	trans	-63.2	-42.9	179.3	77.3	0	0	0	0	111.9	Q112 K113 A114 N120 N123	Q112-S116 WeakPolarHBondContact O-CB 3.27Å; Q112-S116 PolarHBondContact O-N 2.99Å; K113-S116 PolarHBondContact O-N 2.99Å; K113-S116 PolarHBondContact O-OG 3.49Å; K113-S116 VanDerWaalsContact O-OG 3.09Å; A114-S116 PolarHBondContact O-N 3.2Å; S116-N120 WeakPolarHBondContact O-CB 3.44Å; S116-N120 PolarHBondContact O-N 2.86Å; S116-N123 PolarHBondContact OG-OD1 2.77Å
117	V	86.5	Confident	79.9	Confident	70 Å²	70	78.1 Å²	78.1	42%	0.424	43%	0.43	S	S	.	.	H	α-helix	trans	-65.3	-42.2	174.4	174	0	0	0	0	111.7	K113 A114 W115 G121 N123	K113-V117 VanDerWaalsContact O-CG2 3.31Å; K113-V117 WeakPolarHBondContact O-CG2 3.39Å; K113-V117 PolarHBondContact O-N 2.92Å; K113-V117 VanDerWaalsContact O-N 3.1Å; A114-V117 PolarHBondContact O-N 3.34Å; W115-V117 PolarHBondContact O-N 2.78Å; V117-G121 WeakPolarHBondContact O-CA 3.34Å; V117-G121 PolarHBondContact O-N 3.08Å; V117-N123 HydrophobicContact CG2-CB 3.89Å
118	T	88.4	Confident	81	Confident	111 Å²	111	81 Å²	81	68%	0.681	44%	0.438	S	S	*	.	H	α-helix	trans	-67.3	-38.5	179.5	-63.2	0	0	0	0	113	A114 W115	A114-T118 WeakPolarHBondContact O-CB 3.31Å; A114-T118 PolarHBondContact O-N 3.12Å; A114-T118 PolarHBondContact O-OG1 3.36Å; A114-T118 VanDerWaalsContact O-OG1 3.05Å; W115-T118 PolarHBondContact O-N 3.46Å
119	L	84.8	Confident	81.6	Confident	126 Å²	126	80.3 Å²	80.3	66%	0.66	43%	0.428	S	S	*	.	H	α-helix	trans	-79	-43.8	-179.2	-68.6	169.7	0	0	0	112.5	W115	W115-L119 WeakPolarHBondContact O-CB 3.5Å; W115-L119 VanDerWaalsContact O-CG 3.31Å; W115-L119 WeakPolarHBondContact O-CG 3.37Å; W115-L119 PolarHBondContact O-N 2.82Å
120	N	82.2	Confident	81.9	Confident	76 Å²	76	81.3 Å²	81.3	41%	0.406	43%	0.43	S	S	.	.	H	α-helix	trans	-102.3	-13.1	-169.7	-60.1	-17.6	0	0	0	113.7	S116 Y122	S116-N120 WeakPolarHBondContact O-CB 3.44Å; S116-N120 PolarHBondContact O-N 2.86Å; N120-Y122 VanDerWaalsContact C-N 3.26Å; N120-Y122 HydrophobicContact CB-CD1 4.27Å; N120-Y122 HydrophobicContact CB-CE1 4Å; N120-Y122 WeakPolarHBondContact O-CD1 3.08Å; N120-Y122 VanDerWaalsContact O-CE1 3.3Å; N120-Y122 WeakPolarHBondContact O-CE1 3.3Å; N120-Y122 PolarHBondContact O-N 3.06Å
121	G	82.7	Confident	82	Confident	65 Å²	65	79.2 Å²	79.2	67%	0.67	42%	0.42	S	S	*	.	S	Bend	trans	80.1	-0.9	-172.1	0	0	0	0	0	114.6	V117	V117-G121 WeakPolarHBondContact O-CA 3.34Å; V117-G121 PolarHBondContact O-N 3.08Å
122	Y	80.2	Confident	82.1	Confident	101 Å²	101	82 Å²	82	40%	0.396	43%	0.432	S	S	.	.	S	Bend	trans	-157.6	155.2	177.3	62.4	-80.4	0	0	0	109.9	V89 N120 I124 A127	V89-Y122 VanDerWaalsContact CG2-OH 3.24Å; V89-Y122 WeakPolarHBondContact CG2-OH 3.44Å; N120-Y122 VanDerWaalsContact C-N 3.26Å; N120-Y122 HydrophobicContact CB-CD1 4.27Å; N120-Y122 HydrophobicContact CB-CE1 4Å; N120-Y122 WeakPolarHBondContact O-CD1 3.08Å; N120-Y122 VanDerWaalsContact O-CE1 3.3Å; N120-Y122 WeakPolarHBondContact O-CE1 3.3Å; N120-Y122 PolarHBondContact O-N 3.06Å; Y122-I124 PolarHBondContact O-N 3.38Å; Y122-A127 HydrophobicContact CE2-CB 4.12Å
123	N	81.6	Confident	81.3	Confident	18 Å²	18	78.3 Å²	78.3	10%	0.096	42%	0.418	C	S	.	.			trans	-73.2	123.4	174.3	178.9	26.2	0	0	0	109.9	S116 V117 E125 D126	S116-N123 PolarHBondContact OG-OD1 2.77Å; V117-N123 HydrophobicContact CG2-CB 3.89Å; N123-E125 PolarHBondContact O-N 3.03Å; N123-E125 PolarHBondContact OD1-N 2.9Å; N123-D126 WeakPolarHBondContact CB-OD2 3.44Å; N123-D126 PolarHBondContact ND2-OD2 3.36Å; N123-D126 PolarHBondContact O-N 3.49Å
124	I	82.4	Confident	80.3	Confident	22 Å²	22	77.2 Å²	77.2	11%	0.113	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-70.4	-21.5	-177.4	-159	155.6	0	0	0	112.9	V89 F92 L93 Y122 D126 A127	V89-I124 HydrophobicContact CG1-CD1 4.32Å; V89-I124 HydrophobicContact CG1-CG1 4.04Å; F92-I124 HydrophobicContact CD1-CD1 3.47Å; F92-I124 VanDerWaalsContact CD1-CD1 3.47Å; F92-I124 HydrophobicContact CD1-CG1 4.15Å; F92-I124 HydrophobicContact CE1-CD1 3.62Å; F92-I124 HydrophobicContact CE1-CG1 4.2Å; F92-I124 HydrophobicContact CE1-CG2 4.26Å; F92-I124 HydrophobicContact CG-CD1 4.39Å; L93-I124 HydrophobicContact CD2-CG1 4.47Å; Y122-I124 PolarHBondContact O-N 3.38Å; I124-D126 VanDerWaalsContact C-N 3.34Å; I124-A127 VanDerWaalsContact O-CB 3.3Å; I124-A127 WeakPolarHBondContact O-CB 3.19Å; I124-A127 PolarHBondContact O-N 3.41Å
125	E	78.3	Confident	79.1	Confident	85 Å²	85	83.8 Å²	83.8	40%	0.397	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-76.3	-21.1	177.6	-50.8	-168.8	137.3	0	0	113	K96 K113 N123 A127	K96-E125 IonicContact NZ-OE1 2.74Å; K96-E125 PolarHBondContact NZ-OE1 3.3Å; K113-E125 WeakPolarHBondContact CE-OE2 3.37Å; N123-E125 PolarHBondContact O-N 3.03Å; N123-E125 PolarHBondContact OD1-N 2.9Å; E125-A127 VanDerWaalsContact C-N 3.31Å
126	D	81.4	Confident	78	Confident	127 Å²	127	80.3 Å²	80.3	68%	0.679	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-85.4	-6.5	171.9	-65	-58.8	0	0	0	112.2	N123 I124	N123-D126 WeakPolarHBondContact CB-OD2 3.44Å; N123-D126 PolarHBondContact ND2-OD2 3.36Å; N123-D126 PolarHBondContact O-N 3.49Å; I124-D126 VanDerWaalsContact C-N 3.34Å
127	A	82.3	Confident	76.9	Confident	26 Å²	26	87.5 Å²	87.5	22%	0.215	48%	0.479	C	S	.	.	S	Bend	trans	-78.7	137	179.3	0	0	0	0	0	111.4	V89 L93 Y122 I124 E125	V89-A127 HydrophobicContact CG1-CB 3.86Å; L93-A127 HydrophobicContact CD1-CB 4.46Å; L93-A127 WeakPolarHBondContact CD1-O 3.48Å; Y122-A127 HydrophobicContact CE2-CB 4.12Å; I124-A127 VanDerWaalsContact O-CB 3.3Å; I124-A127 WeakPolarHBondContact O-CB 3.19Å; I124-A127 PolarHBondContact O-N 3.41Å; E125-A127 VanDerWaalsContact C-N 3.31Å
128	K	81.4	Confident	75.6	Confident	154 Å²	154	91.4 Å²	91.4	67%	0.67	50%	0.498	S	S	*	.			trans	-95.3	127.5	-178.5	-63	-177.3	-178.6	-180	0	110.7	Q86 L130	Q86-K128 PolarHBondContact NE2-O 3.31Å; K128-L130 PolarHBondContact O-N 3.44Å; K128-L130 VanDerWaalsContact O-N 3.15Å
129	I	83.4	Confident	74.3	Confident	61 Å²	61	89.2 Å²	89.2	31%	0.313	49%	0.491	S	S	.	.	S	Bend	trans	-48.1	-43.1	175.8	-55.5	175.4	0	0	0	110.8	A90 L93 L94	A90-I129 HydrophobicContact CB-CG2 3.84Å; A90-I129 VanDerWaalsContact CB-O 3.25Å; A90-I129 WeakPolarHBondContact CB-O 3.47Å; L93-I129 HydrophobicContact CB-CG1 4.17Å; L93-I129 HydrophobicContact CD1-CG1 4.05Å; L94-I129 HydrophobicContact CD1-CG2 4.19Å; L94-I129 HydrophobicContact CD2-CD1 4.13Å; L94-I129 HydrophobicContact CG-CD1 4.39Å; L94-I129 HydrophobicContact CG-CG2 4.3Å
130	L	82.9	Confident	73.6	Confident	102 Å²	102	87.9 Å²	87.9	53%	0.534	49%	0.49	S	S	.	.			trans	-125	136.7	172.7	-62.2	177.8	0	0	0	112	P80 K128	P80-L130 HydrophobicContact CB-CD2 4.27Å; P80-L130 HydrophobicContact CG-CD1 4.34Å; P80-L130 HydrophobicContact CG-CD2 3.93Å; K128-L130 PolarHBondContact O-N 3.44Å; K128-L130 VanDerWaalsContact O-N 3.15Å
131	H	77.6	Confident	72.7	Confident	100 Å²	100	94.2 Å²	94.2	46%	0.463	52%	0.517	S	S	.	.			trans	-109.8	102.3	172.8	-177.6	-106.4	0	0	0	109.6	T81 Q86	T81-H131 PolarHBondContact N-O 3.3Å; T81-H131 PolarHBondContact OG1-ND1 2.82Å; T81-H131 PolarHBondContact OG1-O 3.33Å; Q86-H131 VanDerWaalsContact NE2-CB 3.27Å; Q86-H131 VanDerWaalsContact OE1-CB 3.26Å
132	L	79.5	Confident	71.9	Confident	87 Å²	87	94.7 Å²	94.7	46%	0.455	52%	0.522	S	S	.	.			trans	-94	95.1	178.5	-60.8	169.5	0	0	0	107.8	R77 P80	R77-L132 WeakPolarHBondContact O-CD1 3.21Å; R77-L132 WeakPolarHBondContact O-CD2 3.24Å; P80-L132 HydrophobicContact CB-CD2 4.35Å; P80-L132 HydrophobicContact CG-CD2 3.76Å
133	G	62.6	Low	71.1	Confident	12 Å²	12	97.4 Å²	97.4	12%	0.124	53%	0.533	C	S	.	.			trans	-74.8	158.2	178.5	0	0	0	0	0	112.1	G75 D76 R77	G75-G133 CarbonylContact C-O 2.99Å; G75-G133 VanDerWaalsContact O-O 3.14Å; D76-G133 CarbonylContact C-O 3.06Å; D76-G133 PolarHBondContact N-O 2.99Å; D76-G133 VanDerWaalsContact O-O 3.12Å; R77-G133 PolarHBondContact N-O 3.26Å
134	G	60.7	Low	70	Confident	49 Å²	49	104.4 Å²	104.4	51%	0.505	57%	0.565	S	S	.	*	S	Bend	trans	118.8	149.4	175.7	0	0	0	0	0	113.2	G75	G75-G134 VanDerWaalsContact O-CA 3.27Å; G75-G134 WeakPolarHBondContact O-CA 3.44Å
135	K	58.8	Low	68.6	Low	194 Å²	194	107.5 Å²	107.5	84%	0.843	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-74.1	139.6	166.9	-68.5	-171.9	177.3	-173.1	0	108	L137	K135-L137 PolarHBondContact O-N 3.1Å
136	P	59.2	Low	67.4	Low	83 Å²	83	110.8 Å²	110.8	54%	0.539	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-56.5	135.3	166.9	26.8	-33.6	0	0	0	108.5	N138	P136-N138 PolarHBondContact O-N 3.44Å
137	L	58.7	Low	66.2	Low	169 Å²	169	111.1 Å²	111.1	89%	0.885	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-62.4	129	168.1	-65.8	173.3	0	0	0	107.6	K135	K135-L137 PolarHBondContact O-N 3.1Å
138	N	58.3	Low	64.6	Low	151 Å²	151	119.4 Å²	119.4	81%	0.807	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-57	144.8	169.3	-73.7	0.7	0	0	0	108.7	P136	P136-N138 PolarHBondContact O-N 3.44Å
139	A	62.6	Low	63	Low	66 Å²	66	116.5 Å²	116.5	55%	0.545	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-56.7	141.7	172.4	0	0	0	0	0	109.8	Y143	A139-Y143 HydrophobicContact CB-CD1 3.97Å; A139-Y143 HydrophobicContact CB-CG 4.31Å
140	P	69.4	Low	61	Low	98 Å²	98	121 Å²	121	64%	0.636	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-54	144.3	176.3	-25.6	34.4	0	0	0	111.6	G142 Y143	P140-G142 PolarHBondContact O-N 3.08Å; P140-Y143 VanDerWaalsContact O-CB 3.29Å; P140-Y143 WeakPolarHBondContact O-CB 3.47Å; P140-Y143 PolarHBondContact O-N 3.25Å
141	E	63.4	Low	59.1	Low	208 Å²	208	125.9 Å²	125.9	97%	0.972	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	123.8	175	-66.8	-176.6	132	0	0	109.6
142	G	64.4	Low	57.6	Low	76 Å²	76	125.5 Å²	125.5	78%	0.784	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.1	-4	-173.1	0	0	0	0	0	116.1	P140 Q144	P140-G142 PolarHBondContact O-N 3.08Å; G142-Q144 PolarHBondContact O-N 2.9Å
143	Y	64.5	Low	56	Low	157 Å²	157	130.8 Å²	130.8	62%	0.616	70%	0.697	S	S	*	*			trans	-70.1	96.2	174.5	-175.2	-96.3	0	0	0	111.6	A139 P140 N145	A139-Y143 HydrophobicContact CB-CD1 3.97Å; A139-Y143 HydrophobicContact CB-CG 4.31Å; P140-Y143 VanDerWaalsContact O-CB 3.29Å; P140-Y143 WeakPolarHBondContact O-CB 3.47Å; P140-Y143 PolarHBondContact O-N 3.25Å; Y143-N145 HydrophobicContact CE1-CB 4.39Å
144	Q	58.9	Low	55.1	Low	165 Å²	165	135.6 Å²	135.6	77%	0.771	72%	0.724	S	S	*	*			trans	-80.7	125.7	169.6	-66.2	-172.3	-5.3	0	0	110.1	G142	G142-Q144 PolarHBondContact O-N 2.9Å
145	N	51.7	Low	54.5	Low	88 Å²	88	138.1 Å²	138.1	47%	0.471	73%	0.734	S	S	.	*			trans	-85.9	116.4	171.6	-176.1	0.3	0	0	0	109.3	Y143 L147	Y143-N145 HydrophobicContact CE1-CB 4.39Å; N145-L147 PolarHBondContact O-N 3.07Å; N145-L147 PolarHBondContact OD1-N 3.36Å
146	N	54.5	Low	53.9	Low	153 Å²	153	135.2 Å²	135.2	82%	0.818	73%	0.733	S	S	*	*	S	Bend	trans	-66.9	-14.8	-179.9	-70.8	-6	0	0	0	113.3
147	L	55.3	Low	53.3	Low	135 Å²	135	136.3 Å²	136.3	71%	0.707	74%	0.74	S	S	*	*	S	Bend	trans	-89.6	110.3	170	-62.1	175.7	0	0	0	109.6	N145 V149	N145-L147 PolarHBondContact O-N 3.07Å; N145-L147 PolarHBondContact OD1-N 3.36Å; L147-V149 PolarHBondContact O-N 3.01Å
148	K	48.3	Very low	52.9	Low	199 Å²	199	132.7 Å²	132.7	87%	0.865	73%	0.734	S	S	*	*			trans	-64.8	90.7	173.2	-70.8	-178.5	178.7	177.6	0	110.2	L150	K148-L150 PolarHBondContact O-N 3.31Å
149	V	47.8	Very low	52.4	Low	94 Å²	94	131.1 Å²	131.1	57%	0.57	74%	0.735	S	S	*	*			trans	-73.4	111.7	174.1	-172.3	0	0	0	0	109.2	L147 Y151	L147-V149 PolarHBondContact O-N 3.01Å; V149-Y151 VanDerWaalsContact C-N 3.3Å; V149-Y151 HydrophobicContact CG1-CD2 3.46Å; V149-Y151 VanDerWaalsContact CG1-CD2 3.46Å; V149-Y151 HydrophobicContact CG1-CE2 3.7Å; V149-Y151 PolarHBondContact O-N 3.36Å
150	L	42.9	Very low	51.8	Low	155 Å²	155	135.1 Å²	135.1	81%	0.812	75%	0.746	S	S	*	*			trans	-73	81.6	174.4	-77	88.7	0	0	0	111	K148	K148-L150 PolarHBondContact O-N 3.31Å
151	Y	42.2	Very low	50.9	Low	205 Å²	205	140.2 Å²	140.2	80%	0.804	76%	0.758	S	S	*	*			trans	-115.9	72.7	156.4	-74.4	-62.5	0	0	0	109.9	V149	V149-Y151 VanDerWaalsContact C-N 3.3Å; V149-Y151 HydrophobicContact CG1-CD2 3.46Å; V149-Y151 VanDerWaalsContact CG1-CD2 3.46Å; V149-Y151 HydrophobicContact CG1-CE2 3.7Å; V149-Y151 PolarHBondContact O-N 3.36Å
152	S	46.1	Very low	50.5	Low	92 Å²	92	140 Å²	140	64%	0.643	75%	0.754	S	S	*	*			trans	-60.7	133.2	153.9	43.3	0	0	0	0	108.5	V154	S152-V154 VanDerWaalsContact C-N 3.26Å; S152-V154 PolarHBondContact O-N 2.98Å
153	Q	46.5	Very low	50.6	Low	198 Å²	198	142.7 Å²	142.7	93%	0.925	76%	0.755	S	S	*	*			trans	-72.9	88.4	168.7	-70.4	-176.1	-10.3	0	0	108	S155	Q153-S155 PolarHBondContact O-N 2.82Å
154	V	42	Very low	51.6	Low	113 Å²	113	137.8 Å²	137.8	69%	0.685	74%	0.736	S	S	*	*			trans	-62.6	120.1	172.2	-177.1	0	0	0	0	107.5	S152 T156	S152-V154 VanDerWaalsContact C-N 3.26Å; S152-V154 PolarHBondContact O-N 2.98Å; V154-T156 PolarHBondContact O-N 3.22Å
155	S	48.6	Very low	52.8	Low	102 Å²	102	139.1 Å²	139.1	71%	0.713	74%	0.735	S	S	*	*			trans	-59.2	131.8	172.9	48.4	0	0	0	0	109	Q153 P157	Q153-S155 PolarHBondContact O-N 2.82Å; S155-P157 WeakPolarHBondContact O-CD 3.45Å
156	T	47.2	Very low	54.7	Low	133 Å²	133	136.2 Å²	136.2	82%	0.816	72%	0.72	S	S	*	*			trans	-56.1	114.3	-179.9	47	0	0	0	0	109.4	V154 A158	V154-T156 PolarHBondContact O-N 3.22Å; T156-A158 PolarHBondContact O-N 3.09Å
157	P	45.6	Very low	56.4	Low	106 Å²	106	130.2 Å²	130.2	69%	0.688	69%	0.689	S	S	*	*			trans	-60	139.6	-179.9	-23.7	35.1	0	0	0	109.6	S155 S159	S155-P157 WeakPolarHBondContact O-CD 3.45Å; P157-S159 PolarHBondContact O-N 2.94Å
158	A	50.8	Low	58	Low	92 Å²	92	127.5 Å²	127.5	76%	0.76	68%	0.682	S	S	*	*			trans	-52.8	140.5	170.3	0	0	0	0	0	109.2	T156 L160	T156-A158 PolarHBondContact O-N 3.09Å; A158-L160 VanDerWaalsContact C-N 3.29Å; A158-L160 PolarHBondContact O-N 2.88Å
159	S	48.3	Very low	60.1	Low	119 Å²	119	122 Å²	122	83%	0.832	67%	0.665	S	S	*	*			trans	-64.7	85.8	-171.3	-172.8	0	0	0	0	111.9	P157 K161	P157-S159 PolarHBondContact O-N 2.94Å; S159-K161 PolarHBondContact O-N 2.91Å
160	L	49.8	Very low	62.4	Low	150 Å²	150	119 Å²	119	79%	0.785	65%	0.647	S	S	*	*			trans	-50.4	125.7	162	-70.7	172.5	0	0	0	106.9	A158 K162	A158-L160 VanDerWaalsContact C-N 3.29Å; A158-L160 PolarHBondContact O-N 2.88Å; L160-K162 PolarHBondContact O-N 3.02Å
161	K	50.3	Low	64.9	Low	205 Å²	205	115.4 Å²	115.4	89%	0.891	63%	0.629	S	S	*	*			trans	-54.8	104.6	179.4	-67.5	178.1	-178.7	175.5	0	107.9	S159 T163	S159-K161 PolarHBondContact O-N 2.91Å; K161-T163 PolarHBondContact O-N 2.84Å
162	K	55.1	Low	67.4	Low	203 Å²	203	110.6 Å²	110.6	88%	0.883	61%	0.612	S	S	*	*			trans	-57.1	105	-178.7	-77.2	-171.3	175.2	-175.6	0	109	L160	L160-K162 PolarHBondContact O-N 3.02Å
163	T	67.2	Low	69.9	Low	132 Å²	132	110.4 Å²	110.4	81%	0.81	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-53.7	144	152.9	42	0	0	0	0	107.3	K161	K161-T163 PolarHBondContact O-N 2.84Å
164	R	83.9	Confident	72.4	Confident	55 Å²	55	102.8 Å²	102.8	21%	0.208	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-63.2	144.2	176.6	76.7	177.9	-172.9	-88.4	2.2	108.5	I166 Y383 E385 S444 F445	R164-I166 HydrophobicContact CG-CD1 4.34Å; R164-I166 HydrophobicContact CG-CG1 3.92Å; R164-Y383 VanDerWaalsContact NH1-CG 3.32Å; R164-E385 IonicContact CZ-OE2 2.7Å; R164-E385 VanDerWaalsContact NH1-CD 3.3Å; R164-E385 IonicContact NH1-OE1 2.73Å; R164-E385 PolarHBondContact NH1-OE1 2.92Å; R164-E385 VanDerWaalsContact NH1-OE1 3.08Å; R164-E385 IonicContact NH1-OE2 2.83Å; R164-E385 PolarHBondContact NH1-OE2 2.97Å; R164-E385 IonicContact NH2-OE2 3.63Å; R164-E385 PolarHBondContact NH2-OE2 2.89Å; R164-S444 VanDerWaalsContact CZ-O 3.31Å; R164-S444 PolarHBondContact NE-O 2.76Å; R164-S444 PolarHBondContact NH2-O 2.61Å; R164-F445 VanDerWaalsContact NH2-CD1 3.27Å; R164-F445 VanDerWaalsContact NH2-CE1 3.25Å
165	Y	85.7	Confident	75	Confident	193 Å²	193	104 Å²	104	76%	0.757	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-64.2	139.7	166.1	-179.7	-107.1	0	0	0	108.8
166	I	90.1	Very high	77.4	Confident	27 Å²	27	99.1 Å²	99.1	14%	0.138	54%	0.537	C	S	.	.			trans	-131.1	124.6	172.3	-61	178.2	0	0	0	104.6	R164 S168 I399 V408 L411	R164-I166 HydrophobicContact CG-CD1 4.34Å; R164-I166 HydrophobicContact CG-CG1 3.92Å; I166-S168 PolarHBondContact O-N 2.81Å; I166-I399 HydrophobicContact CD1-CD1 4.22Å; I166-I399 HydrophobicContact CG2-CD1 4.23Å; I166-V408 HydrophobicContact CD1-CG1 4.04Å; I166-L411 HydrophobicContact CG2-CD2 3.9Å
167	S	90	Very high	79.7	Confident	26 Å²	26	96.6 Å²	96.6	18%	0.182	52%	0.523	C	S	.	.			trans	-66.3	132.3	175.7	-175.7	0	0	0	0	110.1	T169 L411	S167-T169 VanDerWaalsContact C-N 3.3Å; S167-T169 WeakPolarHBondContact CB-O 3.46Å; S167-T169 PolarHBondContact OG-N 3.18Å; S167-T169 PolarHBondContact OG-O 3.31Å; S167-T169 PolarHBondContact OG-OG1 2.72Å; S167-L411 WeakPolarHBondContact O-CD2 3.25Å
168	S	88.8	Confident	82	Confident	78 Å²	78	93.4 Å²	93.4	55%	0.545	51%	0.509	S	S	.	.	S	Bend	trans	-80.5	-13.6	171.2	56.1	0	0	0	0	112.8	I166	I166-S168 PolarHBondContact O-N 2.81Å
169	T	92.8	Very high	84.2	Confident	85 Å²	85	89.3 Å²	89.3	52%	0.521	48%	0.475	S	S	.	.	S	Bend	trans	-108.2	151.1	175.1	54.7	0	0	0	0	110.5	S167	S167-T169 VanDerWaalsContact C-N 3.3Å; S167-T169 WeakPolarHBondContact CB-O 3.46Å; S167-T169 PolarHBondContact OG-N 3.18Å; S167-T169 PolarHBondContact OG-O 3.31Å; S167-T169 PolarHBondContact OG-OG1 2.72Å
170	P	96.3	Very high	86.6	Confident	30 Å²	30	88.1 Å²	88.1	20%	0.195	45%	0.452	C	S	.	.			trans	-66.8	155	171.3	30.8	-35.3	0	0	0	111.1	I173 R440 L441 W442	P170-I173 HydrophobicContact CB-CG1 4.34Å; P170-I173 HydrophobicContact CG-CD1 3.87Å; P170-I173 HydrophobicContact CG-CG1 3.66Å; P170-R440 HydrophobicContact CB-CB 4.11Å; P170-L441 CarbonylContact C-O 3.54Å; P170-L441 WeakPolarHBondContact CA-O 3.35Å; P170-W442 HydrophobicContact CB-CD2 4.19Å; P170-W442 HydrophobicContact CB-CE3 4.04Å; P170-W442 HydrophobicContact CB-CH2 4.47Å; P170-W442 HydrophobicContact CB-CZ3 4.19Å; P170-W442 HydrophobicContact CG-CH2 4.46Å; P170-W442 HydrophobicContact CG-CZ3 4.38Å
171	D	95.1	Very high	88.8	Confident	79 Å²	79	84.7 Å²	84.7	42%	0.422	43%	0.434	S	S	.	.	S	Bend	trans	-77.8	-35	173.1	178.9	85	0	0	0	111.6	L441 K443	D171-L441 PolarHBondContact N-O 2.78Å; D171-K443 HydrophobicContact CB-CD 4.01Å; D171-K443 HydrophobicContact CB-CG 4.05Å; D171-K443 WeakPolarHBondContact OD1-CD 3.33Å; D171-K443 VanDerWaalsContact OD1-CE 3.31Å; D171-K443 WeakPolarHBondContact OD1-CE 3.34Å; D171-K443 IonicContact OD1-NZ 3.43Å; D171-K443 PolarHBondContact OD1-NZ 3.45Å; D171-K443 WeakPolarHBondContact OD2-CE 3.44Å; D171-K443 IonicContact OD2-NZ 3.35Å; D171-K443 PolarHBondContact OD2-NZ 2.94Å
172	K	96.3	Very high	91	Very high	105 Å²	105	76.7 Å²	76.7	46%	0.457	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.1	175.1	-68.2	175.7	-176.8	-68.7	0	109.9	W207 L441	K172-W207 HydrophobicContact CD-CH2 4.08Å; K172-W207 HydrophobicContact CD-CZ2 4.35Å; K172-L441 HydrophobicContact CB-CB 4.16Å; K172-L441 HydrophobicContact CB-CD1 3.81Å; K172-L441 HydrophobicContact CD-CD1 4.26Å; K172-L441 PolarHBondContact O-N 3.09Å
173	I	97.7	Very high	92.9	Very high	87 Å²	87	67.9 Å²	67.9	45%	0.446	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.1	166.2	-52.9	-176.7	0	0	0	106	P170 T438 I439 R440	P170-I173 HydrophobicContact CB-CG1 4.34Å; P170-I173 HydrophobicContact CG-CD1 3.87Å; P170-I173 HydrophobicContact CG-CG1 3.66Å; I173-T438 HydrophobicContact CG2-CG2 4.12Å; I173-I439 CarbonylContact C-O 3.55Å; I173-I439 WeakPolarHBondContact CA-O 3.29Å; I173-R440 HydrophobicContact CG1-CG 4.21Å; I173-R440 HydrophobicContact CG2-CG 4.2Å
174	L	98.1	Very high	94.3	Very high	38 Å²	38	66.4 Å²	66.4	20%	0.199	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.3	173.9	-45.7	171.3	0	0	0	108	W207 T438 I439 L441	L174-W207 HydrophobicContact CD1-CD2 3.65Å; L174-W207 HydrophobicContact CD1-CE3 3.6Å; L174-W207 HydrophobicContact CD1-CG 4.27Å; L174-W207 HydrophobicContact CD1-CH2 4.09Å; L174-W207 HydrophobicContact CD1-CZ2 4.16Å; L174-W207 HydrophobicContact CD1-CZ3 3.82Å; L174-W207 HydrophobicContact CD2-CH2 4.36Å; L174-W207 HydrophobicContact CD2-CZ2 3.92Å; L174-T438 WeakPolarHBondContact O-CA 3.4Å; L174-I439 HydrophobicContact CB-CB 4.22Å; L174-I439 HydrophobicContact CD1-CD1 4.47Å; L174-I439 PolarHBondContact N-O 3.49Å; L174-I439 PolarHBondContact O-N 2.68Å; L174-L441 HydrophobicContact CD1-CD1 4.14Å; L174-L441 HydrophobicContact CG-CD1 4.36Å
175	D	97.9	Very high	94.9	Very high	138 Å²	138	63.8 Å²	63.8	74%	0.738	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	139.7	176.1	-55.9	-34.7	0	0	0	110.4
176	A	97.6	Very high	95.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.			trans	-127.1	61	177.3	0	0	0	0	0	110.4	G178 L179 L200 V433 E437 I439	A176-G178 PolarHBondContact O-N 3.26Å; A176-L179 HydrophobicContact CB-CB 4.37Å; A176-L179 VanDerWaalsContact O-CB 3.3Å; A176-L179 WeakPolarHBondContact O-CB 3.36Å; A176-L179 PolarHBondContact O-N 3.48Å; A176-L200 HydrophobicContact CB-CD2 3.72Å; A176-V433 HydrophobicContact CB-CG2 4.34Å; A176-E437 CarbonylContact C-O 3.57Å; A176-E437 WeakPolarHBondContact CA-O 3.42Å; A176-E437 PolarHBondContact N-O 2.84Å; A176-E437 WeakPolarHBondContact O-CB 3.43Å; A176-I439 HydrophobicContact CB-CD1 4.45Å; A176-I439 HydrophobicContact CB-CG1 4.08Å
177	P	97.4	Very high	95.9	Very high	80 Å²	80	55.7 Å²	55.7	52%	0.519	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	136	-174	26.1	-35.7	0	0	0	111.9	L179 L200 E437	P177-L179 VanDerWaalsContact C-N 3.27Å; P177-L179 PolarHBondContact O-N 3.25Å; P177-L200 HydrophobicContact CG-CD1 4.24Å; P177-E437 VanDerWaalsContact CA-OE2 3.3Å; P177-E437 WeakPolarHBondContact CA-OE2 3.34Å
178	G	93.6	Very high	96.3	Very high	39 Å²	39	54.8 Å²	54.8	40%	0.402	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	16	-179.3	0	0	0	0	0	114.8	A176 R180 D201 E437	A176-G178 PolarHBondContact O-N 3.26Å; G178-R180 PolarHBondContact O-N 3.12Å; G178-R180 VanDerWaalsContact O-N 3.15Å; G178-D201 PolarHBondContact O-N 3.02Å; G178-E437 PolarHBondContact N-OE2 2.9Å
179	L	97.2	Very high	96.7	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.037	28%	0.279	C	S	.	.			trans	-57.6	118.4	173.9	-176.6	88.4	0	0	0	111	A176 P177 N181 L187 V198 L200 L419 V433 A434 E437	A176-L179 HydrophobicContact CB-CB 4.37Å; A176-L179 VanDerWaalsContact O-CB 3.3Å; A176-L179 WeakPolarHBondContact O-CB 3.36Å; A176-L179 PolarHBondContact O-N 3.48Å; P177-L179 VanDerWaalsContact C-N 3.27Å; P177-L179 PolarHBondContact O-N 3.25Å; L179-N181 PolarHBondContact O-N 2.93Å; L179-L187 HydrophobicContact CD1-CB 4.2Å; L179-L187 HydrophobicContact CD1-CD1 3.96Å; L179-L187 HydrophobicContact CG-CD1 4.24Å; L179-V198 HydrophobicContact CD1-CG2 4.23Å; L179-L200 HydrophobicContact CB-CD2 4.19Å; L179-L200 HydrophobicContact CD1-CD2 4.08Å; L179-L419 HydrophobicContact CD2-CD1 3.85Å; L179-V433 HydrophobicContact CD1-CG2 3.82Å; L179-V433 HydrophobicContact CD2-CG2 3.56Å; L179-V433 HydrophobicContact CG-CG2 4.32Å; L179-A434 WeakPolarHBondContact CD2-O 3.48Å; L179-E437 HydrophobicContact CB-CG 4.46Å
180	R	97.2	Very high	97	Very high	93 Å²	93	49.6 Å²	49.6	35%	0.351	26%	0.258	S	S	.	.			trans	-67.2	111.6	-177.2	-63.3	-170.4	77.7	106.1	-3.2	111.4	G178 D182 L185 L187 D201 Y226	G178-R180 PolarHBondContact O-N 3.12Å; G178-R180 VanDerWaalsContact O-N 3.15Å; R180-D182 PolarHBondContact O-N 3.23Å; R180-L185 HydrophobicContact CB-CD1 4.44Å; R180-L187 HydrophobicContact CB-CD1 4.34Å; R180-L187 WeakPolarHBondContact O-CD1 3.42Å; R180-D201 VanDerWaalsContact CD-OD1 3.24Å; R180-D201 WeakPolarHBondContact CD-OD1 3.44Å; R180-D201 HydrophobicContact CG-CB 4.38Å; R180-D201 IonicContact CZ-OD1 3.68Å; R180-D201 IonicContact NE-OD1 3.58Å; R180-D201 IonicContact NH1-OD1 3.16Å; R180-D201 PolarHBondContact NH1-OD1 3.11Å; R180-Y226 VanDerWaalsContact CD-CD2 3.48Å
181	N	96.3	Very high	97.1	Very high	78 Å²	78	48.2 Å²	48.2	42%	0.417	25%	0.249	S	C	.	.			trans	-75.7	62.6	-179.8	-161.3	-4.6	0	0	0	112.6	L179 R417	L179-N181 PolarHBondContact O-N 2.93Å; N181-R417 PolarHBondContact O-NH2 3.45Å; N181-R417 PolarHBondContact OD1-NE 2.63Å; N181-R417 PolarHBondContact OD1-NH1 2.89Å; N181-R417 PolarHBondContact OD1-NH2 3.47Å
182	D	96.1	Very high	97.2	Very high	38 Å²	38	47.5 Å²	47.5	20%	0.203	25%	0.25	C	S	.	.			trans	-114.8	128.1	173.4	-178.8	-18.8	0	0	0	109	R180 Y184 L185 R268	R180-D182 PolarHBondContact O-N 3.23Å; D182-Y184 VanDerWaalsContact C-N 3.31Å; D182-Y184 PolarHBondContact O-N 3.21Å; D182-Y184 WeakPolarHBondContact OD1-CD2 3.38Å; D182-Y184 PolarHBondContact OD1-N 2.95Å; D182-L185 HydrophobicContact CB-CD1 3.87Å; D182-L185 HydrophobicContact CB-CG 3.88Å; D182-R268 IonicContact OD1-NH2 3.97Å; D182-R268 IonicContact OD2-CZ 2.79Å; D182-R268 IonicContact OD2-NH1 3.47Å; D182-R268 PolarHBondContact OD2-NH1 2.91Å; D182-R268 IonicContact OD2-NH2 3.87Å; D182-R268 PolarHBondContact OD2-NH2 3.02Å
183	F	95.4	Very high	97.2	Very high	18 Å²	18	47.7 Å²	47.7	8%	0.079	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-39.1	-180	177.9	-103.9	0	0	0	112.3	L185 A329 K331 Q373	F183-L185 VanDerWaalsContact C-N 3.29Å; F183-L185 PolarHBondContact O-N 3.41Å; F183-A329 HydrophobicContact CE1-CB 4.42Å; F183-K331 HydrophobicContact CD1-CD 4.23Å; F183-K331 HydrophobicContact CD2-CD 4.23Å; F183-K331 HydrophobicContact CE1-CB 3.69Å; F183-K331 HydrophobicContact CE1-CD 4Å; F183-K331 HydrophobicContact CE2-CD 4.02Å; F183-K331 HydrophobicContact CG-CD 4.35Å; F183-K331 HydrophobicContact CZ-CB 3.73Å; F183-K331 HydrophobicContact CZ-CD 3.9Å; F183-K331 WeakPolarHBondContact O-CD 3.4Å; F183-K331 WeakPolarHBondContact O-CE 3.38Å; F183-K331 PolarHBondContact O-NZ 3.19Å; F183-Q373 VanDerWaalsContact CD2-NE2 3.3Å
184	Y	96.4	Very high	97.2	Very high	100 Å²	100	45.6 Å²	45.6	39%	0.392	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.9	-166.5	-63.8	-81.8	0	0	0	114.3	D182 A329	D182-Y184 VanDerWaalsContact C-N 3.31Å; D182-Y184 PolarHBondContact O-N 3.21Å; D182-Y184 WeakPolarHBondContact OD1-CD2 3.38Å; D182-Y184 PolarHBondContact OD1-N 2.95Å; Y184-A329 HydrophobicContact CE1-CB 3.87Å
185	L	97.4	Very high	97.2	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.237	C	C	.	.			trans	-88.8	149	-174.9	-53.3	-174.3	0	0	0	112.4	R180 D182 F183 L187 Y226 C228 K331	R180-L185 HydrophobicContact CB-CD1 4.44Å; D182-L185 HydrophobicContact CB-CD1 3.87Å; D182-L185 HydrophobicContact CB-CG 3.88Å; F183-L185 VanDerWaalsContact C-N 3.29Å; F183-L185 PolarHBondContact O-N 3.41Å; L185-L187 HydrophobicContact CB-CD1 4.28Å; L185-L187 HydrophobicContact CB-CD2 3.73Å; L185-L187 HydrophobicContact CB-CG 3.78Å; L185-L187 HydrophobicContact CD1-CD2 4.13Å; L185-Y226 HydrophobicContact CD1-CD2 4.2Å; L185-Y226 HydrophobicContact CD1-CE2 3.9Å; L185-C228 WeakPolarHBondContact CA-O 3.41Å; L185-C228 WeakPolarHBondContact CB-O 3.1Å; L185-C228 HydrophobicContact CD2-CB 3.84Å; L185-K331 PolarHBondContact O-NZ 3.31Å
186	N	97.8	Very high	97.2	Very high	44 Å²	44	38.7 Å²	38.7	24%	0.235	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-113.1	75.2	-179.2	-68	-60.8	0	0	0	110.1	L188 C228 S229 L230 S270 K331	N186-L188 PolarHBondContact O-N 3.39Å; N186-C228 PolarHBondContact N-O 3.33Å; N186-S229 CarbonylContact O-C 3.53Å; N186-S229 WeakPolarHBondContact O-CA 3.38Å; N186-L230 PolarHBondContact O-N 2.96Å; N186-S270 PolarHBondContact ND2-O 3.04Å; N186-K331 PolarHBondContact OD1-NZ 2.79Å
187	L	98.2	Very high	97.3	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.031	20%	0.202	C	C	.	.			trans	-86.7	7.2	-163.8	-57.5	178.4	0	0	0	115.6	L179 R180 L185 V198 A199 I227	L179-L187 HydrophobicContact CD1-CB 4.2Å; L179-L187 HydrophobicContact CD1-CD1 3.96Å; L179-L187 HydrophobicContact CG-CD1 4.24Å; R180-L187 HydrophobicContact CB-CD1 4.34Å; R180-L187 WeakPolarHBondContact O-CD1 3.42Å; L185-L187 HydrophobicContact CB-CD1 4.28Å; L185-L187 HydrophobicContact CB-CD2 3.73Å; L185-L187 HydrophobicContact CB-CG 3.78Å; L185-L187 HydrophobicContact CD1-CD2 4.13Å; L187-V198 WeakPolarHBondContact O-CA 3.29Å; L187-A199 HydrophobicContact CB-CB 4.06Å; L187-A199 HydrophobicContact CD2-CB 3.72Å; L187-A199 HydrophobicContact CG-CB 4.47Å; L187-A199 PolarHBondContact O-N 3.38Å; L187-I227 WeakPolarHBondContact CD2-O 3.34Å
188	L	98.4	Very high	97.3	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.031	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	129.7	-174.2	-178	79.5	0	0	0	110.2	N186 I196 A197 V198 V422 A431 V433 I439	N186-L188 PolarHBondContact O-N 3.39Å; L188-I196 HydrophobicContact CD1-CG2 3.52Å; L188-A197 WeakPolarHBondContact CA-O 3.42Å; L188-V198 HydrophobicContact CD1-CB 4.23Å; L188-V198 HydrophobicContact CD1-CG2 4.44Å; L188-V422 HydrophobicContact CD2-CG2 3.84Å; L188-V422 HydrophobicContact CG-CG2 4.09Å; L188-A431 HydrophobicContact CD2-CB 4.29Å; L188-V433 HydrophobicContact CB-CG1 3.83Å; L188-V433 HydrophobicContact CD2-CB 4.05Å; L188-V433 HydrophobicContact CD2-CG1 3.94Å; L188-V433 HydrophobicContact CG-CG1 4.38Å; L188-I439 HydrophobicContact CD1-CD1 4.32Å
189	D	98.6	Very high	97.6	Very high	34 Å²	34	33.7 Å²	33.7	18%	0.182	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	150.4	169	-164.9	16.9	0	0	0	112.5	A197 L230 S231 W232	D189-A197 PolarHBondContact N-O 3.25Å; D189-A197 PolarHBondContact O-N 3.17Å; D189-L230 HydrophobicContact CB-CB 4.5Å; D189-S231 VanDerWaalsContact OD2-CA 3.29Å; D189-S231 WeakPolarHBondContact OD2-CA 3.08Å; D189-W232 PolarHBondContact O-NE1 2.56Å; D189-W232 PolarHBondContact OD2-N 2.85Å
190	W	98.5	Very high	97.6	Very high	21 Å²	21	34.1 Å²	34.1	8%	0.08	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.4	-174.4	-156.9	-19	0	0	0	110.8	N194 I196 A209 V422 T429 A431 L441	W190-N194 VanDerWaalsContact NE1-C 3.29Å; W190-N194 PolarHBondContact NE1-O 3.43Å; W190-N194 PolarHBondContact NE1-OD1 3.24Å; W190-I196 HydrophobicContact CB-CG1 4.38Å; W190-I196 HydrophobicContact CD2-CD1 3.88Å; W190-I196 HydrophobicContact CD2-CG1 3.62Å; W190-I196 HydrophobicContact CE3-CD1 4.04Å; W190-I196 HydrophobicContact CE3-CG1 4.27Å; W190-I196 HydrophobicContact CG-CD1 4.42Å; W190-I196 HydrophobicContact CG-CG1 3.67Å; W190-I196 HydrophobicContact CH2-CD1 4.25Å; W190-I196 HydrophobicContact CZ2-CD1 4.09Å; W190-I196 HydrophobicContact CZ2-CG1 4.26Å; W190-I196 HydrophobicContact CZ3-CD1 4.23Å; W190-A209 HydrophobicContact CZ2-CB 3.69Å; W190-V422 HydrophobicContact CB-CB 4.48Å; W190-V422 HydrophobicContact CB-CG2 3.89Å; W190-V422 HydrophobicContact CE3-CG2 4.34Å; W190-T429 HydrophobicContact CH2-CG2 3.99Å; W190-T429 HydrophobicContact CZ3-CG2 4.24Å; W190-A431 HydrophobicContact CE3-CB 3.78Å; W190-A431 HydrophobicContact CZ3-CB 3.7Å; W190-L441 HydrophobicContact CH2-CD2 3.48Å; W190-L441 VanDerWaalsContact CH2-CD2 3.48Å; W190-L441 HydrophobicContact CZ2-CD2 4.43Å; W190-L441 HydrophobicContact CZ3-CD2 3.67Å
191	S	98.1	Very high	97.6	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	16%	0.159	C	C	.	.			trans	-66.4	152.6	179.3	65.4	0	0	0	0	112.4	R193 N194 V195 W232 P425	S191-R193 PolarHBondContact O-N 2.91Å; S191-R193 VanDerWaalsContact O-N 3.09Å; S191-R193 PolarHBondContact OG-N 3.4Å; S191-N194 PolarHBondContact O-N 3.42Å; S191-V195 WeakPolarHBondContact CB-O 3.01Å; S191-V195 PolarHBondContact N-O 2.92Å; S191-V195 WeakPolarHBondContact OG-CA 3.19Å; S191-V195 WeakPolarHBondContact OG-CB 3.45Å; S191-V195 PolarHBondContact OG-N 2.94Å; S191-V195 PolarHBondContact OG-O 3.06Å; S191-W232 VanDerWaalsContact N-CD1 3.29Å; S191-P425 WeakPolarHBondContact O-CG 3.38Å
192	S	97	Very high	97.7	Very high	64 Å²	64	28.9 Å²	28.9	45%	0.448	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.4	167.3	49.2	0	0	0	0	113.8	N194 K234 G236	S192-N194 VanDerWaalsContact C-N 3.27Å; S192-N194 PolarHBondContact O-N 2.82Å; S192-K234 WeakPolarHBondContact CB-O 3.34Å; S192-K234 PolarHBondContact OG-O 2.95Å; S192-G236 PolarHBondContact OG-N 2.73Å
193	R	96.8	Very high	97.8	Very high	108 Å²	108	27.4 Å²	27.4	41%	0.408	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	10.5	173.6	-62.4	179	176.7	-148.7	-0.1	114.3	S191 V195 E235 S237 E254	S191-R193 PolarHBondContact O-N 2.91Å; S191-R193 VanDerWaalsContact O-N 3.09Å; S191-R193 PolarHBondContact OG-N 3.4Å; R193-V195 PolarHBondContact O-N 2.71Å; R193-E235 PolarHBondContact NE-O 3.27Å; R193-S237 PolarHBondContact NH2-OG 3.41Å; R193-E254 IonicContact CZ-OE1 3.43Å; R193-E254 IonicContact NH1-OE1 2.66Å; R193-E254 PolarHBondContact NH1-OE1 3.2Å; R193-E254 IonicContact NH2-OE1 3.43Å; R193-E254 PolarHBondContact NH2-OE1 3.47Å
194	N	97.4	Very high	97.9	Very high	44 Å²	44	26.6 Å²	26.6	24%	0.235	13%	0.133	C	C	.	.	S	Bend	trans	68.6	5.3	-179.6	-156.4	41	0	0	0	115.9	W190 S191 S192 A209 S210	W190-N194 VanDerWaalsContact NE1-C 3.29Å; W190-N194 PolarHBondContact NE1-O 3.43Å; W190-N194 PolarHBondContact NE1-OD1 3.24Å; S191-N194 PolarHBondContact O-N 3.42Å; S192-N194 VanDerWaalsContact C-N 3.27Å; S192-N194 PolarHBondContact O-N 2.82Å; N194-A209 VanDerWaalsContact O-CB 3.29Å; N194-A209 WeakPolarHBondContact O-CB 3.44Å; N194-A209 PolarHBondContact O-N 3.19Å; N194-S210 PolarHBondContact ND2-N 3.36Å; N194-S210 PolarHBondContact ND2-OG 3.48Å
195	V	98.2	Very high	98	Very high	28 Å²	28	25.7 Å²	25.7	17%	0.17	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	127.6	171.8	-176	0	0	0	0	110.3	S191 R193 L206 W207 D208 W232	S191-V195 WeakPolarHBondContact CB-O 3.01Å; S191-V195 PolarHBondContact N-O 2.92Å; S191-V195 WeakPolarHBondContact OG-CA 3.19Å; S191-V195 WeakPolarHBondContact OG-CB 3.45Å; S191-V195 PolarHBondContact OG-N 2.94Å; S191-V195 PolarHBondContact OG-O 3.06Å; R193-V195 PolarHBondContact O-N 2.71Å; V195-L206 HydrophobicContact CG1-CB 3.91Å; V195-W207 CarbonylContact C-O 3.57Å; V195-W207 WeakPolarHBondContact CA-O 3.47Å; V195-D208 HydrophobicContact CG2-CB 4.32Å; V195-W232 HydrophobicContact CB-CH2 4.39Å; V195-W232 HydrophobicContact CB-CZ2 4.27Å; V195-W232 HydrophobicContact CG1-CH2 4.18Å; V195-W232 HydrophobicContact CG1-CZ2 4.04Å
196	I	98.4	Very high	98.1	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137.4	169.6	-63.1	-175.1	0	0	0	108.8	L188 W190 L206 W207 A431 L441	L188-I196 HydrophobicContact CD1-CG2 3.52Å; W190-I196 HydrophobicContact CB-CG1 4.38Å; W190-I196 HydrophobicContact CD2-CD1 3.88Å; W190-I196 HydrophobicContact CD2-CG1 3.62Å; W190-I196 HydrophobicContact CE3-CD1 4.04Å; W190-I196 HydrophobicContact CE3-CG1 4.27Å; W190-I196 HydrophobicContact CG-CD1 4.42Å; W190-I196 HydrophobicContact CG-CG1 3.67Å; W190-I196 HydrophobicContact CH2-CD1 4.25Å; W190-I196 HydrophobicContact CZ2-CD1 4.09Å; W190-I196 HydrophobicContact CZ2-CG1 4.26Å; W190-I196 HydrophobicContact CZ3-CD1 4.23Å; I196-L206 CarbonylContact O-C 3.57Å; I196-L206 VanDerWaalsContact O-CA 3.29Å; I196-L206 WeakPolarHBondContact O-CA 3.48Å; I196-W207 HydrophobicContact CB-CE3 4.34Å; I196-W207 HydrophobicContact CD1-CE3 3.83Å; I196-W207 HydrophobicContact CD1-CZ3 3.9Å; I196-W207 HydrophobicContact CG1-CE3 4.15Å; I196-W207 PolarHBondContact N-O 3.19Å; I196-W207 PolarHBondContact O-N 3.3Å; I196-A431 HydrophobicContact CD1-CB 4.06Å; I196-L441 HydrophobicContact CD1-CD2 4.08Å
197	A	98.7	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.3	164.9	0	0	0	0	0	109.7	L188 D189 Y205 L206 L230 W232 L239	L188-A197 WeakPolarHBondContact CA-O 3.42Å; D189-A197 PolarHBondContact N-O 3.25Å; D189-A197 PolarHBondContact O-N 3.17Å; A197-Y205 WeakPolarHBondContact CA-O 3.22Å; A197-L206 HydrophobicContact CB-CD2 3.6Å; A197-L230 HydrophobicContact CB-CD1 3.9Å; A197-W232 HydrophobicContact CB-CZ2 3.68Å; A197-L239 HydrophobicContact CB-CD1 4.23Å; A197-L239 HydrophobicContact CB-CD2 3.76Å
198	V	98.6	Very high	98	Very high	13 Å²	13	26.4 Å²	26.4	8%	0.079	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.7	175.4	63.4	0	0	0	0	111	L179 L187 L188 L200 V204 Y205 I439	L179-V198 HydrophobicContact CD1-CG2 4.23Å; L187-V198 WeakPolarHBondContact O-CA 3.29Å; L188-V198 HydrophobicContact CD1-CB 4.23Å; L188-V198 HydrophobicContact CD1-CG2 4.44Å; V198-L200 HydrophobicContact CG1-CD2 4.46Å; V198-L200 HydrophobicContact CG1-CG 4.25Å; V198-L200 HydrophobicContact CG2-CD2 3.76Å; V198-L200 HydrophobicContact CG2-CG 4.31Å; V198-V204 WeakPolarHBondContact O-CA 3.11Å; V198-Y205 PolarHBondContact N-O 3.06Å; V198-Y205 PolarHBondContact O-N 3.35Å; V198-I439 HydrophobicContact CB-CD1 4.13Å; V198-I439 HydrophobicContact CG1-CD1 4.2Å; V198-I439 HydrophobicContact CG2-CD1 4.1Å
199	A	98.4	Very high	97.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	104.6	176.6	0	0	0	0	0	110.1	L187 I227 L230	L187-A199 HydrophobicContact CB-CB 4.06Å; L187-A199 HydrophobicContact CD2-CB 3.72Å; L187-A199 HydrophobicContact CG-CB 4.47Å; L187-A199 PolarHBondContact O-N 3.38Å; A199-I227 HydrophobicContact CB-CB 3.81Å; A199-I227 HydrophobicContact CB-CG2 3.52Å; A199-L230 HydrophobicContact CB-CD1 3.92Å; A199-L230 HydrophobicContact CB-CG 4.15Å
200	L	98	Very high	97.7	Very high	17 Å²	17	29.6 Å²	29.6	9%	0.089	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	100.8	176.1	-58.5	-173.4	0	0	0	108.1	A176 P177 L179 V198 N202 S203 Y205	A176-L200 HydrophobicContact CB-CD2 3.72Å; P177-L200 HydrophobicContact CG-CD1 4.24Å; L179-L200 HydrophobicContact CB-CD2 4.19Å; L179-L200 HydrophobicContact CD1-CD2 4.08Å; V198-L200 HydrophobicContact CG1-CD2 4.46Å; V198-L200 HydrophobicContact CG1-CG 4.25Å; V198-L200 HydrophobicContact CG2-CD2 3.76Å; V198-L200 HydrophobicContact CG2-CG 4.31Å; L200-N202 PolarHBondContact O-N 2.87Å; L200-S203 CarbonylContact C-O 3.4Å; L200-S203 PolarHBondContact N-O 2.93Å; L200-S203 PolarHBondContact O-N 2.84Å; L200-S203 VanDerWaalsContact O-O 3.11Å; L200-Y205 HydrophobicContact CB-CD2 4.08Å; L200-Y205 HydrophobicContact CB-CE2 4.2Å; L200-Y205 HydrophobicContact CD1-CD2 3.73Å; L200-Y205 HydrophobicContact CD1-CE2 4.04Å; L200-Y205 HydrophobicContact CD1-CG 4.46Å; L200-Y205 HydrophobicContact CG-CD2 4.02Å; L200-Y205 HydrophobicContact CG-CE2 4.5Å
201	D	97.1	Very high	97.5	Very high	41 Å²	41	35.5 Å²	35.5	22%	0.219	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	-104.3	-173.5	-171.2	50.6	0	0	0	114.9	G178 R180 Y226 I227	G178-D201 PolarHBondContact O-N 3.02Å; R180-D201 VanDerWaalsContact CD-OD1 3.24Å; R180-D201 WeakPolarHBondContact CD-OD1 3.44Å; R180-D201 HydrophobicContact CG-CB 4.38Å; R180-D201 IonicContact CZ-OD1 3.68Å; R180-D201 IonicContact NE-OD1 3.58Å; R180-D201 IonicContact NH1-OD1 3.16Å; R180-D201 PolarHBondContact NH1-OD1 3.11Å; D201-Y226 WeakPolarHBondContact O-CA 3.09Å; D201-Y226 WeakPolarHBondContact O-CB 3.29Å; D201-I227 PolarHBondContact O-N 3.09Å
202	N	97.5	Very high	97.3	Very high	19 Å²	19	37.1 Å²	37.1	10%	0.102	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	6.4	-179.3	64.1	34.6	0	0	0	113.6	L200 K219 M220 D225	L200-N202 PolarHBondContact O-N 2.87Å; N202-K219 CarbonylContact O-C 3.57Å; N202-K219 WeakPolarHBondContact O-CA 3.48Å; N202-K219 WeakPolarHBondContact OD1-CE 3.45Å; N202-M220 HydrophobicContact CB-CB 4.31Å; N202-M220 WeakPolarHBondContact O-CG 3.41Å; N202-M220 PolarHBondContact O-N 2.8Å; N202-D225 WeakPolarHBondContact CB-O 3.35Å
203	S	98.1	Very high	97.2	Very high	8 Å²	8	38.8 Å²	38.8	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.3	-174.5	-63.7	0	0	0	0	112.8	L200 L218 K219 I227	L200-S203 CarbonylContact C-O 3.4Å; L200-S203 PolarHBondContact N-O 2.93Å; L200-S203 PolarHBondContact O-N 2.84Å; L200-S203 VanDerWaalsContact O-O 3.11Å; S203-L218 CarbonylContact C-O 3.55Å; S203-L218 VanDerWaalsContact CA-O 3.27Å; S203-L218 WeakPolarHBondContact CA-O 3.43Å; S203-K219 WeakPolarHBondContact OG-CG 3.47Å; S203-I227 VanDerWaalsContact N-CD1 3.28Å; S203-I227 WeakPolarHBondContact O-CD1 3.41Å
204	V	98.6	Very high	97.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119	171.8	-176.4	0	0	0	0	109.4	V198 L206 L217 L218 I227 L230 L239 V241	V198-V204 WeakPolarHBondContact O-CA 3.11Å; V204-L206 HydrophobicContact CG1-CD2 4.43Å; V204-L217 HydrophobicContact CG1-CD2 4.5Å; V204-L217 PolarHBondContact O-N 2.77Å; V204-L218 HydrophobicContact CB-CD2 4.18Å; V204-L218 HydrophobicContact CB-CG 3.95Å; V204-L218 HydrophobicContact CG2-CD1 4.08Å; V204-L218 HydrophobicContact CG2-CD2 3.77Å; V204-L218 HydrophobicContact CG2-CG 3.78Å; V204-L218 PolarHBondContact N-O 2.98Å; V204-I227 HydrophobicContact CG2-CD1 3.54Å; V204-I227 HydrophobicContact CG2-CG1 3.82Å; V204-I227 HydrophobicContact CG2-CG2 4.36Å; V204-L230 HydrophobicContact CG1-CD1 4.24Å; V204-L230 HydrophobicContact CG1-CD2 4.05Å; V204-L230 HydrophobicContact CG2-CD2 3.88Å; V204-L239 HydrophobicContact CG1-CD2 3.99Å; V204-V241 HydrophobicContact CG2-CG1 4.17Å; V204-V241 HydrophobicContact CG2-CG2 4.48Å
205	Y	98.6	Very high	97.3	Very high	82 Å²	82	40.7 Å²	40.7	32%	0.322	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	144.5	172.5	-69.2	-93.5	0	0	0	110.4	A197 V198 L200 I214 I215 L216	A197-Y205 WeakPolarHBondContact CA-O 3.22Å; V198-Y205 PolarHBondContact N-O 3.06Å; V198-Y205 PolarHBondContact O-N 3.35Å; L200-Y205 HydrophobicContact CB-CD2 4.08Å; L200-Y205 HydrophobicContact CB-CE2 4.2Å; L200-Y205 HydrophobicContact CD1-CD2 3.73Å; L200-Y205 HydrophobicContact CD1-CE2 4.04Å; L200-Y205 HydrophobicContact CD1-CG 4.46Å; L200-Y205 HydrophobicContact CG-CD2 4.02Å; L200-Y205 HydrophobicContact CG-CE2 4.5Å; Y205-I214 HydrophobicContact CD1-CG2 4.08Å; Y205-I215 CarbonylContact C-O 3.5Å; Y205-I215 WeakPolarHBondContact CA-O 3.33Å; Y205-L216 HydrophobicContact CD1-CB 4.2Å; Y205-L216 HydrophobicContact CD1-CD1 4.32Å; Y205-L216 HydrophobicContact CD2-CD1 4.38Å; Y205-L216 HydrophobicContact CE1-CB 3.96Å; Y205-L216 HydrophobicContact CE1-CD1 3.99Å; Y205-L216 HydrophobicContact CE1-CG 4.45Å; Y205-L216 HydrophobicContact CE2-CD1 4.06Å
206	L	98.5	Very high	97.3	Very high	6 Å²	6	43.4 Å²	43.4	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.2	172.6	-53.8	-179.9	0	0	0	108.8	V195 I196 A197 V204 I214 I215 L217 W232 L239 V253	V195-L206 HydrophobicContact CG1-CB 3.91Å; I196-L206 CarbonylContact O-C 3.57Å; I196-L206 VanDerWaalsContact O-CA 3.29Å; I196-L206 WeakPolarHBondContact O-CA 3.48Å; A197-L206 HydrophobicContact CB-CD2 3.6Å; V204-L206 HydrophobicContact CG1-CD2 4.43Å; L206-I214 WeakPolarHBondContact O-CA 3.15Å; L206-I215 HydrophobicContact CB-CB 4.34Å; L206-I215 PolarHBondContact N-O 3.12Å; L206-I215 PolarHBondContact O-N 3.03Å; L206-L217 HydrophobicContact CD1-CB 4.01Å; L206-L217 HydrophobicContact CD1-CD1 4.28Å; L206-L217 HydrophobicContact CD1-CD2 4.27Å; L206-L217 HydrophobicContact CD1-CG 4.42Å; L206-L217 HydrophobicContact CD2-CD2 4.36Å; L206-L217 HydrophobicContact CG-CB 4.02Å; L206-W232 HydrophobicContact CD2-CH2 3.96Å; L206-W232 HydrophobicContact CD2-CZ2 3.85Å; L206-L239 HydrophobicContact CD2-CD2 4.1Å; L206-V253 HydrophobicContact CD1-CB 4.44Å; L206-V253 HydrophobicContact CD1-CG1 3.46Å; L206-V253 VanDerWaalsContact CD1-CG1 3.46Å; L206-V253 HydrophobicContact CD1-CG2 4.19Å
207	W	98.4	Very high	97.2	Very high	29 Å²	29	43.8 Å²	43.8	11%	0.11	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	121	176.1	178	67.6	0	0	0	110.6	K172 L174 V195 I196 A209 G212 D213 L441	K172-W207 HydrophobicContact CD-CH2 4.08Å; K172-W207 HydrophobicContact CD-CZ2 4.35Å; L174-W207 HydrophobicContact CD1-CD2 3.65Å; L174-W207 HydrophobicContact CD1-CE3 3.6Å; L174-W207 HydrophobicContact CD1-CG 4.27Å; L174-W207 HydrophobicContact CD1-CH2 4.09Å; L174-W207 HydrophobicContact CD1-CZ2 4.16Å; L174-W207 HydrophobicContact CD1-CZ3 3.82Å; L174-W207 HydrophobicContact CD2-CH2 4.36Å; L174-W207 HydrophobicContact CD2-CZ2 3.92Å; V195-W207 CarbonylContact C-O 3.57Å; V195-W207 WeakPolarHBondContact CA-O 3.47Å; I196-W207 HydrophobicContact CB-CE3 4.34Å; I196-W207 HydrophobicContact CD1-CE3 3.83Å; I196-W207 HydrophobicContact CD1-CZ3 3.9Å; I196-W207 HydrophobicContact CG1-CE3 4.15Å; I196-W207 PolarHBondContact N-O 3.19Å; I196-W207 PolarHBondContact O-N 3.3Å; W207-A209 HydrophobicContact CE3-CB 3.89Å; W207-A209 HydrophobicContact CH2-CB 3.79Å; W207-A209 VanDerWaalsContact CZ3-CA 3.47Å; W207-A209 HydrophobicContact CZ3-CB 3.31Å; W207-A209 PolarHBondContact O-N 3.48Å; W207-G212 VanDerWaalsContact CD1-O 3.26Å; W207-G212 PolarHBondContact NE1-O 2.87Å; W207-D213 WeakPolarHBondContact CA-O 3.21Å; W207-L441 HydrophobicContact CH2-CD1 3.58Å; W207-L441 HydrophobicContact CZ3-CD1 3.58Å
208	D	97	Very high	97.2	Very high	30 Å²	30	44.2 Å²	44.2	16%	0.16	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	111.7	174.2	-176.2	-5.4	0	0	0	109.9	V195 S210 Q211 G212 D213	V195-D208 HydrophobicContact CG2-CB 4.32Å; D208-S210 PolarHBondContact O-N 3.32Å; D208-S210 VanDerWaalsContact O-N 3.08Å; D208-S210 WeakPolarHBondContact OD1-CA 3.38Å; D208-S210 WeakPolarHBondContact OD1-CB 3.24Å; D208-S210 PolarHBondContact OD1-N 3.25Å; D208-S210 PolarHBondContact OD1-OG 2.7Å; D208-Q211 PolarHBondContact O-N 3.22Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.48Å; D208-G212 WeakPolarHBondContact O-CA 3.39Å; D208-G212 PolarHBondContact O-N 2.76Å; D208-D213 PolarHBondContact N-O 3.32Å
209	A	95.4	Very high	97.1	Very high	28 Å²	28	48.8 Å²	48.8	23%	0.231	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-3.3	178.9	0	0	0	0	0	114.1	W190 N194 W207	W190-A209 HydrophobicContact CZ2-CB 3.69Å; N194-A209 VanDerWaalsContact O-CB 3.29Å; N194-A209 WeakPolarHBondContact O-CB 3.44Å; N194-A209 PolarHBondContact O-N 3.19Å; W207-A209 HydrophobicContact CE3-CB 3.89Å; W207-A209 HydrophobicContact CH2-CB 3.79Å; W207-A209 VanDerWaalsContact CZ3-CA 3.47Å; W207-A209 HydrophobicContact CZ3-CB 3.31Å; W207-A209 PolarHBondContact O-N 3.48Å
210	S	93.9	Very high	97	Very high	80 Å²	80	49.6 Å²	49.6	56%	0.559	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-46.6	177.6	-26.2	0	0	0	0	111.9	N194 D208	N194-S210 PolarHBondContact ND2-N 3.36Å; N194-S210 PolarHBondContact ND2-OG 3.48Å; D208-S210 PolarHBondContact O-N 3.32Å; D208-S210 VanDerWaalsContact O-N 3.08Å; D208-S210 WeakPolarHBondContact OD1-CA 3.38Å; D208-S210 WeakPolarHBondContact OD1-CB 3.24Å; D208-S210 PolarHBondContact OD1-N 3.25Å; D208-S210 PolarHBondContact OD1-OG 2.7Å
211	Q	93.8	Very high	96.8	Very high	145 Å²	145	56.1 Å²	56.1	68%	0.678	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-33.3	-175.6	-60.1	-171.3	22.1	0	0	112.7	D208	D208-Q211 PolarHBondContact O-N 3.22Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.48Å
212	G	94.3	Very high	96.6	Very high	34 Å²	34	60.5 Å²	60.5	35%	0.351	31%	0.307	S	S	.	.			trans	99	-7.9	-174.4	0	0	0	0	0	114.4	W207 D208	W207-G212 VanDerWaalsContact CD1-O 3.26Å; W207-G212 PolarHBondContact NE1-O 2.87Å; D208-G212 WeakPolarHBondContact O-CA 3.39Å; D208-G212 PolarHBondContact O-N 2.76Å
213	D	96.3	Very high	96.3	Very high	100 Å²	100	66.6 Å²	66.6	54%	0.535	34%	0.335	S	S	.	.			trans	-60.4	144.2	-177.5	-77.6	18.5	0	0	0	113.3	W207 D208	W207-D213 WeakPolarHBondContact CA-O 3.21Å; D208-D213 PolarHBondContact N-O 3.32Å
214	I	97.7	Very high	96.1	Very high	123 Å²	123	73 Å²	73	63%	0.631	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.4	-178.7	-61.2	169	0	0	0	109.7	Y205 L206	Y205-I214 HydrophobicContact CD1-CG2 4.08Å; L206-I214 WeakPolarHBondContact O-CA 3.15Å
215	I	97.4	Very high	96	Very high	69 Å²	69	73.8 Å²	73.8	35%	0.354	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.9	177.4	-62.6	171.2	0	0	0	109.5	Y205 L206 L217	Y205-I215 CarbonylContact C-O 3.5Å; Y205-I215 WeakPolarHBondContact CA-O 3.33Å; L206-I215 HydrophobicContact CB-CB 4.34Å; L206-I215 PolarHBondContact N-O 3.12Å; L206-I215 PolarHBondContact O-N 3.03Å; I215-L217 PolarHBondContact O-N 3.46Å
216	L	97.9	Very high	96	Very high	84 Å²	84	71.8 Å²	71.8	44%	0.44	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	107	164.6	174	60.8	0	0	0	108.5	Y205 L218	Y205-L216 HydrophobicContact CD1-CB 4.2Å; Y205-L216 HydrophobicContact CD1-CD1 4.32Å; Y205-L216 HydrophobicContact CD2-CD1 4.38Å; Y205-L216 HydrophobicContact CE1-CB 3.96Å; Y205-L216 HydrophobicContact CE1-CD1 3.99Å; Y205-L216 HydrophobicContact CE1-CG 4.45Å; Y205-L216 HydrophobicContact CE2-CD1 4.06Å; L216-L218 VanDerWaalsContact CD1-O 3.31Å; L216-L218 WeakPolarHBondContact CD1-O 3.25Å
217	L	97.9	Very high	96	Very high	10 Å²	10	71.5 Å²	71.5	5%	0.052	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-41.5	-178.4	177.6	67.3	0	0	0	112.1	V204 L206 I215 L239 W251 V253	V204-L217 HydrophobicContact CG1-CD2 4.5Å; V204-L217 PolarHBondContact O-N 2.77Å; L206-L217 HydrophobicContact CD1-CB 4.01Å; L206-L217 HydrophobicContact CD1-CD1 4.28Å; L206-L217 HydrophobicContact CD1-CD2 4.27Å; L206-L217 HydrophobicContact CD1-CG 4.42Å; L206-L217 HydrophobicContact CD2-CD2 4.36Å; L206-L217 HydrophobicContact CG-CB 4.02Å; I215-L217 PolarHBondContact O-N 3.46Å; L217-L239 HydrophobicContact CD2-CD2 3.76Å; L217-W251 HydrophobicContact CD1-CE3 4.05Å; L217-W251 HydrophobicContact CD2-CB 4.08Å; L217-W251 HydrophobicContact CD2-CG 4.37Å; L217-W251 HydrophobicContact CG-CD2 4.44Å; L217-W251 HydrophobicContact CG-CE3 4.08Å; L217-W251 WeakPolarHBondContact O-CZ3 3.46Å; L217-V253 HydrophobicContact CD1-CG2 4.22Å; L217-V253 HydrophobicContact CD2-CG2 4.03Å
218	L	97.1	Very high	96	Very high	10 Å²	10	70.1 Å²	70.1	5%	0.052	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	151.3	179	74.2	92.6	0	0	0	111.4	S203 V204 L216 M220 I227 V241 W251	S203-L218 CarbonylContact C-O 3.55Å; S203-L218 VanDerWaalsContact CA-O 3.27Å; S203-L218 WeakPolarHBondContact CA-O 3.43Å; V204-L218 HydrophobicContact CB-CD2 4.18Å; V204-L218 HydrophobicContact CB-CG 3.95Å; V204-L218 HydrophobicContact CG2-CD1 4.08Å; V204-L218 HydrophobicContact CG2-CD2 3.77Å; V204-L218 HydrophobicContact CG2-CG 3.78Å; V204-L218 PolarHBondContact N-O 2.98Å; L216-L218 VanDerWaalsContact CD1-O 3.31Å; L216-L218 WeakPolarHBondContact CD1-O 3.25Å; L218-M220 HydrophobicContact CD1-CG 4.24Å; L218-I227 HydrophobicContact CD1-CD1 4.16Å; L218-I227 HydrophobicContact CD1-CG1 4.48Å; L218-V241 HydrophobicContact CD2-CB 4.49Å; L218-V241 HydrophobicContact CD2-CG1 4.24Å; L218-V241 HydrophobicContact CD2-CG2 4.02Å; L218-W251 HydrophobicContact CB-CH2 3.51Å; L218-W251 HydrophobicContact CB-CZ2 3.5Å; L218-W251 VanDerWaalsContact CB-CZ2 3.5Å; L218-W251 HydrophobicContact CB-CZ3 4.07Å; L218-W251 HydrophobicContact CD2-CD2 4.06Å; L218-W251 VanDerWaalsContact CD2-CE2 3.46Å; L218-W251 HydrophobicContact CD2-CG 4.37Å; L218-W251 HydrophobicContact CD2-CH2 4.49Å; L218-W251 HydrophobicContact CD2-CZ2 3.72Å; L218-W251 HydrophobicContact CG-CZ2 4.18Å
219	K	97.3	Very high	96.1	Very high	109 Å²	109	68.7 Å²	68.7	47%	0.474	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.6	157.4	179	174	176.8	-171.4	0	108	N202 S203 E223	N202-K219 CarbonylContact O-C 3.57Å; N202-K219 WeakPolarHBondContact O-CA 3.48Å; N202-K219 WeakPolarHBondContact OD1-CE 3.45Å; S203-K219 WeakPolarHBondContact OG-CG 3.47Å; K219-E223 IonicContact NZ-OE1 2.74Å; K219-E223 PolarHBondContact NZ-OE1 2.68Å
220	M	96.4	Very high	96.2	Very high	17 Å²	17	67.7 Å²	67.7	8%	0.084	34%	0.337	C	S	.	.			trans	-71.3	149.1	177.6	-64.9	-164.1	69.6	0	0	112.1	N202 L218 R222 D225 I227 T243	N202-M220 HydrophobicContact CB-CB 4.31Å; N202-M220 WeakPolarHBondContact O-CG 3.41Å; N202-M220 PolarHBondContact O-N 2.8Å; L218-M220 HydrophobicContact CD1-CG 4.24Å; M220-R222 VanDerWaalsContact C-N 3.27Å; M220-R222 PolarHBondContact O-N 2.82Å; M220-D225 HydrophobicContact CE-CB 3.66Å; M220-D225 HydrophobicContact SD-CB 4.05Å; M220-I227 HydrophobicContact SD-CG1 4.33Å; M220-T243 HydrophobicContact CE-CG2 3.73Å; M220-T243 HydrophobicContact SD-CG2 3.98Å
221	E	93.3	Very high	96.5	Very high	155 Å²	155	64.7 Å²	64.7	72%	0.724	32%	0.315	S	S	*	.	S	Bend	trans	-72.3	-18.4	-173.2	-63	162.3	-144.8	0	0	112.9	R258	E221-R258 IonicContact OE1-CZ 3.19Å; E221-R258 IonicContact OE1-NH1 3.08Å; E221-R258 PolarHBondContact OE1-NH1 2.92Å; E221-R258 IonicContact OE1-NH2 2.75Å; E221-R258 PolarHBondContact OE1-NH2 2.79Å
222	R	94.3	Very high	96.7	Very high	132 Å²	132	58.5 Å²	58.5	50%	0.498	29%	0.286	S	S	.	.	S	Bend	trans	-122.2	139.2	175.3	-70	172.7	65	-153	11.6	109.5	M220 E224 D225	M220-R222 VanDerWaalsContact C-N 3.27Å; M220-R222 PolarHBondContact O-N 2.82Å; R222-E224 VanDerWaalsContact C-N 3.31Å; R222-E224 IonicContact CZ-OE2 2.65Å; R222-E224 IonicContact NE-OE2 3.79Å; R222-E224 IonicContact NH2-OE2 3.58Å; R222-E224 PolarHBondContact NH2-OE2 3.06Å; R222-E224 PolarHBondContact O-N 3.38Å; R222-D225 HydrophobicContact CB-CB 4.34Å; R222-D225 WeakPolarHBondContact CD-OD2 3.43Å; R222-D225 IonicContact CZ-OD2 3.19Å; R222-D225 IonicContact NE-OD2 3.61Å; R222-D225 IonicContact NH1-OD2 2.65Å; R222-D225 PolarHBondContact NH1-OD2 3.08Å; R222-D225 PolarHBondContact O-N 3.19Å
223	E	90.5	Very high	96.9	Very high	147 Å²	147	57.8 Å²	57.8	69%	0.687	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-16	-178.2	-53	-156.3	124.4	0	0	113.7	K219 D225	K219-E223 IonicContact NZ-OE1 2.74Å; K219-E223 PolarHBondContact NZ-OE1 2.68Å; E223-D225 VanDerWaalsContact C-N 3.33Å
224	E	94.2	Very high	96.9	Very high	143 Å²	143	60.5 Å²	60.5	67%	0.668	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-22	173	-58.6	173.9	119.4	0	0	112.9	R222	R222-E224 VanDerWaalsContact C-N 3.31Å; R222-E224 IonicContact CZ-OE2 2.65Å; R222-E224 IonicContact NE-OE2 3.79Å; R222-E224 IonicContact NH2-OE2 3.58Å; R222-E224 PolarHBondContact NH2-OE2 3.06Å; R222-E224 PolarHBondContact O-N 3.38Å
225	D	96.8	Very high	96.7	Very high	16 Å²	16	59.9 Å²	59.9	9%	0.086	28%	0.276	C	S	.	.			trans	-94.9	140.7	-173.9	-81.5	-54.3	0	0	0	111.7	N202 M220 R222 E223 S244	N202-D225 WeakPolarHBondContact CB-O 3.35Å; M220-D225 HydrophobicContact CE-CB 3.66Å; M220-D225 HydrophobicContact SD-CB 4.05Å; R222-D225 HydrophobicContact CB-CB 4.34Å; R222-D225 WeakPolarHBondContact CD-OD2 3.43Å; R222-D225 IonicContact CZ-OD2 3.19Å; R222-D225 IonicContact NE-OD2 3.61Å; R222-D225 IonicContact NH1-OD2 2.65Å; R222-D225 PolarHBondContact NH1-OD2 3.08Å; R222-D225 PolarHBondContact O-N 3.19Å; E223-D225 VanDerWaalsContact C-N 3.33Å; D225-S244 WeakPolarHBondContact CA-OG 3.37Å; D225-S244 VanDerWaalsContact CB-OG 3.27Å; D225-S244 WeakPolarHBondContact CB-OG 3.34Å; D225-S244 PolarHBondContact OD1-OG 2.95Å
226	Y	98.1	Very high	96.7	Very high	40 Å²	40	56.7 Å²	56.7	16%	0.157	26%	0.26	C	S	.	.			trans	-137.9	153.7	-171.6	61.5	-86.3	0	0	0	112.7	R180 L185 D201 C228 S244 R268	R180-Y226 VanDerWaalsContact CD-CD2 3.48Å; L185-Y226 HydrophobicContact CD1-CD2 4.2Å; L185-Y226 HydrophobicContact CD1-CE2 3.9Å; D201-Y226 WeakPolarHBondContact O-CA 3.09Å; D201-Y226 WeakPolarHBondContact O-CB 3.29Å; Y226-C228 WeakPolarHBondContact CE2-SG 3.31Å; Y226-S244 PolarHBondContact N-OG 2.7Å; Y226-S244 PolarHBondContact O-N 3.14Å; Y226-S244 PolarHBondContact O-OG 2.75Å; Y226-R268 WeakPolarHBondContact OH-CD 3.47Å; Y226-R268 PolarHBondContact OH-NH1 2.81Å
227	I	98.6	Very high	96.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.9	176.7	-62.2	117	0	0	0	110	L187 A199 D201 S203 V204 L218 M220 L230 V241	L187-I227 WeakPolarHBondContact CD2-O 3.34Å; A199-I227 HydrophobicContact CB-CB 3.81Å; A199-I227 HydrophobicContact CB-CG2 3.52Å; D201-I227 PolarHBondContact O-N 3.09Å; S203-I227 VanDerWaalsContact N-CD1 3.28Å; S203-I227 WeakPolarHBondContact O-CD1 3.41Å; V204-I227 HydrophobicContact CG2-CD1 3.54Å; V204-I227 HydrophobicContact CG2-CG1 3.82Å; V204-I227 HydrophobicContact CG2-CG2 4.36Å; L218-I227 HydrophobicContact CD1-CD1 4.16Å; L218-I227 HydrophobicContact CD1-CG1 4.48Å; M220-I227 HydrophobicContact SD-CG1 4.33Å; I227-L230 HydrophobicContact CG2-CD2 3.95Å; I227-L230 HydrophobicContact CG2-CG 4.39Å; I227-V241 HydrophobicContact CB-CG1 4.49Å; I227-V241 HydrophobicContact CG1-CG1 3.96Å; I227-V241 HydrophobicContact CG2-CG1 3.76Å
228	C	98.3	Very high	96.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-26.7	-174.2	-71.8	0	0	0	0	113.1	L185 N186 Y226 G242 S244 V269	L185-C228 WeakPolarHBondContact CA-O 3.41Å; L185-C228 WeakPolarHBondContact CB-O 3.1Å; L185-C228 HydrophobicContact CD2-CB 3.84Å; N186-C228 PolarHBondContact N-O 3.33Å; Y226-C228 WeakPolarHBondContact CE2-SG 3.31Å; C228-G242 WeakPolarHBondContact CA-O 3.39Å; C228-G242 PolarHBondContact N-O 3.35Å; C228-S244 PolarHBondContact SG-N 3.42Å; C228-V269 CarbonylContact C-O 3.6Å; C228-V269 WeakPolarHBondContact CB-O 3.47Å
229	S	98.5	Very high	96.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	149.9	174.3	48.5	0	0	0	0	113.2	N186 V241 G242 V269 L272	N186-S229 CarbonylContact O-C 3.53Å; N186-S229 WeakPolarHBondContact O-CA 3.38Å; S229-V241 CarbonylContact O-C 3.6Å; S229-V241 WeakPolarHBondContact O-CA 3.38Å; S229-G242 PolarHBondContact N-O 3.11Å; S229-G242 PolarHBondContact O-N 3.44Å; S229-G242 WeakPolarHBondContact OG-CA 3.3Å; S229-V269 PolarHBondContact OG-O 3.44Å; S229-L272 WeakPolarHBondContact OG-CG 3.4Å
230	L	98.7	Very high	96.7	Very high	8 Å²	8	52 Å²	52	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144.3	170.2	-62.3	-179.9	0	0	0	109.4	N186 D189 A197 A199 V204 I227 L239 A240 V241	N186-L230 PolarHBondContact O-N 2.96Å; D189-L230 HydrophobicContact CB-CB 4.5Å; A197-L230 HydrophobicContact CB-CD1 3.9Å; A199-L230 HydrophobicContact CB-CD1 3.92Å; A199-L230 HydrophobicContact CB-CG 4.15Å; V204-L230 HydrophobicContact CG1-CD1 4.24Å; V204-L230 HydrophobicContact CG1-CD2 4.05Å; V204-L230 HydrophobicContact CG2-CD2 3.88Å; I227-L230 HydrophobicContact CG2-CD2 3.95Å; I227-L230 HydrophobicContact CG2-CG 4.39Å; L230-L239 HydrophobicContact CB-CD1 4.37Å; L230-L239 HydrophobicContact CD2-CD2 4.29Å; L230-A240 WeakPolarHBondContact CA-O 3.43Å; L230-V241 HydrophobicContact CD2-CB 4.36Å; L230-V241 HydrophobicContact CD2-CG1 4.07Å; L230-V241 HydrophobicContact CD2-CG2 3.9Å
231	S	98.6	Very high	96.8	Very high	16 Å²	16	51.2 Å²	51.2	11%	0.112	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	124.9	163.4	-172	0	0	0	0	112.8	D189 A240 W274	D189-S231 VanDerWaalsContact OD2-CA 3.29Å; D189-S231 WeakPolarHBondContact OD2-CA 3.08Å; S231-A240 PolarHBondContact N-O 2.98Å; S231-A240 WeakPolarHBondContact O-CB 3.07Å; S231-A240 PolarHBondContact O-N 3.07Å; S231-W274 PolarHBondContact O-NE1 2.83Å
232	W	98.6	Very high	97.1	Very high	15 Å²	15	43.8 Å²	43.8	6%	0.057	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	142.1	177.7	-71.2	104.5	0	0	0	112.5	D189 S191 V195 A197 L206 G236 L239 V253 W274	D189-W232 PolarHBondContact O-NE1 2.56Å; D189-W232 PolarHBondContact OD2-N 2.85Å; S191-W232 VanDerWaalsContact N-CD1 3.29Å; V195-W232 HydrophobicContact CB-CH2 4.39Å; V195-W232 HydrophobicContact CB-CZ2 4.27Å; V195-W232 HydrophobicContact CG1-CH2 4.18Å; V195-W232 HydrophobicContact CG1-CZ2 4.04Å; A197-W232 HydrophobicContact CB-CZ2 3.68Å; L206-W232 HydrophobicContact CD2-CH2 3.96Å; L206-W232 HydrophobicContact CD2-CZ2 3.85Å; W232-G236 VanDerWaalsContact CZ3-O 3.25Å; W232-G236 WeakPolarHBondContact CZ3-O 3.47Å; W232-L239 HydrophobicContact CD2-CB 4.49Å; W232-L239 HydrophobicContact CD2-CD1 3.81Å; W232-L239 HydrophobicContact CE3-CB 4.05Å; W232-L239 HydrophobicContact CE3-CD1 4.22Å; W232-L239 HydrophobicContact CG-CD1 4.01Å; W232-L239 HydrophobicContact CZ3-CB 4.16Å; W232-V253 HydrophobicContact CH2-CG1 4.2Å; W232-V253 HydrophobicContact CH2-CG2 4Å; W232-V253 HydrophobicContact CZ3-CB 4.26Å; W232-V253 HydrophobicContact CZ3-CG1 4.37Å; W232-V253 HydrophobicContact CZ3-CG2 3.72Å; W232-W274 PolarHBondContact O-NE1 2.8Å
233	T	98.1	Very high	97.3	Very high	19 Å²	19	37.5 Å²	37.5	12%	0.117	17%	0.174	C	C	.	.			trans	-61.9	151.6	161.3	48.9	0	0	0	0	110.9	E235 G236 Y238 W274	T233-E235 PolarHBondContact O-N 3.01Å; T233-E235 VanDerWaalsContact O-N 3.12Å; T233-G236 WeakPolarHBondContact O-CA 3.18Å; T233-G236 PolarHBondContact O-N 2.98Å; T233-Y238 HydrophobicContact CG2-CD2 4.3Å; T233-Y238 PolarHBondContact N-O 2.98Å; T233-Y238 PolarHBondContact OG1-N 3.48Å; T233-Y238 PolarHBondContact OG1-O 3.23Å; T233-W274 HydrophobicContact CG2-CD2 3.94Å; T233-W274 HydrophobicContact CG2-CE3 4.17Å; T233-W274 HydrophobicContact CG2-CH2 3.6Å; T233-W274 HydrophobicContact CG2-CZ2 3.33Å; T233-W274 HydrophobicContact CG2-CZ3 4.02Å
234	K	95.9	Very high	97.6	Very high	158 Å²	158	31.3 Å²	31.3	69%	0.687	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	-37.3	-177.9	179.7	177.9	160.4	-85.3	0	114.2	S192	S192-K234 WeakPolarHBondContact CB-O 3.34Å; S192-K234 PolarHBondContact OG-O 2.95Å
235	E	95.1	Very high	97.8	Very high	109 Å²	109	26.5 Å²	26.5	51%	0.509	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	2.2	-179.9	-44.8	-50.2	138.4	0	0	113.7	R193 T233 S237	R193-E235 PolarHBondContact NE-O 3.27Å; T233-E235 PolarHBondContact O-N 3.01Å; T233-E235 VanDerWaalsContact O-N 3.12Å; E235-S237 PolarHBondContact O-N 2.83Å; E235-S237 VanDerWaalsContact O-N 3.12Å
236	G	95.9	Very high	97.8	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.021	13%	0.132	C	C	.	.	S	Bend	trans	70	0.3	176.2	0	0	0	0	0	116.4	S192 W232 T233	S192-G236 PolarHBondContact OG-N 2.73Å; W232-G236 VanDerWaalsContact CZ3-O 3.25Å; W232-G236 WeakPolarHBondContact CZ3-O 3.47Å; T233-G236 WeakPolarHBondContact O-CA 3.18Å; T233-G236 PolarHBondContact O-N 2.98Å
237	S	95.5	Very high	97.8	Very high	21 Å²	21	28.3 Å²	28.3	15%	0.147	14%	0.137	C	C	.	.	S	Bend	trans	-71.8	-33.7	-178.1	-34.9	0	0	0	0	113.3	R193 E235 V253	R193-S237 PolarHBondContact NH2-OG 3.41Å; E235-S237 PolarHBondContact O-N 2.83Å; E235-S237 VanDerWaalsContact O-N 3.12Å; S237-V253 PolarHBondContact O-N 2.87Å
238	Y	98.1	Very high	97.8	Very high	94 Å²	94	28.3 Å²	28.3	37%	0.369	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.9	-175.3	-47.5	-77.1	0	0	0	112.1	T233 W251 D252 L259	T233-Y238 HydrophobicContact CG2-CD2 4.3Å; T233-Y238 PolarHBondContact N-O 2.98Å; T233-Y238 PolarHBondContact OG1-N 3.48Å; T233-Y238 PolarHBondContact OG1-O 3.23Å; Y238-W251 CarbonylContact C-O 3.55Å; Y238-W251 WeakPolarHBondContact CA-O 3.28Å; Y238-W251 WeakPolarHBondContact CB-O 3.48Å; Y238-D252 HydrophobicContact CD1-CB 4.11Å; Y238-D252 HydrophobicContact CE1-CB 4.13Å; Y238-L259 HydrophobicContact CD1-CD1 3.79Å; Y238-L259 HydrophobicContact CE1-CD1 3.65Å
239	L	98.7	Very high	97.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.3	176.2	-178.4	61.2	0	0	0	110.2	A197 V204 L206 L217 L230 W232 V241 W251 V253	A197-L239 HydrophobicContact CB-CD1 4.23Å; A197-L239 HydrophobicContact CB-CD2 3.76Å; V204-L239 HydrophobicContact CG1-CD2 3.99Å; L206-L239 HydrophobicContact CD2-CD2 4.1Å; L217-L239 HydrophobicContact CD2-CD2 3.76Å; L230-L239 HydrophobicContact CB-CD1 4.37Å; L230-L239 HydrophobicContact CD2-CD2 4.29Å; W232-L239 HydrophobicContact CD2-CB 4.49Å; W232-L239 HydrophobicContact CD2-CD1 3.81Å; W232-L239 HydrophobicContact CE3-CB 4.05Å; W232-L239 HydrophobicContact CE3-CD1 4.22Å; W232-L239 HydrophobicContact CG-CD1 4.01Å; W232-L239 HydrophobicContact CZ3-CB 4.16Å; L239-V241 HydrophobicContact CD2-CG2 4.26Å; L239-V241 HydrophobicContact CG-CG2 4.07Å; L239-W251 PolarHBondContact N-O 2.79Å; L239-W251 PolarHBondContact O-N 3.24Å; L239-V253 HydrophobicContact CB-CG2 4.03Å
240	A	98.8	Very high	97.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.4	166.2	0	0	0	0	0	110.3	L230 S231 Q249 L272 W274 L279	L230-A240 WeakPolarHBondContact CA-O 3.43Å; S231-A240 PolarHBondContact N-O 2.98Å; S231-A240 WeakPolarHBondContact O-CB 3.07Å; S231-A240 PolarHBondContact O-N 3.07Å; A240-Q249 WeakPolarHBondContact CA-O 3.38Å; A240-L272 HydrophobicContact CB-CD1 3.81Å; A240-W274 HydrophobicContact CB-CZ2 3.74Å; A240-L279 HydrophobicContact CB-CD1 4.12Å; A240-L279 HydrophobicContact CB-CD2 3.56Å
241	V	98.8	Very high	97.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	114	-177.9	-174.9	0	0	0	0	109.2	V204 L218 I227 S229 L230 L239 T243 Q249	V204-V241 HydrophobicContact CG2-CG1 4.17Å; V204-V241 HydrophobicContact CG2-CG2 4.48Å; L218-V241 HydrophobicContact CD2-CB 4.49Å; L218-V241 HydrophobicContact CD2-CG1 4.24Å; L218-V241 HydrophobicContact CD2-CG2 4.02Å; I227-V241 HydrophobicContact CB-CG1 4.49Å; I227-V241 HydrophobicContact CG1-CG1 3.96Å; I227-V241 HydrophobicContact CG2-CG1 3.76Å; S229-V241 CarbonylContact O-C 3.6Å; S229-V241 WeakPolarHBondContact O-CA 3.38Å; L230-V241 HydrophobicContact CD2-CB 4.36Å; L230-V241 HydrophobicContact CD2-CG1 4.07Å; L230-V241 HydrophobicContact CD2-CG2 3.9Å; L239-V241 HydrophobicContact CD2-CG2 4.26Å; L239-V241 HydrophobicContact CG-CG2 4.07Å; V241-T243 HydrophobicContact CG1-CG2 4.35Å; V241-Q249 HydrophobicContact CB-CB 4.41Å; V241-Q249 PolarHBondContact N-O 2.77Å; V241-Q249 PolarHBondContact O-N 2.9Å
242	G	98.6	Very high	97.8	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	138.7	174.3	0	0	0	0	0	110.7	C228 S229	C228-G242 WeakPolarHBondContact CA-O 3.39Å; C228-G242 PolarHBondContact N-O 3.35Å; S229-G242 PolarHBondContact N-O 3.11Å; S229-G242 PolarHBondContact O-N 3.44Å; S229-G242 WeakPolarHBondContact OG-CA 3.3Å
243	T	98.6	Very high	97.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	168.5	-165.7	54.9	0	0	0	0	113.7	M220 V241 D245 K247 R268 V269	M220-T243 HydrophobicContact CE-CG2 3.73Å; M220-T243 HydrophobicContact SD-CG2 3.98Å; V241-T243 HydrophobicContact CG1-CG2 4.35Å; T243-D245 WeakPolarHBondContact CB-OD1 3.42Å; T243-D245 PolarHBondContact OG1-OD1 2.86Å; T243-K247 PolarHBondContact N-O 3.25Å; T243-K247 WeakPolarHBondContact OG1-CB 3.35Å; T243-K247 PolarHBondContact OG1-N 3.24Å; T243-K247 PolarHBondContact OG1-O 2.89Å; T243-K247 VanDerWaalsContact OG1-O 3.11Å; T243-R268 WeakPolarHBondContact O-CA 3.48Å; T243-V269 PolarHBondContact O-N 3.13Å
244	S	98.1	Very high	97.5	Very high	17 Å²	17	35.5 Å²	35.5	12%	0.119	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-43	169.9	52.1	0	0	0	0	112.4	D225 Y226 C228 C246	D225-S244 WeakPolarHBondContact CA-OG 3.37Å; D225-S244 VanDerWaalsContact CB-OG 3.27Å; D225-S244 WeakPolarHBondContact CB-OG 3.34Å; D225-S244 PolarHBondContact OD1-OG 2.95Å; Y226-S244 PolarHBondContact N-OG 2.7Å; Y226-S244 PolarHBondContact O-N 3.14Å; Y226-S244 PolarHBondContact O-OG 2.75Å; C228-S244 PolarHBondContact SG-N 3.42Å; S244-C246 PolarHBondContact O-N 3.19Å
245	D	96.8	Very high	97.5	Very high	41 Å²	41	33.3 Å²	33.3	22%	0.219	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	26.5	-179.2	75.1	-17.5	0	0	0	114.4	T243 K247	T243-D245 WeakPolarHBondContact CB-OD1 3.42Å; T243-D245 PolarHBondContact OG1-OD1 2.86Å; D245-K247 PolarHBondContact O-N 3.08Å; D245-K247 VanDerWaalsContact O-N 3.14Å; D245-K247 VanDerWaalsContact OD2-CD 3.27Å; D245-K247 WeakPolarHBondContact OD2-CD 3.29Å; D245-K247 WeakPolarHBondContact OD2-CE 3.39Å; D245-K247 IonicContact OD2-NZ 3.22Å; D245-K247 PolarHBondContact OD2-NZ 2.74Å
246	C	97.3	Very high	97.6	Very high	31 Å²	31	33.3 Å²	33.3	21%	0.209	17%	0.165	C	C	.	.	S	Bend	trans	64.4	13.3	171.1	-45.8	0	0	0	0	115.4	S244 H265 T266 A267	S244-C246 PolarHBondContact O-N 3.19Å; C246-H265 HydrophobicContact CB-CB 4.39Å; C246-H265 VanDerWaalsContact CB-O 3.31Å; C246-H265 WeakPolarHBondContact CB-O 3.35Å; C246-T266 VanDerWaalsContact SG-C 3.6Å; C246-A267 WeakPolarHBondContact SG-CA 3.29Å; C246-A267 PolarHBondContact SG-N 2.96Å; C246-A267 VanDerWaalsContact SG-N 3.42Å
247	K	98.1	Very high	97.6	Very high	63 Å²	63	39.3 Å²	39.3	27%	0.274	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	155.6	-179.8	-66.9	165.3	-164.9	160.6	0	112	T243 D245 Q249 M262 T263	T243-K247 PolarHBondContact N-O 3.25Å; T243-K247 WeakPolarHBondContact OG1-CB 3.35Å; T243-K247 PolarHBondContact OG1-N 3.24Å; T243-K247 PolarHBondContact OG1-O 2.89Å; T243-K247 VanDerWaalsContact OG1-O 3.11Å; D245-K247 PolarHBondContact O-N 3.08Å; D245-K247 VanDerWaalsContact O-N 3.14Å; D245-K247 VanDerWaalsContact OD2-CD 3.27Å; D245-K247 WeakPolarHBondContact OD2-CD 3.29Å; D245-K247 WeakPolarHBondContact OD2-CE 3.39Å; D245-K247 IonicContact OD2-NZ 3.22Å; D245-K247 PolarHBondContact OD2-NZ 2.74Å; K247-Q249 HydrophobicContact CB-CG 4.47Å; K247-M262 WeakPolarHBondContact CA-O 3.38Å; K247-T263 HydrophobicContact CG-CG2 3.81Å
248	V	98.6	Very high	97.8	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	108	163.1	-173.8	0	0	0	0	107.5	M262 V269 L272 L279	V248-M262 HydrophobicContact CB-CB 4.31Å; V248-M262 HydrophobicContact CB-CE 4.06Å; V248-M262 HydrophobicContact CG1-CE 3.76Å; V248-M262 PolarHBondContact N-O 3.45Å; V248-M262 VanDerWaalsContact O-CB 3.28Å; V248-M262 WeakPolarHBondContact O-CB 3.48Å; V248-M262 PolarHBondContact O-N 3Å; V248-V269 HydrophobicContact CG2-CB 4.46Å; V248-V269 HydrophobicContact CG2-CG1 4.05Å; V248-V269 HydrophobicContact CG2-CG2 3.99Å; V248-L272 HydrophobicContact CG1-CD2 3.88Å; V248-L272 HydrophobicContact CG2-CD2 4.44Å; V248-L279 HydrophobicContact CG1-CD2 3.54Å
249	Q	98.6	Very high	97.7	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.033	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	142.2	178.5	-51.1	-174	23.6	0	0	109.6	A240 V241 K247 W251 R260	A240-Q249 WeakPolarHBondContact CA-O 3.38Å; V241-Q249 HydrophobicContact CB-CB 4.41Å; V241-Q249 PolarHBondContact N-O 2.77Å; V241-Q249 PolarHBondContact O-N 2.9Å; K247-Q249 HydrophobicContact CB-CG 4.47Å; Q249-W251 VanDerWaalsContact OE1-NE1 3.08Å; Q249-R260 WeakPolarHBondContact CA-O 3.41Å
250	L	98.6	Very high	97.7	Very high	10 Å²	10	45 Å²	45	5%	0.052	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.3	171.8	-177.2	62.9	0	0	0	108.6	L259 R260 W274 V293	L250-L259 PolarHBondContact O-N 2.93Å; L250-R260 HydrophobicContact CB-CB 4.14Å; L250-R260 PolarHBondContact N-O 3.08Å; L250-R260 PolarHBondContact O-N 3.46Å; L250-W274 HydrophobicContact CD1-CH2 3.73Å; L250-W274 HydrophobicContact CD1-CZ2 3.75Å; L250-V293 HydrophobicContact CD2-CB 4.03Å; L250-V293 HydrophobicContact CD2-CG2 4.23Å
251	W	98.7	Very high	97.7	Very high	29 Å²	29	47.6 Å²	47.6	11%	0.11	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.1	-176.9	-73.3	78.1	0	0	0	111.1	L217 L218 Y238 L239 Q249 K257 R258	L217-W251 HydrophobicContact CD1-CE3 4.05Å; L217-W251 HydrophobicContact CD2-CB 4.08Å; L217-W251 HydrophobicContact CD2-CG 4.37Å; L217-W251 HydrophobicContact CG-CD2 4.44Å; L217-W251 HydrophobicContact CG-CE3 4.08Å; L217-W251 WeakPolarHBondContact O-CZ3 3.46Å; L218-W251 HydrophobicContact CB-CH2 3.51Å; L218-W251 HydrophobicContact CB-CZ2 3.5Å; L218-W251 VanDerWaalsContact CB-CZ2 3.5Å; L218-W251 HydrophobicContact CB-CZ3 4.07Å; L218-W251 HydrophobicContact CD2-CD2 4.06Å; L218-W251 VanDerWaalsContact CD2-CE2 3.46Å; L218-W251 HydrophobicContact CD2-CG 4.37Å; L218-W251 HydrophobicContact CD2-CH2 4.49Å; L218-W251 HydrophobicContact CD2-CZ2 3.72Å; L218-W251 HydrophobicContact CG-CZ2 4.18Å; Y238-W251 CarbonylContact C-O 3.55Å; Y238-W251 WeakPolarHBondContact CA-O 3.28Å; Y238-W251 WeakPolarHBondContact CB-O 3.48Å; L239-W251 PolarHBondContact N-O 2.79Å; L239-W251 PolarHBondContact O-N 3.24Å; Q249-W251 VanDerWaalsContact OE1-NE1 3.08Å; W251-K257 VanDerWaalsContact CE3-C 3.49Å; W251-R258 HydrophobicContact CD2-CB 3.98Å; W251-R258 HydrophobicContact CE3-CB 4.19Å; W251-R258 VanDerWaalsContact CE3-N 3.28Å; W251-R258 HydrophobicContact CH2-CB 3.93Å; W251-R258 HydrophobicContact CZ2-CB 3.69Å; W251-R258 HydrophobicContact CZ2-CG 4.15Å; W251-R258 HydrophobicContact CZ3-CB 4.17Å
252	D	97.9	Very high	97.7	Very high	15 Å²	15	47.6 Å²	47.6	8%	0.08	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.1	160.8	-174.3	-34.4	0	0	0	108.1	Y238 E254 N255 Q256 K257 L259	Y238-D252 HydrophobicContact CD1-CB 4.11Å; Y238-D252 HydrophobicContact CE1-CB 4.13Å; D252-E254 PolarHBondContact OD1-N 3.1Å; D252-N255 HydrophobicContact CB-CB 4.35Å; D252-N255 VanDerWaalsContact CG-ND2 3.34Å; D252-N255 PolarHBondContact OD1-N 2.86Å; D252-N255 PolarHBondContact OD1-ND2 2.95Å; D252-N255 PolarHBondContact OD2-ND2 3.13Å; D252-Q256 CarbonylContact O-C 3.47Å; D252-Q256 VanDerWaalsContact O-CA 3.3Å; D252-Q256 WeakPolarHBondContact O-CA 3.46Å; D252-Q256 PolarHBondContact O-N 3.33Å; D252-Q256 VanDerWaalsContact O-N 3.11Å; D252-K257 PolarHBondContact N-O 2.96Å; D252-K257 PolarHBondContact O-N 3.27Å; D252-L259 HydrophobicContact CB-CD1 4.02Å; D252-L259 HydrophobicContact CB-CD2 3.97Å; D252-L259 HydrophobicContact CB-CG 3.85Å
253	V	96.9	Very high	97.6	Very high	27 Å²	27	52.1 Å²	52.1	16%	0.164	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-29.1	-175.9	168.6	0	0	0	0	111.9	L206 L217 W232 S237 L239	L206-V253 HydrophobicContact CD1-CB 4.44Å; L206-V253 HydrophobicContact CD1-CG1 3.46Å; L206-V253 VanDerWaalsContact CD1-CG1 3.46Å; L206-V253 HydrophobicContact CD1-CG2 4.19Å; L217-V253 HydrophobicContact CD1-CG2 4.22Å; L217-V253 HydrophobicContact CD2-CG2 4.03Å; W232-V253 HydrophobicContact CH2-CG1 4.2Å; W232-V253 HydrophobicContact CH2-CG2 4Å; W232-V253 HydrophobicContact CZ3-CB 4.26Å; W232-V253 HydrophobicContact CZ3-CG1 4.37Å; W232-V253 HydrophobicContact CZ3-CG2 3.72Å; S237-V253 PolarHBondContact O-N 2.87Å; L239-V253 HydrophobicContact CB-CG2 4.03Å
254	E	94.6	Very high	97.5	Very high	122 Å²	122	53.6 Å²	53.6	57%	0.57	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-44.3	174.9	-64.6	177.4	-165.5	0	0	110.5	R193 D252	R193-E254 IonicContact CZ-OE1 3.43Å; R193-E254 IonicContact NH1-OE1 2.66Å; R193-E254 PolarHBondContact NH1-OE1 3.2Å; R193-E254 IonicContact NH2-OE1 3.43Å; R193-E254 PolarHBondContact NH2-OE1 3.47Å; D252-E254 PolarHBondContact OD1-N 3.1Å
255	N	96.1	Very high	97.5	Very high	111 Å²	111	53.4 Å²	53.4	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	4.5	179.3	-63.2	-76.8	0	0	0	113.5	D252 K257	D252-N255 HydrophobicContact CB-CB 4.35Å; D252-N255 VanDerWaalsContact CG-ND2 3.34Å; D252-N255 PolarHBondContact OD1-N 2.86Å; D252-N255 PolarHBondContact OD1-ND2 2.95Å; D252-N255 PolarHBondContact OD2-ND2 3.13Å; N255-K257 VanDerWaalsContact C-N 3.25Å; N255-K257 HydrophobicContact CB-CB 4.36Å; N255-K257 WeakPolarHBondContact O-CB 3.4Å; N255-K257 PolarHBondContact O-N 3.1Å
256	Q	96.1	Very high	97.4	Very high	109 Å²	109	56.9 Å²	56.9	51%	0.509	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	43.8	-178.7	-60.3	-177.4	2.5	0	0	113.7	D252	D252-Q256 CarbonylContact O-C 3.47Å; D252-Q256 VanDerWaalsContact O-CA 3.3Å; D252-Q256 WeakPolarHBondContact O-CA 3.46Å; D252-Q256 PolarHBondContact O-N 3.33Å; D252-Q256 VanDerWaalsContact O-N 3.11Å
257	K	96.9	Very high	97.4	Very high	129 Å²	129	56.7 Å²	56.7	56%	0.561	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.5	-164.4	-176.9	176.4	179.4	-179	0	113.4	W251 D252 N255 L259	W251-K257 VanDerWaalsContact CE3-C 3.49Å; D252-K257 PolarHBondContact N-O 2.96Å; D252-K257 PolarHBondContact O-N 3.27Å; N255-K257 VanDerWaalsContact C-N 3.25Å; N255-K257 HydrophobicContact CB-CB 4.36Å; N255-K257 WeakPolarHBondContact O-CB 3.4Å; N255-K257 PolarHBondContact O-N 3.1Å; K257-L259 PolarHBondContact O-N 3.02Å; K257-L259 VanDerWaalsContact O-N 3.1Å
258	R	98	Very high	97.3	Very high	98 Å²	98	55.1 Å²	55.1	37%	0.37	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	108.2	166.6	-169.9	162.8	67.8	-164.7	-0.8	110	E221 W251	E221-R258 IonicContact OE1-CZ 3.19Å; E221-R258 IonicContact OE1-NH1 3.08Å; E221-R258 PolarHBondContact OE1-NH1 2.92Å; E221-R258 IonicContact OE1-NH2 2.75Å; E221-R258 PolarHBondContact OE1-NH2 2.79Å; W251-R258 HydrophobicContact CD2-CB 3.98Å; W251-R258 HydrophobicContact CE3-CB 4.19Å; W251-R258 VanDerWaalsContact CE3-N 3.28Å; W251-R258 HydrophobicContact CH2-CB 3.93Å; W251-R258 HydrophobicContact CZ2-CB 3.69Å; W251-R258 HydrophobicContact CZ2-CG 4.15Å; W251-R258 HydrophobicContact CZ3-CB 4.17Å
259	L	97.8	Very high	97.3	Very high	81 Å²	81	55.1 Å²	55.1	42%	0.424	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-42.3	174.1	-62.7	-175.7	0	0	0	111.5	Y238 L250 D252 K257	Y238-L259 HydrophobicContact CD1-CD1 3.79Å; Y238-L259 HydrophobicContact CE1-CD1 3.65Å; L250-L259 PolarHBondContact O-N 2.93Å; D252-L259 HydrophobicContact CB-CD1 4.02Å; D252-L259 HydrophobicContact CB-CD2 3.97Å; D252-L259 HydrophobicContact CB-CG 3.85Å; K257-L259 PolarHBondContact O-N 3.02Å; K257-L259 VanDerWaalsContact O-N 3.1Å
260	R	98.2	Very high	97.2	Very high	54 Å²	54	55.7 Å²	55.7	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.7	-177.9	-52.8	-165.4	71.8	173.6	-0.9	111.7	Q249 L250 M262 V293 V295 A296	Q249-R260 WeakPolarHBondContact CA-O 3.41Å; L250-R260 HydrophobicContact CB-CB 4.14Å; L250-R260 PolarHBondContact N-O 3.08Å; L250-R260 PolarHBondContact O-N 3.46Å; R260-M262 HydrophobicContact CB-CG 4.14Å; R260-V293 WeakPolarHBondContact CD-O 3.41Å; R260-V293 PolarHBondContact NH1-O 3.42Å; R260-V295 VanDerWaalsContact CZ-O 3.26Å; R260-V295 PolarHBondContact NH1-O 3.11Å; R260-V295 PolarHBondContact NH2-O 2.81Å; R260-A296 PolarHBondContact NH2-O 2.97Å
261	S	97.9	Very high	97.1	Very high	55 Å²	55	57.5 Å²	57.5	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	102.8	166.4	174.7	0	0	0	0	107
262	M	98.4	Very high	97.1	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.3	-170.7	-63.6	-178.9	-65.5	0	0	110	K247 V248 R260 L279 H291 V293 H298	K247-M262 WeakPolarHBondContact CA-O 3.38Å; V248-M262 HydrophobicContact CB-CB 4.31Å; V248-M262 HydrophobicContact CB-CE 4.06Å; V248-M262 HydrophobicContact CG1-CE 3.76Å; V248-M262 PolarHBondContact N-O 3.45Å; V248-M262 VanDerWaalsContact O-CB 3.28Å; V248-M262 WeakPolarHBondContact O-CB 3.48Å; V248-M262 PolarHBondContact O-N 3Å; R260-M262 HydrophobicContact CB-CG 4.14Å; M262-L279 HydrophobicContact CE-CD2 4.11Å; M262-H291 HydrophobicContact SD-CB 4.26Å; M262-V293 HydrophobicContact CE-CG1 4.22Å; M262-V293 HydrophobicContact SD-CG1 4.4Å; M262-H298 HydrophobicContact CG-CB 4.3Å; M262-H298 HydrophobicContact SD-CB 3.73Å
263	T	97.8	Very high	97.2	Very high	94 Å²	94	60 Å²	60	58%	0.577	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.8	-178.4	45.7	0	0	0	0	109.8	K247	K247-T263 HydrophobicContact CG-CG2 3.81Å
264	S	96.3	Very high	97.2	Very high	31 Å²	31	60.7 Å²	60.7	22%	0.217	32%	0.323	C	S	.	.			trans	-162.8	-28.7	174.2	56.2	0	0	0	0	113	H289 H291 H299	S264-H289 WeakPolarHBondContact CB-ND1 3.41Å; S264-H289 PolarHBondContact O-CE1 2.86Å; S264-H289 PolarHBondContact OG-ND1 2.93Å; S264-H291 PolarHBondContact OG-CE1 3.46Å; S264-H299 WeakPolarHBondContact CB-ND1 3.48Å
265	H	97.1	Very high	97.4	Very high	13 Å²	13	60.5 Å²	60.5	6%	0.06	33%	0.326	C	S	.	.			trans	-77.2	154.6	176.5	-74.6	-64.7	0	0	0	112.4	C246 V269 S281 S283 H289	C246-H265 HydrophobicContact CB-CB 4.39Å; C246-H265 VanDerWaalsContact CB-O 3.31Å; C246-H265 WeakPolarHBondContact CB-O 3.35Å; H265-V269 HydrophobicContact CB-CG2 4.24Å; H265-S281 PolarHBondContact CE1-O 2.91Å; H265-S281 PolarHBondContact NE2-O 2.68Å; H265-S281 VanDerWaalsContact NE2-O 3.07Å; H265-S281 PolarHBondContact NE2-OG 3.19Å; H265-S283 WeakPolarHBondContact ND1-CB 3.28Å; H265-H289 AromaticContact CE1-CD2 3.79Å; H265-H289 AromaticContact CE1-CE1 3.87Å; H265-H289 AromaticContact CE1-CG 3.38Å; H265-H289 AromaticContact CE1-ND1 3.44Å; H265-H289 PolarHBondContact CE1-ND1 2.89Å; H265-H289 AromaticContact CG-ND1 3.91Å; H265-H289 AromaticContact ND1-CE1 3.65Å; H265-H289 AromaticContact ND1-CG 3.94Å; H265-H289 AromaticContact ND1-ND1 3.56Å; H265-H289 AromaticContact NE2-CG 3.71Å; H265-H289 AromaticContact NE2-ND1 3.72Å
266	T	96.2	Very high	97.4	Very high	115 Å²	115	61 Å²	61	71%	0.706	33%	0.328	S	S	*	.	S	Bend	trans	-102.8	-4.9	177.6	50.7	0	0	0	0	113.6	C246	C246-T266 VanDerWaalsContact SG-C 3.6Å
267	A	96.6	Very high	97.5	Very high	26 Å²	26	60.2 Å²	60.2	22%	0.215	32%	0.321	C	S	.	.	S	Bend	trans	-146	167.5	175	0	0	0	0	0	110.9	C246 S283 R284	C246-A267 WeakPolarHBondContact SG-CA 3.29Å; C246-A267 PolarHBondContact SG-N 2.96Å; C246-A267 VanDerWaalsContact SG-N 3.42Å; A267-S283 PolarHBondContact O-OG 2.95Å; A267-R284 HydrophobicContact CB-CB 4.1Å
268	R	96.8	Very high	97.5	Very high	30 Å²	30	55.1 Å²	55.1	11%	0.113	30%	0.3	C	S	.	.			trans	-45.8	140.3	-177.1	73.8	-179.6	-170.4	170.7	6.7	114.1	D182 Y226 T243 S270 S283 R284	D182-R268 IonicContact OD1-NH2 3.97Å; D182-R268 IonicContact OD2-CZ 2.79Å; D182-R268 IonicContact OD2-NH1 3.47Å; D182-R268 PolarHBondContact OD2-NH1 2.91Å; D182-R268 IonicContact OD2-NH2 3.87Å; D182-R268 PolarHBondContact OD2-NH2 3.02Å; Y226-R268 WeakPolarHBondContact OH-CD 3.47Å; Y226-R268 PolarHBondContact OH-NH1 2.81Å; T243-R268 WeakPolarHBondContact O-CA 3.48Å; R268-S270 PolarHBondContact O-N 2.86Å; R268-S283 WeakPolarHBondContact O-CA 3.18Å; R268-S283 PolarHBondContact O-OG 2.79Å; R268-R284 HydrophobicContact CG-CB 3.95Å; R268-R284 PolarHBondContact O-N 2.9Å
269	V	98.3	Very high	97.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	95.1	-178.6	-174.6	0	0	0	0	110.2	C228 S229 T243 V248 H265 L272 G282	C228-V269 CarbonylContact C-O 3.6Å; C228-V269 WeakPolarHBondContact CB-O 3.47Å; S229-V269 PolarHBondContact OG-O 3.44Å; T243-V269 PolarHBondContact O-N 3.13Å; V248-V269 HydrophobicContact CG2-CB 4.46Å; V248-V269 HydrophobicContact CG2-CG1 4.05Å; V248-V269 HydrophobicContact CG2-CG2 3.99Å; H265-V269 HydrophobicContact CB-CG2 4.24Å; V269-L272 HydrophobicContact CG1-CD2 4.08Å; V269-G282 CarbonylContact C-O 3.59Å
270	S	96.1	Very high	97.6	Very high	19 Å²	19	47.8 Å²	47.8	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-14.9	-173.4	43.9	0	0	0	0	114.9	N186 R268 G282	N186-S270 PolarHBondContact ND2-O 3.04Å; R268-S270 PolarHBondContact O-N 2.86Å; S270-G282 PolarHBondContact N-O 2.83Å
271	S	97.3	Very high	97.6	Very high	49 Å²	49	45.2 Å²	45.2	34%	0.343	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.8	176.6	55.8	0	0	0	0	113	S281 G282	S271-S281 WeakPolarHBondContact O-CA 3.27Å; S271-G282 PolarHBondContact N-O 2.87Å; S271-G282 PolarHBondContact O-N 3.1Å; S271-G282 WeakPolarHBondContact OG-CA 3.44Å
272	L	98.6	Very high	97.6	Very high	22 Å²	22	42.9 Å²	42.9	12%	0.115	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.5	178.5	-68.8	169.8	0	0	0	109.2	S229 A240 V248 V269 L279 S280	S229-L272 WeakPolarHBondContact OG-CG 3.4Å; A240-L272 HydrophobicContact CB-CD1 3.81Å; V248-L272 HydrophobicContact CG1-CD2 3.88Å; V248-L272 HydrophobicContact CG2-CD2 4.44Å; V269-L272 HydrophobicContact CG1-CD2 4.08Å; L272-L279 HydrophobicContact CB-CD1 4.25Å; L272-L279 HydrophobicContact CD2-CD1 4.02Å; L272-L279 HydrophobicContact CD2-CD2 4.3Å; L272-L279 HydrophobicContact CD2-CG 4.26Å; L272-S280 CarbonylContact C-O 3.57Å; L272-S280 WeakPolarHBondContact CA-O 3.44Å
273	S	98.4	Very high	97.5	Very high	74 Å²	74	43.3 Å²	43.3	52%	0.517	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	131.2	172.8	-171.8	0	0	0	0	110.8	S280	S273-S280 PolarHBondContact N-O 2.95Å; S273-S280 WeakPolarHBondContact O-CB 3.35Å; S273-S280 PolarHBondContact O-N 2.78Å
274	W	98.4	Very high	97.3	Very high	42 Å²	42	45.6 Å²	45.6	16%	0.159	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	137.9	-179.6	-71.1	98.8	0	0	0	112.6	S231 W232 T233 A240 L250 L279 V293	S231-W274 PolarHBondContact O-NE1 2.83Å; W232-W274 PolarHBondContact O-NE1 2.8Å; T233-W274 HydrophobicContact CG2-CD2 3.94Å; T233-W274 HydrophobicContact CG2-CE3 4.17Å; T233-W274 HydrophobicContact CG2-CH2 3.6Å; T233-W274 HydrophobicContact CG2-CZ2 3.33Å; T233-W274 HydrophobicContact CG2-CZ3 4.02Å; A240-W274 HydrophobicContact CB-CZ2 3.74Å; L250-W274 HydrophobicContact CD1-CH2 3.73Å; L250-W274 HydrophobicContact CD1-CZ2 3.75Å; W274-L279 HydrophobicContact CD2-CB 4.3Å; W274-L279 HydrophobicContact CD2-CD1 3.85Å; W274-L279 HydrophobicContact CE3-CB 3.87Å; W274-L279 HydrophobicContact CE3-CD1 4.3Å; W274-L279 HydrophobicContact CG-CD1 4.16Å; W274-L279 HydrophobicContact CH2-CB 4.17Å; W274-L279 HydrophobicContact CH2-CD2 4.19Å; W274-L279 HydrophobicContact CZ2-CD1 4.28Å; W274-L279 HydrophobicContact CZ2-CD2 4.08Å; W274-L279 HydrophobicContact CZ3-CB 3.8Å; W274-V293 HydrophobicContact CH2-CG1 3.86Å; W274-V293 HydrophobicContact CH2-CG2 4.19Å; W274-V293 HydrophobicContact CZ3-CG1 3.79Å; W274-V293 HydrophobicContact CZ3-CG2 3.96Å
275	N	97.6	Very high	97.2	Very high	118 Å²	118	46 Å²	46	63%	0.631	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	88.3	164.4	-179.7	26.4	0	0	0	108	Y277 I278	N275-Y277 PolarHBondContact O-N 2.87Å; N275-I278 HydrophobicContact CB-CB 4.45Å; N275-I278 PolarHBondContact N-O 2.8Å; N275-I278 WeakPolarHBondContact O-CB 3.37Å; N275-I278 PolarHBondContact O-N 2.87Å
276	D	96.8	Very high	96.9	Very high	121 Å²	121	45.7 Å²	45.7	65%	0.647	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	-116.5	-169.3	-167.4	28.1	0	0	0	111.5
277	Y	97.2	Very high	96.8	Very high	92 Å²	92	43.5 Å²	43.5	36%	0.361	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.4	176.4	58.2	-94.7	0	0	0	114.6	N275 V293 R294	N275-Y277 PolarHBondContact O-N 2.87Å; Y277-V293 PolarHBondContact O-N 2.92Å; Y277-R294 VanDerWaalsContact CD2-NE 3.31Å; Y277-R294 VanDerWaalsContact CG-CZ 3.46Å
278	I	98.4	Very high	96.8	Very high	23 Å²	23	44.5 Å²	44.5	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.7	174.5	-59.4	-57	0	0	0	109.6	N275 H290 H291 D292 I300	N275-I278 HydrophobicContact CB-CB 4.45Å; N275-I278 PolarHBondContact N-O 2.8Å; N275-I278 WeakPolarHBondContact O-CB 3.37Å; N275-I278 PolarHBondContact O-N 2.87Å; I278-H290 HydrophobicContact CG2-CB 4.02Å; I278-H291 CarbonylContact C-O 3.58Å; I278-H291 WeakPolarHBondContact CA-O 3.47Å; I278-D292 HydrophobicContact CD1-CB 3.73Å; I278-I300 HydrophobicContact CD1-CD1 3.65Å
279	L	98.6	Very high	96.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.3	169.7	178.1	57	0	0	0	109.8	A240 V248 M262 L272 W274 H291 V293	A240-L279 HydrophobicContact CB-CD1 4.12Å; A240-L279 HydrophobicContact CB-CD2 3.56Å; V248-L279 HydrophobicContact CG1-CD2 3.54Å; M262-L279 HydrophobicContact CE-CD2 4.11Å; L272-L279 HydrophobicContact CB-CD1 4.25Å; L272-L279 HydrophobicContact CD2-CD1 4.02Å; L272-L279 HydrophobicContact CD2-CD2 4.3Å; L272-L279 HydrophobicContact CD2-CG 4.26Å; W274-L279 HydrophobicContact CD2-CB 4.3Å; W274-L279 HydrophobicContact CD2-CD1 3.85Å; W274-L279 HydrophobicContact CE3-CB 3.87Å; W274-L279 HydrophobicContact CE3-CD1 4.3Å; W274-L279 HydrophobicContact CG-CD1 4.16Å; W274-L279 HydrophobicContact CH2-CB 4.17Å; W274-L279 HydrophobicContact CH2-CD2 4.19Å; W274-L279 HydrophobicContact CZ2-CD1 4.28Å; W274-L279 HydrophobicContact CZ2-CD2 4.08Å; W274-L279 HydrophobicContact CZ3-CB 3.8Å; L279-H291 HydrophobicContact CB-CB 4.31Å; L279-H291 PolarHBondContact N-O 2.89Å; L279-H291 WeakPolarHBondContact O-CB 3.43Å; L279-H291 PolarHBondContact O-N 2.9Å; L279-V293 HydrophobicContact CB-CG1 3.9Å
280	S	98.6	Very high	96.8	Very high	24 Å²	24	46 Å²	46	17%	0.168	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	131.1	169.9	-59.4	0	0	0	0	109.9	L272 S273 H289 H290	L272-S280 CarbonylContact C-O 3.57Å; L272-S280 WeakPolarHBondContact CA-O 3.44Å; S273-S280 PolarHBondContact N-O 2.95Å; S273-S280 WeakPolarHBondContact O-CB 3.35Å; S273-S280 PolarHBondContact O-N 2.78Å; S280-H289 WeakPolarHBondContact CA-O 3.46Å; S280-H290 PolarHBondContact OG-CE1 2.93Å; S280-H290 VanDerWaalsContact OG-CE1 3.26Å; S280-H290 PolarHBondContact OG-ND1 2.96Å
281	S	98.5	Very high	96.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.4	-178.2	61.2	0	0	0	0	111.3	H265 S271 I288 H289 H291	H265-S281 PolarHBondContact CE1-O 2.91Å; H265-S281 PolarHBondContact NE2-O 2.68Å; H265-S281 VanDerWaalsContact NE2-O 3.07Å; H265-S281 PolarHBondContact NE2-OG 3.19Å; S271-S281 WeakPolarHBondContact O-CA 3.27Å; S281-I288 CarbonylContact O-C 3.55Å; S281-I288 VanDerWaalsContact O-CA 3.29Å; S281-I288 WeakPolarHBondContact O-CA 3.31Å; S281-H289 PolarHBondContact N-O 2.73Å; S281-H289 PolarHBondContact O-N 3.4Å; S281-H289 PolarHBondContact OG-O 2.72Å; S281-H291 PolarHBondContact OG-CE1 3.41Å; S281-H291 PolarHBondContact OG-NE2 3.37Å
282	G	97.4	Very high	97	Very high	7 Å²	7	43.4 Å²	43.4	7%	0.072	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.8	179	0	0	0	0	0	112	V269 S270 S271	V269-G282 CarbonylContact C-O 3.59Å; S270-G282 PolarHBondContact N-O 2.83Å; S271-G282 PolarHBondContact N-O 2.87Å; S271-G282 PolarHBondContact O-N 3.1Å; S271-G282 WeakPolarHBondContact OG-CA 3.44Å
283	S	96.4	Very high	97	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	156.3	-179.4	175.3	0	0	0	0	112.6	H265 A267 R268 S285 G286 H287	H265-S283 WeakPolarHBondContact ND1-CB 3.28Å; A267-S283 PolarHBondContact O-OG 2.95Å; R268-S283 WeakPolarHBondContact O-CA 3.18Å; R268-S283 PolarHBondContact O-OG 2.79Å; S283-S285 WeakPolarHBondContact CB-OG 3.42Å; S283-S285 PolarHBondContact O-N 3.24Å; S283-S285 VanDerWaalsContact O-N 3.08Å; S283-S285 PolarHBondContact OG-N 2.92Å; S283-S285 PolarHBondContact OG-OG 2.86Å; S283-G286 PolarHBondContact O-N 2.94Å; S283-H287 PolarHBondContact N-O 2.91Å
284	R	94.8	Very high	96.9	Very high	143 Å²	143	47.3 Å²	47.3	54%	0.54	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-18.3	169.1	-179.9	174	175.1	-176.2	-2.8	113.1	A267 R268 G286	A267-R284 HydrophobicContact CB-CB 4.1Å; R268-R284 HydrophobicContact CG-CB 3.95Å; R268-R284 PolarHBondContact O-N 2.9Å; R284-G286 PolarHBondContact O-N 3.17Å
285	S	93.1	Very high	96.9	Very high	38 Å²	38	48.3 Å²	48.3	27%	0.266	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.6	172.1	61.9	0	0	0	0	114.3	S283 H287	S283-S285 WeakPolarHBondContact CB-OG 3.42Å; S283-S285 PolarHBondContact O-N 3.24Å; S283-S285 VanDerWaalsContact O-N 3.08Å; S283-S285 PolarHBondContact OG-N 2.92Å; S283-S285 PolarHBondContact OG-OG 2.86Å; S285-H287 VanDerWaalsContact C-N 3.28Å; S285-H287 PolarHBondContact OG-N 2.89Å
286	G	90.6	Very high	96.8	Very high	8 Å²	8	46.6 Å²	46.6	8%	0.082	24%	0.239	C	C	.	.	S	Bend	trans	87.1	-8.3	-174.3	0	0	0	0	0	114	S283 R284 H306	S283-G286 PolarHBondContact O-N 2.94Å; R284-G286 PolarHBondContact O-N 3.17Å; G286-H306 WeakPolarHBondContact CA-O 3.45Å
287	H	94.1	Very high	96.9	Very high	69 Å²	69	47.6 Å²	47.6	32%	0.319	24%	0.244	S	C	.	.			trans	-80.8	141.1	173.4	-62.4	-60.8	0	0	0	112.1	S283 S285 T302	S283-H287 PolarHBondContact N-O 2.91Å; S285-H287 VanDerWaalsContact C-N 3.28Å; S285-H287 PolarHBondContact OG-N 2.89Å; H287-T302 HydrophobicContact CB-CG2 4.27Å
288	I	96.4	Very high	96.9	Very high	47 Å²	47	44.2 Å²	44.2	24%	0.241	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.6	164.6	-59.5	167.9	0	0	0	107.5	S281 L303	S281-I288 CarbonylContact O-C 3.55Å; S281-I288 VanDerWaalsContact O-CA 3.29Å; S281-I288 WeakPolarHBondContact O-CA 3.31Å; I288-L303 HydrophobicContact CB-CB 4.26Å; I288-L303 HydrophobicContact CG2-CD1 4.48Å; I288-L303 PolarHBondContact N-O 2.87Å; I288-L303 PolarHBondContact O-N 2.81Å
289	H	97.8	Very high	96.9	Very high	11 Å²	11	46.6 Å²	46.6	5%	0.051	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.2	174.9	-66.3	174.2	0	0	0	110.3	S264 H265 S280 S281 H291 H299 S301 T302	S264-H289 WeakPolarHBondContact CB-ND1 3.41Å; S264-H289 PolarHBondContact O-CE1 2.86Å; S264-H289 PolarHBondContact OG-ND1 2.93Å; H265-H289 AromaticContact CE1-CD2 3.79Å; H265-H289 AromaticContact CE1-CE1 3.87Å; H265-H289 AromaticContact CE1-CG 3.38Å; H265-H289 AromaticContact CE1-ND1 3.44Å; H265-H289 PolarHBondContact CE1-ND1 2.89Å; H265-H289 AromaticContact CG-ND1 3.91Å; H265-H289 AromaticContact ND1-CE1 3.65Å; H265-H289 AromaticContact ND1-CG 3.94Å; H265-H289 AromaticContact ND1-ND1 3.56Å; H265-H289 AromaticContact NE2-CG 3.71Å; H265-H289 AromaticContact NE2-ND1 3.72Å; S280-H289 WeakPolarHBondContact CA-O 3.46Å; S281-H289 PolarHBondContact N-O 2.73Å; S281-H289 PolarHBondContact O-N 3.4Å; S281-H289 PolarHBondContact OG-O 2.72Å; H289-H291 VanDerWaalsContact CB-CE1 3.44Å; H289-H291 WeakPolarHBondContact CB-CE1 3.44Å; H289-H299 AromaticContact CD2-NE2 3.69Å; H289-H299 AromaticContact CE1-CE1 3.61Å; H289-H299 AromaticContact CE1-NE2 3.93Å; H289-H299 AromaticContact CG-CE1 3.97Å; H289-H299 AromaticContact CG-NE2 3.56Å; H289-H299 AromaticContact ND1-CE1 3.65Å; H289-H299 AromaticContact ND1-NE2 3.72Å; H289-H299 AromaticContact NE2-CE1 3.9Å; H289-H299 AromaticContact NE2-NE2 3.92Å; H289-S301 WeakPolarHBondContact CA-O 3.36Å; H289-T302 PolarHBondContact CD2-OG1 2.94Å; H289-T302 PolarHBondContact NE2-OG1 3.41Å
290	H	98.3	Very high	96.8	Very high	49 Å²	49	51.1 Å²	51.1	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138	166.4	-65	-28.1	0	0	0	109.9	I278 S280 I300 S301	I278-H290 HydrophobicContact CG2-CB 4.02Å; S280-H290 PolarHBondContact OG-CE1 2.93Å; S280-H290 VanDerWaalsContact OG-CE1 3.26Å; S280-H290 PolarHBondContact OG-ND1 2.96Å; H290-I300 HydrophobicContact CB-CD1 4.15Å; H290-I300 HydrophobicContact CB-CG1 3.79Å; H290-I300 PolarHBondContact O-N 2.86Å; H290-I300 VanDerWaalsContact O-N 3.11Å; H290-S301 PolarHBondContact CD2-OG 2.9Å; H290-S301 PolarHBondContact N-O 2.83Å
291	H	98.4	Very high	96.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.7	179.6	-55	-27.1	0	0	0	110.4	M262 S264 I278 L279 S281 H289 V293 H298	M262-H291 HydrophobicContact SD-CB 4.26Å; S264-H291 PolarHBondContact OG-CE1 3.46Å; I278-H291 CarbonylContact C-O 3.58Å; I278-H291 WeakPolarHBondContact CA-O 3.47Å; L279-H291 HydrophobicContact CB-CB 4.31Å; L279-H291 PolarHBondContact N-O 2.89Å; L279-H291 WeakPolarHBondContact O-CB 3.43Å; L279-H291 PolarHBondContact O-N 2.9Å; S281-H291 PolarHBondContact OG-CE1 3.41Å; S281-H291 PolarHBondContact OG-NE2 3.37Å; H289-H291 VanDerWaalsContact CB-CE1 3.44Å; H289-H291 WeakPolarHBondContact CB-CE1 3.44Å; H291-V293 PolarHBondContact O-N 3.17Å; H291-H298 CarbonylContact C-O 3.59Å; H291-H298 WeakPolarHBondContact CA-O 3.34Å; H291-H298 HydrophobicContact CB-CB 4.45Å; H291-H298 AromaticContact CG-ND1 3.87Å; H291-H298 AromaticContact ND1-ND1 3.57Å
292	D	98.4	Very high	96.5	Very high	15 Å²	15	55.2 Å²	55.2	8%	0.08	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	107.6	161.8	-176.9	-28.3	0	0	0	107.9	I278 R294 V295 H298 I300	I278-D292 HydrophobicContact CD1-CB 3.73Å; D292-R294 PolarHBondContact O-N 2.88Å; D292-R294 VanDerWaalsContact O-N 3.13Å; D292-R294 VanDerWaalsContact OD1-CB 3.24Å; D292-R294 WeakPolarHBondContact OD1-CB 3.29Å; D292-R294 WeakPolarHBondContact OD1-CG 3.42Å; D292-R294 IonicContact OD1-CZ 2.76Å; D292-R294 PolarHBondContact OD1-N 2.82Å; D292-R294 IonicContact OD1-NE 3.16Å; D292-R294 PolarHBondContact OD1-NE 2.88Å; D292-R294 IonicContact OD1-NH2 3.56Å; D292-R294 IonicContact OD2-CZ 2.68Å; D292-R294 IonicContact OD2-NE 2.72Å; D292-R294 PolarHBondContact OD2-NE 2.92Å; D292-R294 IonicContact OD2-NH2 2.93Å; D292-R294 PolarHBondContact OD2-NH2 3.31Å; D292-V295 HydrophobicContact CB-CG2 3.83Å; D292-H298 PolarHBondContact N-O 3.26Å; D292-I300 HydrophobicContact CB-CG2 4.15Å
293	V	97.9	Very high	96.2	Very high	24 Å²	24	58 Å²	58	15%	0.145	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-3.8	-171.7	-54.5	0	0	0	0	113.5	L250 R260 M262 W274 Y277 L279 H291	L250-V293 HydrophobicContact CD2-CB 4.03Å; L250-V293 HydrophobicContact CD2-CG2 4.23Å; R260-V293 WeakPolarHBondContact CD-O 3.41Å; R260-V293 PolarHBondContact NH1-O 3.42Å; M262-V293 HydrophobicContact CE-CG1 4.22Å; M262-V293 HydrophobicContact SD-CG1 4.4Å; W274-V293 HydrophobicContact CH2-CG1 3.86Å; W274-V293 HydrophobicContact CH2-CG2 4.19Å; W274-V293 HydrophobicContact CZ3-CG1 3.79Å; W274-V293 HydrophobicContact CZ3-CG2 3.96Å; Y277-V293 PolarHBondContact O-N 2.92Å; L279-V293 HydrophobicContact CB-CG1 3.9Å; H291-V293 PolarHBondContact O-N 3.17Å
294	R	97.3	Very high	95.8	Very high	153 Å²	153	58.4 Å²	58.4	58%	0.577	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-29.8	-177.3	-49	168.5	-61.6	175.3	9.2	113	Y277 D292	Y277-R294 VanDerWaalsContact CD2-NE 3.31Å; Y277-R294 VanDerWaalsContact CG-CZ 3.46Å; D292-R294 PolarHBondContact O-N 2.88Å; D292-R294 VanDerWaalsContact O-N 3.13Å; D292-R294 VanDerWaalsContact OD1-CB 3.24Å; D292-R294 WeakPolarHBondContact OD1-CB 3.29Å; D292-R294 WeakPolarHBondContact OD1-CG 3.42Å; D292-R294 IonicContact OD1-CZ 2.76Å; D292-R294 PolarHBondContact OD1-N 2.82Å; D292-R294 IonicContact OD1-NE 3.16Å; D292-R294 PolarHBondContact OD1-NE 2.88Å; D292-R294 IonicContact OD1-NH2 3.56Å; D292-R294 IonicContact OD2-CZ 2.68Å; D292-R294 IonicContact OD2-NE 2.72Å; D292-R294 PolarHBondContact OD2-NE 2.92Å; D292-R294 IonicContact OD2-NH2 2.93Å; D292-R294 PolarHBondContact OD2-NH2 3.31Å
295	V	97.9	Very high	95.2	Very high	63 Å²	63	52.4 Å²	52.4	38%	0.382	29%	0.291	S	S	.	.	S	Bend	trans	-98	152.6	-173.5	-61	0	0	0	0	112.5	R260 D292 N297	R260-V295 VanDerWaalsContact CZ-O 3.26Å; R260-V295 PolarHBondContact NH1-O 3.11Å; R260-V295 PolarHBondContact NH2-O 2.81Å; D292-V295 HydrophobicContact CB-CG2 3.83Å; V295-N297 WeakPolarHBondContact CG2-O 3.39Å
296	A	96.9	Very high	94.8	Very high	83 Å²	83	56.2 Å²	56.2	69%	0.686	31%	0.305	S	S	*	.	S	Bend	trans	-56.8	-56	-177.8	0	0	0	0	0	112.1	R260 H298	R260-A296 PolarHBondContact NH2-O 2.97Å; A296-H298 VanDerWaalsContact C-N 3.3Å; A296-H298 PolarHBondContact O-N 3.06Å
297	N	97.3	Very high	94.2	Very high	141 Å²	141	59.3 Å²	59.3	75%	0.754	33%	0.325	S	S	*	.	S	Bend	trans	-77.6	80	172.6	-66.4	-3.9	0	0	0	109.5	V295 H299	V295-N297 WeakPolarHBondContact CG2-O 3.39Å; N297-H299 VanDerWaalsContact C-N 3.32Å; N297-H299 PolarHBondContact O-N 3.17Å
298	H	98.2	Very high	92.7	Very high	22 Å²	22	61.8 Å²	61.8	10%	0.102	34%	0.336	C	S	.	.			trans	-60.7	-38.5	-173.1	60.3	84.4	0	0	0	113.1	M262 H291 D292 A296 I300	M262-H298 HydrophobicContact CG-CB 4.3Å; M262-H298 HydrophobicContact SD-CB 3.73Å; H291-H298 CarbonylContact C-O 3.59Å; H291-H298 WeakPolarHBondContact CA-O 3.34Å; H291-H298 HydrophobicContact CB-CB 4.45Å; H291-H298 AromaticContact CG-ND1 3.87Å; H291-H298 AromaticContact ND1-ND1 3.57Å; D292-H298 PolarHBondContact N-O 3.26Å; A296-H298 VanDerWaalsContact C-N 3.3Å; A296-H298 PolarHBondContact O-N 3.06Å; H298-I300 PolarHBondContact O-N 2.99Å
299	H	98	Very high	90	Very high	72 Å²	72	67 Å²	67	33%	0.333	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	105	-175.2	-177.7	-169.6	0	0	0	110.6	S264 H289 N297 S301 T302	S264-H299 WeakPolarHBondContact CB-ND1 3.48Å; H289-H299 AromaticContact CD2-NE2 3.69Å; H289-H299 AromaticContact CE1-CE1 3.61Å; H289-H299 AromaticContact CE1-NE2 3.93Å; H289-H299 AromaticContact CG-CE1 3.97Å; H289-H299 AromaticContact CG-NE2 3.56Å; H289-H299 AromaticContact ND1-CE1 3.65Å; H289-H299 AromaticContact ND1-NE2 3.72Å; H289-H299 AromaticContact NE2-CE1 3.9Å; H289-H299 AromaticContact NE2-NE2 3.92Å; N297-H299 VanDerWaalsContact C-N 3.32Å; N297-H299 PolarHBondContact O-N 3.17Å; H299-S301 PolarHBondContact CD2-O 2.95Å; H299-S301 VanDerWaalsContact CD2-O 3.26Å; H299-S301 PolarHBondContact NE2-O 3.13Å; H299-T302 PolarHBondContact CE1-OG1 2.92Å; H299-T302 VanDerWaalsContact CE1-OG1 3.31Å; H299-T302 PolarHBondContact NE2-OG1 2.82Å
300	I	96.6	Very high	87.2	Confident	95 Å²	95	76.4 Å²	76.4	49%	0.487	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-24	-175.8	59.2	167.5	0	0	0	114	I278 H290 D292 H298	I278-I300 HydrophobicContact CD1-CD1 3.65Å; H290-I300 HydrophobicContact CB-CD1 4.15Å; H290-I300 HydrophobicContact CB-CG1 3.79Å; H290-I300 PolarHBondContact O-N 2.86Å; H290-I300 VanDerWaalsContact O-N 3.11Å; D292-I300 HydrophobicContact CB-CG2 4.15Å; H298-I300 PolarHBondContact O-N 2.99Å
301	S	94.9	Very high	84.2	Confident	45 Å²	45	76.3 Å²	76.3	32%	0.315	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	160.6	175.3	67.8	0	0	0	0	113.1	H289 H290 H299	H289-S301 WeakPolarHBondContact CA-O 3.36Å; H290-S301 PolarHBondContact CD2-OG 2.9Å; H290-S301 PolarHBondContact N-O 2.83Å; H299-S301 PolarHBondContact CD2-O 2.95Å; H299-S301 VanDerWaalsContact CD2-O 3.26Å; H299-S301 PolarHBondContact NE2-O 3.13Å
302	T	94.9	Very high	81.5	Confident	65 Å²	65	82.5 Å²	82.5	40%	0.399	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.2	171.9	-67.4	0	0	0	0	109.8	H287 H289 H299	H287-T302 HydrophobicContact CB-CG2 4.27Å; H289-T302 PolarHBondContact CD2-OG1 2.94Å; H289-T302 PolarHBondContact NE2-OG1 3.41Å; H299-T302 PolarHBondContact CE1-OG1 2.92Å; H299-T302 VanDerWaalsContact CE1-OG1 3.31Å; H299-T302 PolarHBondContact NE2-OG1 2.82Å
303	L	91.9	Very high	79.3	Confident	65 Å²	65	84 Å²	84	34%	0.34	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.3	171	-61.7	169.2	0	0	0	108.6	I288	I288-L303 HydrophobicContact CB-CB 4.26Å; I288-L303 HydrophobicContact CG2-CD1 4.48Å; I288-L303 PolarHBondContact N-O 2.87Å; I288-L303 PolarHBondContact O-N 2.81Å
304	A	88.7	Confident	76.9	Confident	18 Å²	18	90.4 Å²	90.4	15%	0.149	50%	0.504	C	S	.	.			trans	-108.7	63.1	179.4	0	0	0	0	0	111	S313	A304-S313 VanDerWaalsContact O-CB 3.31Å; A304-S313 WeakPolarHBondContact O-CB 3.47Å; A304-S313 PolarHBondContact O-OG 2.82Å; A304-S313 VanDerWaalsContact O-OG 3.05Å
305	G	82.8	Confident	74.9	Confident	17 Å²	17	85.9 Å²	85.9	18%	0.175	50%	0.496	C	S	.	.			trans	-94.8	-8.3	-176.6	0	0	0	0	0	115.6
306	H	84.5	Confident	72.6	Confident	119 Å²	119	91.5 Å²	91.5	55%	0.551	52%	0.524	S	S	*	.			trans	-133	138.9	-173.6	-51.3	-80.2	0	0	0	111.4	G286	G286-H306 WeakPolarHBondContact CA-O 3.45Å
307	S	76.9	Confident	70.8	Confident	72 Å²	72	89.1 Å²	89.1	50%	0.503	51%	0.508	S	S	.	.			trans	-129.7	108.1	170.9	56.3	0	0	0	0	107.2	G311	S307-G311 WeakPolarHBondContact CB-O 3.23Å
308	Q	62.8	Low	69.2	Low	121 Å²	121	91.5 Å²	91.5	57%	0.565	52%	0.515	S	S	*	.	S	Bend	trans	-88.1	-26.4	-178.7	-165.6	165.9	8.9	0	0	112.6
309	E	40.5	Very low	68.2	Low	157 Å²	157	95 Å²	95	73%	0.734	53%	0.533	S	S	*	.	S	Bend	trans	-134.1	-178.9	164.1	-83.4	166.1	133.4	0	0	107.9	G311	E309-G311 PolarHBondContact O-N 2.88Å
310	E	38.4	Very low	67.5	Low	209 Å²	209	98.2 Å²	98.2	98%	0.977	55%	0.552	S	S	*	*	S	Bend	trans	-55	124.5	-161.3	-60.8	-169.8	147.3	0	0	115.7
311	G	35.8	Very low	67	Low	47 Å²	47	99.8 Å²	99.8	49%	0.485	55%	0.551	S	S	.	*			trans	170.6	114.4	172.2	0	0	0	0	0	112.3	S307 E309 S313	S307-G311 WeakPolarHBondContact CB-O 3.23Å; E309-G311 PolarHBondContact O-N 2.88Å; G311-S313 PolarHBondContact O-N 2.96Å
312	S	41.6	Very low	66.8	Low	130 Å²	130	107 Å²	107	91%	0.909	57%	0.572	S	S	*	*			trans	-77.1	108.8	175.8	-168.6	0	0	0	0	110.1	N314	S312-N314 PolarHBondContact O-N 2.91Å; S312-N314 VanDerWaalsContact O-N 3.09Å
313	S	51.8	Low	66.6	Low	45 Å²	45	107 Å²	107	32%	0.315	57%	0.569	S	S	.	*			trans	-81.7	89	-172.9	58.9	0	0	0	0	113.1	A304 G311 S315	A304-S313 VanDerWaalsContact O-CB 3.31Å; A304-S313 WeakPolarHBondContact O-CB 3.47Å; A304-S313 PolarHBondContact O-OG 2.82Å; A304-S313 VanDerWaalsContact O-OG 3.05Å; G311-S313 PolarHBondContact O-N 2.96Å; S313-S315 PolarHBondContact O-N 2.82Å; S313-S315 PolarHBondContact O-OG 3.16Å
314	N	47.1	Very low	66.6	Low	159 Å²	159	108.5 Å²	108.5	85%	0.85	59%	0.585	S	S	*	*			trans	-56.9	124.3	162.2	-138.5	30.5	0	0	0	108.3	S312	S312-N314 PolarHBondContact O-N 2.91Å; S312-N314 VanDerWaalsContact O-N 3.09Å
315	S	55.6	Low	66.9	Low	58 Å²	58	112.1 Å²	112.1	41%	0.406	60%	0.599	S	S	.	*			trans	-137.3	107.8	-164.9	30.9	0	0	0	0	112.7	S313 G317	S313-S315 PolarHBondContact O-N 2.82Å; S313-S315 PolarHBondContact O-OG 3.16Å; S315-G317 PolarHBondContact O-N 2.97Å
316	D	50.4	Low	67.5	Low	181 Å²	181	112.4 Å²	112.4	97%	0.968	60%	0.596	S	S	*	*	S	Bend	trans	-72.9	18.3	175.9	-59.7	-51.7	0	0	0	113.9
317	G	57.3	Low	68	Low	34 Å²	34	113.1 Å²	113.1	35%	0.351	60%	0.599	S	S	.	*	S	Bend	trans	-134.5	113.3	-178.5	0	0	0	0	0	111	S315 L319	S315-G317 PolarHBondContact O-N 2.97Å; G317-L319 PolarHBondContact O-N 2.83Å; G317-L319 VanDerWaalsContact O-N 3.09Å
318	Q	63.9	Low	68.9	Low	191 Å²	191	111 Å²	111	89%	0.893	59%	0.588	S	S	*	*			trans	-70.6	106	-174.1	-168	175.4	24	0	0	111.8	I320	Q318-I320 PolarHBondContact O-N 3.48Å
319	L	77.4	Confident	70.4	Confident	94 Å²	94	106.9 Å²	106.9	49%	0.492	58%	0.575	S	S	.	*			trans	-61.3	118.4	174.5	-66.5	171.5	0	0	0	110.8	G317 R321	G317-L319 PolarHBondContact O-N 2.83Å; G317-L319 VanDerWaalsContact O-N 3.09Å; L319-R321 PolarHBondContact O-N 2.79Å
320	I	84.6	Confident	73.1	Confident	141 Å²	141	102.3 Å²	102.3	72%	0.723	56%	0.558	S	S	*	*	S	Bend	trans	-66.3	-39.1	-177.1	-52.5	177.5	0	0	0	111.4	Q318	Q318-I320 PolarHBondContact O-N 3.48Å
321	R	86.1	Confident	75.9	Confident	127 Å²	127	93.8 Å²	93.8	48%	0.479	52%	0.517	S	S	.	.			trans	-145.5	148.9	178.3	-59.7	-65.9	174.1	-113.6	10.1	110.2	L319 V359 N360	L319-R321 PolarHBondContact O-N 2.79Å; R321-V359 PolarHBondContact NE-O 3.34Å; R321-N360 PolarHBondContact NH2-O 3.24Å
322	R	89.6	Confident	78.8	Confident	198 Å²	198	91.6 Å²	91.6	75%	0.747	50%	0.495	S	S	*	.			trans	-127.8	125.5	165.8	-176.9	173.9	-178.8	150.5	0.3	107.7
323	L	91.5	Very high	81.5	Confident	63 Å²	63	90.3 Å²	90.3	33%	0.33	48%	0.477	S	S	.	.			trans	-117.2	96.4	-172.7	-56.5	176.8	0	0	0	108.8	W357	L323-W357 HydrophobicContact CB-CH2 3.83Å; L323-W357 HydrophobicContact CB-CZ2 4.14Å; L323-W357 HydrophobicContact CB-CZ3 4.09Å; L323-W357 HydrophobicContact CD1-CD2 3.78Å; L323-W357 HydrophobicContact CD1-CE3 3.87Å; L323-W357 HydrophobicContact CD1-CG 4.09Å; L323-W357 HydrophobicContact CD1-CH2 4.5Å; L323-W357 HydrophobicContact CD1-CZ2 4.49Å; L323-W357 HydrophobicContact CD1-CZ3 4.24Å; L323-W357 HydrophobicContact CD2-CE3 3.94Å; L323-W357 HydrophobicContact CD2-CH2 4.41Å; L323-W357 HydrophobicContact CD2-CZ3 3.79Å; L323-W357 HydrophobicContact CG-CE3 4.33Å; L323-W357 HydrophobicContact CG-CH2 4.46Å; L323-W357 HydrophobicContact CG-CZ3 4.24Å
324	S	91.9	Very high	83.7	Confident	98 Å²	98	88.6 Å²	88.6	69%	0.685	47%	0.466	S	S	*	.			trans	-101.4	17.7	-167.9	53.9	0	0	0	0	114.9
325	E	94.3	Very high	86.1	Confident	93 Å²	93	88.5 Å²	88.5	44%	0.435	45%	0.454	S	S	.	.			trans	-74.5	-24.2	-176.6	-76.2	-78.4	129.5	0	0	114.5	Q327 R355 W357	E325-Q327 PolarHBondContact O-NE2 2.78Å; E325-R355 PolarHBondContact O-NH2 2.88Å; E325-R355 VanDerWaalsContact O-NH2 3.07Å; E325-R355 IonicContact OE2-CZ 3.77Å; E325-R355 VanDerWaalsContact OE2-CZ 3.29Å; E325-R355 IonicContact OE2-NH1 2.64Å; E325-R355 PolarHBondContact OE2-NH1 2.86Å; E325-R355 IonicContact OE2-NH2 3.29Å; E325-R355 PolarHBondContact OE2-NH2 3.03Å; E325-R355 VanDerWaalsContact OE2-NH2 3.16Å; E325-W357 HydrophobicContact CB-CH2 3.68Å; E325-W357 HydrophobicContact CB-CZ2 4.23Å; E325-W357 HydrophobicContact CG-CH2 3.58Å; E325-W357 HydrophobicContact CG-CZ3 4.22Å
326	H	96.3	Very high	88.1	Confident	24 Å²	24	86 Å²	86	11%	0.111	44%	0.436	C	S	.	.			trans	-79.2	129	-178.4	-77.2	-73.7	0	0	0	111.4	G328 V330 S345 D351 H353	H326-G328 PolarHBondContact O-N 3.26Å; H326-V330 HydrophobicContact CB-CG2 3.58Å; H326-V330 VanDerWaalsContact CD2-CG2 3.48Å; H326-V330 WeakPolarHBondContact CD2-CG2 3.42Å; H326-S345 PolarHBondContact NE2-OG 3.5Å; H326-D351 VanDerWaalsContact CA-OD1 3.22Å; H326-D351 WeakPolarHBondContact CA-OD1 3.34Å; H326-D351 IonicContact CE1-OD2 2.88Å; H326-D351 IonicContact CG-OD1 3.82Å; H326-D351 IonicContact CG-OD2 2.83Å; H326-D351 VanDerWaalsContact ND1-CG 3.32Å; H326-D351 IonicContact ND1-OD1 3.66Å; H326-D351 PolarHBondContact ND1-OD1 3.34Å; H326-D351 IonicContact ND1-OD2 3.58Å; H326-D351 PolarHBondContact ND1-OD2 3.37Å; H326-H353 PolarHBondContact CE1-O 3.29Å
327	Q	95.4	Very high	90.3	Very high	133 Å²	133	81.7 Å²	81.7	62%	0.621	42%	0.418	S	S	*	.	S	Bend	trans	-88.6	27.5	-177.1	-53.5	-52.3	-59.5	0	0	113.1	E325 S350 D351	E325-Q327 PolarHBondContact O-NE2 2.78Å; Q327-S350 WeakPolarHBondContact O-CB 3.46Å; Q327-D351 HydrophobicContact CB-CB 4.31Å; Q327-D351 PolarHBondContact N-OD1 3.45Å
328	G	94	Very high	92.2	Very high	27 Å²	27	82.9 Å²	82.9	28%	0.278	41%	0.412	S	S	.	.	S	Bend	trans	-177.8	177	-175.2	0	0	0	0	0	112.5	H326 V330	H326-G328 PolarHBondContact O-N 3.26Å; G328-V330 PolarHBondContact O-N 3.41Å
329	A	94.7	Very high	93.7	Very high	35 Å²	35	77.5 Å²	77.5	29%	0.289	39%	0.387	S	S	.	.			trans	-57.6	129.4	-177.6	0	0	0	0	0	112.2	F183 Y184 G348	F183-A329 HydrophobicContact CE1-CB 4.42Å; Y184-A329 HydrophobicContact CE1-CB 3.87Å; A329-G348 PolarHBondContact O-N 2.86Å
330	V	97.1	Very high	94.6	Very high	61 Å²	61	78.4 Å²	78.4	37%	0.37	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	106.8	175.9	-178.5	0	0	0	0	108.6	H326 G328 L333	H326-V330 HydrophobicContact CB-CG2 3.58Å; H326-V330 VanDerWaalsContact CD2-CG2 3.48Å; H326-V330 WeakPolarHBondContact CD2-CG2 3.42Å; G328-V330 PolarHBondContact O-N 3.41Å; V330-L333 HydrophobicContact CG1-CD2 3.8Å; V330-L333 HydrophobicContact CG1-CG 4.23Å
331	K	96.9	Very high	95.1	Very high	30 Å²	30	73.8 Å²	73.8	13%	0.13	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-48.2	173.6	171.6	-173.3	171.8	67	0	110.9	F183 L185 N186 L333 S375 L419	F183-K331 HydrophobicContact CD1-CD 4.23Å; F183-K331 HydrophobicContact CD2-CD 4.23Å; F183-K331 HydrophobicContact CE1-CB 3.69Å; F183-K331 HydrophobicContact CE1-CD 4Å; F183-K331 HydrophobicContact CE2-CD 4.02Å; F183-K331 HydrophobicContact CG-CD 4.35Å; F183-K331 HydrophobicContact CZ-CB 3.73Å; F183-K331 HydrophobicContact CZ-CD 3.9Å; F183-K331 WeakPolarHBondContact O-CD 3.4Å; F183-K331 WeakPolarHBondContact O-CE 3.38Å; F183-K331 PolarHBondContact O-NZ 3.19Å; L185-K331 PolarHBondContact O-NZ 3.31Å; N186-K331 PolarHBondContact OD1-NZ 2.79Å; K331-L333 PolarHBondContact O-N 2.82Å; K331-S375 WeakPolarHBondContact CD-O 3.39Å; K331-S375 WeakPolarHBondContact CE-O 3.43Å; K331-S375 VanDerWaalsContact CG-O 3.32Å; K331-S375 WeakPolarHBondContact CG-O 3.47Å; K331-L419 WeakPolarHBondContact CE-O 3.19Å
332	A	97.6	Very high	95.7	Very high	2 Å²	2	68.1 Å²	68.1	2%	0.017	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	115.5	-176.1	0	0	0	0	0	109.6	S345 G346 I374 L377	A332-S345 CarbonylContact O-C 3.55Å; A332-S345 VanDerWaalsContact O-CA 3.25Å; A332-S345 WeakPolarHBondContact O-CA 3.38Å; A332-G346 PolarHBondContact O-N 2.91Å; A332-I374 HydrophobicContact CB-CG2 3.71Å; A332-L377 HydrophobicContact CB-CB 4.13Å; A332-L377 HydrophobicContact CB-CD1 3.86Å; A332-L377 HydrophobicContact CB-CG 3.8Å
333	L	97.9	Very high	96.1	Very high	102 Å²	102	59.7 Å²	59.7	53%	0.534	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	127.8	178.8	-69.7	173.8	0	0	0	108.6	V330 K331 L343 A344	V330-L333 HydrophobicContact CG1-CD2 3.8Å; V330-L333 HydrophobicContact CG1-CG 4.23Å; K331-L333 PolarHBondContact O-N 2.82Å; L333-L343 HydrophobicContact CD2-CD1 4.49Å; L333-A344 WeakPolarHBondContact CA-O 3.38Å
334	A	98.2	Very high	96.4	Very high	10 Å²	10	56.7 Å²	56.7	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	123.4	179.2	0	0	0	0	0	111.3	A344 L377 F379	A334-A344 PolarHBondContact N-O 3.02Å; A334-A344 PolarHBondContact O-N 3.45Å; A334-L377 HydrophobicContact CB-CB 3.95Å; A334-F379 HydrophobicContact CB-CD2 3.94Å; A334-F379 HydrophobicContact CB-CE2 4.3Å; A334-F379 WeakPolarHBondContact O-CE2 3.37Å
335	W	97.9	Very high	96.7	Very high	157 Å²	157	52.2 Å²	52.2	60%	0.595	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	142.3	169.7	-71.8	100.3	0	0	0	110.6	P337 L343 V359 F379	W335-P337 VanDerWaalsContact O-CD 3.29Å; W335-P337 WeakPolarHBondContact O-CD 3.33Å; W335-L343 HydrophobicContact CD2-CD1 3.98Å; W335-L343 HydrophobicContact CE3-CB 4.11Å; W335-L343 HydrophobicContact CE3-CD1 4.4Å; W335-L343 HydrophobicContact CG-CD1 4.28Å; W335-L343 HydrophobicContact CH2-CB 4.41Å; W335-L343 HydrophobicContact CZ2-CD1 4.38Å; W335-L343 HydrophobicContact CZ3-CB 4.05Å; W335-V359 HydrophobicContact CH2-CB 4.36Å; W335-V359 HydrophobicContact CH2-CG1 3.77Å; W335-V359 HydrophobicContact CH2-CG2 3.99Å; W335-V359 HydrophobicContact CZ3-CB 4.48Å; W335-V359 HydrophobicContact CZ3-CG1 3.82Å; W335-V359 HydrophobicContact CZ3-CG2 3.88Å; W335-F379 WeakPolarHBondContact O-CD2 3.42Å
336	C	97.8	Very high	96.9	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.034	26%	0.259	C	S	.	.			trans	-80.3	111.3	179.4	-177	0	0	0	0	111	W338 Q339 I342 F379	C336-W338 PolarHBondContact O-N 2.78Å; C336-W338 PolarHBondContact SG-NE1 2.94Å; C336-W338 VanDerWaalsContact SG-NE1 3.42Å; C336-Q339 HydrophobicContact CB-CB 4.35Å; C336-Q339 CarbonylContact O-C 3.58Å; C336-Q339 PolarHBondContact O-N 2.74Å; C336-Q339 VanDerWaalsContact O-N 3.07Å; C336-I342 HydrophobicContact CB-CB 3.72Å; C336-I342 HydrophobicContact CB-CG2 3.81Å; C336-I342 WeakPolarHBondContact CB-O 3.44Å; C336-I342 PolarHBondContact N-O 3.4Å; C336-F379 HydrophobicContact CB-CD2 4.08Å; C336-F379 HydrophobicContact CB-CE1 4.36Å; C336-F379 HydrophobicContact CB-CE2 3.79Å; C336-F379 HydrophobicContact CB-CG 4.47Å; C336-F379 HydrophobicContact CB-CZ 3.93Å
337	P	96.3	Very high	96.9	Very high	90 Å²	90	46.7 Å²	46.7	58%	0.584	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	0.5	-171.6	28.9	-33	0	0	0	114	W335 F379 P381	W335-P337 VanDerWaalsContact O-CD 3.29Å; W335-P337 WeakPolarHBondContact O-CD 3.33Å; P337-F379 VanDerWaalsContact CD-CB 3.47Å; P337-F379 HydrophobicContact CG-CB 4.2Å; P337-P381 HydrophobicContact CG-CB 4.49Å
338	W	96.2	Very high	96.9	Very high	59 Å²	59	40.5 Å²	40.5	22%	0.223	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	1.4	171.9	61.4	81.5	0	0	0	114.3	C336 F379 P381 K384 Y402	C336-W338 PolarHBondContact O-N 2.78Å; C336-W338 PolarHBondContact SG-NE1 2.94Å; C336-W338 VanDerWaalsContact SG-NE1 3.42Å; W338-F379 HydrophobicContact CH2-CB 3.87Å; W338-F379 AromaticContact CH2-CD1 3.57Å; W338-F379 HydrophobicContact CH2-CD1 3.57Å; W338-F379 HydrophobicContact CH2-CE1 4.49Å; W338-F379 HydrophobicContact CH2-CG 4.12Å; W338-F379 AromaticContact CZ2-CD1 3.85Å; W338-F379 HydrophobicContact CZ2-CD1 3.85Å; W338-F379 HydrophobicContact CZ2-CE1 4.35Å; W338-F379 HydrophobicContact CZ3-CB 3.96Å; W338-F379 HydrophobicContact CZ3-CD1 4.43Å; W338-P381 HydrophobicContact CE3-CB 4.08Å; W338-P381 HydrophobicContact CZ3-CB 4.02Å; W338-K384 HydrophobicContact CD2-CD 4.28Å; W338-K384 HydrophobicContact CD2-CG 4.04Å; W338-K384 HydrophobicContact CE3-CG 4.31Å; W338-K384 HydrophobicContact CG-CD 4.39Å; W338-K384 HydrophobicContact CH2-CB 4.12Å; W338-K384 HydrophobicContact CH2-CG 4.35Å; W338-K384 HydrophobicContact CZ2-CB 3.79Å; W338-K384 HydrophobicContact CZ2-CG 4.06Å; W338-K384 HydrophobicContact CZ3-CG 4.48Å; W338-Y402 AromaticContact CZ2-CD1 3.77Å; W338-Y402 HydrophobicContact CZ2-CD1 3.77Å; W338-Y402 HydrophobicContact CZ2-CE1 4.43Å; W338-Y402 HydrophobicContact CZ2-CG 4.2Å; W338-Y402 AromaticContact NE1-CD1 3.88Å; W338-Y402 AromaticContact NE1-CE1 3.88Å
339	Q	96.2	Very high	96.9	Very high	79 Å²	79	43.1 Å²	43.1	37%	0.369	24%	0.237	S	C	.	.			trans	-146.7	96.3	174.4	-76	171.3	6.2	0	0	109.2	C336 N341 I342 Y402	C336-Q339 HydrophobicContact CB-CB 4.35Å; C336-Q339 CarbonylContact O-C 3.58Å; C336-Q339 PolarHBondContact O-N 2.74Å; C336-Q339 VanDerWaalsContact O-N 3.07Å; Q339-N341 PolarHBondContact O-N 3.11Å; Q339-N341 VanDerWaalsContact O-N 3.1Å; Q339-I342 HydrophobicContact CB-CB 4.1Å; Q339-I342 HydrophobicContact CB-CG1 3.8Å; Q339-I342 PolarHBondContact O-N 3.36Å; Q339-Y402 PolarHBondContact OE1-OH 3.14Å
340	S	95.7	Very high	96.9	Very high	112 Å²	112	45.7 Å²	45.7	78%	0.783	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.1	-172.7	52.2	0	0	0	0	115	I342	S340-I342 VanDerWaalsContact C-N 3.35Å
341	N	95.7	Very high	96.9	Very high	44 Å²	44	43 Å²	43	24%	0.235	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.8	176.7	70.7	-58.7	0	0	0	113.8	Q339 N358 V359	Q339-N341 PolarHBondContact O-N 3.11Å; Q339-N341 VanDerWaalsContact O-N 3.1Å; N341-N358 VanDerWaalsContact ND2-CG 3.29Å; N341-N358 PolarHBondContact ND2-OD1 3.27Å; N341-N358 CarbonylContact O-C 3.59Å; N341-N358 WeakPolarHBondContact O-CA 3.5Å; N341-V359 PolarHBondContact O-N 3.07Å
342	I	97.7	Very high	96.9	Very high	8 Å²	8	45 Å²	45	4%	0.041	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.3	-178.4	-61.7	-58.7	0	0	0	112.1	C336 Q339 S340 I356 W357 N358 F379	C336-I342 HydrophobicContact CB-CB 3.72Å; C336-I342 HydrophobicContact CB-CG2 3.81Å; C336-I342 WeakPolarHBondContact CB-O 3.44Å; C336-I342 PolarHBondContact N-O 3.4Å; Q339-I342 HydrophobicContact CB-CB 4.1Å; Q339-I342 HydrophobicContact CB-CG1 3.8Å; Q339-I342 PolarHBondContact O-N 3.36Å; S340-I342 VanDerWaalsContact C-N 3.35Å; I342-I356 HydrophobicContact CG2-CG2 3.83Å; I342-W357 WeakPolarHBondContact CA-O 3.48Å; I342-W357 WeakPolarHBondContact CD1-O 3.48Å; I342-N358 HydrophobicContact CD1-CB 4.23Å; I342-F379 HydrophobicContact CG2-CZ 4.3Å
343	L	98.1	Very high	96.9	Very high	21 Å²	21	47.1 Å²	47.1	11%	0.11	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.3	171.3	176.1	66.9	0	0	0	108.9	L333 W335 W357 V359	L333-L343 HydrophobicContact CD2-CD1 4.49Å; W335-L343 HydrophobicContact CD2-CD1 3.98Å; W335-L343 HydrophobicContact CE3-CB 4.11Å; W335-L343 HydrophobicContact CE3-CD1 4.4Å; W335-L343 HydrophobicContact CG-CD1 4.28Å; W335-L343 HydrophobicContact CH2-CB 4.41Å; W335-L343 HydrophobicContact CZ2-CD1 4.38Å; W335-L343 HydrophobicContact CZ3-CB 4.05Å; L343-W357 HydrophobicContact CB-CB 4.41Å; L343-W357 PolarHBondContact N-O 3.07Å; L343-W357 VanDerWaalsContact N-O 3.16Å; L343-W357 PolarHBondContact O-N 2.75Å; L343-V359 HydrophobicContact CB-CG1 3.77Å; L343-V359 HydrophobicContact CD2-CG1 4.31Å
344	A	98.4	Very high	96.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	139.6	164.1	0	0	0	0	0	109.6	L333 A334 R355 I356 L377 F379 L386	L333-A344 WeakPolarHBondContact CA-O 3.38Å; A334-A344 PolarHBondContact N-O 3.02Å; A334-A344 PolarHBondContact O-N 3.45Å; A344-R355 CarbonylContact C-O 3.56Å; A344-R355 WeakPolarHBondContact CA-O 3.33Å; A344-I356 HydrophobicContact CB-CD1 3.64Å; A344-L377 HydrophobicContact CB-CD1 4.31Å; A344-F379 HydrophobicContact CB-CE2 3.6Å; A344-F379 HydrophobicContact CB-CZ 3.78Å; A344-L386 HydrophobicContact CB-CD1 4.11Å; A344-L386 HydrophobicContact CB-CD2 4.4Å
345	S	98.4	Very high	96.9	Very high	5 Å²	5	43 Å²	43	4%	0.035	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.1	173.2	62.1	0	0	0	0	111.8	H326 A332 I354 R355 W357	H326-S345 PolarHBondContact NE2-OG 3.5Å; A332-S345 CarbonylContact O-C 3.55Å; A332-S345 VanDerWaalsContact O-CA 3.25Å; A332-S345 WeakPolarHBondContact O-CA 3.38Å; S345-I354 WeakPolarHBondContact O-CA 3.27Å; S345-R355 PolarHBondContact N-O 2.8Å; S345-R355 PolarHBondContact O-N 3.36Å; S345-W357 PolarHBondContact OG-NE1 2.87Å
346	G	98.1	Very high	96.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.6	-179.7	0	0	0	0	0	111.8	A332 H353	A332-G346 PolarHBondContact O-N 2.91Å; G346-H353 WeakPolarHBondContact CA-O 3.47Å
347	G	96.9	Very high	96.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	152.8	179.9	0	0	0	0	0	114.5	D351 H353 I374	G347-D351 WeakPolarHBondContact CA-OD2 3.49Å; G347-H353 PolarHBondContact N-O 2.89Å; G347-H353 VanDerWaalsContact N-O 3.11Å; G347-I374 PolarHBondContact O-N 3.13Å
348	G	95.7	Very high	96.9	Very high	4 Å²	4	33.4 Å²	33.4	4%	0.041	18%	0.182	C	C	.	.			trans	-68.2	-170.9	171.5	0	0	0	0	0	113.9	A329 S350 D351 R352	A329-G348 PolarHBondContact O-N 2.86Å; G348-S350 VanDerWaalsContact C-N 3.3Å; G348-S350 PolarHBondContact O-N 2.93Å; G348-S350 VanDerWaalsContact O-N 3.12Å; G348-D351 PolarHBondContact O-N 3.31Å; G348-R352 PolarHBondContact O-N 2.84Å
349	T	94.3	Very high	96.8	Very high	81 Å²	81	32 Å²	32	50%	0.497	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-35.2	-166.6	-40.4	0	0	0	0	115.3	D351 R352	T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 2.99Å; T349-R352 VanDerWaalsContact O-CG 3.26Å; T349-R352 WeakPolarHBondContact O-CG 3.41Å; T349-R352 PolarHBondContact O-NH1 2.83Å
350	S	94.6	Very high	96.7	Very high	89 Å²	89	33.6 Å²	33.6	62%	0.622	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-29.2	176.6	-50.6	0	0	0	0	113.2	Q327 G348 R352	Q327-S350 WeakPolarHBondContact O-CB 3.46Å; G348-S350 VanDerWaalsContact C-N 3.3Å; G348-S350 PolarHBondContact O-N 2.93Å; G348-S350 VanDerWaalsContact O-N 3.12Å; S350-R352 PolarHBondContact O-NH1 2.82Å
351	D	96.6	Very high	96.6	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.027	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-54.1	-171.2	177.8	87.6	0	0	0	113.5	H326 Q327 G347 G348 T349 H353	H326-D351 VanDerWaalsContact CA-OD1 3.22Å; H326-D351 WeakPolarHBondContact CA-OD1 3.34Å; H326-D351 IonicContact CE1-OD2 2.88Å; H326-D351 IonicContact CG-OD1 3.82Å; H326-D351 IonicContact CG-OD2 2.83Å; H326-D351 VanDerWaalsContact ND1-CG 3.32Å; H326-D351 IonicContact ND1-OD1 3.66Å; H326-D351 PolarHBondContact ND1-OD1 3.34Å; H326-D351 IonicContact ND1-OD2 3.58Å; H326-D351 PolarHBondContact ND1-OD2 3.37Å; Q327-D351 HydrophobicContact CB-CB 4.31Å; Q327-D351 PolarHBondContact N-OD1 3.45Å; G347-D351 WeakPolarHBondContact CA-OD2 3.49Å; G348-D351 PolarHBondContact O-N 3.31Å; T349-D351 VanDerWaalsContact C-N 3.3Å; T349-D351 PolarHBondContact O-N 2.99Å; D351-H353 PolarHBondContact O-N 3.47Å; D351-H353 VanDerWaalsContact O-N 3.09Å; D351-H353 PolarHBondContact O-ND1 2.79Å; D351-H353 WeakPolarHBondContact OD2-CB 3.47Å; D351-H353 PolarHBondContact OD2-N 3.33Å
352	R	95.9	Very high	96.4	Very high	73 Å²	73	30.4 Å²	30.4	28%	0.275	18%	0.175	S	C	.	.			trans	61	6.2	177.6	-49.1	169.9	-52.8	-64.7	-14	116.8	G348 T349 S350 D369 T370 S372	G348-R352 PolarHBondContact O-N 2.84Å; T349-R352 VanDerWaalsContact O-CG 3.26Å; T349-R352 WeakPolarHBondContact O-CG 3.41Å; T349-R352 PolarHBondContact O-NH1 2.83Å; S350-R352 PolarHBondContact O-NH1 2.82Å; R352-D369 WeakPolarHBondContact CB-OD1 3.29Å; R352-D369 IonicContact CZ-OD2 3.86Å; R352-D369 IonicContact NE-OD1 3.65Å; R352-D369 IonicContact NE-OD2 3.76Å; R352-D369 IonicContact NH2-OD2 3.06Å; R352-D369 PolarHBondContact NH2-OD2 3.02Å; R352-T370 PolarHBondContact O-N 3.33Å; R352-T370 PolarHBondContact O-OG1 2.8Å; R352-S372 VanDerWaalsContact CA-O 3.29Å; R352-S372 WeakPolarHBondContact CA-O 3.44Å; R352-S372 VanDerWaalsContact CB-O 3.23Å; R352-S372 WeakPolarHBondContact CB-O 3.35Å
353	H	97.7	Very high	96.2	Very high	45 Å²	45	32.7 Å²	32.7	21%	0.208	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	-177.4	-74	66.9	0	0	0	112.3	H326 G346 G347 D351 R355 S367 L368 D369 I374	H326-H353 PolarHBondContact CE1-O 3.29Å; G346-H353 WeakPolarHBondContact CA-O 3.47Å; G347-H353 PolarHBondContact N-O 2.89Å; G347-H353 VanDerWaalsContact N-O 3.11Å; D351-H353 PolarHBondContact O-N 3.47Å; D351-H353 VanDerWaalsContact O-N 3.09Å; D351-H353 PolarHBondContact O-ND1 2.79Å; D351-H353 WeakPolarHBondContact OD2-CB 3.47Å; D351-H353 PolarHBondContact OD2-N 3.33Å; H353-R355 HydrophobicContact CB-CG 4.28Å; H353-S367 PolarHBondContact CD2-OG 3.11Å; H353-L368 CarbonylContact C-O 3.54Å; H353-L368 VanDerWaalsContact CA-O 3.24Å; H353-L368 WeakPolarHBondContact CA-O 3.48Å; H353-D369 PolarHBondContact CD2-N 3.19Å; H353-D369 IonicContact CE1-OD2 2.7Å; H353-I374 WeakPolarHBondContact O-CD1 3.42Å
354	I	98.4	Very high	96.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.3	155.2	-64.8	173.9	0	0	0	107.1	S345 I356 S367 L368 T370 I374 L377 L386 W400	S345-I354 WeakPolarHBondContact O-CA 3.27Å; I354-I356 HydrophobicContact CG2-CD1 4.17Å; I354-S367 CarbonylContact O-C 3.55Å; I354-S367 WeakPolarHBondContact O-CA 3.44Å; I354-L368 PolarHBondContact N-O 3.04Å; I354-L368 PolarHBondContact O-N 2.84Å; I354-T370 HydrophobicContact CB-CG2 4.47Å; I354-T370 HydrophobicContact CD1-CG2 3.66Å; I354-T370 HydrophobicContact CG1-CG2 3.7Å; I354-I374 HydrophobicContact CG1-CD1 3.6Å; I354-I374 HydrophobicContact CG1-CG1 4.26Å; I354-L377 HydrophobicContact CD1-CD2 4.02Å; I354-L377 HydrophobicContact CG1-CD2 4.23Å; I354-L386 HydrophobicContact CG2-CD2 3.89Å; I354-W400 HydrophobicContact CD1-CZ2 4.45Å
355	R	98.4	Very high	96	Very high	27 Å²	27	38.1 Å²	38.1	10%	0.102	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135	174.2	-67.3	-179.6	178.3	-107	17.7	110.3	E325 A344 S345 H353 W357 S366	E325-R355 PolarHBondContact O-NH2 2.88Å; E325-R355 VanDerWaalsContact O-NH2 3.07Å; E325-R355 IonicContact OE2-CZ 3.77Å; E325-R355 VanDerWaalsContact OE2-CZ 3.29Å; E325-R355 IonicContact OE2-NH1 2.64Å; E325-R355 PolarHBondContact OE2-NH1 2.86Å; E325-R355 IonicContact OE2-NH2 3.29Å; E325-R355 PolarHBondContact OE2-NH2 3.03Å; E325-R355 VanDerWaalsContact OE2-NH2 3.16Å; A344-R355 CarbonylContact C-O 3.56Å; A344-R355 WeakPolarHBondContact CA-O 3.33Å; S345-R355 PolarHBondContact N-O 2.8Å; S345-R355 PolarHBondContact O-N 3.36Å; H353-R355 HydrophobicContact CB-CG 4.28Å; R355-W357 HydrophobicContact CB-CZ2 3.98Å; R355-S366 WeakPolarHBondContact CA-O 3.44Å
356	I	98.3	Very high	95.8	Very high	3 Å²	3	40 Å²	40	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.7	176.9	-53.8	-59.2	0	0	0	107.8	I342 A344 I354 C364 V365 S366 L386 Y402 L405	I342-I356 HydrophobicContact CG2-CG2 3.83Å; A344-I356 HydrophobicContact CB-CD1 3.64Å; I354-I356 HydrophobicContact CG2-CD1 4.17Å; I356-C364 CarbonylContact O-C 3.49Å; I356-V365 HydrophobicContact CG2-CB 4.35Å; I356-V365 PolarHBondContact O-N 3.26Å; I356-S366 PolarHBondContact N-O 3.19Å; I356-S366 PolarHBondContact O-N 3.05Å; I356-L386 HydrophobicContact CD1-CD2 4.05Å; I356-Y402 HydrophobicContact CG2-CE2 4.09Å; I356-L405 HydrophobicContact CD1-CD2 4.41Å; I356-L405 HydrophobicContact CG1-CD1 4.03Å; I356-L405 HydrophobicContact CG1-CD2 4.37Å
357	W	97.8	Very high	95.7	Very high	7 Å²	7	42.5 Å²	42.5	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.6	-172.1	-55	92.5	0	0	0	111.5	L323 E325 I342 L343 S345 R355 C364	L323-W357 HydrophobicContact CB-CH2 3.83Å; L323-W357 HydrophobicContact CB-CZ2 4.14Å; L323-W357 HydrophobicContact CB-CZ3 4.09Å; L323-W357 HydrophobicContact CD1-CD2 3.78Å; L323-W357 HydrophobicContact CD1-CE3 3.87Å; L323-W357 HydrophobicContact CD1-CG 4.09Å; L323-W357 HydrophobicContact CD1-CH2 4.5Å; L323-W357 HydrophobicContact CD1-CZ2 4.49Å; L323-W357 HydrophobicContact CD1-CZ3 4.24Å; L323-W357 HydrophobicContact CD2-CE3 3.94Å; L323-W357 HydrophobicContact CD2-CH2 4.41Å; L323-W357 HydrophobicContact CD2-CZ3 3.79Å; L323-W357 HydrophobicContact CG-CE3 4.33Å; L323-W357 HydrophobicContact CG-CH2 4.46Å; L323-W357 HydrophobicContact CG-CZ3 4.24Å; E325-W357 HydrophobicContact CB-CH2 3.68Å; E325-W357 HydrophobicContact CB-CZ2 4.23Å; E325-W357 HydrophobicContact CG-CH2 3.58Å; E325-W357 HydrophobicContact CG-CZ3 4.22Å; I342-W357 WeakPolarHBondContact CA-O 3.48Å; I342-W357 WeakPolarHBondContact CD1-O 3.48Å; L343-W357 HydrophobicContact CB-CB 4.41Å; L343-W357 PolarHBondContact N-O 3.07Å; L343-W357 VanDerWaalsContact N-O 3.16Å; L343-W357 PolarHBondContact O-N 2.75Å; S345-W357 PolarHBondContact OG-NE1 2.87Å; R355-W357 HydrophobicContact CB-CZ2 3.98Å; W357-C364 HydrophobicContact CE3-CB 3.89Å; W357-C364 HydrophobicContact CH2-CB 4.34Å; W357-C364 HydrophobicContact CZ3-CB 3.75Å
358	N	96.3	Very high	95.7	Very high	39 Å²	39	44.7 Å²	44.7	21%	0.209	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	104.6	159.9	178.8	-2	0	0	0	107.8	N341 I342 N360 S361 G362 S363 V365	N341-N358 VanDerWaalsContact ND2-CG 3.29Å; N341-N358 PolarHBondContact ND2-OD1 3.27Å; N341-N358 CarbonylContact O-C 3.59Å; N341-N358 WeakPolarHBondContact O-CA 3.5Å; I342-N358 HydrophobicContact CD1-CB 4.23Å; N358-N360 PolarHBondContact O-N 2.73Å; N358-N360 PolarHBondContact OD1-N 2.91Å; N358-S361 WeakPolarHBondContact CB-OG 3.45Å; N358-S361 VanDerWaalsContact CG-OG 3.27Å; N358-S361 PolarHBondContact ND2-OG 2.77Å; N358-S361 PolarHBondContact O-N 3.49Å; N358-S361 PolarHBondContact O-OG 2.9Å; N358-G362 WeakPolarHBondContact O-CA 3.39Å; N358-G362 PolarHBondContact O-N 2.9Å; N358-S363 PolarHBondContact N-O 3.47Å; N358-S363 PolarHBondContact O-N 2.87Å; N358-V365 HydrophobicContact CB-CG2 3.79Å
359	V	94.3	Very high	95.8	Very high	30 Å²	30	47.3 Å²	47.3	18%	0.182	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.6	-170.9	-56.7	0	0	0	0	112.8	R321 W335 N341 L343 G362	R321-V359 PolarHBondContact NE-O 3.34Å; W335-V359 HydrophobicContact CH2-CB 4.36Å; W335-V359 HydrophobicContact CH2-CG1 3.77Å; W335-V359 HydrophobicContact CH2-CG2 3.99Å; W335-V359 HydrophobicContact CZ3-CB 4.48Å; W335-V359 HydrophobicContact CZ3-CG1 3.82Å; W335-V359 HydrophobicContact CZ3-CG2 3.88Å; N341-V359 PolarHBondContact O-N 3.07Å; L343-V359 HydrophobicContact CB-CG1 3.77Å; L343-V359 HydrophobicContact CD2-CG1 4.31Å; V359-G362 PolarHBondContact O-N 2.93Å
360	N	93.1	Very high	95.8	Very high	113 Å²	113	44.3 Å²	44.3	60%	0.604	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-45.3	177.9	-66.7	1.9	0	0	0	111	R321 N358	R321-N360 PolarHBondContact NH2-O 3.24Å; N358-N360 PolarHBondContact O-N 2.73Å; N358-N360 PolarHBondContact OD1-N 2.91Å
361	S	93.5	Very high	95.8	Very high	69 Å²	69	47.3 Å²	47.3	48%	0.483	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-20.8	174.8	51.1	0	0	0	0	113.6	N358 S363	N358-S361 WeakPolarHBondContact CB-OG 3.45Å; N358-S361 VanDerWaalsContact CG-OG 3.27Å; N358-S361 PolarHBondContact ND2-OG 2.77Å; N358-S361 PolarHBondContact O-N 3.49Å; N358-S361 PolarHBondContact O-OG 2.9Å; S361-S363 PolarHBondContact O-N 2.86Å; S361-S363 PolarHBondContact OG-N 3.24Å; S361-S363 PolarHBondContact OG-OG 2.81Å
362	G	91.7	Very high	95.7	Very high	20 Å²	20	47.1 Å²	47.1	21%	0.206	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	4.3	-169.8	0	0	0	0	0	114.2	N358 V359	N358-G362 WeakPolarHBondContact O-CA 3.39Å; N358-G362 PolarHBondContact O-N 2.9Å; V359-G362 PolarHBondContact O-N 2.93Å
363	S	94.1	Very high	95.7	Very high	55 Å²	55	44.6 Å²	44.6	39%	0.385	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.3	-173.5	60	0	0	0	0	112.7	N358 S361 V365	N358-S363 PolarHBondContact N-O 3.47Å; N358-S363 PolarHBondContact O-N 2.87Å; S361-S363 PolarHBondContact O-N 2.86Å; S361-S363 PolarHBondContact OG-N 3.24Å; S361-S363 PolarHBondContact OG-OG 2.81Å; S363-V365 PolarHBondContact O-N 2.77Å
364	C	95.8	Very high	95.7	Very high	48 Å²	48	42.5 Å²	42.5	32%	0.324	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	115.3	163.7	-169.1	0	0	0	0	109	I356 W357 S366	I356-C364 CarbonylContact O-C 3.49Å; W357-C364 HydrophobicContact CE3-CB 3.89Å; W357-C364 HydrophobicContact CH2-CB 4.34Å; W357-C364 HydrophobicContact CZ3-CB 3.75Å; C364-S366 PolarHBondContact SG-O 3.42Å; C364-S366 VanDerWaalsContact SG-O 3.35Å
365	V	95.3	Very high	95.7	Very high	87 Å²	87	42.6 Å²	42.6	53%	0.527	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-33.7	-179	-179.9	0	0	0	0	111.2	I356 N358 S363	I356-V365 HydrophobicContact CG2-CB 4.35Å; I356-V365 PolarHBondContact O-N 3.26Å; N358-V365 HydrophobicContact CB-CG2 3.79Å; S363-V365 PolarHBondContact O-N 2.77Å
366	S	94.9	Very high	95.7	Very high	44 Å²	44	42 Å²	42	31%	0.308	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	149.6	177.7	-168.2	0	0	0	0	110.3	R355 I356 C364	R355-S366 WeakPolarHBondContact CA-O 3.44Å; I356-S366 PolarHBondContact N-O 3.19Å; I356-S366 PolarHBondContact O-N 3.05Å; C364-S366 PolarHBondContact SG-O 3.42Å; C364-S366 VanDerWaalsContact SG-O 3.35Å
367	S	96.3	Very high	95.7	Very high	54 Å²	54	42.2 Å²	42.2	38%	0.378	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	137.4	177.8	-168.1	0	0	0	0	108.8	H353 I354	H353-S367 PolarHBondContact CD2-OG 3.11Å; I354-S367 CarbonylContact O-C 3.55Å; I354-S367 WeakPolarHBondContact O-CA 3.44Å
368	L	97.2	Very high	95.7	Very high	45 Å²	45	43.3 Å²	43.3	24%	0.236	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	116.8	-176.1	170.8	64	0	0	0	110	H353 I354 T370 W400 L405	H353-L368 CarbonylContact C-O 3.54Å; H353-L368 VanDerWaalsContact CA-O 3.24Å; H353-L368 WeakPolarHBondContact CA-O 3.48Å; I354-L368 PolarHBondContact N-O 3.04Å; I354-L368 PolarHBondContact O-N 2.84Å; L368-T370 HydrophobicContact CG-CG2 4.39Å; L368-T370 PolarHBondContact O-N 3.24Å; L368-W400 HydrophobicContact CD2-CD2 4.19Å; L368-W400 HydrophobicContact CD2-CE3 3.77Å; L368-W400 HydrophobicContact CD2-CH2 3.91Å; L368-W400 HydrophobicContact CD2-CZ2 4.32Å; L368-W400 HydrophobicContact CD2-CZ3 3.62Å; L368-L405 HydrophobicContact CB-CD1 4.05Å; L368-L405 HydrophobicContact CD2-CB 3.91Å; L368-L405 HydrophobicContact CD2-CD1 4.33Å
369	D	96.4	Very high	95.8	Very high	59 Å²	59	41.8 Å²	41.8	32%	0.316	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.3	167.5	-162.7	-27.6	0	0	0	108.7	R352 H353 Q371	R352-D369 WeakPolarHBondContact CB-OD1 3.29Å; R352-D369 IonicContact CZ-OD2 3.86Å; R352-D369 IonicContact NE-OD1 3.65Å; R352-D369 IonicContact NE-OD2 3.76Å; R352-D369 IonicContact NH2-OD2 3.06Å; R352-D369 PolarHBondContact NH2-OD2 3.02Å; H353-D369 PolarHBondContact CD2-N 3.19Å; H353-D369 IonicContact CE1-OD2 2.7Å; D369-Q371 WeakPolarHBondContact OD1-CA 3.48Å; D369-Q371 PolarHBondContact OD1-N 3.24Å
370	T	95.1	Very high	95.9	Very high	19 Å²	19	40.3 Å²	40.3	12%	0.117	24%	0.241	C	C	.	.			trans	-100.9	2.6	177.6	64.5	0	0	0	0	113.5	R352 I354 L368 S372 I374 H390 W400	R352-T370 PolarHBondContact O-N 3.33Å; R352-T370 PolarHBondContact O-OG1 2.8Å; I354-T370 HydrophobicContact CB-CG2 4.47Å; I354-T370 HydrophobicContact CD1-CG2 3.66Å; I354-T370 HydrophobicContact CG1-CG2 3.7Å; L368-T370 HydrophobicContact CG-CG2 4.39Å; L368-T370 PolarHBondContact O-N 3.24Å; T370-S372 PolarHBondContact O-N 3.36Å; T370-S372 PolarHBondContact OG1-O 2.82Å; T370-I374 HydrophobicContact CG2-CD1 4.3Å; T370-H390 PolarHBondContact OG1-CE1 2.92Å; T370-W400 HydrophobicContact CG2-CH2 4.28Å; T370-W400 HydrophobicContact CG2-CZ2 3.79Å
371	Q	94.6	Very high	95.9	Very high	151 Å²	151	37 Å²	37	71%	0.706	23%	0.225	S	C	*	.	S	Bend	trans	61.6	6.3	-179.2	-54.8	178	-1.8	0	0	114.7	D369	D369-Q371 WeakPolarHBondContact OD1-CA 3.48Å; D369-Q371 PolarHBondContact OD1-N 3.24Å
372	S	95.6	Very high	95.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.014	21%	0.208	C	C	.	.	S	Bend	trans	-141.9	158.7	176.9	-173.4	0	0	0	0	111.3	R352 T370 G391 F392	R352-S372 VanDerWaalsContact CA-O 3.29Å; R352-S372 WeakPolarHBondContact CA-O 3.44Å; R352-S372 VanDerWaalsContact CB-O 3.23Å; R352-S372 WeakPolarHBondContact CB-O 3.35Å; T370-S372 PolarHBondContact O-N 3.36Å; T370-S372 PolarHBondContact OG1-O 2.82Å; S372-G391 PolarHBondContact OG-N 2.99Å; S372-G391 PolarHBondContact OG-O 3.41Å; S372-F392 WeakPolarHBondContact CB-O 3.45Å; S372-F392 PolarHBondContact OG-O 3.3Å
373	Q	95.8	Very high	95.8	Very high	20 Å²	20	36 Å²	36	9%	0.093	21%	0.207	C	C	.	.			trans	-59.3	143.5	167.2	71	-174.5	114.2	0	0	110.3	F183 H390 G391	F183-Q373 VanDerWaalsContact CD2-NE2 3.3Å; Q373-H390 WeakPolarHBondContact O-CA 3.3Å; Q373-H390 PolarHBondContact O-ND1 3.07Å; Q373-G391 PolarHBondContact O-N 2.81Å
374	I	97.9	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.2	176.2	-57	139.1	0	0	0	108.4	A332 G347 H353 I354 T370 L377 A389	A332-I374 HydrophobicContact CB-CG2 3.71Å; G347-I374 PolarHBondContact O-N 3.13Å; H353-I374 WeakPolarHBondContact O-CD1 3.42Å; I354-I374 HydrophobicContact CG1-CD1 3.6Å; I354-I374 HydrophobicContact CG1-CG1 4.26Å; T370-I374 HydrophobicContact CG2-CD1 4.3Å; I374-L377 HydrophobicContact CG2-CD1 4.36Å; I374-L377 HydrophobicContact CG2-CD2 4.28Å; I374-L377 HydrophobicContact CG2-CG 3.93Å; I374-A389 WeakPolarHBondContact CA-O 3.25Å
375	S	97	Very high	95.9	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-34.5	-176.2	54.5	0	0	0	0	113.5	K331 A389 V418	K331-S375 WeakPolarHBondContact CD-O 3.39Å; K331-S375 WeakPolarHBondContact CE-O 3.43Å; K331-S375 VanDerWaalsContact CG-O 3.32Å; K331-S375 WeakPolarHBondContact CG-O 3.47Å; S375-A389 PolarHBondContact N-O 3.42Å; S375-A389 WeakPolarHBondContact OG-CB 3.45Å; S375-A389 PolarHBondContact OG-O 2.71Å; S375-V418 WeakPolarHBondContact CB-O 3.49Å; S375-V418 PolarHBondContact OG-O 3.28Å
376	S	97.8	Very high	96	Very high	16 Å²	16	32.6 Å²	32.6	11%	0.112	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.8	172	-177.2	0	0	0	0	111	S388 A389 L421	S376-S388 WeakPolarHBondContact O-CA 3.43Å; S376-A389 PolarHBondContact O-N 3.3Å; S376-L421 PolarHBondContact OG-O 3.32Å; S376-L421 VanDerWaalsContact OG-O 3.13Å
377	L	98.3	Very high	96.2	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.037	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.3	175.6	-80.5	166.1	0	0	0	108.4	A332 A334 A344 I354 I374 L386 V387	A332-L377 HydrophobicContact CB-CB 4.13Å; A332-L377 HydrophobicContact CB-CD1 3.86Å; A332-L377 HydrophobicContact CB-CG 3.8Å; A334-L377 HydrophobicContact CB-CB 3.95Å; A344-L377 HydrophobicContact CB-CD1 4.31Å; I354-L377 HydrophobicContact CD1-CD2 4.02Å; I354-L377 HydrophobicContact CG1-CD2 4.23Å; I374-L377 HydrophobicContact CG2-CD1 4.36Å; I374-L377 HydrophobicContact CG2-CD2 4.28Å; I374-L377 HydrophobicContact CG2-CG 3.93Å; L377-L386 HydrophobicContact CD2-CD1 4.08Å; L377-L386 HydrophobicContact CD2-CD2 4.1Å; L377-L386 HydrophobicContact CD2-CG 4.04Å; L377-V387 CarbonylContact C-O 3.6Å; L377-V387 VanDerWaalsContact CA-O 3.3Å; L377-V387 WeakPolarHBondContact CA-O 3.3Å
378	V	98.2	Very high	96.3	Very high	30 Å²	30	28 Å²	28	18%	0.182	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	143.8	167.4	81.1	0	0	0	0	111.3	V387 L421 L423	V378-V387 HydrophobicContact CG1-CB 4.1Å; V378-V387 HydrophobicContact CG1-CG2 4.13Å; V378-V387 PolarHBondContact N-O 3.22Å; V378-V387 PolarHBondContact O-N 2.8Å; V378-L421 HydrophobicContact CB-CD2 3.87Å; V378-L421 HydrophobicContact CG1-CD2 3.28Å; V378-L423 HydrophobicContact CB-CD1 4.45Å; V378-L423 HydrophobicContact CG1-CD1 3.89Å; V378-L423 HydrophobicContact CG1-CG 3.82Å; V378-L423 HydrophobicContact CG2-CD1 3.66Å; V378-L423 HydrophobicContact CG2-CG 4.06Å
379	F	98.2	Very high	96.3	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121	172.3	-80.7	-78.4	0	0	0	110.4	A334 W335 C336 P337 W338 I342 A344 P381 E385 L386 Y402 L423	A334-F379 HydrophobicContact CB-CD2 3.94Å; A334-F379 HydrophobicContact CB-CE2 4.3Å; A334-F379 WeakPolarHBondContact O-CE2 3.37Å; W335-F379 WeakPolarHBondContact O-CD2 3.42Å; C336-F379 HydrophobicContact CB-CD2 4.08Å; C336-F379 HydrophobicContact CB-CE1 4.36Å; C336-F379 HydrophobicContact CB-CE2 3.79Å; C336-F379 HydrophobicContact CB-CG 4.47Å; C336-F379 HydrophobicContact CB-CZ 3.93Å; P337-F379 VanDerWaalsContact CD-CB 3.47Å; P337-F379 HydrophobicContact CG-CB 4.2Å; W338-F379 HydrophobicContact CH2-CB 3.87Å; W338-F379 AromaticContact CH2-CD1 3.57Å; W338-F379 HydrophobicContact CH2-CD1 3.57Å; W338-F379 HydrophobicContact CH2-CE1 4.49Å; W338-F379 HydrophobicContact CH2-CG 4.12Å; W338-F379 AromaticContact CZ2-CD1 3.85Å; W338-F379 HydrophobicContact CZ2-CD1 3.85Å; W338-F379 HydrophobicContact CZ2-CE1 4.35Å; W338-F379 HydrophobicContact CZ3-CB 3.96Å; W338-F379 HydrophobicContact CZ3-CD1 4.43Å; I342-F379 HydrophobicContact CG2-CZ 4.3Å; A344-F379 HydrophobicContact CB-CE2 3.6Å; A344-F379 HydrophobicContact CB-CZ 3.78Å; F379-P381 VanDerWaalsContact O-CD 3.28Å; F379-P381 WeakPolarHBondContact O-CD 3.49Å; F379-E385 CarbonylContact C-O 3.59Å; F379-E385 WeakPolarHBondContact CA-O 3.45Å; F379-L386 HydrophobicContact CD1-CB 4.3Å; F379-L386 HydrophobicContact CD1-CD1 3.83Å; F379-L386 HydrophobicContact CD2-CD1 4.03Å; F379-L386 HydrophobicContact CE1-CB 4.32Å; F379-L386 HydrophobicContact CE1-CD1 3.85Å; F379-L386 HydrophobicContact CE2-CD1 4.04Å; F379-L386 HydrophobicContact CG-CD1 3.95Å; F379-L386 HydrophobicContact CZ-CD1 3.97Å; F379-Y402 AromaticContact CE1-CD2 3.66Å; F379-Y402 HydrophobicContact CE1-CD2 3.66Å; F379-Y402 AromaticContact CE1-CE2 3.95Å; F379-Y402 HydrophobicContact CE1-CE2 3.95Å; F379-Y402 HydrophobicContact CE1-CG 4.04Å; F379-Y402 HydrophobicContact CZ-CD2 4.37Å; F379-Y402 HydrophobicContact CZ-CE2 4.27Å; F379-L423 WeakPolarHBondContact O-CD1 3.05Å
380	A	96.6	Very high	96.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105	177.4	0	0	0	0	0	111	N382 K384 E385 V387 F445	A380-N382 PolarHBondContact O-N 2.99Å; A380-K384 WeakPolarHBondContact O-CA 3.49Å; A380-K384 PolarHBondContact O-N 2.88Å; A380-K384 VanDerWaalsContact O-N 3.14Å; A380-E385 PolarHBondContact N-O 3.24Å; A380-E385 PolarHBondContact O-N 3.22Å; A380-E385 VanDerWaalsContact O-N 3.13Å; A380-V387 HydrophobicContact CB-CG2 4.3Å; A380-F445 HydrophobicContact CB-CD1 3.56Å; A380-F445 HydrophobicContact CB-CD2 4.43Å; A380-F445 HydrophobicContact CB-CE1 3.56Å; A380-F445 HydrophobicContact CB-CE2 4.44Å; A380-F445 HydrophobicContact CB-CG 4.03Å; A380-F445 HydrophobicContact CB-CZ 4.04Å
381	P	94.2	Very high	96.2	Very high	42 Å²	42	22.2 Å²	22.2	27%	0.273	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-27.1	-171.4	28.9	-36.3	0	0	0	114.1	P337 W338 F379 Y383 K384 N427	P337-P381 HydrophobicContact CG-CB 4.49Å; W338-P381 HydrophobicContact CE3-CB 4.08Å; W338-P381 HydrophobicContact CZ3-CB 4.02Å; F379-P381 VanDerWaalsContact O-CD 3.28Å; F379-P381 WeakPolarHBondContact O-CD 3.49Å; P381-Y383 PolarHBondContact O-N 3.22Å; P381-Y383 VanDerWaalsContact O-N 3.11Å; P381-K384 PolarHBondContact O-N 2.83Å; P381-N427 WeakPolarHBondContact CD-OD1 3.09Å; P381-N427 HydrophobicContact CG-CB 3.95Å; P381-N427 WeakPolarHBondContact CG-OD1 3.12Å
382	N	91.3	Very high	96	Very high	20 Å²	20	22.1 Å²	22.1	11%	0.107	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.5	-176.9	-77.1	-11.1	0	0	0	113.4	A380 D426 N427 F445 M447 K455	A380-N382 PolarHBondContact O-N 2.99Å; N382-D426 PolarHBondContact ND2-O 3.06Å; N382-N427 VanDerWaalsContact ND2-C 3.28Å; N382-N427 PolarHBondContact ND2-O 3.41Å; N382-F445 PolarHBondContact ND2-O 2.71Å; N382-M447 HydrophobicContact CB-CG 3.72Å; N382-M447 HydrophobicContact CB-SD 3.88Å; N382-M447 VanDerWaalsContact CG-SD 3.54Å; N382-M447 PolarHBondContact OD1-SD 3Å; N382-M447 VanDerWaalsContact OD1-SD 3.38Å; N382-K455 PolarHBondContact OD1-NZ 3.26Å
383	Y	91.1	Very high	95.5	Very high	50 Å²	50	24.5 Å²	24.5	20%	0.196	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.7	3.3	175.7	-70.8	-82.5	0	0	0	114.5	R164 P381 E385 K401 F445 E446 M447	R164-Y383 VanDerWaalsContact NH1-CG 3.32Å; P381-Y383 PolarHBondContact O-N 3.22Å; P381-Y383 VanDerWaalsContact O-N 3.11Å; Y383-E385 WeakPolarHBondContact CB-OE1 3.45Å; Y383-K401 PolarHBondContact O-NZ 3.13Å; Y383-F445 HydrophobicContact CD2-CB 4.47Å; Y383-F445 HydrophobicContact CD2-CD1 4.32Å; Y383-E446 WeakPolarHBondContact CE2-O 3.45Å; Y383-E446 PolarHBondContact OH-O 3.42Å; Y383-M447 HydrophobicContact CE2-CG 4.48Å
384	K	94.6	Very high	95.2	Very high	112 Å²	112	28.9 Å²	28.9	49%	0.487	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	65.2	-169.4	-63.4	-171	178	-175.2	0	111.8	W338 A380 P381 Y402	W338-K384 HydrophobicContact CD2-CD 4.28Å; W338-K384 HydrophobicContact CD2-CG 4.04Å; W338-K384 HydrophobicContact CE3-CG 4.31Å; W338-K384 HydrophobicContact CG-CD 4.39Å; W338-K384 HydrophobicContact CH2-CB 4.12Å; W338-K384 HydrophobicContact CH2-CG 4.35Å; W338-K384 HydrophobicContact CZ2-CB 3.79Å; W338-K384 HydrophobicContact CZ2-CG 4.06Å; W338-K384 HydrophobicContact CZ3-CG 4.48Å; A380-K384 WeakPolarHBondContact O-CA 3.49Å; A380-K384 PolarHBondContact O-N 2.88Å; A380-K384 VanDerWaalsContact O-N 3.14Å; P381-K384 PolarHBondContact O-N 2.83Å; K384-Y402 PolarHBondContact O-N 2.66Å
385	E	96.8	Very high	95.1	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.028	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	162.2	-178.9	-83.7	154.2	-152.5	0	0	110.1	R164 F379 A380 Y383 I399 W400 K401 F445	R164-E385 IonicContact CZ-OE2 2.7Å; R164-E385 VanDerWaalsContact NH1-CD 3.3Å; R164-E385 IonicContact NH1-OE1 2.73Å; R164-E385 PolarHBondContact NH1-OE1 2.92Å; R164-E385 VanDerWaalsContact NH1-OE1 3.08Å; R164-E385 IonicContact NH1-OE2 2.83Å; R164-E385 PolarHBondContact NH1-OE2 2.97Å; R164-E385 IonicContact NH2-OE2 3.63Å; R164-E385 PolarHBondContact NH2-OE2 2.89Å; F379-E385 CarbonylContact C-O 3.59Å; F379-E385 WeakPolarHBondContact CA-O 3.45Å; A380-E385 PolarHBondContact N-O 3.24Å; A380-E385 PolarHBondContact O-N 3.22Å; A380-E385 VanDerWaalsContact O-N 3.13Å; Y383-E385 WeakPolarHBondContact CB-OE1 3.45Å; E385-I399 HydrophobicContact CB-CG2 4.22Å; E385-I399 HydrophobicContact CG-CG2 4.42Å; E385-W400 WeakPolarHBondContact CA-O 3.15Å; E385-W400 WeakPolarHBondContact CB-O 3.44Å; E385-W400 WeakPolarHBondContact CG-O 3.46Å; E385-K401 HydrophobicContact CG-CD 3.62Å; E385-K401 IonicContact OE1-NZ 3.19Å; E385-K401 PolarHBondContact OE1-NZ 3.47Å; E385-F445 HydrophobicContact CB-CE1 4.22Å
386	L	98.2	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.3	175.7	-179.4	70.4	0	0	0	107.5	A344 I354 I356 L377 F379 W400 L405	A344-L386 HydrophobicContact CB-CD1 4.11Å; A344-L386 HydrophobicContact CB-CD2 4.4Å; I354-L386 HydrophobicContact CG2-CD2 3.89Å; I356-L386 HydrophobicContact CD1-CD2 4.05Å; L377-L386 HydrophobicContact CD2-CD1 4.08Å; L377-L386 HydrophobicContact CD2-CD2 4.1Å; L377-L386 HydrophobicContact CD2-CG 4.04Å; F379-L386 HydrophobicContact CD1-CB 4.3Å; F379-L386 HydrophobicContact CD1-CD1 3.83Å; F379-L386 HydrophobicContact CD2-CD1 4.03Å; F379-L386 HydrophobicContact CE1-CB 4.32Å; F379-L386 HydrophobicContact CE1-CD1 3.85Å; F379-L386 HydrophobicContact CE2-CD1 4.04Å; F379-L386 HydrophobicContact CG-CD1 3.95Å; F379-L386 HydrophobicContact CZ-CD1 3.97Å; L386-W400 HydrophobicContact CB-CB 4.46Å; L386-W400 PolarHBondContact N-O 2.94Å; L386-W400 PolarHBondContact O-N 2.96Å; L386-L405 HydrophobicContact CD2-CD2 4.11Å
387	V	98.4	Very high	95	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.5	177.3	-159.3	0	0	0	0	108.7	L377 V378 A380 V397 V398 I399 L421 F445	L377-V387 CarbonylContact C-O 3.6Å; L377-V387 VanDerWaalsContact CA-O 3.3Å; L377-V387 WeakPolarHBondContact CA-O 3.3Å; V378-V387 HydrophobicContact CG1-CB 4.1Å; V378-V387 HydrophobicContact CG1-CG2 4.13Å; V378-V387 PolarHBondContact N-O 3.22Å; V378-V387 PolarHBondContact O-N 2.8Å; A380-V387 HydrophobicContact CB-CG2 4.3Å; V387-V397 HydrophobicContact CG1-CG1 3.49Å; V387-V397 VanDerWaalsContact CG1-CG1 3.49Å; V387-V398 WeakPolarHBondContact CA-O 3.3Å; V387-I399 HydrophobicContact CG1-CG1 4.27Å; V387-L421 HydrophobicContact CB-CD1 4.4Å; V387-L421 HydrophobicContact CG1-CD1 3.86Å; V387-F445 HydrophobicContact CG2-CE1 4.25Å; V387-F445 HydrophobicContact CG2-CE2 3.83Å; V387-F445 HydrophobicContact CG2-CZ 3.38Å
388	S	98.2	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.3	175.4	54.5	0	0	0	0	111.5	S376 H390 V397 V398 W400	S376-S388 WeakPolarHBondContact O-CA 3.43Å; S388-H390 PolarHBondContact OG-CE1 2.89Å; S388-H390 PolarHBondContact OG-NE2 2.85Å; S388-V397 CarbonylContact O-C 3.58Å; S388-V397 WeakPolarHBondContact O-CA 3.33Å; S388-V398 PolarHBondContact N-O 2.71Å; S388-V398 PolarHBondContact O-N 2.64Å; S388-W400 PolarHBondContact OG-NE1 2.8Å
389	A	97.8	Very high	94.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.6	170.4	0	0	0	0	0	110.3	I374 S375 S376 V418 L421	I374-A389 WeakPolarHBondContact CA-O 3.25Å; S375-A389 PolarHBondContact N-O 3.42Å; S375-A389 WeakPolarHBondContact OG-CB 3.45Å; S375-A389 PolarHBondContact OG-O 2.71Å; S376-A389 PolarHBondContact O-N 3.3Å; A389-V418 HydrophobicContact CB-CB 3.98Å; A389-V418 HydrophobicContact CB-CG1 3.62Å; A389-L421 HydrophobicContact CB-CB 3.97Å; A389-L421 HydrophobicContact CB-CD1 3.91Å
390	H	97.6	Very high	94.9	Very high	2 Å²	2	29 Å²	29	1%	0.009	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.7	-174	-64.2	-74.9	0	0	0	114.3	T370 Q373 S388 N396 V418	T370-H390 PolarHBondContact OG1-CE1 2.92Å; Q373-H390 WeakPolarHBondContact O-CA 3.3Å; Q373-H390 PolarHBondContact O-ND1 3.07Å; S388-H390 PolarHBondContact OG-CE1 2.89Å; S388-H390 PolarHBondContact OG-NE2 2.85Å; H390-N396 WeakPolarHBondContact CB-O 3.42Å; H390-N396 PolarHBondContact N-O 2.87Å; H390-V418 PolarHBondContact O-N 3.44Å; H390-V418 VanDerWaalsContact O-N 3.13Å
391	G	93	Very high	94.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.158	C	C	.	.			trans	-101.5	-131.8	173.6	0	0	0	0	0	112.8	S372 Q373 H394 H395	S372-G391 PolarHBondContact OG-N 2.99Å; S372-G391 PolarHBondContact OG-O 3.41Å; Q373-G391 PolarHBondContact O-N 2.81Å; G391-H394 PolarHBondContact O-N 3.44Å; G391-H395 VanDerWaalsContact C-ND1 3.28Å; G391-H395 WeakPolarHBondContact O-CA 3.39Å; G391-H395 PolarHBondContact O-N 3.38Å; G391-H395 PolarHBondContact O-ND1 3.48Å
392	F	89.4	Confident	94.9	Very high	149 Å²	149	31.6 Å²	31.6	65%	0.654	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	139.1	178.4	-175.1	-93	0	0	0	110.9	S372	S372-F392 WeakPolarHBondContact CB-O 3.45Å; S372-F392 PolarHBondContact OG-O 3.3Å
393	A	85.9	Confident	95.1	Very high	52 Å²	52	35.1 Å²	35.1	43%	0.43	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	cis	-97.2	-11.7	7	0	0	0	0	0	115.8
394	H	89.3	Confident	95.3	Very high	112 Å²	112	36.2 Å²	36.2	52%	0.519	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-16.7	-165.4	-59.2	-54.2	0	0	0	115.6	G391 N396	G391-H394 PolarHBondContact O-N 3.44Å; H394-N396 HydrophobicContact CB-CB 4.31Å; H394-N396 PolarHBondContact O-N 2.72Å
395	H	94.4	Very high	95.3	Very high	41 Å²	41	31.4 Å²	31.4	19%	0.19	17%	0.168	C	C	.	.			trans	54.3	25.3	177.8	-58.6	-13.3	0	0	0	113.8	G391 H414 G416 V418	G391-H395 VanDerWaalsContact C-ND1 3.28Å; G391-H395 WeakPolarHBondContact O-CA 3.39Å; G391-H395 PolarHBondContact O-N 3.38Å; G391-H395 PolarHBondContact O-ND1 3.48Å; H395-H414 HydrophobicContact CB-CB 4.49Å; H395-H414 WeakPolarHBondContact CB-O 3.43Å; H395-H414 WeakPolarHBondContact O-CB 3.15Å; H395-G416 WeakPolarHBondContact CB-O 3.31Å; H395-G416 VanDerWaalsContact CD2-C 3.48Å; H395-G416 VanDerWaalsContact CD2-CA 3.47Å; H395-G416 WeakPolarHBondContact CD2-CA 3.18Å; H395-V418 WeakPolarHBondContact O-CG2 3.24Å
396	N	95.3	Very high	95.1	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.037	19%	0.189	C	C	.	.			trans	-102.9	171.2	-167.9	66.5	-9.7	0	0	0	113.2	H390 H394 L411 N412	H390-N396 WeakPolarHBondContact CB-O 3.42Å; H390-N396 PolarHBondContact N-O 2.87Å; H394-N396 HydrophobicContact CB-CB 4.31Å; H394-N396 PolarHBondContact O-N 2.72Å; N396-L411 WeakPolarHBondContact CB-O 3.41Å; N396-N412 WeakPolarHBondContact CB-OD1 3.36Å; N396-N412 PolarHBondContact ND2-OD1 2.98Å
397	V	97.6	Very high	95	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.3	175.3	-176.4	0	0	0	0	107.7	V387 S388 L411 V418 L421 T432	V387-V397 HydrophobicContact CG1-CG1 3.49Å; V387-V397 VanDerWaalsContact CG1-CG1 3.49Å; S388-V397 CarbonylContact O-C 3.58Å; S388-V397 WeakPolarHBondContact O-CA 3.33Å; V397-L411 HydrophobicContact CB-CB 4.16Å; V397-L411 HydrophobicContact CB-CD1 4.32Å; V397-L411 HydrophobicContact CG1-CD1 4.26Å; V397-L411 PolarHBondContact N-O 3.5Å; V397-L411 PolarHBondContact O-N 2.92Å; V397-V418 HydrophobicContact CG2-CG2 4.35Å; V397-L421 HydrophobicContact CG1-CD1 3.54Å; V397-T432 HydrophobicContact CG1-CG2 4.38Å; V397-T432 HydrophobicContact CG2-CG2 3.61Å
398	V	97.7	Very high	94.8	Very high	3 Å²	3	43 Å²	43	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.4	-173.1	-173.4	0	0	0	0	110.6	V387 S388 W400 K407 E410	V387-V398 WeakPolarHBondContact CA-O 3.3Å; S388-V398 PolarHBondContact N-O 2.71Å; S388-V398 PolarHBondContact O-N 2.64Å; V398-W400 HydrophobicContact CB-CZ2 3.82Å; V398-W400 HydrophobicContact CG1-CD2 3.87Å; V398-W400 HydrophobicContact CG1-CE3 4.25Å; V398-W400 HydrophobicContact CG1-CH2 3.87Å; V398-W400 HydrophobicContact CG1-CZ2 3.4Å; V398-W400 VanDerWaalsContact CG1-CZ2 3.4Å; V398-W400 HydrophobicContact CG1-CZ3 4.25Å; V398-W400 HydrophobicContact CG2-CZ2 4.42Å; V398-K407 HydrophobicContact CG1-CD 4.15Å; V398-K407 HydrophobicContact CG1-CG 3.81Å; V398-E410 HydrophobicContact CG1-CG 4.46Å; V398-E410 HydrophobicContact CG2-CG 4.22Å
399	I	97.6	Very high	94.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.4	176.4	-53.7	177.4	0	0	0	108.4	I166 E385 V387 V408 S409 L411 F445	I166-I399 HydrophobicContact CD1-CD1 4.22Å; I166-I399 HydrophobicContact CG2-CD1 4.23Å; E385-I399 HydrophobicContact CB-CG2 4.22Å; E385-I399 HydrophobicContact CG-CG2 4.42Å; V387-I399 HydrophobicContact CG1-CG1 4.27Å; I399-V408 HydrophobicContact CB-CB 4.33Å; I399-V408 HydrophobicContact CG2-CB 4.1Å; I399-V408 HydrophobicContact CG2-CG1 4.49Å; I399-V408 WeakPolarHBondContact O-CB 3.38Å; I399-V408 PolarHBondContact O-N 2.65Å; I399-S409 PolarHBondContact N-O 3.35Å; I399-L411 HydrophobicContact CD1-CD1 4.3Å; I399-L411 HydrophobicContact CD1-CD2 4.38Å; I399-L411 HydrophobicContact CD1-CG 4.46Å; I399-F445 HydrophobicContact CB-CZ 4.49Å; I399-F445 HydrophobicContact CD1-CE1 4.3Å; I399-F445 HydrophobicContact CD1-CE2 4.11Å; I399-F445 HydrophobicContact CD1-CZ 3.59Å; I399-F445 HydrophobicContact CG1-CZ 3.86Å; I399-F445 HydrophobicContact CG2-CE1 3.89Å; I399-F445 HydrophobicContact CG2-CZ 3.84Å
400	W	97.6	Very high	94.5	Very high	13 Å²	13	47.7 Å²	47.7	5%	0.049	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.2	-178.4	-47.7	92.6	0	0	0	111.4	I354 L368 T370 E385 L386 S388 V398 Y402 L405 C406 K407	I354-W400 HydrophobicContact CD1-CZ2 4.45Å; L368-W400 HydrophobicContact CD2-CD2 4.19Å; L368-W400 HydrophobicContact CD2-CE3 3.77Å; L368-W400 HydrophobicContact CD2-CH2 3.91Å; L368-W400 HydrophobicContact CD2-CZ2 4.32Å; L368-W400 HydrophobicContact CD2-CZ3 3.62Å; T370-W400 HydrophobicContact CG2-CH2 4.28Å; T370-W400 HydrophobicContact CG2-CZ2 3.79Å; E385-W400 WeakPolarHBondContact CA-O 3.15Å; E385-W400 WeakPolarHBondContact CB-O 3.44Å; E385-W400 WeakPolarHBondContact CG-O 3.46Å; L386-W400 HydrophobicContact CB-CB 4.46Å; L386-W400 PolarHBondContact N-O 2.94Å; L386-W400 PolarHBondContact O-N 2.96Å; S388-W400 PolarHBondContact OG-NE1 2.8Å; V398-W400 HydrophobicContact CB-CZ2 3.82Å; V398-W400 HydrophobicContact CG1-CD2 3.87Å; V398-W400 HydrophobicContact CG1-CE3 4.25Å; V398-W400 HydrophobicContact CG1-CH2 3.87Å; V398-W400 HydrophobicContact CG1-CZ2 3.4Å; V398-W400 VanDerWaalsContact CG1-CZ2 3.4Å; V398-W400 HydrophobicContact CG1-CZ3 4.25Å; V398-W400 HydrophobicContact CG2-CZ2 4.42Å; W400-Y402 PolarHBondContact O-N 3.36Å; W400-L405 VanDerWaalsContact CE3-O 3.31Å; W400-C406 CarbonylContact C-O 3.56Å; W400-C406 WeakPolarHBondContact CA-O 3.5Å; W400-K407 HydrophobicContact CE3-CB 3.95Å; W400-K407 HydrophobicContact CE3-CG 4.47Å; W400-K407 HydrophobicContact CZ3-CB 3.78Å; W400-K407 HydrophobicContact CZ3-CG 4.23Å
401	K	95.7	Very high	94.4	Very high	73 Å²	73	47.7 Å²	47.7	32%	0.317	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	117.3	176.6	-166	50.4	162.3	-175.4	0	111	Y383 E385 S404 L405 C406 V408	Y383-K401 PolarHBondContact O-NZ 3.13Å; E385-K401 HydrophobicContact CG-CD 3.62Å; E385-K401 IonicContact OE1-NZ 3.19Å; E385-K401 PolarHBondContact OE1-NZ 3.47Å; K401-S404 CarbonylContact O-C 3.56Å; K401-S404 PolarHBondContact O-N 3.46Å; K401-S404 VanDerWaalsContact O-N 3.11Å; K401-S404 PolarHBondContact O-OG 2.54Å; K401-L405 WeakPolarHBondContact O-CA 3.02Å; K401-L405 PolarHBondContact O-N 3.35Å; K401-C406 HydrophobicContact CB-CB 4.41Å; K401-C406 PolarHBondContact N-O 3.19Å; K401-V408 HydrophobicContact CB-CG2 3.82Å
402	Y	95.8	Very high	94.5	Very high	23 Å²	23	51.5 Å²	51.5	9%	0.09	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	137.4	172.7	-171.5	-95.1	0	0	0	110	W338 Q339 I356 F379 K384 W400	W338-Y402 AromaticContact CZ2-CD1 3.77Å; W338-Y402 HydrophobicContact CZ2-CD1 3.77Å; W338-Y402 HydrophobicContact CZ2-CE1 4.43Å; W338-Y402 HydrophobicContact CZ2-CG 4.2Å; W338-Y402 AromaticContact NE1-CD1 3.88Å; W338-Y402 AromaticContact NE1-CE1 3.88Å; Q339-Y402 PolarHBondContact OE1-OH 3.14Å; I356-Y402 HydrophobicContact CG2-CE2 4.09Å; F379-Y402 AromaticContact CE1-CD2 3.66Å; F379-Y402 HydrophobicContact CE1-CD2 3.66Å; F379-Y402 AromaticContact CE1-CE2 3.95Å; F379-Y402 HydrophobicContact CE1-CE2 3.95Å; F379-Y402 HydrophobicContact CE1-CG 4.04Å; F379-Y402 HydrophobicContact CZ-CD2 4.37Å; F379-Y402 HydrophobicContact CZ-CE2 4.27Å; K384-Y402 PolarHBondContact O-N 2.66Å; W400-Y402 PolarHBondContact O-N 3.36Å
403	P	95.2	Very high	94.6	Very high	94 Å²	94	46.1 Å²	46.1	61%	0.61	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.4	-3.2	3.1	37.1	-36.6	0	0	0	115.6	L405	P403-L405 VanDerWaalsContact C-N 3.26Å; P403-L405 PolarHBondContact O-N 3.36Å
404	S	94.4	Very high	95.1	Very high	73 Å²	73	44 Å²	44	51%	0.51	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-8.1	-170.1	63.2	0	0	0	0	115.6	K401 C406	K401-S404 CarbonylContact O-C 3.56Å; K401-S404 PolarHBondContact O-N 3.46Å; K401-S404 VanDerWaalsContact O-N 3.11Å; K401-S404 PolarHBondContact O-OG 2.54Å; S404-C406 PolarHBondContact O-N 3.23Å; S404-C406 VanDerWaalsContact O-N 3.07Å; S404-C406 PolarHBondContact OG-SG 2.92Å
405	L	94.7	Very high	95.4	Very high	12 Å²	12	45.2 Å²	45.2	6%	0.063	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	28.3	-171.6	-55.1	-176.8	0	0	0	114.4	I356 L368 L386 W400 K401 P403 K407	I356-L405 HydrophobicContact CD1-CD2 4.41Å; I356-L405 HydrophobicContact CG1-CD1 4.03Å; I356-L405 HydrophobicContact CG1-CD2 4.37Å; L368-L405 HydrophobicContact CB-CD1 4.05Å; L368-L405 HydrophobicContact CD2-CB 3.91Å; L368-L405 HydrophobicContact CD2-CD1 4.33Å; L386-L405 HydrophobicContact CD2-CD2 4.11Å; W400-L405 VanDerWaalsContact CE3-O 3.31Å; K401-L405 WeakPolarHBondContact O-CA 3.02Å; K401-L405 PolarHBondContact O-N 3.35Å; P403-L405 VanDerWaalsContact C-N 3.26Å; P403-L405 PolarHBondContact O-N 3.36Å; L405-K407 PolarHBondContact O-N 2.99Å
406	C	93.3	Very high	95.5	Very high	71 Å²	71	43.7 Å²	43.7	48%	0.48	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.4	173.3	-56.4	0	0	0	0	109.9	W400 K401 S404 V408	W400-C406 CarbonylContact C-O 3.56Å; W400-C406 WeakPolarHBondContact CA-O 3.5Å; K401-C406 HydrophobicContact CB-CB 4.41Å; K401-C406 PolarHBondContact N-O 3.19Å; S404-C406 PolarHBondContact O-N 3.23Å; S404-C406 VanDerWaalsContact O-N 3.07Å; S404-C406 PolarHBondContact OG-SG 2.92Å; C406-V408 PolarHBondContact O-N 3.34Å
407	K	95.4	Very high	95.5	Very high	114 Å²	114	46.6 Å²	46.6	50%	0.496	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	126.3	174.7	-169.5	173.9	-70.5	-171.9	0	110.3	V398 W400 L405 E410	V398-K407 HydrophobicContact CG1-CD 4.15Å; V398-K407 HydrophobicContact CG1-CG 3.81Å; W400-K407 HydrophobicContact CE3-CB 3.95Å; W400-K407 HydrophobicContact CE3-CG 4.47Å; W400-K407 HydrophobicContact CZ3-CB 3.78Å; W400-K407 HydrophobicContact CZ3-CG 4.23Å; L405-K407 PolarHBondContact O-N 2.99Å; K407-E410 HydrophobicContact CD-CG 3.89Å; K407-E410 WeakPolarHBondContact CD-OE1 3.35Å; K407-E410 WeakPolarHBondContact CE-OE1 3.43Å; K407-E410 IonicContact NZ-OE1 2.72Å; K407-E410 PolarHBondContact NZ-OE1 2.91Å
408	V	94.6	Very high	95.5	Very high	64 Å²	64	46.7 Å²	46.7	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-42.5	-179	179.8	0	0	0	0	110.9	I166 I399 K401 C406	I166-V408 HydrophobicContact CD1-CG1 4.04Å; I399-V408 HydrophobicContact CB-CB 4.33Å; I399-V408 HydrophobicContact CG2-CB 4.1Å; I399-V408 HydrophobicContact CG2-CG1 4.49Å; I399-V408 WeakPolarHBondContact O-CB 3.38Å; I399-V408 PolarHBondContact O-N 2.65Å; K401-V408 HydrophobicContact CB-CG2 3.82Å; C406-V408 PolarHBondContact O-N 3.34Å
409	S	94.5	Very high	95.5	Very high	28 Å²	28	46.7 Å²	46.7	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	153.5	-177.8	-176.6	0	0	0	0	109.9	I399	I399-S409 PolarHBondContact N-O 3.35Å
410	E	94.9	Very high	95.5	Very high	71 Å²	71	47 Å²	47	33%	0.332	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.2	166.7	-55.6	-171.9	162.2	0	0	108.3	V398 K407	V398-E410 HydrophobicContact CG1-CG 4.46Å; V398-E410 HydrophobicContact CG2-CG 4.22Å; K407-E410 HydrophobicContact CD-CG 3.89Å; K407-E410 WeakPolarHBondContact CD-OE1 3.35Å; K407-E410 WeakPolarHBondContact CE-OE1 3.43Å; K407-E410 IonicContact NZ-OE1 2.72Å; K407-E410 PolarHBondContact NZ-OE1 2.91Å
411	L	95.8	Very high	95.4	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	110.8	173.8	-42.9	175.3	0	0	0	106.4	I166 S167 N396 V397 I399 W442	I166-L411 HydrophobicContact CG2-CD2 3.9Å; S167-L411 WeakPolarHBondContact O-CD2 3.25Å; N396-L411 WeakPolarHBondContact CB-O 3.41Å; V397-L411 HydrophobicContact CB-CB 4.16Å; V397-L411 HydrophobicContact CB-CD1 4.32Å; V397-L411 HydrophobicContact CG1-CD1 4.26Å; V397-L411 PolarHBondContact N-O 3.5Å; V397-L411 PolarHBondContact O-N 2.92Å; I399-L411 HydrophobicContact CD1-CD1 4.3Å; I399-L411 HydrophobicContact CD1-CD2 4.38Å; I399-L411 HydrophobicContact CD1-CG 4.46Å; L411-W442 HydrophobicContact CB-CD2 4.09Å; L411-W442 HydrophobicContact CB-CE3 3.74Å; L411-W442 HydrophobicContact CB-CH2 4.08Å; L411-W442 HydrophobicContact CB-CZ2 4.41Å; L411-W442 HydrophobicContact CB-CZ3 3.74Å; L411-W442 HydrophobicContact CD1-CB 3.83Å; L411-W442 HydrophobicContact CD1-CD2 3.9Å; L411-W442 HydrophobicContact CD1-CE3 4.06Å; L411-W442 HydrophobicContact CD1-CG 3.82Å; L411-W442 HydrophobicContact CD2-CE3 4.45Å; L411-W442 HydrophobicContact CG-CE3 4.31Å
412	N	94.9	Very high	95.5	Very high	79 Å²	79	44.1 Å²	44.1	42%	0.422	25%	0.253	S	S	.	.			trans	-111.8	152.9	-171.5	-68.2	-41.5	0	0	0	110.2	N396	N396-N412 WeakPolarHBondContact CB-OD1 3.36Å; N396-N412 PolarHBondContact ND2-OD1 2.98Å
413	G	92.2	Very high	95.6	Very high	36 Å²	36	44.1 Å²	44.1	37%	0.371	26%	0.255	S	S	.	.			trans	131.9	-4.5	166.6	0	0	0	0	0	116.4	R440	G413-R440 VanDerWaalsContact C-NH1 3.26Å; G413-R440 PolarHBondContact O-NH1 2.87Å; G413-R440 PolarHBondContact O-NH2 3.34Å
414	H	97	Very high	95.7	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.042	23%	0.227	C	C	.	.			trans	-67.2	133.2	164	-86	-67.6	0	0	0	109.5	H395 G416 V418 T432 A434 D436 T438 R440	H395-H414 HydrophobicContact CB-CB 4.49Å; H395-H414 WeakPolarHBondContact CB-O 3.43Å; H395-H414 WeakPolarHBondContact O-CB 3.15Å; H414-G416 VanDerWaalsContact C-N 3.33Å; H414-V418 HydrophobicContact CB-CG2 4.42Å; H414-T432 PolarHBondContact NE2-OG1 2.65Å; H414-A434 HydrophobicContact CB-CB 4.17Å; H414-A434 VanDerWaalsContact ND1-CB 3.3Å; H414-A434 WeakPolarHBondContact ND1-CB 3.22Å; H414-D436 VanDerWaalsContact CA-OD2 3.29Å; H414-D436 WeakPolarHBondContact CA-OD2 3.41Å; H414-D436 IonicContact CE1-OD1 3.79Å; H414-D436 IonicContact CG-OD2 2.72Å; H414-D436 IonicContact ND1-OD1 3.8Å; H414-D436 PolarHBondContact ND1-OD1 2.65Å; H414-D436 IonicContact ND1-OD2 2.73Å; H414-D436 PolarHBondContact ND1-OD2 3.35Å; H414-T438 PolarHBondContact CE1-OG1 3.02Å; H414-T438 VanDerWaalsContact CE1-OG1 3.3Å; H414-T438 PolarHBondContact ND1-OG1 3.39Å; H414-R440 VanDerWaalsContact CE1-CD 3.46Å; H414-R440 WeakPolarHBondContact CE1-CD 3.27Å; H414-R440 VanDerWaalsContact CE1-CG 3.47Å; H414-R440 WeakPolarHBondContact CE1-CG 3.48Å; H414-R440 PolarHBondContact ND1-NE 2.99Å
415	D	95.1	Very high	95.8	Very high	137 Å²	137	38.9 Å²	38.9	73%	0.733	22%	0.219	S	C	*	.	S	Bend	trans	-92.7	1.5	-176.3	-63.4	-60.8	0	0	0	112.7	D436 R440	D415-D436 HydrophobicContact CB-CB 4.2Å; D415-D436 PolarHBondContact N-OD2 3.17Å; D415-R440 IonicContact OD2-NH2 2.93Å
416	G	95.4	Very high	95.7	Very high	9 Å²	9	42.3 Å²	42.3	9%	0.093	24%	0.237	C	C	.	.	S	Bend	trans	-144.1	162.2	177.5	0	0	0	0	0	111	H395 H414 V418	H395-G416 WeakPolarHBondContact CB-O 3.31Å; H395-G416 VanDerWaalsContact CD2-C 3.48Å; H395-G416 VanDerWaalsContact CD2-CA 3.47Å; H395-G416 WeakPolarHBondContact CD2-CA 3.18Å; H414-G416 VanDerWaalsContact C-N 3.33Å; G416-V418 PolarHBondContact O-N 3.21Å
417	R	96.2	Very high	95.7	Very high	67 Å²	67	41 Å²	41	25%	0.253	23%	0.225	S	C	.	.			trans	-56.4	132.6	-175.3	68.5	-178.9	-157.8	-110.6	-2.9	112.2	N181 L419 A434 G435	N181-R417 PolarHBondContact O-NH2 3.45Å; N181-R417 PolarHBondContact OD1-NE 2.63Å; N181-R417 PolarHBondContact OD1-NH1 2.89Å; N181-R417 PolarHBondContact OD1-NH2 3.47Å; R417-L419 HydrophobicContact CG-CD2 4.02Å; R417-A434 WeakPolarHBondContact O-CA 3.33Å; R417-A434 WeakPolarHBondContact O-CB 3.47Å; R417-G435 PolarHBondContact O-N 2.94Å
418	V	97.9	Very high	95.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	133.8	175.1	-168.4	0	0	0	0	109	S375 A389 H390 H395 V397 H414 G416 T432 V433 A434	S375-V418 WeakPolarHBondContact CB-O 3.49Å; S375-V418 PolarHBondContact OG-O 3.28Å; A389-V418 HydrophobicContact CB-CB 3.98Å; A389-V418 HydrophobicContact CB-CG1 3.62Å; H390-V418 PolarHBondContact O-N 3.44Å; H390-V418 VanDerWaalsContact O-N 3.13Å; H395-V418 WeakPolarHBondContact O-CG2 3.24Å; V397-V418 HydrophobicContact CG2-CG2 4.35Å; H414-V418 HydrophobicContact CB-CG2 4.42Å; G416-V418 PolarHBondContact O-N 3.21Å; V418-T432 HydrophobicContact CG1-CG2 4.2Å; V418-V433 WeakPolarHBondContact CG1-O 3.15Å; V418-A434 HydrophobicContact CB-CB 4.43Å; V418-A434 HydrophobicContact CG2-CB 4.3Å
419	L	97.2	Very high	95.7	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-37.6	-172.9	-63.5	174.9	0	0	0	113.1	L179 K331 R417 V433	L179-L419 HydrophobicContact CD2-CD1 3.85Å; K331-L419 WeakPolarHBondContact CE-O 3.19Å; R417-L419 HydrophobicContact CG-CD2 4.02Å; L419-V433 PolarHBondContact N-O 3.05Å
420	S	96.8	Very high	95.9	Very high	7 Å²	7	32.3 Å²	32.3	5%	0.049	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	159.7	174.8	-166.1	0	0	0	0	111.5	T432 V433	S420-T432 WeakPolarHBondContact O-CA 3.09Å; S420-V433 PolarHBondContact N-O 3.25Å; S420-V433 PolarHBondContact O-N 3.37Å; S420-V433 VanDerWaalsContact O-N 3.07Å
421	L	97.1	Very high	96	Very high	5 Å²	5	29 Å²	29	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	129.5	-178.2	-177.8	158.2	0	0	0	108.6	S376 V378 V387 A389 V397 V430 A431 T432	S376-L421 PolarHBondContact OG-O 3.32Å; S376-L421 VanDerWaalsContact OG-O 3.13Å; V378-L421 HydrophobicContact CB-CD2 3.87Å; V378-L421 HydrophobicContact CG1-CD2 3.28Å; V387-L421 HydrophobicContact CB-CD1 4.4Å; V387-L421 HydrophobicContact CG1-CD1 3.86Å; A389-L421 HydrophobicContact CB-CB 3.97Å; A389-L421 HydrophobicContact CB-CD1 3.91Å; V397-L421 HydrophobicContact CG1-CD1 3.54Å; L421-V430 HydrophobicContact CD1-CG1 3.92Å; L421-V430 HydrophobicContact CD2-CG1 3.81Å; L421-V430 HydrophobicContact CG-CG1 3.54Å; L421-A431 WeakPolarHBondContact CA-O 3.39Å; L421-T432 HydrophobicContact CB-CG2 3.97Å; L421-T432 HydrophobicContact CD1-CG2 3.68Å; L421-T432 HydrophobicContact CG-CG2 3.69Å
422	V	97.8	Very high	96.2	Very high	19 Å²	19	28.9 Å²	28.9	12%	0.115	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.1	177.8	-63.9	0	0	0	0	111.7	L188 W190 V430 A431	L188-V422 HydrophobicContact CD2-CG2 3.84Å; L188-V422 HydrophobicContact CG-CG2 4.09Å; W190-V422 HydrophobicContact CB-CB 4.48Å; W190-V422 HydrophobicContact CB-CG2 3.89Å; W190-V422 HydrophobicContact CE3-CG2 4.34Å; V422-V430 CarbonylContact O-C 3.58Å; V422-V430 WeakPolarHBondContact O-CA 3.34Å; V422-A431 HydrophobicContact CG2-CB 4.02Å; V422-A431 PolarHBondContact N-O 2.68Å; V422-A431 PolarHBondContact O-N 3.09Å
423	L	97.4	Very high	96.3	Very high	24 Å²	24	25.1 Å²	25.1	13%	0.126	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	150.7	177.8	-82	167.5	0	0	0	111.8	V378 F379 V430	V378-L423 HydrophobicContact CB-CD1 4.45Å; V378-L423 HydrophobicContact CG1-CD1 3.89Å; V378-L423 HydrophobicContact CG1-CG 3.82Å; V378-L423 HydrophobicContact CG2-CD1 3.66Å; V378-L423 HydrophobicContact CG2-CG 4.06Å; F379-L423 WeakPolarHBondContact O-CD1 3.05Å; L423-V430 HydrophobicContact CD2-CG2 3.57Å; L423-V430 HydrophobicContact CG-CG2 4.43Å
424	S	97.3	Very high	96.6	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.028	13%	0.128	C	C	.	.			trans	-66.7	155.6	164.7	60	0	0	0	0	111.7	D426 N427 A428 T429	S424-D426 VanDerWaalsContact C-N 3.26Å; S424-D426 WeakPolarHBondContact CB-OD1 3.4Å; S424-D426 PolarHBondContact O-N 3.02Å; S424-D426 PolarHBondContact OG-OD1 3.28Å; S424-N427 WeakPolarHBondContact O-CA 3.29Å; S424-N427 PolarHBondContact O-N 3.01Å; S424-A428 PolarHBondContact OG-N 3.06Å; S424-T429 PolarHBondContact N-O 3.4Å; S424-T429 PolarHBondContact OG-N 3.03Å; S424-T429 PolarHBondContact OG-O 3.15Å
425	P	95.4	Very high	96.6	Very high	53 Å²	53	23.9 Å²	23.9	34%	0.344	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.1	179.3	-28.4	38	0	0	0	114.4	S191 N427	S191-P425 WeakPolarHBondContact O-CG 3.38Å; P425-N427 PolarHBondContact O-N 3.05Å; P425-N427 PolarHBondContact O-ND2 2.79Å
426	D	92.9	Very high	96.6	Very high	84 Å²	84	19 Å²	19	45%	0.449	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.1	175.5	78.9	-24.4	0	0	0	113.9	N382 S424 A428	N382-D426 PolarHBondContact ND2-O 3.06Å; S424-D426 VanDerWaalsContact C-N 3.26Å; S424-D426 WeakPolarHBondContact CB-OD1 3.4Å; S424-D426 PolarHBondContact O-N 3.02Å; S424-D426 PolarHBondContact OG-OD1 3.28Å; D426-A428 PolarHBondContact O-N 3Å; D426-A428 WeakPolarHBondContact OD1-CB 3.4Å; D426-A428 PolarHBondContact OD1-N 2.71Å; D426-A428 VanDerWaalsContact OD2-CB 3.22Å; D426-A428 WeakPolarHBondContact OD2-CB 3.36Å
427	N	94.9	Very high	96.7	Very high	42 Å²	42	23.1 Å²	23.1	23%	0.225	13%	0.126	C	C	.	.	S	Bend	trans	60.2	22.8	-177.9	-61.4	-113.5	0	0	0	113.8	P381 N382 S424 P425 F445	P381-N427 WeakPolarHBondContact CD-OD1 3.09Å; P381-N427 HydrophobicContact CG-CB 3.95Å; P381-N427 WeakPolarHBondContact CG-OD1 3.12Å; N382-N427 VanDerWaalsContact ND2-C 3.28Å; N382-N427 PolarHBondContact ND2-O 3.41Å; S424-N427 WeakPolarHBondContact O-CA 3.29Å; S424-N427 PolarHBondContact O-N 3.01Å; P425-N427 PolarHBondContact O-N 3.05Å; P425-N427 PolarHBondContact O-ND2 2.79Å; N427-F445 WeakPolarHBondContact O-CB 3.3Å
428	A	93.6	Very high	96.8	Very high	7 Å²	7	20.9 Å²	20.9	6%	0.058	12%	0.12	C	C	.	.	S	Bend	trans	-90.9	-30.5	178	0	0	0	0	0	113.7	S424 D426 S444 F445 E446	S424-A428 PolarHBondContact OG-N 3.06Å; D426-A428 PolarHBondContact O-N 3Å; D426-A428 WeakPolarHBondContact OD1-CB 3.4Å; D426-A428 PolarHBondContact OD1-N 2.71Å; D426-A428 VanDerWaalsContact OD2-CB 3.22Å; D426-A428 WeakPolarHBondContact OD2-CB 3.36Å; A428-S444 PolarHBondContact O-N 2.81Å; A428-F445 CarbonylContact O-C 3.59Å; A428-F445 WeakPolarHBondContact O-CA 3.07Å; A428-F445 PolarHBondContact O-N 3.18Å; A428-E446 HydrophobicContact CB-CB 4.32Å; A428-E446 PolarHBondContact O-N 2.97Å
429	T	96.4	Very high	96.9	Very high	18 Å²	18	21 Å²	21	11%	0.11	12%	0.12	C	C	.	.			trans	-118.2	141.7	-173.1	-50.2	0	0	0	0	110.4	W190 S424 L441 W442 K443	W190-T429 HydrophobicContact CH2-CG2 3.99Å; W190-T429 HydrophobicContact CZ3-CG2 4.24Å; S424-T429 PolarHBondContact N-O 3.4Å; S424-T429 PolarHBondContact OG-N 3.03Å; S424-T429 PolarHBondContact OG-O 3.15Å; T429-L441 HydrophobicContact CG2-CB 4.17Å; T429-L441 HydrophobicContact CG2-CD2 3.95Å; T429-W442 WeakPolarHBondContact CA-O 3.32Å; T429-K443 HydrophobicContact CG2-CG 4.37Å
430	V	97.6	Very high	96.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.2	166.1	167.5	0	0	0	0	108.8	L421 V422 L423 T432 L441 W442 F445	L421-V430 HydrophobicContact CD1-CG1 3.92Å; L421-V430 HydrophobicContact CD2-CG1 3.81Å; L421-V430 HydrophobicContact CG-CG1 3.54Å; V422-V430 CarbonylContact O-C 3.58Å; V422-V430 WeakPolarHBondContact O-CA 3.34Å; L423-V430 HydrophobicContact CD2-CG2 3.57Å; L423-V430 HydrophobicContact CG-CG2 4.43Å; V430-T432 HydrophobicContact CG1-CG2 3.87Å; V430-L441 CarbonylContact O-C 3.58Å; V430-L441 WeakPolarHBondContact O-CA 3.44Å; V430-W442 HydrophobicContact CB-CB 4.5Å; V430-W442 PolarHBondContact N-O 2.9Å; V430-W442 PolarHBondContact O-N 2.97Å; V430-F445 HydrophobicContact CG2-CD2 3.97Å; V430-F445 HydrophobicContact CG2-CE2 3.64Å
431	A	98.2	Very high	97	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.3	163.6	0	0	0	0	0	109.2	L188 W190 I196 L421 V422 I439 R440 L441	L188-A431 HydrophobicContact CD2-CB 4.29Å; W190-A431 HydrophobicContact CE3-CB 3.78Å; W190-A431 HydrophobicContact CZ3-CB 3.7Å; I196-A431 HydrophobicContact CD1-CB 4.06Å; L421-A431 WeakPolarHBondContact CA-O 3.39Å; V422-A431 HydrophobicContact CG2-CB 4.02Å; V422-A431 PolarHBondContact N-O 2.68Å; V422-A431 PolarHBondContact O-N 3.09Å; A431-I439 HydrophobicContact CB-CG2 4.45Å; A431-R440 WeakPolarHBondContact CA-O 3.05Å; A431-L441 HydrophobicContact CB-CD2 3.74Å
432	T	98.3	Very high	97	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.7	169	54.4	0	0	0	0	111	V397 H414 V418 S420 L421 V430 I439 R440 W442	V397-T432 HydrophobicContact CG1-CG2 4.38Å; V397-T432 HydrophobicContact CG2-CG2 3.61Å; H414-T432 PolarHBondContact NE2-OG1 2.65Å; V418-T432 HydrophobicContact CG1-CG2 4.2Å; S420-T432 WeakPolarHBondContact O-CA 3.09Å; L421-T432 HydrophobicContact CB-CG2 3.97Å; L421-T432 HydrophobicContact CD1-CG2 3.68Å; L421-T432 HydrophobicContact CG-CG2 3.69Å; V430-T432 HydrophobicContact CG1-CG2 3.87Å; T432-I439 CarbonylContact O-C 3.54Å; T432-I439 VanDerWaalsContact O-CA 3.23Å; T432-I439 WeakPolarHBondContact O-CA 3.5Å; T432-R440 PolarHBondContact N-O 3.05Å; T432-R440 PolarHBondContact O-N 3.34Å; T432-W442 PolarHBondContact OG1-NE1 3.13Å
433	V	98.2	Very high	96.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.2	172.8	72.6	0	0	0	0	109.6	A176 L179 L188 V418 L419 S420 T438 I439	A176-V433 HydrophobicContact CB-CG2 4.34Å; L179-V433 HydrophobicContact CD1-CG2 3.82Å; L179-V433 HydrophobicContact CD2-CG2 3.56Å; L179-V433 HydrophobicContact CG-CG2 4.32Å; L188-V433 HydrophobicContact CB-CG1 3.83Å; L188-V433 HydrophobicContact CD2-CB 4.05Å; L188-V433 HydrophobicContact CD2-CG1 3.94Å; L188-V433 HydrophobicContact CG-CG1 4.38Å; V418-V433 WeakPolarHBondContact CG1-O 3.15Å; L419-V433 PolarHBondContact N-O 3.05Å; S420-V433 PolarHBondContact N-O 3.25Å; S420-V433 PolarHBondContact O-N 3.37Å; S420-V433 VanDerWaalsContact O-N 3.07Å; V433-T438 WeakPolarHBondContact CA-O 3.47Å; V433-I439 HydrophobicContact CB-CG1 4.11Å; V433-I439 HydrophobicContact CG2-CG1 3.69Å
434	A	97.9	Very high	96.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	164.7	-172.7	0	0	0	0	0	113	L179 H414 R417 V418 D436 E437 T438	L179-A434 WeakPolarHBondContact CD2-O 3.48Å; H414-A434 HydrophobicContact CB-CB 4.17Å; H414-A434 VanDerWaalsContact ND1-CB 3.3Å; H414-A434 WeakPolarHBondContact ND1-CB 3.22Å; R417-A434 WeakPolarHBondContact O-CA 3.33Å; R417-A434 WeakPolarHBondContact O-CB 3.47Å; V418-A434 HydrophobicContact CB-CB 4.43Å; V418-A434 HydrophobicContact CG2-CB 4.3Å; A434-D436 PolarHBondContact O-N 3.27Å; A434-E437 PolarHBondContact O-N 3Å; A434-T438 PolarHBondContact N-O 3.47Å
435	G	96.6	Very high	96.2	Very high	20 Å²	20	24 Å²	24	21%	0.206	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	18.6	174.5	0	0	0	0	0	115.1	R417	R417-G435 PolarHBondContact O-N 2.94Å
436	D	96.6	Very high	95.7	Very high	34 Å²	34	27.5 Å²	27.5	18%	0.182	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	8.8	163.9	65.7	-0.5	0	0	0	112.3	H414 D415 A434 T438 R440	H414-D436 VanDerWaalsContact CA-OD2 3.29Å; H414-D436 WeakPolarHBondContact CA-OD2 3.41Å; H414-D436 IonicContact CE1-OD1 3.79Å; H414-D436 IonicContact CG-OD2 2.72Å; H414-D436 IonicContact ND1-OD1 3.8Å; H414-D436 PolarHBondContact ND1-OD1 2.65Å; H414-D436 IonicContact ND1-OD2 2.73Å; H414-D436 PolarHBondContact ND1-OD2 3.35Å; D415-D436 HydrophobicContact CB-CB 4.2Å; D415-D436 PolarHBondContact N-OD2 3.17Å; A434-D436 PolarHBondContact O-N 3.27Å; D436-T438 PolarHBondContact O-N 3.34Å; D436-T438 WeakPolarHBondContact OD1-CB 3.47Å; D436-T438 PolarHBondContact OD1-N 2.79Å; D436-T438 PolarHBondContact OD1-OG1 3.11Å; D436-T438 PolarHBondContact OD2-OG1 2.96Å; D436-T438 VanDerWaalsContact OD2-OG1 3.13Å; D436-R440 IonicContact OD2-CZ 3.39Å; D436-R440 IonicContact OD2-NE 3.83Å; D436-R440 IonicContact OD2-NH2 2.86Å; D436-R440 PolarHBondContact OD2-NH2 3.4Å
437	E	97.6	Very high	95.1	Very high	96 Å²	96	25.1 Å²	25.1	45%	0.449	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	31.7	-176.2	-63.4	-177	-146.1	0	0	113	A176 P177 G178 L179 A434	A176-E437 CarbonylContact C-O 3.57Å; A176-E437 WeakPolarHBondContact CA-O 3.42Å; A176-E437 PolarHBondContact N-O 2.84Å; A176-E437 WeakPolarHBondContact O-CB 3.43Å; P177-E437 VanDerWaalsContact CA-OE2 3.3Å; P177-E437 WeakPolarHBondContact CA-OE2 3.34Å; G178-E437 PolarHBondContact N-OE2 2.9Å; L179-E437 HydrophobicContact CB-CG 4.46Å; A434-E437 PolarHBondContact O-N 3Å
438	T	98.1	Very high	94.1	Very high	19 Å²	19	26.6 Å²	26.6	12%	0.117	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.7	171.2	73.2	0	0	0	0	113.7	I173 L174 H414 V433 A434 D436 R440	I173-T438 HydrophobicContact CG2-CG2 4.12Å; L174-T438 WeakPolarHBondContact O-CA 3.4Å; H414-T438 PolarHBondContact CE1-OG1 3.02Å; H414-T438 VanDerWaalsContact CE1-OG1 3.3Å; H414-T438 PolarHBondContact ND1-OG1 3.39Å; V433-T438 WeakPolarHBondContact CA-O 3.47Å; A434-T438 PolarHBondContact N-O 3.47Å; D436-T438 PolarHBondContact O-N 3.34Å; D436-T438 WeakPolarHBondContact OD1-CB 3.47Å; D436-T438 PolarHBondContact OD1-N 2.79Å; D436-T438 PolarHBondContact OD1-OG1 3.11Å; D436-T438 PolarHBondContact OD2-OG1 2.96Å; D436-T438 VanDerWaalsContact OD2-OG1 3.13Å; T438-R440 PolarHBondContact OG1-NE 2.92Å
439	I	98.3	Very high	93.1	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.9	159.3	-54.9	163	0	0	0	107.9	I173 L174 A176 L188 V198 A431 T432 V433	I173-I439 CarbonylContact C-O 3.55Å; I173-I439 WeakPolarHBondContact CA-O 3.29Å; L174-I439 HydrophobicContact CB-CB 4.22Å; L174-I439 HydrophobicContact CD1-CD1 4.47Å; L174-I439 PolarHBondContact N-O 3.49Å; L174-I439 PolarHBondContact O-N 2.68Å; A176-I439 HydrophobicContact CB-CD1 4.45Å; A176-I439 HydrophobicContact CB-CG1 4.08Å; L188-I439 HydrophobicContact CD1-CD1 4.32Å; V198-I439 HydrophobicContact CB-CD1 4.13Å; V198-I439 HydrophobicContact CG1-CD1 4.2Å; V198-I439 HydrophobicContact CG2-CD1 4.1Å; A431-I439 HydrophobicContact CB-CG2 4.45Å; T432-I439 CarbonylContact O-C 3.54Å; T432-I439 VanDerWaalsContact O-CA 3.23Å; T432-I439 WeakPolarHBondContact O-CA 3.5Å; V433-I439 HydrophobicContact CB-CG1 4.11Å; V433-I439 HydrophobicContact CG2-CG1 3.69Å
440	R	98.3	Very high	91.9	Very high	24 Å²	24	34.8 Å²	34.8	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.1	179.5	-61.4	-174.3	-168	-152.7	15.3	111	P170 I173 G413 H414 D415 A431 T432 D436 T438 W442	P170-R440 HydrophobicContact CB-CB 4.11Å; I173-R440 HydrophobicContact CG1-CG 4.21Å; I173-R440 HydrophobicContact CG2-CG 4.2Å; G413-R440 VanDerWaalsContact C-NH1 3.26Å; G413-R440 PolarHBondContact O-NH1 2.87Å; G413-R440 PolarHBondContact O-NH2 3.34Å; H414-R440 VanDerWaalsContact CE1-CD 3.46Å; H414-R440 WeakPolarHBondContact CE1-CD 3.27Å; H414-R440 VanDerWaalsContact CE1-CG 3.47Å; H414-R440 WeakPolarHBondContact CE1-CG 3.48Å; H414-R440 PolarHBondContact ND1-NE 2.99Å; D415-R440 IonicContact OD2-NH2 2.93Å; A431-R440 WeakPolarHBondContact CA-O 3.05Å; T432-R440 PolarHBondContact N-O 3.05Å; T432-R440 PolarHBondContact O-N 3.34Å; D436-R440 IonicContact OD2-CZ 3.39Å; D436-R440 IonicContact OD2-NE 3.83Å; D436-R440 IonicContact OD2-NH2 2.86Å; D436-R440 PolarHBondContact OD2-NH2 3.4Å; T438-R440 PolarHBondContact OG1-NE 2.92Å; R440-W442 HydrophobicContact CB-CZ2 3.85Å; R440-W442 PolarHBondContact O-NE1 2.7Å
441	L	97.9	Very high	90.7	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.4	-173.6	-74.4	157.5	0	0	0	110	P170 D171 K172 L174 W190 I196 W207 T429 V430 A431	P170-L441 CarbonylContact C-O 3.54Å; P170-L441 WeakPolarHBondContact CA-O 3.35Å; D171-L441 PolarHBondContact N-O 2.78Å; K172-L441 HydrophobicContact CB-CB 4.16Å; K172-L441 HydrophobicContact CB-CD1 3.81Å; K172-L441 HydrophobicContact CD-CD1 4.26Å; K172-L441 PolarHBondContact O-N 3.09Å; L174-L441 HydrophobicContact CD1-CD1 4.14Å; L174-L441 HydrophobicContact CG-CD1 4.36Å; W190-L441 HydrophobicContact CH2-CD2 3.48Å; W190-L441 VanDerWaalsContact CH2-CD2 3.48Å; W190-L441 HydrophobicContact CZ2-CD2 4.43Å; W190-L441 HydrophobicContact CZ3-CD2 3.67Å; I196-L441 HydrophobicContact CD1-CD2 4.08Å; W207-L441 HydrophobicContact CH2-CD1 3.58Å; W207-L441 HydrophobicContact CZ3-CD1 3.58Å; T429-L441 HydrophobicContact CG2-CB 4.17Å; T429-L441 HydrophobicContact CG2-CD2 3.95Å; V430-L441 CarbonylContact O-C 3.58Å; V430-L441 WeakPolarHBondContact O-CA 3.44Å; A431-L441 HydrophobicContact CB-CD2 3.74Å
442	W	96.9	Very high	89.5	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	105.5	-169.9	-47.9	89.1	0	0	0	111.2	P170 L411 T429 V430 T432 R440 S444	P170-W442 HydrophobicContact CB-CD2 4.19Å; P170-W442 HydrophobicContact CB-CE3 4.04Å; P170-W442 HydrophobicContact CB-CH2 4.47Å; P170-W442 HydrophobicContact CB-CZ3 4.19Å; P170-W442 HydrophobicContact CG-CH2 4.46Å; P170-W442 HydrophobicContact CG-CZ3 4.38Å; L411-W442 HydrophobicContact CB-CD2 4.09Å; L411-W442 HydrophobicContact CB-CE3 3.74Å; L411-W442 HydrophobicContact CB-CH2 4.08Å; L411-W442 HydrophobicContact CB-CZ2 4.41Å; L411-W442 HydrophobicContact CB-CZ3 3.74Å; L411-W442 HydrophobicContact CD1-CB 3.83Å; L411-W442 HydrophobicContact CD1-CD2 3.9Å; L411-W442 HydrophobicContact CD1-CE3 4.06Å; L411-W442 HydrophobicContact CD1-CG 3.82Å; L411-W442 HydrophobicContact CD2-CE3 4.45Å; L411-W442 HydrophobicContact CG-CE3 4.31Å; T429-W442 WeakPolarHBondContact CA-O 3.32Å; V430-W442 HydrophobicContact CB-CB 4.5Å; V430-W442 PolarHBondContact N-O 2.9Å; V430-W442 PolarHBondContact O-N 2.97Å; T432-W442 PolarHBondContact OG1-NE1 3.13Å; R440-W442 HydrophobicContact CB-CZ2 3.85Å; R440-W442 PolarHBondContact O-NE1 2.7Å; W442-S444 PolarHBondContact O-N 2.66Å
443	K	93.4	Very high	88.2	Confident	92 Å²	92	51 Å²	51	40%	0.4	26%	0.257	S	S	.	.			trans	-76.3	71.9	174.1	-71.8	-179.7	-177.1	157.9	0	110.9	D171 T429	D171-K443 HydrophobicContact CB-CD 4.01Å; D171-K443 HydrophobicContact CB-CG 4.05Å; D171-K443 WeakPolarHBondContact OD1-CD 3.33Å; D171-K443 VanDerWaalsContact OD1-CE 3.31Å; D171-K443 WeakPolarHBondContact OD1-CE 3.34Å; D171-K443 IonicContact OD1-NZ 3.43Å; D171-K443 PolarHBondContact OD1-NZ 3.45Å; D171-K443 WeakPolarHBondContact OD2-CE 3.44Å; D171-K443 IonicContact OD2-NZ 3.35Å; D171-K443 PolarHBondContact OD2-NZ 2.94Å; T429-K443 HydrophobicContact CG2-CG 4.37Å
444	S	91.4	Very high	87	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.021	28%	0.276	C	S	.	.			trans	-105.1	-7.1	-173.2	-53.6	0	0	0	0	114	R164 A428 W442	R164-S444 VanDerWaalsContact CZ-O 3.31Å; R164-S444 PolarHBondContact NE-O 2.76Å; R164-S444 PolarHBondContact NH2-O 2.61Å; A428-S444 PolarHBondContact O-N 2.81Å; W442-S444 PolarHBondContact O-N 2.66Å
445	F	91.6	Very high	85.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-132.2	15.6	-171.6	-57.7	-80.4	0	0	0	113.8	R164 A380 N382 Y383 E385 V387 I399 N427 A428 V430 M447	R164-F445 VanDerWaalsContact NH2-CD1 3.27Å; R164-F445 VanDerWaalsContact NH2-CE1 3.25Å; A380-F445 HydrophobicContact CB-CD1 3.56Å; A380-F445 HydrophobicContact CB-CD2 4.43Å; A380-F445 HydrophobicContact CB-CE1 3.56Å; A380-F445 HydrophobicContact CB-CE2 4.44Å; A380-F445 HydrophobicContact CB-CG 4.03Å; A380-F445 HydrophobicContact CB-CZ 4.04Å; N382-F445 PolarHBondContact ND2-O 2.71Å; Y383-F445 HydrophobicContact CD2-CB 4.47Å; Y383-F445 HydrophobicContact CD2-CD1 4.32Å; E385-F445 HydrophobicContact CB-CE1 4.22Å; V387-F445 HydrophobicContact CG2-CE1 4.25Å; V387-F445 HydrophobicContact CG2-CE2 3.83Å; V387-F445 HydrophobicContact CG2-CZ 3.38Å; I399-F445 HydrophobicContact CB-CZ 4.49Å; I399-F445 HydrophobicContact CD1-CE1 4.3Å; I399-F445 HydrophobicContact CD1-CE2 4.11Å; I399-F445 HydrophobicContact CD1-CZ 3.59Å; I399-F445 HydrophobicContact CG1-CZ 3.86Å; I399-F445 HydrophobicContact CG2-CE1 3.89Å; I399-F445 HydrophobicContact CG2-CZ 3.84Å; N427-F445 WeakPolarHBondContact O-CB 3.3Å; A428-F445 CarbonylContact O-C 3.59Å; A428-F445 WeakPolarHBondContact O-CA 3.07Å; A428-F445 PolarHBondContact O-N 3.18Å; V430-F445 HydrophobicContact CG2-CD2 3.97Å; V430-F445 HydrophobicContact CG2-CE2 3.64Å; F445-M447 PolarHBondContact O-N 3.46Å
446	E	85.3	Confident	84.6	Confident	128 Å²	128	60.8 Å²	60.8	60%	0.598	30%	0.304	S	S	*	.			trans	-56.5	131.2	173.8	-174.5	173.2	-166	0	0	111.1	Y383 A428	Y383-E446 WeakPolarHBondContact CE2-O 3.45Å; Y383-E446 PolarHBondContact OH-O 3.42Å; A428-E446 HydrophobicContact CB-CB 4.32Å; A428-E446 PolarHBondContact O-N 2.97Å
447	M	80.1	Confident	83.3	Confident	34 Å²	34	68.5 Å²	68.5	17%	0.167	33%	0.33	C	S	.	.			trans	-91.5	129.2	177.1	-68.4	-171.6	70.4	0	0	110.7	N382 Y383 F445 K451 K452 K455	N382-M447 HydrophobicContact CB-CG 3.72Å; N382-M447 HydrophobicContact CB-SD 3.88Å; N382-M447 VanDerWaalsContact CG-SD 3.54Å; N382-M447 PolarHBondContact OD1-SD 3Å; N382-M447 VanDerWaalsContact OD1-SD 3.38Å; Y383-M447 HydrophobicContact CE2-CG 4.48Å; F445-M447 PolarHBondContact O-N 3.46Å; M447-K451 HydrophobicContact CE-CB 3.97Å; M447-K452 HydrophobicContact CB-CB 4.37Å; M447-K455 HydrophobicContact CE-CD 4.15Å; M447-K455 HydrophobicContact SD-CD 3.82Å
448	D	74.4	Confident	81.8	Confident	72 Å²	72	70.1 Å²	70.1	39%	0.385	34%	0.342	S	S	.	.			trans	-35.7	123.4	163.1	177	-27.4	0	0	0	111.2	V450 K451 K452	D448-V450 PolarHBondContact O-N 2.96Å; D448-V450 WeakPolarHBondContact OD1-CB 3.39Å; D448-V450 PolarHBondContact OD1-N 2.72Å; D448-K451 HydrophobicContact CB-CB 4.29Å; D448-K451 HydrophobicContact CB-CD 4.06Å; D448-K451 HydrophobicContact CB-CG 4.12Å; D448-K451 CarbonylContact O-C 3.57Å; D448-K451 WeakPolarHBondContact O-CA 3.19Å; D448-K451 WeakPolarHBondContact O-CB 3.43Å; D448-K451 PolarHBondContact O-N 3.08Å; D448-K452 PolarHBondContact O-N 3.25Å
449	P	72.9	Confident	80.3	Confident	86 Å²	86	73.4 Å²	73.4	56%	0.558	36%	0.361	S	S	*	.	H	α-helix	trans	-52.6	-28.7	-176.6	-30.8	36.3	0	0	0	115	K453	P449-K453 WeakPolarHBondContact O-CB 3.24Å; P449-K453 WeakPolarHBondContact O-CG 3.47Å; P449-K453 PolarHBondContact O-N 2.74Å
450	V	70.7	Confident	78.4	Confident	112 Å²	112	77.7 Å²	77.7	68%	0.679	38%	0.384	S	S	*	.	H	α-helix	trans	-69.4	-41.7	175.5	-176.2	0	0	0	0	110.7	D448 A454	D448-V450 PolarHBondContact O-N 2.96Å; D448-V450 WeakPolarHBondContact OD1-CB 3.39Å; D448-V450 PolarHBondContact OD1-N 2.72Å; V450-A454 WeakPolarHBondContact O-CB 3.21Å; V450-A454 PolarHBondContact O-N 2.87Å; V450-A454 VanDerWaalsContact O-N 3.07Å
451	K	71.5	Confident	76.4	Confident	114 Å²	114	80.5 Å²	80.5	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-73.2	-35.4	176.8	-62	179.2	-172.1	165.7	0	111.9	M447 D448 A454 K455	M447-K451 HydrophobicContact CE-CB 3.97Å; D448-K451 HydrophobicContact CB-CB 4.29Å; D448-K451 HydrophobicContact CB-CD 4.06Å; D448-K451 HydrophobicContact CB-CG 4.12Å; D448-K451 CarbonylContact O-C 3.57Å; D448-K451 WeakPolarHBondContact O-CA 3.19Å; D448-K451 WeakPolarHBondContact O-CB 3.43Å; D448-K451 PolarHBondContact O-N 3.08Å; K451-A454 PolarHBondContact O-N 3.02Å; K451-K455 WeakPolarHBondContact O-CB 3.49Å; K451-K455 PolarHBondContact O-N 3.27Å
452	K	74.3	Confident	74.3	Confident	95 Å²	95	84 Å²	84	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-59.7	-53.5	172.3	-178.3	167.6	178.9	173.8	0	110.6	M447 D448 A454 K455 E456	M447-K452 HydrophobicContact CB-CB 4.37Å; D448-K452 PolarHBondContact O-N 3.25Å; K452-A454 VanDerWaalsContact C-N 3.28Å; K452-A454 PolarHBondContact O-N 3.24Å; K452-K455 WeakPolarHBondContact O-CB 3.44Å; K452-K455 PolarHBondContact O-N 2.72Å; K452-K455 VanDerWaalsContact O-N 3.09Å; K452-E456 WeakPolarHBondContact CE-OE1 3.22Å; K452-E456 HydrophobicContact CG-CG 4.48Å; K452-E456 WeakPolarHBondContact CG-OE1 3.31Å; K452-E456 WeakPolarHBondContact O-CG 3.46Å; K452-E456 PolarHBondContact O-N 3.02Å
453	K	71.3	Confident	72.3	Confident	132 Å²	132	87.9 Å²	87.9	57%	0.574	46%	0.464	S	S	*	.	H	α-helix	trans	-59.7	-32.8	175.5	-73.1	177.8	179.6	179.6	0	113.7	P449 E456 R457	P449-K453 WeakPolarHBondContact O-CB 3.24Å; P449-K453 WeakPolarHBondContact O-CG 3.47Å; P449-K453 PolarHBondContact O-N 2.74Å; K453-E456 WeakPolarHBondContact CA-OE2 3.47Å; K453-R457 WeakPolarHBondContact O-CB 3.29Å; K453-R457 VanDerWaalsContact O-CG 3.24Å; K453-R457 WeakPolarHBondContact O-CG 3.23Å; K453-R457 PolarHBondContact O-N 2.82Å; K453-R457 VanDerWaalsContact O-N 3.08Å
454	A	71.9	Confident	70.1	Confident	49 Å²	49	87.5 Å²	87.5	41%	0.405	47%	0.473	S	S	.	.	H	α-helix	trans	-69.5	-43.3	173.6	0	0	0	0	0	112.6	V450 K451 K452 R457 L458	V450-A454 WeakPolarHBondContact O-CB 3.21Å; V450-A454 PolarHBondContact O-N 2.87Å; V450-A454 VanDerWaalsContact O-N 3.07Å; K451-A454 PolarHBondContact O-N 3.02Å; K452-A454 VanDerWaalsContact C-N 3.28Å; K452-A454 PolarHBondContact O-N 3.24Å; A454-R457 PolarHBondContact O-N 3.44Å; A454-L458 WeakPolarHBondContact O-CG 3.35Å; A454-L458 PolarHBondContact O-N 3.43Å; A454-L458 VanDerWaalsContact O-N 3.1Å
455	K	70.3	Confident	68.2	Low	93 Å²	93	92.8 Å²	92.8	40%	0.404	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-45.4	175.1	-174.3	-174.4	178.6	-166.9	0	111.1	N382 M447 K451 K452 L458 V459	N382-K455 PolarHBondContact OD1-NZ 3.26Å; M447-K455 HydrophobicContact CE-CD 4.15Å; M447-K455 HydrophobicContact SD-CD 3.82Å; K451-K455 WeakPolarHBondContact O-CB 3.49Å; K451-K455 PolarHBondContact O-N 3.27Å; K452-K455 WeakPolarHBondContact O-CB 3.44Å; K452-K455 PolarHBondContact O-N 2.72Å; K452-K455 VanDerWaalsContact O-N 3.09Å; K455-L458 PolarHBondContact O-N 2.86Å; K455-V459 WeakPolarHBondContact O-CG2 3.33Å; K455-V459 PolarHBondContact O-N 3.23Å
456	E	73.9	Confident	66.5	Low	83 Å²	83	99.7 Å²	99.7	39%	0.388	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-44.5	176.9	-70.8	162.1	170.8	0	0	111.9	K452 K453 L458 V459 N460	K452-E456 WeakPolarHBondContact CE-OE1 3.22Å; K452-E456 HydrophobicContact CG-CG 4.48Å; K452-E456 WeakPolarHBondContact CG-OE1 3.31Å; K452-E456 WeakPolarHBondContact O-CG 3.46Å; K452-E456 PolarHBondContact O-N 3.02Å; K453-E456 WeakPolarHBondContact CA-OE2 3.47Å; E456-L458 VanDerWaalsContact C-N 3.35Å; E456-L458 PolarHBondContact O-N 3.05Å; E456-V459 PolarHBondContact O-N 3.36Å; E456-N460 WeakPolarHBondContact O-CB 3.44Å; E456-N460 VanDerWaalsContact O-CG 3.25Å; E456-N460 PolarHBondContact O-N 2.96Å; E456-N460 PolarHBondContact O-OD1 3.16Å
457	R	69	Low	64.9	Low	196 Å²	196	101.1 Å²	101.1	74%	0.74	55%	0.547	S	S	*	.	H	α-helix	trans	-60.6	-40.5	174.4	-76.6	171.6	178	-167.8	-2.3	112.8	K453 A454 S461	K453-R457 WeakPolarHBondContact O-CB 3.29Å; K453-R457 VanDerWaalsContact O-CG 3.24Å; K453-R457 WeakPolarHBondContact O-CG 3.23Å; K453-R457 PolarHBondContact O-N 2.82Å; K453-R457 VanDerWaalsContact O-N 3.08Å; A454-R457 PolarHBondContact O-N 3.44Å; R457-S461 WeakPolarHBondContact O-CB 3.4Å; R457-S461 PolarHBondContact O-N 2.61Å
458	L	66.5	Low	63.9	Low	130 Å²	130	108.7 Å²	108.7	68%	0.681	58%	0.582	S	S	*	*	H	α-helix	trans	-67.1	-42.1	177.6	-74.9	164.2	0	0	0	112.3	A454 K455 E456 S461 A462	A454-L458 WeakPolarHBondContact O-CG 3.35Å; A454-L458 PolarHBondContact O-N 3.43Å; A454-L458 VanDerWaalsContact O-N 3.1Å; K455-L458 PolarHBondContact O-N 2.86Å; E456-L458 VanDerWaalsContact C-N 3.35Å; E456-L458 PolarHBondContact O-N 3.05Å; L458-S461 PolarHBondContact O-N 3.05Å; L458-A462 PolarHBondContact O-N 3.07Å
459	V	66.4	Low	63.1	Low	88 Å²	88	108.6 Å²	108.6	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-64.8	-47.1	175.7	172.2	0	0	0	0	110.7	K455 E456 S461 A462 S463	K455-V459 WeakPolarHBondContact O-CG2 3.33Å; K455-V459 PolarHBondContact O-N 3.23Å; E456-V459 PolarHBondContact O-N 3.36Å; V459-S461 VanDerWaalsContact C-N 3.32Å; V459-S461 PolarHBondContact O-N 2.83Å; V459-A462 WeakPolarHBondContact O-CB 3.26Å; V459-A462 PolarHBondContact O-N 2.9Å; V459-S463 PolarHBondContact O-N 3.16Å; V459-S463 VanDerWaalsContact O-N 3.08Å; V459-S463 PolarHBondContact O-OG 2.9Å
460	N	58.9	Low	62.4	Low	95 Å²	95	112.1 Å²	112.1	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-64.1	-38	179	-68.9	-1.7	0	0	0	111.7	E456 A462 S463 S464	E456-N460 WeakPolarHBondContact O-CB 3.44Å; E456-N460 VanDerWaalsContact O-CG 3.25Å; E456-N460 PolarHBondContact O-N 2.96Å; E456-N460 PolarHBondContact O-OD1 3.16Å; N460-A462 PolarHBondContact O-N 2.89Å; N460-S463 PolarHBondContact O-N 3.46Å; N460-S463 PolarHBondContact O-OG 3.12Å; N460-S464 WeakPolarHBondContact O-CB 3.45Å; N460-S464 PolarHBondContact O-N 2.79Å; N460-S464 PolarHBondContact O-OG 2.77Å; N460-S464 VanDerWaalsContact O-OG 3.06Å
461	S	55.5	Low	61.5	Low	83 Å²	83	122 Å²	122	58%	0.58	63%	0.625	S	S	*	*	H	α-helix	trans	-62.9	-19.3	173.3	-174.2	0	0	0	0	114.1	R457 L458 V459	R457-S461 WeakPolarHBondContact O-CB 3.4Å; R457-S461 PolarHBondContact O-N 2.61Å; L458-S461 PolarHBondContact O-N 3.05Å; V459-S461 VanDerWaalsContact C-N 3.32Å; V459-S461 PolarHBondContact O-N 2.83Å
462	A	55	Low	61	Low	78 Å²	78	122.5 Å²	122.5	65%	0.645	63%	0.631	S	S	*	*	H	α-helix	trans	-93	-29.2	175.1	0	0	0	0	0	112.8	L458 V459 N460	L458-A462 PolarHBondContact O-N 3.07Å; V459-A462 WeakPolarHBondContact O-CB 3.26Å; V459-A462 PolarHBondContact O-N 2.9Å; N460-A462 PolarHBondContact O-N 2.89Å
463	S	53.2	Low	60.3	Low	82 Å²	82	123.9 Å²	123.9	57%	0.573	64%	0.643	S	S	*	*	H	α-helix	trans	-90.8	-24	178.2	60	0	0	0	0	114.1	V459 N460 V465	V459-S463 PolarHBondContact O-N 3.16Å; V459-S463 VanDerWaalsContact O-N 3.08Å; V459-S463 PolarHBondContact O-OG 2.9Å; N460-S463 PolarHBondContact O-N 3.46Å; N460-S463 PolarHBondContact O-OG 3.12Å; S463-V465 VanDerWaalsContact C-N 3.28Å; S463-V465 PolarHBondContact O-N 3.09Å
464	S	48.9	Very low	59.7	Low	85 Å²	85	123.4 Å²	123.4	59%	0.594	65%	0.646	S	S	*	*			trans	-86	19.6	-175.4	78.6	0	0	0	0	114.9	N460 I466	N460-S464 WeakPolarHBondContact O-CB 3.45Å; N460-S464 PolarHBondContact O-N 2.79Å; N460-S464 PolarHBondContact O-OG 2.77Å; N460-S464 VanDerWaalsContact O-OG 3.06Å; S464-I466 PolarHBondContact O-N 3.06Å
465	V	50.4	Low	59	Low	113 Å²	113	127.8 Å²	127.8	69%	0.685	66%	0.661	S	S	*	*			trans	-80.1	8.8	-177.2	-163.8	0	0	0	0	112.3	S463 H467	S463-V465 VanDerWaalsContact C-N 3.28Å; S463-V465 PolarHBondContact O-N 3.09Å; V465-H467 PolarHBondContact O-N 3.36Å
466	I	55.4	Low	58.3	Low	146 Å²	146	130 Å²	130	75%	0.749	68%	0.677	S	S	*	*			trans	-74.2	79.1	162.9	-54.9	-177.7	0	0	0	108.3	S464 Q468	S464-I466 PolarHBondContact O-N 3.06Å; I466-Q468 PolarHBondContact O-N 3.29Å
467	H	53.4	Low	57.2	Low	158 Å²	158	133.1 Å²	133.1	73%	0.731	70%	0.696	S	S	*	*			trans	-70.9	88.4	177.8	-168.1	-84.1	0	0	0	110	V465 S469	V465-H467 PolarHBondContact O-N 3.36Å; H467-S469 VanDerWaalsContact C-N 3.27Å; H467-S469 WeakPolarHBondContact ND1-CB 3.1Å; H467-S469 PolarHBondContact ND1-OG 3.24Å; H467-S469 PolarHBondContact O-N 2.96Å
468	Q	57.7	Low	56.4	Low	192 Å²	192	128.6 Å²	128.6	90%	0.897	69%	0.693	S	S	*	*			trans	-68.7	85.1	173.1	-84.2	-166	-25	0	0	110.8	I466	I466-Q468 PolarHBondContact O-N 3.29Å
469	S	57.8	Low	55.6	Low	70 Å²	70	128.5 Å²	128.5	49%	0.49	69%	0.694	S	S	.	*			trans	-114.5	103.8	169	50.5	0	0	0	0	110.2	H467	H467-S469 VanDerWaalsContact C-N 3.27Å; H467-S469 WeakPolarHBondContact ND1-CB 3.1Å; H467-S469 PolarHBondContact ND1-OG 3.24Å; H467-S469 PolarHBondContact O-N 2.96Å
470	I	57.7	Low	54.7	Low	160 Å²	160	131.9 Å²	131.9	82%	0.821	71%	0.707	S	S	*	*				172.2	77.7	118.5	-78.3	150.7	0	0	0	108.1
471	R	52.3	Low	54.3	Low	321 Å²	321	135.3 Å²	135.3	100%	1.211	73%	0.725	S	S	*	*				-179.3	0	125.7	-102.5	-178.9	172.5	-178.9	-1.9	111.5

Retrieved 471 of 471 residues in 520.6 ms (Link to these results)

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