A0A087XEP7_POEFO Loading...

Transforming growth factor beta regulator 1

AlphaFold DB , UniProt , Accession A0A087XEP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 546 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	41.9	Very low	33.8	Very low	227 Å²	227	160.8 Å²	160.8	100%	1.118	84%	0.843	S	S	*	*				0	154.3	0	-67	-178.7	-179.8	0	0	106.1
2	E	34.2	Very low	33.9	Very low	185 Å²	185	161 Å²	161	86%	0.864	84%	0.836	S	S	*	*			trans	80.3	105	-142.5	-57	158	175.4	0	0	107.9
3	S	36.2	Very low	34.2	Very low	107 Å²	107	156.5 Å²	156.5	75%	0.748	82%	0.823	S	S	*	*			cis	76.6	131.6	27.7	-42.6	0	0	0	0	113
4	L	35.4	Very low	33.9	Very low	140 Å²	140	155.4 Å²	155.4	73%	0.733	82%	0.818	S	S	*	*			cis	-159.9	161.1	-3.9	-111	166.9	0	0	0	108.4
5	N	32.2	Very low	34	Very low	139 Å²	139	150.3 Å²	150.3	74%	0.743	82%	0.818	S	S	*	*			trans	44.8	125.7	152.4	-68.8	4.2	0	0	0	120.7
6	S	36.4	Very low	34	Very low	110 Å²	110	152.9 Å²	152.9	77%	0.769	82%	0.823	S	S	*	*			cis	100.2	110.2	48.6	179.9	0	0	0	0	112.2
7	F	27.6	Very low	33.9	Very low	200 Å²	200	150.6 Å²	150.6	88%	0.877	82%	0.816	S	S	*	*			trans	-156.2	154.7	155.5	-151.2	-108.3	0	0	0	111.5
8	E	35.3	Very low	34.1	Very low	171 Å²	171	151.4 Å²	151.4	80%	0.799	82%	0.82	S	S	*	*			trans	-91.2	158.6	177.8	-65.5	165.9	85.9	0	0	111.9
9	S	29.8	Very low	34.4	Very low	120 Å²	120	154.8 Å²	154.8	84%	0.839	82%	0.821	S	S	*	*			trans	-164	146.5	147.3	-170.5	0	0	0	0	110.7
10	E	33.8	Very low	35.1	Very low	181 Å²	181	150.8 Å²	150.8	85%	0.846	81%	0.806	S	S	*	*			trans	-69.8	153.7	172	-56.7	157.6	95	0	0	112
11	M	28.6	Very low	35.8	Very low	189 Å²	189	149.2 Å²	149.2	93%	0.931	80%	0.797	S	S	*	*				-164.1	129.3	127.6	-141.8	150.8	-175.2	0	0	113
12	E	35.3	Very low	36.2	Very low	163 Å²	163	145.3 Å²	145.3	76%	0.762	77%	0.774	S	S	*	*			trans	-65	160.7	160	-92.3	-72.4	128.5	0	0	110.4
13	P	38.5	Very low	36.8	Very low	102 Å²	102	141.7 Å²	141.7	66%	0.662	77%	0.766	S	S	*	*				-157.6	-172	62.5	44.7	-22.8	0	0	0	119.4
14	D	29.3	Very low	37.1	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	77%	0.766	S	S	*	*			trans	85.3	87.4	151.3	-69.2	-31.2	0	0	0	119.1
15	G	35.5	Very low	37.4	Very low	80 Å²	80	139.6 Å²	139.6	83%	0.825	76%	0.76	S	S	*	*			trans	-55.5	156.2	165.4	0	0	0	0	0	115.6
16	Q	34	Very low	38.2	Very low	191 Å²	191	138.3 Å²	138.3	89%	0.893	75%	0.753	S	S	*	*			trans	-115.8	127.6	176	-74.9	-178.1	-15.4	0	0	110.9
17	T	32.5	Very low	38.5	Very low	115 Å²	115	138.2 Å²	138.2	71%	0.706	75%	0.752	S	S	*	*			trans	-76.4	133.6	-176	38.8	0	0	0	0	112.1	Y19	T17-Y19 PolarHBondContact O-N 3.43Å
18	N	37.9	Very low	39.2	Very low	165 Å²	165	135.5 Å²	135.5	88%	0.882	75%	0.745	S	S	*	*			trans	-73.4	108.5	172.9	-76	-61	0	0	0	110.3	S20	N18-S20 PolarHBondContact O-N 3.44Å
19	Y	40.1	Very low	39.6	Very low	215 Å²	215	131.7 Å²	131.7	84%	0.843	74%	0.743	S	S	*	*			trans	-72.2	105.7	172.3	-85.5	-97.1	0	0	0	110.9	T17	T17-Y19 PolarHBondContact O-N 3.43Å
20	S	46.7	Very low	40.3	Very low	75 Å²	75	130.8 Å²	130.8	52%	0.524	74%	0.736	S	S	.	*			trans	-67.5	142.9	173.4	-175.5	0	0	0	0	111.5	N18	N18-S20 PolarHBondContact O-N 3.44Å
21	L	50.3	Low	40.3	Very low	118 Å²	118	130.3 Å²	130.3	62%	0.618	74%	0.739	S	S	*	*	S	Bend	trans	-87.3	-2.6	-173	-120.6	160.7	0	0	0	113.9
22	F	50.1	Low	40.5	Very low	145 Å²	145	127.5 Å²	127.5	64%	0.636	74%	0.738	S	S	*	*			trans	-144.4	77.7	-179.6	-65.9	-78.4	0	0	0	112.8	A24 L25	F22-A24 PolarHBondContact O-N 3.02Å; F22-L25 PolarHBondContact O-N 2.67Å
23	P	47.9	Very low	40.3	Very low	108 Å²	108	122.5 Å²	122.5	70%	0.701	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-14.3	-176.3	-24.9	35.2	0	0	0	116.1	L25	P23-L25 VanDerWaalsContact C-N 3.34Å; P23-L25 PolarHBondContact O-N 3.5Å
24	A	42.5	Very low	39.9	Very low	91 Å²	91	124.9 Å²	124.9	75%	0.752	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-1.7	-174	0	0	0	0	0	115.1	F22	F22-A24 PolarHBondContact O-N 3.02Å
25	L	42.1	Very low	40.1	Very low	113 Å²	113	122 Å²	122	59%	0.592	74%	0.739	S	S	*	*	S	Bend	trans	-107	-23.8	-177.5	-68.1	176.6	0	0	0	114.2	F22 P23 S27 I28	F22-L25 PolarHBondContact O-N 2.67Å; P23-L25 VanDerWaalsContact C-N 3.34Å; P23-L25 PolarHBondContact O-N 3.5Å; L25-S27 PolarHBondContact O-N 2.76Å; L25-I28 WeakPolarHBondContact O-CG1 3.5Å
26	D	48.3	Very low	39.7	Very low	111 Å²	111	126.5 Å²	126.5	59%	0.594	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-70.6	-17.8	-177.7	-61.4	-43	0	0	0	112.8	I28	D26-I28 PolarHBondContact O-N 3.34Å
27	S	42.8	Very low	39.5	Very low	108 Å²	108	123 Å²	123	76%	0.755	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-82	-1.1	-174.5	-163.1	0	0	0	0	116	L25	L25-S27 PolarHBondContact O-N 2.76Å
28	I	42.7	Very low	39.5	Very low	144 Å²	144	124 Å²	124	74%	0.738	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-117	2.4	-177.7	38.1	173.4	0	0	0	114.3	L25 D26	L25-I28 WeakPolarHBondContact O-CG1 3.5Å; D26-I28 PolarHBondContact O-N 3.34Å
29	A	42.3	Very low	39.1	Very low	91 Å²	91	124 Å²	124	75%	0.752	72%	0.721	S	S	*	*	S	Bend	trans	-89.7	-8.7	177.7	0	0	0	0	0	114.3
30	S	44.3	Very low	38.6	Very low	100 Å²	100	118.4 Å²	118.4	70%	0.699	71%	0.713	S	S	*	*			trans	-113.9	93.7	-175.9	-66.3	0	0	0	0	111.8
31	L	34.1	Very low	37.8	Very low	172 Å²	172	121.6 Å²	121.6	90%	0.901	72%	0.72	S	S	*	*			trans	175.5	89.8	145.8	-99.5	173.5	0	0	0	112
32	S	32.3	Very low	37.3	Very low	129 Å²	129	121.4 Å²	121.4	90%	0.902	73%	0.726	S	S	*	*			trans	179.4	140	142.3	43.5	0	0	0	0	109.5
33	G	32.5	Very low	36.7	Very low	59 Å²	59	119.5 Å²	119.5	61%	0.608	73%	0.728	S	S	*	*			trans	-149.6	-162.1	177.6	0	0	0	0	0	110.6
34	T	30.4	Very low	36	Very low	151 Å²	151	119.2 Å²	119.2	93%	0.926	73%	0.728	S	S	*	*			trans	75.1	136.1	-173.2	79.1	0	0	0	0	113
35	A	31.9	Very low	35.5	Very low	80 Å²	80	123.4 Å²	123.4	66%	0.661	73%	0.732	S	S	*	*			cis	-154.2	159.5	-3	0	0	0	0	0	112.3
36	E	28.8	Very low	35.6	Very low	176 Å²	176	125.5 Å²	125.5	82%	0.822	74%	0.742	S	S	*	*			trans	63.1	147.5	138.6	-80.8	178.4	-141.9	0	0	121.9
37	N	29.5	Very low	35.2	Very low	118 Å²	118	125.4 Å²	125.4	63%	0.631	75%	0.746	S	S	*	*			cis	-164.7	143.2	-15.7	-145.1	-3.7	0	0	0	111.1
38	L	32.9	Very low	35.4	Very low	135 Å²	135	128.8 Å²	128.8	71%	0.707	75%	0.75	S	S	*	*			trans	55.2	154.3	164.6	-47.4	179.5	0	0	0	116.8
39	E	28.7	Very low	36.1	Very low	166 Å²	166	128.4 Å²	128.4	78%	0.776	74%	0.743	S	S	*	*			cis	-160.8	171.2	-11.7	-120.7	176.7	89.4	0	0	106.4
40	S	29.5	Very low	37.1	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	73%	0.731	S	S	*	*			cis	-155.1	149.9	3	54.5	0	0	0	0	110.1
41	E	29.6	Very low	38.2	Very low	142 Å²	142	128.4 Å²	128.4	66%	0.664	73%	0.727	S	S	*	*			trans	-75.3	150.3	166.1	-96.2	-84.9	122.8	0	0	110.8	P43	E41-P43 WeakPolarHBondContact OE2-CA 3.19Å
42	P	39.3	Very low	40.5	Very low	114 Å²	114	122.5 Å²	122.5	74%	0.74	70%	0.695	S	S	*	*				-154	-176.7	75.8	44	-25.5	0	0	0	116
43	P	38.2	Very low	43.1	Very low	105 Å²	105	120 Å²	120	68%	0.682	68%	0.675	S	S	*	*			cis	-126.5	116.8	-49.8	33.7	-18.2	0	0	0	111.9	E41 E45	E41-P43 WeakPolarHBondContact OE2-CA 3.19Å; P43-E45 PolarHBondContact O-N 2.96Å; P43-E45 VanDerWaalsContact O-N 3.12Å
44	S	34.1	Very low	45.7	Very low	101 Å²	101	118.4 Å²	118.4	71%	0.706	65%	0.65	S	S	*	*			trans	36.7	61.2	150.6	-63.6	0	0	0	0	118.5	I46	S44-I46 PolarHBondContact O-N 2.9Å
45	E	31.1	Very low	48.4	Very low	180 Å²	180	112.3 Å²	112.3	84%	0.841	61%	0.612	S	S	*	*			trans	-75.2	113.3	163.7	-167.3	171.5	-123.9	0	0	109.2	P43 T47	P43-E45 PolarHBondContact O-N 2.96Å; P43-E45 VanDerWaalsContact O-N 3.12Å; E45-T47 VanDerWaalsContact C-N 3.28Å; E45-T47 PolarHBondContact O-N 3.39Å
46	I	43.8	Very low	51.1	Low	156 Å²	156	110.7 Å²	110.7	80%	0.8	59%	0.592	S	S	*	*			trans	-73.3	84	-177.7	-56.4	173.8	0	0	0	109.1	S44 E48	S44-I46 PolarHBondContact O-N 2.9Å; I46-E48 PolarHBondContact O-N 3.24Å
47	T	39.5	Very low	54	Low	109 Å²	109	102.3 Å²	102.3	67%	0.669	55%	0.553	S	S	*	*			trans	-67.6	104.4	173.1	-40.8	0	0	0	0	109.2	E45 K49	E45-T47 VanDerWaalsContact C-N 3.28Å; E45-T47 PolarHBondContact O-N 3.39Å; T47-K49 PolarHBondContact O-N 3.5Å
48	E	48.4	Very low	56.8	Low	179 Å²	179	96.7 Å²	96.7	84%	0.836	52%	0.523	S	S	*	.			trans	-56.6	97.9	167.5	-69	-167	130.9	0	0	109.1	I46 P50	I46-E48 PolarHBondContact O-N 3.24Å; E48-P50 WeakPolarHBondContact O-CD 3.47Å
49	K	57.5	Low	59.5	Low	137 Å²	137	92.5 Å²	92.5	60%	0.596	50%	0.5	S	S	*	.			trans	-61.6	113.3	177.9	-76.2	-171.1	174.2	-174.2	0	108.6	T47 N51 R81	T47-K49 PolarHBondContact O-N 3.5Å; K49-N51 PolarHBondContact O-N 3.21Å; K49-R81 PolarHBondContact NZ-O 3.31Å
50	P	61.7	Low	62.3	Low	78 Å²	78	88 Å²	88	51%	0.506	48%	0.48	S	S	.	.			trans	-66.6	133.8	-175.7	26	-33	0	0	0	109.5	E48 L52	E48-P50 WeakPolarHBondContact O-CD 3.47Å; P50-L52 HydrophobicContact CB-CD2 4.44Å; P50-L52 HydrophobicContact CB-CG 4.19Å; P50-L52 HydrophobicContact CG-CD1 4.14Å; P50-L52 HydrophobicContact CG-CD2 4.31Å; P50-L52 HydrophobicContact CG-CG 3.98Å; P50-L52 PolarHBondContact O-N 2.82Å
51	N	69.3	Low	65.2	Low	113 Å²	113	83.3 Å²	83.3	60%	0.604	45%	0.448	S	S	*	.			trans	-72.7	79.6	171.3	-69.9	-81.6	0	0	0	108.7	K49 Q85	K49-N51 PolarHBondContact O-N 3.21Å; N51-Q85 VanDerWaalsContact OD1-CG 3.28Å; N51-Q85 WeakPolarHBondContact OD1-CG 3.34Å; N51-Q85 PolarHBondContact OD1-NE2 3.02Å
52	L	81.2	Confident	68.1	Low	47 Å²	47	76.9 Å²	76.9	25%	0.246	42%	0.418	C	S	.	.			trans	-69.4	163	-173.7	-71.9	159.2	0	0	0	111.6	P50 D56 A57 I60 L83	P50-L52 HydrophobicContact CB-CD2 4.44Å; P50-L52 HydrophobicContact CB-CG 4.19Å; P50-L52 HydrophobicContact CG-CD1 4.14Å; P50-L52 HydrophobicContact CG-CD2 4.31Å; P50-L52 HydrophobicContact CG-CG 3.98Å; P50-L52 PolarHBondContact O-N 2.82Å; L52-D56 HydrophobicContact CD2-CB 4.26Å; L52-A57 HydrophobicContact CB-CB 4.29Å; L52-I60 HydrophobicContact CD1-CD1 3.76Å; L52-L83 HydrophobicContact CD1-CB 4.34Å; L52-L83 HydrophobicContact CD1-CD2 3.92Å; L52-L83 PolarHBondContact N-O 3.31Å; L52-L83 VanDerWaalsContact N-O 3.11Å
53	T	86.5	Confident	70.4	Confident	76 Å²	76	76.8 Å²	76.8	47%	0.466	41%	0.408	S	S	.	.			trans	-75	155.9	168.5	88.4	0	0	0	0	110.2	L55 D56 A57	T53-L55 PolarHBondContact O-N 3.33Å; T53-L55 VanDerWaalsContact O-N 3.11Å; T53-L55 PolarHBondContact OG1-N 3.47Å; T53-D56 WeakPolarHBondContact CB-OD2 3.31Å; T53-D56 VanDerWaalsContact CG2-OD2 3.26Å; T53-D56 WeakPolarHBondContact CG2-OD2 3.42Å; T53-D56 PolarHBondContact O-N 2.86Å; T53-D56 VanDerWaalsContact O-N 3.09Å; T53-D56 VanDerWaalsContact OG1-CG 3.26Å; T53-D56 PolarHBondContact OG1-N 3.42Å; T53-D56 PolarHBondContact OG1-OD2 3.21Å; T53-A57 WeakPolarHBondContact O-CB 3.48Å; T53-A57 PolarHBondContact O-N 2.85Å
54	W	87.5	Confident	72.7	Confident	26 Å²	26	77.6 Å²	77.6	10%	0.098	40%	0.402	C	S	.	.	H	α-helix	trans	-54.9	-28	174.4	-80.4	121	0	0	0	114	A58 K75 I78 I79 V84 A88 S90 L92	W54-A58 WeakPolarHBondContact O-CB 3.48Å; W54-A58 PolarHBondContact O-N 3.33Å; W54-K75 HydrophobicContact CH2-CG 4.4Å; W54-K75 HydrophobicContact CZ3-CG 4.43Å; W54-I78 HydrophobicContact CE3-CD1 3.97Å; W54-I78 HydrophobicContact CE3-CG2 3.84Å; W54-I78 HydrophobicContact CH2-CG2 4.4Å; W54-I78 HydrophobicContact CZ3-CB 4.08Å; W54-I78 HydrophobicContact CZ3-CD1 4.16Å; W54-I78 HydrophobicContact CZ3-CG2 3.45Å; W54-I78 VanDerWaalsContact CZ3-CG2 3.45Å; W54-I79 HydrophobicContact CH2-CG1 4.41Å; W54-V84 HydrophobicContact CD2-CB 4.31Å; W54-V84 HydrophobicContact CD2-CG1 3.87Å; W54-V84 HydrophobicContact CD2-CG2 4.21Å; W54-V84 HydrophobicContact CE3-CB 4.15Å; W54-V84 HydrophobicContact CE3-CG1 4.21Å; W54-V84 HydrophobicContact CE3-CG2 3.96Å; W54-V84 HydrophobicContact CG-CG1 4.38Å; W54-V84 HydrophobicContact CH2-CB 4.34Å; W54-V84 HydrophobicContact CH2-CG1 4.28Å; W54-V84 HydrophobicContact CZ2-CB 4.48Å; W54-V84 HydrophobicContact CZ2-CG1 3.92Å; W54-V84 HydrophobicContact CZ3-CB 4.19Å; W54-V84 HydrophobicContact CZ3-CG1 4.42Å; W54-V84 HydrophobicContact CZ3-CG2 4.39Å; W54-A88 HydrophobicContact CZ2-CB 4.21Å; W54-S90 PolarHBondContact NE1-O 3.13Å; W54-L92 HydrophobicContact CB-CD1 3.89Å; W54-L92 HydrophobicContact CD2-CB 3.84Å; W54-L92 HydrophobicContact CD2-CD1 4.33Å; W54-L92 HydrophobicContact CE3-CB 3.64Å; W54-L92 HydrophobicContact CE3-CD1 3.9Å; W54-L92 HydrophobicContact CE3-CD2 4.24Å; W54-L92 HydrophobicContact CE3-CG 4.11Å; W54-L92 HydrophobicContact CG-CB 4.3Å; W54-L92 HydrophobicContact CG-CD1 4.4Å; W54-L92 HydrophobicContact CZ3-CB 4.01Å; W54-L92 HydrophobicContact CZ3-CD2 4.35Å; W54-L92 VanDerWaalsContact O-CD1 3.32Å; W54-L92 WeakPolarHBondContact O-CD1 3.43Å
55	L	88.1	Confident	75.2	Confident	23 Å²	23	73.8 Å²	73.8	12%	0.12	38%	0.377	C	S	.	.	H	α-helix	trans	-76.6	-42.5	176.2	-69.9	-179.7	0	0	0	111.6	T53 A58 Q59 V95 M96 E99 F107	T53-L55 PolarHBondContact O-N 3.33Å; T53-L55 VanDerWaalsContact O-N 3.11Å; T53-L55 PolarHBondContact OG1-N 3.47Å; L55-A58 CarbonylContact O-C 3.56Å; L55-A58 PolarHBondContact O-N 3.39Å; L55-Q59 PolarHBondContact O-N 3.26Å; L55-V95 HydrophobicContact CD1-CG1 4.07Å; L55-V95 HydrophobicContact CD2-CG1 3.72Å; L55-V95 HydrophobicContact CG-CG1 3.62Å; L55-M96 HydrophobicContact CD2-SD 3.75Å; L55-E99 HydrophobicContact CD1-CB 4.42Å; L55-E99 HydrophobicContact CD1-CG 4.15Å; L55-E99 HydrophobicContact CD2-CB 4.04Å; L55-E99 HydrophobicContact CD2-CG 3.96Å; L55-F107 HydrophobicContact CB-CE2 4.32Å; L55-F107 HydrophobicContact CD2-CD2 4.36Å; L55-F107 HydrophobicContact CD2-CE2 3.89Å; L55-F107 WeakPolarHBondContact O-CZ 3.38Å
56	D	87.6	Confident	77.7	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.251	37%	0.374	S	S	.	.	H	α-helix	trans	-75.5	-36.4	-174.2	-45.4	-47.9	0	0	0	110.5	L52 T53 Q59 I60 R106	L52-D56 HydrophobicContact CD2-CB 4.26Å; T53-D56 WeakPolarHBondContact CB-OD2 3.31Å; T53-D56 VanDerWaalsContact CG2-OD2 3.26Å; T53-D56 WeakPolarHBondContact CG2-OD2 3.42Å; T53-D56 PolarHBondContact O-N 2.86Å; T53-D56 VanDerWaalsContact O-N 3.09Å; T53-D56 VanDerWaalsContact OG1-CG 3.26Å; T53-D56 PolarHBondContact OG1-N 3.42Å; T53-D56 PolarHBondContact OG1-OD2 3.21Å; D56-Q59 WeakPolarHBondContact O-CB 3.39Å; D56-Q59 PolarHBondContact O-N 2.85Å; D56-I60 WeakPolarHBondContact O-CG1 3.48Å; D56-I60 PolarHBondContact O-N 2.82Å; D56-I60 VanDerWaalsContact O-N 3.14Å; D56-R106 IonicContact OD1-CZ 3.89Å; D56-R106 VanDerWaalsContact OD1-CZ 3.28Å; D56-R106 IonicContact OD1-NH1 3.01Å; D56-R106 PolarHBondContact OD1-NH1 3.21Å; D56-R106 IonicContact OD1-NH2 3.33Å; D56-R106 PolarHBondContact OD1-NH2 3.49Å
57	A	89.2	Confident	79.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.6	-36.1	168.5	0	0	0	0	0	112.8	L52 T53 V61 I78 L83 V84	L52-A57 HydrophobicContact CB-CB 4.29Å; T53-A57 WeakPolarHBondContact O-CB 3.48Å; T53-A57 PolarHBondContact O-N 2.85Å; A57-V61 WeakPolarHBondContact O-CB 3.41Å; A57-V61 WeakPolarHBondContact O-CG2 3.4Å; A57-V61 PolarHBondContact O-N 3.03Å; A57-V61 VanDerWaalsContact O-N 3.16Å; A57-I78 HydrophobicContact CB-CD1 3.98Å; A57-I78 HydrophobicContact CB-CG1 3.96Å; A57-I78 HydrophobicContact CB-CG2 3.89Å; A57-L83 HydrophobicContact CB-CB 3.78Å; A57-L83 HydrophobicContact CB-CD1 4.23Å; A57-V84 HydrophobicContact CB-CG2 3.59Å
58	A	89.4	Confident	82.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-72	-29.8	174.3	0	0	0	0	0	113.1	W54 L55 L62 I74 I78 L92 M96 F107	W54-A58 WeakPolarHBondContact O-CB 3.48Å; W54-A58 PolarHBondContact O-N 3.33Å; L55-A58 CarbonylContact O-C 3.56Å; L55-A58 PolarHBondContact O-N 3.39Å; A58-L62 WeakPolarHBondContact O-CB 3.33Å; A58-L62 WeakPolarHBondContact O-CG 3.47Å; A58-L62 PolarHBondContact O-N 2.79Å; A58-L62 VanDerWaalsContact O-N 3.13Å; A58-I74 HydrophobicContact CB-CG2 3.95Å; A58-I78 HydrophobicContact CB-CD1 3.99Å; A58-L92 HydrophobicContact CB-CD1 3.99Å; A58-M96 HydrophobicContact CB-SD 4.01Å; A58-F107 HydrophobicContact CB-CE1 4.47Å; A58-F107 HydrophobicContact CB-CZ 4.5Å
59	Q	89.1	Confident	84	Confident	47 Å²	47	55.9 Å²	55.9	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-59.5	170.5	-176.1	-178.6	-32.7	0	0	109.6	L55 D56 V61 L62 E63 F107 L119	L55-Q59 PolarHBondContact O-N 3.26Å; D56-Q59 WeakPolarHBondContact O-CB 3.39Å; D56-Q59 PolarHBondContact O-N 2.85Å; Q59-V61 VanDerWaalsContact C-N 3.27Å; Q59-V61 PolarHBondContact O-N 3.39Å; Q59-L62 PolarHBondContact O-N 3.24Å; Q59-E63 WeakPolarHBondContact CG-OE2 3.44Å; Q59-E63 PolarHBondContact NE2-OE2 2.91Å; Q59-E63 VanDerWaalsContact O-CB 3.3Å; Q59-E63 WeakPolarHBondContact O-CB 3.43Å; Q59-E63 PolarHBondContact O-N 2.94Å; Q59-F107 HydrophobicContact CB-CE1 4.25Å; Q59-F107 HydrophobicContact CB-CZ 3.96Å; Q59-L119 HydrophobicContact CG-CD2 4.04Å
60	I	87.9	Confident	85.6	Confident	70 Å²	70	52.6 Å²	52.6	36%	0.359	29%	0.29	S	S	.	.	H	α-helix	trans	-52.5	-45.2	-178.8	-64.5	162.9	0	0	0	111.7	L52 D56 E63 E64	L52-I60 HydrophobicContact CD1-CD1 3.76Å; D56-I60 WeakPolarHBondContact O-CG1 3.48Å; D56-I60 PolarHBondContact O-N 2.82Å; D56-I60 VanDerWaalsContact O-N 3.14Å; I60-E63 PolarHBondContact O-N 3.47Å; I60-E64 PolarHBondContact O-N 3.08Å; I60-E64 VanDerWaalsContact O-N 3.09Å
61	V	90.4	Very high	87	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.5	-34.6	-178.9	164.2	0	0	0	0	113.3	A57 Q59 A65 M69 I74 R77 I78 L83	A57-V61 WeakPolarHBondContact O-CB 3.41Å; A57-V61 WeakPolarHBondContact O-CG2 3.4Å; A57-V61 PolarHBondContact O-N 3.03Å; A57-V61 VanDerWaalsContact O-N 3.16Å; Q59-V61 VanDerWaalsContact C-N 3.27Å; Q59-V61 PolarHBondContact O-N 3.39Å; V61-A65 VanDerWaalsContact O-CB 3.25Å; V61-A65 WeakPolarHBondContact O-CB 3.28Å; V61-A65 PolarHBondContact O-N 3.3Å; V61-M69 HydrophobicContact CG1-CE 4.33Å; V61-M69 HydrophobicContact CG1-SD 4.03Å; V61-I74 HydrophobicContact CG1-CG2 4.1Å; V61-R77 HydrophobicContact CG1-CB 3.79Å; V61-R77 HydrophobicContact CG1-CG 4.48Å; V61-R77 HydrophobicContact CG2-CB 4.04Å; V61-I78 HydrophobicContact CB-CG1 4.41Å; V61-I78 HydrophobicContact CG2-CG1 3.84Å; V61-L83 HydrophobicContact CG2-CD1 4.18Å
62	L	89.3	Confident	87.9	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-78.9	-32.1	174.5	-75.4	169.8	0	0	0	112.6	A58 Q59 A65 G66 M69 I74 F107 F117 L119	A58-L62 WeakPolarHBondContact O-CB 3.33Å; A58-L62 WeakPolarHBondContact O-CG 3.47Å; A58-L62 PolarHBondContact O-N 2.79Å; A58-L62 VanDerWaalsContact O-N 3.13Å; Q59-L62 PolarHBondContact O-N 3.24Å; L62-A65 PolarHBondContact O-N 3.44Å; L62-G66 PolarHBondContact O-N 3.35Å; L62-M69 HydrophobicContact CD2-CB 3.75Å; L62-M69 HydrophobicContact CD2-CG 3.7Å; L62-M69 HydrophobicContact CD2-SD 3.93Å; L62-I74 HydrophobicContact CD1-CD1 4.18Å; L62-I74 HydrophobicContact CD2-CD1 3.9Å; L62-I74 HydrophobicContact CD2-CG1 4.21Å; L62-I74 HydrophobicContact CG-CD1 4.16Å; L62-I74 HydrophobicContact CG-CG1 4.48Å; L62-F107 HydrophobicContact CD1-CD1 3.74Å; L62-F107 HydrophobicContact CD1-CE1 3.89Å; L62-F117 HydrophobicContact CD1-CB 4.47Å; L62-L119 HydrophobicContact CB-CD1 4.05Å; L62-L119 HydrophobicContact CB-CD2 4.45Å; L62-L119 HydrophobicContact CB-CG 3.82Å
63	E	87.6	Confident	88.4	Confident	113 Å²	113	52.4 Å²	52.4	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-66.9	-51.3	-178.6	-156.9	162	152.1	0	0	110.4	Q59 I60 A65 G66 L119	Q59-E63 WeakPolarHBondContact CG-OE2 3.44Å; Q59-E63 PolarHBondContact NE2-OE2 2.91Å; Q59-E63 VanDerWaalsContact O-CB 3.3Å; Q59-E63 WeakPolarHBondContact O-CB 3.43Å; Q59-E63 PolarHBondContact O-N 2.94Å; I60-E63 PolarHBondContact O-N 3.47Å; E63-A65 VanDerWaalsContact C-N 3.32Å; E63-A65 PolarHBondContact O-N 2.93Å; E63-G66 PolarHBondContact O-N 3.01Å; E63-L119 HydrophobicContact CB-CD1 3.67Å; E63-L119 HydrophobicContact CG-CD1 4.02Å
64	E	87.4	Confident	88.5	Confident	121 Å²	121	48.8 Å²	48.8	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-66.3	-32.1	174.8	-169.6	-157.4	108.4	0	0	112.9	I60 G66 R81	I60-E64 PolarHBondContact O-N 3.08Å; I60-E64 VanDerWaalsContact O-N 3.09Å; E64-G66 VanDerWaalsContact C-N 3.28Å; E64-G66 PolarHBondContact O-N 3.28Å; E64-R81 IonicContact OE1-CZ 3.68Å; E64-R81 IonicContact OE1-NH1 3.28Å; E64-R81 IonicContact OE1-NH2 2.67Å; E64-R81 PolarHBondContact OE1-NH2 2.98Å; E64-R81 IonicContact OE2-CZ 3.81Å; E64-R81 IonicContact OE2-NH1 3.41Å; E64-R81 PolarHBondContact OE2-NH1 3.28Å; E64-R81 IonicContact OE2-NH2 3.9Å; E64-R81 PolarHBondContact OE2-NH2 2.95Å
65	A	86.4	Confident	88.6	Confident	21 Å²	21	52.1 Å²	52.1	17%	0.174	27%	0.268	C	S	.	.	H	α-helix	trans	-70.7	-24.1	179	0	0	0	0	0	113.2	V61 L62 E63 R67 M69	V61-A65 VanDerWaalsContact O-CB 3.25Å; V61-A65 WeakPolarHBondContact O-CB 3.28Å; V61-A65 PolarHBondContact O-N 3.3Å; L62-A65 PolarHBondContact O-N 3.44Å; E63-A65 VanDerWaalsContact C-N 3.32Å; E63-A65 PolarHBondContact O-N 2.93Å; A65-R67 HydrophobicContact CB-CG 4.3Å; A65-R67 WeakPolarHBondContact O-CG 3.38Å; A65-R67 PolarHBondContact O-N 3.34Å; A65-M69 HydrophobicContact CB-CE 4.36Å; A65-M69 HydrophobicContact CB-CG 4.09Å; A65-M69 HydrophobicContact CB-SD 3.37Å; A65-M69 WeakPolarHBondContact CB-SD 3.41Å
66	G	83.1	Confident	88.6	Confident	75 Å²	75	56 Å²	56	77%	0.773	29%	0.286	S	S	*	.			trans	59.4	9	-179.2	0	0	0	0	0	115.3	L62 E63 E64	L62-G66 PolarHBondContact O-N 3.35Å; E63-G66 PolarHBondContact O-N 3.01Å; E64-G66 VanDerWaalsContact C-N 3.28Å; E64-G66 PolarHBondContact O-N 3.28Å
67	R	87.5	Confident	88.8	Confident	109 Å²	109	57.1 Å²	57.1	41%	0.411	29%	0.286	S	S	.	.	S	Bend	trans	-143.3	160.1	-172.2	70.2	168.1	165.8	80.5	-4	112.2	A65 M69 E73	A65-R67 HydrophobicContact CB-CG 4.3Å; A65-R67 WeakPolarHBondContact O-CG 3.38Å; A65-R67 PolarHBondContact O-N 3.34Å; R67-M69 HydrophobicContact CG-CG 4.45Å; R67-E73 IonicContact CZ-OE1 4Å; R67-E73 IonicContact CZ-OE2 3.32Å; R67-E73 IonicContact NH1-OE1 3.87Å; R67-E73 PolarHBondContact NH1-OE1 3.47Å; R67-E73 IonicContact NH1-OE2 2.62Å; R67-E73 PolarHBondContact NH1-OE2 3.29Å; R67-E73 IonicContact NH2-OE1 2.72Å; R67-E73 PolarHBondContact NH2-OE1 3.5Å; R67-E73 IonicContact NH2-OE2 2.73Å
68	P	88.6	Confident	88.8	Confident	63 Å²	63	57.1 Å²	57.1	41%	0.409	29%	0.286	S	S	.	.			trans	-59.7	139.2	166.4	-20.2	32.3	0	0	0	111.9	I110 V116 F117 A118	P68-I110 HydrophobicContact CB-CD1 3.52Å; P68-I110 HydrophobicContact CG-CD1 3.53Å; P68-V116 HydrophobicContact CB-CG1 3.64Å; P68-F117 WeakPolarHBondContact CA-O 3.42Å; P68-A118 HydrophobicContact CB-CB 4.14Å; P68-A118 HydrophobicContact CG-CB 4.08Å
69	M	87.9	Confident	88.7	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152	-179.5	-58.6	-175.9	76.4	0	0	111	V61 L62 A65 R67 E73 I74 V116 F117	V61-M69 HydrophobicContact CG1-CE 4.33Å; V61-M69 HydrophobicContact CG1-SD 4.03Å; L62-M69 HydrophobicContact CD2-CB 3.75Å; L62-M69 HydrophobicContact CD2-CG 3.7Å; L62-M69 HydrophobicContact CD2-SD 3.93Å; A65-M69 HydrophobicContact CB-CE 4.36Å; A65-M69 HydrophobicContact CB-CG 4.09Å; A65-M69 HydrophobicContact CB-SD 3.37Å; A65-M69 WeakPolarHBondContact CB-SD 3.41Å; R67-M69 HydrophobicContact CG-CG 4.45Å; M69-E73 HydrophobicContact CE-CB 4.19Å; M69-E73 HydrophobicContact CE-CG 3.57Å; M69-E73 WeakPolarHBondContact CE-OE1 3.32Å; M69-I74 HydrophobicContact CB-CD1 4.04Å; M69-I74 HydrophobicContact CB-CG1 3.58Å; M69-I74 HydrophobicContact SD-CG1 4.3Å; M69-V116 WeakPolarHBondContact O-CA 3.42Å; M69-F117 PolarHBondContact N-O 3.12Å; M69-F117 PolarHBondContact O-N 3.38Å
70	H	91.8	Very high	88.5	Confident	68 Å²	68	62.8 Å²	62.8	32%	0.315	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144.6	174.1	-175.8	-108	0	0	0	111	K72 E73 I74 G115 V116	H70-K72 PolarHBondContact ND1-N 3.02Å; H70-K72 PolarHBondContact O-N 3.45Å; H70-E73 WeakPolarHBondContact O-CA 3.5Å; H70-E73 VanDerWaalsContact O-CB 3.27Å; H70-E73 WeakPolarHBondContact O-CB 3.13Å; H70-E73 PolarHBondContact O-N 3.33Å; H70-I74 PolarHBondContact O-N 2.98Å; H70-G115 CarbonylContact C-O 3.58Å; H70-G115 WeakPolarHBondContact CA-O 3.36Å; H70-G115 VanDerWaalsContact CD2-C 3.48Å; H70-G115 PolarHBondContact CD2-O 2.97Å; H70-G115 VanDerWaalsContact CD2-O 3.3Å; H70-V116 HydrophobicContact CB-CG2 4.35Å
71	I	90.5	Very high	88.3	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-54.4	-31	-174.7	-166.6	61.5	0	0	0	114	K75 L92 E93 M96 G115 F117	I71-K75 WeakPolarHBondContact O-CB 3.47Å; I71-K75 PolarHBondContact O-N 3.4Å; I71-L92 HydrophobicContact CD1-CD2 3.95Å; I71-L92 HydrophobicContact CD1-CG 3.87Å; I71-E93 HydrophobicContact CG1-CB 4.08Å; I71-E93 HydrophobicContact CG1-CG 4.35Å; I71-M96 HydrophobicContact CD1-CB 4.07Å; I71-M96 HydrophobicContact CD1-CG 3.84Å; I71-G115 WeakPolarHBondContact CB-O 3.3Å; I71-G115 PolarHBondContact N-O 3.49Å; I71-F117 HydrophobicContact CB-CD2 4.21Å; I71-F117 HydrophobicContact CB-CE2 4Å; I71-F117 HydrophobicContact CD1-CD2 4.05Å; I71-F117 HydrophobicContact CD1-CE2 3.89Å; I71-F117 HydrophobicContact CG1-CE2 4.19Å
72	K	89.8	Confident	88	Confident	160 Å²	160	64.3 Å²	64.3	70%	0.696	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-39.6	172.5	-65.2	-179	179.3	-178.5	0	112.7	H70 K75 Q76	H70-K72 PolarHBondContact ND1-N 3.02Å; H70-K72 PolarHBondContact O-N 3.45Å; K72-K75 PolarHBondContact O-N 3.42Å; K72-Q76 WeakPolarHBondContact O-CB 3.33Å; K72-Q76 PolarHBondContact O-N 3.03Å
73	E	91.3	Very high	87.6	Confident	64 Å²	64	65.3 Å²	65.3	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-42.8	177.3	-163	-168.1	177.9	0	0	110.8	R67 M69 H70 Q76 R77	R67-E73 IonicContact CZ-OE1 4Å; R67-E73 IonicContact CZ-OE2 3.32Å; R67-E73 IonicContact NH1-OE1 3.87Å; R67-E73 PolarHBondContact NH1-OE1 3.47Å; R67-E73 IonicContact NH1-OE2 2.62Å; R67-E73 PolarHBondContact NH1-OE2 3.29Å; R67-E73 IonicContact NH2-OE1 2.72Å; R67-E73 PolarHBondContact NH2-OE1 3.5Å; R67-E73 IonicContact NH2-OE2 2.73Å; M69-E73 HydrophobicContact CE-CB 4.19Å; M69-E73 HydrophobicContact CE-CG 3.57Å; M69-E73 WeakPolarHBondContact CE-OE1 3.32Å; H70-E73 WeakPolarHBondContact O-CA 3.5Å; H70-E73 VanDerWaalsContact O-CB 3.27Å; H70-E73 WeakPolarHBondContact O-CB 3.13Å; H70-E73 PolarHBondContact O-N 3.33Å; E73-Q76 PolarHBondContact O-N 3.38Å; E73-R77 PolarHBondContact O-N 3.03Å; E73-R77 VanDerWaalsContact O-N 3.11Å; E73-R77 IonicContact OE1-NH2 2.69Å
74	I	89.1	Confident	87.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-49.3	173.9	-55.8	168.8	0	0	0	109.9	A58 V61 L62 M69 H70 Q76 R77 I78 L92 F117	A58-I74 HydrophobicContact CB-CG2 3.95Å; V61-I74 HydrophobicContact CG1-CG2 4.1Å; L62-I74 HydrophobicContact CD1-CD1 4.18Å; L62-I74 HydrophobicContact CD2-CD1 3.9Å; L62-I74 HydrophobicContact CD2-CG1 4.21Å; L62-I74 HydrophobicContact CG-CD1 4.16Å; L62-I74 HydrophobicContact CG-CG1 4.48Å; M69-I74 HydrophobicContact CB-CD1 4.04Å; M69-I74 HydrophobicContact CB-CG1 3.58Å; M69-I74 HydrophobicContact SD-CG1 4.3Å; H70-I74 PolarHBondContact O-N 2.98Å; I74-Q76 VanDerWaalsContact C-N 3.31Å; I74-Q76 PolarHBondContact O-N 3.09Å; I74-R77 PolarHBondContact O-N 3.1Å; I74-I78 HydrophobicContact CG2-CD1 3.9Å; I74-I78 VanDerWaalsContact O-CG1 3.3Å; I74-I78 WeakPolarHBondContact O-CG1 3.47Å; I74-I78 PolarHBondContact O-N 3.13Å; I74-I78 VanDerWaalsContact O-N 3.09Å; I74-L92 HydrophobicContact CB-CD2 4.36Å; I74-L92 HydrophobicContact CG2-CD2 4.01Å; I74-F117 HydrophobicContact CD1-CB 4.1Å
75	K	89.2	Confident	86.6	Confident	96 Å²	96	59.2 Å²	59.2	42%	0.417	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-44.1	178	-170.4	-173.2	174.1	-171.4	0	111.9	W54 I71 K72 I78 I79 L92	W54-K75 HydrophobicContact CH2-CG 4.4Å; W54-K75 HydrophobicContact CZ3-CG 4.43Å; I71-K75 WeakPolarHBondContact O-CB 3.47Å; I71-K75 PolarHBondContact O-N 3.4Å; K72-K75 PolarHBondContact O-N 3.42Å; K75-I78 PolarHBondContact O-N 2.87Å; K75-I79 HydrophobicContact CD-CD1 4.5Å; K75-I79 HydrophobicContact CG-CD1 4Å; K75-I79 WeakPolarHBondContact O-CG1 3.36Å; K75-I79 PolarHBondContact O-N 3.3Å; K75-L92 HydrophobicContact CB-CD2 3.8Å; K75-L92 HydrophobicContact CG-CD2 4.35Å
76	Q	88.4	Confident	85.5	Confident	106 Å²	106	63.6 Å²	63.6	50%	0.495	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-55.9	-179	-164.5	58.6	53.1	0	0	110.2	K72 E73 I74 I78 I79 D80	K72-Q76 WeakPolarHBondContact O-CB 3.33Å; K72-Q76 PolarHBondContact O-N 3.03Å; E73-Q76 PolarHBondContact O-N 3.38Å; I74-Q76 VanDerWaalsContact C-N 3.31Å; I74-Q76 PolarHBondContact O-N 3.09Å; Q76-I78 VanDerWaalsContact C-N 3.27Å; Q76-I78 PolarHBondContact O-N 3.13Å; Q76-I78 VanDerWaalsContact O-N 3.17Å; Q76-I79 CarbonylContact O-C 3.56Å; Q76-I79 WeakPolarHBondContact O-CA 3.47Å; Q76-I79 WeakPolarHBondContact O-CB 3.41Å; Q76-I79 PolarHBondContact O-N 3.24Å; Q76-D80 VanDerWaalsContact C-OD2 3.24Å; Q76-D80 PolarHBondContact NE2-OD1 3.14Å; Q76-D80 PolarHBondContact O-N 2.69Å; Q76-D80 VanDerWaalsContact O-OD2 3.13Å
77	R	90	Very high	84.4	Confident	69 Å²	69	65.6 Å²	65.6	26%	0.26	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-32.9	179.9	-69.2	-166.9	-172.7	-168.8	-2.5	114.2	V61 E73 I74 I79 D80 R81	V61-R77 HydrophobicContact CG1-CB 3.79Å; V61-R77 HydrophobicContact CG1-CG 4.48Å; V61-R77 HydrophobicContact CG2-CB 4.04Å; E73-R77 PolarHBondContact O-N 3.03Å; E73-R77 VanDerWaalsContact O-N 3.11Å; E73-R77 IonicContact OE1-NH2 2.69Å; I74-R77 PolarHBondContact O-N 3.1Å; R77-I79 VanDerWaalsContact C-N 3.34Å; R77-D80 WeakPolarHBondContact CA-OD2 3.24Å; R77-D80 PolarHBondContact N-OD2 3.41Å; R77-R81 WeakPolarHBondContact O-CB 3.24Å; R77-R81 VanDerWaalsContact O-CD 3.28Å; R77-R81 WeakPolarHBondContact O-CD 3.2Å; R77-R81 WeakPolarHBondContact O-CG 3.37Å; R77-R81 PolarHBondContact O-N 3.25Å
78	I	89.5	Confident	83.3	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-41.6	174.2	-71.1	172.6	0	0	0	111.3	W54 A57 A58 V61 I74 K75 Q76 G82 L83 V84 L92	W54-I78 HydrophobicContact CE3-CD1 3.97Å; W54-I78 HydrophobicContact CE3-CG2 3.84Å; W54-I78 HydrophobicContact CH2-CG2 4.4Å; W54-I78 HydrophobicContact CZ3-CB 4.08Å; W54-I78 HydrophobicContact CZ3-CD1 4.16Å; W54-I78 HydrophobicContact CZ3-CG2 3.45Å; W54-I78 VanDerWaalsContact CZ3-CG2 3.45Å; A57-I78 HydrophobicContact CB-CD1 3.98Å; A57-I78 HydrophobicContact CB-CG1 3.96Å; A57-I78 HydrophobicContact CB-CG2 3.89Å; A58-I78 HydrophobicContact CB-CD1 3.99Å; V61-I78 HydrophobicContact CB-CG1 4.41Å; V61-I78 HydrophobicContact CG2-CG1 3.84Å; I74-I78 HydrophobicContact CG2-CD1 3.9Å; I74-I78 VanDerWaalsContact O-CG1 3.3Å; I74-I78 WeakPolarHBondContact O-CG1 3.47Å; I74-I78 PolarHBondContact O-N 3.13Å; I74-I78 VanDerWaalsContact O-N 3.09Å; K75-I78 PolarHBondContact O-N 2.87Å; Q76-I78 VanDerWaalsContact C-N 3.27Å; Q76-I78 PolarHBondContact O-N 3.13Å; Q76-I78 VanDerWaalsContact O-N 3.17Å; I78-G82 PolarHBondContact O-N 3.3Å; I78-L83 HydrophobicContact CG2-CB 4.27Å; I78-L83 PolarHBondContact O-N 3.21Å; I78-V84 HydrophobicContact CG2-CB 3.76Å; I78-V84 HydrophobicContact CG2-CG2 3.52Å; I78-L92 HydrophobicContact CD1-CD1 4.22Å; I78-L92 HydrophobicContact CD1-CD2 3.94Å
79	I	87.7	Confident	81.7	Confident	63 Å²	63	69.5 Å²	69.5	32%	0.323	35%	0.35	S	S	.	.	H	α-helix	trans	-72.9	-47.1	179	-67	169.6	0	0	0	110.4	W54 K75 Q76 R77 R81 G82	W54-I79 HydrophobicContact CH2-CG1 4.41Å; K75-I79 HydrophobicContact CD-CD1 4.5Å; K75-I79 HydrophobicContact CG-CD1 4Å; K75-I79 WeakPolarHBondContact O-CG1 3.36Å; K75-I79 PolarHBondContact O-N 3.3Å; Q76-I79 CarbonylContact O-C 3.56Å; Q76-I79 WeakPolarHBondContact O-CA 3.47Å; Q76-I79 WeakPolarHBondContact O-CB 3.41Å; Q76-I79 PolarHBondContact O-N 3.24Å; R77-I79 VanDerWaalsContact C-N 3.34Å; I79-R81 PolarHBondContact O-N 2.91Å; I79-R81 VanDerWaalsContact O-N 3.15Å; I79-G82 PolarHBondContact O-N 3.01Å
80	D	85.1	Confident	80.8	Confident	103 Å²	103	72.8 Å²	72.8	55%	0.551	37%	0.373	S	S	*	.	H	α-helix	trans	-56.2	-33.6	-179.5	-54.3	-29	0	0	0	112.3	Q76 R77	Q76-D80 VanDerWaalsContact C-OD2 3.24Å; Q76-D80 PolarHBondContact NE2-OD1 3.14Å; Q76-D80 PolarHBondContact O-N 2.69Å; Q76-D80 VanDerWaalsContact O-OD2 3.13Å; R77-D80 WeakPolarHBondContact CA-OD2 3.24Å; R77-D80 PolarHBondContact N-OD2 3.41Å
81	R	84.9	Confident	80.4	Confident	66 Å²	66	72.3 Å²	72.3	25%	0.249	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-17.4	178.8	-68.6	169.7	-177.4	-148.1	-11.8	113.8	K49 E64 R77 I79 L83	K49-R81 PolarHBondContact NZ-O 3.31Å; E64-R81 IonicContact OE1-CZ 3.68Å; E64-R81 IonicContact OE1-NH1 3.28Å; E64-R81 IonicContact OE1-NH2 2.67Å; E64-R81 PolarHBondContact OE1-NH2 2.98Å; E64-R81 IonicContact OE2-CZ 3.81Å; E64-R81 IonicContact OE2-NH1 3.41Å; E64-R81 PolarHBondContact OE2-NH1 3.28Å; E64-R81 IonicContact OE2-NH2 3.9Å; E64-R81 PolarHBondContact OE2-NH2 2.95Å; R77-R81 WeakPolarHBondContact O-CB 3.24Å; R77-R81 VanDerWaalsContact O-CD 3.28Å; R77-R81 WeakPolarHBondContact O-CD 3.2Å; R77-R81 WeakPolarHBondContact O-CG 3.37Å; R77-R81 PolarHBondContact O-N 3.25Å; I79-R81 PolarHBondContact O-N 2.91Å; I79-R81 VanDerWaalsContact O-N 3.15Å; R81-L83 HydrophobicContact CB-CD1 4.1Å; R81-L83 HydrophobicContact CB-CG 3.78Å
82	G	82.1	Confident	80.1	Confident	37 Å²	37	71.9 Å²	71.9	38%	0.381	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	26	-172.2	0	0	0	0	0	114.2	I78 I79 V84	I78-G82 PolarHBondContact O-N 3.3Å; I79-G82 PolarHBondContact O-N 3.01Å; G82-V84 VanDerWaalsContact C-N 3.31Å; G82-V84 PolarHBondContact O-N 2.99Å
83	L	81.8	Confident	79.9	Confident	26 Å²	26	68.8 Å²	68.8	14%	0.136	36%	0.363	C	S	.	.	S	Bend	trans	-73.1	-23.8	-178.7	-62.4	171	0	0	0	112.7	L52 A57 V61 I78 R81	L52-L83 HydrophobicContact CD1-CB 4.34Å; L52-L83 HydrophobicContact CD1-CD2 3.92Å; L52-L83 PolarHBondContact N-O 3.31Å; L52-L83 VanDerWaalsContact N-O 3.11Å; A57-L83 HydrophobicContact CB-CB 3.78Å; A57-L83 HydrophobicContact CB-CD1 4.23Å; V61-L83 HydrophobicContact CG2-CD1 4.18Å; I78-L83 HydrophobicContact CG2-CB 4.27Å; I78-L83 PolarHBondContact O-N 3.21Å; R81-L83 HydrophobicContact CB-CD1 4.1Å; R81-L83 HydrophobicContact CB-CG 3.78Å
84	V	82.8	Confident	79.7	Confident	13 Å²	13	68.7 Å²	68.7	8%	0.079	37%	0.373	C	S	.	.	S	Bend	trans	-140.2	136.5	176	-173.2	0	0	0	0	109.2	W54 A57 I78 G82 A88	W54-V84 HydrophobicContact CD2-CB 4.31Å; W54-V84 HydrophobicContact CD2-CG1 3.87Å; W54-V84 HydrophobicContact CD2-CG2 4.21Å; W54-V84 HydrophobicContact CE3-CB 4.15Å; W54-V84 HydrophobicContact CE3-CG1 4.21Å; W54-V84 HydrophobicContact CE3-CG2 3.96Å; W54-V84 HydrophobicContact CG-CG1 4.38Å; W54-V84 HydrophobicContact CH2-CB 4.34Å; W54-V84 HydrophobicContact CH2-CG1 4.28Å; W54-V84 HydrophobicContact CZ2-CB 4.48Å; W54-V84 HydrophobicContact CZ2-CG1 3.92Å; W54-V84 HydrophobicContact CZ3-CB 4.19Å; W54-V84 HydrophobicContact CZ3-CG1 4.42Å; W54-V84 HydrophobicContact CZ3-CG2 4.39Å; A57-V84 HydrophobicContact CB-CG2 3.59Å; I78-V84 HydrophobicContact CG2-CB 3.76Å; I78-V84 HydrophobicContact CG2-CG2 3.52Å; G82-V84 VanDerWaalsContact C-N 3.31Å; G82-V84 PolarHBondContact O-N 2.99Å; V84-A88 HydrophobicContact CG1-CB 3.9Å
85	Q	71.8	Confident	79.7	Confident	94 Å²	94	70.4 Å²	70.4	44%	0.439	38%	0.384	S	S	.	.			trans	-64.6	139.5	177.8	-60	-172.2	13.4	0	0	112	N51 N87 A88	N51-Q85 VanDerWaalsContact OD1-CG 3.28Å; N51-Q85 WeakPolarHBondContact OD1-CG 3.34Å; N51-Q85 PolarHBondContact OD1-NE2 3.02Å; Q85-N87 VanDerWaalsContact CB-OD1 3.29Å; Q85-N87 WeakPolarHBondContact CB-OD1 3.28Å; Q85-N87 PolarHBondContact O-N 2.85Å; Q85-N87 VanDerWaalsContact O-N 3.1Å; Q85-N87 PolarHBondContact OE1-ND2 3.06Å; Q85-N87 PolarHBondContact OE1-OD1 3Å; Q85-A88 VanDerWaalsContact O-CB 3.28Å; Q85-A88 WeakPolarHBondContact O-CB 3.45Å; Q85-A88 PolarHBondContact O-N 3.48Å; Q85-A88 VanDerWaalsContact O-N 3.08Å
86	S	63.5	Low	79.6	Confident	113 Å²	113	65.8 Å²	65.8	79%	0.79	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.1	177.7	52.8	0	0	0	0	114.3
87	N	59.3	Low	79.5	Confident	117 Å²	117	63.7 Å²	63.7	63%	0.626	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-3.1	176	66.4	25.4	0	0	0	114.4	Q85 K89	Q85-N87 VanDerWaalsContact CB-OD1 3.29Å; Q85-N87 WeakPolarHBondContact CB-OD1 3.28Å; Q85-N87 PolarHBondContact O-N 2.85Å; Q85-N87 VanDerWaalsContact O-N 3.1Å; Q85-N87 PolarHBondContact OE1-ND2 3.06Å; Q85-N87 PolarHBondContact OE1-OD1 3Å; N87-K89 PolarHBondContact O-N 2.95Å
88	A	63.3	Low	79.2	Confident	34 Å²	34	69.6 Å²	69.6	28%	0.281	37%	0.374	S	S	.	.			trans	-58.6	125.6	-167.2	0	0	0	0	0	113.1	W54 V84 Q85 S90	W54-A88 HydrophobicContact CZ2-CB 4.21Å; V84-A88 HydrophobicContact CG1-CB 3.9Å; Q85-A88 VanDerWaalsContact O-CB 3.28Å; Q85-A88 WeakPolarHBondContact O-CB 3.45Å; Q85-A88 PolarHBondContact O-N 3.48Å; Q85-A88 VanDerWaalsContact O-N 3.08Å; A88-S90 PolarHBondContact O-N 3.04Å
89	K	56.7	Low	79	Confident	219 Å²	219	72 Å²	72	95%	0.952	39%	0.385	S	S	*	.	S	Bend	trans	-65.4	2.3	-170.2	-166.6	169.7	178.2	176.7	0	115.9	N87	N87-K89 PolarHBondContact O-N 2.95Å
90	S	68.6	Low	78.8	Confident	71 Å²	71	70.1 Å²	70.1	50%	0.497	38%	0.377	S	S	.	.	S	Bend	trans	-127.9	144.4	172.7	-79.1	0	0	0	0	110.2	W54 A88	W54-S90 PolarHBondContact NE1-O 3.13Å; A88-S90 PolarHBondContact O-N 3.04Å
91	S	82.4	Confident	78.4	Confident	57 Å²	57	72 Å²	72	40%	0.399	38%	0.382	S	S	.	.			trans	-79.8	131.1	168.5	179.5	0	0	0	0	110.2	E93 A94 V95	S91-E93 PolarHBondContact O-N 2.75Å; S91-E93 VanDerWaalsContact O-N 3.12Å; S91-E93 PolarHBondContact OG-N 2.98Å; S91-A94 PolarHBondContact O-N 2.94Å; S91-V95 PolarHBondContact O-N 3.27Å
92	L	85.1	Confident	77.6	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	41%	0.406	C	S	.	.	H	α-helix	trans	-42.7	-45.1	170.7	174.4	62.4	0	0	0	112.4	W54 A58 I71 I74 K75 I78 A94 V95 M96	W54-L92 HydrophobicContact CB-CD1 3.89Å; W54-L92 HydrophobicContact CD2-CB 3.84Å; W54-L92 HydrophobicContact CD2-CD1 4.33Å; W54-L92 HydrophobicContact CE3-CB 3.64Å; W54-L92 HydrophobicContact CE3-CD1 3.9Å; W54-L92 HydrophobicContact CE3-CD2 4.24Å; W54-L92 HydrophobicContact CE3-CG 4.11Å; W54-L92 HydrophobicContact CG-CB 4.3Å; W54-L92 HydrophobicContact CG-CD1 4.4Å; W54-L92 HydrophobicContact CZ3-CB 4.01Å; W54-L92 HydrophobicContact CZ3-CD2 4.35Å; W54-L92 VanDerWaalsContact O-CD1 3.32Å; W54-L92 WeakPolarHBondContact O-CD1 3.43Å; A58-L92 HydrophobicContact CB-CD1 3.99Å; I71-L92 HydrophobicContact CD1-CD2 3.95Å; I71-L92 HydrophobicContact CD1-CG 3.87Å; I74-L92 HydrophobicContact CB-CD2 4.36Å; I74-L92 HydrophobicContact CG2-CD2 4.01Å; K75-L92 HydrophobicContact CB-CD2 3.8Å; K75-L92 HydrophobicContact CG-CD2 4.35Å; I78-L92 HydrophobicContact CD1-CD1 4.22Å; I78-L92 HydrophobicContact CD1-CD2 3.94Å; L92-A94 PolarHBondContact O-N 3.48Å; L92-V95 PolarHBondContact O-N 2.92Å; L92-V95 VanDerWaalsContact O-N 3.16Å; L92-M96 HydrophobicContact CD1-CG 3.67Å; L92-M96 HydrophobicContact CD1-SD 4.39Å; L92-M96 HydrophobicContact CG-CG 4.1Å; L92-M96 WeakPolarHBondContact O-CB 3.48Å; L92-M96 WeakPolarHBondContact O-CG 3.32Å; L92-M96 PolarHBondContact O-N 2.85Å
93	E	86.3	Confident	76.6	Confident	94 Å²	94	78.1 Å²	78.1	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-58.9	-46.1	-178.7	-179.1	171.1	-154.2	0	0	112.4	I71 S91 V95 M96 Y97	I71-E93 HydrophobicContact CG1-CB 4.08Å; I71-E93 HydrophobicContact CG1-CG 4.35Å; S91-E93 PolarHBondContact O-N 2.75Å; S91-E93 VanDerWaalsContact O-N 3.12Å; S91-E93 PolarHBondContact OG-N 2.98Å; E93-V95 VanDerWaalsContact C-N 3.27Å; E93-V95 PolarHBondContact O-N 2.83Å; E93-M96 PolarHBondContact O-N 3.32Å; E93-Y97 HydrophobicContact CG-CD2 3.68Å; E93-Y97 HydrophobicContact CG-CE2 3.58Å; E93-Y97 WeakPolarHBondContact O-CB 3.43Å; E93-Y97 VanDerWaalsContact O-CD2 3.24Å; E93-Y97 WeakPolarHBondContact O-CD2 3.42Å; E93-Y97 PolarHBondContact O-N 2.99Å
94	A	86.9	Confident	76.2	Confident	62 Å²	62	77.4 Å²	77.4	51%	0.512	41%	0.414	S	S	.	.	H	α-helix	trans	-67.4	-29.2	178.8	0	0	0	0	0	112.5	S91 L92 R98	S91-A94 PolarHBondContact O-N 2.94Å; L92-A94 PolarHBondContact O-N 3.48Å; A94-R98 VanDerWaalsContact O-CB 3.28Å; A94-R98 WeakPolarHBondContact O-CB 3.46Å; A94-R98 PolarHBondContact O-N 3.18Å
95	V	87.4	Confident	75.5	Confident	36 Å²	36	82.9 Å²	82.9	22%	0.218	43%	0.433	C	S	.	.	H	α-helix	trans	-76.6	-48.2	176.1	-172.6	0	0	0	0	110.3	L55 S91 L92 E93 Y97 R98 E99	L55-V95 HydrophobicContact CD1-CG1 4.07Å; L55-V95 HydrophobicContact CD2-CG1 3.72Å; L55-V95 HydrophobicContact CG-CG1 3.62Å; S91-V95 PolarHBondContact O-N 3.27Å; L92-V95 PolarHBondContact O-N 2.92Å; L92-V95 VanDerWaalsContact O-N 3.16Å; E93-V95 VanDerWaalsContact C-N 3.27Å; E93-V95 PolarHBondContact O-N 2.83Å; V95-Y97 PolarHBondContact O-N 2.9Å; V95-R98 PolarHBondContact O-N 3.01Å; V95-R98 VanDerWaalsContact O-N 3.17Å; V95-E99 VanDerWaalsContact O-CB 3.3Å; V95-E99 WeakPolarHBondContact O-CB 3.41Å; V95-E99 PolarHBondContact O-N 3.02Å
96	M	87.3	Confident	75.5	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-61.8	-40.5	178.1	-71.2	-66.7	-69.9	0	0	112.8	L55 A58 I71 L92 E93 T100 F107 F117	L55-M96 HydrophobicContact CD2-SD 3.75Å; A58-M96 HydrophobicContact CB-SD 4.01Å; I71-M96 HydrophobicContact CD1-CB 4.07Å; I71-M96 HydrophobicContact CD1-CG 3.84Å; L92-M96 HydrophobicContact CD1-CG 3.67Å; L92-M96 HydrophobicContact CD1-SD 4.39Å; L92-M96 HydrophobicContact CG-CG 4.1Å; L92-M96 WeakPolarHBondContact O-CB 3.48Å; L92-M96 WeakPolarHBondContact O-CG 3.32Å; L92-M96 PolarHBondContact O-N 2.85Å; E93-M96 PolarHBondContact O-N 3.32Å; M96-T100 WeakPolarHBondContact O-CB 3.47Å; M96-T100 PolarHBondContact O-N 3Å; M96-T100 PolarHBondContact O-OG1 3.35Å; M96-F107 HydrophobicContact CE-CB 4.11Å; M96-F107 HydrophobicContact CE-CD1 3.73Å; M96-F107 HydrophobicContact CE-CD2 4.35Å; M96-F107 HydrophobicContact CE-CE1 4.24Å; M96-F107 HydrophobicContact CE-CG 3.78Å; M96-F107 HydrophobicContact SD-CD1 4.41Å; M96-F107 HydrophobicContact SD-CD2 4.26Å; M96-F107 HydrophobicContact SD-CE1 4.5Å; M96-F107 HydrophobicContact SD-CE2 4.36Å; M96-F107 HydrophobicContact SD-CG 4.28Å; M96-F107 HydrophobicContact SD-CZ 4.48Å; M96-F117 HydrophobicContact CB-CE1 4.05Å; M96-F117 HydrophobicContact CB-CE2 4.43Å; M96-F117 HydrophobicContact CB-CZ 3.99Å; M96-F117 HydrophobicContact CE-CB 3.87Å; M96-F117 HydrophobicContact CE-CD1 3.7Å; M96-F117 HydrophobicContact CE-CD2 4.41Å; M96-F117 HydrophobicContact CE-CE1 4.34Å; M96-F117 HydrophobicContact CE-CG 3.74Å
97	Y	86.5	Confident	76.5	Confident	62 Å²	62	76.4 Å²	76.4	24%	0.243	39%	0.387	C	S	.	.	H	α-helix	trans	-68.2	-38.9	173.4	-80	-59.5	0	0	0	112.3	E93 V95 E99 T100 Q101 F117	E93-Y97 HydrophobicContact CG-CD2 3.68Å; E93-Y97 HydrophobicContact CG-CE2 3.58Å; E93-Y97 WeakPolarHBondContact O-CB 3.43Å; E93-Y97 VanDerWaalsContact O-CD2 3.24Å; E93-Y97 WeakPolarHBondContact O-CD2 3.42Å; E93-Y97 PolarHBondContact O-N 2.99Å; V95-Y97 PolarHBondContact O-N 2.9Å; Y97-E99 VanDerWaalsContact C-N 3.34Å; Y97-E99 PolarHBondContact O-N 3.33Å; Y97-T100 PolarHBondContact O-OG1 2.97Å; Y97-Q101 VanDerWaalsContact O-CB 3.25Å; Y97-Q101 WeakPolarHBondContact O-CB 3.22Å; Y97-Q101 WeakPolarHBondContact O-CG 3.49Å; Y97-Q101 PolarHBondContact O-N 2.88Å; Y97-F117 HydrophobicContact CD1-CZ 4.03Å; Y97-F117 AromaticContact CE1-CZ 3.9Å; Y97-F117 HydrophobicContact CE1-CZ 3.9Å; Y97-F117 HydrophobicContact CG-CZ 4.42Å
98	R	84.6	Confident	77.7	Confident	192 Å²	192	75.5 Å²	75.5	73%	0.725	38%	0.378	S	S	*	.	H	α-helix	trans	-65.1	-38.8	176.7	177.4	177.1	-67.8	-151.1	-2.9	112.4	A94 V95	A94-R98 VanDerWaalsContact O-CB 3.28Å; A94-R98 WeakPolarHBondContact O-CB 3.46Å; A94-R98 PolarHBondContact O-N 3.18Å; V95-R98 PolarHBondContact O-N 3.01Å; V95-R98 VanDerWaalsContact O-N 3.17Å
99	E	84.6	Confident	78.8	Confident	51 Å²	51	77.6 Å²	77.6	24%	0.238	38%	0.378	C	S	.	.	H	α-helix	trans	-69	-49.6	179.2	177.4	56.7	-158.5	0	0	111.1	L55 V95 Y97 Q101 K102 S104 F107	L55-E99 HydrophobicContact CD1-CB 4.42Å; L55-E99 HydrophobicContact CD1-CG 4.15Å; L55-E99 HydrophobicContact CD2-CB 4.04Å; L55-E99 HydrophobicContact CD2-CG 3.96Å; V95-E99 VanDerWaalsContact O-CB 3.3Å; V95-E99 WeakPolarHBondContact O-CB 3.41Å; V95-E99 PolarHBondContact O-N 3.02Å; Y97-E99 VanDerWaalsContact C-N 3.34Å; Y97-E99 PolarHBondContact O-N 3.33Å; E99-Q101 PolarHBondContact O-N 3.24Å; E99-K102 PolarHBondContact O-N 3.11Å; E99-S104 WeakPolarHBondContact CG-OG 3.2Å; E99-S104 PolarHBondContact O-N 3.38Å; E99-S104 VanDerWaalsContact OE1-CB 3.25Å; E99-S104 WeakPolarHBondContact OE1-CB 3.26Å; E99-S104 PolarHBondContact OE1-OG 2.91Å; E99-F107 HydrophobicContact CG-CD2 3.85Å; E99-F107 HydrophobicContact CG-CE2 4.43Å
100	T	83	Confident	80.1	Confident	23 Å²	23	69.6 Å²	69.6	14%	0.141	35%	0.346	C	S	.	.	H	α-helix	trans	-67.5	-36.3	179.5	48.3	0	0	0	0	113.6	M96 Y97 K102 G103 F107 R109 F117	M96-T100 WeakPolarHBondContact O-CB 3.47Å; M96-T100 PolarHBondContact O-N 3Å; M96-T100 PolarHBondContact O-OG1 3.35Å; Y97-T100 PolarHBondContact O-OG1 2.97Å; T100-K102 PolarHBondContact O-N 2.94Å; T100-K102 VanDerWaalsContact O-N 3.15Å; T100-G103 PolarHBondContact O-N 3.35Å; T100-G103 VanDerWaalsContact O-N 3.16Å; T100-F107 HydrophobicContact CG2-CB 3.95Å; T100-R109 HydrophobicContact CG2-CB 4.38Å; T100-F117 HydrophobicContact CG2-CD1 3.88Å; T100-F117 HydrophobicContact CG2-CE1 3.76Å
101	Q	77.6	Confident	80.3	Confident	144 Å²	144	74.1 Å²	74.1	67%	0.673	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.8	177.2	-73.5	-77.2	-2.5	0	0	114.5	Y97 E99	Y97-Q101 VanDerWaalsContact O-CB 3.25Å; Y97-Q101 WeakPolarHBondContact O-CB 3.22Å; Y97-Q101 WeakPolarHBondContact O-CG 3.49Å; Y97-Q101 PolarHBondContact O-N 2.88Å; E99-Q101 PolarHBondContact O-N 3.24Å
102	K	66.9	Low	79.9	Confident	173 Å²	173	78.9 Å²	78.9	75%	0.752	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	1.4	176.9	-73.9	-171.6	170.2	-165.8	0	114.2	E99 T100	E99-K102 PolarHBondContact O-N 3.11Å; T100-K102 PolarHBondContact O-N 2.94Å; T100-K102 VanDerWaalsContact O-N 3.15Å
103	G	63	Low	79.6	Confident	57 Å²	57	87.2 Å²	87.2	59%	0.588	41%	0.411	S	S	*	.			trans	74.4	74.6	-166.4	0	0	0	0	0	110.3	T100	T100-G103 PolarHBondContact O-N 3.35Å; T100-G103 VanDerWaalsContact O-N 3.16Å
104	S	71.8	Confident	79.2	Confident	12 Å²	12	88.6 Å²	88.6	8%	0.084	42%	0.422	C	S	.	.			trans	-63.8	139.3	178.5	-177.1	0	0	0	0	111.4	E99 R106 F107	E99-S104 WeakPolarHBondContact CG-OG 3.2Å; E99-S104 PolarHBondContact O-N 3.38Å; E99-S104 VanDerWaalsContact OE1-CB 3.25Å; E99-S104 WeakPolarHBondContact OE1-CB 3.26Å; E99-S104 PolarHBondContact OE1-OG 2.91Å; S104-R106 PolarHBondContact O-N 3.3Å; S104-R106 PolarHBondContact OG-N 2.92Å; S104-F107 WeakPolarHBondContact CB-O 3.44Å; S104-F107 PolarHBondContact OG-N 3.04Å
105	R	67.9	Low	79.1	Confident	128 Å²	128	85.9 Å²	85.9	48%	0.483	40%	0.399	S	S	.	.	S	Bend	trans	-78.4	-5.3	169.4	-63.9	-177.9	174	-161.2	-2.2	113.2
106	R	72.3	Confident	79.1	Confident	65 Å²	65	85 Å²	85	25%	0.245	39%	0.394	C	S	.	.	S	Bend	trans	-119	-44.3	-173.9	-65	-160	-81.7	179.2	-6.1	113	D56 S104 L119 L120	D56-R106 IonicContact OD1-CZ 3.89Å; D56-R106 VanDerWaalsContact OD1-CZ 3.28Å; D56-R106 IonicContact OD1-NH1 3.01Å; D56-R106 PolarHBondContact OD1-NH1 3.21Å; D56-R106 IonicContact OD1-NH2 3.33Å; D56-R106 PolarHBondContact OD1-NH2 3.49Å; S104-R106 PolarHBondContact O-N 3.3Å; S104-R106 PolarHBondContact OG-N 2.92Å; R106-L119 VanDerWaalsContact O-CA 3.32Å; R106-L119 WeakPolarHBondContact O-CA 3.46Å; R106-L119 WeakPolarHBondContact O-CD2 3.35Å; R106-L120 PolarHBondContact O-N 3.46Å
107	F	85.1	Confident	79.2	Confident	5 Å²	5	85 Å²	85	2%	0.022	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.1	-168.1	-53.4	-74.3	0	0	0	113.8	L55 A58 Q59 L62 M96 E99 T100 S104 A118 L119	L55-F107 HydrophobicContact CB-CE2 4.32Å; L55-F107 HydrophobicContact CD2-CD2 4.36Å; L55-F107 HydrophobicContact CD2-CE2 3.89Å; L55-F107 WeakPolarHBondContact O-CZ 3.38Å; A58-F107 HydrophobicContact CB-CE1 4.47Å; A58-F107 HydrophobicContact CB-CZ 4.5Å; Q59-F107 HydrophobicContact CB-CE1 4.25Å; Q59-F107 HydrophobicContact CB-CZ 3.96Å; L62-F107 HydrophobicContact CD1-CD1 3.74Å; L62-F107 HydrophobicContact CD1-CE1 3.89Å; M96-F107 HydrophobicContact CE-CB 4.11Å; M96-F107 HydrophobicContact CE-CD1 3.73Å; M96-F107 HydrophobicContact CE-CD2 4.35Å; M96-F107 HydrophobicContact CE-CE1 4.24Å; M96-F107 HydrophobicContact CE-CG 3.78Å; M96-F107 HydrophobicContact SD-CD1 4.41Å; M96-F107 HydrophobicContact SD-CD2 4.26Å; M96-F107 HydrophobicContact SD-CE1 4.5Å; M96-F107 HydrophobicContact SD-CE2 4.36Å; M96-F107 HydrophobicContact SD-CG 4.28Å; M96-F107 HydrophobicContact SD-CZ 4.48Å; E99-F107 HydrophobicContact CG-CD2 3.85Å; E99-F107 HydrophobicContact CG-CE2 4.43Å; T100-F107 HydrophobicContact CG2-CB 3.95Å; S104-F107 WeakPolarHBondContact CB-O 3.44Å; S104-F107 PolarHBondContact OG-N 3.04Å; F107-A118 CarbonylContact C-O 3.59Å; F107-A118 WeakPolarHBondContact CA-O 3.47Å; F107-L119 HydrophobicContact CD1-CD2 3.8Å; F107-L119 HydrophobicContact CE1-CD2 3.63Å
108	K	84.8	Confident	79.2	Confident	99 Å²	99	82.7 Å²	82.7	43%	0.43	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.1	172.2	-167.5	171.5	-177.1	177.7	0	109.2	F117 A118 L120 E124	K108-F117 WeakPolarHBondContact O-CA 3.44Å; K108-A118 PolarHBondContact N-O 2.91Å; K108-A118 PolarHBondContact O-N 3.44Å; K108-L120 HydrophobicContact CB-CD1 3.92Å; K108-E124 IonicContact NZ-OE1 3.43Å; K108-E124 PolarHBondContact NZ-OE1 3.47Å
109	R	85.6	Confident	79.3	Confident	78 Å²	78	75.3 Å²	75.3	29%	0.294	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	134.8	167	179.3	-178	171.4	-168.5	-2.2	108.5	T100 E111 N114 F117	T100-R109 HydrophobicContact CG2-CB 4.38Å; R109-E111 PolarHBondContact O-N 3.19Å; R109-N114 PolarHBondContact NH2-OD1 3.37Å; R109-N114 VanDerWaalsContact NH2-OD1 3.13Å; R109-F117 HydrophobicContact CB-CD1 4.35Å; R109-F117 HydrophobicContact CB-CE1 4.25Å; R109-F117 HydrophobicContact CG-CE1 4.47Å
110	I	83.6	Confident	79.2	Confident	51 Å²	51	74 Å²	74	26%	0.262	36%	0.357	S	S	.	.			trans	-88.8	103.4	171.2	-59.8	-169.9	0	0	0	108.5	P68 N112 R113 V116	P68-I110 HydrophobicContact CB-CD1 3.52Å; P68-I110 HydrophobicContact CG-CD1 3.53Å; I110-N112 HydrophobicContact CG2-CB 4.42Å; I110-N112 PolarHBondContact O-N 2.96Å; I110-R113 HydrophobicContact CG2-CB 4.27Å; I110-R113 CarbonylContact O-C 3.49Å; I110-R113 PolarHBondContact O-N 3.45Å; I110-V116 HydrophobicContact CB-CB 4.41Å; I110-V116 HydrophobicContact CB-CG1 4.3Å; I110-V116 HydrophobicContact CD1-CG1 4.04Å; I110-V116 HydrophobicContact CG1-CG1 4.32Å; I110-V116 PolarHBondContact N-O 2.82Å
111	E	73.9	Confident	78.8	Confident	165 Å²	165	76.3 Å²	76.3	77%	0.771	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-36.8	-175.9	-58.9	-171.9	146.6	0	0	112.5	R109 R113	R109-E111 PolarHBondContact O-N 3.19Å; E111-R113 PolarHBondContact O-N 3.49Å; E111-R113 VanDerWaalsContact O-N 3.15Å
112	N	72.6	Confident	78.4	Confident	158 Å²	158	73.8 Å²	73.8	85%	0.845	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-3.4	177.5	-64	-15.8	0	0	0	114.5	I110	I110-N112 HydrophobicContact CG2-CB 4.42Å; I110-N112 PolarHBondContact O-N 2.96Å
113	R	79.6	Confident	78.3	Confident	177 Å²	177	71.6 Å²	71.6	67%	0.668	36%	0.355	S	S	*	.	S	Bend	trans	-143.2	100.6	176.3	-68.8	-171.3	176.9	-177.2	-0.7	110.9	I110 E111 G115 V116	I110-R113 HydrophobicContact CG2-CB 4.27Å; I110-R113 CarbonylContact O-C 3.49Å; I110-R113 PolarHBondContact O-N 3.45Å; E111-R113 PolarHBondContact O-N 3.49Å; E111-R113 VanDerWaalsContact O-N 3.15Å; R113-G115 PolarHBondContact O-N 3.47Å; R113-V116 HydrophobicContact CB-CB 3.84Å; R113-V116 HydrophobicContact CB-CG2 3.61Å; R113-V116 WeakPolarHBondContact O-CB 3.47Å; R113-V116 PolarHBondContact O-N 3.21Å
114	N	78.9	Confident	78.6	Confident	123 Å²	123	71.3 Å²	71.3	66%	0.658	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	136.3	178.4	-79.3	-31.6	0	0	0	112.4	R109 V116	R109-N114 PolarHBondContact NH2-OD1 3.37Å; R109-N114 VanDerWaalsContact NH2-OD1 3.13Å; N114-V116 PolarHBondContact O-N 2.87Å
115	G	83.8	Confident	78.2	Confident	4 Å²	4	74.8 Å²	74.8	4%	0.041	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	3.6	-177.1	0	0	0	0	0	115.9	H70 I71 R113 F117	H70-G115 CarbonylContact C-O 3.58Å; H70-G115 WeakPolarHBondContact CA-O 3.36Å; H70-G115 VanDerWaalsContact CD2-C 3.48Å; H70-G115 PolarHBondContact CD2-O 2.97Å; H70-G115 VanDerWaalsContact CD2-O 3.3Å; I71-G115 WeakPolarHBondContact CB-O 3.3Å; I71-G115 PolarHBondContact N-O 3.49Å; R113-G115 PolarHBondContact O-N 3.47Å; G115-F117 WeakPolarHBondContact O-CD2 3.39Å
116	V	88	Confident	77.9	Confident	17 Å²	17	74.9 Å²	74.9	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.5	178.3	179.5	0	0	0	0	111.7	P68 M69 H70 I110 R113 N114	P68-V116 HydrophobicContact CB-CG1 3.64Å; M69-V116 WeakPolarHBondContact O-CA 3.42Å; H70-V116 HydrophobicContact CB-CG2 4.35Å; I110-V116 HydrophobicContact CB-CB 4.41Å; I110-V116 HydrophobicContact CB-CG1 4.3Å; I110-V116 HydrophobicContact CD1-CG1 4.04Å; I110-V116 HydrophobicContact CG1-CG1 4.32Å; I110-V116 PolarHBondContact N-O 2.82Å; R113-V116 HydrophobicContact CB-CB 3.84Å; R113-V116 HydrophobicContact CB-CG2 3.61Å; R113-V116 WeakPolarHBondContact O-CB 3.47Å; R113-V116 PolarHBondContact O-N 3.21Å; N114-V116 PolarHBondContact O-N 2.87Å
117	F	88.8	Confident	77.4	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.7	179.4	-62.8	-92.4	0	0	0	110.3	L62 P68 M69 I71 I74 M96 Y97 T100 K108 R109 G115	L62-F117 HydrophobicContact CD1-CB 4.47Å; P68-F117 WeakPolarHBondContact CA-O 3.42Å; M69-F117 PolarHBondContact N-O 3.12Å; M69-F117 PolarHBondContact O-N 3.38Å; I71-F117 HydrophobicContact CB-CD2 4.21Å; I71-F117 HydrophobicContact CB-CE2 4Å; I71-F117 HydrophobicContact CD1-CD2 4.05Å; I71-F117 HydrophobicContact CD1-CE2 3.89Å; I71-F117 HydrophobicContact CG1-CE2 4.19Å; I74-F117 HydrophobicContact CD1-CB 4.1Å; M96-F117 HydrophobicContact CB-CE1 4.05Å; M96-F117 HydrophobicContact CB-CE2 4.43Å; M96-F117 HydrophobicContact CB-CZ 3.99Å; M96-F117 HydrophobicContact CE-CB 3.87Å; M96-F117 HydrophobicContact CE-CD1 3.7Å; M96-F117 HydrophobicContact CE-CD2 4.41Å; M96-F117 HydrophobicContact CE-CE1 4.34Å; M96-F117 HydrophobicContact CE-CG 3.74Å; Y97-F117 HydrophobicContact CD1-CZ 4.03Å; Y97-F117 AromaticContact CE1-CZ 3.9Å; Y97-F117 HydrophobicContact CE1-CZ 3.9Å; Y97-F117 HydrophobicContact CG-CZ 4.42Å; T100-F117 HydrophobicContact CG2-CD1 3.88Å; T100-F117 HydrophobicContact CG2-CE1 3.76Å; K108-F117 WeakPolarHBondContact O-CA 3.44Å; R109-F117 HydrophobicContact CB-CD1 4.35Å; R109-F117 HydrophobicContact CB-CE1 4.25Å; R109-F117 HydrophobicContact CG-CE1 4.47Å; G115-F117 WeakPolarHBondContact O-CD2 3.39Å
118	A	87.6	Confident	76.2	Confident	15 Å²	15	79.4 Å²	79.4	12%	0.124	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	168.5	172.8	0	0	0	0	0	109.4	P68 F107 K108	P68-A118 HydrophobicContact CB-CB 4.14Å; P68-A118 HydrophobicContact CG-CB 4.08Å; F107-A118 CarbonylContact C-O 3.59Å; F107-A118 WeakPolarHBondContact CA-O 3.47Å; K108-A118 PolarHBondContact N-O 2.91Å; K108-A118 PolarHBondContact O-N 3.44Å
119	L	86.6	Confident	75	Confident	36 Å²	36	78.8 Å²	78.8	19%	0.188	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	156.3	164.6	-68.7	169.7	0	0	0	110.6	Q59 L62 E63 R106 F107	Q59-L119 HydrophobicContact CG-CD2 4.04Å; L62-L119 HydrophobicContact CB-CD1 4.05Å; L62-L119 HydrophobicContact CB-CD2 4.45Å; L62-L119 HydrophobicContact CB-CG 3.82Å; E63-L119 HydrophobicContact CB-CD1 3.67Å; E63-L119 HydrophobicContact CG-CD1 4.02Å; R106-L119 VanDerWaalsContact O-CA 3.32Å; R106-L119 WeakPolarHBondContact O-CA 3.46Å; R106-L119 WeakPolarHBondContact O-CD2 3.35Å; F107-L119 HydrophobicContact CD1-CD2 3.8Å; F107-L119 HydrophobicContact CE1-CD2 3.63Å
120	L	82.3	Confident	73.7	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.12	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-71.8	140.3	162.9	-86.9	72.9	0	0	0	109.3	R106 K108 E124 A128	R106-L120 PolarHBondContact O-N 3.46Å; K108-L120 HydrophobicContact CB-CD1 3.92Å; L120-E124 WeakPolarHBondContact CA-OE2 3.43Å; L120-E124 HydrophobicContact CB-CB 4.02Å; L120-E124 HydrophobicContact CD2-CB 4.04Å; L120-E124 HydrophobicContact CG-CB 3.98Å; L120-A128 HydrophobicContact CD2-CB 4.47Å
121	T	75.1	Confident	72.5	Confident	72 Å²	72	80.2 Å²	80.2	44%	0.442	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-70.5	166.5	166.1	77.1	0	0	0	0	110.8	E123 E124 R125	T121-E123 VanDerWaalsContact C-N 3.33Å; T121-E123 PolarHBondContact O-N 2.92Å; T121-E123 PolarHBondContact OG1-OE2 2.83Å; T121-E124 PolarHBondContact N-OE2 2.93Å; T121-E124 PolarHBondContact O-N 3.23Å; T121-E124 VanDerWaalsContact O-N 3.17Å; T121-E124 PolarHBondContact OG1-N 3.36Å; T121-R125 WeakPolarHBondContact O-CB 3.41Å; T121-R125 PolarHBondContact O-N 3.45Å
122	D	68.3	Low	71.6	Confident	92 Å²	92	77.2 Å²	77.2	49%	0.492	40%	0.399	S	S	.	.	H	α-helix	trans	-67.1	-29.4	-179.7	-79.4	-59.5	0	0	0	113.4	R125 Q126	D122-R125 PolarHBondContact O-N 2.93Å; D122-R125 WeakPolarHBondContact OD1-CD 3.43Å; D122-R125 IonicContact OD1-CZ 2.96Å; D122-R125 IonicContact OD1-NE 3.28Å; D122-R125 IonicContact OD1-NH1 2.72Å; D122-R125 PolarHBondContact OD1-NH1 3.23Å; D122-R125 IonicContact OD2-NH1 2.86Å; D122-Q126 VanDerWaalsContact O-CG 3.29Å; D122-Q126 WeakPolarHBondContact O-CG 3.41Å; D122-Q126 PolarHBondContact O-N 3.33Å
123	E	65.6	Low	70.4	Confident	126 Å²	126	73 Å²	73	59%	0.589	39%	0.386	S	S	*	.	H	α-helix	trans	-64.8	-43.6	168.6	-60.6	87.6	172	0	0	112.1	T121 R125 Q126 Q127	T121-E123 VanDerWaalsContact C-N 3.33Å; T121-E123 PolarHBondContact O-N 2.92Å; T121-E123 PolarHBondContact OG1-OE2 2.83Å; E123-R125 VanDerWaalsContact C-N 3.32Å; E123-R125 PolarHBondContact O-N 3.03Å; E123-Q126 PolarHBondContact O-N 3.44Å; E123-Q127 WeakPolarHBondContact O-CG 3.48Å; E123-Q127 PolarHBondContact O-N 3.22Å
124	E	67.9	Low	68.7	Low	52 Å²	52	73.7 Å²	73.7	24%	0.243	39%	0.394	C	S	.	.	H	α-helix	trans	-65	-38.8	177.3	-64.7	-173.1	127.3	0	0	111.5	K108 L120 T121 Q126 Q127 A128	K108-E124 IonicContact NZ-OE1 3.43Å; K108-E124 PolarHBondContact NZ-OE1 3.47Å; L120-E124 WeakPolarHBondContact CA-OE2 3.43Å; L120-E124 HydrophobicContact CB-CB 4.02Å; L120-E124 HydrophobicContact CD2-CB 4.04Å; L120-E124 HydrophobicContact CG-CB 3.98Å; T121-E124 PolarHBondContact N-OE2 2.93Å; T121-E124 PolarHBondContact O-N 3.23Å; T121-E124 VanDerWaalsContact O-N 3.17Å; T121-E124 PolarHBondContact OG1-N 3.36Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 2.9Å; E124-Q127 PolarHBondContact O-N 2.81Å; E124-A128 WeakPolarHBondContact O-CB 3.49Å; E124-A128 PolarHBondContact O-N 3.06Å
125	R	64.1	Low	67.2	Low	84 Å²	84	75.1 Å²	75.1	32%	0.317	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-39	175.2	-174.7	-178.5	-71.1	165.4	-5.9	111.5	T121 D122 E123 L129	T121-R125 WeakPolarHBondContact O-CB 3.41Å; T121-R125 PolarHBondContact O-N 3.45Å; D122-R125 PolarHBondContact O-N 2.93Å; D122-R125 WeakPolarHBondContact OD1-CD 3.43Å; D122-R125 IonicContact OD1-CZ 2.96Å; D122-R125 IonicContact OD1-NE 3.28Å; D122-R125 IonicContact OD1-NH1 2.72Å; D122-R125 PolarHBondContact OD1-NH1 3.23Å; D122-R125 IonicContact OD2-NH1 2.86Å; E123-R125 VanDerWaalsContact C-N 3.32Å; E123-R125 PolarHBondContact O-N 3.03Å; R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 3.36Å
126	Q	60.8	Low	65.1	Low	130 Å²	130	79.7 Å²	79.7	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-69.1	-45.5	174.5	-72.7	172.8	8	0	0	112	D122 E123 E124 A128 L129 T130	D122-Q126 VanDerWaalsContact O-CG 3.29Å; D122-Q126 WeakPolarHBondContact O-CG 3.41Å; D122-Q126 PolarHBondContact O-N 3.33Å; E123-Q126 PolarHBondContact O-N 3.44Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-Q126 PolarHBondContact O-N 2.9Å; Q126-A128 VanDerWaalsContact C-N 3.3Å; Q126-A128 PolarHBondContact O-N 2.93Å; Q126-L129 WeakPolarHBondContact O-CB 3.42Å; Q126-L129 PolarHBondContact O-N 3.5Å; Q126-T130 PolarHBondContact O-N 2.88Å; Q126-T130 VanDerWaalsContact O-N 3.15Å; Q126-T130 PolarHBondContact O-OG1 2.82Å
127	Q	62.3	Low	62.8	Low	134 Å²	134	84 Å²	84	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-59.8	-39	176.9	-69.8	175.7	22.8	0	0	112.6	E123 E124 L129 T130 A131	E123-Q127 WeakPolarHBondContact O-CG 3.48Å; E123-Q127 PolarHBondContact O-N 3.22Å; E124-Q127 PolarHBondContact O-N 2.81Å; Q127-L129 PolarHBondContact O-N 3.31Å; Q127-T130 PolarHBondContact O-N 2.96Å; Q127-A131 PolarHBondContact O-N 3.44Å
128	A	59.8	Low	60.7	Low	32 Å²	32	89.7 Å²	89.7	26%	0.264	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-27.7	175.8	0	0	0	0	0	113.5	L120 E124 Q126	L120-A128 HydrophobicContact CD2-CB 4.47Å; E124-A128 WeakPolarHBondContact O-CB 3.49Å; E124-A128 PolarHBondContact O-N 3.06Å; Q126-A128 VanDerWaalsContact C-N 3.3Å; Q126-A128 PolarHBondContact O-N 2.93Å
129	L	60.6	Low	58.6	Low	86 Å²	86	94.6 Å²	94.6	45%	0.45	53%	0.531	S	S	.	.	H	α-helix	trans	-76.9	-43.3	173.7	-67.2	167.1	0	0	0	111.4	R125 Q126 Q127 A131 Q132 A133	R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 3.36Å; Q126-L129 WeakPolarHBondContact O-CB 3.42Å; Q126-L129 PolarHBondContact O-N 3.5Å; Q127-L129 PolarHBondContact O-N 3.31Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 3.17Å; L129-Q132 PolarHBondContact O-N 3.19Å; L129-A133 PolarHBondContact O-N 3.5Å
130	T	58.2	Low	56.3	Low	92 Å²	92	98.9 Å²	98.9	56%	0.564	56%	0.561	S	S	*	*	H	α-helix	trans	-60	-40.4	177.6	-39	0	0	0	0	111.8	Q126 Q127 Q132 A133	Q126-T130 PolarHBondContact O-N 2.88Å; Q126-T130 VanDerWaalsContact O-N 3.15Å; Q126-T130 PolarHBondContact O-OG1 2.82Å; Q127-T130 PolarHBondContact O-N 2.96Å; T130-Q132 VanDerWaalsContact C-N 3.27Å; T130-Q132 PolarHBondContact O-N 3.45Å; T130-A133 PolarHBondContact O-N 3.23Å
131	A	57.4	Low	54.2	Low	67 Å²	67	102.2 Å²	102.2	55%	0.554	59%	0.591	S	S	*	*	H	α-helix	trans	-62.4	-28	-179.4	0	0	0	0	0	114.1	Q127 L129	Q127-A131 PolarHBondContact O-N 3.44Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 3.17Å
132	Q	54.9	Low	52.7	Low	102 Å²	102	104.9 Å²	104.9	48%	0.477	61%	0.61	S	S	.	*	H	α-helix	trans	-87.2	-22.4	178.5	-68.9	-166.2	-31.7	0	0	113.7	L129 T130 F134 L135	L129-Q132 PolarHBondContact O-N 3.19Å; T130-Q132 VanDerWaalsContact C-N 3.27Å; T130-Q132 PolarHBondContact O-N 3.45Å; Q132-F134 VanDerWaalsContact C-N 3.27Å; Q132-F134 PolarHBondContact O-N 3.48Å; Q132-L135 PolarHBondContact O-N 3.02Å
133	A	48	Very low	51	Low	70 Å²	70	109.1 Å²	109.1	58%	0.579	63%	0.627	S	S	*	*	H	α-helix	trans	-63.5	-33.3	177	0	0	0	0	0	112.6	L129 T130 L135	L129-A133 PolarHBondContact O-N 3.5Å; T130-A133 PolarHBondContact O-N 3.23Å; A133-L135 PolarHBondContact O-N 3.06Å
134	F	43.7	Very low	49.5	Very low	191 Å²	191	108.6 Å²	108.6	84%	0.838	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-5.4	-177.5	-109.4	-87.5	0	0	0	115.6	Q132	Q132-F134 VanDerWaalsContact C-N 3.27Å; Q132-F134 PolarHBondContact O-N 3.48Å
135	L	48.3	Very low	47.7	Very low	152 Å²	152	110.1 Å²	110.1	80%	0.796	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	4	-178.9	-65.2	175.6	0	0	0	113.7	Q132 A133	Q132-L135 PolarHBondContact O-N 3.02Å; A133-L135 PolarHBondContact O-N 3.06Å
136	S	39.7	Very low	46.1	Very low	100 Å²	100	110.6 Å²	110.6	70%	0.699	69%	0.689	S	S	*	*			trans	-116.8	67.3	-176.8	-67.3	0	0	0	0	112.2
137	S	38.5	Very low	44.7	Very low	107 Å²	107	110 Å²	110	75%	0.748	70%	0.699	S	S	*	*			trans	-150.8	127.3	167.6	-75.5	0	0	0	0	110.6
138	P	44.6	Very low	43.3	Very low	120 Å²	120	108.5 Å²	108.5	78%	0.779	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-77.8	144.7	-179.7	31.8	-34.3	0	0	0	111.5
139	P	44.4	Very low	42	Very low	119 Å²	119	112.7 Å²	112.7	77%	0.773	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-72	143.3	173	30.5	-34.2	0	0	0	111.2
140	P	38.4	Very low	40.6	Very low	126 Å²	126	112.4 Å²	112.4	82%	0.818	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.2	147.1	175.2	30.9	-34.8	0	0	0	111.7
141	A	36.6	Very low	39.5	Very low	92 Å²	92	114.3 Å²	114.3	76%	0.76	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-84.7	136.5	176.5	0	0	0	0	0	111.9
142	P	44.3	Very low	38.3	Very low	129 Å²	129	115.1 Å²	115.1	84%	0.838	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-81.8	133.7	168.9	32.2	-31.8	0	0	0	111
143	Q	33.7	Very low	37.3	Very low	180 Å²	180	115 Å²	115	84%	0.841	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-97.5	140.8	174	-69.1	-171.3	-2.1	0	0	112.4
144	S	33.3	Very low	36.6	Very low	116 Å²	116	117.7 Å²	117.7	81%	0.811	81%	0.811	S	S	*	*			trans	29.1	111.6	151.1	59.9	0	0	0	0	120.5
145	G	29.6	Very low	36.7	Very low	83 Å²	83	117.1 Å²	117.1	86%	0.856	81%	0.813	S	S	*	*			trans	-124	139.3	142.7	0	0	0	0	0	108.3
146	A	31.9	Very low	36.3	Very low	95 Å²	95	116 Å²	116	79%	0.785	82%	0.815	S	S	*	*			trans	-112	176.5	-167	0	0	0	0	0	114
147	S	31.5	Very low	36	Very low	118 Å²	118	115.7 Å²	115.7	83%	0.825	82%	0.819	S	S	*	*			trans	72.9	142.3	177.8	75.2	0	0	0	0	116.7
148	S	31.3	Very low	35.9	Very low	101 Å²	101	120.2 Å²	120.2	71%	0.706	83%	0.825	S	S	*	*			cis	-165.5	155.3	-13.7	44.3	0	0	0	0	111.7
149	S	32.5	Very low	35.8	Very low	120 Å²	120	120.2 Å²	120.2	84%	0.839	83%	0.825	S	S	*	*			trans	52.4	125.5	152	61.4	0	0	0	0	120.8
150	G	31.9	Very low	35.3	Very low	80 Å²	80	119.9 Å²	119.9	83%	0.825	83%	0.826	S	S	*	*			trans	172.5	91.1	165.9	0	0	0	0	0	114.2
151	S	34.4	Very low	35.9	Very low	133 Å²	133	120.1 Å²	120.1	93%	0.93	83%	0.827	S	S	*	*			trans	-69.9	152.9	179.6	-50.9	0	0	0	0	113.7
152	G	32.6	Very low	35.6	Very low	83 Å²	83	121.9 Å²	121.9	86%	0.856	83%	0.834	S	S	*	*			trans	136.4	114.1	154.7	0	0	0	0	0	115.4
153	A	34.5	Very low	35.3	Very low	101 Å²	101	121.2 Å²	121.2	84%	0.835	83%	0.832	S	S	*	*			trans	-106.6	134.1	169.6	0	0	0	0	0	110.8
154	S	33.9	Very low	35.5	Very low	125 Å²	125	118.9 Å²	118.9	87%	0.874	84%	0.836	S	S	*	*			trans	-172.1	155.5	154.1	25.6	0	0	0	0	111.7
155	M	44.5	Very low	36	Very low	179 Å²	179	118.6 Å²	118.6	88%	0.882	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-79.9	147.8	179.6	-61.6	-77.5	-162	0	0	111.9
156	P	40.7	Very low	36.2	Very low	130 Å²	130	123.9 Å²	123.9	84%	0.844	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-81.1	123.8	158.3	32.4	-29.9	0	0	0	110.6
157	A	33.1	Very low	36.8	Very low	93 Å²	93	127.6 Å²	127.6	77%	0.769	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-93.1	160.8	173.2	0	0	0	0	0	112.2
158	F	36.8	Very low	37.7	Very low	202 Å²	202	130.4 Å²	130.4	89%	0.886	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-64.8	141.2	174.6	-79	-100	0	0	0	112.8
159	P	42.4	Very low	38.4	Very low	120 Å²	120	130.6 Å²	130.6	78%	0.779	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-102	131.4	153.2	34	-26.9	0	0	0	111.6
160	S	32.9	Very low	39.4	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-101.5	160	167.3	-82.2	0	0	0	0	110.6
161	P	50.8	Low	40.5	Very low	131 Å²	131	136 Å²	136	85%	0.851	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-89	157.1	-155.3	34.3	-37.2	0	0	0	115.4
162	S	31.5	Very low	41.2	Very low	128 Å²	128	137.6 Å²	137.6	90%	0.895	81%	0.814	S	S	*	*			trans	-128.3	160.1	160.5	60.8	0	0	0	0	110.1
163	S	38.4	Very low	42.1	Very low	115 Å²	115	143.5 Å²	143.5	80%	0.804	81%	0.811	S	S	*	*			trans	-120	137.9	-160.9	59.4	0	0	0	0	114.3
164	S	37.9	Very low	42.9	Very low	132 Å²	132	140.8 Å²	140.8	92%	0.923	79%	0.793	S	S	*	*			trans	-162.1	171.1	147.5	50.2	0	0	0	0	110.4
165	S	42.6	Very low	43.9	Very low	110 Å²	110	141 Å²	141	77%	0.769	78%	0.78	S	S	*	*			trans	-115.8	140.6	-160.2	56.9	0	0	0	0	114.3
166	E	34.7	Very low	44.6	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	77%	0.772	S	S	*	*			trans	-155.5	-177.9	148.7	-125.1	174.8	-176	0	0	114.2
167	Q	43.8	Very low	45.5	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	77%	0.767	S	S	*	*			trans	-99.4	131.6	-149.8	-54	-168.5	20.2	0	0	116.4
168	K	50.1	Low	46.9	Very low	176 Å²	176	143.4 Å²	143.4	77%	0.765	75%	0.754	S	S	*	*			trans	15.7	138.5	154.7	-65.6	166.8	-174	148.1	0	119.3
169	P	47.1	Very low	48.5	Very low	106 Å²	106	139.1 Å²	139.1	69%	0.688	74%	0.736	S	S	*	*				-114.1	157.8	114	32.9	-34.2	0	0	0	114.1	I171	P169-I171 PolarHBondContact O-N 3.39Å; P169-I171 VanDerWaalsContact O-N 3.08Å
170	K	52.9	Low	50.2	Low	188 Å²	188	138.7 Å²	138.7	82%	0.817	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-1.7	-166.4	-64	169.4	-177	168.9	0	115	R173	K170-R173 PolarHBondContact O-N 3.24Å
171	I	54.7	Low	52.8	Low	124 Å²	124	137.8 Å²	137.8	64%	0.636	71%	0.711	S	S	*	*	H	α-helix	trans	-64.6	-46.4	-167.6	-59	169.9	0	0	0	113.1	P169 R173 G174 Q175	P169-I171 PolarHBondContact O-N 3.39Å; P169-I171 VanDerWaalsContact O-N 3.08Å; I171-R173 PolarHBondContact O-N 3.17Å; I171-R173 VanDerWaalsContact O-N 3.1Å; I171-G174 PolarHBondContact O-N 2.63Å; I171-Q175 PolarHBondContact O-N 2.87Å
172	K	50.3	Low	54.5	Low	168 Å²	168	138.2 Å²	138.2	73%	0.73	70%	0.7	S	S	*	*	H	α-helix	trans	-60.5	-22.6	-179.5	-81.6	-177.5	175.3	175	0	113.9	R176	K172-R176 PolarHBondContact O-N 3.49Å
173	R	50.7	Low	57.4	Low	207 Å²	207	139.5 Å²	139.5	78%	0.781	69%	0.686	S	S	*	*	H	α-helix	trans	-72.2	-31.4	172.7	-86.3	-173.1	170.3	-170.2	-3.9	112.6	K170 I171 K177	K170-R173 PolarHBondContact O-N 3.24Å; I171-R173 PolarHBondContact O-N 3.17Å; I171-R173 VanDerWaalsContact O-N 3.1Å; R173-K177 WeakPolarHBondContact O-CG 3.09Å; R173-K177 PolarHBondContact O-N 2.98Å
174	G	51.9	Low	60	Low	44 Å²	44	140.1 Å²	140.1	45%	0.454	67%	0.67	S	S	.	*	H	α-helix	trans	-66.1	-51	174.9	0	0	0	0	0	111.9	I171 R176 K177 N178	I171-G174 PolarHBondContact O-N 2.63Å; G174-R176 PolarHBondContact O-N 2.96Å; G174-K177 PolarHBondContact O-N 3.34Å; G174-N178 WeakPolarHBondContact O-CB 3.38Å; G174-N178 PolarHBondContact O-N 2.93Å
175	Q	54.5	Low	62.7	Low	128 Å²	128	137.4 Å²	137.4	60%	0.598	65%	0.645	S	S	*	*	H	α-helix	trans	-60	-43.5	176.7	-75	177.7	-39.3	0	0	112.6	I171 K177 N178 Q179	I171-Q175 PolarHBondContact O-N 2.87Å; Q175-K177 PolarHBondContact O-N 2.88Å; Q175-N178 PolarHBondContact O-N 3.1Å; Q175-Q179 PolarHBondContact O-N 3.08Å
176	R	58	Low	65.1	Low	194 Å²	194	139.2 Å²	139.2	73%	0.732	64%	0.639	S	S	*	*	H	α-helix	trans	-64.2	-37.7	175.7	-81.3	-173.9	169.5	-180	-2.9	113.2	K172 G174 N180	K172-R176 PolarHBondContact O-N 3.49Å; G174-R176 PolarHBondContact O-N 2.96Å; R176-N180 WeakPolarHBondContact O-CB 3.43Å; R176-N180 PolarHBondContact O-N 3.45Å
177	K	59.8	Low	67.9	Low	169 Å²	169	136.6 Å²	136.6	74%	0.735	62%	0.622	S	S	*	*	H	α-helix	trans	-62.9	-47	172.2	-81.6	-170.5	172.1	-165.6	0	111.7	R173 G174 Q175 Q179 N180 E181	R173-K177 WeakPolarHBondContact O-CG 3.09Å; R173-K177 PolarHBondContact O-N 2.98Å; G174-K177 PolarHBondContact O-N 3.34Å; Q175-K177 PolarHBondContact O-N 2.88Å; K177-Q179 PolarHBondContact O-N 3.34Å; K177-N180 PolarHBondContact O-N 3.33Å; K177-N180 VanDerWaalsContact O-N 3.17Å; K177-E181 PolarHBondContact O-N 3.4Å
178	N	63.8	Low	70.3	Confident	90 Å²	90	132.9 Å²	132.9	48%	0.481	61%	0.605	S	S	.	*	H	α-helix	trans	-65.9	-37.8	-179.2	-166.7	-43.1	0	0	0	112	G174 Q175 E181 K182	G174-N178 WeakPolarHBondContact O-CB 3.38Å; G174-N178 PolarHBondContact O-N 2.93Å; Q175-N178 PolarHBondContact O-N 3.1Å; N178-E181 PolarHBondContact O-N 3.25Å; N178-K182 WeakPolarHBondContact O-CG 3.45Å; N178-K182 PolarHBondContact O-N 3.24Å; N178-K182 WeakPolarHBondContact OD1-CE 3.21Å
179	Q	70.8	Confident	72.4	Confident	112 Å²	112	133.7 Å²	133.7	52%	0.523	60%	0.603	S	S	.	*	H	α-helix	trans	-60.7	-48	168.4	-79	-178	-21.6	0	0	112.1	Q175 K177 E181 K182 Y183	Q175-Q179 PolarHBondContact O-N 3.08Å; K177-Q179 PolarHBondContact O-N 3.34Å; Q179-E181 VanDerWaalsContact C-N 3.29Å; Q179-E181 PolarHBondContact O-N 3.03Å; Q179-K182 WeakPolarHBondContact O-CA 3.4Å; Q179-K182 WeakPolarHBondContact O-CB 3.46Å; Q179-K182 PolarHBondContact O-N 3.02Å; Q179-Y183 HydrophobicContact CB-CE2 4.41Å; Q179-Y183 WeakPolarHBondContact O-CD2 3.44Å; Q179-Y183 PolarHBondContact O-N 2.68Å
180	N	77.6	Confident	74.7	Confident	112 Å²	112	134.2 Å²	134.2	60%	0.599	60%	0.599	S	S	*	*	H	α-helix	trans	-60.6	-38.3	179.1	-162.2	-19.4	0	0	0	111.6	R176 K177 Y183 R184	R176-N180 WeakPolarHBondContact O-CB 3.43Å; R176-N180 PolarHBondContact O-N 3.45Å; K177-N180 PolarHBondContact O-N 3.33Å; K177-N180 VanDerWaalsContact O-N 3.17Å; N180-Y183 PolarHBondContact O-N 3.39Å; N180-R184 WeakPolarHBondContact O-CB 3.33Å; N180-R184 PolarHBondContact O-N 3.32Å
181	E	87.3	Confident	76.7	Confident	93 Å²	93	131.5 Å²	131.5	44%	0.435	58%	0.584	S	S	.	*	H	α-helix	trans	-61.9	-42.2	171.1	-176.2	125.3	-112.5	0	0	113.1	K177 N178 Q179 Y183 R184 L185	K177-E181 PolarHBondContact O-N 3.4Å; N178-E181 PolarHBondContact O-N 3.25Å; Q179-E181 VanDerWaalsContact C-N 3.29Å; Q179-E181 PolarHBondContact O-N 3.03Å; E181-Y183 VanDerWaalsContact C-N 3.33Å; E181-Y183 PolarHBondContact O-N 3.12Å; E181-R184 WeakPolarHBondContact O-CB 3.37Å; E181-R184 PolarHBondContact O-N 3.03Å; E181-R184 IonicContact OE1-CZ 3.52Å; E181-R184 IonicContact OE1-NE 3.53Å; E181-R184 IonicContact OE1-NH2 2.69Å; E181-R184 PolarHBondContact OE1-NH2 3.44Å; E181-L185 HydrophobicContact CG-CD1 4.26Å; E181-L185 WeakPolarHBondContact O-CG 3.27Å; E181-L185 PolarHBondContact O-N 2.91Å
182	K	86.9	Confident	78.7	Confident	140 Å²	140	133 Å²	133	61%	0.609	59%	0.586	S	S	*	*	H	α-helix	trans	-62	-38.7	172.8	-70.3	176.7	-178.4	-173.7	0	112	N178 Q179 K186	N178-K182 WeakPolarHBondContact O-CG 3.45Å; N178-K182 PolarHBondContact O-N 3.24Å; N178-K182 WeakPolarHBondContact OD1-CE 3.21Å; Q179-K182 WeakPolarHBondContact O-CA 3.4Å; Q179-K182 WeakPolarHBondContact O-CB 3.46Å; Q179-K182 PolarHBondContact O-N 3.02Å; K182-K186 WeakPolarHBondContact O-CB 3.34Å; K182-K186 PolarHBondContact O-N 3.23Å
183	Y	92.3	Very high	80.8	Confident	155 Å²	155	127.3 Å²	127.3	61%	0.608	57%	0.571	S	S	*	*	H	α-helix	trans	-66.6	-41.8	172.6	-72.7	-69.7	0	0	0	112.2	Q179 N180 E181 L185 K186 Y187	Q179-Y183 HydrophobicContact CB-CE2 4.41Å; Q179-Y183 WeakPolarHBondContact O-CD2 3.44Å; Q179-Y183 PolarHBondContact O-N 2.68Å; N180-Y183 PolarHBondContact O-N 3.39Å; E181-Y183 VanDerWaalsContact C-N 3.33Å; E181-Y183 PolarHBondContact O-N 3.12Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; Y183-L185 PolarHBondContact O-N 2.92Å; Y183-K186 PolarHBondContact O-N 2.93Å; Y183-Y187 WeakPolarHBondContact O-CB 3.35Å; Y183-Y187 PolarHBondContact O-N 2.75Å
184	R	92.9	Very high	82.9	Confident	127 Å²	127	119.7 Å²	119.7	48%	0.479	55%	0.551	S	S	.	*	H	α-helix	trans	-57.1	-46	174	-173.9	176.9	77.1	108.3	-5.5	111.6	N180 E181 Y187 Q188	N180-R184 WeakPolarHBondContact O-CB 3.33Å; N180-R184 PolarHBondContact O-N 3.32Å; E181-R184 WeakPolarHBondContact O-CB 3.37Å; E181-R184 PolarHBondContact O-N 3.03Å; E181-R184 IonicContact OE1-CZ 3.52Å; E181-R184 IonicContact OE1-NE 3.53Å; E181-R184 IonicContact OE1-NH2 2.69Å; E181-R184 PolarHBondContact OE1-NH2 3.44Å; R184-Y187 PolarHBondContact O-N 2.79Å; R184-Q188 WeakPolarHBondContact O-CG 3.23Å; R184-Q188 PolarHBondContact O-N 2.84Å
185	L	93.3	Very high	84.9	Confident	75 Å²	75	124.4 Å²	124.4	39%	0.393	56%	0.556	S	S	.	*	H	α-helix	trans	-67.5	-40.5	176.2	-72.9	165.8	0	0	0	112.3	E181 Y183 Q188 R189	E181-L185 HydrophobicContact CG-CD1 4.26Å; E181-L185 WeakPolarHBondContact O-CG 3.27Å; E181-L185 PolarHBondContact O-N 2.91Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; Y183-L185 PolarHBondContact O-N 2.92Å; L185-Q188 PolarHBondContact O-N 3Å; L185-R189 WeakPolarHBondContact O-CG 3.43Å; L185-R189 PolarHBondContact O-N 3.06Å
186	K	92.9	Very high	86.9	Confident	148 Å²	148	122 Å²	122	64%	0.643	55%	0.55	S	S	*	.	H	α-helix	trans	-62.6	-43.5	174.3	-172.4	177	179.5	-178.7	0	111.3	K182 Y183 R189 L190	K182-K186 WeakPolarHBondContact O-CB 3.34Å; K182-K186 PolarHBondContact O-N 3.23Å; Y183-K186 PolarHBondContact O-N 2.93Å; K186-R189 PolarHBondContact O-N 2.86Å; K186-L190 WeakPolarHBondContact O-CB 3.45Å; K186-L190 PolarHBondContact O-N 2.63Å
187	Y	94	Very high	88.7	Confident	140 Å²	140	118.9 Å²	118.9	55%	0.549	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-44.3	175.1	174	-98.7	0	0	0	112	Y183 R184 R189 L190 R191	Y183-Y187 WeakPolarHBondContact O-CB 3.35Å; Y183-Y187 PolarHBondContact O-N 2.75Å; R184-Y187 PolarHBondContact O-N 2.79Å; Y187-R189 PolarHBondContact O-N 3.49Å; Y187-L190 PolarHBondContact O-N 3.06Å; Y187-R191 VanDerWaalsContact O-CB 3.3Å; Y187-R191 WeakPolarHBondContact O-CB 3.47Å; Y187-R191 PolarHBondContact O-N 3.18Å
188	Q	93.9	Very high	90.4	Very high	95 Å²	95	116.3 Å²	116.3	44%	0.444	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.7	-76.7	176.8	-18.8	0	0	112.6	R184 L185 R191 K192	R184-Q188 WeakPolarHBondContact O-CG 3.23Å; R184-Q188 PolarHBondContact O-N 2.84Å; L185-Q188 PolarHBondContact O-N 3Å; Q188-R191 PolarHBondContact O-N 3.26Å; Q188-K192 PolarHBondContact O-N 2.87Å
189	R	95.6	Very high	92	Very high	192 Å²	192	119.4 Å²	119.4	73%	0.725	55%	0.547	S	S	*	.	H	α-helix	trans	-62.8	-47.2	174	-71.7	175.3	-174.3	-171.4	1	111.7	L185 K186 Y187 R191 K192 A193	L185-R189 WeakPolarHBondContact O-CG 3.43Å; L185-R189 PolarHBondContact O-N 3.06Å; K186-R189 PolarHBondContact O-N 2.86Å; Y187-R189 PolarHBondContact O-N 3.49Å; R189-R191 PolarHBondContact O-N 3.45Å; R189-K192 PolarHBondContact O-N 3.02Å; R189-A193 PolarHBondContact O-N 3.08Å
190	L	95.7	Very high	93.2	Very high	117 Å²	117	119.6 Å²	119.6	61%	0.613	55%	0.549	S	S	*	.	H	α-helix	trans	-62.8	-41.4	177.9	-174.5	62.3	0	0	0	111.8	K186 Y187 K192 A193 A194	K186-L190 WeakPolarHBondContact O-CB 3.45Å; K186-L190 PolarHBondContact O-N 2.63Å; Y187-L190 PolarHBondContact O-N 3.06Å; L190-K192 VanDerWaalsContact C-N 3.32Å; L190-K192 PolarHBondContact O-N 3.04Å; L190-A193 PolarHBondContact O-N 2.9Å; L190-A194 WeakPolarHBondContact O-CB 3.43Å; L190-A194 PolarHBondContact O-N 3.38Å
191	R	94.9	Very high	94	Very high	132 Å²	132	119.1 Å²	119.1	50%	0.498	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-32	174.9	-168.3	179.2	-173.2	-163.2	4.4	112.5	Y187 Q188 R189 R195	Y187-R191 VanDerWaalsContact O-CB 3.3Å; Y187-R191 WeakPolarHBondContact O-CB 3.47Å; Y187-R191 PolarHBondContact O-N 3.18Å; Q188-R191 PolarHBondContact O-N 3.26Å; R189-R191 PolarHBondContact O-N 3.45Å; R191-R195 WeakPolarHBondContact O-CB 3.46Å; R191-R195 WeakPolarHBondContact O-CG 3.34Å; R191-R195 PolarHBondContact O-N 3.33Å
192	K	95.6	Very high	94.4	Very high	154 Å²	154	117 Å²	117	67%	0.67	54%	0.544	S	S	*	.	H	α-helix	trans	-69.8	-47.6	171.4	-170.9	179.1	178.6	-176.6	0	110.9	Q188 R189 L190 A194 R195 T196	Q188-K192 PolarHBondContact O-N 2.87Å; R189-K192 PolarHBondContact O-N 3.02Å; L190-K192 VanDerWaalsContact C-N 3.32Å; L190-K192 PolarHBondContact O-N 3.04Å; K192-A194 PolarHBondContact O-N 3.46Å; K192-R195 WeakPolarHBondContact O-CB 3.39Å; K192-R195 PolarHBondContact O-N 3.28Å; K192-T196 PolarHBondContact O-N 3.17Å; K192-T196 PolarHBondContact O-OG1 3.44Å
193	A	95.3	Very high	94.9	Very high	50 Å²	50	112.8 Å²	112.8	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-59.4	-46.7	177.9	0	0	0	0	0	112.2	R189 L190 R195 T196 M197	R189-A193 PolarHBondContact O-N 3.08Å; L190-A193 PolarHBondContact O-N 2.9Å; A193-R195 VanDerWaalsContact C-N 3.32Å; A193-R195 PolarHBondContact O-N 2.94Å; A193-T196 WeakPolarHBondContact O-CB 3.46Å; A193-T196 PolarHBondContact O-N 3.09Å; A193-T196 VanDerWaalsContact O-N 3.11Å; A193-M197 PolarHBondContact O-N 2.76Å
194	A	95.2	Very high	95	Very high	46 Å²	46	110.2 Å²	110.2	38%	0.38	53%	0.532	S	S	.	.	H	α-helix	trans	-60.3	-39.4	175.9	0	0	0	0	0	112.5	L190 K192 M197 I198	L190-A194 WeakPolarHBondContact O-CB 3.43Å; L190-A194 PolarHBondContact O-N 3.38Å; K192-A194 PolarHBondContact O-N 3.46Å; A194-M197 PolarHBondContact O-N 3.37Å; A194-I198 WeakPolarHBondContact O-CD1 3.33Å; A194-I198 VanDerWaalsContact O-CG1 3.26Å; A194-I198 WeakPolarHBondContact O-CG1 3.47Å; A194-I198 PolarHBondContact O-N 3.47Å
195	R	93.7	Very high	95.1	Very high	144 Å²	144	107.4 Å²	107.4	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-43.3	172.3	-79.6	174	166.6	-169.7	-7.4	112.2	R191 K192 A193 I198 F199	R191-R195 WeakPolarHBondContact O-CB 3.46Å; R191-R195 WeakPolarHBondContact O-CG 3.34Å; R191-R195 PolarHBondContact O-N 3.33Å; K192-R195 WeakPolarHBondContact O-CB 3.39Å; K192-R195 PolarHBondContact O-N 3.28Å; A193-R195 VanDerWaalsContact C-N 3.32Å; A193-R195 PolarHBondContact O-N 2.94Å; R195-I198 PolarHBondContact O-N 3.07Å; R195-F199 WeakPolarHBondContact O-CD2 3.29Å; R195-F199 PolarHBondContact O-N 3.39Å; R195-F199 VanDerWaalsContact O-N 3.13Å
196	T	95.7	Very high	95.3	Very high	77 Å²	77	109.4 Å²	109.4	47%	0.472	54%	0.542	S	S	.	.	H	α-helix	trans	-60.3	-46.8	176.2	-61.6	0	0	0	0	111.2	K192 A193 I198 F199 E200	K192-T196 PolarHBondContact O-N 3.17Å; K192-T196 PolarHBondContact O-OG1 3.44Å; A193-T196 WeakPolarHBondContact O-CB 3.46Å; A193-T196 PolarHBondContact O-N 3.09Å; A193-T196 VanDerWaalsContact O-N 3.11Å; T196-I198 VanDerWaalsContact C-N 3.29Å; T196-I198 PolarHBondContact O-N 3.45Å; T196-F199 PolarHBondContact O-N 2.78Å; T196-E200 WeakPolarHBondContact O-CB 3.47Å; T196-E200 PolarHBondContact O-N 3.02Å
197	M	95.6	Very high	95.5	Very high	129 Å²	129	107.7 Å²	107.7	64%	0.635	54%	0.536	S	S	*	.	H	α-helix	trans	-60.3	-35.2	175.2	-72	-177.9	69.5	0	0	113.2	A193 A194 N201	A193-M197 PolarHBondContact O-N 2.76Å; A194-M197 PolarHBondContact O-N 3.37Å; M197-N201 WeakPolarHBondContact O-CB 3.32Å; M197-N201 PolarHBondContact O-N 2.93Å
198	I	96.4	Very high	95.6	Very high	115 Å²	115	105.6 Å²	105.6	59%	0.59	53%	0.533	S	S	*	.	H	α-helix	trans	-66.2	-41.9	176.3	-70.9	162.1	0	0	0	111.1	A194 R195 T196 A202	A194-I198 WeakPolarHBondContact O-CD1 3.33Å; A194-I198 VanDerWaalsContact O-CG1 3.26Å; A194-I198 WeakPolarHBondContact O-CG1 3.47Å; A194-I198 PolarHBondContact O-N 3.47Å; R195-I198 PolarHBondContact O-N 3.07Å; T196-I198 VanDerWaalsContact C-N 3.29Å; T196-I198 PolarHBondContact O-N 3.45Å; I198-A202 WeakPolarHBondContact O-CB 3.34Å; I198-A202 PolarHBondContact O-N 3.03Å
199	F	96.2	Very high	95.7	Very high	154 Å²	154	103.7 Å²	103.7	68%	0.675	53%	0.534	S	S	*	.	H	α-helix	trans	-69.2	-38.7	175.5	-71.8	-63.9	0	0	0	112.8	R195 T196 A202 A203	R195-F199 WeakPolarHBondContact O-CD2 3.29Å; R195-F199 PolarHBondContact O-N 3.39Å; R195-F199 VanDerWaalsContact O-N 3.13Å; T196-F199 PolarHBondContact O-N 2.78Å; F199-A202 PolarHBondContact O-N 3.37Å; F199-A203 PolarHBondContact O-N 2.84Å
200	E	96.7	Very high	95.7	Very high	117 Å²	117	98.4 Å²	98.4	55%	0.547	52%	0.518	S	S	.	.	H	α-helix	trans	-63.7	-44.8	175.5	-175	173.7	-167.4	0	0	111.4	T196 A203 L204	T196-E200 WeakPolarHBondContact O-CB 3.47Å; T196-E200 PolarHBondContact O-N 3.02Å; E200-A203 PolarHBondContact O-N 3Å; E200-L204 HydrophobicContact CG-CD1 4.47Å; E200-L204 VanDerWaalsContact O-CG 3.32Å; E200-L204 WeakPolarHBondContact O-CG 3.32Å; E200-L204 PolarHBondContact O-N 2.6Å
201	N	93.7	Very high	95.7	Very high	102 Å²	102	96.9 Å²	96.9	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-38.9	176	-164.6	29.6	0	0	0	112.1	M197 L204 C205	M197-N201 WeakPolarHBondContact O-CB 3.32Å; M197-N201 PolarHBondContact O-N 2.93Å; N201-L204 PolarHBondContact O-N 2.81Å; N201-C205 PolarHBondContact O-N 2.72Å; N201-C205 PolarHBondContact O-SG 3.08Å; N201-C205 VanDerWaalsContact O-SG 3.35Å
202	A	95.9	Very high	95.7	Very high	47 Å²	47	96.6 Å²	96.6	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-61.2	-47.6	174.1	0	0	0	0	0	111.9	I198 F199 L204 C205 D206	I198-A202 WeakPolarHBondContact O-CB 3.34Å; I198-A202 PolarHBondContact O-N 3.03Å; F199-A202 PolarHBondContact O-N 3.37Å; A202-L204 VanDerWaalsContact C-N 3.28Å; A202-L204 PolarHBondContact O-N 3.45Å; A202-C205 WeakPolarHBondContact O-CB 3.38Å; A202-C205 PolarHBondContact O-N 2.9Å; A202-C205 VanDerWaalsContact O-N 3.09Å; A202-D206 PolarHBondContact O-N 3.05Å
203	A	96.9	Very high	95.7	Very high	53 Å²	53	93.9 Å²	93.9	44%	0.438	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-33.1	176.8	0	0	0	0	0	112.9	F199 E200 D206 E207	F199-A203 PolarHBondContact O-N 2.84Å; E200-A203 PolarHBondContact O-N 3Å; A203-D206 PolarHBondContact O-N 3.45Å; A203-E207 PolarHBondContact O-N 2.84Å; A203-E207 VanDerWaalsContact O-N 3.12Å
204	L	95.8	Very high	95.8	Very high	100 Å²	100	97 Å²	97	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-37.7	172.4	-71.8	168.8	0	0	0	112.1	E200 N201 A202 E207 I208	E200-L204 HydrophobicContact CG-CD1 4.47Å; E200-L204 VanDerWaalsContact O-CG 3.32Å; E200-L204 WeakPolarHBondContact O-CG 3.32Å; E200-L204 PolarHBondContact O-N 2.6Å; N201-L204 PolarHBondContact O-N 2.81Å; A202-L204 VanDerWaalsContact C-N 3.28Å; A202-L204 PolarHBondContact O-N 3.45Å; L204-E207 PolarHBondContact O-N 2.8Å; L204-I208 WeakPolarHBondContact O-CB 3.25Å; L204-I208 WeakPolarHBondContact O-CD1 3.45Å; L204-I208 WeakPolarHBondContact O-CG1 3.31Å; L204-I208 PolarHBondContact O-N 3.18Å
205	C	94.5	Very high	95.7	Very high	69 Å²	69	101.5 Å²	101.5	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-41.4	172.1	-69.6	0	0	0	0	112.2	N201 A202 I208 A209	N201-C205 PolarHBondContact O-N 2.72Å; N201-C205 PolarHBondContact O-SG 3.08Å; N201-C205 VanDerWaalsContact O-SG 3.35Å; A202-C205 WeakPolarHBondContact O-CB 3.38Å; A202-C205 PolarHBondContact O-N 2.9Å; A202-C205 VanDerWaalsContact O-N 3.09Å; C205-I208 PolarHBondContact O-N 2.91Å; C205-A209 PolarHBondContact O-N 3.48Å
206	D	96.9	Very high	95.7	Very high	116 Å²	116	100 Å²	100	62%	0.62	53%	0.525	S	S	*	.	H	α-helix	trans	-62.8	-44.7	177.8	-64.7	-30.9	0	0	0	111.6	A202 A203 A209 H210	A202-D206 PolarHBondContact O-N 3.05Å; A203-D206 PolarHBondContact O-N 3.45Å; D206-A209 PolarHBondContact O-N 2.85Å; D206-H210 VanDerWaalsContact O-CB 3.28Å; D206-H210 WeakPolarHBondContact O-CB 3.43Å; D206-H210 PolarHBondContact O-N 2.92Å
207	E	97.2	Very high	95.7	Very high	112 Å²	112	103.1 Å²	103.1	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-31.7	176.1	-75.3	-64.8	173.4	0	0	113.5	A203 L204 H210 T211	A203-E207 PolarHBondContact O-N 2.84Å; A203-E207 VanDerWaalsContact O-N 3.12Å; L204-E207 PolarHBondContact O-N 2.8Å; E207-H210 IonicContact OE2-CE1 3.78Å; E207-H210 IonicContact OE2-ND1 2.95Å; E207-H210 PolarHBondContact OE2-ND1 2.93Å; E207-T211 VanDerWaalsContact O-CB 3.28Å; E207-T211 WeakPolarHBondContact O-CB 3.39Å; E207-T211 PolarHBondContact O-N 3.41Å; E207-T211 PolarHBondContact O-OG1 3Å
208	I	95.6	Very high	95.7	Very high	96 Å²	96	99.4 Å²	99.4	49%	0.492	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-52.6	171.7	-72.5	164	0	0	0	109.8	L204 C205 H210 T211 E212	L204-I208 WeakPolarHBondContact O-CB 3.25Å; L204-I208 WeakPolarHBondContact O-CD1 3.45Å; L204-I208 WeakPolarHBondContact O-CG1 3.31Å; L204-I208 PolarHBondContact O-N 3.18Å; C205-I208 PolarHBondContact O-N 2.91Å; I208-H210 VanDerWaalsContact C-N 3.32Å; I208-H210 PolarHBondContact O-N 3.3Å; I208-T211 CarbonylContact O-C 3.56Å; I208-T211 WeakPolarHBondContact O-CA 3.27Å; I208-T211 WeakPolarHBondContact O-CB 3.21Å; I208-T211 PolarHBondContact O-N 3.39Å; I208-E212 HydrophobicContact CG2-CG 4.31Å; I208-E212 WeakPolarHBondContact O-CG 3.45Å; I208-E212 PolarHBondContact O-N 2.76Å
209	A	96	Very high	95.7	Very high	56 Å²	56	100.1 Å²	100.1	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-41.9	-179.4	0	0	0	0	0	112.4	C205 D206 T211 E212 E213	C205-A209 PolarHBondContact O-N 3.48Å; D206-A209 PolarHBondContact O-N 2.85Å; A209-T211 VanDerWaalsContact C-N 3.33Å; A209-T211 PolarHBondContact O-N 2.87Å; A209-E212 PolarHBondContact O-N 2.77Å; A209-E213 PolarHBondContact O-N 2.74Å
210	H	96.3	Very high	95.7	Very high	80 Å²	80	99.3 Å²	99.3	37%	0.37	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-35.8	173.6	169.1	-139.3	0	0	0	113.2	D206 E207 I208 K214	D206-H210 VanDerWaalsContact O-CB 3.28Å; D206-H210 WeakPolarHBondContact O-CB 3.43Å; D206-H210 PolarHBondContact O-N 2.92Å; E207-H210 IonicContact OE2-CE1 3.78Å; E207-H210 IonicContact OE2-ND1 2.95Å; E207-H210 PolarHBondContact OE2-ND1 2.93Å; I208-H210 VanDerWaalsContact C-N 3.32Å; I208-H210 PolarHBondContact O-N 3.3Å; H210-K214 PolarHBondContact CE1-NZ 2.8Å; H210-K214 VanDerWaalsContact NE2-CE 3.33Å; H210-K214 WeakPolarHBondContact NE2-CE 3.45Å; H210-K214 PolarHBondContact NE2-NZ 2.96Å; H210-K214 WeakPolarHBondContact O-CG 3.46Å; H210-K214 PolarHBondContact O-N 2.89Å
211	T	95.1	Very high	95.7	Very high	85 Å²	85	98.9 Å²	98.9	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-73.8	-38.5	175.3	-61.4	0	0	0	0	111.8	E207 I208 A209 K214 F215	E207-T211 VanDerWaalsContact O-CB 3.28Å; E207-T211 WeakPolarHBondContact O-CB 3.39Å; E207-T211 PolarHBondContact O-N 3.41Å; E207-T211 PolarHBondContact O-OG1 3Å; I208-T211 CarbonylContact O-C 3.56Å; I208-T211 WeakPolarHBondContact O-CA 3.27Å; I208-T211 WeakPolarHBondContact O-CB 3.21Å; I208-T211 PolarHBondContact O-N 3.39Å; A209-T211 VanDerWaalsContact C-N 3.33Å; A209-T211 PolarHBondContact O-N 2.87Å; T211-K214 PolarHBondContact O-N 2.87Å; T211-F215 WeakPolarHBondContact O-CB 3.1Å; T211-F215 PolarHBondContact O-N 2.73Å
212	E	95.3	Very high	95.8	Very high	126 Å²	126	103.2 Å²	103.2	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-66.3	-40.5	175.7	-71.9	-178.1	149.3	0	0	112	I208 A209 F215 L216	I208-E212 HydrophobicContact CG2-CG 4.31Å; I208-E212 WeakPolarHBondContact O-CG 3.45Å; I208-E212 PolarHBondContact O-N 2.76Å; A209-E212 PolarHBondContact O-N 2.77Å; E212-F215 PolarHBondContact O-N 2.72Å; E212-L216 WeakPolarHBondContact O-CB 3.46Å; E212-L216 PolarHBondContact O-N 2.85Å
213	E	96.3	Very high	95.8	Very high	97 Å²	97	108.6 Å²	108.6	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-61	-45.7	174.3	-163	-133.8	121.7	0	0	111.4	A209 F215 L216 R217	A209-E213 PolarHBondContact O-N 2.74Å; E213-F215 PolarHBondContact O-N 2.62Å; E213-L216 PolarHBondContact O-N 2.8Å; E213-R217 WeakPolarHBondContact O-CB 3.21Å; E213-R217 PolarHBondContact O-N 2.98Å; E213-R217 IonicContact OE1-CZ 3.53Å; E213-R217 IonicContact OE1-NE 3.57Å; E213-R217 IonicContact OE1-NH2 2.67Å; E213-R217 PolarHBondContact OE1-NH2 3.22Å
214	K	96.3	Very high	95.8	Very high	115 Å²	115	112.7 Å²	112.7	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-40.8	174.9	-79.5	172	169.6	167.5	0	112.6	H210 T211 R217 A218	H210-K214 PolarHBondContact CE1-NZ 2.8Å; H210-K214 VanDerWaalsContact NE2-CE 3.33Å; H210-K214 WeakPolarHBondContact NE2-CE 3.45Å; H210-K214 PolarHBondContact NE2-NZ 2.96Å; H210-K214 WeakPolarHBondContact O-CG 3.46Å; H210-K214 PolarHBondContact O-N 2.89Å; T211-K214 PolarHBondContact O-N 2.87Å; K214-R217 PolarHBondContact O-N 3.08Å; K214-A218 WeakPolarHBondContact O-CB 3.38Å; K214-A218 PolarHBondContact O-N 3.03Å
215	F	93.6	Very high	95.8	Very high	141 Å²	141	113.3 Å²	113.3	62%	0.618	55%	0.548	S	S	*	.	H	α-helix	trans	-65.1	-41.5	175.7	178.1	-102.5	0	0	0	111.8	T211 E212 E213 K219	T211-F215 WeakPolarHBondContact O-CB 3.1Å; T211-F215 PolarHBondContact O-N 2.73Å; E212-F215 PolarHBondContact O-N 2.72Å; E213-F215 PolarHBondContact O-N 2.62Å; F215-K219 HydrophobicContact CE1-CD 4.38Å; F215-K219 WeakPolarHBondContact O-CB 3.09Å; F215-K219 PolarHBondContact O-N 2.91Å
216	L	93.5	Very high	95.8	Very high	113 Å²	113	115.4 Å²	115.4	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-62.7	-45.4	176.2	-168.3	71.7	0	0	0	111.1	E212 E213 K219 E220	E212-L216 WeakPolarHBondContact O-CB 3.46Å; E212-L216 PolarHBondContact O-N 2.85Å; E213-L216 PolarHBondContact O-N 2.8Å; L216-K219 WeakPolarHBondContact O-CB 3.32Å; L216-K219 PolarHBondContact O-N 2.97Å; L216-E220 PolarHBondContact O-N 3.02Å
217	R	96.1	Very high	95.6	Very high	143 Å²	143	117.2 Å²	117.2	54%	0.54	56%	0.556	S	S	.	*	H	α-helix	trans	-60.7	-51	176.6	-165.8	-172.6	-63.1	-143.8	2.1	111.8	E213 K214 K219 E220 E221	E213-R217 WeakPolarHBondContact O-CB 3.21Å; E213-R217 PolarHBondContact O-N 2.98Å; E213-R217 IonicContact OE1-CZ 3.53Å; E213-R217 IonicContact OE1-NE 3.57Å; E213-R217 IonicContact OE1-NH2 2.67Å; E213-R217 PolarHBondContact OE1-NH2 3.22Å; K214-R217 PolarHBondContact O-N 3.08Å; R217-K219 VanDerWaalsContact C-N 3.26Å; R217-K219 PolarHBondContact O-N 2.65Å; R217-E220 PolarHBondContact O-N 2.88Å; R217-E220 VanDerWaalsContact O-N 3.08Å; R217-E221 WeakPolarHBondContact CG-OE1 3.47Å; R217-E221 WeakPolarHBondContact O-CG 3.36Å; R217-E221 PolarHBondContact O-N 3.36Å
218	A	95.5	Very high	95.5	Very high	50 Å²	50	113.5 Å²	113.5	41%	0.413	54%	0.542	S	S	.	.	H	α-helix	trans	-62.4	-31.3	177.3	0	0	0	0	0	112.9	K214 R222	K214-A218 WeakPolarHBondContact O-CB 3.38Å; K214-A218 PolarHBondContact O-N 3.03Å; A218-R222 VanDerWaalsContact O-CB 3.24Å; A218-R222 WeakPolarHBondContact O-CB 3.31Å; A218-R222 PolarHBondContact O-N 2.96Å
219	K	96.5	Very high	95.3	Very high	130 Å²	130	114 Å²	114	57%	0.565	55%	0.545	S	S	*	.	H	α-helix	trans	-69.6	-37.1	173.9	-178.9	-177.6	178.8	-175.9	0	112	F215 L216 R217 K223	F215-K219 HydrophobicContact CE1-CD 4.38Å; F215-K219 WeakPolarHBondContact O-CB 3.09Å; F215-K219 PolarHBondContact O-N 2.91Å; L216-K219 WeakPolarHBondContact O-CB 3.32Å; L216-K219 PolarHBondContact O-N 2.97Å; R217-K219 VanDerWaalsContact C-N 3.26Å; R217-K219 PolarHBondContact O-N 2.65Å; K219-K223 WeakPolarHBondContact O-CB 3.39Å; K219-K223 PolarHBondContact O-N 3.33Å; K219-K223 VanDerWaalsContact O-N 3.13Å
220	E	96.4	Very high	95	Very high	138 Å²	138	116.3 Å²	116.3	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-72.5	-45.4	173.7	-177.7	153.1	-125.5	0	0	112.1	L216 R217 R222 K223 F224	L216-E220 PolarHBondContact O-N 3.02Å; R217-E220 PolarHBondContact O-N 2.88Å; R217-E220 VanDerWaalsContact O-N 3.08Å; E220-R222 VanDerWaalsContact C-N 3.33Å; E220-R222 PolarHBondContact O-N 2.85Å; E220-K223 CarbonylContact O-C 3.58Å; E220-K223 WeakPolarHBondContact O-CA 3.46Å; E220-K223 WeakPolarHBondContact O-CB 3.22Å; E220-K223 PolarHBondContact O-N 2.88Å; E220-F224 PolarHBondContact O-N 3.39Å
221	E	96.6	Very high	94.7	Very high	107 Å²	107	117.8 Å²	117.8	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-54.9	-46.9	172.6	-72	168.5	-173.3	0	0	111.2	R217 K223 F224 L225	R217-E221 WeakPolarHBondContact CG-OE1 3.47Å; R217-E221 WeakPolarHBondContact O-CG 3.36Å; R217-E221 PolarHBondContact O-N 3.36Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 2.99Å; E221-F224 PolarHBondContact O-N 3.09Å; E221-L225 WeakPolarHBondContact O-CB 3.48Å; E221-L225 VanDerWaalsContact O-CG 3.31Å; E221-L225 WeakPolarHBondContact O-CG 3.34Å; E221-L225 PolarHBondContact O-N 3.27Å
222	R	96.4	Very high	94.2	Very high	194 Å²	194	121.4 Å²	121.4	73%	0.732	56%	0.562	S	S	*	*	H	α-helix	trans	-59.4	-40.4	174.1	-179.7	176.7	177.4	170.4	1.1	112.5	A218 E220 L226	A218-R222 VanDerWaalsContact O-CB 3.24Å; A218-R222 WeakPolarHBondContact O-CB 3.31Å; A218-R222 PolarHBondContact O-N 2.96Å; E220-R222 VanDerWaalsContact C-N 3.33Å; E220-R222 PolarHBondContact O-N 2.85Å; R222-L226 VanDerWaalsContact O-CB 3.24Å; R222-L226 WeakPolarHBondContact O-CB 3.16Å; R222-L226 PolarHBondContact O-N 3.13Å
223	K	94.3	Very high	93.5	Very high	159 Å²	159	120.7 Å²	120.7	69%	0.691	56%	0.558	S	S	*	*	H	α-helix	trans	-68.4	-39.8	178	-175	-174.4	177	-170.6	0	111.4	K219 E220 E221 K227	K219-K223 WeakPolarHBondContact O-CB 3.39Å; K219-K223 PolarHBondContact O-N 3.33Å; K219-K223 VanDerWaalsContact O-N 3.13Å; E220-K223 CarbonylContact O-C 3.58Å; E220-K223 WeakPolarHBondContact O-CA 3.46Å; E220-K223 WeakPolarHBondContact O-CB 3.22Å; E220-K223 PolarHBondContact O-N 2.88Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 2.99Å; K223-K227 WeakPolarHBondContact O-CB 3.36Å; K223-K227 PolarHBondContact O-N 3.39Å
224	F	96.9	Very high	92.6	Very high	140 Å²	140	120 Å²	120	61%	0.614	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-51.5	175.3	176.8	-93.4	0	0	0	111.4	E220 E221 L226 K227 S228	E220-F224 PolarHBondContact O-N 3.39Å; E221-F224 PolarHBondContact O-N 3.09Å; F224-L226 VanDerWaalsContact C-N 3.35Å; F224-L226 PolarHBondContact O-N 2.89Å; F224-K227 PolarHBondContact O-N 3.47Å; F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 2.66Å
225	L	96.3	Very high	91.5	Very high	113 Å²	113	119.4 Å²	119.4	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-60.3	-42.4	178.6	-70.6	171.4	0	0	0	111.8	E221 S228 L229	E221-L225 WeakPolarHBondContact O-CB 3.48Å; E221-L225 VanDerWaalsContact O-CG 3.31Å; E221-L225 WeakPolarHBondContact O-CG 3.34Å; E221-L225 PolarHBondContact O-N 3.27Å; L225-S228 PolarHBondContact O-N 3.45Å; L225-L229 WeakPolarHBondContact O-CB 3.25Å; L225-L229 PolarHBondContact O-N 2.88Å
226	L	94.1	Very high	90.3	Very high	113 Å²	113	116.9 Å²	116.9	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-64.4	-41.8	176.2	-178.1	61.7	0	0	0	112.3	R222 F224 L230	R222-L226 VanDerWaalsContact O-CB 3.24Å; R222-L226 WeakPolarHBondContact O-CB 3.16Å; R222-L226 PolarHBondContact O-N 3.13Å; F224-L226 VanDerWaalsContact C-N 3.35Å; F224-L226 PolarHBondContact O-N 2.89Å; L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 PolarHBondContact O-N 3.34Å
227	K	94.4	Very high	88.5	Confident	153 Å²	153	119 Å²	119	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-63.7	-42.2	174.6	-175.9	-174.6	175.4	-171.4	0	111.4	K223 F224 L230 Q231	K223-K227 WeakPolarHBondContact O-CB 3.36Å; K223-K227 PolarHBondContact O-N 3.39Å; F224-K227 PolarHBondContact O-N 3.47Å; K227-L230 PolarHBondContact O-N 2.91Å; K227-Q231 WeakPolarHBondContact O-CB 3.15Å; K227-Q231 PolarHBondContact O-N 3.26Å
228	S	93.1	Very high	86.7	Confident	34 Å²	34	115.3 Å²	115.3	24%	0.238	58%	0.576	C	S	.	*	H	α-helix	trans	-67.3	-42.9	179.6	-174.2	0	0	0	0	111.7	F224 L225 L230 Q231 Y232	F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 2.66Å; L225-S228 PolarHBondContact O-N 3.45Å; S228-L230 PolarHBondContact O-N 3.49Å; S228-Q231 WeakPolarHBondContact O-CB 3.35Å; S228-Q231 PolarHBondContact O-N 3Å; S228-Y232 WeakPolarHBondContact O-CD2 3.15Å; S228-Y232 PolarHBondContact O-N 3.38Å; S228-Y232 WeakPolarHBondContact OG-CE2 3.29Å
229	L	91.9	Very high	84.3	Confident	107 Å²	107	121 Å²	121	56%	0.56	59%	0.594	S	S	*	*	H	α-helix	trans	-59.3	-46.5	174.2	-177.2	154.7	0	0	0	111.5	L225 Q231 Y232 Q233	L225-L229 WeakPolarHBondContact O-CB 3.25Å; L225-L229 PolarHBondContact O-N 2.88Å; L229-Q231 VanDerWaalsContact C-N 3.3Å; L229-Q231 PolarHBondContact O-N 3.15Å; L229-Y232 PolarHBondContact O-N 3.14Å; L229-Q233 PolarHBondContact O-N 3.01Å
230	L	89.8	Confident	81.7	Confident	104 Å²	104	122.4 Å²	122.4	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-61.2	-40	176.4	-175.4	64.3	0	0	0	111.7	L226 K227 S228 Q233 T234	L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 PolarHBondContact O-N 3.34Å; K227-L230 PolarHBondContact O-N 2.91Å; S228-L230 PolarHBondContact O-N 3.49Å; L230-Q233 PolarHBondContact O-N 3.34Å; L230-T234 PolarHBondContact O-N 3.23Å; L230-T234 PolarHBondContact O-OG1 3.11Å
231	Q	89.4	Confident	78.9	Confident	112 Å²	112	123.7 Å²	123.7	52%	0.523	62%	0.617	S	S	.	*	H	α-helix	trans	-63.6	-43.9	175.3	-174.6	174.5	-7.6	0	0	112	K227 S228 L229 Q233 T234 L235	K227-Q231 WeakPolarHBondContact O-CB 3.15Å; K227-Q231 PolarHBondContact O-N 3.26Å; S228-Q231 WeakPolarHBondContact O-CB 3.35Å; S228-Q231 PolarHBondContact O-N 3Å; L229-Q231 VanDerWaalsContact C-N 3.3Å; L229-Q231 PolarHBondContact O-N 3.15Å; Q231-Q233 VanDerWaalsContact C-N 3.33Å; Q231-Q233 PolarHBondContact O-N 3.48Å; Q231-T234 WeakPolarHBondContact CA-OG1 3.44Å; Q231-T234 PolarHBondContact O-N 3.47Å; Q231-T234 PolarHBondContact O-OG1 3.05Å; Q231-L235 HydrophobicContact CG-CD1 4.22Å; Q231-L235 WeakPolarHBondContact O-CG 3.5Å; Q231-L235 PolarHBondContact O-N 3.25Å
232	Y	85.6	Confident	76.3	Confident	160 Å²	160	124.1 Å²	124.1	63%	0.627	63%	0.629	S	S	*	*	H	α-helix	trans	-63.1	-37.4	174.2	-81.2	-66.6	0	0	0	112.5	S228 L229 L235 S236	S228-Y232 WeakPolarHBondContact O-CD2 3.15Å; S228-Y232 PolarHBondContact O-N 3.38Å; S228-Y232 WeakPolarHBondContact OG-CE2 3.29Å; L229-Y232 PolarHBondContact O-N 3.14Å; Y232-L235 PolarHBondContact O-N 2.91Å; Y232-S236 WeakPolarHBondContact O-CB 3.19Å; Y232-S236 PolarHBondContact O-N 3.47Å
233	Q	80.9	Confident	73.3	Confident	111 Å²	111	121.4 Å²	121.4	52%	0.519	63%	0.634	S	S	.	*	H	α-helix	trans	-61.9	-47.6	174.5	-171.1	171.6	1	0	0	111.3	L229 L230 Q231 L235 S236 E237	L229-Q233 PolarHBondContact O-N 3.01Å; L230-Q233 PolarHBondContact O-N 3.34Å; Q231-Q233 VanDerWaalsContact C-N 3.33Å; Q231-Q233 PolarHBondContact O-N 3.48Å; Q233-L235 VanDerWaalsContact C-N 3.27Å; Q233-L235 PolarHBondContact O-N 3.44Å; Q233-S236 PolarHBondContact O-N 2.8Å; Q233-E237 PolarHBondContact O-N 3.07Å; Q233-E237 VanDerWaalsContact O-N 3.14Å
234	T	77	Confident	71.1	Confident	83 Å²	83	119.7 Å²	119.7	51%	0.509	64%	0.639	S	S	.	*	H	α-helix	trans	-66.2	-24.4	177.1	54.7	0	0	0	0	114.3	L230 Q231	L230-T234 PolarHBondContact O-N 3.23Å; L230-T234 PolarHBondContact O-OG1 3.11Å; Q231-T234 WeakPolarHBondContact CA-OG1 3.44Å; Q231-T234 PolarHBondContact O-N 3.47Å; Q231-T234 PolarHBondContact O-OG1 3.05Å
235	L	74.3	Confident	68.1	Low	103 Å²	103	118.4 Å²	118.4	54%	0.539	65%	0.648	S	S	.	*	H	α-helix	trans	-80.6	-38.2	173.2	-70.8	169.5	0	0	0	111.4	Q231 Y232 Q233 E237 G238	Q231-L235 HydrophobicContact CG-CD1 4.22Å; Q231-L235 WeakPolarHBondContact O-CG 3.5Å; Q231-L235 PolarHBondContact O-N 3.25Å; Y232-L235 PolarHBondContact O-N 2.91Å; Q233-L235 VanDerWaalsContact C-N 3.27Å; Q233-L235 PolarHBondContact O-N 3.44Å; L235-E237 VanDerWaalsContact C-N 3.29Å; L235-E237 PolarHBondContact O-N 3.13Å; L235-G238 PolarHBondContact O-N 2.69Å
236	S	66.6	Low	65.2	Low	88 Å²	88	118 Å²	118	62%	0.615	66%	0.655	S	S	*	*	H	α-helix	trans	-66.9	-26.4	177.9	-171.7	0	0	0	0	113.6	Y232 Q233 G238	Y232-S236 WeakPolarHBondContact O-CB 3.19Å; Y232-S236 PolarHBondContact O-N 3.47Å; Q233-S236 PolarHBondContact O-N 2.8Å; S236-G238 VanDerWaalsContact C-N 3.27Å
237	E	57.4	Low	62.5	Low	156 Å²	156	118.2 Å²	118.2	73%	0.729	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-15.4	169.4	-76.5	-176.8	120.5	0	0	113	Q233 L235	Q233-E237 PolarHBondContact O-N 3.07Å; Q233-E237 VanDerWaalsContact O-N 3.14Å; L235-E237 VanDerWaalsContact C-N 3.29Å; L235-E237 PolarHBondContact O-N 3.13Å
238	G	56.8	Low	59.7	Low	66 Å²	66	115.8 Å²	115.8	68%	0.68	67%	0.668	S	S	*	*	S	Bend	trans	-90.4	-12.1	-173.8	0	0	0	0	0	116.3	L235 S236	L235-G238 PolarHBondContact O-N 2.69Å; S236-G238 VanDerWaalsContact C-N 3.27Å
239	E	44.7	Very low	57.2	Low	171 Å²	171	120.7 Å²	120.7	80%	0.799	70%	0.696	S	S	*	*	S	Bend	trans	-100.1	-1.1	-169.2	-158.8	162.7	-177.1	0	0	114.5	L241	E239-L241 PolarHBondContact O-N 2.93Å
240	L	42.6	Very low	54.8	Low	159 Å²	159	121.3 Å²	121.3	83%	0.832	71%	0.706	S	S	*	*			trans	-91	89.3	175.8	-66.2	-178.7	0	0	0	112.2
241	L	36.9	Very low	52.2	Low	165 Å²	165	122.3 Å²	122.3	86%	0.864	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-69.9	149.5	169.5	-78	175	0	0	0	112.4	E239	E239-L241 PolarHBondContact O-N 2.93Å
242	P	43.8	Very low	50	Low	115 Å²	115	122.7 Å²	122.7	75%	0.747	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-87.9	142.6	-163.2	33.4	-36.6	0	0	0	114.9
243	T	33.2	Very low	48.2	Very low	137 Å²	137	120.6 Å²	120.6	84%	0.84	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-99.5	134.4	161.9	52.4	0	0	0	0	110.7
244	P	47.7	Very low	46.6	Very low	123 Å²	123	121.2 Å²	121.2	80%	0.799	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-89.3	130.8	-169.8	33.2	-34.7	0	0	0	114.2
245	S	33.5	Very low	44.5	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	77%	0.765	S	S	*	*			trans	-162	112.2	153.2	-82.2	0	0	0	0	113
246	S	35.2	Very low	43.2	Very low	104 Å²	104	122.7 Å²	122.7	73%	0.727	78%	0.777	S	S	*	*			trans	41.1	116.5	152	58.8	0	0	0	0	122
247	S	37.6	Very low	41.6	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	79%	0.791	S	S	*	*			trans	61.2	137.5	143.1	51.7	0	0	0	0	120.8
248	S	35.3	Very low	40.6	Very low	102 Å²	102	125.3 Å²	125.3	71%	0.713	79%	0.793	S	S	*	*			cis	-163.6	145.7	-3	50.6	0	0	0	0	113.2
249	V	41	Very low	39.5	Very low	136 Å²	136	128.2 Å²	128.2	82%	0.824	80%	0.802	S	S	*	*			trans	50.6	109	160.8	-65.5	0	0	0	0	120.4
250	P	42.5	Very low	39	Very low	120 Å²	120	124.4 Å²	124.4	78%	0.779	80%	0.801	S	S	*	*			trans	-97.6	153.2	157	36.5	-30.6	0	0	0	112.4
251	S	33.2	Very low	39.2	Very low	125 Å²	125	122.7 Å²	122.7	87%	0.874	80%	0.799	S	S	*	*			trans	-110.4	134	171	-68.7	0	0	0	0	110.8
252	V	44.2	Very low	39	Very low	120 Å²	120	119 Å²	119	73%	0.727	79%	0.793	S	S	*	*			trans	-124.8	132.2	-172.1	175.9	0	0	0	0	111.7
253	P	47.2	Very low	38.4	Very low	116 Å²	116	118.9 Å²	118.9	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.4	124	159.8	33.1	-27.6	0	0	0	110.5
254	P	48.1	Very low	38.1	Very low	124 Å²	124	116.3 Å²	116.3	81%	0.805	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84.2	149	-178.1	32.6	-34.7	0	0	0	113.5
255	A	33.7	Very low	37.2	Very low	96 Å²	96	115 Å²	115	79%	0.793	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-87.3	157.2	169.5	0	0	0	0	0	111.9
256	P	46.8	Very low	37.1	Very low	122 Å²	122	115.6 Å²	115.6	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.1	134.4	-177.3	34.8	-32.2	0	0	0	113.2
257	L	32.8	Very low	36.7	Very low	175 Å²	175	114 Å²	114	92%	0.916	81%	0.806	S	S	*	*			trans	-142.2	146.6	161	-80.2	-176.5	0	0	0	113.6
258	T	36.1	Very low	36.3	Very low	124 Å²	124	114.4 Å²	114.4	76%	0.761	81%	0.809	S	S	*	*			trans	-57.5	147.4	-174.3	52.2	0	0	0	0	118
259	S	33.9	Very low	36	Very low	126 Å²	126	114 Å²	114	88%	0.881	81%	0.805	S	S	*	*				178.4	166.7	108.9	42.6	0	0	0	0	112.9
260	A	33.5	Very low	35.4	Very low	92 Å²	92	114.9 Å²	114.9	76%	0.76	81%	0.805	S	S	*	*			trans	-111	176	-178	0	0	0	0	0	110.8
261	P	46.8	Very low	34.7	Very low	122 Å²	122	114.6 Å²	114.6	79%	0.792	80%	0.801	S	S	*	*				-155.7	-178.5	67.2	43	-21.9	0	0	0	118.6
262	A	32	Very low	34.5	Very low	89 Å²	89	117 Å²	117	74%	0.736	80%	0.798	S	S	*	*			trans	79.4	112.2	143.3	0	0	0	0	0	123.7
263	A	31.3	Very low	33.9	Very low	111 Å²	111	117.9 Å²	117.9	92%	0.917	80%	0.798	S	S	*	*				64.7	143.7	129.1	0	0	0	0	0	123.3
264	G	27.1	Very low	33.7	Very low	84 Å²	84	118 Å²	118	87%	0.866	80%	0.799	S	S	*	*			trans	138	103.8	161	0	0	0	0	0	115.1
265	A	29.3	Very low	32.8	Very low	95 Å²	95	119.8 Å²	119.8	79%	0.785	80%	0.799	S	S	*	*			trans	-97.7	153.4	-177.4	0	0	0	0	0	114
266	S	31.4	Very low	32.5	Very low	126 Å²	126	120.2 Å²	120.2	88%	0.881	80%	0.796	S	S	*	*			trans	147.8	147	135.4	-67.1	0	0	0	0	115.2
267	G	27.5	Very low	31.5	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	80%	0.796	S	S	*	*			trans	88.9	110.6	170.1	0	0	0	0	0	114.2
268	S	28.9	Very low	31.2	Very low	126 Å²	126	119.1 Å²	119.1	88%	0.881	79%	0.788	S	S	*	*				65.9	125.7	59.8	-149.8	0	0	0	0	111.9
269	S	28.3	Very low	30.9	Very low	92 Å²	92	117.9 Å²	117.9	64%	0.643	78%	0.784	S	S	*	*			cis	-168.3	168.2	35.3	63.4	0	0	0	0	114.1
270	L	28.5	Very low	30.6	Very low	156 Å²	156	119.4 Å²	119.4	82%	0.817	78%	0.781	S	S	*	*			trans	63.5	148	167.2	-76.7	66.2	0	0	0	117.6
271	V	29.2	Very low	30.3	Very low	114 Å²	114	118.5 Å²	118.5	69%	0.691	78%	0.78	S	S	*	*			cis	-151.6	130.9	-11.6	128.5	0	0	0	0	111.4
272	H	28.9	Very low	29.4	Very low	175 Å²	175	120.8 Å²	120.8	81%	0.81	78%	0.78	S	S	*	*			trans	19.6	118.8	153.7	-55.6	-72.2	0	0	0	124.9
273	N	30.1	Very low	29.1	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	79%	0.785	S	S	*	*			trans	-74.4	176.2	137.9	-147.2	14.8	0	0	0	109.2
274	P	43.5	Very low	28.9	Very low	119 Å²	119	123 Å²	123	77%	0.773	77%	0.774	S	S	*	*				-154	-154.3	50.5	44.2	-19.5	0	0	0	116.8
275	M	28.6	Very low	29	Very low	162 Å²	162	125.7 Å²	125.7	80%	0.798	77%	0.768	S	S	*	*			trans	-105.3	168.8	-167.3	-54.6	157.3	55.4	0	0	115.6
276	S	27.1	Very low	29	Very low	104 Å²	104	128 Å²	128	73%	0.727	77%	0.766	S	S	*	*			trans	79	131.3	141.6	-157.6	0	0	0	0	120.9
277	L	25.9	Very low	28.9	Very low	153 Å²	153	131.1 Å²	131.1	80%	0.801	76%	0.764	S	S	*	*				163.5	130.4	103.9	-165.3	71	0	0	0	114.9
278	V	26.9	Very low	29.1	Very low	122 Å²	122	137.2 Å²	137.2	74%	0.739	77%	0.77	S	S	*	*			trans	-17	141.1	161.2	-172.2	0	0	0	0	120.7
279	S	29.9	Very low	29.4	Very low	97 Å²	97	136.7 Å²	136.7	68%	0.678	76%	0.764	S	S	*	*				169.6	138.5	123	-77.2	0	0	0	0	118.3
280	I	28.2	Very low	29.3	Very low	159 Å²	159	141.7 Å²	141.7	82%	0.815	77%	0.774	S	S	*	*			trans	57.4	132.2	145.5	-59	162.9	0	0	0	118.6
281	G	27.6	Very low	29.3	Very low	73 Å²	73	141.6 Å²	141.6	75%	0.753	77%	0.767	S	S	*	*			cis	-160.5	-141.4	2.9	0	0	0	0	0	109.8
282	E	26.7	Very low	29.2	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	77%	0.767	S	S	*	*			cis	-168.8	149.6	-9.7	-161.8	152.4	100.6	0	0	111.1
283	E	26.5	Very low	29.2	Very low	179 Å²	179	144.9 Å²	144.9	84%	0.836	77%	0.766	S	S	*	*			trans	51	157	166.6	-88.7	-57.8	144.6	0	0	123.5
284	G	27.9	Very low	29.3	Very low	66 Å²	66	146.1 Å²	146.1	68%	0.68	77%	0.765	S	S	*	*			trans	148.9	13.4	164.3	0	0	0	0	0	124.9
285	L	27.7	Very low	28.6	Very low	142 Å²	142	145.1 Å²	145.1	74%	0.743	75%	0.753	S	S	*	*			trans	46.5	110.3	149.2	-157.5	75.1	0	0	0	124.3
286	L	29.8	Very low	28.7	Very low	142 Å²	142	147.9 Å²	147.9	74%	0.743	76%	0.755	S	S	*	*			trans	32.3	129.5	140.7	-51.9	170.9	0	0	0	123.6
287	K	28.6	Very low	28.8	Very low	193 Å²	193	146.2 Å²	146.2	84%	0.839	75%	0.753	S	S	*	*				171	143.3	109.5	-92	156.5	-169.3	168.7	0	116.7
288	K	31.8	Very low	29.2	Very low	199 Å²	199	148.6 Å²	148.6	87%	0.865	76%	0.757	S	S	*	*			trans	-93	165.1	153.7	-76.3	179.3	178.8	175.3	0	107.8
289	P	36.3	Very low	29.3	Very low	116 Å²	116	150 Å²	150	75%	0.753	76%	0.756	S	S	*	*			cis	-160.2	173.8	42.9	47	-24.9	0	0	0	120.9
290	K	26.7	Very low	29.3	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	76%	0.76	S	S	*	*			trans	34.6	131	131	-167.9	-172.7	-177.9	178.2	0	121.1
291	K	26.9	Very low	29.3	Very low	154 Å²	154	147.9 Å²	147.9	67%	0.67	76%	0.755	S	S	*	*				160.1	126.3	108.6	-171.9	172.6	176.9	-174.8	0	117.2
292	E	26.9	Very low	29.4	Very low	147 Å²	147	154.5 Å²	154.5	69%	0.687	76%	0.763	S	S	*	*			trans	59.6	170.5	157.2	-69.3	167.2	-160.6	0	0	118.3
293	R	30.5	Very low	29.5	Very low	212 Å²	212	155.1 Å²	155.1	80%	0.8	77%	0.766	S	S	*	*			cis	-152.8	127.7	15.3	-162.1	158.5	162.8	155.1	-9.1	109.5
294	K	30.6	Very low	29.4	Very low	163 Å²	163	155.6 Å²	155.6	71%	0.709	77%	0.768	S	S	*	*				48.3	132	98.5	-177.7	-179.9	175.6	178.8	0	114.3
295	D	29.8	Very low	29.6	Very low	98 Å²	98	162 Å²	162	52%	0.524	78%	0.777	S	S	.	*			cis	-159.4	168.6	43.1	-142.6	-4.1	0	0	0	115.1
296	R	30.7	Very low	29.8	Very low	221 Å²	221	161 Å²	161	83%	0.834	78%	0.779	S	S	*	*			trans	37.4	147	151.3	-70.5	156	-172.8	-170.6	-3.9	122.6
297	G	29.5	Very low	29.8	Very low	68 Å²	68	163.1 Å²	163.1	70%	0.701	78%	0.783	S	S	*	*			cis	149.9	174.2	-2.1	0	0	0	0	0	113.6
298	K	34.4	Very low	29.9	Very low	203 Å²	203	162.6 Å²	162.6	88%	0.883	78%	0.78	S	S	*	*			trans	74.4	155.9	-179.8	-64.3	-174.4	174.4	-170.9	0	117.2
299	E	28.5	Very low	29.6	Very low	152 Å²	152	160.9 Å²	160.9	71%	0.71	78%	0.777	S	S	*	*			cis	-164.7	169.7	-38.2	-146.1	-165.8	107.3	0	0	109.7
300	N	29.1	Very low	29.4	Very low	143 Å²	143	160.7 Å²	160.7	77%	0.765	78%	0.779	S	S	*	*			trans	-19.1	147.7	170	-59	-45	0	0	0	119
301	G	28.9	Very low	29.8	Very low	69 Å²	69	161 Å²	161	71%	0.711	78%	0.78	S	S	*	*			cis	132.2	147.1	3	0	0	0	0	0	112.9
302	K	30	Very low	30.5	Very low	211 Å²	211	163.7 Å²	163.7	92%	0.917	79%	0.792	S	S	*	*			trans	-177.1	167.3	159.3	-109.1	171.1	-174.6	-172.5	0	114.3
303	E	27.9	Very low	30.9	Very low	184 Å²	184	167.8 Å²	167.8	86%	0.86	80%	0.801	S	S	*	*			trans	-71.6	165.4	178.8	-66.8	162	107.6	0	0	112.3
304	E	25.7	Very low	30.8	Very low	188 Å²	188	167.3 Å²	167.3	88%	0.879	81%	0.805	S	S	*	*			cis	-147.5	173.2	46	-69.3	-170.3	108.8	0	0	115.8
305	F	30.1	Very low	31.1	Very low	200 Å²	200	167.6 Å²	167.6	88%	0.877	81%	0.813	S	S	*	*			trans	-89	145.6	165.2	-91.8	-90.1	0	0	0	112
306	P	32.8	Very low	31.2	Very low	121 Å²	121	167.3 Å²	167.3	79%	0.786	82%	0.824	S	S	*	*				-142.5	122.6	116.9	31.8	-15.9	0	0	0	116.3
307	K	30.4	Very low	31.5	Very low	187 Å²	187	164.3 Å²	164.3	81%	0.813	83%	0.825	S	S	*	*				29.3	103.2	125.9	-75.1	175.8	177.5	167.7	0	118.8
308	K	29.2	Very low	32.2	Very low	182 Å²	182	164 Å²	164	79%	0.791	82%	0.821	S	S	*	*				156.3	163.3	106.8	-86.2	168	176.6	-179.4	0	114.9
309	M	25.9	Very low	32.9	Very low	163 Å²	163	158.6 Å²	158.6	80%	0.803	81%	0.81	S	S	*	*			trans	82.2	135.4	155.6	-45.4	-150.8	-170.8	0	0	120.7
310	S	33.8	Very low	34.2	Very low	112 Å²	112	159.6 Å²	159.6	78%	0.783	81%	0.807	S	S	*	*			trans	55.5	85	142.3	-57	0	0	0	0	120.3
311	K	33.4	Very low	36.3	Very low	204 Å²	204	157.4 Å²	157.4	89%	0.887	79%	0.788	S	S	*	*				-147.7	118.6	122.7	-115.9	159.4	-171.7	170.1	0	111.9	R313	K311-R313 VanDerWaalsContact C-N 3.33Å; K311-R313 PolarHBondContact O-N 3.27Å
312	K	43.2	Very low	38.6	Very low	210 Å²	210	157.7 Å²	157.7	91%	0.913	77%	0.773	S	S	*	*			trans	-59.9	90.6	171.3	-179.4	178.3	-179	177	0	108.2	K314	K312-K314 PolarHBondContact O-N 3.04Å
313	R	35	Very low	41.1	Very low	232 Å²	232	148 Å²	148	88%	0.875	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-59.8	124.7	175	-63.8	-172.4	-172.7	-175.2	2.9	106.9	K311 L315	K311-R313 VanDerWaalsContact C-N 3.33Å; K311-R313 PolarHBondContact O-N 3.27Å; R313-L315 PolarHBondContact O-N 3.14Å
314	K	28.6	Very low	43.5	Very low	202 Å²	202	142.1 Å²	142.1	88%	0.878	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-50.8	140.6	168.3	-72.5	-177.1	172	-174.9	0	107.6	K312 A316	K312-K314 PolarHBondContact O-N 3.04Å; K314-A316 PolarHBondContact O-N 2.8Å
315	L	35.3	Very low	46	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-54.1	128.2	155.6	-103.7	66.9	0	0	0	106.2	R313	R313-L315 PolarHBondContact O-N 3.14Å
316	A	32.6	Very low	48.7	Very low	92 Å²	92	129 Å²	129	76%	0.76	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-58.6	144.3	163.9	0	0	0	0	0	107.7	K314 G318	K314-A316 PolarHBondContact O-N 2.8Å; A316-G318 PolarHBondContact O-N 3.33Å
317	D	37.8	Very low	51.1	Low	159 Å²	159	127.6 Å²	127.6	85%	0.85	64%	0.643	S	S	*	*			trans	-59.6	105.1	-170.7	-172.8	24	0	0	0	111	S319	D317-S319 VanDerWaalsContact C-N 3.33Å; D317-S319 PolarHBondContact O-N 3.06Å
318	G	43.6	Very low	53.8	Low	60 Å²	60	123.4 Å²	123.4	62%	0.619	63%	0.629	S	S	*	*			trans	-82.5	83.1	-178.6	0	0	0	0	0	108.6	A316 R320	A316-G318 PolarHBondContact O-N 3.33Å; G318-R320 PolarHBondContact O-N 3.49Å
319	S	48.3	Very low	56.3	Low	91 Å²	91	117 Å²	117	64%	0.636	60%	0.603	S	S	*	*			trans	-50	111.8	-176.9	50.1	0	0	0	0	110.9	D317 R321	D317-S319 VanDerWaalsContact C-N 3.33Å; D317-S319 PolarHBondContact O-N 3.06Å; S319-R321 PolarHBondContact O-N 3.42Å
320	R	56.6	Low	58.9	Low	173 Å²	173	115.9 Å²	115.9	65%	0.653	61%	0.612	S	S	*	*			trans	-65.4	105.4	-173.2	-69.9	161.3	176.3	-120.8	9.4	108.6	G318 L322 E476	G318-R320 PolarHBondContact O-N 3.49Å; R320-L322 PolarHBondContact O-N 2.86Å; R320-L322 VanDerWaalsContact O-N 3.12Å; R320-E476 VanDerWaalsContact CD-OE2 3.25Å; R320-E476 WeakPolarHBondContact CD-OE2 3.37Å; R320-E476 IonicContact CZ-OE1 3.68Å; R320-E476 IonicContact CZ-OE2 3.21Å; R320-E476 IonicContact NE-OE2 2.74Å; R320-E476 VanDerWaalsContact NH1-CD 3.33Å; R320-E476 IonicContact NH1-OE1 2.69Å; R320-E476 PolarHBondContact NH1-OE1 2.97Å; R320-E476 IonicContact NH1-OE2 3.9Å; R320-E476 PolarHBondContact NH1-OE2 3.3Å
321	R	73.4	Confident	61.1	Low	96 Å²	96	114.3 Å²	114.3	36%	0.362	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.2	106.5	178.9	-73.5	-168.9	173	-150	-15.7	109	S319 P452 F475 E476	S319-R321 PolarHBondContact O-N 3.42Å; R321-P452 HydrophobicContact CB-CB 4.27Å; R321-P452 HydrophobicContact CB-CG 4.49Å; R321-F475 HydrophobicContact CB-CD1 3.5Å; R321-F475 HydrophobicContact CB-CE1 3.62Å; R321-F475 HydrophobicContact CG-CE1 4.32Å; R321-F475 WeakPolarHBondContact O-CA 3.47Å; R321-E476 PolarHBondContact O-N 3.21Å; R321-E476 VanDerWaalsContact O-N 3.12Å
322	L	78.1	Confident	63.3	Low	76 Å²	76	106.9 Å²	106.9	40%	0.398	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.8	138.2	174.3	-70.4	174	0	0	0	110.5	R320 P452 E476 C478	R320-L322 PolarHBondContact O-N 2.86Å; R320-L322 VanDerWaalsContact O-N 3.12Å; L322-P452 WeakPolarHBondContact O-CB 3.46Å; L322-E476 CarbonylContact C-O 3.59Å; L322-E476 WeakPolarHBondContact CA-O 3.37Å; L322-C478 HydrophobicContact CD2-CB 4.46Å
323	V	82.1	Confident	65.2	Low	8 Å²	8	104.4 Å²	104.4	5%	0.048	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.3	131.2	176.6	166.4	0	0	0	0	109.2	P452 T453 N456 F475 E476 C478	V323-P452 HydrophobicContact CG2-CB 4.24Å; V323-T453 HydrophobicContact CG1-CG2 4.16Å; V323-N456 HydrophobicContact CG2-CB 4.02Å; V323-F475 HydrophobicContact CG2-CB 3.69Å; V323-F475 HydrophobicContact CG2-CD1 3.63Å; V323-F475 HydrophobicContact CG2-CG 3.89Å; V323-E476 PolarHBondContact N-O 3.17Å; V323-C478 PolarHBondContact O-N 2.98Å
324	Q	77.3	Confident	67.7	Low	60 Å²	60	94.9 Å²	94.9	28%	0.28	54%	0.535	S	S	.	.			trans	-70.7	137.3	172	-70.6	176.7	-17.9	0	0	109.9	I326 T453	Q324-I326 PolarHBondContact O-N 3.1Å; Q324-T453 PolarHBondContact N-OG1 3.19Å
325	P	79.3	Confident	70.7	Confident	76 Å²	76	88.4 Å²	88.4	49%	0.494	51%	0.512	S	S	.	.			trans	-59	133.5	168.6	-21.4	33	0	0	0	110.8	V477	P325-V477 HydrophobicContact CG-CG1 4.17Å
326	I	85.6	Confident	73.4	Confident	37 Å²	37	84.1 Å²	84.1	19%	0.19	49%	0.487	C	S	.	.			trans	-114.2	156.3	175.7	65.8	-179	0	0	0	110.5	Q324 L328 P334 I338 T453 L457	Q324-I326 PolarHBondContact O-N 3.1Å; I326-L328 HydrophobicContact CD1-CD2 4.13Å; I326-L328 HydrophobicContact CG1-CD2 3.95Å; I326-L328 PolarHBondContact O-N 3.07Å; I326-P334 HydrophobicContact CD1-CB 3.88Å; I326-P334 HydrophobicContact CD1-CG 4Å; I326-I338 HydrophobicContact CD1-CD1 4.36Å; I326-I338 HydrophobicContact CG2-CG2 4.07Å; I326-T453 HydrophobicContact CG2-CG2 3.48Å; I326-T453 VanDerWaalsContact CG2-CG2 3.48Å; I326-L457 HydrophobicContact CD1-CD1 3.63Å; I326-L457 HydrophobicContact CD1-CD2 3.72Å; I326-L457 HydrophobicContact CD1-CG 4.18Å
327	P	83.3	Confident	76.4	Confident	91 Å²	91	83.4 Å²	83.4	59%	0.591	47%	0.474	S	S	*	.			trans	-63	133.8	168.4	-18.1	31.8	0	0	0	111.1	V335	P327-V335 HydrophobicContact CB-CB 4.19Å; P327-V335 HydrophobicContact CB-CG2 4.2Å; P327-V335 PolarHBondContact O-N 3.07Å
328	L	86.8	Confident	79	Confident	99 Å²	99	76.1 Å²	76.1	52%	0.518	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-115.1	145.7	172.4	-58.5	179.8	0	0	0	109.8	I326 R333 P334	I326-L328 HydrophobicContact CD1-CD2 4.13Å; I326-L328 HydrophobicContact CG1-CD2 3.95Å; I326-L328 PolarHBondContact O-N 3.07Å; L328-R333 CarbonylContact C-O 3.38Å; L328-R333 VanDerWaalsContact CA-O 3.25Å; L328-R333 WeakPolarHBondContact CA-O 3.47Å; L328-P334 HydrophobicContact CD2-CG 4.48Å
329	D	82.6	Confident	81.4	Confident	46 Å²	46	77.9 Å²	77.9	25%	0.246	43%	0.434	C	S	.	.			trans	-72.3	174.7	172.5	79.2	1.5	0	0	0	111.9	S331 G332 R333 V335	D329-S331 PolarHBondContact O-N 2.87Å; D329-S331 VanDerWaalsContact OD1-C 3.29Å; D329-S331 VanDerWaalsContact OD1-CA 3.25Å; D329-S331 WeakPolarHBondContact OD1-CA 3.41Å; D329-S331 WeakPolarHBondContact OD1-CB 3.39Å; D329-S331 PolarHBondContact OD1-N 3.35Å; D329-S331 PolarHBondContact OD1-OG 2.9Å; D329-S331 PolarHBondContact OD2-OG 2.66Å; D329-G332 PolarHBondContact O-N 2.78Å; D329-G332 PolarHBondContact OD1-N 2.93Å; D329-R333 PolarHBondContact N-O 3.28Å; D329-R333 PolarHBondContact OD1-N 3.44Å; D329-R333 IonicContact OD1-NE 3.75Å; D329-R333 IonicContact OD2-CZ 3.57Å; D329-R333 IonicContact OD2-NE 2.6Å; D329-R333 PolarHBondContact OD2-NE 3.37Å; D329-R333 VanDerWaalsContact OD2-NE 3.08Å; D329-R333 IonicContact OD2-NH2 3.24Å; D329-R333 PolarHBondContact OD2-NH2 2.94Å; D329-V335 HydrophobicContact CB-CG2 4.27Å
330	S	81.1	Confident	83.4	Confident	141 Å²	141	73.9 Å²	73.9	99%	0.986	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-6.1	178.1	54.9	0	0	0	0	114.8
331	S	79.3	Confident	84.8	Confident	78 Å²	78	67.9 Å²	67.9	55%	0.545	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	1.6	171.7	73.3	0	0	0	0	113.6	D329 R333	D329-S331 PolarHBondContact O-N 2.87Å; D329-S331 VanDerWaalsContact OD1-C 3.29Å; D329-S331 VanDerWaalsContact OD1-CA 3.25Å; D329-S331 WeakPolarHBondContact OD1-CA 3.41Å; D329-S331 WeakPolarHBondContact OD1-CB 3.39Å; D329-S331 PolarHBondContact OD1-N 3.35Å; D329-S331 PolarHBondContact OD1-OG 2.9Å; D329-S331 PolarHBondContact OD2-OG 2.66Å; S331-R333 PolarHBondContact OG-NE 2.96Å
332	G	78.6	Confident	85.5	Confident	48 Å²	48	64.9 Å²	64.9	50%	0.495	40%	0.397	S	S	.	.	S	Bend	trans	81.6	15.7	-179.6	0	0	0	0	0	114.9	D329	D329-G332 PolarHBondContact O-N 2.78Å; D329-G332 PolarHBondContact OD1-N 2.93Å
333	R	83.3	Confident	86.2	Confident	159 Å²	159	61.3 Å²	61.3	60%	0.6	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-93.8	150.6	177.5	-61	177.8	-59.8	160.5	9.3	111	L328 D329 S331 V335	L328-R333 CarbonylContact C-O 3.38Å; L328-R333 VanDerWaalsContact CA-O 3.25Å; L328-R333 WeakPolarHBondContact CA-O 3.47Å; D329-R333 PolarHBondContact N-O 3.28Å; D329-R333 PolarHBondContact OD1-N 3.44Å; D329-R333 IonicContact OD1-NE 3.75Å; D329-R333 IonicContact OD2-CZ 3.57Å; D329-R333 IonicContact OD2-NE 2.6Å; D329-R333 PolarHBondContact OD2-NE 3.37Å; D329-R333 VanDerWaalsContact OD2-NE 3.08Å; D329-R333 IonicContact OD2-NH2 3.24Å; D329-R333 PolarHBondContact OD2-NH2 2.94Å; S331-R333 PolarHBondContact OG-NE 2.96Å; R333-V335 PolarHBondContact O-N 2.96Å
334	P	88.3	Confident	86.9	Confident	32 Å²	32	62.1 Å²	62.1	21%	0.208	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-55.7	135	174.8	-25	35	0	0	0	112.8	I326 L328 F336 I338 L457	I326-P334 HydrophobicContact CD1-CB 3.88Å; I326-P334 HydrophobicContact CD1-CG 4Å; L328-P334 HydrophobicContact CD2-CG 4.48Å; P334-F336 HydrophobicContact CB-CE2 4.12Å; P334-F336 HydrophobicContact CB-CZ 4.05Å; P334-I338 HydrophobicContact CB-CD1 3.99Å; P334-L457 HydrophobicContact CB-CD1 4.3Å; P334-L457 HydrophobicContact CG-CD1 3.99Å; P334-L457 HydrophobicContact CG-CD2 3.71Å; P334-L457 HydrophobicContact CG-CG 4.39Å
335	V	91.4	Very high	87.9	Confident	65 Å²	65	59.3 Å²	59.3	39%	0.394	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-83.4	134.9	166.8	-175.4	0	0	0	0	108.6	P327 D329 R333 I338	P327-V335 HydrophobicContact CB-CB 4.19Å; P327-V335 HydrophobicContact CB-CG2 4.2Å; P327-V335 PolarHBondContact O-N 3.07Å; D329-V335 HydrophobicContact CB-CG2 4.27Å; R333-V335 PolarHBondContact O-N 2.96Å; V335-I338 VanDerWaalsContact O-CG1 3.31Å; V335-I338 WeakPolarHBondContact O-CG1 3.28Å
336	F	92.3	Very high	88.7	Confident	80 Å²	80	60.6 Å²	60.6	35%	0.351	37%	0.365	S	S	.	.	S	Bend	trans	-108	149.1	175.3	-63.3	-83.6	0	0	0	110.3	P334 I338 V345 Y346 L348	P334-F336 HydrophobicContact CB-CE2 4.12Å; P334-F336 HydrophobicContact CB-CZ 4.05Å; F336-I338 HydrophobicContact CD1-CD1 4.01Å; F336-I338 HydrophobicContact CD1-CG1 3.89Å; F336-I338 HydrophobicContact CE1-CD1 3.62Å; F336-I338 HydrophobicContact CE1-CG1 4.05Å; F336-I338 HydrophobicContact CZ-CD1 4.26Å; F336-V345 HydrophobicContact CE1-CG1 4.46Å; F336-Y346 WeakPolarHBondContact CD1-O 3.38Å; F336-Y346 WeakPolarHBondContact CG-O 3.44Å; F336-L348 HydrophobicContact CE1-CD1 4.39Å; F336-L348 HydrophobicContact CE1-CG 3.92Å; F336-L348 HydrophobicContact CZ-CD1 3.83Å; F336-L348 HydrophobicContact CZ-CG 3.73Å
337	P	94.9	Very high	89.3	Confident	76 Å²	76	60.8 Å²	60.8	49%	0.494	37%	0.37	S	S	.	.	S	Bend	cis	-76.3	147.2	-0.2	31.3	-35	0	0	0	113.6	T344 V345 Y346	P337-T344 HydrophobicContact CB-CG2 3.62Å; P337-V345 CarbonylContact C-O 3.54Å; P337-V345 VanDerWaalsContact CA-O 3.27Å; P337-V345 WeakPolarHBondContact CA-O 3.49Å; P337-Y346 HydrophobicContact CB-CD1 4Å; P337-Y346 HydrophobicContact CB-CE1 4.09Å
338	I	93.7	Very high	89.9	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	110.4	173.8	-53.3	173.7	0	0	0	107.8	I326 P334 V335 F336 L340 T344 V345 I454 L457	I326-I338 HydrophobicContact CD1-CD1 4.36Å; I326-I338 HydrophobicContact CG2-CG2 4.07Å; P334-I338 HydrophobicContact CB-CD1 3.99Å; V335-I338 VanDerWaalsContact O-CG1 3.31Å; V335-I338 WeakPolarHBondContact O-CG1 3.28Å; F336-I338 HydrophobicContact CD1-CD1 4.01Å; F336-I338 HydrophobicContact CD1-CG1 3.89Å; F336-I338 HydrophobicContact CE1-CD1 3.62Å; F336-I338 HydrophobicContact CE1-CG1 4.05Å; F336-I338 HydrophobicContact CZ-CD1 4.26Å; I338-L340 HydrophobicContact CG2-CD1 4.28Å; I338-L340 HydrophobicContact CG2-CD2 4.3Å; I338-L340 HydrophobicContact CG2-CG 4.12Å; I338-T344 CarbonylContact O-C 3.53Å; I338-T344 WeakPolarHBondContact O-CA 3.41Å; I338-V345 HydrophobicContact CB-CB 4.47Å; I338-V345 PolarHBondContact N-O 3.44Å; I338-V345 PolarHBondContact O-N 2.86Å; I338-I454 HydrophobicContact CD1-CD1 4.36Å; I338-I454 HydrophobicContact CG2-CD1 4.34Å; I338-L457 HydrophobicContact CD1-CD1 3.55Å
339	V	92.9	Very high	90.3	Very high	96 Å²	96	53.4 Å²	53.4	58%	0.582	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.3	-179.6	-175.4	0	0	0	0	110.1	T344	V339-T344 HydrophobicContact CG2-CG2 4.11Å
340	L	89.6	Confident	91	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.037	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	71	-171.9	-63.2	171.8	0	0	0	109.5	I338 L343 I454	I338-L340 HydrophobicContact CG2-CD1 4.28Å; I338-L340 HydrophobicContact CG2-CD2 4.3Å; I338-L340 HydrophobicContact CG2-CG 4.12Å; L340-L343 HydrophobicContact CB-CB 4.37Å; L340-L343 HydrophobicContact CB-CD2 4.37Å; L340-L343 HydrophobicContact CD1-CD2 4.16Å; L340-L343 PolarHBondContact N-O 3.48Å; L340-L343 PolarHBondContact O-N 3.22Å; L340-I454 HydrophobicContact CD1-CD1 3.64Å; L340-I454 HydrophobicContact CD1-CG1 3.58Å
341	G	87.1	Confident	91.8	Very high	47 Å²	47	52.6 Å²	52.6	49%	0.485	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	-133.6	-170.1	0	0	0	0	0	110.9	L343	G341-L343 PolarHBondContact O-N 3.16Å
342	G	87	Confident	92.6	Very high	34 Å²	34	50.1 Å²	50.1	35%	0.351	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	4.4	175.7	0	0	0	0	0	116.9	R373 V374	G342-R373 WeakPolarHBondContact O-CA 3.43Å; G342-V374 PolarHBondContact O-N 2.91Å
343	L	94.5	Very high	93.3	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.8	176.4	172.2	70	0	0	0	110.6	L340 G341 V345 H451	L340-L343 HydrophobicContact CB-CB 4.37Å; L340-L343 HydrophobicContact CB-CD2 4.37Å; L340-L343 HydrophobicContact CD1-CD2 4.16Å; L340-L343 PolarHBondContact N-O 3.48Å; L340-L343 PolarHBondContact O-N 3.22Å; G341-L343 PolarHBondContact O-N 3.16Å; L343-V345 HydrophobicContact CD1-CG2 4.4Å; L343-V345 HydrophobicContact CD2-CG2 4.41Å; L343-V345 HydrophobicContact CG-CG2 4.26Å; L343-H451 HydrophobicContact CD2-CB 4.32Å
344	T	96.3	Very high	93.8	Very high	25 Å²	25	48.2 Å²	48.2	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.6	170.1	-63.1	0	0	0	0	110.5	P337 I338 V339 Y346 S371 T372	P337-T344 HydrophobicContact CB-CG2 3.62Å; I338-T344 CarbonylContact O-C 3.53Å; I338-T344 WeakPolarHBondContact O-CA 3.41Å; V339-T344 HydrophobicContact CG2-CG2 4.11Å; T344-Y346 HydrophobicContact CG2-CD2 4.48Å; T344-Y346 HydrophobicContact CG2-CE1 4.16Å; T344-Y346 HydrophobicContact CG2-CE2 3.79Å; T344-S371 CarbonylContact O-C 3.59Å; T344-S371 WeakPolarHBondContact O-CA 3.3Å; T344-S371 WeakPolarHBondContact O-CB 3.36Å; T344-T372 PolarHBondContact N-O 2.96Å; T344-T372 PolarHBondContact O-N 2.96Å
345	V	97.8	Very high	94	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.7	179.6	-175.4	0	0	0	0	110.4	F336 P337 I338 L343 L348 F369 I454	F336-V345 HydrophobicContact CE1-CG1 4.46Å; P337-V345 CarbonylContact C-O 3.54Å; P337-V345 VanDerWaalsContact CA-O 3.27Å; P337-V345 WeakPolarHBondContact CA-O 3.49Å; I338-V345 HydrophobicContact CB-CB 4.47Å; I338-V345 PolarHBondContact N-O 3.44Å; I338-V345 PolarHBondContact O-N 2.86Å; L343-V345 HydrophobicContact CD1-CG2 4.4Å; L343-V345 HydrophobicContact CD2-CG2 4.41Å; L343-V345 HydrophobicContact CG-CG2 4.26Å; V345-L348 HydrophobicContact CG1-CD2 4.35Å; V345-F369 HydrophobicContact CG1-CE2 4.24Å; V345-F369 HydrophobicContact CG1-CZ 4.35Å; V345-I454 HydrophobicContact CB-CD1 4.11Å; V345-I454 HydrophobicContact CG1-CD1 4.41Å; V345-I454 HydrophobicContact CG2-CD1 3.67Å; V345-I454 HydrophobicContact CG2-CG1 3.98Å
346	Y	96.4	Very high	94.1	Very high	104 Å²	104	50 Å²	50	41%	0.408	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-26.8	-177.6	-56.7	-95.5	0	0	0	112.7	F336 P337 T344 C370 T372	F336-Y346 WeakPolarHBondContact CD1-O 3.38Å; F336-Y346 WeakPolarHBondContact CG-O 3.44Å; P337-Y346 HydrophobicContact CB-CD1 4Å; P337-Y346 HydrophobicContact CB-CE1 4.09Å; T344-Y346 HydrophobicContact CG2-CD2 4.48Å; T344-Y346 HydrophobicContact CG2-CE1 4.16Å; T344-Y346 HydrophobicContact CG2-CE2 3.79Å; Y346-C370 PolarHBondContact N-O 3.17Å; Y346-T372 HydrophobicContact CE2-CG2 3.61Å; Y346-T372 WeakPolarHBondContact CE2-OG1 3.21Å; Y346-T372 PolarHBondContact OH-OG1 3.5Å; Y346-T372 VanDerWaalsContact OH-OG1 3.12Å
347	S	97.1	Very high	94.2	Very high	41 Å²	41	51.3 Å²	51.3	29%	0.287	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	138.7	178.7	172.4	0	0	0	0	110.3	G349 G368 F369 C370	S347-G349 PolarHBondContact OG-N 3.04Å; S347-G368 VanDerWaalsContact CB-O 3.27Å; S347-G368 WeakPolarHBondContact CB-O 3.35Å; S347-G368 PolarHBondContact OG-O 3.42Å; S347-F369 WeakPolarHBondContact O-CA 3.41Å; S347-C370 PolarHBondContact N-O 2.89Å; S347-C370 PolarHBondContact O-N 3.41Å
348	L	96.3	Very high	94.2	Very high	14 Å²	14	47.8 Å²	47.8	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-13.5	170.3	-64.8	170.7	0	0	0	113.1	F336 V345 P366 F369 I454 L457 I458	F336-L348 HydrophobicContact CE1-CD1 4.39Å; F336-L348 HydrophobicContact CE1-CG 3.92Å; F336-L348 HydrophobicContact CZ-CD1 3.83Å; F336-L348 HydrophobicContact CZ-CG 3.73Å; V345-L348 HydrophobicContact CG1-CD2 4.35Å; L348-P366 WeakPolarHBondContact O-CB 3.3Å; L348-P366 VanDerWaalsContact O-CG 3.29Å; L348-P366 WeakPolarHBondContact O-CG 3.47Å; L348-F369 HydrophobicContact CD2-CE2 4.36Å; L348-I454 HydrophobicContact CD2-CG2 3.86Å; L348-L457 HydrophobicContact CD1-CB 3.59Å; L348-L457 HydrophobicContact CD1-CD1 4.11Å; L348-L457 HydrophobicContact CD1-CG 4.45Å; L348-L457 HydrophobicContact CD2-CB 4.24Å; L348-I458 HydrophobicContact CD2-CG1 4.12Å
349	G	96.5	Very high	94.3	Very high	21 Å²	21	48.4 Å²	48.4	22%	0.216	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.9	-173.3	-175.7	0	0	0	0	0	115.3	S347 V367 G368	S347-G349 PolarHBondContact OG-N 3.04Å; G349-V367 CarbonylContact C-O 3.55Å; G349-V367 WeakPolarHBondContact CA-O 3.35Å; G349-G368 VanDerWaalsContact CA-C 3.43Å
350	E	96.9	Very high	94.4	Very high	150 Å²	150	46.7 Å²	46.7	70%	0.701	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.5	179.1	-61.8	-169	164.4	0	0	111.2	I352 P366 V367	E350-I352 PolarHBondContact O-N 3.22Å; E350-P366 CarbonylContact O-C 3.39Å; E350-P366 VanDerWaalsContact O-CA 3.23Å; E350-P366 WeakPolarHBondContact O-CA 3.38Å; E350-P366 WeakPolarHBondContact O-CB 3.42Å; E350-V367 PolarHBondContact N-O 3.04Å; E350-V367 PolarHBondContact O-N 2.69Å
351	I	97.3	Very high	94.6	Very high	19 Å²	19	52.6 Å²	52.6	10%	0.097	29%	0.294	C	S	.	.			trans	-79.1	113.9	-179	-62	178.2	0	0	0	109.9	T353 I364 P366 I458 C461 A464	I351-T353 HydrophobicContact CG2-CG2 3.82Å; I351-T353 PolarHBondContact O-N 2.96Å; I351-I364 HydrophobicContact CB-CG2 4.44Å; I351-I364 HydrophobicContact CD1-CD1 4.44Å; I351-I364 HydrophobicContact CD1-CG2 4.08Å; I351-I364 HydrophobicContact CG1-CG2 3.95Å; I351-I364 HydrophobicContact CG2-CG2 3.77Å; I351-P366 HydrophobicContact CG1-CB 4.26Å; I351-P366 HydrophobicContact CG1-CG 4.19Å; I351-I458 HydrophobicContact CD1-CG2 4.31Å; I351-I458 WeakPolarHBondContact CD1-O 3.24Å; I351-C461 HydrophobicContact CD1-CB 3.68Å; I351-C461 HydrophobicContact CG1-CB 4.29Å; I351-A464 HydrophobicContact CD1-CB 3.73Å
352	I	96.4	Very high	94.9	Very high	27 Å²	27	54 Å²	54	14%	0.138	30%	0.295	C	S	.	.			trans	-75.9	117.6	174.4	-57.4	-53.3	0	0	0	109.4	E350 D354 R355 F358 V367	E350-I352 PolarHBondContact O-N 3.22Å; I352-D354 WeakPolarHBondContact CG2-OD1 3.31Å; I352-R355 HydrophobicContact CG2-CB 4.35Å; I352-F358 HydrophobicContact CB-CB 3.8Å; I352-F358 HydrophobicContact CB-CD1 3.89Å; I352-F358 HydrophobicContact CB-CD2 4.07Å; I352-F358 HydrophobicContact CB-CE1 4.49Å; I352-F358 HydrophobicContact CB-CG 3.65Å; I352-F358 HydrophobicContact CG1-CD1 3.86Å; I352-F358 HydrophobicContact CG1-CE1 4.14Å; I352-F358 HydrophobicContact CG1-CG 4.16Å; I352-F358 HydrophobicContact CG2-CB 4.14Å; I352-F358 HydrophobicContact CG2-CD1 4.23Å; I352-F358 HydrophobicContact CG2-CD2 3.58Å; I352-F358 HydrophobicContact CG2-CE2 3.97Å; I352-F358 HydrophobicContact CG2-CG 3.71Å; I352-F358 HydrophobicContact CG2-CZ 4.45Å; I352-V367 HydrophobicContact CD1-CB 4.19Å; I352-V367 HydrophobicContact CD1-CG2 4.03Å; I352-V367 HydrophobicContact CG1-CB 4.06Å; I352-V367 HydrophobicContact CG1-CG2 3.49Å; I352-V367 VanDerWaalsContact CG1-CG2 3.49Å
353	T	94.3	Very high	95.3	Very high	43 Å²	43	52.8 Å²	52.8	26%	0.264	28%	0.282	S	S	.	.			trans	-118.5	0.2	-174.9	67.3	0	0	0	0	114.6	I351 G463 K466	I351-T353 HydrophobicContact CG2-CG2 3.82Å; I351-T353 PolarHBondContact O-N 2.96Å; T353-G463 WeakPolarHBondContact CG2-O 3.32Å; T353-K466 HydrophobicContact CG2-CB 3.91Å; T353-K466 HydrophobicContact CG2-CD 3.96Å; T353-K466 HydrophobicContact CG2-CG 4.4Å; T353-K466 WeakPolarHBondContact OG1-CD 3.41Å; T353-K466 PolarHBondContact OG1-NZ 2.76Å
354	D	92.6	Very high	95.4	Very high	124 Å²	124	53 Å²	53	66%	0.663	28%	0.282	S	S	*	.	S	Bend	trans	-85.6	-26.6	176.1	60.4	-4.9	0	0	0	112.5	I352	I352-D354 WeakPolarHBondContact CG2-OD1 3.31Å
355	R	93.5	Very high	95.5	Very high	62 Å²	62	53.5 Å²	53.5	23%	0.234	28%	0.282	C	S	.	.	S	Bend	trans	-120.3	124.8	-175.5	-70.5	164.8	-73.4	164.5	-2	110.4	I352 L357 F358 D393 G395	I352-R355 HydrophobicContact CG2-CB 4.35Å; R355-L357 PolarHBondContact O-N 3.28Å; R355-F358 HydrophobicContact CB-CD2 3.76Å; R355-F358 HydrophobicContact CB-CE2 3.98Å; R355-D393 IonicContact CZ-OD1 3.01Å; R355-D393 IonicContact CZ-OD2 2.92Å; R355-D393 VanDerWaalsContact NH1-CG 3.26Å; R355-D393 IonicContact NH1-OD1 3.95Å; R355-D393 PolarHBondContact NH1-OD1 3.46Å; R355-D393 IonicContact NH1-OD2 3.39Å; R355-D393 PolarHBondContact NH1-OD2 3.07Å; R355-D393 IonicContact NH2-OD1 2.69Å; R355-D393 IonicContact NH2-OD2 3.84Å; R355-D393 PolarHBondContact NH2-OD2 2.8Å; R355-G395 WeakPolarHBondContact CD-O 3.39Å; R355-G395 PolarHBondContact NH1-O 3.2Å
356	S	91.9	Very high	95.5	Very high	73 Å²	73	53.5 Å²	53.5	51%	0.51	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-73.8	-5.3	-174.2	52.1	0	0	0	0	115.4
357	L	94.7	Very high	95.6	Very high	107 Å²	107	50.2 Å²	50.2	56%	0.56	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-88.7	-4.8	178.6	-60.3	-177.7	0	0	0	113.8	R355 Y359 P398	R355-L357 PolarHBondContact O-N 3.28Å; L357-Y359 VanDerWaalsContact C-N 3.28Å; L357-P398 WeakPolarHBondContact O-CD 3.46Å
358	F	96.3	Very high	95.6	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-88.3	10.3	176.2	-71.9	-96	0	0	0	113.6	I352 R355 Y365 V367 G397 P398	I352-F358 HydrophobicContact CB-CB 3.8Å; I352-F358 HydrophobicContact CB-CD1 3.89Å; I352-F358 HydrophobicContact CB-CD2 4.07Å; I352-F358 HydrophobicContact CB-CE1 4.49Å; I352-F358 HydrophobicContact CB-CG 3.65Å; I352-F358 HydrophobicContact CG1-CD1 3.86Å; I352-F358 HydrophobicContact CG1-CE1 4.14Å; I352-F358 HydrophobicContact CG1-CG 4.16Å; I352-F358 HydrophobicContact CG2-CB 4.14Å; I352-F358 HydrophobicContact CG2-CD1 4.23Å; I352-F358 HydrophobicContact CG2-CD2 3.58Å; I352-F358 HydrophobicContact CG2-CE2 3.97Å; I352-F358 HydrophobicContact CG2-CG 3.71Å; I352-F358 HydrophobicContact CG2-CZ 4.45Å; R355-F358 HydrophobicContact CB-CD2 3.76Å; R355-F358 HydrophobicContact CB-CE2 3.98Å; F358-Y365 PolarHBondContact O-N 3.44Å; F358-V367 HydrophobicContact CD1-CG2 3.96Å; F358-V367 HydrophobicContact CE1-CG2 3.52Å; F358-V367 HydrophobicContact CZ-CG2 4.48Å; F358-G397 VanDerWaalsContact CE2-CA 3.48Å; F358-G397 WeakPolarHBondContact CZ-O 3.18Å; F358-P398 HydrophobicContact CD1-CB 3.98Å; F358-P398 HydrophobicContact CD1-CG 4.37Å; F358-P398 HydrophobicContact CE1-CB 4.06Å
359	Y	95.6	Very high	95.7	Very high	21 Å²	21	49.5 Å²	49.5	8%	0.082	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-157.8	154.3	170.6	54.2	-90	0	0	0	110	L357 A363 C467 N469	L357-Y359 VanDerWaalsContact C-N 3.28Å; Y359-A363 WeakPolarHBondContact CA-O 3.38Å; Y359-C467 HydrophobicContact CD1-CB 3.85Å; Y359-C467 VanDerWaalsContact CD1-SG 3.51Å; Y359-C467 HydrophobicContact CD2-CB 3.7Å; Y359-C467 HydrophobicContact CE1-CB 4.14Å; Y359-C467 HydrophobicContact CE2-CB 4Å; Y359-C467 HydrophobicContact CG-CB 3.62Å; Y359-N469 HydrophobicContact CD2-CB 4.42Å; Y359-N469 HydrophobicContact CE2-CB 4.25Å
360	D	94.3	Very high	95.8	Very high	59 Å²	59	49.9 Å²	49.9	32%	0.316	27%	0.274	S	S	.	.			trans	-131.6	-165.2	170.6	62.7	35.4	0	0	0	110.3	C362 A363 Y365 Y470	D360-C362 PolarHBondContact O-N 3.3Å; D360-C362 WeakPolarHBondContact OD1-CA 3.27Å; D360-C362 WeakPolarHBondContact OD1-CB 3.4Å; D360-C362 PolarHBondContact OD1-N 2.8Å; D360-A363 PolarHBondContact N-O 3.25Å; D360-A363 PolarHBondContact OD1-N 3.03Å; D360-Y365 PolarHBondContact OD2-OH 3.27Å; D360-Y470 WeakPolarHBondContact O-CA 3.29Å
361	E	94.9	Very high	95.9	Very high	132 Å²	132	42.8 Å²	42.8	62%	0.617	24%	0.241	S	C	*	.	S	Bend	trans	-68.5	-18.6	178.9	-61	-171.9	-174.8	0	0	113.9	N469 R471	E361-N469 WeakPolarHBondContact CA-O 3.3Å; E361-R471 WeakPolarHBondContact O-CB 3.35Å; E361-R471 PolarHBondContact O-N 2.87Å
362	C	91.8	Very high	95.9	Very high	75 Å²	75	42.1 Å²	42.1	51%	0.507	24%	0.238	S	C	.	.	S	Bend	trans	-109	-34.3	-171.2	-70.6	0	0	0	0	113.2	D360 Q455	D360-C362 PolarHBondContact O-N 3.3Å; D360-C362 WeakPolarHBondContact OD1-CA 3.27Å; D360-C362 WeakPolarHBondContact OD1-CB 3.4Å; D360-C362 PolarHBondContact OD1-N 2.8Å; C362-Q455 PolarHBondContact O-NE2 3.46Å
363	A	95.8	Very high	95.9	Very high	9 Å²	9	41.5 Å²	41.5	7%	0.074	23%	0.234	C	C	.	.			trans	-142.6	160	-174.2	0	0	0	0	0	113.2	Y359 D360 Y365 F449	Y359-A363 WeakPolarHBondContact CA-O 3.38Å; D360-A363 PolarHBondContact N-O 3.25Å; D360-A363 PolarHBondContact OD1-N 3.03Å; A363-Y365 HydrophobicContact CB-CD1 4.29Å; A363-Y365 HydrophobicContact CB-CE1 3.58Å; A363-F449 HydrophobicContact CB-CD2 4.33Å; A363-F449 HydrophobicContact CB-CE2 4.16Å
364	I	97.6	Very high	95.9	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-111.5	143.7	163.1	-62.4	169.4	0	0	0	105.8	I351 P366 I458 A464 C467 Y470	I351-I364 HydrophobicContact CB-CG2 4.44Å; I351-I364 HydrophobicContact CD1-CD1 4.44Å; I351-I364 HydrophobicContact CD1-CG2 4.08Å; I351-I364 HydrophobicContact CG1-CG2 3.95Å; I351-I364 HydrophobicContact CG2-CG2 3.77Å; I364-P366 HydrophobicContact CG2-CG 4.4Å; I364-P366 WeakPolarHBondContact O-CD 3.48Å; I364-I458 HydrophobicContact CB-CG2 3.83Å; I364-I458 HydrophobicContact CD1-CG2 4.48Å; I364-I458 HydrophobicContact CG2-CG2 4.11Å; I364-A464 HydrophobicContact CD1-CB 3.92Å; I364-C467 HydrophobicContact CD1-CB 4.21Å; I364-C467 HydrophobicContact CG1-CB 4.35Å; I364-Y470 HydrophobicContact CD1-CD1 3.91Å; I364-Y470 HydrophobicContact CD1-CD2 4.2Å; I364-Y470 HydrophobicContact CD1-CE1 4.22Å; I364-Y470 HydrophobicContact CD1-CE2 4.48Å; I364-Y470 HydrophobicContact CD1-CG 3.89Å; I364-Y470 HydrophobicContact CG1-CD1 4.28Å; I364-Y470 HydrophobicContact CG1-CD2 3.65Å; I364-Y470 HydrophobicContact CG1-CE2 4.07Å; I364-Y470 HydrophobicContact CG1-CG 3.76Å
365	Y	97.8	Very high	96	Very high	36 Å²	36	36 Å²	36	14%	0.141	20%	0.204	C	C	.	.			trans	-118.9	83.9	-175.5	-53.3	-60.4	0	0	0	110	F358 D360 A363 I391 P398 F400 F449	F358-Y365 PolarHBondContact O-N 3.44Å; D360-Y365 PolarHBondContact OD2-OH 3.27Å; A363-Y365 HydrophobicContact CB-CD1 4.29Å; A363-Y365 HydrophobicContact CB-CE1 3.58Å; Y365-I391 HydrophobicContact CD1-CD1 4.49Å; Y365-P398 HydrophobicContact CD2-CG 3.95Å; Y365-P398 HydrophobicContact CG-CG 4.11Å; Y365-F400 AromaticContact CD1-CE1 3.9Å; Y365-F400 HydrophobicContact CD1-CE1 3.9Å; Y365-F400 AromaticContact CD1-CZ 3.56Å; Y365-F400 HydrophobicContact CD1-CZ 3.56Å; Y365-F400 HydrophobicContact CD2-CZ 4.43Å; Y365-F400 HydrophobicContact CE1-CE1 4.28Å; Y365-F400 AromaticContact CE1-CZ 3.86Å; Y365-F400 HydrophobicContact CE1-CZ 3.86Å; Y365-F400 AromaticContact CG-CZ 3.86Å; Y365-F400 HydrophobicContact CG-CZ 3.86Å; Y365-F449 HydrophobicContact CD1-CE2 4.24Å; Y365-F449 HydrophobicContact CD1-CZ 4.19Å; Y365-F449 HydrophobicContact CE1-CD2 4.5Å; Y365-F449 AromaticContact CE1-CE2 3.71Å; Y365-F449 HydrophobicContact CE1-CE2 3.71Å; Y365-F449 AromaticContact CE1-CZ 3.79Å; Y365-F449 HydrophobicContact CE1-CZ 3.79Å
366	P	97.8	Very high	96.1	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.193	C	C	.	.			trans	-74.1	139.2	-175.5	-11.6	28.8	0	0	0	111.2	L348 E350 I351 I364 F369 I391 I458	L348-P366 WeakPolarHBondContact O-CB 3.3Å; L348-P366 VanDerWaalsContact O-CG 3.29Å; L348-P366 WeakPolarHBondContact O-CG 3.47Å; E350-P366 CarbonylContact O-C 3.39Å; E350-P366 VanDerWaalsContact O-CA 3.23Å; E350-P366 WeakPolarHBondContact O-CA 3.38Å; E350-P366 WeakPolarHBondContact O-CB 3.42Å; I351-P366 HydrophobicContact CG1-CB 4.26Å; I351-P366 HydrophobicContact CG1-CG 4.19Å; I364-P366 HydrophobicContact CG2-CG 4.4Å; I364-P366 WeakPolarHBondContact O-CD 3.48Å; P366-F369 WeakPolarHBondContact O-CB 3.24Å; P366-F369 PolarHBondContact O-N 2.8Å; P366-I391 WeakPolarHBondContact O-CB 3.47Å; P366-I391 WeakPolarHBondContact O-CG2 3.43Å; P366-I458 HydrophobicContact CG-CD1 4.39Å; P366-I458 HydrophobicContact CG-CG1 4.34Å; P366-I458 HydrophobicContact CG-CG2 3.91Å
367	V	98.3	Very high	96.2	Very high	34 Å²	34	29.6 Å²	29.6	21%	0.206	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	132.5	176.9	169.1	0	0	0	0	109.6	G349 E350 I352 F358 D393	G349-V367 CarbonylContact C-O 3.55Å; G349-V367 WeakPolarHBondContact CA-O 3.35Å; E350-V367 PolarHBondContact N-O 3.04Å; E350-V367 PolarHBondContact O-N 2.69Å; I352-V367 HydrophobicContact CD1-CB 4.19Å; I352-V367 HydrophobicContact CD1-CG2 4.03Å; I352-V367 HydrophobicContact CG1-CB 4.06Å; I352-V367 HydrophobicContact CG1-CG2 3.49Å; I352-V367 VanDerWaalsContact CG1-CG2 3.49Å; F358-V367 HydrophobicContact CD1-CG2 3.96Å; F358-V367 HydrophobicContact CE1-CG2 3.52Å; F358-V367 HydrophobicContact CZ-CG2 4.48Å; V367-D393 HydrophobicContact CG1-CB 4.06Å; V367-D393 HydrophobicContact CG2-CB 3.94Å
368	G	97.6	Very high	96.2	Very high	39 Å²	39	24.8 Å²	24.8	40%	0.402	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	82.2	11.9	-172.4	0	0	0	0	0	113.9	S347 G349 C370 I391	S347-G368 VanDerWaalsContact CB-O 3.27Å; S347-G368 WeakPolarHBondContact CB-O 3.35Å; S347-G368 PolarHBondContact OG-O 3.42Å; G349-G368 VanDerWaalsContact CA-C 3.43Å; G368-C370 PolarHBondContact O-N 3.13Å; G368-I391 PolarHBondContact N-O 3.5Å
369	F	98.5	Very high	95.9	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	131.7	162.3	179.1	-84.3	0	0	0	108.9	V345 S347 L348 P366 Q390 I391 F447 F449 I454 I458	V345-F369 HydrophobicContact CG1-CE2 4.24Å; V345-F369 HydrophobicContact CG1-CZ 4.35Å; S347-F369 WeakPolarHBondContact O-CA 3.41Å; L348-F369 HydrophobicContact CD2-CE2 4.36Å; P366-F369 WeakPolarHBondContact O-CB 3.24Å; P366-F369 PolarHBondContact O-N 2.8Å; F369-Q390 WeakPolarHBondContact O-CA 3.49Å; F369-I391 HydrophobicContact CB-CB 4.08Å; F369-I391 HydrophobicContact CB-CD1 3.97Å; F369-I391 HydrophobicContact CB-CG1 4.07Å; F369-I391 HydrophobicContact CD1-CD1 4.1Å; F369-I391 HydrophobicContact CD1-CG1 4.15Å; F369-I391 HydrophobicContact CG-CD1 4.13Å; F369-I391 HydrophobicContact CG-CG1 4.43Å; F369-I391 PolarHBondContact O-N 2.74Å; F369-F447 WeakPolarHBondContact CE1-O 3.31Å; F369-F449 HydrophobicContact CE1-CB 4.49Å; F369-F449 HydrophobicContact CE2-CB 4.04Å; F369-F449 HydrophobicContact CZ-CB 3.96Å; F369-I454 HydrophobicContact CE2-CG2 3.76Å; F369-I454 HydrophobicContact CZ-CG2 4.23Å; F369-I458 HydrophobicContact CD2-CD1 4.27Å; F369-I458 HydrophobicContact CE2-CD1 4.17Å
370	C	98.3	Very high	95.7	Very high	30 Å²	30	32.4 Å²	32.4	20%	0.203	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	125.4	-176.7	-173.1	0	0	0	0	111.1	Y346 S347 G368 C389 Q390	Y346-C370 PolarHBondContact N-O 3.17Å; S347-C370 PolarHBondContact N-O 2.89Å; S347-C370 PolarHBondContact O-N 3.41Å; G368-C370 PolarHBondContact O-N 3.13Å; C370-C389 WeakPolarHBondContact CA-O 3.02Å; C370-Q390 HydrophobicContact CB-CG 4.44Å
371	S	98.3	Very high	95.6	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.8	175.7	57.5	0	0	0	0	111.1	T344 T388 C389 F447	T344-S371 CarbonylContact O-C 3.59Å; T344-S371 WeakPolarHBondContact O-CA 3.3Å; T344-S371 WeakPolarHBondContact O-CB 3.36Å; S371-T388 CarbonylContact O-C 3.57Å; S371-T388 WeakPolarHBondContact O-CA 3.32Å; S371-C389 PolarHBondContact N-O 3.01Å; S371-C389 PolarHBondContact O-N 3.12Å; S371-F447 PolarHBondContact OG-O 3.12Å
372	T	98.1	Very high	95.3	Very high	6 Å²	6	27.8 Å²	27.8	4%	0.037	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.7	164.6	58.4	0	0	0	0	110.6	T344 Y346 L386 Y387 T388	T344-T372 PolarHBondContact N-O 2.96Å; T344-T372 PolarHBondContact O-N 2.96Å; Y346-T372 HydrophobicContact CE2-CG2 3.61Å; Y346-T372 WeakPolarHBondContact CE2-OG1 3.21Å; Y346-T372 PolarHBondContact OH-OG1 3.5Å; Y346-T372 VanDerWaalsContact OH-OG1 3.12Å; T372-L386 HydrophobicContact CG2-CD1 4.48Å; T372-L386 HydrophobicContact CG2-CG 4.34Å; T372-Y387 CarbonylContact C-O 3.56Å; T372-Y387 VanDerWaalsContact CA-O 3.23Å; T372-Y387 WeakPolarHBondContact CA-O 3.2Å; T372-T388 WeakPolarHBondContact CG2-OG1 3.43Å
373	R	95.8	Very high	95.4	Very high	13 Å²	13	28.4 Å²	28.4	5%	0.049	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	135.7	173.3	176	173.4	-70.9	-79.4	5.8	110.5	G342 Y387 D445 F446 I496	G342-R373 WeakPolarHBondContact O-CA 3.43Å; R373-Y387 PolarHBondContact N-O 3.28Å; R373-Y387 PolarHBondContact O-N 2.54Å; R373-D445 PolarHBondContact NH2-O 3.48Å; R373-F446 HydrophobicContact CG-CE2 4.5Å; R373-F446 HydrophobicContact CG-CZ 4.44Å; R373-F446 PolarHBondContact NE-O 3.08Å; R373-I496 PolarHBondContact NH1-O 3.21Å
374	V	94.6	Very high	95.2	Very high	51 Å²	51	33.3 Å²	33.3	31%	0.309	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.4	169.8	179.7	0	0	0	0	108.9	G342 Q384 L386	G342-V374 PolarHBondContact O-N 2.91Å; V374-Q384 HydrophobicContact CG1-CB 3.98Å; V374-Q384 HydrophobicContact CG1-CG 3.99Å; V374-L386 HydrophobicContact CG2-CD1 3.83Å
375	Y	95.5	Very high	95.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-179.5	177.6	-162.2	-112.3	0	0	0	111.1	C385 L424 L425 I428 F446 A494 Y501	Y375-C385 PolarHBondContact N-O 3.29Å; Y375-C385 PolarHBondContact O-N 2.86Å; Y375-C385 VanDerWaalsContact O-O 3.1Å; Y375-L424 HydrophobicContact CD1-CD2 4.23Å; Y375-L425 HydrophobicContact CE1-CD2 3.88Å; Y375-L425 VanDerWaalsContact OH-CD2 3.31Å; Y375-L425 WeakPolarHBondContact OH-CD2 3.39Å; Y375-I428 HydrophobicContact CD1-CD1 3.8Å; Y375-I428 HydrophobicContact CE1-CD1 3.62Å; Y375-F446 AromaticContact CD1-CE2 3.87Å; Y375-F446 HydrophobicContact CD1-CE2 3.87Å; Y375-F446 HydrophobicContact CD1-CZ 4.43Å; Y375-F446 HydrophobicContact CD2-CE2 4.21Å; Y375-F446 HydrophobicContact CE1-CE2 4.45Å; Y375-F446 AromaticContact CG-CE2 3.73Å; Y375-F446 HydrophobicContact CG-CE2 3.73Å; Y375-F446 HydrophobicContact CG-CZ 4.32Å; Y375-A494 WeakPolarHBondContact CE2-O 3.47Å; Y375-A494 PolarHBondContact OH-O 3.3Å; Y375-Y501 WeakPolarHBondContact OH-CD2 3.49Å
376	A	95	Very high	95	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	139.4	-178.6	0	0	0	0	0	112.1	Q383 Y387 I428 F498 Y501	A376-Q383 CarbonylContact C-O 3.58Å; A376-Q383 WeakPolarHBondContact CA-O 3.46Å; A376-Y387 VanDerWaalsContact O-CE2 3.32Å; A376-Y387 WeakPolarHBondContact O-CE2 3.49Å; A376-Y387 PolarHBondContact O-OH 2.57Å; A376-I428 HydrophobicContact CB-CD1 4.31Å; A376-I428 HydrophobicContact CB-CG2 4.25Å; A376-I428 WeakPolarHBondContact O-CD1 3.4Å; A376-F498 HydrophobicContact CB-CD2 3.87Å; A376-F498 HydrophobicContact CB-CE2 3.94Å; A376-Y501 HydrophobicContact CB-CD1 3.7Å; A376-Y501 HydrophobicContact CB-CE1 3.65Å; A376-Y501 HydrophobicContact CB-CG 4.31Å
377	S	94.7	Very high	95	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	18%	0.18	C	C	.	.			trans	-67	138.5	177.6	-177.2	0	0	0	0	111.4	K379 H380 Q383 Y387 E406	S377-K379 PolarHBondContact O-N 3.11Å; S377-K379 PolarHBondContact OG-N 3.42Å; S377-H380 WeakPolarHBondContact CB-O 3.39Å; S377-H380 CarbonylContact O-C 3.41Å; S377-H380 PolarHBondContact O-N 3.4Å; S377-Q383 PolarHBondContact N-O 3.49Å; S377-Y387 WeakPolarHBondContact CA-OH 3.48Å; S377-E406 WeakPolarHBondContact CB-OE2 3.48Å; S377-E406 PolarHBondContact OG-OE2 3Å
378	M	92.9	Very high	95	Very high	7 Å²	7	33.9 Å²	33.9	3%	0.034	18%	0.178	C	C	.	.	S	Bend	trans	-60.5	-26.8	173.5	-75.5	-167.8	-75.4	0	0	113.3	Y387 P404 N410 I412 L424 A427 I428 N431	M378-Y387 HydrophobicContact CE-CE1 4.31Å; M378-Y387 HydrophobicContact CG-CE1 4.45Å; M378-Y387 PolarHBondContact N-OH 2.94Å; M378-P404 HydrophobicContact CE-CB 4.27Å; M378-P404 HydrophobicContact CE-CG 3.6Å; M378-N410 HydrophobicContact CE-CB 4.4Å; M378-N410 VanDerWaalsContact CE-ND2 3.34Å; M378-N410 WeakPolarHBondContact CE-ND2 3.39Å; M378-I412 HydrophobicContact CE-CD1 4.47Å; M378-I412 HydrophobicContact SD-CD1 3.73Å; M378-I412 HydrophobicContact SD-CG1 4.35Å; M378-L424 HydrophobicContact CG-CD1 3.5Å; M378-L424 HydrophobicContact SD-CD1 3.85Å; M378-A427 HydrophobicContact CB-CB 4.42Å; M378-A427 HydrophobicContact CG-CB 3.93Å; M378-A427 HydrophobicContact SD-CB 3.65Å; M378-I428 HydrophobicContact CG-CG1 4.16Å; M378-N431 PolarHBondContact O-ND2 3.1Å
379	K	91.4	Very high	95	Very high	95 Å²	95	32 Å²	32	41%	0.413	16%	0.159	S	C	.	.	S	Bend	trans	-91.6	-34.6	-179.5	-65.6	174.6	-178.4	173	0	112.2	S377 D407	S377-K379 PolarHBondContact O-N 3.11Å; S377-K379 PolarHBondContact OG-N 3.42Å; K379-D407 WeakPolarHBondContact CE-OD2 3.25Å; K379-D407 IonicContact NZ-OD2 2.74Å; K379-D407 PolarHBondContact NZ-OD2 3.38Å
380	H	91.2	Very high	95	Very high	87 Å²	87	34.6 Å²	34.6	40%	0.403	17%	0.171	S	C	.	.			trans	-135.2	83.7	-171	-69.5	-68.6	0	0	0	109.2	S377 E382 Q383	S377-H380 WeakPolarHBondContact CB-O 3.39Å; S377-H380 CarbonylContact O-C 3.41Å; S377-H380 PolarHBondContact O-N 3.4Å; H380-E382 WeakPolarHBondContact CA-OE2 3.41Å; H380-E382 WeakPolarHBondContact CB-OE1 3.41Å; H380-E382 IonicContact CG-OE1 3.76Å; H380-E382 IonicContact ND1-OE1 3.36Å; H380-E382 PolarHBondContact ND1-OE1 3.38Å; H380-E382 PolarHBondContact O-N 2.99Å; H380-Q383 HydrophobicContact CB-CB 3.93Å; H380-Q383 HydrophobicContact CB-CG 3.85Å; H380-Q383 VanDerWaalsContact CG-NE2 3.33Å; H380-Q383 PolarHBondContact O-N 3.06Å
381	P	91.5	Very high	95	Very high	9 Å²	9	33.2 Å²	33.2	6%	0.058	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.9	-176	-26.4	36.7	0	0	0	114.4	Q383 I428 N431 Y501	P381-Q383 VanDerWaalsContact C-N 3.3Å; P381-I428 HydrophobicContact CB-CG2 3.85Å; P381-I428 HydrophobicContact CG-CG2 4Å; P381-N431 HydrophobicContact CG-CB 4.48Å; P381-Y501 HydrophobicContact CB-CE1 4.36Å; P381-Y501 WeakPolarHBondContact O-CE1 3.23Å
382	E	89.6	Confident	95	Very high	85 Å²	85	36.6 Å²	36.6	40%	0.397	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-5.2	174	79.1	-66.1	169.7	0	0	114.4	H380	H380-E382 WeakPolarHBondContact CA-OE2 3.41Å; H380-E382 WeakPolarHBondContact CB-OE1 3.41Å; H380-E382 IonicContact CG-OE1 3.76Å; H380-E382 IonicContact ND1-OE1 3.36Å; H380-E382 PolarHBondContact ND1-OE1 3.38Å; H380-E382 PolarHBondContact O-N 2.99Å
383	Q	92.3	Very high	95	Very high	87 Å²	87	39.5 Å²	39.5	41%	0.407	19%	0.192	S	C	.	.	S	Bend	trans	-119.2	151.5	-175.6	-59.5	177	43.2	0	0	111.7	A376 S377 H380 P381 F498	A376-Q383 CarbonylContact C-O 3.58Å; A376-Q383 WeakPolarHBondContact CA-O 3.46Å; S377-Q383 PolarHBondContact N-O 3.49Å; H380-Q383 HydrophobicContact CB-CB 3.93Å; H380-Q383 HydrophobicContact CB-CG 3.85Å; H380-Q383 VanDerWaalsContact CG-NE2 3.33Å; H380-Q383 PolarHBondContact O-N 3.06Å; P381-Q383 VanDerWaalsContact C-N 3.3Å; Q383-F498 WeakPolarHBondContact O-CE2 3.25Å
384	Q	93.3	Very high	94.9	Very high	112 Å²	112	40.6 Å²	40.6	52%	0.523	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	134.3	175.5	-70.9	-176.3	-11.9	0	0	111.5	V374 F498	V374-Q384 HydrophobicContact CG1-CB 3.98Å; V374-Q384 HydrophobicContact CG1-CG 3.99Å; Q384-F498 HydrophobicContact CG-CB 4.44Å; Q384-F498 HydrophobicContact CG-CD1 3.42Å; Q384-F498 VanDerWaalsContact CG-CD1 3.42Å; Q384-F498 HydrophobicContact CG-CD2 4.01Å; Q384-F498 HydrophobicContact CG-CE1 3.43Å; Q384-F498 VanDerWaalsContact CG-CE1 3.43Å; Q384-F498 HydrophobicContact CG-CE2 4.05Å; Q384-F498 HydrophobicContact CG-CG 3.69Å; Q384-F498 HydrophobicContact CG-CZ 3.75Å; Q384-F498 VanDerWaalsContact NE2-CD1 3.28Å
385	C	94.2	Very high	94.9	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.027	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143.1	171.4	-179.1	0	0	0	0	109.7	Y375 Y387 E406	Y375-C385 PolarHBondContact N-O 3.29Å; Y375-C385 PolarHBondContact O-N 2.86Å; Y375-C385 VanDerWaalsContact O-O 3.1Å; C385-Y387 HydrophobicContact CB-CD2 4.45Å; C385-Y387 HydrophobicContact CB-CE2 3.76Å; C385-Y387 WeakPolarHBondContact O-CD2 3.34Å; C385-E406 HydrophobicContact CB-CG 4.38Å; C385-E406 WeakPolarHBondContact CB-OE2 3.24Å; C385-E406 PolarHBondContact SG-OE2 3.11Å
386	L	96.3	Very high	94.7	Very high	56 Å²	56	45.6 Å²	45.6	29%	0.293	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.5	174.1	-169.9	57.8	0	0	0	109.7	T372 V374 E405	T372-L386 HydrophobicContact CG2-CD1 4.48Å; T372-L386 HydrophobicContact CG2-CG 4.34Å; V374-L386 HydrophobicContact CG2-CD1 3.83Å; L386-E405 WeakPolarHBondContact CD2-OE1 3.36Å; L386-E405 WeakPolarHBondContact CG-OE1 3.4Å; L386-E405 PolarHBondContact O-N 2.9Å
387	Y	97.7	Very high	94.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.2	-177.3	-69.6	-83.1	0	0	0	111.3	T372 R373 A376 S377 M378 C385 C389 I402 V403 P404 L424 F446	T372-Y387 CarbonylContact C-O 3.56Å; T372-Y387 VanDerWaalsContact CA-O 3.23Å; T372-Y387 WeakPolarHBondContact CA-O 3.2Å; R373-Y387 PolarHBondContact N-O 3.28Å; R373-Y387 PolarHBondContact O-N 2.54Å; A376-Y387 VanDerWaalsContact O-CE2 3.32Å; A376-Y387 WeakPolarHBondContact O-CE2 3.49Å; A376-Y387 PolarHBondContact O-OH 2.57Å; S377-Y387 WeakPolarHBondContact CA-OH 3.48Å; M378-Y387 HydrophobicContact CE-CE1 4.31Å; M378-Y387 HydrophobicContact CG-CE1 4.45Å; M378-Y387 PolarHBondContact N-OH 2.94Å; C385-Y387 HydrophobicContact CB-CD2 4.45Å; C385-Y387 HydrophobicContact CB-CE2 3.76Å; C385-Y387 WeakPolarHBondContact O-CD2 3.34Å; Y387-C389 PolarHBondContact O-N 3.13Å; Y387-I402 HydrophobicContact CD1-CG2 3.55Å; Y387-I402 HydrophobicContact CE1-CG2 4.38Å; Y387-I402 HydrophobicContact CG-CG2 4.11Å; Y387-V403 CarbonylContact C-O 3.31Å; Y387-V403 WeakPolarHBondContact CA-O 3.42Å; Y387-P404 HydrophobicContact CD1-CB 3.95Å; Y387-P404 HydrophobicContact CE1-CB 3.72Å; Y387-L424 HydrophobicContact CD1-CD1 4.36Å; Y387-L424 HydrophobicContact CE1-CD1 3.57Å; Y387-L424 HydrophobicContact CE1-CD2 4.48Å; Y387-F446 HydrophobicContact CD2-CZ 4.29Å; Y387-F446 HydrophobicContact CG-CZ 4.36Å
388	T	98.3	Very high	94.8	Very high	28 Å²	28	46.7 Å²	46.7	17%	0.172	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	117.8	168.1	-74	0	0	0	0	109.8	S371 T372 Q390 V403 E405	S371-T388 CarbonylContact O-C 3.57Å; S371-T388 WeakPolarHBondContact O-CA 3.32Å; T372-T388 WeakPolarHBondContact CG2-OG1 3.43Å; T388-Q390 HydrophobicContact CG2-CG 3.99Å; T388-V403 PolarHBondContact N-O 3.46Å; T388-V403 PolarHBondContact O-N 3.37Å; T388-E405 PolarHBondContact OG1-OE1 2.75Å
389	C	98.4	Very high	95.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.9	178.1	-61.7	0	0	0	0	110.1	C370 S371 Y387 E401 F447	C370-C389 WeakPolarHBondContact CA-O 3.02Å; S371-C389 PolarHBondContact N-O 3.01Å; S371-C389 PolarHBondContact O-N 3.12Å; Y387-C389 PolarHBondContact O-N 3.13Å; C389-E401 WeakPolarHBondContact CA-O 3.32Å; C389-F447 HydrophobicContact CB-CD1 3.73Å; C389-F447 HydrophobicContact CB-CD2 4.44Å; C389-F447 HydrophobicContact CB-CE1 3.94Å; C389-F447 HydrophobicContact CB-CG 4Å; C389-F447 HydrophobicContact CB-CZ 4.39Å
390	Q	98.4	Very high	95.4	Very high	56 Å²	56	45.4 Å²	45.4	26%	0.262	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.7	-175	-76	173.5	81.4	0	0	112.9	F369 C370 T388 E401	F369-Q390 WeakPolarHBondContact O-CA 3.49Å; C370-Q390 HydrophobicContact CB-CG 4.44Å; T388-Q390 HydrophobicContact CG2-CG 3.99Å; Q390-E401 HydrophobicContact CB-CB 4.46Å; Q390-E401 PolarHBondContact N-O 2.8Å; Q390-E401 PolarHBondContact O-N 2.94Å
391	I	98.5	Very high	95.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121	166.2	-53.5	178.1	0	0	0	108.5	Y365 P366 G368 F369 P398 Q399 F400 F447 F449	Y365-I391 HydrophobicContact CD1-CD1 4.49Å; P366-I391 WeakPolarHBondContact O-CB 3.47Å; P366-I391 WeakPolarHBondContact O-CG2 3.43Å; G368-I391 PolarHBondContact N-O 3.5Å; F369-I391 HydrophobicContact CB-CB 4.08Å; F369-I391 HydrophobicContact CB-CD1 3.97Å; F369-I391 HydrophobicContact CB-CG1 4.07Å; F369-I391 HydrophobicContact CD1-CD1 4.1Å; F369-I391 HydrophobicContact CD1-CG1 4.15Å; F369-I391 HydrophobicContact CG-CD1 4.13Å; F369-I391 HydrophobicContact CG-CG1 4.43Å; F369-I391 PolarHBondContact O-N 2.74Å; I391-P398 HydrophobicContact CG2-CB 3.8Å; I391-Q399 CarbonylContact C-O 3.6Å; I391-Q399 WeakPolarHBondContact CA-O 3.21Å; I391-F400 HydrophobicContact CD1-CD1 4.27Å; I391-F400 HydrophobicContact CD1-CE1 3.79Å; I391-F400 HydrophobicContact CG1-CD1 3.85Å; I391-F400 HydrophobicContact CG1-CE1 3.87Å; I391-F447 HydrophobicContact CG1-CD1 4.42Å; I391-F449 HydrophobicContact CD1-CD1 3.99Å; I391-F449 HydrophobicContact CD1-CE1 4.22Å
392	K	97.9	Very high	96.1	Very high	72 Å²	72	41.9 Å²	41.9	31%	0.313	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	167.6	179.2	-62.5	-173.9	-169.4	165.6	0	111.4	G394 Q399 E401	K392-G394 PolarHBondContact O-N 2.83Å; K392-Q399 HydrophobicContact CB-CB 4.33Å; K392-Q399 PolarHBondContact N-O 2.88Å; K392-Q399 PolarHBondContact O-N 3.36Å; K392-E401 WeakPolarHBondContact CD-OE1 3.25Å; K392-E401 VanDerWaalsContact CE-CD 3.42Å; K392-E401 VanDerWaalsContact CE-OE1 3.32Å; K392-E401 WeakPolarHBondContact CE-OE1 3.37Å; K392-E401 WeakPolarHBondContact CE-OE2 3.46Å; K392-E401 IonicContact NZ-OE1 2.72Å; K392-E401 PolarHBondContact NZ-OE1 2.85Å; K392-E401 IonicContact NZ-OE2 3.08Å; K392-E401 PolarHBondContact NZ-OE2 3.5Å
393	D	97.2	Very high	96.5	Very high	67 Å²	67	38.9 Å²	38.9	36%	0.358	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	107.2	173.4	-164.9	-29.8	0	0	0	110.4	R355 V367 G395	R355-D393 IonicContact CZ-OD1 3.01Å; R355-D393 IonicContact CZ-OD2 2.92Å; R355-D393 VanDerWaalsContact NH1-CG 3.26Å; R355-D393 IonicContact NH1-OD1 3.95Å; R355-D393 PolarHBondContact NH1-OD1 3.46Å; R355-D393 IonicContact NH1-OD2 3.39Å; R355-D393 PolarHBondContact NH1-OD2 3.07Å; R355-D393 IonicContact NH2-OD1 2.69Å; R355-D393 IonicContact NH2-OD2 3.84Å; R355-D393 PolarHBondContact NH2-OD2 2.8Å; V367-D393 HydrophobicContact CG1-CB 4.06Å; V367-D393 HydrophobicContact CG2-CB 3.94Å; D393-G395 VanDerWaalsContact C-N 3.27Å; D393-G395 PolarHBondContact O-N 3.26Å; D393-G395 WeakPolarHBondContact OD1-CA 3.35Å; D393-G395 PolarHBondContact OD1-N 3.32Å
394	G	94.9	Very high	96.7	Very high	36 Å²	36	34.9 Å²	34.9	37%	0.371	20%	0.202	S	C	.	.			trans	-86.9	15	174.1	0	0	0	0	0	114	K392 T396 G397	K392-G394 PolarHBondContact O-N 2.83Å; G394-T396 VanDerWaalsContact C-N 3.31Å; G394-T396 PolarHBondContact O-N 3.43Å; G394-G397 CarbonylContact C-O 3.46Å; G394-G397 WeakPolarHBondContact CA-O 3.48Å; G394-G397 PolarHBondContact N-O 2.95Å
395	G	93.8	Very high	96.6	Very high	42 Å²	42	34.2 Å²	34.2	43%	0.433	20%	0.199	S	C	.	.	S	Bend	trans	80	-66.9	-179.1	0	0	0	0	0	113.1	R355 D393	R355-G395 WeakPolarHBondContact CD-O 3.39Å; R355-G395 PolarHBondContact NH1-O 3.2Å; D393-G395 VanDerWaalsContact C-N 3.27Å; D393-G395 PolarHBondContact O-N 3.26Å; D393-G395 WeakPolarHBondContact OD1-CA 3.35Å; D393-G395 PolarHBondContact OD1-N 3.32Å
396	T	91.7	Very high	96.3	Very high	114 Å²	114	38.4 Å²	38.4	70%	0.699	22%	0.218	S	C	*	.	S	Bend	trans	-80.1	-37.7	178.2	51.3	0	0	0	0	112.3	G394	G394-T396 VanDerWaalsContact C-N 3.31Å; G394-T396 PolarHBondContact O-N 3.43Å
397	G	94.7	Very high	96	Very high	10 Å²	10	37.7 Å²	37.7	10%	0.103	22%	0.215	C	C	.	.	S	Bend	trans	-154.9	-175.8	-179.7	0	0	0	0	0	111.7	F358 G394	F358-G397 VanDerWaalsContact CE2-CA 3.48Å; F358-G397 WeakPolarHBondContact CZ-O 3.18Å; G394-G397 CarbonylContact C-O 3.46Å; G394-G397 WeakPolarHBondContact CA-O 3.48Å; G394-G397 PolarHBondContact N-O 2.95Å
398	P	97.6	Very high	95.7	Very high	13 Å²	13	41.9 Å²	41.9	8%	0.084	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	135.4	179.5	26	-33.6	0	0	0	111.9	L357 F358 Y365 I391 F400	L357-P398 WeakPolarHBondContact O-CD 3.46Å; F358-P398 HydrophobicContact CD1-CB 3.98Å; F358-P398 HydrophobicContact CD1-CG 4.37Å; F358-P398 HydrophobicContact CE1-CB 4.06Å; Y365-P398 HydrophobicContact CD2-CG 3.95Å; Y365-P398 HydrophobicContact CG-CG 4.11Å; I391-P398 HydrophobicContact CG2-CB 3.8Å; P398-F400 HydrophobicContact CB-CD2 4.41Å; P398-F400 HydrophobicContact CB-CE2 3.78Å; P398-F400 HydrophobicContact CB-CZ 4.08Å; P398-F400 HydrophobicContact CG-CE2 3.69Å; P398-F400 HydrophobicContact CG-CZ 4.04Å
399	Q	98.1	Very high	95.3	Very high	71 Å²	71	49.3 Å²	49.3	33%	0.332	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.4	168.3	177.2	172.4	52.2	0	0	108.1	I391 K392 V413	I391-Q399 CarbonylContact C-O 3.6Å; I391-Q399 WeakPolarHBondContact CA-O 3.21Å; K392-Q399 HydrophobicContact CB-CB 4.33Å; K392-Q399 PolarHBondContact N-O 2.88Å; K392-Q399 PolarHBondContact O-N 3.36Å; Q399-V413 HydrophobicContact CG-CG1 3.66Å; Q399-V413 VanDerWaalsContact NE2-CG1 3.34Å
400	F	98.6	Very high	94.9	Very high	5 Å²	5	52.9 Å²	52.9	2%	0.022	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138	178.5	-63	-97.9	0	0	0	109.2	Y365 I391 P398 V413 A414 A417 C420 F447 F449	Y365-F400 AromaticContact CD1-CE1 3.9Å; Y365-F400 HydrophobicContact CD1-CE1 3.9Å; Y365-F400 AromaticContact CD1-CZ 3.56Å; Y365-F400 HydrophobicContact CD1-CZ 3.56Å; Y365-F400 HydrophobicContact CD2-CZ 4.43Å; Y365-F400 HydrophobicContact CE1-CE1 4.28Å; Y365-F400 AromaticContact CE1-CZ 3.86Å; Y365-F400 HydrophobicContact CE1-CZ 3.86Å; Y365-F400 AromaticContact CG-CZ 3.86Å; Y365-F400 HydrophobicContact CG-CZ 3.86Å; I391-F400 HydrophobicContact CD1-CD1 4.27Å; I391-F400 HydrophobicContact CD1-CE1 3.79Å; I391-F400 HydrophobicContact CG1-CD1 3.85Å; I391-F400 HydrophobicContact CG1-CE1 3.87Å; P398-F400 HydrophobicContact CB-CD2 4.41Å; P398-F400 HydrophobicContact CB-CE2 3.78Å; P398-F400 HydrophobicContact CB-CZ 4.08Å; P398-F400 HydrophobicContact CG-CE2 3.69Å; P398-F400 HydrophobicContact CG-CZ 4.04Å; F400-V413 WeakPolarHBondContact O-CA 3.34Å; F400-A414 PolarHBondContact N-O 2.65Å; F400-A414 PolarHBondContact O-N 2.91Å; F400-A417 HydrophobicContact CD1-CB 3.68Å; F400-A417 HydrophobicContact CE1-CB 3.85Å; F400-A417 HydrophobicContact CG-CB 4.31Å; F400-C420 VanDerWaalsContact CB-SG 3.52Å; F400-C420 PolarHBondContact O-SG 3.4Å; F400-C420 VanDerWaalsContact O-SG 3.35Å; F400-F447 HydrophobicContact CB-CE1 4.11Å; F400-F447 HydrophobicContact CB-CZ 3.84Å; F400-F447 HydrophobicContact CD1-CD1 4.24Å; F400-F447 AromaticContact CD1-CE1 3.85Å; F400-F447 HydrophobicContact CD1-CE1 3.85Å; F400-F447 HydrophobicContact CD1-CZ 4.16Å; F400-F447 HydrophobicContact CG-CE1 4.49Å; F400-F447 HydrophobicContact CG-CZ 4.5Å; F400-F449 HydrophobicContact CD1-CE1 4.45Å; F400-F449 AromaticContact CE1-CE1 3.88Å; F400-F449 HydrophobicContact CE1-CE1 3.88Å; F400-F449 HydrophobicContact CE1-CZ 4.14Å
401	E	98.3	Very high	94.8	Very high	21 Å²	21	52 Å²	52	10%	0.098	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.2	176.3	-58	-169.7	-177.1	0	0	111.4	C389 Q390 K392 V403 I412 V413 F447	C389-E401 WeakPolarHBondContact CA-O 3.32Å; Q390-E401 HydrophobicContact CB-CB 4.46Å; Q390-E401 PolarHBondContact N-O 2.8Å; Q390-E401 PolarHBondContact O-N 2.94Å; K392-E401 WeakPolarHBondContact CD-OE1 3.25Å; K392-E401 VanDerWaalsContact CE-CD 3.42Å; K392-E401 VanDerWaalsContact CE-OE1 3.32Å; K392-E401 WeakPolarHBondContact CE-OE1 3.37Å; K392-E401 WeakPolarHBondContact CE-OE2 3.46Å; K392-E401 IonicContact NZ-OE1 2.72Å; K392-E401 PolarHBondContact NZ-OE1 2.85Å; K392-E401 IonicContact NZ-OE2 3.08Å; K392-E401 PolarHBondContact NZ-OE2 3.5Å; E401-V403 HydrophobicContact CB-CG2 4.46Å; E401-I412 CarbonylContact C-O 3.49Å; E401-I412 VanDerWaalsContact CA-O 3.3Å; E401-I412 WeakPolarHBondContact CA-O 3.35Å; E401-V413 HydrophobicContact CG-CB 4.47Å; E401-V413 HydrophobicContact CG-CG1 4.14Å; E401-V413 HydrophobicContact CG-CG2 3.97Å; E401-F447 WeakPolarHBondContact O-CZ 3.43Å
402	I	98.5	Very high	94.8	Very high	1 Å²	1	53 Å²	53	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.4	164.1	-61.6	176.5	0	0	0	107.1	Y387 I412 C420 L424 F446 F447	Y387-I402 HydrophobicContact CD1-CG2 3.55Å; Y387-I402 HydrophobicContact CE1-CG2 4.38Å; Y387-I402 HydrophobicContact CG-CG2 4.11Å; I402-I412 HydrophobicContact CB-CB 4.39Å; I402-I412 PolarHBondContact N-O 3.31Å; I402-I412 PolarHBondContact O-N 3.21Å; I402-C420 HydrophobicContact CD1-CB 3.68Å; I402-C420 HydrophobicContact CG1-CB 3.91Å; I402-L424 HydrophobicContact CD1-CB 4.47Å; I402-L424 HydrophobicContact CD1-CD2 4.3Å; I402-L424 HydrophobicContact CG2-CD2 4.41Å; I402-F446 HydrophobicContact CD1-CD1 4.05Å; I402-F446 HydrophobicContact CD1-CE1 4.01Å; I402-F446 HydrophobicContact CG2-CE1 4.37Å; I402-F447 HydrophobicContact CD1-CE2 3.84Å; I402-F447 HydrophobicContact CD1-CZ 4.45Å; I402-F447 HydrophobicContact CG1-CE2 3.6Å; I402-F447 HydrophobicContact CG1-CZ 3.74Å
403	V	97.9	Very high	94.8	Very high	21 Å²	21	52.7 Å²	52.7	13%	0.127	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.7	-178.5	-171.9	0	0	0	0	108.9	Y387 T388 E401 P408 A411	Y387-V403 CarbonylContact C-O 3.31Å; Y387-V403 WeakPolarHBondContact CA-O 3.42Å; T388-V403 PolarHBondContact N-O 3.46Å; T388-V403 PolarHBondContact O-N 3.37Å; E401-V403 HydrophobicContact CB-CG2 4.46Å; V403-P408 HydrophobicContact CG1-CB 4.11Å; V403-A411 HydrophobicContact CG1-CB 4.48Å; V403-A411 HydrophobicContact CG2-CB 3.96Å
404	P	95.9	Very high	94.8	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.019	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	135.8	171.2	31.8	-33.9	0	0	0	109.8	M378 Y387 E406 D407	M378-P404 HydrophobicContact CE-CB 4.27Å; M378-P404 HydrophobicContact CE-CG 3.6Å; Y387-P404 HydrophobicContact CD1-CB 3.95Å; Y387-P404 HydrophobicContact CE1-CB 3.72Å; P404-E406 PolarHBondContact O-N 2.9Å; P404-D407 HydrophobicContact CG-CB 4.27Å; P404-D407 WeakPolarHBondContact CG-O 3.33Å; P404-D407 CarbonylContact O-C 3.55Å; P404-D407 VanDerWaalsContact O-C 3.31Å; P404-D407 PolarHBondContact O-N 3.43Å
405	E	91.8	Very high	94.9	Very high	98 Å²	98	53.6 Å²	53.6	46%	0.458	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-23.8	177.5	-69.6	-178.1	-153.7	0	0	112.5	L386 T388 D407	L386-E405 WeakPolarHBondContact CD2-OE1 3.36Å; L386-E405 WeakPolarHBondContact CG-OE1 3.4Å; L386-E405 PolarHBondContact O-N 2.9Å; T388-E405 PolarHBondContact OG1-OE1 2.75Å; E405-D407 VanDerWaalsContact C-N 3.32Å; E405-D407 PolarHBondContact O-N 2.93Å
406	E	88.4	Confident	95	Very high	93 Å²	93	53.2 Å²	53.2	44%	0.435	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-26.7	172.1	-62.9	176.3	153.4	0	0	114	S377 C385 P404	S377-E406 WeakPolarHBondContact CB-OE2 3.48Å; S377-E406 PolarHBondContact OG-OE2 3Å; C385-E406 HydrophobicContact CB-CG 4.38Å; C385-E406 WeakPolarHBondContact CB-OE2 3.24Å; C385-E406 PolarHBondContact SG-OE2 3.11Å; P404-E406 PolarHBondContact O-N 2.9Å
407	D	89.4	Confident	95.3	Very high	40 Å²	40	48 Å²	48	21%	0.214	27%	0.271	C	S	.	.			trans	-152.3	75.6	-177.5	-167.1	-17.1	0	0	0	112.3	K379 P404 E405 Q409 N410	K379-D407 WeakPolarHBondContact CE-OD2 3.25Å; K379-D407 IonicContact NZ-OD2 2.74Å; K379-D407 PolarHBondContact NZ-OD2 3.38Å; P404-D407 HydrophobicContact CG-CB 4.27Å; P404-D407 WeakPolarHBondContact CG-O 3.33Å; P404-D407 CarbonylContact O-C 3.55Å; P404-D407 VanDerWaalsContact O-C 3.31Å; P404-D407 PolarHBondContact O-N 3.43Å; E405-D407 VanDerWaalsContact C-N 3.32Å; E405-D407 PolarHBondContact O-N 2.93Å; D407-Q409 PolarHBondContact O-N 3.37Å; D407-Q409 PolarHBondContact OD1-N 3.17Å; D407-N410 HydrophobicContact CB-CB 4.32Å; D407-N410 PolarHBondContact O-N 2.6Å; D407-N410 PolarHBondContact OD1-N 2.85Å
408	P	91.3	Very high	95.4	Very high	88 Å²	88	52 Å²	52	57%	0.571	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-4.8	-177	-25	36.2	0	0	0	115.3	V403	V403-P408 HydrophobicContact CG1-CB 4.11Å
409	Q	89.4	Confident	95.4	Very high	185 Å²	185	54.1 Å²	54.1	86%	0.864	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-28.4	172.2	-59	-169.6	7.7	0	0	112.2	D407 A411	D407-Q409 PolarHBondContact O-N 3.37Å; D407-Q409 PolarHBondContact OD1-N 3.17Å; Q409-A411 PolarHBondContact O-N 2.97Å; Q409-A411 VanDerWaalsContact O-N 3.08Å
410	N	91.6	Very high	95.4	Very high	75 Å²	75	50.7 Å²	50.7	40%	0.401	29%	0.287	S	S	.	.	S	Bend	trans	-86.3	48.9	178.4	-165.1	24.2	0	0	0	112.2	M378 D407	M378-N410 HydrophobicContact CE-CB 4.4Å; M378-N410 VanDerWaalsContact CE-ND2 3.34Å; M378-N410 WeakPolarHBondContact CE-ND2 3.39Å; D407-N410 HydrophobicContact CB-CB 4.32Å; D407-N410 PolarHBondContact O-N 2.6Å; D407-N410 PolarHBondContact OD1-N 2.85Å
411	A	95.6	Very high	95.4	Very high	38 Å²	38	50.5 Å²	50.5	31%	0.314	29%	0.286	S	S	.	.			trans	-74.9	125.4	179.4	0	0	0	0	0	111.6	V403 Q409	V403-A411 HydrophobicContact CG1-CB 4.48Å; V403-A411 HydrophobicContact CG2-CB 3.96Å; Q409-A411 PolarHBondContact O-N 2.97Å; Q409-A411 VanDerWaalsContact O-N 3.08Å
412	I	97.6	Very high	95.3	Very high	20 Å²	20	50.7 Å²	50.7	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118	175	-59.2	178.4	0	0	0	108.7	M378 E401 I402 C420 N423 L424	M378-I412 HydrophobicContact CE-CD1 4.47Å; M378-I412 HydrophobicContact SD-CD1 3.73Å; M378-I412 HydrophobicContact SD-CG1 4.35Å; E401-I412 CarbonylContact C-O 3.49Å; E401-I412 VanDerWaalsContact CA-O 3.3Å; E401-I412 WeakPolarHBondContact CA-O 3.35Å; I402-I412 HydrophobicContact CB-CB 4.39Å; I402-I412 PolarHBondContact N-O 3.31Å; I402-I412 PolarHBondContact O-N 3.21Å; I412-C420 HydrophobicContact CG2-CB 4.31Å; I412-N423 HydrophobicContact CG2-CB 3.87Å; I412-L424 HydrophobicContact CD1-CB 3.83Å; I412-L424 HydrophobicContact CD1-CD1 4.13Å
413	V	97.9	Very high	95.3	Very high	66 Å²	66	53.4 Å²	53.4	40%	0.4	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.3	-177	-173.5	0	0	0	0	110.6	Q399 F400 E401	Q399-V413 HydrophobicContact CG-CG1 3.66Å; Q399-V413 VanDerWaalsContact NE2-CG1 3.34Å; F400-V413 WeakPolarHBondContact O-CA 3.34Å; E401-V413 HydrophobicContact CG-CB 4.47Å; E401-V413 HydrophobicContact CG-CG1 4.14Å; E401-V413 HydrophobicContact CG-CG2 3.97Å
414	A	97.9	Very high	95.2	Very high	18 Å²	18	52.4 Å²	52.4	15%	0.149	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	172.8	173.4	0	0	0	0	0	113.7	F400 S416 T419 C420	F400-A414 PolarHBondContact N-O 2.65Å; F400-A414 PolarHBondContact O-N 2.91Å; A414-S416 VanDerWaalsContact C-N 3.29Å; A414-S416 PolarHBondContact O-N 2.93Å; A414-T419 HydrophobicContact CB-CG2 3.65Å; A414-C420 VanDerWaalsContact CB-SG 3.58Å
415	S	96.3	Very high	95.2	Very high	103 Å²	103	53.3 Å²	53.3	72%	0.72	30%	0.302	S	S	*	.	S	Bend	trans	-81.6	2.2	175.4	52.9	0	0	0	0	114.7
416	S	97.3	Very high	95.3	Very high	35 Å²	35	54.3 Å²	54.3	25%	0.245	31%	0.305	C	S	.	.	S	Bend	trans	-149.3	148.8	170.1	87.2	0	0	0	0	111.9	A414 L418 T419 C420	A414-S416 VanDerWaalsContact C-N 3.29Å; A414-S416 PolarHBondContact O-N 2.93Å; S416-L418 PolarHBondContact O-N 3.01Å; S416-L418 PolarHBondContact OG-N 2.98Å; S416-T419 PolarHBondContact O-N 3.47Å; S416-T419 WeakPolarHBondContact OG-CB 3.02Å; S416-T419 PolarHBondContact OG-N 2.69Å; S416-T419 PolarHBondContact OG-OG1 2.92Å; S416-C420 PolarHBondContact O-N 3.01Å; S416-C420 PolarHBondContact O-SG 3.01Å
417	A	97.5	Very high	95.5	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-36.8	171.8	0	0	0	0	0	112	F400 C420 H421 G443 F447 F449	F400-A417 HydrophobicContact CD1-CB 3.68Å; F400-A417 HydrophobicContact CE1-CB 3.85Å; F400-A417 HydrophobicContact CG-CB 4.31Å; A417-C420 PolarHBondContact O-N 3.21Å; A417-H421 PolarHBondContact O-N 3Å; A417-G443 WeakPolarHBondContact O-CA 3.41Å; A417-F447 HydrophobicContact CB-CD2 3.7Å; A417-F447 HydrophobicContact CB-CE2 3.84Å; A417-F447 HydrophobicContact CB-CG 4.15Å; A417-F447 HydrophobicContact CB-CZ 4.41Å; A417-F449 HydrophobicContact CB-CE1 3.86Å; A417-F449 HydrophobicContact CB-CZ 3.79Å
418	L	97.2	Very high	95.7	Very high	94 Å²	94	49.4 Å²	49.4	49%	0.492	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-43.8	176.4	-177.4	64.4	0	0	0	111.5	S416 S422 P441	S416-L418 PolarHBondContact O-N 3.01Å; S416-L418 PolarHBondContact OG-N 2.98Å; L418-S422 WeakPolarHBondContact O-CB 3.37Å; L418-S422 PolarHBondContact O-N 3.22Å; L418-S422 PolarHBondContact O-OG 2.84Å; L418-P441 HydrophobicContact CD1-CB 4.14Å; L418-P441 HydrophobicContact CD1-CG 4.02Å; L418-P441 WeakPolarHBondContact CD1-O 3.49Å
419	T	97.8	Very high	95.7	Very high	57 Å²	57	48.2 Å²	48.2	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-40	177.1	-51.4	0	0	0	0	111.5	A414 S416 S422 N423	A414-T419 HydrophobicContact CB-CG2 3.65Å; S416-T419 PolarHBondContact O-N 3.47Å; S416-T419 WeakPolarHBondContact OG-CB 3.02Å; S416-T419 PolarHBondContact OG-N 2.69Å; S416-T419 PolarHBondContact OG-OG1 2.92Å; T419-S422 PolarHBondContact O-N 2.74Å; T419-N423 WeakPolarHBondContact O-CB 3.14Å; T419-N423 VanDerWaalsContact O-CG 3.25Å; T419-N423 PolarHBondContact O-N 2.91Å; T419-N423 PolarHBondContact O-ND2 2.84Å
420	C	97.9	Very high	95.8	Very high	0 Å²	0	44 Å²	44	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-53.7	175.9	-62	0	0	0	0	111	F400 I402 I412 A414 S416 A417 S422 N423 L424 F447	F400-C420 VanDerWaalsContact CB-SG 3.52Å; F400-C420 PolarHBondContact O-SG 3.4Å; F400-C420 VanDerWaalsContact O-SG 3.35Å; I402-C420 HydrophobicContact CD1-CB 3.68Å; I402-C420 HydrophobicContact CG1-CB 3.91Å; I412-C420 HydrophobicContact CG2-CB 4.31Å; A414-C420 VanDerWaalsContact CB-SG 3.58Å; S416-C420 PolarHBondContact O-N 3.01Å; S416-C420 PolarHBondContact O-SG 3.01Å; A417-C420 PolarHBondContact O-N 3.21Å; C420-S422 PolarHBondContact O-N 3.29Å; C420-N423 PolarHBondContact O-N 2.93Å; C420-L424 PolarHBondContact O-N 3.14Å; C420-F447 HydrophobicContact CB-CE2 4.08Å; C420-F447 HydrophobicContact CB-CZ 4.28Å
421	H	97.8	Very high	95.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-38.3	179.9	-173.8	-166.5	0	0	0	111.9	A417 N423 L424 L425 S442 F446 S495	A417-H421 PolarHBondContact O-N 3Å; H421-N423 PolarHBondContact O-N 3.35Å; H421-L424 WeakPolarHBondContact O-CB 3.28Å; H421-L424 PolarHBondContact O-N 3.39Å; H421-L424 VanDerWaalsContact O-N 3.16Å; H421-L425 PolarHBondContact O-N 2.89Å; H421-S442 PolarHBondContact ND1-N 3.45Å; H421-S442 PolarHBondContact ND1-O 3.06Å; H421-F446 HydrophobicContact CB-CB 4.49Å; H421-F446 AromaticContact CD2-CD2 3.84Å; H421-F446 AromaticContact CE1-CD2 3.73Å; H421-F446 AromaticContact NE2-CD2 3.64Å; H421-S495 PolarHBondContact CE1-O 3.1Å; H421-S495 PolarHBondContact NE2-O 3.36Å; H421-S495 VanDerWaalsContact NE2-O 3.08Å
422	S	97.3	Very high	95.2	Very high	26 Å²	26	44.6 Å²	44.6	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-32.3	172.1	-61.8	0	0	0	0	113.2	L418 T419 C420 K426 P441	L418-S422 WeakPolarHBondContact O-CB 3.37Å; L418-S422 PolarHBondContact O-N 3.22Å; L418-S422 PolarHBondContact O-OG 2.84Å; T419-S422 PolarHBondContact O-N 2.74Å; C420-S422 PolarHBondContact O-N 3.29Å; S422-K426 VanDerWaalsContact O-CD 3.31Å; S422-K426 WeakPolarHBondContact O-CD 3.37Å; S422-K426 VanDerWaalsContact O-CE 3.24Å; S422-K426 WeakPolarHBondContact O-CE 3.34Å; S422-K426 WeakPolarHBondContact O-CG 3.38Å; S422-K426 PolarHBondContact O-N 3.42Å; S422-P441 WeakPolarHBondContact OG-CG 3.06Å
423	N	97	Very high	94.1	Very high	58 Å²	58	49.9 Å²	49.9	31%	0.31	31%	0.314	S	S	.	.	H	α-helix	trans	-83.5	-32.2	178	-70	-10.2	0	0	0	111.8	I412 T419 C420 H421 K426 A427	I412-N423 HydrophobicContact CG2-CB 3.87Å; T419-N423 WeakPolarHBondContact O-CB 3.14Å; T419-N423 VanDerWaalsContact O-CG 3.25Å; T419-N423 PolarHBondContact O-N 2.91Å; T419-N423 PolarHBondContact O-ND2 2.84Å; C420-N423 PolarHBondContact O-N 2.93Å; H421-N423 PolarHBondContact O-N 3.35Å; N423-K426 PolarHBondContact O-N 2.63Å; N423-K426 PolarHBondContact OD1-NZ 2.82Å; N423-A427 PolarHBondContact O-N 2.65Å
424	L	96.5	Very high	92.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60	-51.6	170.7	177.8	63	0	0	0	111.2	Y375 M378 Y387 I402 I412 C420 H421 K426 A427 I428 F446	Y375-L424 HydrophobicContact CD1-CD2 4.23Å; M378-L424 HydrophobicContact CG-CD1 3.5Å; M378-L424 HydrophobicContact SD-CD1 3.85Å; Y387-L424 HydrophobicContact CD1-CD1 4.36Å; Y387-L424 HydrophobicContact CE1-CD1 3.57Å; Y387-L424 HydrophobicContact CE1-CD2 4.48Å; I402-L424 HydrophobicContact CD1-CB 4.47Å; I402-L424 HydrophobicContact CD1-CD2 4.3Å; I402-L424 HydrophobicContact CG2-CD2 4.41Å; I412-L424 HydrophobicContact CD1-CB 3.83Å; I412-L424 HydrophobicContact CD1-CD1 4.13Å; C420-L424 PolarHBondContact O-N 3.14Å; H421-L424 WeakPolarHBondContact O-CB 3.28Å; H421-L424 PolarHBondContact O-N 3.39Å; H421-L424 VanDerWaalsContact O-N 3.16Å; L424-K426 VanDerWaalsContact C-N 3.29Å; L424-K426 PolarHBondContact O-N 2.99Å; L424-A427 PolarHBondContact O-N 2.69Å; L424-A427 VanDerWaalsContact O-N 3.09Å; L424-I428 HydrophobicContact CD1-CD1 3.89Å; L424-I428 HydrophobicContact CD1-CG1 4.31Å; L424-I428 HydrophobicContact CG-CD1 3.82Å; L424-I428 WeakPolarHBondContact O-CG1 3.32Å; L424-I428 PolarHBondContact O-N 3.45Å; L424-F446 HydrophobicContact CD2-CE1 3.95Å; L424-F446 HydrophobicContact CD2-CE2 3.67Å; L424-F446 HydrophobicContact CD2-CZ 3.33Å
425	L	95.1	Very high	91.4	Very high	21 Å²	21	55.3 Å²	55.3	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-60.4	-37.5	178.1	-66.3	179.5	0	0	0	112.2	Y375 H421 A429 I439 P441	Y375-L425 HydrophobicContact CE1-CD2 3.88Å; Y375-L425 VanDerWaalsContact OH-CD2 3.31Å; Y375-L425 WeakPolarHBondContact OH-CD2 3.39Å; H421-L425 PolarHBondContact O-N 2.89Å; L425-A429 WeakPolarHBondContact O-CB 3.19Å; L425-A429 PolarHBondContact O-N 2.83Å; L425-I439 HydrophobicContact CD1-CB 4.19Å; L425-I439 HydrophobicContact CD1-CG2 4Å; L425-I439 HydrophobicContact CD2-CG2 4.46Å; L425-P441 HydrophobicContact CD1-CB 3.9Å
426	K	94.1	Very high	90.2	Very high	120 Å²	120	52.7 Å²	52.7	52%	0.522	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-41.4	173.4	-70.9	166.2	-156.7	161.4	0	112.4	S422 N423 L424 A429 S430	S422-K426 VanDerWaalsContact O-CD 3.31Å; S422-K426 WeakPolarHBondContact O-CD 3.37Å; S422-K426 VanDerWaalsContact O-CE 3.24Å; S422-K426 WeakPolarHBondContact O-CE 3.34Å; S422-K426 WeakPolarHBondContact O-CG 3.38Å; S422-K426 PolarHBondContact O-N 3.42Å; N423-K426 PolarHBondContact O-N 2.63Å; N423-K426 PolarHBondContact OD1-NZ 2.82Å; L424-K426 VanDerWaalsContact C-N 3.29Å; L424-K426 PolarHBondContact O-N 2.99Å; K426-A429 PolarHBondContact O-N 3.24Å; K426-S430 WeakPolarHBondContact O-CB 3.38Å; K426-S430 PolarHBondContact O-N 2.91Å; K426-S430 PolarHBondContact O-OG 3.15Å
427	A	93.7	Very high	89.3	Confident	28 Å²	28	53.9 Å²	53.9	23%	0.231	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-47.2	178.8	0	0	0	0	0	111.2	M378 N423 L424 S430 N431	M378-A427 HydrophobicContact CB-CB 4.42Å; M378-A427 HydrophobicContact CG-CB 3.93Å; M378-A427 HydrophobicContact SD-CB 3.65Å; N423-A427 PolarHBondContact O-N 2.65Å; L424-A427 PolarHBondContact O-N 2.69Å; L424-A427 VanDerWaalsContact O-N 3.09Å; A427-S430 PolarHBondContact O-N 3.42Å; A427-N431 PolarHBondContact O-N 3Å; A427-N431 PolarHBondContact O-ND2 3.22Å
428	I	93.3	Very high	88.7	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-48.4	175	-62.2	163	0	0	0	110.3	Y375 A376 M378 P381 L424 S430 N431 S432 Y501	Y375-I428 HydrophobicContact CD1-CD1 3.8Å; Y375-I428 HydrophobicContact CE1-CD1 3.62Å; A376-I428 HydrophobicContact CB-CD1 4.31Å; A376-I428 HydrophobicContact CB-CG2 4.25Å; A376-I428 WeakPolarHBondContact O-CD1 3.4Å; M378-I428 HydrophobicContact CG-CG1 4.16Å; P381-I428 HydrophobicContact CB-CG2 3.85Å; P381-I428 HydrophobicContact CG-CG2 4Å; L424-I428 HydrophobicContact CD1-CD1 3.89Å; L424-I428 HydrophobicContact CD1-CG1 4.31Å; L424-I428 HydrophobicContact CG-CD1 3.82Å; L424-I428 WeakPolarHBondContact O-CG1 3.32Å; L424-I428 PolarHBondContact O-N 3.45Å; I428-S430 VanDerWaalsContact C-N 3.29Å; I428-S430 PolarHBondContact O-N 3.42Å; I428-N431 CarbonylContact O-C 3.6Å; I428-N431 PolarHBondContact O-N 3.09Å; I428-S432 PolarHBondContact O-N 3.37Å; I428-Y501 HydrophobicContact CG2-CE2 4.27Å; I428-Y501 WeakPolarHBondContact CG2-OH 3.44Å
429	A	91.4	Very high	88.4	Confident	64 Å²	64	56.7 Å²	56.7	53%	0.529	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-29.2	178.9	0	0	0	0	0	113.6	L425 K426 N431 S432	L425-A429 WeakPolarHBondContact O-CB 3.19Å; L425-A429 PolarHBondContact O-N 2.83Å; K426-A429 PolarHBondContact O-N 3.24Å; A429-N431 VanDerWaalsContact C-N 3.29Å; A429-N431 PolarHBondContact O-N 3.5Å; A429-S432 PolarHBondContact O-N 3.13Å
430	S	91.6	Very high	88.1	Confident	96 Å²	96	60.9 Å²	60.9	67%	0.671	38%	0.382	S	S	*	.	H	α-helix	trans	-70	-25.6	176.5	-58.1	0	0	0	0	113	K426 A427 I428	K426-S430 WeakPolarHBondContact O-CB 3.38Å; K426-S430 PolarHBondContact O-N 2.91Å; K426-S430 PolarHBondContact O-OG 3.15Å; A427-S430 PolarHBondContact O-N 3.42Å; I428-S430 VanDerWaalsContact C-N 3.29Å; I428-S430 PolarHBondContact O-N 3.42Å
431	N	89.3	Confident	88	Confident	98 Å²	98	62.6 Å²	62.6	52%	0.524	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	3.5	176.8	-64.4	-43.8	0	0	0	112.7	M378 P381 A427 I428 A429	M378-N431 PolarHBondContact O-ND2 3.1Å; P381-N431 HydrophobicContact CG-CB 4.48Å; A427-N431 PolarHBondContact O-N 3Å; A427-N431 PolarHBondContact O-ND2 3.22Å; I428-N431 CarbonylContact O-C 3.6Å; I428-N431 PolarHBondContact O-N 3.09Å; A429-N431 VanDerWaalsContact C-N 3.29Å; A429-N431 PolarHBondContact O-N 3.5Å
432	S	84.8	Confident	87.8	Confident	27 Å²	27	64.1 Å²	64.1	19%	0.189	40%	0.404	C	S	.	.			trans	-83.3	129.9	172.4	-167	0	0	0	0	110.5	I428 A429 Q434 Q505	I428-S432 PolarHBondContact O-N 3.37Å; A429-S432 PolarHBondContact O-N 3.13Å; S432-Q434 PolarHBondContact O-N 3.05Å; S432-Q505 PolarHBondContact OG-NE2 3.38Å; S432-Q505 VanDerWaalsContact OG-NE2 3.09Å
433	S	75.1	Confident	87.8	Confident	132 Å²	132	63 Å²	63	92%	0.923	40%	0.396	S	S	*	.	S	Bend	trans	-75.9	-5.7	174.9	53.7	0	0	0	0	113.8
434	Q	72	Confident	87.7	Confident	86 Å²	86	61.8 Å²	61.8	40%	0.402	39%	0.394	S	S	.	.	S	Bend	trans	-119.8	124	-166.8	-161.8	175.2	-29.2	0	0	111.7	S432 V436 Q505	S432-Q434 PolarHBondContact O-N 3.05Å; Q434-V436 HydrophobicContact CB-CG2 4.21Å; Q434-V436 HydrophobicContact CG-CG2 3.87Å; Q434-V436 PolarHBondContact O-N 3.16Å; Q434-V436 VanDerWaalsContact O-N 3.13Å; Q434-Q505 PolarHBondContact NE2-O 2.72Å; Q434-Q505 PolarHBondContact OE1-O 2.56Å
435	A	65.6	Low	87.7	Confident	111 Å²	111	63.6 Å²	63.6	92%	0.917	40%	0.404	S	S	*	.			trans	-77.6	97.7	177.8	0	0	0	0	0	110.7
436	V	71.5	Confident	87.8	Confident	48 Å²	48	62.6 Å²	62.6	29%	0.291	40%	0.399	S	S	.	.			trans	-115.1	163.2	-177	-179.3	0	0	0	0	110.1	Q434 H504	Q434-V436 HydrophobicContact CB-CG2 4.21Å; Q434-V436 HydrophobicContact CG-CG2 3.87Å; Q434-V436 PolarHBondContact O-N 3.16Å; Q434-V436 VanDerWaalsContact O-N 3.13Å; V436-H504 WeakPolarHBondContact CG1-ND1 3.26Å; V436-H504 WeakPolarHBondContact CG1-O 3.42Å
437	A	79.4	Confident	88	Confident	61 Å²	61	56.9 Å²	56.9	50%	0.504	37%	0.374	S	S	.	.			trans	-57	147.1	177.3	0	0	0	0	0	112.2	I439 H504	A437-I439 PolarHBondContact O-N 3.2Å; A437-H504 PolarHBondContact O-CE1 3.16Å
438	P	84.1	Confident	88.1	Confident	124 Å²	124	55.6 Å²	55.6	81%	0.805	36%	0.363	S	S	*	.			trans	-71.7	114.9	179.1	28.4	-33.7	0	0	0	111.1
439	I	90.5	Very high	88.3	Confident	32 Å²	32	56 Å²	56	16%	0.164	37%	0.365	C	S	.	.			trans	-64.5	134.3	173.8	-60.6	176.5	0	0	0	109.5	L425 A437 A494 Y501	L425-I439 HydrophobicContact CD1-CB 4.19Å; L425-I439 HydrophobicContact CD1-CG2 4Å; L425-I439 HydrophobicContact CD2-CG2 4.46Å; A437-I439 PolarHBondContact O-N 3.2Å; I439-A494 HydrophobicContact CD1-CB 4.21Å; I439-Y501 HydrophobicContact CD1-CD2 3.52Å; I439-Y501 HydrophobicContact CD1-CE2 3.77Å
440	I	92.9	Very high	88.4	Confident	146 Å²	146	53.7 Å²	53.7	75%	0.749	35%	0.345	S	S	*	.			trans	-77.7	123.4	178.3	-59	176.7	0	0	0	108.5	S442 S495	I440-S442 PolarHBondContact O-N 3.23Å; I440-S495 WeakPolarHBondContact O-CB 3.39Å
441	P	94.3	Very high	88.5	Confident	36 Å²	36	49.4 Å²	49.4	23%	0.234	31%	0.314	C	S	.	.			trans	-74.6	111.9	-177.8	26.7	-32.2	0	0	0	111.7	L418 S422 L425 G443	L418-P441 HydrophobicContact CD1-CB 4.14Å; L418-P441 HydrophobicContact CD1-CG 4.02Å; L418-P441 WeakPolarHBondContact CD1-O 3.49Å; S422-P441 WeakPolarHBondContact OG-CG 3.06Å; L425-P441 HydrophobicContact CD1-CB 3.9Å; P441-G443 PolarHBondContact O-N 3.47Å
442	S	95	Very high	88.7	Confident	32 Å²	32	45.9 Å²	45.9	22%	0.224	30%	0.297	C	S	.	.			trans	-92.5	90.4	161.6	-168.5	0	0	0	0	111.2	H421 I440 D445 F446	H421-S442 PolarHBondContact ND1-N 3.45Å; H421-S442 PolarHBondContact ND1-O 3.06Å; I440-S442 PolarHBondContact O-N 3.23Å; S442-D445 WeakPolarHBondContact OG-CB 3.48Å; S442-D445 VanDerWaalsContact OG-CG 3.3Å; S442-D445 PolarHBondContact OG-OD2 3.17Å; S442-F446 WeakPolarHBondContact O-CB 3.3Å; S442-F446 PolarHBondContact O-N 3.23Å; S442-F446 VanDerWaalsContact O-N 3.1Å
443	G	96.3	Very high	89.1	Confident	2 Å²	2	44.7 Å²	44.7	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-36.6	-178.4	0	0	0	0	0	114.1	A417 P441 F447	A417-G443 WeakPolarHBondContact O-CA 3.41Å; P441-G443 PolarHBondContact O-N 3.47Å; G443-F447 VanDerWaalsContact O-CD2 3.3Å; G443-F447 WeakPolarHBondContact O-CD2 3.38Å; G443-F447 PolarHBondContact O-N 2.99Å
444	A	96.4	Very high	90	Very high	32 Å²	32	38.4 Å²	38.4	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-70	-41.6	-178.7	0	0	0	0	0	112	G448 F449 S450	A444-G448 PolarHBondContact O-N 2.82Å; A444-F449 HydrophobicContact CB-CD2 4.3Å; A444-F449 HydrophobicContact CB-CE2 3.56Å; A444-F449 HydrophobicContact CB-CZ 3.85Å; A444-F449 PolarHBondContact O-N 3.16Å; A444-S450 PolarHBondContact O-OG 3.09Å; A444-S450 VanDerWaalsContact O-OG 3.07Å
445	D	95.5	Very high	91.1	Very high	39 Å²	39	35 Å²	35	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-72.9	-32.9	179.2	-59.8	-45.2	0	0	0	111.4	R373 S442 G448 S450 L489 I496	R373-D445 PolarHBondContact NH2-O 3.48Å; S442-D445 WeakPolarHBondContact OG-CB 3.48Å; S442-D445 VanDerWaalsContact OG-CG 3.3Å; S442-D445 PolarHBondContact OG-OD2 3.17Å; D445-G448 PolarHBondContact O-N 2.75Å; D445-S450 VanDerWaalsContact CA-OG 3.28Å; D445-S450 WeakPolarHBondContact CA-OG 3.41Å; D445-S450 PolarHBondContact N-OG 3.45Å; D445-S450 VanDerWaalsContact N-OG 3.13Å; D445-S450 WeakPolarHBondContact OD1-CB 3.36Å; D445-S450 PolarHBondContact OD1-OG 3.46Å; D445-L489 HydrophobicContact CB-CD1 4.09Å; D445-I496 HydrophobicContact CB-CD1 4.17Å; D445-I496 HydrophobicContact CB-CG2 4.13Å
446	F	97.3	Very high	92.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-51.4	172.5	-165.4	-81.5	0	0	0	111.4	R373 Y375 Y387 I402 H421 L424 S442 G448 I496	R373-F446 HydrophobicContact CG-CE2 4.5Å; R373-F446 HydrophobicContact CG-CZ 4.44Å; R373-F446 PolarHBondContact NE-O 3.08Å; Y375-F446 AromaticContact CD1-CE2 3.87Å; Y375-F446 HydrophobicContact CD1-CE2 3.87Å; Y375-F446 HydrophobicContact CD1-CZ 4.43Å; Y375-F446 HydrophobicContact CD2-CE2 4.21Å; Y375-F446 HydrophobicContact CE1-CE2 4.45Å; Y375-F446 AromaticContact CG-CE2 3.73Å; Y375-F446 HydrophobicContact CG-CE2 3.73Å; Y375-F446 HydrophobicContact CG-CZ 4.32Å; Y387-F446 HydrophobicContact CD2-CZ 4.29Å; Y387-F446 HydrophobicContact CG-CZ 4.36Å; I402-F446 HydrophobicContact CD1-CD1 4.05Å; I402-F446 HydrophobicContact CD1-CE1 4.01Å; I402-F446 HydrophobicContact CG2-CE1 4.37Å; H421-F446 HydrophobicContact CB-CB 4.49Å; H421-F446 AromaticContact CD2-CD2 3.84Å; H421-F446 AromaticContact CE1-CD2 3.73Å; H421-F446 AromaticContact NE2-CD2 3.64Å; L424-F446 HydrophobicContact CD2-CE1 3.95Å; L424-F446 HydrophobicContact CD2-CE2 3.67Å; L424-F446 HydrophobicContact CD2-CZ 3.33Å; S442-F446 WeakPolarHBondContact O-CB 3.3Å; S442-F446 PolarHBondContact O-N 3.23Å; S442-F446 VanDerWaalsContact O-N 3.1Å; F446-G448 VanDerWaalsContact C-N 3.27Å; F446-G448 PolarHBondContact O-N 3Å; F446-I496 HydrophobicContact CB-CG2 4.13Å; F446-I496 HydrophobicContact CD2-CG2 4.32Å
447	F	97.9	Very high	93.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.3	-27.1	174.1	-83.6	-113.7	0	0	0	113	F369 S371 C389 I391 F400 E401 I402 A417 C420 G443 F449	F369-F447 WeakPolarHBondContact CE1-O 3.31Å; S371-F447 PolarHBondContact OG-O 3.12Å; C389-F447 HydrophobicContact CB-CD1 3.73Å; C389-F447 HydrophobicContact CB-CD2 4.44Å; C389-F447 HydrophobicContact CB-CE1 3.94Å; C389-F447 HydrophobicContact CB-CG 4Å; C389-F447 HydrophobicContact CB-CZ 4.39Å; I391-F447 HydrophobicContact CG1-CD1 4.42Å; F400-F447 HydrophobicContact CB-CE1 4.11Å; F400-F447 HydrophobicContact CB-CZ 3.84Å; F400-F447 HydrophobicContact CD1-CD1 4.24Å; F400-F447 AromaticContact CD1-CE1 3.85Å; F400-F447 HydrophobicContact CD1-CE1 3.85Å; F400-F447 HydrophobicContact CD1-CZ 4.16Å; F400-F447 HydrophobicContact CG-CE1 4.49Å; F400-F447 HydrophobicContact CG-CZ 4.5Å; E401-F447 WeakPolarHBondContact O-CZ 3.43Å; I402-F447 HydrophobicContact CD1-CE2 3.84Å; I402-F447 HydrophobicContact CD1-CZ 4.45Å; I402-F447 HydrophobicContact CG1-CE2 3.6Å; I402-F447 HydrophobicContact CG1-CZ 3.74Å; A417-F447 HydrophobicContact CB-CD2 3.7Å; A417-F447 HydrophobicContact CB-CE2 3.84Å; A417-F447 HydrophobicContact CB-CG 4.15Å; A417-F447 HydrophobicContact CB-CZ 4.41Å; C420-F447 HydrophobicContact CB-CE2 4.08Å; C420-F447 HydrophobicContact CB-CZ 4.28Å; G443-F447 VanDerWaalsContact O-CD2 3.3Å; G443-F447 WeakPolarHBondContact O-CD2 3.38Å; G443-F447 PolarHBondContact O-N 2.99Å; F447-F449 HydrophobicContact CB-CD1 3.52Å; F447-F449 HydrophobicContact CB-CE1 3.51Å; F447-F449 HydrophobicContact CD1-CD1 4.46Å; F447-F449 HydrophobicContact CD1-CE1 4.2Å; F447-F449 HydrophobicContact CG-CD1 4.29Å; F447-F449 AromaticContact CG-CE1 3.93Å; F447-F449 HydrophobicContact CG-CE1 3.93Å
448	G	96.2	Very high	94.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	89	-3.4	175.8	0	0	0	0	0	116	A444 D445 F446 S450 H451 I454	A444-G448 PolarHBondContact O-N 2.82Å; D445-G448 PolarHBondContact O-N 2.75Å; F446-G448 VanDerWaalsContact C-N 3.27Å; F446-G448 PolarHBondContact O-N 3Å; G448-S450 PolarHBondContact O-N 2.84Å; G448-H451 WeakPolarHBondContact O-CB 3.46Å; G448-H451 PolarHBondContact O-N 3.44Å; G448-I454 WeakPolarHBondContact O-CB 3.13Å
449	F	96.3	Very high	94.8	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.039	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15	-179.9	58.8	-107.9	0	0	0	114.1	A363 Y365 F369 I391 F400 A417 A444 F447 I458	A363-F449 HydrophobicContact CB-CD2 4.33Å; A363-F449 HydrophobicContact CB-CE2 4.16Å; Y365-F449 HydrophobicContact CD1-CE2 4.24Å; Y365-F449 HydrophobicContact CD1-CZ 4.19Å; Y365-F449 HydrophobicContact CE1-CD2 4.5Å; Y365-F449 AromaticContact CE1-CE2 3.71Å; Y365-F449 HydrophobicContact CE1-CE2 3.71Å; Y365-F449 AromaticContact CE1-CZ 3.79Å; Y365-F449 HydrophobicContact CE1-CZ 3.79Å; F369-F449 HydrophobicContact CE1-CB 4.49Å; F369-F449 HydrophobicContact CE2-CB 4.04Å; F369-F449 HydrophobicContact CZ-CB 3.96Å; I391-F449 HydrophobicContact CD1-CD1 3.99Å; I391-F449 HydrophobicContact CD1-CE1 4.22Å; F400-F449 HydrophobicContact CD1-CE1 4.45Å; F400-F449 AromaticContact CE1-CE1 3.88Å; F400-F449 HydrophobicContact CE1-CE1 3.88Å; F400-F449 HydrophobicContact CE1-CZ 4.14Å; A417-F449 HydrophobicContact CB-CE1 3.86Å; A417-F449 HydrophobicContact CB-CZ 3.79Å; A444-F449 HydrophobicContact CB-CD2 4.3Å; A444-F449 HydrophobicContact CB-CE2 3.56Å; A444-F449 HydrophobicContact CB-CZ 3.85Å; A444-F449 PolarHBondContact O-N 3.16Å; F447-F449 HydrophobicContact CB-CD1 3.52Å; F447-F449 HydrophobicContact CB-CE1 3.51Å; F447-F449 HydrophobicContact CD1-CD1 4.46Å; F447-F449 HydrophobicContact CD1-CE1 4.2Å; F447-F449 HydrophobicContact CG-CD1 4.29Å; F447-F449 AromaticContact CG-CE1 3.93Å; F447-F449 HydrophobicContact CG-CE1 3.93Å; F449-I458 HydrophobicContact CB-CD1 3.87Å
450	S	94.6	Very high	94.9	Very high	16 Å²	16	25 Å²	25	11%	0.112	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.9	169.2	48.9	0	0	0	0	114.1	A444 D445 G448	A444-S450 PolarHBondContact O-OG 3.09Å; A444-S450 VanDerWaalsContact O-OG 3.07Å; D445-S450 VanDerWaalsContact CA-OG 3.28Å; D445-S450 WeakPolarHBondContact CA-OG 3.41Å; D445-S450 PolarHBondContact N-OG 3.45Å; D445-S450 VanDerWaalsContact N-OG 3.13Å; D445-S450 WeakPolarHBondContact OD1-CB 3.36Å; D445-S450 PolarHBondContact OD1-OG 3.46Å; G448-S450 PolarHBondContact O-N 2.84Å
451	H	94	Very high	94.9	Very high	7 Å²	7	19.5 Å²	19.5	3%	0.032	12%	0.123	C	C	.	.	S	Bend	trans	-57.8	129.2	178.1	-177.2	-74.8	0	0	0	109.1	L343 G448 T453 I454 Q455 S488 L489	L343-H451 HydrophobicContact CD2-CB 4.32Å; G448-H451 WeakPolarHBondContact O-CB 3.46Å; G448-H451 PolarHBondContact O-N 3.44Å; H451-T453 VanDerWaalsContact C-N 3.32Å; H451-T453 PolarHBondContact CE1-OG1 3.03Å; H451-T453 PolarHBondContact ND1-N 3.25Å; H451-T453 PolarHBondContact O-N 3.12Å; H451-T453 VanDerWaalsContact O-N 3.11Å; H451-I454 HydrophobicContact CB-CB 4.35Å; H451-I454 HydrophobicContact CB-CG1 4.17Å; H451-I454 PolarHBondContact O-N 2.78Å; H451-Q455 PolarHBondContact O-N 3.15Å; H451-S488 PolarHBondContact NE2-OG 3.02Å; H451-L489 HydrophobicContact CB-CD1 3.74Å; H451-L489 HydrophobicContact CB-CG 4.39Å
452	P	92.8	Very high	94.8	Very high	24 Å²	24	23.5 Å²	23.5	16%	0.156	15%	0.149	C	C	.	.	H	α-helix	trans	-46.9	-48.7	-172.1	-33.8	37.2	0	0	0	114.9	R321 L322 V323 Q455 N456 F475	R321-P452 HydrophobicContact CB-CB 4.27Å; R321-P452 HydrophobicContact CB-CG 4.49Å; L322-P452 WeakPolarHBondContact O-CB 3.46Å; V323-P452 HydrophobicContact CG2-CB 4.24Å; P452-Q455 PolarHBondContact O-N 3.32Å; P452-N456 VanDerWaalsContact O-CB 3.31Å; P452-N456 WeakPolarHBondContact O-CB 3.35Å; P452-N456 PolarHBondContact O-N 3.05Å; P452-F475 HydrophobicContact CB-CD1 4.28Å; P452-F475 HydrophobicContact CB-CE1 4.08Å; P452-F475 WeakPolarHBondContact O-CE1 3.32Å
453	T	92.6	Very high	94.7	Very high	2 Å²	2	23 Å²	23	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-55.5	-52.2	175.2	-51.2	0	0	0	0	112.3	V323 Q324 I326 H451 N456 L457	V323-T453 HydrophobicContact CG1-CG2 4.16Å; Q324-T453 PolarHBondContact N-OG1 3.19Å; I326-T453 HydrophobicContact CG2-CG2 3.48Å; I326-T453 VanDerWaalsContact CG2-CG2 3.48Å; H451-T453 VanDerWaalsContact C-N 3.32Å; H451-T453 PolarHBondContact CE1-OG1 3.03Å; H451-T453 PolarHBondContact ND1-N 3.25Å; H451-T453 PolarHBondContact O-N 3.12Å; H451-T453 VanDerWaalsContact O-N 3.11Å; T453-N456 WeakPolarHBondContact O-CB 3.47Å; T453-N456 PolarHBondContact O-N 3.16Å; T453-L457 WeakPolarHBondContact O-CG 3.25Å; T453-L457 PolarHBondContact O-N 3.25Å; T453-L457 VanDerWaalsContact O-N 3.11Å
454	I	95.3	Very high	94.7	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.7	-41.4	-176.4	-56.4	-55.7	0	0	0	111.1	I338 L340 V345 L348 F369 G448 H451 N456 L457 I458	I338-I454 HydrophobicContact CD1-CD1 4.36Å; I338-I454 HydrophobicContact CG2-CD1 4.34Å; L340-I454 HydrophobicContact CD1-CD1 3.64Å; L340-I454 HydrophobicContact CD1-CG1 3.58Å; V345-I454 HydrophobicContact CB-CD1 4.11Å; V345-I454 HydrophobicContact CG1-CD1 4.41Å; V345-I454 HydrophobicContact CG2-CD1 3.67Å; V345-I454 HydrophobicContact CG2-CG1 3.98Å; L348-I454 HydrophobicContact CD2-CG2 3.86Å; F369-I454 HydrophobicContact CE2-CG2 3.76Å; F369-I454 HydrophobicContact CZ-CG2 4.23Å; G448-I454 WeakPolarHBondContact O-CB 3.13Å; H451-I454 HydrophobicContact CB-CB 4.35Å; H451-I454 HydrophobicContact CB-CG1 4.17Å; H451-I454 PolarHBondContact O-N 2.78Å; I454-N456 VanDerWaalsContact C-N 3.31Å; I454-N456 PolarHBondContact O-N 3.4Å; I454-L457 HydrophobicContact CD1-CD1 4.47Å; I454-L457 PolarHBondContact O-N 3.49Å; I454-L457 VanDerWaalsContact O-N 3.1Å; I454-I458 HydrophobicContact CG2-CD1 4.02Å; I454-I458 HydrophobicContact CG2-CG1 4.47Å; I454-I458 WeakPolarHBondContact O-CG1 3.45Å; I454-I458 PolarHBondContact O-N 2.95Å
455	Q	95	Very high	94.6	Very high	14 Å²	14	31.9 Å²	31.9	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-39.3	177.1	-162.9	178.2	37	0	0	111.7	C362 H451 P452 I458 Q459 F475	C362-Q455 PolarHBondContact O-NE2 3.46Å; H451-Q455 PolarHBondContact O-N 3.15Å; P452-Q455 PolarHBondContact O-N 3.32Å; Q455-I458 PolarHBondContact O-N 2.9Å; Q455-Q459 WeakPolarHBondContact O-CG 3.49Å; Q455-Q459 PolarHBondContact O-N 3.49Å; Q455-F475 HydrophobicContact CB-CE1 4.49Å; Q455-F475 HydrophobicContact CB-CZ 3.84Å; Q455-F475 HydrophobicContact CG-CZ 3.94Å
456	N	93.9	Very high	94.5	Very high	42 Å²	42	36.7 Å²	36.7	23%	0.225	20%	0.195	C	C	.	.	H	α-helix	trans	-64.9	-37	172.9	-178.9	67.4	0	0	0	112.9	V323 P452 T453 I454 S460 F475	V323-N456 HydrophobicContact CG2-CB 4.02Å; P452-N456 VanDerWaalsContact O-CB 3.31Å; P452-N456 WeakPolarHBondContact O-CB 3.35Å; P452-N456 PolarHBondContact O-N 3.05Å; T453-N456 WeakPolarHBondContact O-CB 3.47Å; T453-N456 PolarHBondContact O-N 3.16Å; I454-N456 VanDerWaalsContact C-N 3.31Å; I454-N456 PolarHBondContact O-N 3.4Å; N456-S460 PolarHBondContact O-N 3.17Å; N456-S460 VanDerWaalsContact O-N 3.17Å; N456-S460 PolarHBondContact O-OG 3.2Å; N456-F475 HydrophobicContact CB-CB 4.23Å; N456-F475 HydrophobicContact CB-CD1 4.19Å; N456-F475 HydrophobicContact CB-CD2 3.49Å; N456-F475 VanDerWaalsContact CB-CD2 3.49Å; N456-F475 HydrophobicContact CB-CE1 4.47Å; N456-F475 HydrophobicContact CB-CE2 3.79Å; N456-F475 HydrophobicContact CB-CG 3.7Å; N456-F475 HydrophobicContact CB-CZ 4.29Å; N456-F475 VanDerWaalsContact OD1-CD2 3.24Å; N456-F475 WeakPolarHBondContact OD1-CD2 3.04Å
457	L	94.2	Very high	94.4	Very high	18 Å²	18	36.9 Å²	36.9	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-42.8	175.4	-63.9	177.6	0	0	0	112.1	I326 P334 I338 L348 T453 I454 Q459 S460 C461	I326-L457 HydrophobicContact CD1-CD1 3.63Å; I326-L457 HydrophobicContact CD1-CD2 3.72Å; I326-L457 HydrophobicContact CD1-CG 4.18Å; P334-L457 HydrophobicContact CB-CD1 4.3Å; P334-L457 HydrophobicContact CG-CD1 3.99Å; P334-L457 HydrophobicContact CG-CD2 3.71Å; P334-L457 HydrophobicContact CG-CG 4.39Å; I338-L457 HydrophobicContact CD1-CD1 3.55Å; L348-L457 HydrophobicContact CD1-CB 3.59Å; L348-L457 HydrophobicContact CD1-CD1 4.11Å; L348-L457 HydrophobicContact CD1-CG 4.45Å; L348-L457 HydrophobicContact CD2-CB 4.24Å; T453-L457 WeakPolarHBondContact O-CG 3.25Å; T453-L457 PolarHBondContact O-N 3.25Å; T453-L457 VanDerWaalsContact O-N 3.11Å; I454-L457 HydrophobicContact CD1-CD1 4.47Å; I454-L457 PolarHBondContact O-N 3.49Å; I454-L457 VanDerWaalsContact O-N 3.1Å; L457-Q459 VanDerWaalsContact C-N 3.32Å; L457-Q459 PolarHBondContact O-N 3.44Å; L457-S460 CarbonylContact O-C 3.6Å; L457-S460 WeakPolarHBondContact O-CA 3.43Å; L457-S460 WeakPolarHBondContact O-CB 3.42Å; L457-S460 PolarHBondContact O-N 3.35Å; L457-C461 PolarHBondContact O-N 3.02Å; L457-C461 VanDerWaalsContact O-N 3.08Å; L457-C461 PolarHBondContact O-SG 3.26Å
458	I	95.7	Very high	94.1	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-41.1	175.6	-65.3	170	0	0	0	110.6	L348 I351 I364 P366 F369 F449 I454 Q455 S460 C461	L348-I458 HydrophobicContact CD2-CG1 4.12Å; I351-I458 HydrophobicContact CD1-CG2 4.31Å; I351-I458 WeakPolarHBondContact CD1-O 3.24Å; I364-I458 HydrophobicContact CB-CG2 3.83Å; I364-I458 HydrophobicContact CD1-CG2 4.48Å; I364-I458 HydrophobicContact CG2-CG2 4.11Å; P366-I458 HydrophobicContact CG-CD1 4.39Å; P366-I458 HydrophobicContact CG-CG1 4.34Å; P366-I458 HydrophobicContact CG-CG2 3.91Å; F369-I458 HydrophobicContact CD2-CD1 4.27Å; F369-I458 HydrophobicContact CE2-CD1 4.17Å; F449-I458 HydrophobicContact CB-CD1 3.87Å; I454-I458 HydrophobicContact CG2-CD1 4.02Å; I454-I458 HydrophobicContact CG2-CG1 4.47Å; I454-I458 WeakPolarHBondContact O-CG1 3.45Å; I454-I458 PolarHBondContact O-N 2.95Å; Q455-I458 PolarHBondContact O-N 2.9Å; I458-S460 PolarHBondContact O-N 2.83Å; I458-C461 WeakPolarHBondContact O-CB 3.45Å; I458-C461 PolarHBondContact O-N 3.2Å
459	Q	94.4	Very high	93.8	Very high	14 Å²	14	46.1 Å²	46.1	7%	0.065	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-30	171	-77.9	-173.8	6.2	0	0	114.1	Q455 L457 A464 Y470 W472 I473	Q455-Q459 WeakPolarHBondContact O-CG 3.49Å; Q455-Q459 PolarHBondContact O-N 3.49Å; L457-Q459 VanDerWaalsContact C-N 3.32Å; L457-Q459 PolarHBondContact O-N 3.44Å; Q459-A464 WeakPolarHBondContact O-CB 3.28Å; Q459-Y470 HydrophobicContact CG-CE1 3.7Å; Q459-Y470 WeakPolarHBondContact CG-OH 3.39Å; Q459-Y470 PolarHBondContact NE2-OH 3.38Å; Q459-W472 HydrophobicContact CB-CZ3 4.09Å; Q459-W472 HydrophobicContact CG-CZ3 4.47Å; Q459-W472 WeakPolarHBondContact O-CH2 3.45Å; Q459-I473 PolarHBondContact NE2-O 2.67Å; Q459-I473 PolarHBondContact OE1-O 2.86Å; Q459-I473 VanDerWaalsContact OE1-O 3.14Å
460	S	92	Very high	93.8	Very high	86 Å²	86	46.2 Å²	46.2	60%	0.601	25%	0.253	S	S	*	.	H	α-helix	trans	-82.1	-14.8	-179.5	-57.9	0	0	0	0	112.8	N456 L457 I458	N456-S460 PolarHBondContact O-N 3.17Å; N456-S460 VanDerWaalsContact O-N 3.17Å; N456-S460 PolarHBondContact O-OG 3.2Å; L457-S460 CarbonylContact O-C 3.6Å; L457-S460 WeakPolarHBondContact O-CA 3.43Å; L457-S460 WeakPolarHBondContact O-CB 3.42Å; L457-S460 PolarHBondContact O-N 3.35Å; I458-S460 PolarHBondContact O-N 2.83Å
461	C	92.5	Very high	93.8	Very high	29 Å²	29	52.9 Å²	52.9	20%	0.196	28%	0.275	C	S	.	.	S	Bend	trans	-69.3	149.5	-179.5	-71.4	0	0	0	0	113	I351 L457 I458 G463 A464	I351-C461 HydrophobicContact CD1-CB 3.68Å; I351-C461 HydrophobicContact CG1-CB 4.29Å; L457-C461 PolarHBondContact O-N 3.02Å; L457-C461 VanDerWaalsContact O-N 3.08Å; L457-C461 PolarHBondContact O-SG 3.26Å; I458-C461 WeakPolarHBondContact O-CB 3.45Å; I458-C461 PolarHBondContact O-N 3.2Å; C461-G463 PolarHBondContact O-N 3.32Å; C461-A464 PolarHBondContact O-N 3.07Å
462	P	93.7	Very high	93.8	Very high	121 Å²	121	57.9 Å²	57.9	79%	0.786	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	134.6	170	-24.3	34.4	0	0	0	111.4
463	G	92.8	Very high	93.7	Very high	21 Å²	21	58.7 Å²	58.7	22%	0.216	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.8	-31	-179.3	0	0	0	0	0	114.8	T353 C461 R465 K466	T353-G463 WeakPolarHBondContact CG2-O 3.32Å; C461-G463 PolarHBondContact O-N 3.32Å; G463-R465 PolarHBondContact O-N 3.23Å; G463-K466 WeakPolarHBondContact O-CB 3.37Å; G463-K466 PolarHBondContact O-N 3.39Å
464	A	94.9	Very high	93.4	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.008	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-52.6	-35.5	-175.6	0	0	0	0	0	114.2	I351 I364 Q459 C461 K466 C467 W472	I351-A464 HydrophobicContact CD1-CB 3.73Å; I364-A464 HydrophobicContact CD1-CB 3.92Å; Q459-A464 WeakPolarHBondContact O-CB 3.28Å; C461-A464 PolarHBondContact O-N 3.07Å; A464-K466 PolarHBondContact O-N 3.24Å; A464-C467 WeakPolarHBondContact O-CB 3.12Å; A464-C467 PolarHBondContact O-N 2.9Å; A464-W472 HydrophobicContact CB-CH2 4.19Å; A464-W472 HydrophobicContact CB-CZ2 4.16Å
465	R	94.1	Very high	93	Very high	219 Å²	219	69 Å²	69	83%	0.826	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-69.6	-6.6	177.1	-66.8	-178.7	-178.2	-90.8	-0.5	115.1	G463 W472	G463-R465 PolarHBondContact O-N 3.23Å; R465-W472 HydrophobicContact CB-CZ2 4.38Å; R465-W472 HydrophobicContact CG-CH2 3.82Å; R465-W472 HydrophobicContact CG-CZ2 3.67Å
466	K	95.3	Very high	92.3	Very high	141 Å²	141	70.3 Å²	70.3	61%	0.613	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-97.5	-11.8	173.7	-55.5	-175.9	-165.9	165.7	0	113	T353 G463 A464 S468	T353-K466 HydrophobicContact CG2-CB 3.91Å; T353-K466 HydrophobicContact CG2-CD 3.96Å; T353-K466 HydrophobicContact CG2-CG 4.4Å; T353-K466 WeakPolarHBondContact OG1-CD 3.41Å; T353-K466 PolarHBondContact OG1-NZ 2.76Å; G463-K466 WeakPolarHBondContact O-CB 3.37Å; G463-K466 PolarHBondContact O-N 3.39Å; A464-K466 PolarHBondContact O-N 3.24Å; K466-S468 VanDerWaalsContact C-N 3.35Å; K466-S468 PolarHBondContact O-N 3.35Å
467	C	93.7	Very high	91.4	Very high	4 Å²	4	72.9 Å²	72.9	3%	0.027	36%	0.359	C	S	.	.			trans	-73	86.3	178.4	-60.5	0	0	0	0	109.4	Y359 I364 A464 N469 Y470	Y359-C467 HydrophobicContact CD1-CB 3.85Å; Y359-C467 VanDerWaalsContact CD1-SG 3.51Å; Y359-C467 HydrophobicContact CD2-CB 3.7Å; Y359-C467 HydrophobicContact CE1-CB 4.14Å; Y359-C467 HydrophobicContact CE2-CB 4Å; Y359-C467 HydrophobicContact CG-CB 3.62Å; I364-C467 HydrophobicContact CD1-CB 4.21Å; I364-C467 HydrophobicContact CG1-CB 4.35Å; A464-C467 WeakPolarHBondContact O-CB 3.12Å; A464-C467 PolarHBondContact O-N 2.9Å; C467-N469 PolarHBondContact O-N 2.93Å; C467-N469 VanDerWaalsContact O-N 3.17Å; C467-Y470 WeakPolarHBondContact O-CB 3.47Å; C467-Y470 PolarHBondContact O-N 3.38Å; C467-Y470 VanDerWaalsContact O-N 3.11Å
468	S	91.4	Very high	90	Very high	95 Å²	95	73 Å²	73	66%	0.664	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.6	-166	56.4	0	0	0	0	114.5	K466	K466-S468 VanDerWaalsContact C-N 3.35Å; K466-S468 PolarHBondContact O-N 3.35Å
469	N	91.5	Very high	88.3	Confident	98 Å²	98	80.6 Å²	80.6	52%	0.524	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.5	-174.5	-58.3	7.5	0	0	0	111.8	Y359 E361 C467 R471	Y359-N469 HydrophobicContact CD2-CB 4.42Å; Y359-N469 HydrophobicContact CE2-CB 4.25Å; E361-N469 WeakPolarHBondContact CA-O 3.3Å; C467-N469 PolarHBondContact O-N 2.93Å; C467-N469 VanDerWaalsContact O-N 3.17Å; N469-R471 PolarHBondContact O-N 3.41Å
470	Y	95.6	Very high	85.8	Confident	11 Å²	11	89 Å²	89	4%	0.043	43%	0.428	C	S	.	.			trans	-72.7	122.3	-173.2	177.1	-100.7	0	0	0	112.2	D360 I364 Q459 C467 W472	D360-Y470 WeakPolarHBondContact O-CA 3.29Å; I364-Y470 HydrophobicContact CD1-CD1 3.91Å; I364-Y470 HydrophobicContact CD1-CD2 4.2Å; I364-Y470 HydrophobicContact CD1-CE1 4.22Å; I364-Y470 HydrophobicContact CD1-CE2 4.48Å; I364-Y470 HydrophobicContact CD1-CG 3.89Å; I364-Y470 HydrophobicContact CG1-CD1 4.28Å; I364-Y470 HydrophobicContact CG1-CD2 3.65Å; I364-Y470 HydrophobicContact CG1-CE2 4.07Å; I364-Y470 HydrophobicContact CG1-CG 3.76Å; Q459-Y470 HydrophobicContact CG-CE1 3.7Å; Q459-Y470 WeakPolarHBondContact CG-OH 3.39Å; Q459-Y470 PolarHBondContact NE2-OH 3.38Å; C467-Y470 WeakPolarHBondContact O-CB 3.47Å; C467-Y470 PolarHBondContact O-N 3.38Å; C467-Y470 VanDerWaalsContact O-N 3.11Å; Y470-W472 HydrophobicContact CD1-CG 4.45Å; Y470-W472 HydrophobicContact CE1-CG 4.48Å; Y470-W472 PolarHBondContact O-N 3.47Å
471	R	94.6	Very high	83.8	Confident	157 Å²	157	88.6 Å²	88.6	59%	0.592	44%	0.438	S	S	*	.			trans	-81	106.7	179.5	-172	178.8	59.6	-170.7	-5.5	110.5	E361 N469 I473	E361-R471 WeakPolarHBondContact O-CB 3.35Å; E361-R471 PolarHBondContact O-N 2.87Å; N469-R471 PolarHBondContact O-N 3.41Å; R471-I473 PolarHBondContact O-N 3Å
472	W	93.2	Very high	81.6	Confident	112 Å²	112	92.6 Å²	92.6	42%	0.424	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-59.8	124.7	175.3	-73.7	71.3	0	0	0	111.7	Q459 A464 R465 Y470	Q459-W472 HydrophobicContact CB-CZ3 4.09Å; Q459-W472 HydrophobicContact CG-CZ3 4.47Å; Q459-W472 WeakPolarHBondContact O-CH2 3.45Å; A464-W472 HydrophobicContact CB-CH2 4.19Å; A464-W472 HydrophobicContact CB-CZ2 4.16Å; R465-W472 HydrophobicContact CB-CZ2 4.38Å; R465-W472 HydrophobicContact CG-CH2 3.82Å; R465-W472 HydrophobicContact CG-CZ2 3.67Å; Y470-W472 HydrophobicContact CD1-CG 4.45Å; Y470-W472 HydrophobicContact CE1-CG 4.48Å; Y470-W472 PolarHBondContact O-N 3.47Å
473	I	90.8	Very high	79.2	Confident	40 Å²	40	90.5 Å²	90.5	21%	0.205	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-101	139.8	176.4	-61.3	169.2	0	0	0	108.5	Q459 R471 F475	Q459-I473 PolarHBondContact NE2-O 2.67Å; Q459-I473 PolarHBondContact OE1-O 2.86Å; Q459-I473 VanDerWaalsContact OE1-O 3.14Å; R471-I473 PolarHBondContact O-N 3Å; I473-F475 HydrophobicContact CB-CE2 3.93Å; I473-F475 HydrophobicContact CB-CZ 4.01Å; I473-F475 HydrophobicContact CD1-CZ 4.49Å; I473-F475 HydrophobicContact CG2-CD2 4.4Å; I473-F475 HydrophobicContact CG2-CE1 4.07Å; I473-F475 HydrophobicContact CG2-CE2 3.97Å; I473-F475 HydrophobicContact CG2-CZ 3.77Å
474	R	87.9	Confident	76.7	Confident	192 Å²	192	98.3 Å²	98.3	73%	0.725	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-90	123.3	170.2	178.2	176.6	166.8	146.5	-1.2	109.8	E476	R474-E476 IonicContact CZ-OE1 2.91Å; R474-E476 IonicContact NE-OE1 2.65Å; R474-E476 PolarHBondContact NE-OE1 3.14Å; R474-E476 IonicContact NH2-OE1 3.17Å; R474-E476 PolarHBondContact NH2-OE1 2.84Å
475	F	86.6	Confident	74.4	Confident	26 Å²	26	102.5 Å²	102.5	11%	0.114	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	153.7	174	-64.4	-80.6	0	0	0	111.1	R321 V323 P452 Q455 N456 I473	R321-F475 HydrophobicContact CB-CD1 3.5Å; R321-F475 HydrophobicContact CB-CE1 3.62Å; R321-F475 HydrophobicContact CG-CE1 4.32Å; R321-F475 WeakPolarHBondContact O-CA 3.47Å; V323-F475 HydrophobicContact CG2-CB 3.69Å; V323-F475 HydrophobicContact CG2-CD1 3.63Å; V323-F475 HydrophobicContact CG2-CG 3.89Å; P452-F475 HydrophobicContact CB-CD1 4.28Å; P452-F475 HydrophobicContact CB-CE1 4.08Å; P452-F475 WeakPolarHBondContact O-CE1 3.32Å; Q455-F475 HydrophobicContact CB-CE1 4.49Å; Q455-F475 HydrophobicContact CB-CZ 3.84Å; Q455-F475 HydrophobicContact CG-CZ 3.94Å; N456-F475 HydrophobicContact CB-CB 4.23Å; N456-F475 HydrophobicContact CB-CD1 4.19Å; N456-F475 HydrophobicContact CB-CD2 3.49Å; N456-F475 VanDerWaalsContact CB-CD2 3.49Å; N456-F475 HydrophobicContact CB-CE1 4.47Å; N456-F475 HydrophobicContact CB-CE2 3.79Å; N456-F475 HydrophobicContact CB-CG 3.7Å; N456-F475 HydrophobicContact CB-CZ 4.29Å; N456-F475 VanDerWaalsContact OD1-CD2 3.24Å; N456-F475 WeakPolarHBondContact OD1-CD2 3.04Å; I473-F475 HydrophobicContact CB-CE2 3.93Å; I473-F475 HydrophobicContact CB-CZ 4.01Å; I473-F475 HydrophobicContact CD1-CZ 4.49Å; I473-F475 HydrophobicContact CG2-CD2 4.4Å; I473-F475 HydrophobicContact CG2-CE1 4.07Å; I473-F475 HydrophobicContact CG2-CE2 3.97Å; I473-F475 HydrophobicContact CG2-CZ 3.77Å
476	E	79.9	Confident	72	Confident	42 Å²	42	96.7 Å²	96.7	20%	0.196	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.9	177.6	-58.1	-163.9	150	0	0	109.5	R320 R321 L322 V323 R474 C478	R320-E476 VanDerWaalsContact CD-OE2 3.25Å; R320-E476 WeakPolarHBondContact CD-OE2 3.37Å; R320-E476 IonicContact CZ-OE1 3.68Å; R320-E476 IonicContact CZ-OE2 3.21Å; R320-E476 IonicContact NE-OE2 2.74Å; R320-E476 VanDerWaalsContact NH1-CD 3.33Å; R320-E476 IonicContact NH1-OE1 2.69Å; R320-E476 PolarHBondContact NH1-OE1 2.97Å; R320-E476 IonicContact NH1-OE2 3.9Å; R320-E476 PolarHBondContact NH1-OE2 3.3Å; R321-E476 PolarHBondContact O-N 3.21Å; R321-E476 VanDerWaalsContact O-N 3.12Å; L322-E476 CarbonylContact C-O 3.59Å; L322-E476 WeakPolarHBondContact CA-O 3.37Å; V323-E476 PolarHBondContact N-O 3.17Å; R474-E476 IonicContact CZ-OE1 2.91Å; R474-E476 IonicContact NE-OE1 2.65Å; R474-E476 PolarHBondContact NE-OE1 3.14Å; R474-E476 IonicContact NH2-OE1 3.17Å; R474-E476 PolarHBondContact NH2-OE1 2.84Å; E476-C478 PolarHBondContact O-N 3.11Å
477	V	75.5	Confident	69.5	Low	97 Å²	97	96.3 Å²	96.3	59%	0.588	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	123.4	-176	-177.6	0	0	0	0	108.8	P325 R479	P325-V477 HydrophobicContact CG-CG1 4.17Å; V477-R479 PolarHBondContact O-N 3.5Å
478	C	64.1	Low	67.4	Low	20 Å²	20	97.5 Å²	97.5	14%	0.135	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-64.2	133	178.8	-173.6	0	0	0	0	110.5	L322 V323 E476 L485	L322-C478 HydrophobicContact CD2-CB 4.46Å; V323-C478 PolarHBondContact O-N 2.98Å; E476-C478 PolarHBondContact O-N 3.11Å; C478-L485 HydrophobicContact CB-CD2 4.41Å
479	R	58.9	Low	65.6	Low	167 Å²	167	95.2 Å²	95.2	63%	0.63	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-98	141.5	177.9	-67.6	-174.5	175.8	-161.2	-1	110	V477 G481 D482	V477-R479 PolarHBondContact O-N 3.5Å; R479-G481 PolarHBondContact O-N 3.35Å; R479-D482 PolarHBondContact O-N 3.48Å
480	H	43.6	Very low	64.2	Low	190 Å²	190	93.4 Å²	93.4	88%	0.88	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	101.5	174.5	-59.9	96.7	0	0	0	109.9
481	G	49.1	Very low	62.9	Low	77 Å²	77	97.1 Å²	97.1	79%	0.794	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	144.6	-27.2	-176.9	0	0	0	0	0	113.7	R479 G483	R479-G481 PolarHBondContact O-N 3.35Å; G481-G483 PolarHBondContact O-N 2.99Å
482	D	45.7	Very low	62.1	Low	114 Å²	114	94.6 Å²	94.6	61%	0.61	50%	0.503	S	S	*	.	S	Bend	trans	-70.9	120.6	174.4	-65.6	-47.6	0	0	0	109.9	R479	R479-D482 PolarHBondContact O-N 3.48Å
483	G	44.2	Very low	61.9	Low	76 Å²	76	91.8 Å²	91.8	78%	0.784	50%	0.496	S	S	*	.	S	Bend	trans	-69	135.9	-171	0	0	0	0	0	113.9	G481	G481-G483 PolarHBondContact O-N 2.99Å
484	Q	40.7	Very low	61.9	Low	185 Å²	185	90.4 Å²	90.4	86%	0.864	49%	0.49	S	S	*	.	S	Bend	trans	50.9	91.9	170.4	-161.7	136	-26.9	0	0	115.4	S486	Q484-S486 PolarHBondContact O-N 3.28Å; Q484-S486 VanDerWaalsContact O-N 3.14Å
485	L	45.5	Very low	62	Low	89 Å²	89	81.3 Å²	81.3	47%	0.466	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-47.5	120	166.8	-69.9	168.1	0	0	0	110.7	C478 H487	C478-L485 HydrophobicContact CB-CD2 4.41Å; L485-H487 PolarHBondContact O-N 3.48Å; L485-H487 VanDerWaalsContact O-N 3.13Å
486	S	43.7	Very low	62.3	Low	98 Å²	98	80.3 Å²	80.3	69%	0.685	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-58	117.1	158.2	57.8	0	0	0	0	107.3	Q484 S488	Q484-S486 PolarHBondContact O-N 3.28Å; Q484-S486 VanDerWaalsContact O-N 3.14Å; S486-S488 PolarHBondContact O-N 2.97Å
487	H	44	Very low	62.9	Low	132 Å²	132	79.2 Å²	79.2	61%	0.611	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-49.5	135.3	-160.9	-89.7	-121.2	0	0	0	114	L485 L489	L485-H487 PolarHBondContact O-N 3.48Å; L485-H487 VanDerWaalsContact O-N 3.13Å; H487-L489 PolarHBondContact O-N 3.46Å; H487-L489 VanDerWaalsContact O-N 3.14Å
488	S	48.3	Very low	63.7	Low	29 Å²	29	75.6 Å²	75.6	20%	0.203	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-39.7	116.9	159.3	169.1	0	0	0	0	109.7	H451 S486 S490	H451-S488 PolarHBondContact NE2-OG 3.02Å; S486-S488 PolarHBondContact O-N 2.97Å; S488-S490 VanDerWaalsContact C-N 3.27Å; S488-S490 PolarHBondContact O-N 3.04Å
489	L	54.5	Low	65	Low	47 Å²	47	81.1 Å²	81.1	25%	0.246	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	15.8	67	-176.3	-70	-177.1	0	0	0	114	D445 H451 H487 E491 I496	D445-L489 HydrophobicContact CB-CD1 4.09Å; H451-L489 HydrophobicContact CB-CD1 3.74Å; H451-L489 HydrophobicContact CB-CG 4.39Å; H487-L489 PolarHBondContact O-N 3.46Å; H487-L489 VanDerWaalsContact O-N 3.14Å; L489-E491 PolarHBondContact O-N 3.25Å; L489-I496 HydrophobicContact CB-CD1 4.04Å; L489-I496 WeakPolarHBondContact O-CD1 3.45Å
490	S	61.2	Low	66.5	Low	60 Å²	60	73.4 Å²	73.4	42%	0.42	42%	0.421	S	S	.	.			trans	13.8	95.7	177.6	-169	0	0	0	0	115.1	S488 D492 D493	S488-S490 VanDerWaalsContact C-N 3.27Å; S488-S490 PolarHBondContact O-N 3.04Å; S490-D492 PolarHBondContact O-N 3.22Å; S490-D493 WeakPolarHBondContact O-CB 3.42Å; S490-D493 PolarHBondContact O-N 3.09Å
491	E	68.1	Low	68.7	Low	89 Å²	89	64.7 Å²	64.7	42%	0.416	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-1.2	178.8	-58.8	-170.4	125.5	0	0	113.5	L489 S497	L489-E491 PolarHBondContact O-N 3.25Å; E491-S497 WeakPolarHBondContact O-CB 3.36Å; E491-S497 PolarHBondContact O-OG 2.57Å
492	D	78.6	Confident	70.7	Confident	105 Å²	105	62.2 Å²	62.2	56%	0.561	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.4	163.4	-67.6	-55.4	0	0	0	115.1	S490 A494 A500 R503	S490-D492 PolarHBondContact O-N 3.22Å; D492-A494 PolarHBondContact O-N 3.11Å; D492-A500 VanDerWaalsContact C-CB 3.46Å; D492-A500 WeakPolarHBondContact O-CB 3.37Å; D492-R503 IonicContact OD1-CZ 3.73Å; D492-R503 VanDerWaalsContact OD1-CZ 3.24Å; D492-R503 IonicContact OD1-NH1 2.79Å; D492-R503 PolarHBondContact OD1-NH1 3.05Å; D492-R503 IonicContact OD1-NH2 2.68Å; D492-R503 PolarHBondContact OD1-NH2 3.35Å
493	D	88.3	Confident	72.7	Confident	52 Å²	52	62 Å²	62	28%	0.278	34%	0.339	S	S	.	.			trans	-76.8	106.6	173.3	177.1	22.2	0	0	0	111	S490 S495 I496 S497	S490-D493 WeakPolarHBondContact O-CB 3.42Å; S490-D493 PolarHBondContact O-N 3.09Å; D493-S495 PolarHBondContact O-N 3.37Å; D493-S495 WeakPolarHBondContact OD1-CB 3.45Å; D493-S495 PolarHBondContact OD1-N 3.08Å; D493-S495 PolarHBondContact OD1-OG 2.82Å; D493-S495 PolarHBondContact OD2-OG 3.25Å; D493-I496 HydrophobicContact CB-CD1 4.37Å; D493-I496 HydrophobicContact CB-CG1 3.96Å; D493-I496 PolarHBondContact O-N 3.32Å; D493-S497 WeakPolarHBondContact O-CB 3.28Å; D493-S497 PolarHBondContact O-N 3.06Å
494	A	91.1	Very high	74.7	Confident	11 Å²	11	61.9 Å²	61.9	9%	0.091	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-14.1	175.3	0	0	0	0	0	114.1	Y375 I439 D492 A500 H504	Y375-A494 WeakPolarHBondContact CE2-O 3.47Å; Y375-A494 PolarHBondContact OH-O 3.3Å; I439-A494 HydrophobicContact CD1-CB 4.21Å; D492-A494 PolarHBondContact O-N 3.11Å; A494-A500 HydrophobicContact CB-CB 4.18Å; A494-H504 HydrophobicContact CB-CB 3.78Å
495	S	91.4	Very high	76.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-21.3	173.8	99.3	0	0	0	0	114	H421 I440 D493	H421-S495 PolarHBondContact CE1-O 3.1Å; H421-S495 PolarHBondContact NE2-O 3.36Å; H421-S495 VanDerWaalsContact NE2-O 3.08Å; I440-S495 WeakPolarHBondContact O-CB 3.39Å; D493-S495 PolarHBondContact O-N 3.37Å; D493-S495 WeakPolarHBondContact OD1-CB 3.45Å; D493-S495 PolarHBondContact OD1-N 3.08Å; D493-S495 PolarHBondContact OD1-OG 2.82Å; D493-S495 PolarHBondContact OD2-OG 3.25Å
496	I	92.3	Very high	78	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-8.1	-175.9	63.6	177.7	0	0	0	115	R373 D445 F446 L489 D493	R373-I496 PolarHBondContact NH1-O 3.21Å; D445-I496 HydrophobicContact CB-CD1 4.17Å; D445-I496 HydrophobicContact CB-CG2 4.13Å; F446-I496 HydrophobicContact CB-CG2 4.13Å; F446-I496 HydrophobicContact CD2-CG2 4.32Å; L489-I496 HydrophobicContact CB-CD1 4.04Å; L489-I496 WeakPolarHBondContact O-CD1 3.45Å; D493-I496 HydrophobicContact CB-CD1 4.37Å; D493-I496 HydrophobicContact CB-CG1 3.96Å; D493-I496 PolarHBondContact O-N 3.32Å
497	S	92.1	Very high	78.9	Confident	19 Å²	19	50.5 Å²	50.5	13%	0.133	27%	0.269	C	S	.	.			trans	-117.8	129	179.4	166.2	0	0	0	0	110.9	E491 D493 A500 Y501	E491-S497 WeakPolarHBondContact O-CB 3.36Å; E491-S497 PolarHBondContact O-OG 2.57Å; D493-S497 WeakPolarHBondContact O-CB 3.28Å; D493-S497 PolarHBondContact O-N 3.06Å; S497-A500 PolarHBondContact OG-N 3.47Å; S497-Y501 WeakPolarHBondContact O-CB 3.29Å; S497-Y501 PolarHBondContact O-N 3.11Å
498	F	91.9	Very high	79.3	Confident	20 Å²	20	50.4 Å²	50.4	9%	0.088	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-37	177.9	178.6	-101	0	0	0	112.7	A376 Q383 Q384 Y501 L502	A376-F498 HydrophobicContact CB-CD2 3.87Å; A376-F498 HydrophobicContact CB-CE2 3.94Å; Q383-F498 WeakPolarHBondContact O-CE2 3.25Å; Q384-F498 HydrophobicContact CG-CB 4.44Å; Q384-F498 HydrophobicContact CG-CD1 3.42Å; Q384-F498 VanDerWaalsContact CG-CD1 3.42Å; Q384-F498 HydrophobicContact CG-CD2 4.01Å; Q384-F498 HydrophobicContact CG-CE1 3.43Å; Q384-F498 VanDerWaalsContact CG-CE1 3.43Å; Q384-F498 HydrophobicContact CG-CE2 4.05Å; Q384-F498 HydrophobicContact CG-CG 3.69Å; Q384-F498 HydrophobicContact CG-CZ 3.75Å; Q384-F498 VanDerWaalsContact NE2-CD1 3.28Å; F498-Y501 WeakPolarHBondContact O-CB 3.43Å; F498-Y501 PolarHBondContact O-N 3.17Å; F498-L502 HydrophobicContact CD1-CD1 4.07Å; F498-L502 HydrophobicContact CD1-CG 4.2Å; F498-L502 HydrophobicContact CE1-CD1 3.34Å; F498-L502 HydrophobicContact CE1-CD2 4.35Å; F498-L502 HydrophobicContact CE1-CG 3.74Å; F498-L502 HydrophobicContact CE2-CD2 4.2Å; F498-L502 HydrophobicContact CE2-CG 4.23Å; F498-L502 HydrophobicContact CZ-CD1 3.67Å; F498-L502 HydrophobicContact CZ-CD2 3.87Å; F498-L502 HydrophobicContact CZ-CG 3.75Å; F498-L502 PolarHBondContact O-N 3.28Å
499	E	91.4	Very high	79.1	Confident	137 Å²	137	53 Å²	53	64%	0.64	30%	0.304	S	S	*	.	H	α-helix	trans	-69.2	-37.6	178.2	-63.3	-175.5	175.3	0	0	111.4	R503	E499-R503 WeakPolarHBondContact O-CB 3.3Å; E499-R503 WeakPolarHBondContact O-CG 3.41Å; E499-R503 PolarHBondContact O-N 2.87Å; E499-R503 PolarHBondContact O-NE 3.22Å
500	A	90.7	Very high	78.5	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-67.3	-37	170.8	0	0	0	0	0	111.9	D492 A494 S497 R503 H504	D492-A500 VanDerWaalsContact C-CB 3.46Å; D492-A500 WeakPolarHBondContact O-CB 3.37Å; A494-A500 HydrophobicContact CB-CB 4.18Å; S497-A500 PolarHBondContact OG-N 3.47Å; A500-R503 PolarHBondContact O-N 3.37Å; A500-H504 VanDerWaalsContact O-CB 3.22Å; A500-H504 WeakPolarHBondContact O-CB 3.17Å; A500-H504 PolarHBondContact O-N 2.94Å
501	Y	90.7	Very high	77.7	Confident	8 Å²	8	59 Å²	59	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-49.5	172.7	177.2	-93.9	0	0	0	111.9	Y375 A376 P381 I428 I439 S497 F498 R503 H504 Q505	Y375-Y501 WeakPolarHBondContact OH-CD2 3.49Å; A376-Y501 HydrophobicContact CB-CD1 3.7Å; A376-Y501 HydrophobicContact CB-CE1 3.65Å; A376-Y501 HydrophobicContact CB-CG 4.31Å; P381-Y501 HydrophobicContact CB-CE1 4.36Å; P381-Y501 WeakPolarHBondContact O-CE1 3.23Å; I428-Y501 HydrophobicContact CG2-CE2 4.27Å; I428-Y501 WeakPolarHBondContact CG2-OH 3.44Å; I439-Y501 HydrophobicContact CD1-CD2 3.52Å; I439-Y501 HydrophobicContact CD1-CE2 3.77Å; S497-Y501 WeakPolarHBondContact O-CB 3.29Å; S497-Y501 PolarHBondContact O-N 3.11Å; F498-Y501 WeakPolarHBondContact O-CB 3.43Å; F498-Y501 PolarHBondContact O-N 3.17Å; Y501-R503 PolarHBondContact O-N 3.15Å; Y501-H504 WeakPolarHBondContact O-CB 3.28Å; Y501-H504 PolarHBondContact O-N 2.84Å; Y501-Q505 HydrophobicContact CD1-CG 4.13Å; Y501-Q505 HydrophobicContact CE1-CG 3.65Å; Y501-Q505 HydrophobicContact CE2-CG 4.05Å; Y501-Q505 VanDerWaalsContact O-CG 3.29Å; Y501-Q505 WeakPolarHBondContact O-CG 3.33Å; Y501-Q505 PolarHBondContact O-N 2.84Å; Y501-Q505 PolarHBondContact OH-NE2 2.81Å
502	L	89.6	Confident	76	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-41.2	177.3	-72.1	-172	0	0	0	112.7	F498 Q505 G506 L507	F498-L502 HydrophobicContact CD1-CD1 4.07Å; F498-L502 HydrophobicContact CD1-CG 4.2Å; F498-L502 HydrophobicContact CE1-CD1 3.34Å; F498-L502 HydrophobicContact CE1-CD2 4.35Å; F498-L502 HydrophobicContact CE1-CG 3.74Å; F498-L502 HydrophobicContact CE2-CD2 4.2Å; F498-L502 HydrophobicContact CE2-CG 4.23Å; F498-L502 HydrophobicContact CZ-CD1 3.67Å; F498-L502 HydrophobicContact CZ-CD2 3.87Å; F498-L502 HydrophobicContact CZ-CG 3.75Å; F498-L502 PolarHBondContact O-N 3.28Å; L502-Q505 CarbonylContact O-C 3.48Å; L502-Q505 PolarHBondContact O-N 3.45Å; L502-G506 PolarHBondContact O-N 3.47Å; L502-L507 HydrophobicContact CD2-CB 4.17Å; L502-L507 HydrophobicContact CD2-CD1 3.8Å; L502-L507 PolarHBondContact O-N 3.37Å
503	R	88.8	Confident	74	Confident	108 Å²	108	67.5 Å²	67.5	41%	0.408	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-43.3	172.9	-75.3	-178.3	-70.1	151.3	-7.7	111.7	D492 E499 A500 Y501 Q505 G506	D492-R503 IonicContact OD1-CZ 3.73Å; D492-R503 VanDerWaalsContact OD1-CZ 3.24Å; D492-R503 IonicContact OD1-NH1 2.79Å; D492-R503 PolarHBondContact OD1-NH1 3.05Å; D492-R503 IonicContact OD1-NH2 2.68Å; D492-R503 PolarHBondContact OD1-NH2 3.35Å; E499-R503 WeakPolarHBondContact O-CB 3.3Å; E499-R503 WeakPolarHBondContact O-CG 3.41Å; E499-R503 PolarHBondContact O-N 2.87Å; E499-R503 PolarHBondContact O-NE 3.22Å; A500-R503 PolarHBondContact O-N 3.37Å; Y501-R503 PolarHBondContact O-N 3.15Å; R503-Q505 VanDerWaalsContact C-N 3.32Å; R503-Q505 PolarHBondContact O-N 2.86Å; R503-G506 PolarHBondContact O-N 3.27Å
504	H	86	Confident	71.3	Confident	75 Å²	75	73.5 Å²	73.5	35%	0.347	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-33.7	176.5	-172.9	-88	0	0	0	112.8	V436 A437 A494 A500 Y501 G506	V436-H504 WeakPolarHBondContact CG1-ND1 3.26Å; V436-H504 WeakPolarHBondContact CG1-O 3.42Å; A437-H504 PolarHBondContact O-CE1 3.16Å; A494-H504 HydrophobicContact CB-CB 3.78Å; A500-H504 VanDerWaalsContact O-CB 3.22Å; A500-H504 WeakPolarHBondContact O-CB 3.17Å; A500-H504 PolarHBondContact O-N 2.94Å; Y501-H504 WeakPolarHBondContact O-CB 3.28Å; Y501-H504 PolarHBondContact O-N 2.84Å; H504-G506 VanDerWaalsContact C-N 3.28Å
505	Q	82.8	Confident	68.4	Low	13 Å²	13	80.2 Å²	80.2	6%	0.061	43%	0.43	C	S	.	.	H	α-helix	trans	-76.1	-10.4	171.3	-64.5	-72	102.4	0	0	113.3	S432 Q434 Y501 L502 R503 L507	S432-Q505 PolarHBondContact OG-NE2 3.38Å; S432-Q505 VanDerWaalsContact OG-NE2 3.09Å; Q434-Q505 PolarHBondContact NE2-O 2.72Å; Q434-Q505 PolarHBondContact OE1-O 2.56Å; Y501-Q505 HydrophobicContact CD1-CG 4.13Å; Y501-Q505 HydrophobicContact CE1-CG 3.65Å; Y501-Q505 HydrophobicContact CE2-CG 4.05Å; Y501-Q505 VanDerWaalsContact O-CG 3.29Å; Y501-Q505 WeakPolarHBondContact O-CG 3.33Å; Y501-Q505 PolarHBondContact O-N 2.84Å; Y501-Q505 PolarHBondContact OH-NE2 2.81Å; L502-Q505 CarbonylContact O-C 3.48Å; L502-Q505 PolarHBondContact O-N 3.45Å; R503-Q505 VanDerWaalsContact C-N 3.32Å; R503-Q505 PolarHBondContact O-N 2.86Å; Q505-L507 VanDerWaalsContact C-N 3.32Å; Q505-L507 HydrophobicContact CB-CD1 3.79Å; Q505-L507 HydrophobicContact CB-CG 3.85Å; Q505-L507 HydrophobicContact CG-CD1 4.46Å
506	G	73	Confident	65.6	Low	58 Å²	58	87.8 Å²	87.8	60%	0.598	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	20.5	-176	0	0	0	0	0	114.6	L502 R503 H504 D508	L502-G506 PolarHBondContact O-N 3.47Å; R503-G506 PolarHBondContact O-N 3.27Å; H504-G506 VanDerWaalsContact C-N 3.28Å; G506-D508 VanDerWaalsContact C-N 3.31Å; G506-D508 PolarHBondContact O-N 3.27Å
507	L	63.3	Low	62.7	Low	62 Å²	62	91.9 Å²	91.9	33%	0.325	49%	0.494	S	S	.	.			trans	-86.8	2.1	-175.5	-66.3	172.9	0	0	0	114.2	L502 Q505 G509	L502-L507 HydrophobicContact CD2-CB 4.17Å; L502-L507 HydrophobicContact CD2-CD1 3.8Å; L502-L507 PolarHBondContact O-N 3.37Å; Q505-L507 VanDerWaalsContact C-N 3.32Å; Q505-L507 HydrophobicContact CB-CD1 3.79Å; Q505-L507 HydrophobicContact CB-CG 3.85Å; Q505-L507 HydrophobicContact CG-CD1 4.46Å; L507-G509 PolarHBondContact O-N 3.26Å
508	D	50.8	Low	59.9	Low	129 Å²	129	94.7 Å²	94.7	69%	0.69	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-10.6	-174.3	-149.4	19.4	0	0	0	114.8	G506	G506-D508 VanDerWaalsContact C-N 3.31Å; G506-D508 PolarHBondContact O-N 3.27Å
509	G	44.4	Very low	57	Low	83 Å²	83	102.4 Å²	102.4	86%	0.856	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7.4	-173.9	0	0	0	0	0	117.2	L507	L507-G509 PolarHBondContact O-N 3.26Å
510	S	42.8	Very low	54.2	Low	105 Å²	105	100.8 Å²	100.8	73%	0.734	57%	0.567	S	S	*	*	S	Bend	trans	-120.4	-20.3	-162.7	-154.3	0	0	0	0	116.6
511	L	43.2	Very low	51.6	Low	130 Å²	130	106.1 Å²	106.1	68%	0.681	60%	0.601	S	S	*	*			trans	-111.5	84.8	-171.1	-65.9	179.2	0	0	0	113	M513	L511-M513 PolarHBondContact O-N 3.41Å; L511-M513 VanDerWaalsContact O-N 3.13Å
512	K	33.5	Very low	48.9	Very low	204 Å²	204	111.9 Å²	111.9	89%	0.887	64%	0.64	S	S	*	*			trans	-68.9	101.8	154.9	-76.3	-174.2	177.6	-179.4	0	108.3	E514	K512-E514 PolarHBondContact O-N 3.46Å
513	M	35.8	Very low	46.2	Very low	168 Å²	168	115.9 Å²	115.9	83%	0.828	67%	0.669	S	S	*	*			trans	-64.5	119.4	174.6	-171.4	160.7	75.5	0	0	109.9	L511 H515	L511-M513 PolarHBondContact O-N 3.41Å; L511-M513 VanDerWaalsContact O-N 3.13Å; M513-H515 PolarHBondContact O-N 3.23Å; M513-H515 VanDerWaalsContact O-N 3.1Å
514	E	30.7	Very low	43.6	Very low	178 Å²	178	116.8 Å²	116.8	83%	0.832	69%	0.689	S	S	*	*			trans	-66.5	111.6	171	-73.2	-150	130.3	0	0	109.2	K512 I516	K512-E514 PolarHBondContact O-N 3.46Å; E514-I516 PolarHBondContact O-N 3.12Å
515	H	31	Very low	40.8	Very low	151 Å²	151	118.5 Å²	118.5	70%	0.699	71%	0.71	S	S	*	*			trans	-77.2	93.5	-177.6	-167.1	-96.3	0	0	0	109.1	M513 T517	M513-H515 PolarHBondContact O-N 3.23Å; M513-H515 VanDerWaalsContact O-N 3.1Å; H515-T517 PolarHBondContact O-N 3.33Å
516	I	33.7	Very low	38.4	Very low	161 Å²	161	123.7 Å²	123.7	83%	0.826	75%	0.748	S	S	*	*			trans	-69.8	75.4	179.6	-52.8	180	0	0	0	110.3	E514 G518	E514-I516 PolarHBondContact O-N 3.12Å; I516-G518 PolarHBondContact O-N 2.82Å
517	T	30.7	Very low	36.3	Very low	91 Å²	91	125.9 Å²	125.9	56%	0.558	75%	0.754	S	S	*	*			trans	-73.8	116.3	156.6	37.7	0	0	0	0	108.4	H515 Q519	H515-T517 PolarHBondContact O-N 3.33Å; T517-Q519 PolarHBondContact O-N 3.03Å
518	G	33.3	Very low	34.9	Very low	79 Å²	79	131.9 Å²	131.9	81%	0.814	78%	0.78	S	S	*	*			trans	-61.3	107.3	177.9	0	0	0	0	0	111.5	I516	I516-G518 PolarHBondContact O-N 2.82Å
519	Q	29.9	Very low	34	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.4	131.7	170.5	-65.9	-169.2	15	0	0	109.9	T517	T517-Q519 PolarHBondContact O-N 3.03Å
520	S	33.3	Very low	33.5	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-59.5	147.8	167.1	49.8	0	0	0	0	111
521	P	37.1	Very low	33	Very low	116 Å²	116	142.8 Å²	142.8	75%	0.753	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-61	142.6	179.9	26.4	-35.1	0	0	0	111.6	S523	P521-S523 PolarHBondContact O-N 3.23Å
522	P	32.8	Very low	32.5	Very low	129 Å²	129	145 Å²	145	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.3	129.1	-178.5	28	-34.3	0	0	0	111.3
523	S	33	Very low	32.5	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.5	139.4	169.6	43.8	0	0	0	0	110.8	P521 S525	P521-S523 PolarHBondContact O-N 3.23Å; S523-S525 PolarHBondContact O-N 2.88Å
524	P	34.4	Very low	32.5	Very low	127 Å²	127	139.3 Å²	139.3	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.2	126.2	178.6	28.8	-33.6	0	0	0	110.7
525	S	28.3	Very low	33.5	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.2	123.7	177.1	41.5	0	0	0	0	111.7	S523	S523-S525 PolarHBondContact O-N 2.88Å
526	S	30.7	Very low	33.5	Very low	122 Å²	122	134.7 Å²	134.7	85%	0.853	79%	0.793	S	S	*	*			trans	-89.7	113.5	174.9	48.6	0	0	0	0	111.4
527	S	30.6	Very low	33.5	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	79%	0.794	S	S	*	*			trans	-127.7	69.7	-178.6	-62	0	0	0	0	111.6
528	H	33.6	Very low	33.8	Very low	188 Å²	188	139.8 Å²	139.8	87%	0.87	81%	0.806	S	S	*	*			trans	-147.6	104.5	173.2	-99.8	-46.6	0	0	0	113.4
529	Q	31.8	Very low	34.5	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	80%	0.804	S	S	*	*			trans	-158.5	116.1	133.2	-118.8	178.5	33.4	0	0	111.2
530	Q	32.8	Very low	34.7	Very low	194 Å²	194	137.4 Å²	137.4	91%	0.907	79%	0.794	S	S	*	*			trans	-143.4	147.3	157.3	-134.7	176.8	11.5	0	0	107.4
531	H	33.1	Very low	34.9	Very low	168 Å²	168	138.7 Å²	138.7	78%	0.778	80%	0.798	S	S	*	*			trans	-84.6	163.8	-160.1	-92.8	-99.7	0	0	0	115.4
532	Q	31.9	Very low	35	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	79%	0.792	S	S	*	*			trans	-73.7	146.9	-172.7	-55.9	163.8	5	0	0	113.7
533	T	33.6	Very low	35.5	Very low	144 Å²	144	141.1 Å²	141.1	88%	0.883	79%	0.79	S	S	*	*			trans	-138.5	160.5	147.2	50.8	0	0	0	0	109.8
534	S	35.5	Very low	36.2	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	80%	0.795	S	S	*	*			trans	-103.3	-163.7	-160.7	-51.1	0	0	0	0	113.4
535	P	52.5	Low	36.9	Very low	115 Å²	115	142.5 Å²	142.5	75%	0.747	79%	0.79	S	S	*	*				-124.9	-135.6	-90.8	41.5	-24.3	0	0	0	112.2
536	T	31.8	Very low	37.9	Very low	117 Å²	117	146.4 Å²	146.4	72%	0.718	82%	0.817	S	S	*	*			trans	79.8	139.9	177.2	-4.7	0	0	0	0	114.2
537	M	33.9	Very low	38.3	Very low	172 Å²	172	147.6 Å²	147.6	85%	0.847	82%	0.815	S	S	*	*			cis	-124.2	175.6	9.1	-70.7	-116.3	69.5	0	0	114
538	K	35.2	Very low	38.7	Very low	187 Å²	187	149.9 Å²	149.9	81%	0.813	82%	0.82	S	S	*	*			trans	-98.3	-179.7	166.8	-57.6	-179.3	-178.6	178.5	0	109.7
539	P	47.8	Very low	39	Very low	119 Å²	119	147.8 Å²	147.8	77%	0.773	82%	0.817	S	S	*	*			cis	-113.8	-141.7	-8.5	18.2	9	0	0	0	110.3
540	S	34.3	Very low	39.4	Very low	93 Å²	93	145.7 Å²	145.7	65%	0.65	82%	0.815	S	S	*	*			cis	-159.6	168.1	13.6	-51.4	0	0	0	0	114
541	T	38.5	Very low	39.8	Very low	129 Å²	129	142.7 Å²	142.7	79%	0.791	81%	0.809	S	S	*	*			trans	15.6	145.5	145.2	53	0	0	0	0	122.5
542	S	39.2	Very low	40.3	Very low	90 Å²	90	141 Å²	141	63%	0.629	81%	0.811	S	S	*	*			cis	177.9	161.3	-11.4	49.2	0	0	0	0	112.6
543	Y	43.1	Very low	40.9	Very low	207 Å²	207	138.4 Å²	138.4	81%	0.812	81%	0.81	S	S	*	*			trans	94.4	129.9	157.7	-82.2	-79.7	0	0	0	121.6
544	F	46.8	Very low	41.4	Very low	193 Å²	193	138 Å²	138	85%	0.846	81%	0.805	S	S	*	*			trans	-23	160.7	144.3	-67.8	-104.5	0	0	0	115.5
545	G	49.9	Very low	41.9	Very low	70 Å²	70	140.5 Å²	140.5	72%	0.722	81%	0.809	S	S	*	*			cis	161.7	-179.2	12.8	0	0	0	0	0	107.9
546	S	49.8	Very low	40.9	Very low	194 Å²	194	142.8 Å²	142.8	100%	1.357	81%	0.814	S	S	*	*			cis	-139.7	0	5.2	-46.8	0	0	0	0	110.4

Retrieved 546 of 546 residues in 106.7 ms (Link to these results)

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