A0A087Y132_POEFO Loading...

BTB domain containing 17

AlphaFold DB , UniProt , Accession A0A087Y132, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 470 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	32.7	Very low	27.6	Very low	223 Å²	223	163.8 Å²	163.8	100%	1.099	82%	0.817	S	S	*	*				0	94.8	0	-117.5	-176.9	149.9	0	0	106.7
2	L	29.4	Very low	27.5	Very low	135 Å²	135	161.8 Å²	161.8	71%	0.707	82%	0.82	S	S	*	*				75.5	102.5	106.3	-83.7	144.4	0	0	0	111.1
3	L	28.8	Very low	27.3	Very low	143 Å²	143	156.7 Å²	156.7	75%	0.749	82%	0.817	S	S	*	*				71.7	130.7	84	-98.6	152.8	0	0	0	114.3
4	L	29.4	Very low	27.2	Very low	148 Å²	148	153.1 Å²	153.1	78%	0.775	82%	0.821	S	S	*	*			trans	135.9	109.1	144.9	-91.9	103.5	0	0	0	110.5
5	T	31.1	Very low	27.2	Very low	97 Å²	97	149.2 Å²	149.2	60%	0.595	82%	0.819	S	S	*	*				57.4	102.3	62.6	68.6	0	0	0	0	116
6	M	25.9	Very low	27.7	Very low	176 Å²	176	144.8 Å²	144.8	87%	0.867	82%	0.818	S	S	*	*			trans	-149.1	98.3	150.1	-76.7	-174.8	76.7	0	0	105.6
7	W	25.2	Very low	27.6	Very low	225 Å²	225	146 Å²	146	85%	0.852	82%	0.821	S	S	*	*				37.6	98.8	83.7	-73.2	66.7	0	0	0	113.7
8	L	25.9	Very low	27.6	Very low	164 Å²	164	147.6 Å²	147.6	86%	0.859	83%	0.826	S	S	*	*			trans	-137	118.5	150.1	-134.5	89.7	0	0	0	108.8
9	Q	24.4	Very low	27.6	Very low	169 Å²	169	149.4 Å²	149.4	79%	0.79	82%	0.824	S	S	*	*			trans	-63.8	138.9	174.8	-70.8	155.2	-70.4	0	0	110.3
10	V	26.5	Very low	27.4	Very low	137 Å²	137	146.6 Å²	146.6	83%	0.83	82%	0.822	S	S	*	*			trans	-111.5	112.2	159.7	175.7	0	0	0	0	106.8
11	E	24.1	Very low	27.4	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	82%	0.818	S	S	*	*			trans	-60.2	125.9	171.3	-72.3	175.5	135.9	0	0	110.1
12	V	26.9	Very low	27.3	Very low	140 Å²	140	143.7 Å²	143.7	85%	0.848	81%	0.808	S	S	*	*			trans	-89.1	107.3	166.9	176.5	0	0	0	0	107.4	A14	V12-A14 PolarHBondContact O-N 3.39Å
13	A	24.9	Very low	27.3	Very low	95 Å²	95	141.4 Å²	141.4	79%	0.785	81%	0.809	S	S	*	*			trans	-60.6	124.6	171.2	0	0	0	0	0	110.3	A15	A13-A15 PolarHBondContact O-N 2.77Å; A13-A15 VanDerWaalsContact O-N 3.17Å
14	A	25.9	Very low	27.7	Very low	106 Å²	106	143.7 Å²	143.7	88%	0.876	82%	0.816	S	S	*	*			trans	-66.4	107.5	175.4	0	0	0	0	0	110.5	V12	V12-A14 PolarHBondContact O-N 3.39Å
15	A	27.3	Very low	27.7	Very low	95 Å²	95	145.6 Å²	145.6	79%	0.785	82%	0.821	S	S	*	*			trans	-82	112.1	164	0	0	0	0	0	108.5	A13 L17	A13-A15 PolarHBondContact O-N 2.77Å; A13-A15 VanDerWaalsContact O-N 3.17Å; A15-L17 PolarHBondContact O-N 3.09Å
16	G	34.2	Very low	28	Very low	79 Å²	79	145 Å²	145	81%	0.814	83%	0.834	S	S	*	*			trans	-60.9	128.7	174.2	0	0	0	0	0	111.2
17	L	27	Very low	28.6	Very low	165 Å²	165	140.3 Å²	140.3	86%	0.864	83%	0.831	S	S	*	*			trans	-121.6	129.4	164.9	-132.3	87	0	0	0	108.6	A15 K19	A15-L17 PolarHBondContact O-N 3.09Å; L17-K19 PolarHBondContact O-N 3.33Å
18	L	26.5	Very low	29.4	Very low	174 Å²	174	132.9 Å²	132.9	91%	0.911	82%	0.824	S	S	*	*			trans	-48.3	117.5	-176.9	-72.1	130.1	0	0	0	112	A20	L18-A20 PolarHBondContact O-N 3.26Å
19	K	27.5	Very low	30.4	Very low	182 Å²	182	132 Å²	132	79%	0.791	82%	0.82	S	S	*	*			trans	-62.6	112.9	157.4	-83.2	179.6	173	-179.4	0	107.7	L17 D21	L17-K19 PolarHBondContact O-N 3.33Å; K19-D21 VanDerWaalsContact C-N 3.27Å; K19-D21 PolarHBondContact O-N 3.1Å; K19-D21 VanDerWaalsContact O-N 3.11Å
20	A	25.4	Very low	31.9	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	82%	0.823	S	S	*	*			trans	-71	95.6	153.7	0	0	0	0	0	106.2	L18 L22	L18-A20 PolarHBondContact O-N 3.26Å; A20-L22 VanDerWaalsContact C-N 3.3Å; A20-L22 PolarHBondContact O-N 3.47Å
21	D	26.4	Very low	34	Very low	140 Å²	140	128.4 Å²	128.4	75%	0.749	82%	0.821	S	S	*	*			trans	-61.5	96.6	166.5	-77	-30	0	0	0	107.5	K19 A23	K19-D21 VanDerWaalsContact C-N 3.27Å; K19-D21 PolarHBondContact O-N 3.1Å; K19-D21 VanDerWaalsContact O-N 3.11Å; D21-A23 PolarHBondContact O-N 3.38Å; D21-A23 VanDerWaalsContact O-N 3.09Å
22	L	29.6	Very low	36.4	Very low	168 Å²	168	125.5 Å²	125.5	88%	0.88	82%	0.816	S	S	*	*			trans	-59.4	111	154.5	-80.8	161.1	0	0	0	105.6	A20 Q24	A20-L22 VanDerWaalsContact C-N 3.3Å; A20-L22 PolarHBondContact O-N 3.47Å; L22-Q24 PolarHBondContact O-N 3.07Å
23	A	29.6	Very low	39.1	Very low	88 Å²	88	125.6 Å²	125.6	73%	0.727	81%	0.81	S	S	*	*			trans	-46.3	108.1	178.5	0	0	0	0	0	109.9	D21 E25	D21-A23 PolarHBondContact O-N 3.38Å; D21-A23 VanDerWaalsContact O-N 3.09Å; A23-E25 VanDerWaalsContact C-N 3.25Å; A23-E25 PolarHBondContact O-N 3.48Å
24	Q	37.1	Very low	41.9	Very low	190 Å²	190	125 Å²	125	89%	0.888	80%	0.801	S	S	*	*			trans	-60.8	98.5	150.9	-126.6	173.1	-4.4	0	0	104.9	L22 G26	L22-Q24 PolarHBondContact O-N 3.07Å; Q24-G26 PolarHBondContact O-N 2.97Å
25	E	30.2	Very low	44.9	Very low	189 Å²	189	126.4 Å²	126.4	88%	0.883	79%	0.789	S	S	*	*			trans	-60.5	98.1	159.4	-80.5	-167.1	153.4	0	0	106.7	A23 G27	A23-E25 VanDerWaalsContact C-N 3.25Å; A23-E25 PolarHBondContact O-N 3.48Å; E25-G27 PolarHBondContact O-N 3.17Å
26	G	37.9	Very low	47.7	Very low	84 Å²	84	125.3 Å²	125.3	87%	0.866	78%	0.776	S	S	*	*	S	Bend	trans	-65.6	97.6	175.9	0	0	0	0	0	109.7	Q24	Q24-G26 PolarHBondContact O-N 2.97Å
27	G	38.8	Very low	50.2	Low	78 Å²	78	128.5 Å²	128.5	80%	0.804	77%	0.769	S	S	*	*			trans	-159.5	40.2	167.9	0	0	0	0	0	110.5	E25	E25-G27 PolarHBondContact O-N 3.17Å
28	G	42.3	Very low	53.1	Low	69 Å²	69	123.7 Å²	123.7	71%	0.711	75%	0.747	S	S	*	*			trans	-108.9	111.4	178.4	0	0	0	0	0	110.9
29	D	46.3	Very low	56	Low	144 Å²	144	120.4 Å²	120.4	77%	0.77	73%	0.73	S	S	*	*			trans	-38.5	138.7	163.7	-104.5	-24.5	0	0	0	111.8	N31	D29-N31 PolarHBondContact O-N 2.96Å
30	G	55.4	Low	59	Low	83 Å²	83	115.1 Å²	115.1	86%	0.856	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	25.5	-176.7	0	0	0	0	0	116.7
31	N	70.3	Confident	61.9	Low	149 Å²	149	116.3 Å²	116.3	80%	0.797	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	5	-173.9	-77.6	-3.5	0	0	0	115	D29	D29-N31 PolarHBondContact O-N 2.96Å
32	T	75.1	Confident	64.9	Low	123 Å²	123	118.4 Å²	118.4	76%	0.755	70%	0.696	S	S	*	*			trans	-97.6	109.6	-176.3	-44	0	0	0	0	111.9
33	I	83.8	Confident	67.8	Low	142 Å²	142	112.6 Å²	112.6	73%	0.728	67%	0.666	S	S	*	*			trans	-83.8	112	170.9	-56.5	174.6	0	0	0	108.6	H35	I33-H35 WeakPolarHBondContact CG2-NE2 3.36Å
34	S	84.1	Confident	70.5	Confident	84 Å²	84	110.7 Å²	110.7	59%	0.587	64%	0.642	S	S	*	*			trans	-101.6	123.6	178	-176.4	0	0	0	0	111.7	S36	S34-S36 PolarHBondContact OG-OG 3.19Å; S34-S36 VanDerWaalsContact OG-OG 3.09Å
35	H	87.8	Confident	73	Confident	135 Å²	135	103.3 Å²	103.3	63%	0.625	61%	0.614	S	S	*	*			trans	-115.4	16.6	170.7	-60.8	-54.5	0	0	0	112.4	I33 Q37 T38 L39	I33-H35 WeakPolarHBondContact CG2-NE2 3.36Å; H35-Q37 VanDerWaalsContact C-N 3.31Å; H35-Q37 PolarHBondContact O-N 3.4Å; H35-T38 PolarHBondContact O-N 3.47Å; H35-L39 PolarHBondContact O-N 3.08Å; H35-L39 VanDerWaalsContact O-N 3.1Å
36	S	86.8	Confident	75.9	Confident	72 Å²	72	97 Å²	97	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-58.2	-41.9	-174.5	56.2	0	0	0	0	112.3	S34 T38 L39 L40	S34-S36 PolarHBondContact OG-OG 3.19Å; S34-S36 VanDerWaalsContact OG-OG 3.09Å; S36-T38 PolarHBondContact O-N 3.17Å; S36-L39 WeakPolarHBondContact O-CB 3.42Å; S36-L39 PolarHBondContact O-N 2.96Å; S36-L39 VanDerWaalsContact O-N 3.17Å; S36-L40 WeakPolarHBondContact O-CG 3.41Å; S36-L40 PolarHBondContact O-N 3.42Å
37	Q	85.4	Confident	78.3	Confident	146 Å²	146	94.3 Å²	94.3	68%	0.682	55%	0.551	S	S	*	*	H	α-helix	trans	-66.1	-39.2	-178.7	-155.8	167.6	16	0	0	112.4	H35 L39 L40 Q41	H35-Q37 VanDerWaalsContact C-N 3.31Å; H35-Q37 PolarHBondContact O-N 3.4Å; Q37-L39 VanDerWaalsContact C-N 3.31Å; Q37-L39 PolarHBondContact O-N 3.48Å; Q37-L40 PolarHBondContact O-N 2.97Å; Q37-Q41 WeakPolarHBondContact O-CG 3.44Å; Q37-Q41 PolarHBondContact O-N 3.44Å; Q37-Q41 VanDerWaalsContact O-N 3.07Å
38	T	88	Confident	80.7	Confident	63 Å²	63	96.5 Å²	96.5	39%	0.387	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-35.9	174	-46.9	0	0	0	0	111.6	H35 S36 R42	H35-T38 PolarHBondContact O-N 3.47Å; S36-T38 PolarHBondContact O-N 3.17Å; T38-R42 WeakPolarHBondContact O-CG 3.43Å; T38-R42 PolarHBondContact O-N 3.31Å; T38-R42 VanDerWaalsContact O-N 3.08Å
39	L	88.5	Confident	82.9	Confident	106 Å²	106	100.1 Å²	100.1	56%	0.555	54%	0.541	S	S	*	.	H	α-helix	trans	-66.4	-43.4	175.9	-173.9	144.5	0	0	0	111.4	H35 S36 Q37 Q41 R42 L43	H35-L39 PolarHBondContact O-N 3.08Å; H35-L39 VanDerWaalsContact O-N 3.1Å; S36-L39 WeakPolarHBondContact O-CB 3.42Å; S36-L39 PolarHBondContact O-N 2.96Å; S36-L39 VanDerWaalsContact O-N 3.17Å; Q37-L39 VanDerWaalsContact C-N 3.31Å; Q37-L39 PolarHBondContact O-N 3.48Å; L39-Q41 PolarHBondContact O-N 3.31Å; L39-R42 PolarHBondContact O-N 2.87Å; L39-L43 HydrophobicContact CD2-CD1 3.67Å; L39-L43 HydrophobicContact CD2-CG 4.21Å; L39-L43 WeakPolarHBondContact O-CG 3.35Å; L39-L43 PolarHBondContact O-N 3.22Å
40	L	89.4	Confident	84.6	Confident	70 Å²	70	94.1 Å²	94.1	37%	0.366	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-43.1	175.3	-67	173.5	0	0	0	111.9	S36 Q37 R42 L43 E44	S36-L40 WeakPolarHBondContact O-CG 3.41Å; S36-L40 PolarHBondContact O-N 3.42Å; Q37-L40 PolarHBondContact O-N 2.97Å; L40-R42 VanDerWaalsContact C-N 3.31Å; L40-R42 PolarHBondContact O-N 2.95Å; L40-L43 PolarHBondContact O-N 3Å; L40-E44 PolarHBondContact O-N 2.85Å
41	Q	87.6	Confident	86	Confident	119 Å²	119	96 Å²	96	56%	0.556	51%	0.505	S	S	*	.	H	α-helix	trans	-61.5	-38.4	175.3	-73	176.3	-6.9	0	0	112.5	Q37 L39 E44 A45	Q37-Q41 WeakPolarHBondContact O-CG 3.44Å; Q37-Q41 PolarHBondContact O-N 3.44Å; Q37-Q41 VanDerWaalsContact O-N 3.07Å; L39-Q41 PolarHBondContact O-N 3.31Å; Q41-E44 PolarHBondContact O-N 3.28Å; Q41-A45 WeakPolarHBondContact O-CB 3.48Å; Q41-A45 PolarHBondContact O-N 3.21Å
42	R	89.1	Confident	86.6	Confident	184 Å²	184	91.8 Å²	91.8	69%	0.694	50%	0.496	S	S	*	.	H	α-helix	trans	-68	-39	175.8	-73	176.6	-177.1	-174.1	2	112.1	T38 L39 L40 A45 L46	T38-R42 WeakPolarHBondContact O-CG 3.43Å; T38-R42 PolarHBondContact O-N 3.31Å; T38-R42 VanDerWaalsContact O-N 3.08Å; L39-R42 PolarHBondContact O-N 2.87Å; L40-R42 VanDerWaalsContact C-N 3.31Å; L40-R42 PolarHBondContact O-N 2.95Å; R42-A45 PolarHBondContact O-N 3.23Å; R42-L46 VanDerWaalsContact O-CB 3.24Å; R42-L46 WeakPolarHBondContact O-CB 3.24Å; R42-L46 PolarHBondContact O-N 3.1Å
43	L	89.5	Confident	87.3	Confident	46 Å²	46	87.7 Å²	87.7	24%	0.241	47%	0.473	C	S	.	.	H	α-helix	trans	-64.1	-41.3	174.8	-72.3	176.1	0	0	0	111.6	L39 L40 L46 L47 Y116	L39-L43 HydrophobicContact CD2-CD1 3.67Å; L39-L43 HydrophobicContact CD2-CG 4.21Å; L39-L43 WeakPolarHBondContact O-CG 3.35Å; L39-L43 PolarHBondContact O-N 3.22Å; L40-L43 PolarHBondContact O-N 3Å; L43-L46 PolarHBondContact O-N 3.32Å; L43-L47 PolarHBondContact O-N 3.31Å; L43-L47 VanDerWaalsContact O-N 3.1Å; L43-Y116 HydrophobicContact CB-CD1 4.36Å; L43-Y116 WeakPolarHBondContact O-CD1 3.24Å
44	E	87.8	Confident	87.6	Confident	49 Å²	49	84.4 Å²	84.4	23%	0.229	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-46.3	174.8	-172.7	-174.6	159.3	0	0	111.7	L40 Q41 L46 L47 I48 R113	L40-E44 PolarHBondContact O-N 2.85Å; Q41-E44 PolarHBondContact O-N 3.28Å; E44-L46 PolarHBondContact O-N 3.22Å; E44-L47 PolarHBondContact O-N 3.01Å; E44-I48 HydrophobicContact CG-CD1 4.2Å; E44-I48 WeakPolarHBondContact O-CG1 3.31Å; E44-I48 PolarHBondContact O-N 3.32Å; E44-I48 VanDerWaalsContact O-N 3.12Å; E44-R113 VanDerWaalsContact CD-CZ 3.49Å; E44-R113 IonicContact OE1-CZ 3.21Å; E44-R113 IonicContact OE1-NH1 2.69Å; E44-R113 PolarHBondContact OE1-NH1 3.42Å; E44-R113 IonicContact OE1-NH2 3.9Å; E44-R113 PolarHBondContact OE1-NH2 3.43Å; E44-R113 IonicContact OE2-CZ 3.85Å; E44-R113 IonicContact OE2-NH2 3.34Å; E44-R113 PolarHBondContact OE2-NH2 2.69Å
45	A	89.5	Confident	87.9	Confident	35 Å²	35	80.5 Å²	80.5	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-60.3	-35.9	176.4	0	0	0	0	0	112.1	Q41 R42 I48 Q49	Q41-A45 WeakPolarHBondContact O-CB 3.48Å; Q41-A45 PolarHBondContact O-N 3.21Å; R42-A45 PolarHBondContact O-N 3.23Å; A45-I48 PolarHBondContact O-N 2.69Å; A45-Q49 VanDerWaalsContact O-CB 3.31Å; A45-Q49 WeakPolarHBondContact O-CB 3.39Å; A45-Q49 VanDerWaalsContact O-CG 3.24Å; A45-Q49 WeakPolarHBondContact O-CG 3.03Å; A45-Q49 PolarHBondContact O-N 3.12Å
46	L	90.1	Very high	88.1	Confident	56 Å²	56	74.8 Å²	74.8	29%	0.293	40%	0.404	S	S	.	.	H	α-helix	trans	-68.5	-36.1	178.5	176.9	143.6	0	0	0	112.3	R42 L43 E44 G50 H73 Y116	R42-L46 VanDerWaalsContact O-CB 3.24Å; R42-L46 WeakPolarHBondContact O-CB 3.24Å; R42-L46 PolarHBondContact O-N 3.1Å; L43-L46 PolarHBondContact O-N 3.32Å; E44-L46 PolarHBondContact O-N 3.22Å; L46-G50 PolarHBondContact O-N 2.97Å; L46-H73 WeakPolarHBondContact CD2-CE1 3.43Å; L46-H73 WeakPolarHBondContact CD2-ND1 3.21Å; L46-H73 WeakPolarHBondContact CD2-NE2 3.44Å; L46-Y116 HydrophobicContact CD2-CD1 4.46Å; L46-Y116 HydrophobicContact CD2-CE1 3.83Å
47	L	89	Confident	88.3	Confident	27 Å²	27	71.4 Å²	71.4	14%	0.141	38%	0.38	C	S	.	.	H	α-helix	trans	-64.5	-43.4	169.8	178	63.8	0	0	0	111.9	L43 E44 I70 I112 R113 Y116	L43-L47 PolarHBondContact O-N 3.31Å; L43-L47 VanDerWaalsContact O-N 3.1Å; E44-L47 PolarHBondContact O-N 3.01Å; L47-I70 HydrophobicContact CD1-CG2 4.23Å; L47-I112 HydrophobicContact CD1-CG2 3.85Å; L47-I112 HydrophobicContact CD2-CG2 4.09Å; L47-R113 HydrophobicContact CD2-CB 4.2Å; L47-Y116 HydrophobicContact CB-CD1 4.01Å; L47-Y116 HydrophobicContact CB-CE1 4.08Å; L47-Y116 HydrophobicContact CB-CG 4.22Å; L47-Y116 HydrophobicContact CD1-CD2 4.36Å; L47-Y116 HydrophobicContact CD1-CE2 3.87Å; L47-Y116 HydrophobicContact CD2-CD2 4.07Å; L47-Y116 HydrophobicContact CD2-CE2 4.4Å; L47-Y116 HydrophobicContact CD2-CG 4.31Å
48	I	88.6	Confident	88.5	Confident	125 Å²	125	69 Å²	69	64%	0.641	37%	0.365	S	S	*	.	H	α-helix	trans	-69.6	-42.1	-177.7	-64.8	167.8	0	0	0	111.5	E44 A45	E44-I48 HydrophobicContact CG-CD1 4.2Å; E44-I48 WeakPolarHBondContact O-CG1 3.31Å; E44-I48 PolarHBondContact O-N 3.32Å; E44-I48 VanDerWaalsContact O-N 3.12Å; A45-I48 PolarHBondContact O-N 2.69Å
49	Q	88	Confident	88.5	Confident	144 Å²	144	66 Å²	66	67%	0.673	35%	0.347	S	S	*	.	H	α-helix	trans	-78.7	-22.8	-178.4	-67.5	173.5	12.1	0	0	112.6	A45 N51	A45-Q49 VanDerWaalsContact O-CB 3.31Å; A45-Q49 WeakPolarHBondContact O-CB 3.39Å; A45-Q49 VanDerWaalsContact O-CG 3.24Å; A45-Q49 WeakPolarHBondContact O-CG 3.03Å; A45-Q49 PolarHBondContact O-N 3.12Å; Q49-N51 PolarHBondContact O-N 3.16Å
50	G	83.4	Confident	88.5	Confident	19 Å²	19	63.6 Å²	63.6	20%	0.196	33%	0.333	C	S	.	.			trans	65.2	16.2	-177.5	0	0	0	0	0	114	L46 G52 S53	L46-G50 PolarHBondContact O-N 2.97Å; G50-G52 PolarHBondContact O-N 3.45Å; G50-S53 PolarHBondContact O-N 3.38Å; G50-S53 PolarHBondContact O-OG 3.18Å
51	N	84.8	Confident	88.3	Confident	123 Å²	123	61 Å²	61	66%	0.658	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	121.6	-175	-170.6	17.7	0	0	0	110.7	Q49 H73	Q49-N51 PolarHBondContact O-N 3.16Å; N51-H73 PolarHBondContact O-NE2 3.01Å; N51-H73 VanDerWaalsContact O-NE2 3.16Å
52	G	83.2	Confident	87.6	Confident	60 Å²	60	60 Å²	60	62%	0.619	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	14.3	-178.4	0	0	0	0	0	114.9	G50 D54 H73	G50-G52 PolarHBondContact O-N 3.45Å; G52-D54 PolarHBondContact O-N 3.38Å; G52-H73 VanDerWaalsContact C-NE2 3.35Å; G52-H73 PolarHBondContact O-CD2 3.24Å; G52-H73 VanDerWaalsContact O-CD2 3.31Å
53	S	88.3	Confident	86.5	Confident	37 Å²	37	59 Å²	59	26%	0.259	33%	0.332	S	S	.	.			trans	-64.6	124.5	176.9	59.6	0	0	0	0	111.7	G50 A72 H73	G50-S53 PolarHBondContact O-N 3.38Å; G50-S53 PolarHBondContact O-OG 3.18Å; S53-A72 WeakPolarHBondContact CA-O 3.32Å; S53-A72 VanDerWaalsContact CB-O 3.32Å; S53-A72 WeakPolarHBondContact CB-O 3.35Å; S53-H73 PolarHBondContact N-NE2 3.44Å
54	D	90.5	Very high	85.4	Confident	73 Å²	73	58.9 Å²	58.9	39%	0.39	34%	0.338	S	S	.	.			trans	-103.7	-3.6	178.4	70.9	-48.2	0	0	0	112.9	G52 A72 H73 S74 R91	G52-D54 PolarHBondContact O-N 3.38Å; D54-A72 PolarHBondContact N-O 3.37Å; D54-H73 VanDerWaalsContact OD1-CA 3.29Å; D54-H73 WeakPolarHBondContact OD1-CA 3.41Å; D54-S74 PolarHBondContact OD1-N 3.14Å; D54-S74 WeakPolarHBondContact OD2-CB 3.09Å; D54-R91 PolarHBondContact O-NH2 3.27Å; D54-R91 IonicContact OD2-NH2 3.13Å; D54-R91 PolarHBondContact OD2-NH2 3.04Å
55	V	91.1	Very high	84.3	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.006	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139.8	176	63.5	0	0	0	0	112.4	L57 A72 L77 L88 S94 V96	V55-L57 HydrophobicContact CG2-CD2 4.12Å; V55-A72 HydrophobicContact CG1-CB 4.1Å; V55-A72 WeakPolarHBondContact CG1-O 3.33Å; V55-A72 PolarHBondContact N-O 2.78Å; V55-A72 PolarHBondContact O-N 3.26Å; V55-A72 VanDerWaalsContact O-O 3.1Å; V55-L77 HydrophobicContact CG1-CD1 4.2Å; V55-L88 HydrophobicContact CB-CD2 4.23Å; V55-L88 HydrophobicContact CG1-CD2 4.34Å; V55-L88 HydrophobicContact CG2-CD2 3.73Å; V55-S94 WeakPolarHBondContact CA-O 3.28Å; V55-V96 HydrophobicContact CG2-CB 4.45Å; V55-V96 HydrophobicContact CG2-CG2 3.81Å
56	S	91.3	Very high	83.3	Confident	16 Å²	16	69.7 Å²	69.7	11%	0.112	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114	173.4	-177	0	0	0	0	109.4	V69 Q71 S94 T95 V96	S56-V69 WeakPolarHBondContact OG-CG1 3.36Å; S56-Q71 PolarHBondContact OG-NE2 3.22Å; S56-S94 PolarHBondContact N-O 2.84Å; S56-T95 CarbonylContact O-C 3.58Å; S56-T95 WeakPolarHBondContact O-CA 3.45Å; S56-V96 PolarHBondContact O-N 3.01Å
57	L	90.7	Very high	82.8	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	115.4	176.5	-56.8	-178.8	0	0	0	109.2	V55 V69 I70 A72 L77 V96 L98 F108 I112	V55-L57 HydrophobicContact CG2-CD2 4.12Å; L57-V69 CarbonylContact O-C 3.6Å; L57-V69 WeakPolarHBondContact O-CA 3.35Å; L57-I70 HydrophobicContact CB-CB 4.4Å; L57-I70 PolarHBondContact N-O 3.44Å; L57-I70 PolarHBondContact O-N 3.21Å; L57-A72 HydrophobicContact CD1-CB 4.32Å; L57-A72 HydrophobicContact CG-CB 4.42Å; L57-L77 HydrophobicContact CD1-CD1 3.93Å; L57-L77 HydrophobicContact CD2-CD1 4.29Å; L57-L77 HydrophobicContact CG-CD1 4.42Å; L57-V96 HydrophobicContact CD2-CB 4.03Å; L57-V96 HydrophobicContact CD2-CG1 4.41Å; L57-L98 HydrophobicContact CB-CD1 4.29Å; L57-L98 HydrophobicContact CD1-CD1 4.46Å; L57-L98 HydrophobicContact CD2-CD1 4.25Å; L57-F108 HydrophobicContact CD1-CE1 4.3Å; L57-I112 HydrophobicContact CD1-CD1 3.73Å; L57-I112 HydrophobicContact CD1-CG1 4.3Å
58	R	90.2	Very high	82.6	Confident	96 Å²	96	72 Å²	72	36%	0.362	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	106	172.4	-67	180	69.6	105.2	-1.6	108.8	V67 V69 T95 V96 V97 L98	R58-V67 HydrophobicContact CB-CG1 4.35Å; R58-V69 HydrophobicContact CG-CG1 4.39Å; R58-V69 HydrophobicContact CG-CG2 4.15Å; R58-T95 HydrophobicContact CG-CG2 3.62Å; R58-V96 PolarHBondContact N-O 3.07Å; R58-V97 HydrophobicContact CB-CG2 4.42Å; R58-V97 CarbonylContact O-C 3.38Å; R58-V97 WeakPolarHBondContact O-CA 3.24Å; R58-L98 PolarHBondContact O-N 3.43Å
59	V	89	Confident	82.6	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111.8	175.3	-173.7	0	0	0	0	107.9	V67 K68 L98 E100 A105 F108	V59-V67 WeakPolarHBondContact O-CA 3.33Å; V59-K68 HydrophobicContact CB-CB 4.32Å; V59-K68 PolarHBondContact N-O 3.34Å; V59-K68 PolarHBondContact O-N 3.44Å; V59-K68 VanDerWaalsContact O-N 3.08Å; V59-L98 CarbonylContact C-O 3.58Å; V59-L98 WeakPolarHBondContact CA-O 3.49Å; V59-L98 HydrophobicContact CG2-CD1 4.47Å; V59-E100 HydrophobicContact CG1-CB 4.11Å; V59-E100 HydrophobicContact CG1-CG 3.99Å; V59-A105 HydrophobicContact CG1-CB 3.98Å; V59-F108 HydrophobicContact CG1-CD2 4.47Å; V59-F108 HydrophobicContact CG1-CG 4.4Å; V59-F108 HydrophobicContact CG2-CD1 3.45Å; V59-F108 VanDerWaalsContact CG2-CD1 3.45Å; V59-F108 HydrophobicContact CG2-CD2 4.27Å; V59-F108 HydrophobicContact CG2-CE1 3.52Å; V59-F108 HydrophobicContact CG2-CE2 4.35Å; V59-F108 HydrophobicContact CG2-CG 3.84Å; V59-F108 HydrophobicContact CG2-CZ 4.01Å
60	E	87.7	Confident	82.7	Confident	54 Å²	54	63.8 Å²	63.8	25%	0.252	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.7	179.3	-65.8	-179.8	176.3	0	0	109.7	V67 V97 L98 R99 E100	E60-V67 HydrophobicContact CG-CG1 4.26Å; E60-V67 HydrophobicContact CG-CG2 4.24Å; E60-V97 HydrophobicContact CG-CG1 4.01Å; E60-V97 VanDerWaalsContact OE2-CG1 3.3Å; E60-V97 WeakPolarHBondContact OE2-CG1 3.44Å; E60-L98 PolarHBondContact N-O 3.08Å; E60-R99 WeakPolarHBondContact O-CA 3.29Å; E60-E100 PolarHBondContact O-N 3.3Å; E60-E100 VanDerWaalsContact O-N 3.07Å
61	T	84.6	Confident	83.1	Confident	15 Å²	15	66.7 Å²	66.7	9%	0.092	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.6	170.4	45.2	0	0	0	0	110	N63 A64 E66 A105	T61-N63 PolarHBondContact O-N 3.14Å; T61-N63 VanDerWaalsContact O-N 3.08Å; T61-A64 PolarHBondContact O-N 2.91Å; T61-A64 WeakPolarHBondContact OG1-CB 2.97Å; T61-A64 PolarHBondContact OG1-O 3.09Å; T61-E66 PolarHBondContact OG1-O 2.92Å; T61-A105 HydrophobicContact CG2-CB 3.45Å; T61-A105 VanDerWaalsContact CG2-CB 3.45Å
62	P	73.1	Confident	83.5	Confident	99 Å²	99	60.8 Å²	60.8	64%	0.643	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.6	-174.6	22.8	-31.4	0	0	0	114.4	E100	P62-E100 WeakPolarHBondContact CD-O 3.34Å
63	N	66	Low	83.9	Confident	162 Å²	162	58.9 Å²	58.9	87%	0.866	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	2.9	-174.4	-63.2	-10.5	0	0	0	114.1	T61	T61-N63 PolarHBondContact O-N 3.14Å; T61-N63 VanDerWaalsContact O-N 3.08Å
64	A	66.6	Low	84.1	Confident	45 Å²	45	57.9 Å²	57.9	37%	0.372	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	143	178.8	0	0	0	0	0	110.4	T61 E66	T61-A64 PolarHBondContact O-N 2.91Å; T61-A64 WeakPolarHBondContact OG1-CB 2.97Å; T61-A64 PolarHBondContact OG1-O 3.09Å; A64-E66 PolarHBondContact O-N 2.92Å; A64-E66 VanDerWaalsContact O-N 3.13Å
65	D	64	Low	84	Confident	171 Å²	171	60.9 Å²	60.9	91%	0.914	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	6.8	178.4	-101.7	-6.7	0	0	0	113.3	V67	D65-V67 PolarHBondContact O-N 3.11Å; D65-V67 VanDerWaalsContact O-N 3.09Å
66	E	68.4	Low	84.1	Confident	139 Å²	139	62.1 Å²	62.1	65%	0.65	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	99.4	176.6	-70	-168.6	176.8	0	0	110.6	T61 A64	T61-E66 PolarHBondContact OG1-O 2.92Å; A64-E66 PolarHBondContact O-N 2.92Å; A64-E66 VanDerWaalsContact O-N 3.13Å
67	V	79.9	Confident	84.1	Confident	61 Å²	61	61.3 Å²	61.3	37%	0.37	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	111.5	171.3	-176	0	0	0	0	109.2	R58 V59 E60 D65 V69	R58-V67 HydrophobicContact CB-CG1 4.35Å; V59-V67 WeakPolarHBondContact O-CA 3.33Å; E60-V67 HydrophobicContact CG-CG1 4.26Å; E60-V67 HydrophobicContact CG-CG2 4.24Å; D65-V67 PolarHBondContact O-N 3.11Å; D65-V67 VanDerWaalsContact O-N 3.09Å; V67-V69 HydrophobicContact CG1-CG2 4.18Å
68	K	84.4	Confident	84.2	Confident	70 Å²	70	62.7 Å²	62.7	30%	0.304	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126	171.1	-74.4	-176	178.8	-179.4	0	109.5	V59 A105 T106 D109	V59-K68 HydrophobicContact CB-CB 4.32Å; V59-K68 PolarHBondContact N-O 3.34Å; V59-K68 PolarHBondContact O-N 3.44Å; V59-K68 VanDerWaalsContact O-N 3.08Å; K68-A105 PolarHBondContact NZ-O 2.89Å; K68-T106 PolarHBondContact NZ-O 2.92Å; K68-D109 IonicContact NZ-OD1 3.45Å; K68-D109 PolarHBondContact NZ-OD1 3.06Å
69	V	88.9	Confident	84.3	Confident	71 Å²	71	64.2 Å²	64.2	43%	0.43	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.8	176.5	-171.7	0	0	0	0	109.3	S56 L57 R58 V67	S56-V69 WeakPolarHBondContact OG-CG1 3.36Å; L57-V69 CarbonylContact O-C 3.6Å; L57-V69 WeakPolarHBondContact O-CA 3.35Å; R58-V69 HydrophobicContact CG-CG1 4.39Å; R58-V69 HydrophobicContact CG-CG2 4.15Å; V67-V69 HydrophobicContact CG1-CG2 4.18Å
70	I	89.9	Confident	84.4	Confident	27 Å²	27	67.9 Å²	67.9	14%	0.138	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.6	-178.8	-55.3	175	0	0	0	108.5	L47 L57 F108 I112	L47-I70 HydrophobicContact CD1-CG2 4.23Å; L57-I70 HydrophobicContact CB-CB 4.4Å; L57-I70 PolarHBondContact N-O 3.44Å; L57-I70 PolarHBondContact O-N 3.21Å; I70-F108 HydrophobicContact CD1-CD1 3.71Å; I70-F108 HydrophobicContact CD1-CE1 4.2Å; I70-I112 HydrophobicContact CD1-CG1 4.23Å; I70-I112 HydrophobicContact CG2-CG2 4.34Å
71	Q	92.1	Very high	84.7	Confident	79 Å²	79	65.4 Å²	65.4	37%	0.369	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.7	171.1	-61.7	-48.9	-52.9	0	0	109.2	S56	S56-Q71 PolarHBondContact OG-NE2 3.22Å
72	A	92.7	Very high	85.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	176.2	-174.1	0	0	0	0	0	112	S53 D54 V55 L57 L77 Y116	S53-A72 WeakPolarHBondContact CA-O 3.32Å; S53-A72 VanDerWaalsContact CB-O 3.32Å; S53-A72 WeakPolarHBondContact CB-O 3.35Å; D54-A72 PolarHBondContact N-O 3.37Å; V55-A72 HydrophobicContact CG1-CB 4.1Å; V55-A72 WeakPolarHBondContact CG1-O 3.33Å; V55-A72 PolarHBondContact N-O 2.78Å; V55-A72 PolarHBondContact O-N 3.26Å; V55-A72 VanDerWaalsContact O-O 3.1Å; L57-A72 HydrophobicContact CD1-CB 4.32Å; L57-A72 HydrophobicContact CG-CB 4.42Å; A72-L77 HydrophobicContact CB-CD1 3.86Å; A72-L77 HydrophobicContact CB-CG 4.48Å; A72-Y116 WeakPolarHBondContact CA-OH 3.31Å
73	H	93.1	Very high	86	Confident	19 Å²	19	63.4 Å²	63.4	9%	0.088	34%	0.344	C	S	.	.			trans	-117.6	117.9	-173.9	-56.5	77.5	0	0	0	108.9	L46 N51 G52 S53 D54 L75 V76 L77 Y116	L46-H73 WeakPolarHBondContact CD2-CE1 3.43Å; L46-H73 WeakPolarHBondContact CD2-ND1 3.21Å; L46-H73 WeakPolarHBondContact CD2-NE2 3.44Å; N51-H73 PolarHBondContact O-NE2 3.01Å; N51-H73 VanDerWaalsContact O-NE2 3.16Å; G52-H73 VanDerWaalsContact C-NE2 3.35Å; G52-H73 PolarHBondContact O-CD2 3.24Å; G52-H73 VanDerWaalsContact O-CD2 3.31Å; S53-H73 PolarHBondContact N-NE2 3.44Å; D54-H73 VanDerWaalsContact OD1-CA 3.29Å; D54-H73 WeakPolarHBondContact OD1-CA 3.41Å; H73-L75 PolarHBondContact O-N 3.18Å; H73-V76 HydrophobicContact CB-CB 4.41Å; H73-V76 HydrophobicContact CB-CG2 4.06Å; H73-V76 PolarHBondContact O-N 3.23Å; H73-V76 VanDerWaalsContact O-N 3.14Å; H73-L77 PolarHBondContact O-N 3.01Å; H73-Y116 PolarHBondContact N-OH 3.12Å; H73-Y116 AromaticContact ND1-CE1 3.73Å; H73-Y116 AromaticContact ND1-CZ 3.79Å; H73-Y116 PolarHBondContact ND1-OH 3.32Å
74	S	90.8	Very high	87.2	Confident	17 Å²	17	55.7 Å²	55.7	12%	0.119	30%	0.303	C	S	.	.	H	α-helix	trans	-55.9	-41.2	-174.5	-174.9	0	0	0	0	111.7	D54 V76 L77 S78 L88 R91	D54-S74 PolarHBondContact OD1-N 3.14Å; D54-S74 WeakPolarHBondContact OD2-CB 3.09Å; S74-V76 PolarHBondContact O-N 2.76Å; S74-L77 PolarHBondContact O-N 3.05Å; S74-S78 WeakPolarHBondContact O-CB 3.21Å; S74-S78 PolarHBondContact O-N 3.05Å; S74-S78 PolarHBondContact O-OG 3.22Å; S74-L88 WeakPolarHBondContact OG-CD1 3.47Å; S74-R91 PolarHBondContact OG-NH1 3.48Å
75	L	90.2	Very high	88.4	Confident	135 Å²	135	58.1 Å²	58.1	71%	0.707	31%	0.306	S	S	*	.	H	α-helix	trans	-61.2	-42.9	180	179.1	65	0	0	0	112.8	H73 S78 L79	H73-L75 PolarHBondContact O-N 3.18Å; L75-S78 PolarHBondContact O-OG 3.19Å; L75-S78 VanDerWaalsContact O-OG 3.06Å; L75-L79 WeakPolarHBondContact O-CB 3.33Å; L75-L79 PolarHBondContact O-N 2.96Å; L75-L79 VanDerWaalsContact O-N 3.13Å
76	V	91.9	Very high	89.7	Confident	27 Å²	27	55.9 Å²	55.9	16%	0.164	29%	0.29	C	S	.	.	H	α-helix	trans	-69.3	-42.8	-178.6	180	0	0	0	0	109.9	H73 S74 Q80 Y116	H73-V76 HydrophobicContact CB-CB 4.41Å; H73-V76 HydrophobicContact CB-CG2 4.06Å; H73-V76 PolarHBondContact O-N 3.23Å; H73-V76 VanDerWaalsContact O-N 3.14Å; S74-V76 PolarHBondContact O-N 2.76Å; V76-Q80 WeakPolarHBondContact O-CG 3.49Å; V76-Q80 PolarHBondContact O-N 3.48Å; V76-Y116 HydrophobicContact CB-CE1 4.21Å; V76-Y116 HydrophobicContact CG1-CD1 3.97Å; V76-Y116 HydrophobicContact CG1-CD2 3.99Å; V76-Y116 HydrophobicContact CG1-CE1 4.02Å; V76-Y116 HydrophobicContact CG1-CE2 4.05Å; V76-Y116 HydrophobicContact CG1-CG 3.98Å; V76-Y116 HydrophobicContact CG2-CE1 4.13Å
77	L	92.2	Very high	90.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-43.8	179.3	-62.9	178.5	0	0	0	112.2	V55 L57 A72 H73 S74 L79 Q80 S81 F84 L88 I112 L115 Y116	V55-L77 HydrophobicContact CG1-CD1 4.2Å; L57-L77 HydrophobicContact CD1-CD1 3.93Å; L57-L77 HydrophobicContact CD2-CD1 4.29Å; L57-L77 HydrophobicContact CG-CD1 4.42Å; A72-L77 HydrophobicContact CB-CD1 3.86Å; A72-L77 HydrophobicContact CB-CG 4.48Å; H73-L77 PolarHBondContact O-N 3.01Å; S74-L77 PolarHBondContact O-N 3.05Å; L77-L79 VanDerWaalsContact C-N 3.32Å; L77-L79 PolarHBondContact O-N 3.29Å; L77-Q80 PolarHBondContact O-N 3.42Å; L77-S81 PolarHBondContact O-N 2.9Å; L77-S81 VanDerWaalsContact O-N 3.15Å; L77-F84 HydrophobicContact CB-CB 4.04Å; L77-F84 HydrophobicContact CB-CD2 4.35Å; L77-F84 HydrophobicContact CB-CG 4.17Å; L77-L88 HydrophobicContact CB-CD1 3.97Å; L77-L88 HydrophobicContact CD1-CD1 4.43Å; L77-I112 HydrophobicContact CD2-CD1 4.05Å; L77-L115 HydrophobicContact CD2-CD1 3.66Å; L77-Y116 HydrophobicContact CD2-CE2 4.34Å
78	S	92.4	Very high	91.1	Very high	29 Å²	29	49.6 Å²	49.6	20%	0.203	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-35.7	179.6	62.7	0	0	0	0	112.2	S74 L75 Q80	S74-S78 WeakPolarHBondContact O-CB 3.21Å; S74-S78 PolarHBondContact O-N 3.05Å; S74-S78 PolarHBondContact O-OG 3.22Å; L75-S78 PolarHBondContact O-OG 3.19Å; L75-S78 VanDerWaalsContact O-OG 3.06Å; S78-Q80 VanDerWaalsContact C-N 3.26Å; S78-Q80 PolarHBondContact O-N 2.89Å
79	L	91.9	Very high	91.2	Very high	128 Å²	128	52.9 Å²	52.9	67%	0.67	28%	0.278	S	S	*	.	H	α-helix	trans	-65.1	-30.4	178.6	-173.4	141.8	0	0	0	112.7	L75 L77	L75-L79 WeakPolarHBondContact O-CB 3.33Å; L75-L79 PolarHBondContact O-N 2.96Å; L75-L79 VanDerWaalsContact O-N 3.13Å; L77-L79 VanDerWaalsContact C-N 3.32Å; L77-L79 PolarHBondContact O-N 3.29Å
80	Q	91.6	Very high	90.9	Very high	78 Å²	78	53.6 Å²	53.6	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-97.4	-15.7	-175.3	-61.3	-66.1	-12	0	0	113.9	V76 L77 S78 L115	V76-Q80 WeakPolarHBondContact O-CG 3.49Å; V76-Q80 PolarHBondContact O-N 3.48Å; L77-Q80 PolarHBondContact O-N 3.42Å; S78-Q80 VanDerWaalsContact C-N 3.26Å; S78-Q80 PolarHBondContact O-N 2.89Å; Q80-L115 HydrophobicContact CB-CB 4.28Å; Q80-L115 HydrophobicContact CB-CD2 3.83Å; Q80-L115 HydrophobicContact CG-CB 4.22Å; Q80-L115 HydrophobicContact CG-CD2 4.5Å; Q80-L115 WeakPolarHBondContact CG-O 3.22Å
81	S	93.9	Very high	90.4	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.293	C	S	.	.			trans	-150	120.5	-173.7	170.7	0	0	0	0	111	L77 V83 F84 E85 Y137	L77-S81 PolarHBondContact O-N 2.9Å; L77-S81 VanDerWaalsContact O-N 3.15Å; S81-V83 PolarHBondContact O-N 2.87Å; S81-V83 PolarHBondContact OG-N 3.25Å; S81-F84 PolarHBondContact O-N 2.84Å; S81-F84 PolarHBondContact OG-N 3.3Å; S81-E85 PolarHBondContact O-N 2.87Å; S81-Y137 WeakPolarHBondContact CB-O 3.43Å; S81-Y137 PolarHBondContact OG-O 3.44Å
82	S	92	Very high	89.6	Confident	45 Å²	45	60.4 Å²	60.4	32%	0.315	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-28.3	174.3	73.8	0	0	0	0	112.2	E85 E86	S82-E85 WeakPolarHBondContact O-CB 3.46Å; S82-E85 PolarHBondContact O-N 3.02Å; S82-E86 WeakPolarHBondContact O-CG 3.18Å; S82-E86 PolarHBondContact O-N 3.48Å
83	V	92.5	Very high	89.1	Confident	27 Å²	27	63.6 Å²	63.6	16%	0.164	34%	0.342	C	S	.	.	H	α-helix	trans	-69.5	-43	177.6	179.2	0	0	0	0	110.4	S81 M87 Y137 K138	S81-V83 PolarHBondContact O-N 2.87Å; S81-V83 PolarHBondContact OG-N 3.25Å; V83-M87 HydrophobicContact CG1-CE 4.3Å; V83-M87 WeakPolarHBondContact O-CB 3.41Å; V83-M87 PolarHBondContact O-N 3.14Å; V83-Y137 HydrophobicContact CB-CD1 4.44Å; V83-Y137 HydrophobicContact CG1-CD1 4.14Å; V83-K138 HydrophobicContact CG2-CB 4.14Å; V83-K138 HydrophobicContact CG2-CD 3.8Å; V83-K138 HydrophobicContact CG2-CG 3.76Å
84	F	92.3	Very high	88.6	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-40	172.6	-78	-56.7	0	0	0	111.3	L77 S81 M87 L88 L98 F108 F111 I112 L115 Y137	L77-F84 HydrophobicContact CB-CB 4.04Å; L77-F84 HydrophobicContact CB-CD2 4.35Å; L77-F84 HydrophobicContact CB-CG 4.17Å; S81-F84 PolarHBondContact O-N 2.84Å; S81-F84 PolarHBondContact OG-N 3.3Å; F84-M87 PolarHBondContact O-N 3.41Å; F84-L88 HydrophobicContact CB-CD1 4.03Å; F84-L88 WeakPolarHBondContact O-CB 3.34Å; F84-L88 VanDerWaalsContact O-CD1 3.26Å; F84-L88 WeakPolarHBondContact O-CD1 3.26Å; F84-L88 WeakPolarHBondContact O-CG 3.41Å; F84-L88 PolarHBondContact O-N 3.04Å; F84-L98 HydrophobicContact CE1-CD1 4.15Å; F84-F108 HydrophobicContact CZ-CZ 4.42Å; F84-F111 AromaticContact CE2-CE1 3.9Å; F84-F111 HydrophobicContact CE2-CE1 3.9Å; F84-F111 HydrophobicContact CE2-CZ 4.33Å; F84-F111 HydrophobicContact CZ-CE1 4.29Å; F84-I112 HydrophobicContact CZ-CD1 4.32Å; F84-L115 HydrophobicContact CD2-CD1 4.24Å; F84-L115 HydrophobicContact CE2-CD1 3.92Å; F84-Y137 HydrophobicContact CD1-CD1 4.37Å; F84-Y137 HydrophobicContact CD1-CE1 4.31Å; F84-Y137 HydrophobicContact CD2-CD1 4Å; F84-Y137 AromaticContact CE1-CD1 3.9Å; F84-Y137 HydrophobicContact CE1-CD1 3.9Å; F84-Y137 AromaticContact CE1-CE1 3.53Å; F84-Y137 HydrophobicContact CE1-CE1 3.53Å; F84-Y137 AromaticContact CE2-CD1 3.47Å; F84-Y137 HydrophobicContact CE2-CD1 3.47Å; F84-Y137 VanDerWaalsContact CE2-CD1 3.47Å; F84-Y137 AromaticContact CE2-CE1 3.87Å; F84-Y137 HydrophobicContact CE2-CE1 3.87Å; F84-Y137 AromaticContact CE2-CG 3.85Å; F84-Y137 HydrophobicContact CE2-CG 3.85Å; F84-Y137 HydrophobicContact CG-CD1 4.41Å; F84-Y137 AromaticContact CZ-CD1 3.41Å; F84-Y137 HydrophobicContact CZ-CD1 3.41Å; F84-Y137 VanDerWaalsContact CZ-CD1 3.41Å; F84-Y137 AromaticContact CZ-CE1 3.26Å; F84-Y137 HydrophobicContact CZ-CE1 3.26Å; F84-Y137 HydrophobicContact CZ-CE2 4.44Å; F84-Y137 HydrophobicContact CZ-CG 4.07Å; F84-Y137 AromaticContact CZ-CZ 3.82Å
85	E	91.3	Very high	88.4	Confident	96 Å²	96	67.9 Å²	67.9	45%	0.449	37%	0.372	S	S	.	.	H	α-helix	trans	-54.5	-55.5	174.5	-176.1	178.4	-163.4	0	0	112	S81 S82 M87 L88 L89	S81-E85 PolarHBondContact O-N 2.87Å; S82-E85 WeakPolarHBondContact O-CB 3.46Å; S82-E85 PolarHBondContact O-N 3.02Å; E85-M87 PolarHBondContact O-N 3.29Å; E85-L88 PolarHBondContact O-N 3.26Å; E85-L89 HydrophobicContact CG-CD1 3.91Å; E85-L89 WeakPolarHBondContact O-CB 3.44Å; E85-L89 WeakPolarHBondContact O-CG 3.43Å; E85-L89 PolarHBondContact O-N 3.19Å
86	E	90.9	Very high	88.2	Confident	124 Å²	124	62 Å²	62	58%	0.579	34%	0.341	S	S	*	.	H	α-helix	trans	-58.9	-47.2	178.3	-72.9	172.2	-161.5	0	0	111.9	S82 L88 L89 S90	S82-E86 WeakPolarHBondContact O-CG 3.18Å; S82-E86 PolarHBondContact O-N 3.48Å; E86-L88 VanDerWaalsContact C-N 3.34Å; E86-L88 PolarHBondContact O-N 3.4Å; E86-L89 PolarHBondContact O-N 3.46Å; E86-S90 WeakPolarHBondContact O-CB 3.41Å; E86-S90 PolarHBondContact O-N 3.46Å; E86-S90 PolarHBondContact O-OG 3.02Å
87	M	89.7	Confident	88	Confident	59 Å²	59	64.1 Å²	64.1	29%	0.291	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-41.3	-178.9	-173.3	-178.4	-62.6	0	0	111.8	V83 F84 E85 S90 R91 V96 L98	V83-M87 HydrophobicContact CG1-CE 4.3Å; V83-M87 WeakPolarHBondContact O-CB 3.41Å; V83-M87 PolarHBondContact O-N 3.14Å; F84-M87 PolarHBondContact O-N 3.41Å; E85-M87 PolarHBondContact O-N 3.29Å; M87-S90 PolarHBondContact O-N 2.68Å; M87-S90 PolarHBondContact O-OG 3.37Å; M87-S90 VanDerWaalsContact O-OG 3.06Å; M87-R91 PolarHBondContact O-N 3.16Å; M87-V96 HydrophobicContact CG-CG1 3.99Å; M87-V96 HydrophobicContact SD-CG1 3.31Å; M87-V96 WeakPolarHBondContact SD-CG1 3.32Å; M87-L98 HydrophobicContact CE-CD2 3.9Å; M87-L98 HydrophobicContact SD-CD2 3.57Å; M87-L98 VanDerWaalsContact SD-CD2 3.57Å
88	L	88.4	Confident	87.8	Confident	9 Å²	9	64.4 Å²	64.4	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-76.6	-26.4	-178.6	-69.2	166.3	0	0	0	112.7	V55 S74 L77 F84 E85 E86 R91 V96	V55-L88 HydrophobicContact CB-CD2 4.23Å; V55-L88 HydrophobicContact CG1-CD2 4.34Å; V55-L88 HydrophobicContact CG2-CD2 3.73Å; S74-L88 WeakPolarHBondContact OG-CD1 3.47Å; L77-L88 HydrophobicContact CB-CD1 3.97Å; L77-L88 HydrophobicContact CD1-CD1 4.43Å; F84-L88 HydrophobicContact CB-CD1 4.03Å; F84-L88 WeakPolarHBondContact O-CB 3.34Å; F84-L88 VanDerWaalsContact O-CD1 3.26Å; F84-L88 WeakPolarHBondContact O-CD1 3.26Å; F84-L88 WeakPolarHBondContact O-CG 3.41Å; F84-L88 PolarHBondContact O-N 3.04Å; E85-L88 PolarHBondContact O-N 3.26Å; E86-L88 VanDerWaalsContact C-N 3.34Å; E86-L88 PolarHBondContact O-N 3.4Å; L88-R91 WeakPolarHBondContact O-CD 3.43Å; L88-R91 VanDerWaalsContact O-CG 3.26Å; L88-R91 WeakPolarHBondContact O-CG 3.4Å; L88-R91 PolarHBondContact O-NH1 3.16Å; L88-V96 HydrophobicContact CD2-CG2 4.05Å
89	L	86.4	Confident	87.6	Confident	138 Å²	138	71.8 Å²	71.8	72%	0.723	38%	0.379	S	S	*	.	H	α-helix	trans	-73.2	-38.9	171	-74.6	168.4	0	0	0	111.8	E85 E86 R91	E85-L89 HydrophobicContact CG-CD1 3.91Å; E85-L89 WeakPolarHBondContact O-CB 3.44Å; E85-L89 WeakPolarHBondContact O-CG 3.43Å; E85-L89 PolarHBondContact O-N 3.19Å; E86-L89 PolarHBondContact O-N 3.46Å; L89-R91 VanDerWaalsContact C-N 3.27Å; L89-R91 PolarHBondContact O-N 3.5Å
90	S	82.8	Confident	87.4	Confident	86 Å²	86	66.2 Å²	66.2	60%	0.601	35%	0.35	S	S	*	.	S	Bend	trans	-81.4	1.7	179.2	70.5	0	0	0	0	114.8	E86 M87	E86-S90 WeakPolarHBondContact O-CB 3.41Å; E86-S90 PolarHBondContact O-N 3.46Å; E86-S90 PolarHBondContact O-OG 3.02Å; M87-S90 PolarHBondContact O-N 2.68Å; M87-S90 PolarHBondContact O-OG 3.37Å; M87-S90 VanDerWaalsContact O-OG 3.06Å
91	R	80.3	Confident	87.2	Confident	75 Å²	75	64.9 Å²	64.9	28%	0.283	35%	0.349	S	S	.	.			trans	-74.5	134.3	-171.2	82.6	-174.1	-175.6	-122.3	19.7	111.7	D54 S74 M87 L88 L89 S93	D54-R91 PolarHBondContact O-NH2 3.27Å; D54-R91 IonicContact OD2-NH2 3.13Å; D54-R91 PolarHBondContact OD2-NH2 3.04Å; S74-R91 PolarHBondContact OG-NH1 3.48Å; M87-R91 PolarHBondContact O-N 3.16Å; L88-R91 WeakPolarHBondContact O-CD 3.43Å; L88-R91 VanDerWaalsContact O-CG 3.26Å; L88-R91 WeakPolarHBondContact O-CG 3.4Å; L88-R91 PolarHBondContact O-NH1 3.16Å; L89-R91 VanDerWaalsContact C-N 3.27Å; L89-R91 PolarHBondContact O-N 3.5Å; R91-S93 WeakPolarHBondContact CD-O 3.36Å; R91-S93 WeakPolarHBondContact CG-O 3.33Å
92	N	74.9	Confident	86.9	Confident	175 Å²	175	68.2 Å²	68.2	94%	0.936	37%	0.372	S	S	*	.	S	Bend	trans	-95	-10.9	173.1	-66.3	-24.8	0	0	0	113
93	S	81.3	Confident	86.7	Confident	66 Å²	66	70.7 Å²	70.7	46%	0.462	38%	0.382	S	S	.	.	S	Bend	trans	-138	163.1	-178.6	68.6	0	0	0	0	110.8	R91 T95	R91-S93 WeakPolarHBondContact CD-O 3.36Å; R91-S93 WeakPolarHBondContact CG-O 3.33Å; S93-T95 PolarHBondContact O-N 2.87Å; S93-T95 PolarHBondContact OG-N 2.91Å; S93-T95 PolarHBondContact OG-O 3.04Å
94	S	82.4	Confident	86.6	Confident	76 Å²	76	69.6 Å²	69.6	53%	0.531	38%	0.376	S	S	.	.	S	Bend	trans	-71.4	-4.6	173.8	56.4	0	0	0	0	113.4	V55 S56	V55-S94 WeakPolarHBondContact CA-O 3.28Å; S56-S94 PolarHBondContact N-O 2.84Å
95	T	86.3	Confident	86.4	Confident	50 Å²	50	70 Å²	70	31%	0.307	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.2	-175.5	-58.4	0	0	0	0	110.3	S56 R58 S93	S56-T95 CarbonylContact O-C 3.58Å; S56-T95 WeakPolarHBondContact O-CA 3.45Å; R58-T95 HydrophobicContact CG-CG2 3.62Å; S93-T95 PolarHBondContact O-N 2.87Å; S93-T95 PolarHBondContact OG-N 2.91Å; S93-T95 PolarHBondContact OG-O 3.04Å
96	V	86.9	Confident	86.4	Confident	11 Å²	11	69.1 Å²	69.1	7%	0.067	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.2	178.9	176.9	0	0	0	0	108.7	V55 S56 L57 R58 M87 L88 L98	V55-V96 HydrophobicContact CG2-CB 4.45Å; V55-V96 HydrophobicContact CG2-CG2 3.81Å; S56-V96 PolarHBondContact O-N 3.01Å; L57-V96 HydrophobicContact CD2-CB 4.03Å; L57-V96 HydrophobicContact CD2-CG1 4.41Å; R58-V96 PolarHBondContact N-O 3.07Å; M87-V96 HydrophobicContact CG-CG1 3.99Å; M87-V96 HydrophobicContact SD-CG1 3.31Å; M87-V96 WeakPolarHBondContact SD-CG1 3.32Å; L88-V96 HydrophobicContact CD2-CG2 4.05Å; V96-L98 HydrophobicContact CG1-CD2 3.94Å; V96-L98 HydrophobicContact CG1-CG 4.23Å
97	V	86.9	Confident	86.5	Confident	72 Å²	72	63.2 Å²	63.2	44%	0.436	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	121.6	178.4	-177.6	0	0	0	0	109.4	R58 E60	R58-V97 HydrophobicContact CB-CG2 4.42Å; R58-V97 CarbonylContact O-C 3.38Å; R58-V97 WeakPolarHBondContact O-CA 3.24Å; E60-V97 HydrophobicContact CG-CG1 4.01Å; E60-V97 VanDerWaalsContact OE2-CG1 3.3Å; E60-V97 WeakPolarHBondContact OE2-CG1 3.44Å
98	L	88.6	Confident	86.6	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.2	-178.2	-61.1	173.7	0	0	0	108.9	L57 R58 V59 E60 F84 M87 V96 F108 Y137	L57-L98 HydrophobicContact CB-CD1 4.29Å; L57-L98 HydrophobicContact CD1-CD1 4.46Å; L57-L98 HydrophobicContact CD2-CD1 4.25Å; R58-L98 PolarHBondContact O-N 3.43Å; V59-L98 CarbonylContact C-O 3.58Å; V59-L98 WeakPolarHBondContact CA-O 3.49Å; V59-L98 HydrophobicContact CG2-CD1 4.47Å; E60-L98 PolarHBondContact N-O 3.08Å; F84-L98 HydrophobicContact CE1-CD1 4.15Å; M87-L98 HydrophobicContact CE-CD2 3.9Å; M87-L98 HydrophobicContact SD-CD2 3.57Å; M87-L98 VanDerWaalsContact SD-CD2 3.57Å; V96-L98 HydrophobicContact CG1-CD2 3.94Å; V96-L98 HydrophobicContact CG1-CG 4.23Å; L98-F108 HydrophobicContact CD1-CE1 4.16Å; L98-F108 HydrophobicContact CD1-CE2 4.27Å; L98-F108 HydrophobicContact CD1-CZ 3.51Å; L98-Y137 HydrophobicContact CD2-CE1 4.34Å
99	R	87.8	Confident	86.8	Confident	184 Å²	184	63.5 Å²	63.5	69%	0.694	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.2	177.7	-67.1	-178.3	179.3	168.7	0.2	110	E60 K136	E60-R99 WeakPolarHBondContact O-CA 3.29Å; R99-K136 PolarHBondContact O-NZ 2.8Å
100	E	89.1	Confident	87.1	Confident	12 Å²	12	59 Å²	59	6%	0.056	33%	0.33	C	S	.	.			trans	-124.9	155.4	-178.8	-60	-50.7	143.1	0	0	111.8	V59 E60 P62 C104 F108 L133 K136 Y137	V59-E100 HydrophobicContact CG1-CB 4.11Å; V59-E100 HydrophobicContact CG1-CG 3.99Å; E60-E100 PolarHBondContact O-N 3.3Å; E60-E100 VanDerWaalsContact O-N 3.07Å; P62-E100 WeakPolarHBondContact CD-O 3.34Å; E100-C104 HydrophobicContact CB-CB 4.06Å; E100-F108 HydrophobicContact CG-CD2 4.21Å; E100-F108 HydrophobicContact CG-CE2 4.25Å; E100-L133 HydrophobicContact CG-CD2 4.39Å; E100-K136 WeakPolarHBondContact OE1-CE 3.45Å; E100-K136 IonicContact OE1-NZ 3.47Å; E100-K136 PolarHBondContact OE1-NZ 3.47Å; E100-K136 IonicContact OE2-NZ 3.81Å; E100-K136 PolarHBondContact OE2-NZ 3.2Å; E100-Y137 PolarHBondContact OE1-OH 2.93Å
101	S	87.6	Confident	87.7	Confident	50 Å²	50	54.9 Å²	54.9	35%	0.35	30%	0.301	S	S	.	.			trans	-65.8	157.1	169.2	61.2	0	0	0	0	110.6	D103 C104 A105	S101-D103 VanDerWaalsContact C-N 3.31Å; S101-D103 PolarHBondContact O-N 3.35Å; S101-C104 PolarHBondContact O-N 3.47Å; S101-C104 PolarHBondContact OG-SG 3.04Å; S101-C104 VanDerWaalsContact OG-SG 3.34Å; S101-A105 PolarHBondContact O-N 3.31Å
102	S	86.6	Confident	88.3	Confident	71 Å²	71	51.4 Å²	51.4	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-49.7	-51.5	179.6	-172.3	0	0	0	0	111.9	C104 A105 T106	S102-C104 VanDerWaalsContact C-N 3.31Å; S102-C104 PolarHBondContact O-N 3.13Å; S102-A105 WeakPolarHBondContact O-CB 2.95Å; S102-A105 PolarHBondContact O-N 3.01Å; S102-A105 VanDerWaalsContact O-N 3.1Å; S102-T106 WeakPolarHBondContact O-CG2 3.42Å; S102-T106 PolarHBondContact O-N 3.4Å
103	D	87.8	Confident	89.2	Confident	98 Å²	98	47.9 Å²	47.9	52%	0.524	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-41.3	-179.8	-49.4	-26.2	0	0	0	112.7	S101 T106 P129	S101-D103 VanDerWaalsContact C-N 3.31Å; S101-D103 PolarHBondContact O-N 3.35Å; D103-T106 PolarHBondContact O-N 3.31Å; D103-T106 PolarHBondContact O-OG1 3.12Å; D103-P129 HydrophobicContact CB-CB 4.16Å
104	C	90	Very high	89.8	Confident	4 Å²	4	46.2 Å²	46.2	3%	0.027	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-39.5	178.1	-72	0	0	0	0	111.7	E100 S101 S102 T106 V107 F108 L133	E100-C104 HydrophobicContact CB-CB 4.06Å; S101-C104 PolarHBondContact O-N 3.47Å; S101-C104 PolarHBondContact OG-SG 3.04Å; S101-C104 VanDerWaalsContact OG-SG 3.34Å; S102-C104 VanDerWaalsContact C-N 3.31Å; S102-C104 PolarHBondContact O-N 3.13Å; C104-T106 VanDerWaalsContact C-N 3.25Å; C104-T106 PolarHBondContact O-N 3.47Å; C104-V107 WeakPolarHBondContact O-CG2 3.49Å; C104-V107 PolarHBondContact O-N 3.06Å; C104-F108 WeakPolarHBondContact O-CB 3.35Å; C104-F108 PolarHBondContact O-N 2.93Å; C104-L133 HydrophobicContact CB-CD1 4.38Å; C104-L133 HydrophobicContact CB-CD2 4.03Å; C104-L133 HydrophobicContact CB-CG 4.14Å
105	A	89.5	Confident	90.3	Very high	8 Å²	8	42.7 Å²	42.7	7%	0.066	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-32.3	176.2	0	0	0	0	0	112	V59 T61 K68 S101 S102 V107 F108	V59-A105 HydrophobicContact CG1-CB 3.98Å; T61-A105 HydrophobicContact CG2-CB 3.45Å; T61-A105 VanDerWaalsContact CG2-CB 3.45Å; K68-A105 PolarHBondContact NZ-O 2.89Å; S101-A105 PolarHBondContact O-N 3.31Å; S102-A105 WeakPolarHBondContact O-CB 2.95Å; S102-A105 PolarHBondContact O-N 3.01Å; S102-A105 VanDerWaalsContact O-N 3.1Å; A105-V107 VanDerWaalsContact C-N 3.31Å; A105-V107 PolarHBondContact O-N 3.46Å; A105-F108 PolarHBondContact O-N 3.4Å
106	T	90.1	Very high	90.6	Very high	77 Å²	77	40.6 Å²	40.6	47%	0.472	21%	0.207	S	C	.	.	H	α-helix	trans	-65.2	-32.4	176.5	71.7	0	0	0	0	113.6	K68 S102 D103 C104	K68-T106 PolarHBondContact NZ-O 2.92Å; S102-T106 WeakPolarHBondContact O-CG2 3.42Å; S102-T106 PolarHBondContact O-N 3.4Å; D103-T106 PolarHBondContact O-N 3.31Å; D103-T106 PolarHBondContact O-OG1 3.12Å; C104-T106 VanDerWaalsContact C-N 3.25Å; C104-T106 PolarHBondContact O-N 3.47Å
107	V	92.9	Very high	90.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-103.5	1.6	-177.7	-59.4	0	0	0	0	113.3	C104 A105 D109 K110 F111 Q126 P129 L130 L133	C104-V107 WeakPolarHBondContact O-CG2 3.49Å; C104-V107 PolarHBondContact O-N 3.06Å; A105-V107 VanDerWaalsContact C-N 3.31Å; A105-V107 PolarHBondContact O-N 3.46Å; V107-D109 VanDerWaalsContact C-N 3.31Å; V107-D109 PolarHBondContact O-N 3.21Å; V107-K110 WeakPolarHBondContact O-CB 3.34Å; V107-K110 PolarHBondContact O-N 3.5Å; V107-K110 VanDerWaalsContact O-N 3.14Å; V107-F111 PolarHBondContact O-N 3.12Å; V107-Q126 HydrophobicContact CG1-CB 4.07Å; V107-Q126 HydrophobicContact CG1-CG 3.95Å; V107-P129 HydrophobicContact CG1-CG 4.25Å; V107-P129 HydrophobicContact CG2-CB 3.79Å; V107-P129 HydrophobicContact CG2-CG 4.07Å; V107-L130 HydrophobicContact CB-CD2 4.02Å; V107-L130 HydrophobicContact CB-CG 4.11Å; V107-L130 HydrophobicContact CG2-CD2 3.91Å; V107-L130 HydrophobicContact CG2-CG 3.95Å; V107-L133 HydrophobicContact CG2-CD1 3.79Å
108	F	93	Very high	90.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-34.7	-173.4	-161.9	-87.7	0	0	0	112.8	L57 V59 I70 F84 L98 E100 C104 A105 K110 F111 I112 L133 Y137	L57-F108 HydrophobicContact CD1-CE1 4.3Å; V59-F108 HydrophobicContact CG1-CD2 4.47Å; V59-F108 HydrophobicContact CG1-CG 4.4Å; V59-F108 HydrophobicContact CG2-CD1 3.45Å; V59-F108 VanDerWaalsContact CG2-CD1 3.45Å; V59-F108 HydrophobicContact CG2-CD2 4.27Å; V59-F108 HydrophobicContact CG2-CE1 3.52Å; V59-F108 HydrophobicContact CG2-CE2 4.35Å; V59-F108 HydrophobicContact CG2-CG 3.84Å; V59-F108 HydrophobicContact CG2-CZ 4.01Å; I70-F108 HydrophobicContact CD1-CD1 3.71Å; I70-F108 HydrophobicContact CD1-CE1 4.2Å; F84-F108 HydrophobicContact CZ-CZ 4.42Å; L98-F108 HydrophobicContact CD1-CE1 4.16Å; L98-F108 HydrophobicContact CD1-CE2 4.27Å; L98-F108 HydrophobicContact CD1-CZ 3.51Å; E100-F108 HydrophobicContact CG-CD2 4.21Å; E100-F108 HydrophobicContact CG-CE2 4.25Å; C104-F108 WeakPolarHBondContact O-CB 3.35Å; C104-F108 PolarHBondContact O-N 2.93Å; A105-F108 PolarHBondContact O-N 3.4Å; F108-K110 VanDerWaalsContact C-N 3.35Å; F108-K110 PolarHBondContact O-N 3.24Å; F108-F111 HydrophobicContact CD2-CD1 4.47Å; F108-F111 HydrophobicContact CE2-CD1 4.2Å; F108-F111 HydrophobicContact CZ-CD1 4.35Å; F108-F111 WeakPolarHBondContact O-CB 3.38Å; F108-F111 PolarHBondContact O-N 3.38Å; F108-I112 HydrophobicContact CD1-CD1 4.41Å; F108-I112 HydrophobicContact CD1-CG1 3.74Å; F108-I112 HydrophobicContact CE1-CD1 3.63Å; F108-I112 HydrophobicContact CE1-CG1 3.42Å; F108-I112 VanDerWaalsContact CE1-CG1 3.42Å; F108-I112 HydrophobicContact CZ-CD1 4.01Å; F108-I112 HydrophobicContact CZ-CG1 4.25Å; F108-I112 WeakPolarHBondContact O-CG1 3.35Å; F108-I112 PolarHBondContact O-N 3.03Å; F108-L133 HydrophobicContact CD2-CD1 4.17Å; F108-L133 HydrophobicContact CD2-CD2 3.74Å; F108-L133 HydrophobicContact CE2-CD2 3.95Å; F108-Y137 AromaticContact CE2-CE2 3.8Å; F108-Y137 HydrophobicContact CE2-CE2 3.8Å; F108-Y137 AromaticContact CE2-CZ 3.95Å; F108-Y137 WeakPolarHBondContact CE2-OH 3.37Å; F108-Y137 HydrophobicContact CZ-CE2 4.43Å
109	D	91.8	Very high	90.8	Very high	74 Å²	74	46.3 Å²	46.3	40%	0.396	24%	0.243	S	C	.	.	H	α-helix	trans	-60.5	-43.2	174	52.8	-85.6	0	0	0	111.9	K68 V107 F111 I112 R113	K68-D109 IonicContact NZ-OD1 3.45Å; K68-D109 PolarHBondContact NZ-OD1 3.06Å; V107-D109 VanDerWaalsContact C-N 3.31Å; V107-D109 PolarHBondContact O-N 3.21Å; D109-F111 VanDerWaalsContact C-N 3.34Å; D109-F111 PolarHBondContact O-N 3.34Å; D109-I112 PolarHBondContact O-N 3.5Å; D109-R113 WeakPolarHBondContact O-CB 2.87Å; D109-R113 PolarHBondContact O-N 2.89Å
110	K	92.8	Very high	90.9	Very high	44 Å²	44	39.4 Å²	39.4	19%	0.191	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-39.7	174.4	-66.4	-171.1	167.2	-162.7	0	112	V107 F108 R113 Y114 I120 S121	V107-K110 WeakPolarHBondContact O-CB 3.34Å; V107-K110 PolarHBondContact O-N 3.5Å; V107-K110 VanDerWaalsContact O-N 3.14Å; F108-K110 VanDerWaalsContact C-N 3.35Å; F108-K110 PolarHBondContact O-N 3.24Å; K110-R113 PolarHBondContact O-N 2.89Å; K110-Y114 PolarHBondContact O-N 2.87Å; K110-I120 HydrophobicContact CB-CD1 3.98Å; K110-I120 HydrophobicContact CB-CG1 4.39Å; K110-S121 PolarHBondContact NZ-O 3.34Å
111	F	94.9	Very high	90.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-48.5	176.3	171	-107.7	0	0	0	111.3	F84 V107 F108 D109 R113 Y114 L115 L130 L133 Y137 V139 L142	F84-F111 AromaticContact CE2-CE1 3.9Å; F84-F111 HydrophobicContact CE2-CE1 3.9Å; F84-F111 HydrophobicContact CE2-CZ 4.33Å; F84-F111 HydrophobicContact CZ-CE1 4.29Å; V107-F111 PolarHBondContact O-N 3.12Å; F108-F111 HydrophobicContact CD2-CD1 4.47Å; F108-F111 HydrophobicContact CE2-CD1 4.2Å; F108-F111 HydrophobicContact CZ-CD1 4.35Å; F108-F111 WeakPolarHBondContact O-CB 3.38Å; F108-F111 PolarHBondContact O-N 3.38Å; D109-F111 VanDerWaalsContact C-N 3.34Å; D109-F111 PolarHBondContact O-N 3.34Å; F111-R113 PolarHBondContact O-N 3.25Å; F111-Y114 WeakPolarHBondContact O-CB 3.19Å; F111-Y114 PolarHBondContact O-N 2.81Å; F111-L115 HydrophobicContact CE1-CD1 4.08Å; F111-L115 HydrophobicContact CE2-CD2 4.33Å; F111-L115 HydrophobicContact CZ-CD1 4.13Å; F111-L115 HydrophobicContact CZ-CD2 4.28Å; F111-L115 HydrophobicContact CZ-CG 4.49Å; F111-L115 PolarHBondContact O-N 3.09Å; F111-L130 HydrophobicContact CB-CD2 4.12Å; F111-L133 HydrophobicContact CB-CD1 3.89Å; F111-L133 HydrophobicContact CD2-CB 4.07Å; F111-L133 HydrophobicContact CE2-CB 4.35Å; F111-L133 HydrophobicContact CG-CB 4.18Å; F111-L133 HydrophobicContact CG-CD1 4.15Å; F111-Y137 HydrophobicContact CD1-CD2 4.49Å; F111-Y137 AromaticContact CE1-CD2 3.56Å; F111-Y137 HydrophobicContact CE1-CD2 3.56Å; F111-Y137 HydrophobicContact CE1-CE2 4.05Å; F111-Y137 HydrophobicContact CE1-CG 4.01Å; F111-Y137 AromaticContact CZ-CD2 3.66Å; F111-Y137 HydrophobicContact CZ-CD2 3.66Å; F111-Y137 AromaticContact CZ-CG 3.91Å; F111-Y137 HydrophobicContact CZ-CG 3.91Å; F111-V139 HydrophobicContact CE2-CB 4.48Å; F111-V139 HydrophobicContact CE2-CG2 4.02Å; F111-V139 HydrophobicContact CZ-CG2 3.94Å; F111-L142 HydrophobicContact CD2-CD2 3.49Å; F111-L142 VanDerWaalsContact CD2-CD2 3.49Å; F111-L142 HydrophobicContact CE2-CD2 3.76Å
112	I	93.9	Very high	91	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-43.5	176.4	-64.5	-59.5	0	0	0	110.9	L47 L57 I70 L77 F84 F108 D109 Y114 L115 Y116	L47-I112 HydrophobicContact CD1-CG2 3.85Å; L47-I112 HydrophobicContact CD2-CG2 4.09Å; L57-I112 HydrophobicContact CD1-CD1 3.73Å; L57-I112 HydrophobicContact CD1-CG1 4.3Å; I70-I112 HydrophobicContact CD1-CG1 4.23Å; I70-I112 HydrophobicContact CG2-CG2 4.34Å; L77-I112 HydrophobicContact CD2-CD1 4.05Å; F84-I112 HydrophobicContact CZ-CD1 4.32Å; F108-I112 HydrophobicContact CD1-CD1 4.41Å; F108-I112 HydrophobicContact CD1-CG1 3.74Å; F108-I112 HydrophobicContact CE1-CD1 3.63Å; F108-I112 HydrophobicContact CE1-CG1 3.42Å; F108-I112 VanDerWaalsContact CE1-CG1 3.42Å; F108-I112 HydrophobicContact CZ-CD1 4.01Å; F108-I112 HydrophobicContact CZ-CG1 4.25Å; F108-I112 WeakPolarHBondContact O-CG1 3.35Å; F108-I112 PolarHBondContact O-N 3.03Å; D109-I112 PolarHBondContact O-N 3.5Å; I112-Y114 VanDerWaalsContact C-N 3.26Å; I112-Y114 PolarHBondContact O-N 3.09Å; I112-L115 HydrophobicContact CD1-CD1 4.11Å; I112-L115 WeakPolarHBondContact O-CB 3.22Å; I112-L115 PolarHBondContact O-N 3.25Å; I112-Y116 HydrophobicContact CG2-CD2 4.24Å; I112-Y116 HydrophobicContact CG2-CE2 3.91Å; I112-Y116 WeakPolarHBondContact O-CD2 3.49Å; I112-Y116 PolarHBondContact O-N 2.61Å
113	R	93.1	Very high	91.1	Very high	101 Å²	101	44.9 Å²	44.9	38%	0.381	24%	0.238	S	C	.	.	H	α-helix	trans	-53.9	-44.1	174.9	178.1	-177	169.2	113.8	6.6	111.6	E44 L47 D109 K110 F111 L115 Y116 C117	E44-R113 VanDerWaalsContact CD-CZ 3.49Å; E44-R113 IonicContact OE1-CZ 3.21Å; E44-R113 IonicContact OE1-NH1 2.69Å; E44-R113 PolarHBondContact OE1-NH1 3.42Å; E44-R113 IonicContact OE1-NH2 3.9Å; E44-R113 PolarHBondContact OE1-NH2 3.43Å; E44-R113 IonicContact OE2-CZ 3.85Å; E44-R113 IonicContact OE2-NH2 3.34Å; E44-R113 PolarHBondContact OE2-NH2 2.69Å; L47-R113 HydrophobicContact CD2-CB 4.2Å; D109-R113 WeakPolarHBondContact O-CB 2.87Å; D109-R113 PolarHBondContact O-N 2.89Å; K110-R113 PolarHBondContact O-N 2.89Å; F111-R113 PolarHBondContact O-N 3.25Å; R113-L115 VanDerWaalsContact C-N 3.28Å; R113-L115 PolarHBondContact O-N 3.48Å; R113-Y116 PolarHBondContact O-N 3.47Å; R113-C117 PolarHBondContact O-N 2.88Å; R113-C117 PolarHBondContact O-SG 3.49Å
114	Y	94.2	Very high	91.2	Very high	31 Å²	31	41.5 Å²	41.5	12%	0.122	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-37.6	176.5	175.9	-91.1	0	0	0	112.7	K110 F111 I112 Y116 G118 I120 V139 S141 L142	K110-Y114 PolarHBondContact O-N 2.87Å; F111-Y114 WeakPolarHBondContact O-CB 3.19Å; F111-Y114 PolarHBondContact O-N 2.81Å; I112-Y114 VanDerWaalsContact C-N 3.26Å; I112-Y114 PolarHBondContact O-N 3.09Å; Y114-Y116 PolarHBondContact O-N 3.05Å; Y114-G118 VanDerWaalsContact CE2-O 3.28Å; Y114-G118 WeakPolarHBondContact CE2-O 3.37Å; Y114-G118 VanDerWaalsContact O-CA 3.24Å; Y114-G118 WeakPolarHBondContact O-CA 3.14Å; Y114-G118 PolarHBondContact O-N 2.87Å; Y114-I120 HydrophobicContact CD2-CB 3.91Å; Y114-I120 HydrophobicContact CD2-CG2 3.79Å; Y114-I120 HydrophobicContact CE2-CG2 4.28Å; Y114-V139 HydrophobicContact CE1-CG1 4.09Å; Y114-S141 PolarHBondContact OH-OG 2.86Å; Y114-S141 VanDerWaalsContact OH-OG 3.08Å; Y114-L142 HydrophobicContact CD1-CB 4.07Å; Y114-L142 HydrophobicContact CD1-CD1 4.09Å; Y114-L142 HydrophobicContact CD1-CD2 3.98Å; Y114-L142 HydrophobicContact CD1-CG 4.27Å; Y114-L142 HydrophobicContact CD2-CD1 3.99Å; Y114-L142 HydrophobicContact CE1-CB 3.56Å; Y114-L142 HydrophobicContact CE1-CD1 4.08Å; Y114-L142 HydrophobicContact CE1-CD2 4.34Å; Y114-L142 HydrophobicContact CE1-CG 4.19Å; Y114-L142 HydrophobicContact CE2-CD1 3.94Å; Y114-L142 HydrophobicContact CG-CD1 4.05Å; Y114-L142 HydrophobicContact CG-CD2 4.39Å; Y114-L142 PolarHBondContact OH-N 3.32Å
115	L	93.4	Very high	91.1	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-24.1	176.9	-54.7	-180	0	0	0	112.8	L77 Q80 F84 F111 I112 R113 V139	L77-L115 HydrophobicContact CD2-CD1 3.66Å; Q80-L115 HydrophobicContact CB-CB 4.28Å; Q80-L115 HydrophobicContact CB-CD2 3.83Å; Q80-L115 HydrophobicContact CG-CB 4.22Å; Q80-L115 HydrophobicContact CG-CD2 4.5Å; Q80-L115 WeakPolarHBondContact CG-O 3.22Å; F84-L115 HydrophobicContact CD2-CD1 4.24Å; F84-L115 HydrophobicContact CE2-CD1 3.92Å; F111-L115 HydrophobicContact CE1-CD1 4.08Å; F111-L115 HydrophobicContact CE2-CD2 4.33Å; F111-L115 HydrophobicContact CZ-CD1 4.13Å; F111-L115 HydrophobicContact CZ-CD2 4.28Å; F111-L115 HydrophobicContact CZ-CG 4.49Å; F111-L115 PolarHBondContact O-N 3.09Å; I112-L115 HydrophobicContact CD1-CD1 4.11Å; I112-L115 WeakPolarHBondContact O-CB 3.22Å; I112-L115 PolarHBondContact O-N 3.25Å; R113-L115 VanDerWaalsContact C-N 3.28Å; R113-L115 PolarHBondContact O-N 3.48Å; L115-V139 HydrophobicContact CD2-CG1 4.06Å; L115-V139 HydrophobicContact CD2-CG2 3.9Å
116	Y	91.9	Very high	91.2	Very high	6 Å²	6	46.7 Å²	46.7	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-88.7	-44.3	177.8	-78.8	-108.4	0	0	0	112.7	L43 L46 L47 A72 H73 V76 L77 I112 R113 Y114	L43-Y116 HydrophobicContact CB-CD1 4.36Å; L43-Y116 WeakPolarHBondContact O-CD1 3.24Å; L46-Y116 HydrophobicContact CD2-CD1 4.46Å; L46-Y116 HydrophobicContact CD2-CE1 3.83Å; L47-Y116 HydrophobicContact CB-CD1 4.01Å; L47-Y116 HydrophobicContact CB-CE1 4.08Å; L47-Y116 HydrophobicContact CB-CG 4.22Å; L47-Y116 HydrophobicContact CD1-CD2 4.36Å; L47-Y116 HydrophobicContact CD1-CE2 3.87Å; L47-Y116 HydrophobicContact CD2-CD2 4.07Å; L47-Y116 HydrophobicContact CD2-CE2 4.4Å; L47-Y116 HydrophobicContact CD2-CG 4.31Å; A72-Y116 WeakPolarHBondContact CA-OH 3.31Å; H73-Y116 PolarHBondContact N-OH 3.12Å; H73-Y116 AromaticContact ND1-CE1 3.73Å; H73-Y116 AromaticContact ND1-CZ 3.79Å; H73-Y116 PolarHBondContact ND1-OH 3.32Å; V76-Y116 HydrophobicContact CB-CE1 4.21Å; V76-Y116 HydrophobicContact CG1-CD1 3.97Å; V76-Y116 HydrophobicContact CG1-CD2 3.99Å; V76-Y116 HydrophobicContact CG1-CE1 4.02Å; V76-Y116 HydrophobicContact CG1-CE2 4.05Å; V76-Y116 HydrophobicContact CG1-CG 3.98Å; V76-Y116 HydrophobicContact CG2-CE1 4.13Å; L77-Y116 HydrophobicContact CD2-CE2 4.34Å; I112-Y116 HydrophobicContact CG2-CD2 4.24Å; I112-Y116 HydrophobicContact CG2-CE2 3.91Å; I112-Y116 WeakPolarHBondContact O-CD2 3.49Å; I112-Y116 PolarHBondContact O-N 2.61Å; R113-Y116 PolarHBondContact O-N 3.47Å; Y114-Y116 PolarHBondContact O-N 3.05Å
117	C	89.6	Confident	91.3	Very high	14 Å²	14	43 Å²	43	10%	0.095	22%	0.223	C	C	.	.	H	α-helix	trans	-108.8	-12	-170.4	68	0	0	0	0	114.7	R113 E119	R113-C117 PolarHBondContact O-N 2.88Å; R113-C117 PolarHBondContact O-SG 3.49Å; C117-E119 PolarHBondContact O-N 3.02Å; C117-E119 PolarHBondContact SG-O 3.1Å; C117-E119 VanDerWaalsContact SG-O 3.37Å
118	G	87.9	Confident	91.4	Very high	51 Å²	51	44.4 Å²	44.4	53%	0.526	23%	0.232	S	C	.	.	S	Bend	trans	68.9	9.8	-176.8	0	0	0	0	0	114.7	Y114	Y114-G118 VanDerWaalsContact CE2-O 3.28Å; Y114-G118 WeakPolarHBondContact CE2-O 3.37Å; Y114-G118 VanDerWaalsContact O-CA 3.24Å; Y114-G118 WeakPolarHBondContact O-CA 3.14Å; Y114-G118 PolarHBondContact O-N 2.87Å
119	E	88.7	Confident	91.4	Very high	144 Å²	144	45 Å²	45	67%	0.673	24%	0.235	S	C	*	.			trans	-125.8	136.4	-176.1	-171.9	-179.1	173.1	0	0	111	C117	C117-E119 PolarHBondContact O-N 3.02Å; C117-E119 PolarHBondContact SG-O 3.1Å; C117-E119 VanDerWaalsContact SG-O 3.37Å
120	I	91.1	Very high	91.6	Very high	39 Å²	39	41.4 Å²	41.4	20%	0.2	22%	0.216	C	C	.	.			trans	-144.5	133.7	177.8	-168.7	165	0	0	0	111.5	K110 Y114 L122 L130 L142	K110-I120 HydrophobicContact CB-CD1 3.98Å; K110-I120 HydrophobicContact CB-CG1 4.39Å; Y114-I120 HydrophobicContact CD2-CB 3.91Å; Y114-I120 HydrophobicContact CD2-CG2 3.79Å; Y114-I120 HydrophobicContact CE2-CG2 4.28Å; I120-L122 HydrophobicContact CD1-CD2 4.09Å; I120-L122 HydrophobicContact CG1-CD2 4.03Å; I120-L122 HydrophobicContact CG2-CD2 4.13Å; I120-L122 HydrophobicContact CG2-CG 4.24Å; I120-L130 HydrophobicContact CD1-CD1 3.67Å; I120-L130 HydrophobicContact CD1-CD2 3.74Å; I120-L130 HydrophobicContact CD1-CG 4.35Å; I120-L142 HydrophobicContact CG2-CD1 3.89Å
121	S	88.9	Confident	91.7	Very high	94 Å²	94	39.3 Å²	39.3	66%	0.657	21%	0.207	S	C	*	.			trans	-94.4	118.7	171.7	179.8	0	0	0	0	110.2	K110	K110-S121 PolarHBondContact NZ-O 3.34Å
122	L	88.3	Confident	91.7	Very high	29 Å²	29	42.9 Å²	42.9	15%	0.152	22%	0.223	C	C	.	.			trans	-103.4	143.1	-173.6	-59.8	175.4	0	0	0	112	I120 L130 V146 Y149	I120-L122 HydrophobicContact CD1-CD2 4.09Å; I120-L122 HydrophobicContact CG1-CD2 4.03Å; I120-L122 HydrophobicContact CG2-CD2 4.13Å; I120-L122 HydrophobicContact CG2-CG 4.24Å; L122-L130 HydrophobicContact CD2-CD1 3.15Å; L122-L130 HydrophobicContact CD2-CG 4.45Å; L122-V146 HydrophobicContact CD1-CG2 4.05Å; L122-V146 HydrophobicContact CD2-CG2 4.48Å; L122-Y149 HydrophobicContact CB-CD1 4.29Å; L122-Y149 HydrophobicContact CB-CD2 4.25Å; L122-Y149 HydrophobicContact CB-CE1 4.11Å; L122-Y149 HydrophobicContact CB-CE2 4.05Å; L122-Y149 HydrophobicContact CB-CG 4.37Å; L122-Y149 HydrophobicContact CD1-CD1 4Å; L122-Y149 HydrophobicContact CD1-CD2 4.12Å; L122-Y149 HydrophobicContact CD1-CG 3.72Å
123	R	89.6	Confident	91.7	Very high	126 Å²	126	42.9 Å²	42.9	48%	0.475	22%	0.222	S	C	.	.			trans	-118.3	162.8	165.1	-63.2	-171.1	-60.7	-99.5	6.7	109.2	D125 Q126 A127	R123-D125 VanDerWaalsContact C-N 3.32Å; R123-D125 WeakPolarHBondContact CB-OD1 3.45Å; R123-D125 IonicContact NE-OD1 3.12Å; R123-D125 PolarHBondContact NE-OD1 3.4Å; R123-D125 IonicContact NE-OD2 2.83Å; R123-D125 IonicContact NH2-OD2 3.8Å; R123-D125 PolarHBondContact O-N 2.89Å; R123-Q126 HydrophobicContact CB-CG 4.25Å; R123-Q126 VanDerWaalsContact NH2-CD 3.29Å; R123-Q126 PolarHBondContact O-N 2.97Å; R123-Q126 VanDerWaalsContact O-N 3.12Å; R123-A127 PolarHBondContact O-N 2.75Å
124	L	88.8	Confident	91.7	Very high	27 Å²	27	38 Å²	38	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-43.9	-177.1	-67.8	176.2	0	0	0	112.6	Q126 A127 N153 R156 W166	L124-Q126 VanDerWaalsContact C-N 3.27Å; L124-Q126 PolarHBondContact O-N 2.87Å; L124-A127 PolarHBondContact O-N 2.68Å; L124-N153 HydrophobicContact CD2-CB 4.05Å; L124-R156 HydrophobicContact CD1-CB 4.28Å; L124-R156 HydrophobicContact CD1-CG 3.97Å; L124-R156 HydrophobicContact CD2-CB 4.45Å; L124-W166 HydrophobicContact CD2-CH2 3.56Å; L124-W166 HydrophobicContact CD2-CZ2 3.8Å
125	D	88.8	Confident	91.7	Very high	107 Å²	107	39 Å²	39	57%	0.572	21%	0.213	S	C	*	.	H	α-helix	trans	-62.8	-32.2	177.7	59.3	-47	0	0	0	112.8	R123 P129	R123-D125 VanDerWaalsContact C-N 3.32Å; R123-D125 WeakPolarHBondContact CB-OD1 3.45Å; R123-D125 IonicContact NE-OD1 3.12Å; R123-D125 PolarHBondContact NE-OD1 3.4Å; R123-D125 IonicContact NE-OD2 2.83Å; R123-D125 IonicContact NH2-OD2 3.8Å; R123-D125 PolarHBondContact O-N 2.89Å; D125-P129 WeakPolarHBondContact O-CD 3.31Å
126	Q	91.8	Very high	91.7	Very high	13 Å²	13	43.7 Å²	43.7	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-87.4	-13	-175.3	-57.5	-169.8	-53.4	0	0	113.5	V107 R123 L124 P129 L130	V107-Q126 HydrophobicContact CG1-CB 4.07Å; V107-Q126 HydrophobicContact CG1-CG 3.95Å; R123-Q126 HydrophobicContact CB-CG 4.25Å; R123-Q126 VanDerWaalsContact NH2-CD 3.29Å; R123-Q126 PolarHBondContact O-N 2.97Å; R123-Q126 VanDerWaalsContact O-N 3.12Å; L124-Q126 VanDerWaalsContact C-N 3.27Å; L124-Q126 PolarHBondContact O-N 2.87Å; Q126-P129 WeakPolarHBondContact O-CD 3.35Å; Q126-P129 WeakPolarHBondContact O-CG 3.23Å; Q126-L130 HydrophobicContact CB-CD1 4.08Å; Q126-L130 VanDerWaalsContact O-CB 3.31Å; Q126-L130 WeakPolarHBondContact O-CB 3.4Å; Q126-L130 WeakPolarHBondContact O-CD1 3.35Å; Q126-L130 VanDerWaalsContact O-CG 3.32Å; Q126-L130 WeakPolarHBondContact O-CG 3.49Å; Q126-L130 PolarHBondContact O-N 3.45Å; Q126-L130 VanDerWaalsContact O-N 3.11Å
127	A	92.9	Very high	91.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-49.9	-174.5	0	0	0	0	0	111.5	R123 L124 L130 H131 V146 Y149 M150 W166	R123-A127 PolarHBondContact O-N 2.75Å; L124-A127 PolarHBondContact O-N 2.68Å; A127-L130 PolarHBondContact O-N 3.38Å; A127-H131 WeakPolarHBondContact O-CB 3.44Å; A127-H131 PolarHBondContact O-N 2.88Å; A127-V146 HydrophobicContact CB-CG1 4.41Å; A127-V146 WeakPolarHBondContact O-CG1 3.09Å; A127-Y149 HydrophobicContact CB-CD1 4.24Å; A127-Y149 HydrophobicContact CB-CE1 4.15Å; A127-M150 HydrophobicContact CB-CE 3.47Å; A127-M150 VanDerWaalsContact CB-CE 3.47Å; A127-M150 HydrophobicContact CB-CG 3.96Å; A127-M150 VanDerWaalsContact O-CE 3.27Å; A127-M150 WeakPolarHBondContact O-CE 3.48Å; A127-W166 HydrophobicContact CB-CZ2 4.05Å
128	T	93.8	Very high	91.9	Very high	30 Å²	30	48.8 Å²	48.8	18%	0.184	25%	0.254	C	S	.	.	H	α-helix	trans	-59.4	-53.8	179.7	-55.3	0	0	0	0	113.3	L130 H131 K132 Y169	T128-L130 VanDerWaalsContact C-N 3.32Å; T128-L130 PolarHBondContact O-N 2.98Å; T128-H131 PolarHBondContact O-N 2.93Å; T128-K132 HydrophobicContact CG2-CD 4.45Å; T128-K132 WeakPolarHBondContact O-CG 3.22Å; T128-K132 PolarHBondContact O-N 3.47Å; T128-Y169 HydrophobicContact CG2-CD1 3.94Å; T128-Y169 HydrophobicContact CG2-CD2 3.84Å; T128-Y169 HydrophobicContact CG2-CE1 4.33Å; T128-Y169 HydrophobicContact CG2-CE2 4.28Å; T128-Y169 HydrophobicContact CG2-CG 3.66Å
129	P	94.2	Very high	92.3	Very high	11 Å²	11	46.4 Å²	46.4	7%	0.071	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-33.9	179.9	24.9	-34.4	0	0	0	112.8	D103 V107 D125 Q126 K132 L133	D103-P129 HydrophobicContact CB-CB 4.16Å; V107-P129 HydrophobicContact CG1-CG 4.25Å; V107-P129 HydrophobicContact CG2-CB 3.79Å; V107-P129 HydrophobicContact CG2-CG 4.07Å; D125-P129 WeakPolarHBondContact O-CD 3.31Å; Q126-P129 WeakPolarHBondContact O-CD 3.35Å; Q126-P129 WeakPolarHBondContact O-CG 3.23Å; P129-K132 WeakPolarHBondContact O-CB 3.43Å; P129-K132 PolarHBondContact O-N 3.37Å; P129-L133 WeakPolarHBondContact O-CG 3.04Å; P129-L133 PolarHBondContact O-N 3.26Å
130	L	95	Very high	92.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-39.6	175.7	-75.3	168.4	0	0	0	112.7	V107 F111 I120 L122 Q126 A127 T128 K132 L133 A134 V146	V107-L130 HydrophobicContact CB-CD2 4.02Å; V107-L130 HydrophobicContact CB-CG 4.11Å; V107-L130 HydrophobicContact CG2-CD2 3.91Å; V107-L130 HydrophobicContact CG2-CG 3.95Å; F111-L130 HydrophobicContact CB-CD2 4.12Å; I120-L130 HydrophobicContact CD1-CD1 3.67Å; I120-L130 HydrophobicContact CD1-CD2 3.74Å; I120-L130 HydrophobicContact CD1-CG 4.35Å; L122-L130 HydrophobicContact CD2-CD1 3.15Å; L122-L130 HydrophobicContact CD2-CG 4.45Å; Q126-L130 HydrophobicContact CB-CD1 4.08Å; Q126-L130 VanDerWaalsContact O-CB 3.31Å; Q126-L130 WeakPolarHBondContact O-CB 3.4Å; Q126-L130 WeakPolarHBondContact O-CD1 3.35Å; Q126-L130 VanDerWaalsContact O-CG 3.32Å; Q126-L130 WeakPolarHBondContact O-CG 3.49Å; Q126-L130 PolarHBondContact O-N 3.45Å; Q126-L130 VanDerWaalsContact O-N 3.11Å; A127-L130 PolarHBondContact O-N 3.38Å; T128-L130 VanDerWaalsContact C-N 3.32Å; T128-L130 PolarHBondContact O-N 2.98Å; L130-K132 VanDerWaalsContact C-N 3.34Å; L130-L133 HydrophobicContact CD2-CD1 4.47Å; L130-L133 PolarHBondContact O-N 3.43Å; L130-A134 WeakPolarHBondContact O-CB 3.36Å; L130-A134 PolarHBondContact O-N 3.3Å; L130-V146 HydrophobicContact CB-CG2 4.44Å
131	H	94.9	Very high	92.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-41.9	173.1	-169	-82.6	0	0	0	110.9	A127 T128 L133 A134 T135 Q143 V146 T147 M150 Y169 D175	A127-H131 WeakPolarHBondContact O-CB 3.44Å; A127-H131 PolarHBondContact O-N 2.88Å; T128-H131 PolarHBondContact O-N 2.93Å; H131-L133 PolarHBondContact O-N 3.27Å; H131-A134 PolarHBondContact O-N 2.87Å; H131-T135 PolarHBondContact O-N 2.83Å; H131-T135 PolarHBondContact O-OG1 3.35Å; H131-T135 VanDerWaalsContact O-OG1 3.1Å; H131-Q143 WeakPolarHBondContact NE2-CG 3.26Å; H131-V146 HydrophobicContact CB-CB 4.45Å; H131-V146 HydrophobicContact CB-CG1 3.8Å; H131-T147 PolarHBondContact CD2-OG1 3.4Å; H131-T147 PolarHBondContact NE2-OG1 3.35Å; H131-T147 VanDerWaalsContact NE2-OG1 3.11Å; H131-M150 HydrophobicContact CB-CE 4Å; H131-Y169 HydrophobicContact CB-CE1 3.85Å; H131-Y169 AromaticContact CG-CE1 3.78Å; H131-Y169 AromaticContact ND1-CE1 3.37Å; H131-Y169 WeakPolarHBondContact ND1-CE1 3.45Å; H131-Y169 AromaticContact ND1-CZ 3.47Å; H131-Y169 PolarHBondContact ND1-OH 3.13Å; H131-D175 IonicContact NE2-OD2 3.8Å
132	K	94.1	Very high	92.8	Very high	75 Å²	75	42.8 Å²	42.8	33%	0.326	21%	0.208	S	C	.	.	H	α-helix	trans	-56.8	-46.5	174.6	-74.7	177.4	-179.9	177.9	0	112.2	T128 P129 L130 T135 K136 Y169	T128-K132 HydrophobicContact CG2-CD 4.45Å; T128-K132 WeakPolarHBondContact O-CG 3.22Å; T128-K132 PolarHBondContact O-N 3.47Å; P129-K132 WeakPolarHBondContact O-CB 3.43Å; P129-K132 PolarHBondContact O-N 3.37Å; L130-K132 VanDerWaalsContact C-N 3.34Å; K132-T135 PolarHBondContact O-N 3.1Å; K132-K136 WeakPolarHBondContact O-CB 3.42Å; K132-K136 PolarHBondContact O-N 3.31Å; K132-Y169 WeakPolarHBondContact CA-OH 3.49Å; K132-Y169 HydrophobicContact CD-CE2 3.97Å; K132-Y169 HydrophobicContact CG-CD2 4.32Å; K132-Y169 HydrophobicContact CG-CE2 3.32Å; K132-Y169 VanDerWaalsContact CG-OH 3.3Å; K132-Y169 WeakPolarHBondContact CG-OH 3.14Å; K132-Y169 PolarHBondContact N-OH 3.45Å; K132-Y169 VanDerWaalsContact N-OH 3.12Å
133	L	94.4	Very high	93	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-46.8	176.5	-70.9	171	0	0	0	111.2	E100 C104 V107 F108 F111 P129 L130 H131 T135 K136 Y137	E100-L133 HydrophobicContact CG-CD2 4.39Å; C104-L133 HydrophobicContact CB-CD1 4.38Å; C104-L133 HydrophobicContact CB-CD2 4.03Å; C104-L133 HydrophobicContact CB-CG 4.14Å; V107-L133 HydrophobicContact CG2-CD1 3.79Å; F108-L133 HydrophobicContact CD2-CD1 4.17Å; F108-L133 HydrophobicContact CD2-CD2 3.74Å; F108-L133 HydrophobicContact CE2-CD2 3.95Å; F111-L133 HydrophobicContact CB-CD1 3.89Å; F111-L133 HydrophobicContact CD2-CB 4.07Å; F111-L133 HydrophobicContact CE2-CB 4.35Å; F111-L133 HydrophobicContact CG-CB 4.18Å; F111-L133 HydrophobicContact CG-CD1 4.15Å; P129-L133 WeakPolarHBondContact O-CG 3.04Å; P129-L133 PolarHBondContact O-N 3.26Å; L130-L133 HydrophobicContact CD2-CD1 4.47Å; L130-L133 PolarHBondContact O-N 3.43Å; H131-L133 PolarHBondContact O-N 3.27Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.09Å; L133-K136 PolarHBondContact O-N 2.85Å; L133-Y137 HydrophobicContact CB-CD2 4.47Å; L133-Y137 HydrophobicContact CD2-CD2 4.29Å; L133-Y137 HydrophobicContact CD2-CE2 3.75Å; L133-Y137 VanDerWaalsContact O-CD2 3.25Å; L133-Y137 WeakPolarHBondContact O-CD2 3.45Å; L133-Y137 PolarHBondContact O-N 3.15Å
134	A	94.3	Very high	93.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-44.2	178.8	0	0	0	0	0	112.1	L130 H131 K138 V139 L142 Q143	L130-A134 WeakPolarHBondContact O-CB 3.36Å; L130-A134 PolarHBondContact O-N 3.3Å; H131-A134 PolarHBondContact O-N 2.87Å; A134-K138 CarbonylContact O-C 2.67Å; A134-K138 WeakPolarHBondContact O-CA 3.37Å; A134-K138 PolarHBondContact O-N 2.92Å; A134-V139 PolarHBondContact O-N 2.93Å; A134-L142 HydrophobicContact CB-CB 4Å; A134-L142 HydrophobicContact CB-CD2 3.99Å; A134-L142 HydrophobicContact CB-CG 3.93Å; A134-Q143 HydrophobicContact CB-CB 3.97Å
135	T	93	Very high	93.4	Very high	51 Å²	51	44.2 Å²	44.2	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-65.4	-45.9	175.7	-55.4	0	0	0	0	111.7	H131 K132 L133 Y137 K138 Q143	H131-T135 PolarHBondContact O-N 2.83Å; H131-T135 PolarHBondContact O-OG1 3.35Å; H131-T135 VanDerWaalsContact O-OG1 3.1Å; K132-T135 PolarHBondContact O-N 3.1Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.09Å; T135-Y137 PolarHBondContact O-N 3.39Å; T135-K138 PolarHBondContact O-N 3.06Å; T135-Q143 PolarHBondContact OG1-NE2 3.2Å
136	K	92.8	Very high	93.6	Very high	100 Å²	100	39.1 Å²	39.1	44%	0.435	20%	0.202	S	C	.	.	H	α-helix	trans	-61.9	-42.8	-178.9	-176.9	175.6	-177.7	176.8	0	112.6	R99 E100 K132 L133	R99-K136 PolarHBondContact O-NZ 2.8Å; E100-K136 WeakPolarHBondContact OE1-CE 3.45Å; E100-K136 IonicContact OE1-NZ 3.47Å; E100-K136 PolarHBondContact OE1-NZ 3.47Å; E100-K136 IonicContact OE2-NZ 3.81Å; E100-K136 PolarHBondContact OE2-NZ 3.2Å; K132-K136 WeakPolarHBondContact O-CB 3.42Å; K132-K136 PolarHBondContact O-N 3.31Å; L133-K136 PolarHBondContact O-N 2.85Å
137	Y	93.6	Very high	93.7	Very high	3 Å²	3	39 Å²	39	1%	0.012	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	8.5	179.8	-65.3	-75	0	0	0	113.3	S81 V83 F84 L98 E100 F108 F111 L133 T135 V139	S81-Y137 WeakPolarHBondContact CB-O 3.43Å; S81-Y137 PolarHBondContact OG-O 3.44Å; V83-Y137 HydrophobicContact CB-CD1 4.44Å; V83-Y137 HydrophobicContact CG1-CD1 4.14Å; F84-Y137 HydrophobicContact CD1-CD1 4.37Å; F84-Y137 HydrophobicContact CD1-CE1 4.31Å; F84-Y137 HydrophobicContact CD2-CD1 4Å; F84-Y137 AromaticContact CE1-CD1 3.9Å; F84-Y137 HydrophobicContact CE1-CD1 3.9Å; F84-Y137 AromaticContact CE1-CE1 3.53Å; F84-Y137 HydrophobicContact CE1-CE1 3.53Å; F84-Y137 AromaticContact CE2-CD1 3.47Å; F84-Y137 HydrophobicContact CE2-CD1 3.47Å; F84-Y137 VanDerWaalsContact CE2-CD1 3.47Å; F84-Y137 AromaticContact CE2-CE1 3.87Å; F84-Y137 HydrophobicContact CE2-CE1 3.87Å; F84-Y137 AromaticContact CE2-CG 3.85Å; F84-Y137 HydrophobicContact CE2-CG 3.85Å; F84-Y137 HydrophobicContact CG-CD1 4.41Å; F84-Y137 AromaticContact CZ-CD1 3.41Å; F84-Y137 HydrophobicContact CZ-CD1 3.41Å; F84-Y137 VanDerWaalsContact CZ-CD1 3.41Å; F84-Y137 AromaticContact CZ-CE1 3.26Å; F84-Y137 HydrophobicContact CZ-CE1 3.26Å; F84-Y137 HydrophobicContact CZ-CE2 4.44Å; F84-Y137 HydrophobicContact CZ-CG 4.07Å; F84-Y137 AromaticContact CZ-CZ 3.82Å; L98-Y137 HydrophobicContact CD2-CE1 4.34Å; E100-Y137 PolarHBondContact OE1-OH 2.93Å; F108-Y137 AromaticContact CE2-CE2 3.8Å; F108-Y137 HydrophobicContact CE2-CE2 3.8Å; F108-Y137 AromaticContact CE2-CZ 3.95Å; F108-Y137 WeakPolarHBondContact CE2-OH 3.37Å; F108-Y137 HydrophobicContact CZ-CE2 4.43Å; F111-Y137 HydrophobicContact CD1-CD2 4.49Å; F111-Y137 AromaticContact CE1-CD2 3.56Å; F111-Y137 HydrophobicContact CE1-CD2 3.56Å; F111-Y137 HydrophobicContact CE1-CE2 4.05Å; F111-Y137 HydrophobicContact CE1-CG 4.01Å; F111-Y137 AromaticContact CZ-CD2 3.66Å; F111-Y137 HydrophobicContact CZ-CD2 3.66Å; F111-Y137 AromaticContact CZ-CG 3.91Å; F111-Y137 HydrophobicContact CZ-CG 3.91Å; L133-Y137 HydrophobicContact CB-CD2 4.47Å; L133-Y137 HydrophobicContact CD2-CD2 4.29Å; L133-Y137 HydrophobicContact CD2-CE2 3.75Å; L133-Y137 VanDerWaalsContact O-CD2 3.25Å; L133-Y137 WeakPolarHBondContact O-CD2 3.45Å; L133-Y137 PolarHBondContact O-N 3.15Å; T135-Y137 PolarHBondContact O-N 3.39Å; Y137-V139 VanDerWaalsContact C-N 3.28Å; Y137-V139 PolarHBondContact O-N 3.47Å
138	K	94.1	Very high	93.7	Very high	124 Å²	124	43.2 Å²	43.2	54%	0.539	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	37.7	178.8	-60.2	-178.9	-180	173.5	0	114.5	V83 A134 T135 Q140	V83-K138 HydrophobicContact CG2-CB 4.14Å; V83-K138 HydrophobicContact CG2-CD 3.8Å; V83-K138 HydrophobicContact CG2-CG 3.76Å; A134-K138 CarbonylContact O-C 2.67Å; A134-K138 WeakPolarHBondContact O-CA 3.37Å; A134-K138 PolarHBondContact O-N 2.92Å; T135-K138 PolarHBondContact O-N 3.06Å; K138-Q140 PolarHBondContact O-N 3.26Å
139	V	95	Very high	93.7	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	22%	0.222	C	C	.	.			trans	-89.6	86	176.6	-173.8	0	0	0	0	109.1	F111 Y114 L115 A134 Y137 S141 L142 Q143	F111-V139 HydrophobicContact CE2-CB 4.48Å; F111-V139 HydrophobicContact CE2-CG2 4.02Å; F111-V139 HydrophobicContact CZ-CG2 3.94Å; Y114-V139 HydrophobicContact CE1-CG1 4.09Å; L115-V139 HydrophobicContact CD2-CG1 4.06Å; L115-V139 HydrophobicContact CD2-CG2 3.9Å; A134-V139 PolarHBondContact O-N 2.93Å; Y137-V139 VanDerWaalsContact C-N 3.28Å; Y137-V139 PolarHBondContact O-N 3.47Å; V139-S141 PolarHBondContact O-N 3.31Å; V139-L142 HydrophobicContact CB-CB 4.31Å; V139-L142 HydrophobicContact CG1-CB 3.77Å; V139-L142 PolarHBondContact O-N 2.58Å; V139-Q143 PolarHBondContact O-N 3.32Å
140	Q	92.3	Very high	93.6	Very high	138 Å²	138	43 Å²	43	65%	0.645	22%	0.219	S	C	*	.	H	α-helix	trans	-61.4	-38.7	-171.5	-68.1	-175.3	-12.9	0	0	113.7	K138 L142 Q143 Q144	K138-Q140 PolarHBondContact O-N 3.26Å; Q140-L142 PolarHBondContact O-N 2.86Å; Q140-Q143 PolarHBondContact O-N 3.02Å; Q140-Q144 WeakPolarHBondContact O-CG 3.47Å; Q140-Q144 PolarHBondContact O-N 2.95Å
141	S	92.6	Very high	93.4	Very high	60 Å²	60	44.7 Å²	44.7	42%	0.42	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-43.8	179.7	57.7	0	0	0	0	111.8	Y114 V139 G145	Y114-S141 PolarHBondContact OH-OG 2.86Å; Y114-S141 VanDerWaalsContact OH-OG 3.08Å; V139-S141 PolarHBondContact O-N 3.31Å; S141-G145 PolarHBondContact O-N 3.33Å
142	L	94.1	Very high	93.2	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-68.6	-42	176	-174.3	59.3	0	0	0	111.2	F111 Y114 I120 A134 V139 Q140 G145 V146	F111-L142 HydrophobicContact CD2-CD2 3.49Å; F111-L142 VanDerWaalsContact CD2-CD2 3.49Å; F111-L142 HydrophobicContact CE2-CD2 3.76Å; Y114-L142 HydrophobicContact CD1-CB 4.07Å; Y114-L142 HydrophobicContact CD1-CD1 4.09Å; Y114-L142 HydrophobicContact CD1-CD2 3.98Å; Y114-L142 HydrophobicContact CD1-CG 4.27Å; Y114-L142 HydrophobicContact CD2-CD1 3.99Å; Y114-L142 HydrophobicContact CE1-CB 3.56Å; Y114-L142 HydrophobicContact CE1-CD1 4.08Å; Y114-L142 HydrophobicContact CE1-CD2 4.34Å; Y114-L142 HydrophobicContact CE1-CG 4.19Å; Y114-L142 HydrophobicContact CE2-CD1 3.94Å; Y114-L142 HydrophobicContact CG-CD1 4.05Å; Y114-L142 HydrophobicContact CG-CD2 4.39Å; Y114-L142 PolarHBondContact OH-N 3.32Å; I120-L142 HydrophobicContact CG2-CD1 3.89Å; A134-L142 HydrophobicContact CB-CB 4Å; A134-L142 HydrophobicContact CB-CD2 3.99Å; A134-L142 HydrophobicContact CB-CG 3.93Å; V139-L142 HydrophobicContact CB-CB 4.31Å; V139-L142 HydrophobicContact CG1-CB 3.77Å; V139-L142 PolarHBondContact O-N 2.58Å; Q140-L142 PolarHBondContact O-N 2.86Å; L142-G145 PolarHBondContact O-N 2.81Å; L142-V146 HydrophobicContact CD1-CG2 3.91Å; L142-V146 HydrophobicContact CG-CG2 4.19Å; L142-V146 WeakPolarHBondContact O-CB 3.44Å; L142-V146 VanDerWaalsContact O-CG2 3.26Å; L142-V146 WeakPolarHBondContact O-CG2 3.21Å; L142-V146 PolarHBondContact O-N 3.43Å
143	Q	93	Very high	93	Very high	51 Å²	51	48 Å²	48	24%	0.238	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-54.2	178.7	-171.1	-177.6	11.1	0	0	110.6	H131 A134 T135 V139 Q140 G145 V146 T147	H131-Q143 WeakPolarHBondContact NE2-CG 3.26Å; A134-Q143 HydrophobicContact CB-CB 3.97Å; T135-Q143 PolarHBondContact OG1-NE2 3.2Å; V139-Q143 PolarHBondContact O-N 3.32Å; Q140-Q143 PolarHBondContact O-N 3.02Å; Q143-G145 PolarHBondContact O-N 3.43Å; Q143-V146 PolarHBondContact O-N 2.93Å; Q143-T147 PolarHBondContact O-N 3.38Å; Q143-T147 PolarHBondContact O-OG1 3.18Å
144	Q	92.9	Very high	92.7	Very high	124 Å²	124	48.5 Å²	48.5	58%	0.579	25%	0.249	S	C	*	.	H	α-helix	trans	-61.5	-41.9	177.6	-68.9	176.4	1.4	0	0	112.1	Q140 V146 T147 N148	Q140-Q144 WeakPolarHBondContact O-CG 3.47Å; Q140-Q144 PolarHBondContact O-N 2.95Å; Q144-V146 VanDerWaalsContact C-N 3.34Å; Q144-V146 PolarHBondContact O-N 3.4Å; Q144-T147 PolarHBondContact O-N 3.23Å; Q144-N148 WeakPolarHBondContact O-CB 3.26Å; Q144-N148 PolarHBondContact O-N 3.28Å; Q144-N148 PolarHBondContact O-ND2 3.39Å
145	G	93.4	Very high	92.2	Very high	37 Å²	37	48.5 Å²	48.5	38%	0.381	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-41.7	176.8	0	0	0	0	0	112.9	S141 L142 Q143 Y149	S141-G145 PolarHBondContact O-N 3.33Å; L142-G145 PolarHBondContact O-N 2.81Å; Q143-G145 PolarHBondContact O-N 3.43Å; G145-Y149 WeakPolarHBondContact O-CB 3.43Å; G145-Y149 PolarHBondContact O-N 3.26Å
146	V	94.1	Very high	91.8	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-72.8	-39.7	177.6	178	0	0	0	0	111.4	L122 A127 L130 H131 L142 Q143 Q144 N148 Y149 M150	L122-V146 HydrophobicContact CD1-CG2 4.05Å; L122-V146 HydrophobicContact CD2-CG2 4.48Å; A127-V146 HydrophobicContact CB-CG1 4.41Å; A127-V146 WeakPolarHBondContact O-CG1 3.09Å; L130-V146 HydrophobicContact CB-CG2 4.44Å; H131-V146 HydrophobicContact CB-CB 4.45Å; H131-V146 HydrophobicContact CB-CG1 3.8Å; L142-V146 HydrophobicContact CD1-CG2 3.91Å; L142-V146 HydrophobicContact CG-CG2 4.19Å; L142-V146 WeakPolarHBondContact O-CB 3.44Å; L142-V146 VanDerWaalsContact O-CG2 3.26Å; L142-V146 WeakPolarHBondContact O-CG2 3.21Å; L142-V146 PolarHBondContact O-N 3.43Å; Q143-V146 PolarHBondContact O-N 2.93Å; Q144-V146 VanDerWaalsContact C-N 3.34Å; Q144-V146 PolarHBondContact O-N 3.4Å; V146-N148 VanDerWaalsContact C-N 3.33Å; V146-N148 PolarHBondContact O-N 3.25Å; V146-Y149 WeakPolarHBondContact O-CB 3.44Å; V146-Y149 PolarHBondContact O-N 3.02Å; V146-M150 HydrophobicContact CG1-CE 3.86Å; V146-M150 HydrophobicContact CG1-CG 4.44Å; V146-M150 HydrophobicContact CG1-SD 4.43Å; V146-M150 WeakPolarHBondContact O-CG 3.41Å; V146-M150 PolarHBondContact O-N 3.34Å
147	T	93.3	Very high	91	Very high	11 Å²	11	51 Å²	51	7%	0.067	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-43.8	172.7	-61	0	0	0	0	111.1	H131 Q143 Q144 Y149 M150 T151 D175 L178	H131-T147 PolarHBondContact CD2-OG1 3.4Å; H131-T147 PolarHBondContact NE2-OG1 3.35Å; H131-T147 VanDerWaalsContact NE2-OG1 3.11Å; Q143-T147 PolarHBondContact O-N 3.38Å; Q143-T147 PolarHBondContact O-OG1 3.18Å; Q144-T147 PolarHBondContact O-N 3.23Å; T147-Y149 VanDerWaalsContact C-N 3.35Å; T147-Y149 PolarHBondContact O-N 3.41Å; T147-M150 PolarHBondContact O-N 3.35Å; T147-T151 WeakPolarHBondContact O-CG2 3.45Å; T147-T151 PolarHBondContact O-N 2.92Å; T147-T151 PolarHBondContact O-OG1 3.22Å; T147-D175 WeakPolarHBondContact CG2-OD2 3.39Å; T147-D175 PolarHBondContact OG1-OD2 2.99Å; T147-L178 HydrophobicContact CG2-CB 4.16Å
148	N	92.9	Very high	90.2	Very high	88 Å²	88	52.1 Å²	52.1	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-40.9	174.5	-71.8	-15	0	0	0	111.8	Q144 V146 T151 Q152	Q144-N148 WeakPolarHBondContact O-CB 3.26Å; Q144-N148 PolarHBondContact O-N 3.28Å; Q144-N148 PolarHBondContact O-ND2 3.39Å; V146-N148 VanDerWaalsContact C-N 3.33Å; V146-N148 PolarHBondContact O-N 3.25Å; N148-T151 WeakPolarHBondContact CA-OG1 3.02Å; N148-T151 PolarHBondContact O-OG1 3.37Å; N148-Q152 WeakPolarHBondContact O-CB 3.32Å; N148-Q152 VanDerWaalsContact O-CG 3.22Å; N148-Q152 WeakPolarHBondContact O-CG 3.31Å; N148-Q152 PolarHBondContact O-N 3.06Å
149	Y	92.9	Very high	89.1	Confident	35 Å²	35	52.2 Å²	52.2	14%	0.137	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-47.1	174.5	172.2	-93.3	0	0	0	111.7	L122 A127 G145 V146 T147 Q152 N153	L122-Y149 HydrophobicContact CB-CD1 4.29Å; L122-Y149 HydrophobicContact CB-CD2 4.25Å; L122-Y149 HydrophobicContact CB-CE1 4.11Å; L122-Y149 HydrophobicContact CB-CE2 4.05Å; L122-Y149 HydrophobicContact CB-CG 4.37Å; L122-Y149 HydrophobicContact CD1-CD1 4Å; L122-Y149 HydrophobicContact CD1-CD2 4.12Å; L122-Y149 HydrophobicContact CD1-CG 3.72Å; A127-Y149 HydrophobicContact CB-CD1 4.24Å; A127-Y149 HydrophobicContact CB-CE1 4.15Å; G145-Y149 WeakPolarHBondContact O-CB 3.43Å; G145-Y149 PolarHBondContact O-N 3.26Å; V146-Y149 WeakPolarHBondContact O-CB 3.44Å; V146-Y149 PolarHBondContact O-N 3.02Å; T147-Y149 VanDerWaalsContact C-N 3.35Å; T147-Y149 PolarHBondContact O-N 3.41Å; Y149-Q152 PolarHBondContact O-N 3.31Å; Y149-N153 WeakPolarHBondContact CD2-ND2 3.5Å; Y149-N153 VanDerWaalsContact CE2-ND2 3.33Å; Y149-N153 WeakPolarHBondContact CE2-ND2 3.26Å; Y149-N153 WeakPolarHBondContact O-CB 3.39Å; Y149-N153 PolarHBondContact O-N 2.7Å; Y149-N153 VanDerWaalsContact O-N 3.09Å; Y149-N153 PolarHBondContact O-ND2 2.92Å
150	M	93.1	Very high	87.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.7	-48.6	178.9	-71.8	176.2	175.9	0	0	111.1	A127 H131 V146 T147 Q152 N153 L154 W166 L178	A127-M150 HydrophobicContact CB-CE 3.47Å; A127-M150 VanDerWaalsContact CB-CE 3.47Å; A127-M150 HydrophobicContact CB-CG 3.96Å; A127-M150 VanDerWaalsContact O-CE 3.27Å; A127-M150 WeakPolarHBondContact O-CE 3.48Å; H131-M150 HydrophobicContact CB-CE 4Å; V146-M150 HydrophobicContact CG1-CE 3.86Å; V146-M150 HydrophobicContact CG1-CG 4.44Å; V146-M150 HydrophobicContact CG1-SD 4.43Å; V146-M150 WeakPolarHBondContact O-CG 3.41Å; V146-M150 PolarHBondContact O-N 3.34Å; T147-M150 PolarHBondContact O-N 3.35Å; M150-Q152 VanDerWaalsContact C-N 3.32Å; M150-Q152 PolarHBondContact O-N 2.91Å; M150-N153 CarbonylContact O-C 3.58Å; M150-N153 PolarHBondContact O-N 3.02Å; M150-N153 VanDerWaalsContact O-N 3.1Å; M150-L154 WeakPolarHBondContact O-CG 3.25Å; M150-L154 PolarHBondContact O-N 3.4Å; M150-W166 HydrophobicContact CB-CD2 4.3Å; M150-W166 HydrophobicContact CB-CE3 3.91Å; M150-W166 HydrophobicContact CB-CH2 4.24Å; M150-W166 HydrophobicContact CB-CZ3 3.9Å; M150-W166 HydrophobicContact CG-CD2 4.1Å; M150-W166 HydrophobicContact CG-CE3 4.2Å; M150-W166 HydrophobicContact CG-CH2 4.22Å; M150-W166 HydrophobicContact CG-CZ2 4.12Å; M150-W166 HydrophobicContact CG-CZ3 4.28Å; M150-W166 WeakPolarHBondContact O-CZ3 3.49Å; M150-W166 HydrophobicContact SD-CD2 4.45Å; M150-W166 HydrophobicContact SD-CG 4.48Å; M150-L178 HydrophobicContact CB-CD1 3.57Å; M150-L178 HydrophobicContact CG-CD1 4.43Å; M150-L178 HydrophobicContact SD-CD1 3.99Å; M150-L178 HydrophobicContact SD-CD2 3.37Å; M150-L178 WeakPolarHBondContact SD-CD2 3.47Å; M150-L178 HydrophobicContact SD-CG 4.33Å
151	T	91.3	Very high	87.4	Confident	37 Å²	37	50.4 Å²	50.4	23%	0.227	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-36.7	179.8	52.3	0	0	0	0	113.1	T147 N148 N153 L154 L178	T147-T151 WeakPolarHBondContact O-CG2 3.45Å; T147-T151 PolarHBondContact O-N 2.92Å; T147-T151 PolarHBondContact O-OG1 3.22Å; N148-T151 WeakPolarHBondContact CA-OG1 3.02Å; N148-T151 PolarHBondContact O-OG1 3.37Å; T151-N153 VanDerWaalsContact C-N 3.35Å; T151-L154 WeakPolarHBondContact O-CD1 3.31Å; T151-L154 WeakPolarHBondContact O-CG 3.27Å; T151-L178 HydrophobicContact CG2-CD1 4.15Å
152	Q	89.1	Confident	87.2	Confident	130 Å²	130	48.5 Å²	48.5	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-74.5	-22.8	176.1	-69.7	172.5	11.2	0	0	113.8	N148 Y149 M150	N148-Q152 WeakPolarHBondContact O-CB 3.32Å; N148-Q152 VanDerWaalsContact O-CG 3.22Å; N148-Q152 WeakPolarHBondContact O-CG 3.31Å; N148-Q152 PolarHBondContact O-N 3.06Å; Y149-Q152 PolarHBondContact O-N 3.31Å; M150-Q152 VanDerWaalsContact C-N 3.32Å; M150-Q152 PolarHBondContact O-N 2.91Å
153	N	90	Very high	87.1	Confident	13 Å²	13	48.4 Å²	48.4	7%	0.07	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	17.9	-174.9	-72.1	-91	0	0	0	113.5	L124 Y149 M150 T151 A155 R156 H162 W166	L124-N153 HydrophobicContact CD2-CB 4.05Å; Y149-N153 WeakPolarHBondContact CD2-ND2 3.5Å; Y149-N153 VanDerWaalsContact CE2-ND2 3.33Å; Y149-N153 WeakPolarHBondContact CE2-ND2 3.26Å; Y149-N153 WeakPolarHBondContact O-CB 3.39Å; Y149-N153 PolarHBondContact O-N 2.7Å; Y149-N153 VanDerWaalsContact O-N 3.09Å; Y149-N153 PolarHBondContact O-ND2 2.92Å; M150-N153 CarbonylContact O-C 3.58Å; M150-N153 PolarHBondContact O-N 3.02Å; M150-N153 VanDerWaalsContact O-N 3.1Å; T151-N153 VanDerWaalsContact C-N 3.35Å; N153-A155 VanDerWaalsContact C-N 3.3Å; N153-A155 PolarHBondContact O-N 3.11Å; N153-R156 HydrophobicContact CB-CB 4.48Å; N153-R156 WeakPolarHBondContact O-CB 3.06Å; N153-R156 PolarHBondContact O-N 3.41Å; N153-H162 PolarHBondContact O-NE2 3.44Å; N153-W166 HydrophobicContact CB-CH2 4.22Å
154	L	88.5	Confident	87	Confident	11 Å²	11	46.3 Å²	46.3	6%	0.058	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-38.7	176.3	-64.6	172	0	0	0	112.3	M150 T151 R156 H162 V163 W166 Y185	M150-L154 WeakPolarHBondContact O-CG 3.25Å; M150-L154 PolarHBondContact O-N 3.4Å; T151-L154 WeakPolarHBondContact O-CD1 3.31Å; T151-L154 WeakPolarHBondContact O-CG 3.27Å; L154-R156 VanDerWaalsContact C-N 3.28Å; L154-R156 PolarHBondContact O-N 3.36Å; L154-H162 PolarHBondContact O-CE1 3.38Å; L154-V163 HydrophobicContact CB-CG2 4.37Å; L154-V163 HydrophobicContact CD2-CG1 3.95Å; L154-V163 HydrophobicContact CD2-CG2 4.09Å; L154-V163 WeakPolarHBondContact O-CG2 3.36Å; L154-W166 HydrophobicContact CD2-CE3 3.72Å; L154-W166 HydrophobicContact CD2-CZ3 3.93Å; L154-Y185 HydrophobicContact CB-CD1 4.17Å; L154-Y185 HydrophobicContact CB-CD2 3.86Å; L154-Y185 HydrophobicContact CB-CE2 4.32Å; L154-Y185 HydrophobicContact CB-CG 3.78Å; L154-Y185 HydrophobicContact CD1-CG 4.38Å
155	A	85.1	Confident	86.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.4	-179.7	0	0	0	0	0	115.5	N153 Y185 Q411 V416	N153-A155 VanDerWaalsContact C-N 3.3Å; N153-A155 PolarHBondContact O-N 3.11Å; A155-Y185 WeakPolarHBondContact CA-OH 3.39Å; A155-Y185 HydrophobicContact CB-CE2 3.86Å; A155-Q411 HydrophobicContact CB-CB 3.57Å; A155-Q411 HydrophobicContact CB-CG 4.43Å; A155-V416 HydrophobicContact CB-CG1 3.82Å; A155-V416 HydrophobicContact CB-CG2 4.28Å
156	R	84.3	Confident	86.9	Confident	104 Å²	104	41 Å²	41	39%	0.392	24%	0.237	S	C	.	.	S	Bend	trans	-70.2	140.4	-175.6	-168.4	166.3	174.5	-179.9	1.7	110.1	L124 N153 L154 S158 H162	L124-R156 HydrophobicContact CD1-CB 4.28Å; L124-R156 HydrophobicContact CD1-CG 3.97Å; L124-R156 HydrophobicContact CD2-CB 4.45Å; N153-R156 HydrophobicContact CB-CB 4.48Å; N153-R156 WeakPolarHBondContact O-CB 3.06Å; N153-R156 PolarHBondContact O-N 3.41Å; L154-R156 VanDerWaalsContact C-N 3.28Å; L154-R156 PolarHBondContact O-N 3.36Å; R156-S158 PolarHBondContact O-N 3.23Å; R156-H162 PolarHBondContact O-CE1 2.93Å
157	D	74.9	Confident	86.9	Confident	101 Å²	101	41.7 Å²	41.7	54%	0.54	24%	0.239	S	C	.	.			trans	-71.4	133.1	-177.7	-150.2	-1	0	0	0	111.8	K414	D157-K414 IonicContact OD1-NZ 2.69Å; D157-K414 PolarHBondContact OD1-NZ 3.2Å; D157-K414 WeakPolarHBondContact OD2-CE 3.17Å; D157-K414 IonicContact OD2-NZ 2.95Å; D157-K414 PolarHBondContact OD2-NZ 3.47Å
158	S	78	Confident	86.9	Confident	26 Å²	26	43.5 Å²	43.5	18%	0.182	25%	0.247	C	C	.	.			trans	-137.4	129.8	173.2	178.5	0	0	0	0	108.2	R156 S160 G161 H162	R156-S158 PolarHBondContact O-N 3.23Å; S158-S160 PolarHBondContact O-N 2.79Å; S158-S160 VanDerWaalsContact O-N 3.08Å; S158-G161 PolarHBondContact O-N 2.82Å; S158-H162 VanDerWaalsContact CB-ND1 3.31Å; S158-H162 WeakPolarHBondContact CB-ND1 3.41Å
159	P	70	Confident	86.8	Confident	125 Å²	125	40.1 Å²	40.1	81%	0.812	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.7	-174.8	24.8	-34.7	0	0	0	114.1
160	S	70.6	Confident	86.9	Confident	86 Å²	86	38.5 Å²	38.5	60%	0.601	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-2.5	178.9	-50.7	0	0	0	0	113.1	S158	S158-S160 PolarHBondContact O-N 2.79Å; S158-S160 VanDerWaalsContact O-N 3.08Å
161	G	80.9	Confident	86.8	Confident	17 Å²	17	41.6 Å²	41.6	18%	0.175	24%	0.238	C	C	.	.			trans	69.4	139.7	-162.9	0	0	0	0	0	112.3	S158 E198	S158-G161 PolarHBondContact O-N 2.82Å; G161-E198 WeakPolarHBondContact CA-OE1 3.29Å; G161-E198 WeakPolarHBondContact CA-OE2 3.37Å
162	H	88.5	Confident	86.8	Confident	20 Å²	20	46.9 Å²	46.9	9%	0.093	26%	0.26	C	S	.	.	S	Bend	trans	-121.3	-13.5	179.1	61	-72.5	0	0	0	112.4	N153 L154 R156 S158 G165 W166 E198	N153-H162 PolarHBondContact O-NE2 3.44Å; L154-H162 PolarHBondContact O-CE1 3.38Å; R156-H162 PolarHBondContact O-CE1 2.93Å; S158-H162 VanDerWaalsContact CB-ND1 3.31Å; S158-H162 WeakPolarHBondContact CB-ND1 3.41Å; H162-G165 PolarHBondContact O-N 3.07Å; H162-W166 AromaticContact CD2-CD2 3.83Å; H162-W166 AromaticContact CD2-CE2 3.75Å; H162-W166 AromaticContact CD2-CE3 3.59Å; H162-W166 AromaticContact CD2-CH2 3.26Å; H162-W166 WeakPolarHBondContact CD2-CH2 3.38Å; H162-W166 AromaticContact CD2-CZ2 3.5Å; H162-W166 VanDerWaalsContact CD2-CZ2 3.5Å; H162-W166 WeakPolarHBondContact CD2-CZ2 3.39Å; H162-W166 AromaticContact CD2-CZ3 3.29Å; H162-W166 WeakPolarHBondContact CD2-CZ3 3.48Å; H162-W166 AromaticContact NE2-CH2 3.65Å; H162-W166 AromaticContact NE2-CZ3 3.53Å; H162-W166 PolarHBondContact O-N 3.08Å; H162-E198 PolarHBondContact N-OE1 2.97Å
163	V	91.6	Very high	86.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-75.2	-39.2	-174.2	-177.4	0	0	0	0	110.9	L154 G165 W166 Y167 C182 Y185 L186 E198	L154-V163 HydrophobicContact CB-CG2 4.37Å; L154-V163 HydrophobicContact CD2-CG1 3.95Å; L154-V163 HydrophobicContact CD2-CG2 4.09Å; L154-V163 WeakPolarHBondContact O-CG2 3.36Å; V163-G165 VanDerWaalsContact C-N 3.31Å; V163-G165 PolarHBondContact O-N 3.04Å; V163-W166 PolarHBondContact O-N 3.1Å; V163-Y167 WeakPolarHBondContact O-CB 3.42Å; V163-Y167 PolarHBondContact O-N 3.27Å; V163-C182 HydrophobicContact CG1-CB 3.83Å; V163-Y185 HydrophobicContact CB-CD1 4.38Å; V163-Y185 HydrophobicContact CG1-CD1 3.96Å; V163-Y185 HydrophobicContact CG2-CD1 3.95Å; V163-Y185 HydrophobicContact CG2-CE1 3.84Å; V163-L186 HydrophobicContact CB-CD2 4.2Å; V163-L186 HydrophobicContact CG1-CD1 4.16Å; V163-L186 HydrophobicContact CG1-CD2 4.01Å; V163-L186 HydrophobicContact CG1-CG 3.82Å; V163-E198 WeakPolarHBondContact CA-OE1 3.33Å; V163-E198 PolarHBondContact N-OE1 2.7Å
164	A	90.8	Very high	86.8	Confident	7 Å²	7	44.6 Å²	44.6	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-58.8	-44.4	173.3	0	0	0	0	0	111.3	Y167 E168 E198 I202 L206	A164-Y167 PolarHBondContact O-N 3.07Å; A164-E168 WeakPolarHBondContact O-CG 3.49Å; A164-E168 PolarHBondContact O-N 3.41Å; A164-E168 VanDerWaalsContact O-N 3.09Å; A164-E198 HydrophobicContact CB-CG 4.21Å; A164-E198 PolarHBondContact N-OE1 3.45Å; A164-I202 HydrophobicContact CB-CG1 4.02Å; A164-L206 HydrophobicContact CB-CD2 4.33Å
165	G	91	Very high	86.9	Confident	44 Å²	44	45.1 Å²	45.1	45%	0.454	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-39.1	176.6	0	0	0	0	0	113.3	H162 V163 Y169	H162-G165 PolarHBondContact O-N 3.07Å; V163-G165 VanDerWaalsContact C-N 3.31Å; V163-G165 PolarHBondContact O-N 3.04Å; G165-Y169 WeakPolarHBondContact O-CB 3.46Å; G165-Y169 PolarHBondContact O-N 2.8Å
166	W	93.6	Very high	87.2	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.027	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-36.4	174.4	-70.5	-9.5	0	0	0	112.7	L124 A127 M150 N153 L154 H162 V163 Y169 A170	L124-W166 HydrophobicContact CD2-CH2 3.56Å; L124-W166 HydrophobicContact CD2-CZ2 3.8Å; A127-W166 HydrophobicContact CB-CZ2 4.05Å; M150-W166 HydrophobicContact CB-CD2 4.3Å; M150-W166 HydrophobicContact CB-CE3 3.91Å; M150-W166 HydrophobicContact CB-CH2 4.24Å; M150-W166 HydrophobicContact CB-CZ3 3.9Å; M150-W166 HydrophobicContact CG-CD2 4.1Å; M150-W166 HydrophobicContact CG-CE3 4.2Å; M150-W166 HydrophobicContact CG-CH2 4.22Å; M150-W166 HydrophobicContact CG-CZ2 4.12Å; M150-W166 HydrophobicContact CG-CZ3 4.28Å; M150-W166 WeakPolarHBondContact O-CZ3 3.49Å; M150-W166 HydrophobicContact SD-CD2 4.45Å; M150-W166 HydrophobicContact SD-CG 4.48Å; N153-W166 HydrophobicContact CB-CH2 4.22Å; L154-W166 HydrophobicContact CD2-CE3 3.72Å; L154-W166 HydrophobicContact CD2-CZ3 3.93Å; H162-W166 AromaticContact CD2-CD2 3.83Å; H162-W166 AromaticContact CD2-CE2 3.75Å; H162-W166 AromaticContact CD2-CE3 3.59Å; H162-W166 AromaticContact CD2-CH2 3.26Å; H162-W166 WeakPolarHBondContact CD2-CH2 3.38Å; H162-W166 AromaticContact CD2-CZ2 3.5Å; H162-W166 VanDerWaalsContact CD2-CZ2 3.5Å; H162-W166 WeakPolarHBondContact CD2-CZ2 3.39Å; H162-W166 AromaticContact CD2-CZ3 3.29Å; H162-W166 WeakPolarHBondContact CD2-CZ3 3.48Å; H162-W166 AromaticContact NE2-CH2 3.65Å; H162-W166 AromaticContact NE2-CZ3 3.53Å; H162-W166 PolarHBondContact O-N 3.08Å; V163-W166 PolarHBondContact O-N 3.1Å; W166-Y169 PolarHBondContact O-N 2.91Å; W166-A170 VanDerWaalsContact O-CB 3.26Å; W166-A170 WeakPolarHBondContact O-CB 3.48Å; W166-A170 PolarHBondContact O-N 3.21Å
167	Y	94.2	Very high	87.6	Confident	13 Å²	13	48.2 Å²	48.2	5%	0.051	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-49.8	174.4	173.7	-92.4	0	0	0	111.7	V163 A164 Y169 A170 L171 R179 C182 L183 L206	V163-Y167 WeakPolarHBondContact O-CB 3.42Å; V163-Y167 PolarHBondContact O-N 3.27Å; A164-Y167 PolarHBondContact O-N 3.07Å; Y167-Y169 VanDerWaalsContact C-N 3.28Å; Y167-Y169 PolarHBondContact O-N 3.28Å; Y167-A170 PolarHBondContact O-N 2.85Å; Y167-A170 VanDerWaalsContact O-N 3.16Å; Y167-L171 HydrophobicContact CD1-CD1 3.98Å; Y167-L171 HydrophobicContact CE1-CD1 3.32Å; Y167-L171 HydrophobicContact CE1-CG 4.05Å; Y167-L171 PolarHBondContact O-N 2.88Å; Y167-R179 HydrophobicContact CD2-CG 3.93Å; Y167-R179 HydrophobicContact CE2-CG 3.58Å; Y167-C182 HydrophobicContact CD2-CB 4.31Å; Y167-L183 HydrophobicContact CD2-CB 4.35Å; Y167-L183 HydrophobicContact CE2-CB 4.13Å; Y167-L183 HydrophobicContact CE2-CD1 4.24Å; Y167-L206 HydrophobicContact CD1-CB 4.01Å; Y167-L206 HydrophobicContact CD1-CD1 3.76Å; Y167-L206 HydrophobicContact CD1-CD2 3.7Å; Y167-L206 HydrophobicContact CD1-CG 4.01Å; Y167-L206 HydrophobicContact CD2-CD1 4.2Å; Y167-L206 HydrophobicContact CE1-CB 3.7Å; Y167-L206 HydrophobicContact CE1-CD1 3.6Å; Y167-L206 HydrophobicContact CE1-CD2 4.23Å; Y167-L206 HydrophobicContact CE1-CG 4.02Å; Y167-L206 HydrophobicContact CE2-CD1 4.06Å; Y167-L206 HydrophobicContact CG-CD1 4.05Å; Y167-L206 HydrophobicContact CG-CD2 4.14Å
168	E	92.9	Very high	88.4	Confident	49 Å²	49	43.4 Å²	43.4	23%	0.229	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-40.4	177.7	-68.9	-58.6	149.2	0	0	111.7	A164 L171 Q172 S203	A164-E168 WeakPolarHBondContact O-CG 3.49Å; A164-E168 PolarHBondContact O-N 3.41Å; A164-E168 VanDerWaalsContact O-N 3.09Å; E168-L171 PolarHBondContact O-N 3.1Å; E168-Q172 WeakPolarHBondContact O-CG 3.41Å; E168-Q172 PolarHBondContact O-N 3.22Å; E168-S203 WeakPolarHBondContact OE1-CB 3.5Å; E168-S203 PolarHBondContact OE1-OG 3.07Å
169	Y	92.4	Very high	89.2	Confident	17 Å²	17	45.8 Å²	45.8	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-64.5	-44	174.1	173	-114	0	0	0	112.4	T128 H131 K132 G165 W166 Y167 L171 Q172 A173	T128-Y169 HydrophobicContact CG2-CD1 3.94Å; T128-Y169 HydrophobicContact CG2-CD2 3.84Å; T128-Y169 HydrophobicContact CG2-CE1 4.33Å; T128-Y169 HydrophobicContact CG2-CE2 4.28Å; T128-Y169 HydrophobicContact CG2-CG 3.66Å; H131-Y169 HydrophobicContact CB-CE1 3.85Å; H131-Y169 AromaticContact CG-CE1 3.78Å; H131-Y169 AromaticContact ND1-CE1 3.37Å; H131-Y169 WeakPolarHBondContact ND1-CE1 3.45Å; H131-Y169 AromaticContact ND1-CZ 3.47Å; H131-Y169 PolarHBondContact ND1-OH 3.13Å; K132-Y169 WeakPolarHBondContact CA-OH 3.49Å; K132-Y169 HydrophobicContact CD-CE2 3.97Å; K132-Y169 HydrophobicContact CG-CD2 4.32Å; K132-Y169 HydrophobicContact CG-CE2 3.32Å; K132-Y169 VanDerWaalsContact CG-OH 3.3Å; K132-Y169 WeakPolarHBondContact CG-OH 3.14Å; K132-Y169 PolarHBondContact N-OH 3.45Å; K132-Y169 VanDerWaalsContact N-OH 3.12Å; G165-Y169 WeakPolarHBondContact O-CB 3.46Å; G165-Y169 PolarHBondContact O-N 2.8Å; W166-Y169 PolarHBondContact O-N 2.91Å; Y167-Y169 VanDerWaalsContact C-N 3.28Å; Y167-Y169 PolarHBondContact O-N 3.28Å; Y169-L171 VanDerWaalsContact C-N 3.27Å; Y169-L171 PolarHBondContact O-N 3.08Å; Y169-Q172 PolarHBondContact O-N 3.48Å; Y169-Q172 VanDerWaalsContact O-N 3.09Å; Y169-A173 HydrophobicContact CE1-CB 4.23Å; Y169-A173 HydrophobicContact CE2-CB 3.98Å; Y169-A173 WeakPolarHBondContact O-CB 3.3Å; Y169-A173 PolarHBondContact O-N 2.79Å
170	A	93.5	Very high	90.4	Very high	1 Å²	1	43 Å²	43	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-37.4	179.5	0	0	0	0	0	111.7	W166 Y167 A173 G174 D175 L178 R179	W166-A170 VanDerWaalsContact O-CB 3.26Å; W166-A170 WeakPolarHBondContact O-CB 3.48Å; W166-A170 PolarHBondContact O-N 3.21Å; Y167-A170 PolarHBondContact O-N 2.85Å; Y167-A170 VanDerWaalsContact O-N 3.16Å; A170-A173 PolarHBondContact O-N 3.48Å; A170-G174 PolarHBondContact O-N 2.8Å; A170-D175 PolarHBondContact O-N 3.31Å; A170-D175 VanDerWaalsContact O-N 3.07Å; A170-L178 HydrophobicContact CB-CB 4.01Å; A170-L178 HydrophobicContact CB-CD2 3.86Å; A170-L178 HydrophobicContact CB-CG 3.84Å; A170-R179 HydrophobicContact CB-CB 3.88Å
171	L	92.3	Very high	91.5	Very high	65 Å²	65	40.6 Å²	40.6	34%	0.34	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-46.7	171.6	-75.5	175.7	0	0	0	112	Y167 E168 Y169 G174 R179	Y167-L171 HydrophobicContact CD1-CD1 3.98Å; Y167-L171 HydrophobicContact CE1-CD1 3.32Å; Y167-L171 HydrophobicContact CE1-CG 4.05Å; Y167-L171 PolarHBondContact O-N 2.88Å; E168-L171 PolarHBondContact O-N 3.1Å; Y169-L171 VanDerWaalsContact C-N 3.27Å; Y169-L171 PolarHBondContact O-N 3.08Å; L171-G174 PolarHBondContact O-N 3.1Å; L171-R179 VanDerWaalsContact CD2-CD 3.47Å; L171-R179 HydrophobicContact CD2-CG 4.05Å; L171-R179 HydrophobicContact CG-CG 4.41Å
172	Q	91.1	Very high	92.1	Very high	149 Å²	149	39.8 Å²	39.8	70%	0.696	24%	0.235	S	C	*	.	H	α-helix	trans	-68.2	-37.3	179	-66.7	170.6	17.1	0	0	112.5	E168 Y169 G174	E168-Q172 WeakPolarHBondContact O-CG 3.41Å; E168-Q172 PolarHBondContact O-N 3.22Å; Y169-Q172 PolarHBondContact O-N 3.48Å; Y169-Q172 VanDerWaalsContact O-N 3.09Å; Q172-G174 VanDerWaalsContact C-N 3.33Å
173	A	88.9	Confident	92.4	Very high	36 Å²	36	39.5 Å²	39.5	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-78.9	-16.1	-179.8	0	0	0	0	0	113.3	Y169 A170 D175	Y169-A173 HydrophobicContact CE1-CB 4.23Å; Y169-A173 HydrophobicContact CE2-CB 3.98Å; Y169-A173 WeakPolarHBondContact O-CB 3.3Å; Y169-A173 PolarHBondContact O-N 2.79Å; A170-A173 PolarHBondContact O-N 3.48Å; A173-D175 VanDerWaalsContact C-N 3.28Å
174	G	89.5	Confident	92.6	Very high	58 Å²	58	43.2 Å²	43.2	60%	0.598	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	18.3	-173.9	0	0	0	0	0	114	A170 L171 Q172 V176	A170-G174 PolarHBondContact O-N 2.8Å; L171-G174 PolarHBondContact O-N 3.1Å; Q172-G174 VanDerWaalsContact C-N 3.33Å; G174-V176 PolarHBondContact O-N 2.93Å; G174-V176 VanDerWaalsContact O-N 3.17Å
175	D	90.7	Very high	92.7	Very high	23 Å²	23	44.5 Å²	44.5	12%	0.123	26%	0.256	C	S	.	.			trans	-81.8	94.2	176.2	-171.2	-20.8	0	0	0	109.8	H131 T147 A170 A173 V177 L178 R179	H131-D175 IonicContact NE2-OD2 3.8Å; T147-D175 WeakPolarHBondContact CG2-OD2 3.39Å; T147-D175 PolarHBondContact OG1-OD2 2.99Å; A170-D175 PolarHBondContact O-N 3.31Å; A170-D175 VanDerWaalsContact O-N 3.07Å; A173-D175 VanDerWaalsContact C-N 3.28Å; D175-V177 VanDerWaalsContact C-N 3.32Å; D175-V177 PolarHBondContact O-N 2.89Å; D175-V177 PolarHBondContact OD1-N 2.78Å; D175-V177 VanDerWaalsContact OD1-N 3.09Å; D175-L178 HydrophobicContact CB-CB 4.06Å; D175-L178 PolarHBondContact OD1-N 2.85Å; D175-R179 VanDerWaalsContact O-CB 3.28Å; D175-R179 WeakPolarHBondContact O-CB 3.32Å; D175-R179 PolarHBondContact O-N 3.4Å
176	V	91.8	Very high	92.8	Very high	72 Å²	72	42.4 Å²	42.4	44%	0.436	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-38	-179.2	174	0	0	0	0	111.9	G174 R179 D180	G174-V176 PolarHBondContact O-N 2.93Å; G174-V176 VanDerWaalsContact O-N 3.17Å; V176-R179 PolarHBondContact O-N 2.86Å; V176-D180 WeakPolarHBondContact CG1-OD2 3.49Å; V176-D180 WeakPolarHBondContact O-CB 3.44Å; V176-D180 PolarHBondContact O-N 3.46Å
177	V	91.8	Very high	92.9	Very high	96 Å²	96	42.1 Å²	42.1	58%	0.582	23%	0.233	S	C	*	.	H	α-helix	trans	-67.7	-46.6	-176.7	178.3	0	0	0	0	110.1	D175 S181	D175-V177 VanDerWaalsContact C-N 3.32Å; D175-V177 PolarHBondContact O-N 2.89Å; D175-V177 PolarHBondContact OD1-N 2.78Å; D175-V177 VanDerWaalsContact OD1-N 3.09Å; V177-S181 VanDerWaalsContact O-CB 3.31Å; V177-S181 WeakPolarHBondContact O-CB 3.5Å; V177-S181 PolarHBondContact O-N 3.01Å; V177-S181 PolarHBondContact O-OG 3.11Å
178	L	93.3	Very high	92.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-45.3	176.6	-178.7	59.8	0	0	0	111.4	T147 M150 T151 A170 D175 D180 S181 C182	T147-L178 HydrophobicContact CG2-CB 4.16Å; M150-L178 HydrophobicContact CB-CD1 3.57Å; M150-L178 HydrophobicContact CG-CD1 4.43Å; M150-L178 HydrophobicContact SD-CD1 3.99Å; M150-L178 HydrophobicContact SD-CD2 3.37Å; M150-L178 WeakPolarHBondContact SD-CD2 3.47Å; M150-L178 HydrophobicContact SD-CG 4.33Å; T151-L178 HydrophobicContact CG2-CD1 4.15Å; A170-L178 HydrophobicContact CB-CB 4.01Å; A170-L178 HydrophobicContact CB-CD2 3.86Å; A170-L178 HydrophobicContact CB-CG 3.84Å; D175-L178 HydrophobicContact CB-CB 4.06Å; D175-L178 PolarHBondContact OD1-N 2.85Å; L178-D180 PolarHBondContact O-N 2.89Å; L178-S181 PolarHBondContact O-N 2.95Å; L178-C182 WeakPolarHBondContact O-CB 3.4Å; L178-C182 PolarHBondContact O-N 3.41Å; L178-C182 PolarHBondContact O-SG 2.85Å
179	R	94.6	Very high	93	Very high	77 Å²	77	40.8 Å²	40.8	29%	0.291	23%	0.226	S	C	.	.	H	α-helix	trans	-56.3	-51.9	178.7	-179.9	-162	69.7	-167.9	1.1	111.2	Y167 A170 L171 D175 V176 S181 C182 L183	Y167-R179 HydrophobicContact CD2-CG 3.93Å; Y167-R179 HydrophobicContact CE2-CG 3.58Å; A170-R179 HydrophobicContact CB-CB 3.88Å; L171-R179 VanDerWaalsContact CD2-CD 3.47Å; L171-R179 HydrophobicContact CD2-CG 4.05Å; L171-R179 HydrophobicContact CG-CG 4.41Å; D175-R179 VanDerWaalsContact O-CB 3.28Å; D175-R179 WeakPolarHBondContact O-CB 3.32Å; D175-R179 PolarHBondContact O-N 3.4Å; V176-R179 PolarHBondContact O-N 2.86Å; R179-S181 VanDerWaalsContact C-N 3.34Å; R179-S181 PolarHBondContact O-N 2.88Å; R179-C182 PolarHBondContact O-N 2.91Å; R179-L183 WeakPolarHBondContact O-CB 3.27Å; R179-L183 PolarHBondContact O-N 3.29Å
180	D	94.1	Very high	93	Very high	67 Å²	67	40 Å²	40	36%	0.358	22%	0.223	S	C	.	.	H	α-helix	trans	-67.9	-37.6	-175.9	-66.9	-10.4	0	0	0	110.9	V176 L178 L183 Q184	V176-D180 WeakPolarHBondContact CG1-OD2 3.49Å; V176-D180 WeakPolarHBondContact O-CB 3.44Å; V176-D180 PolarHBondContact O-N 3.46Å; L178-D180 PolarHBondContact O-N 2.89Å; D180-L183 PolarHBondContact O-N 2.77Å; D180-Q184 VanDerWaalsContact O-CB 3.23Å; D180-Q184 WeakPolarHBondContact O-CB 3.42Å; D180-Q184 PolarHBondContact O-N 3.23Å
181	S	93.6	Very high	92.8	Very high	34 Å²	34	40.3 Å²	40.3	24%	0.238	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-44.2	174.4	-58.9	0	0	0	0	112.4	V177 L178 R179 Q184 Y185	V177-S181 VanDerWaalsContact O-CB 3.31Å; V177-S181 WeakPolarHBondContact O-CB 3.5Å; V177-S181 PolarHBondContact O-N 3.01Å; V177-S181 PolarHBondContact O-OG 3.11Å; L178-S181 PolarHBondContact O-N 2.95Å; R179-S181 VanDerWaalsContact C-N 3.34Å; R179-S181 PolarHBondContact O-N 2.88Å; S181-Q184 PolarHBondContact O-N 3.15Å; S181-Y185 WeakPolarHBondContact O-CB 3.29Å; S181-Y185 PolarHBondContact O-N 3.1Å
182	C	94.5	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-46.7	175.8	-66.5	0	0	0	0	111	V163 Y167 L178 R179 Q184 Y185 L186	V163-C182 HydrophobicContact CG1-CB 3.83Å; Y167-C182 HydrophobicContact CD2-CB 4.31Å; L178-C182 WeakPolarHBondContact O-CB 3.4Å; L178-C182 PolarHBondContact O-N 3.41Å; L178-C182 PolarHBondContact O-SG 2.85Å; R179-C182 PolarHBondContact O-N 2.91Å; C182-Q184 VanDerWaalsContact C-N 3.34Å; C182-Q184 PolarHBondContact O-N 2.88Å; C182-Y185 PolarHBondContact O-N 3.45Å; C182-L186 WeakPolarHBondContact O-CB 3.3Å; C182-L186 VanDerWaalsContact O-CG 3.29Å; C182-L186 WeakPolarHBondContact O-CG 3.2Å; C182-L186 PolarHBondContact O-N 3.37Å
183	L	94.6	Very high	92.6	Very high	14 Å²	14	32.9 Å²	32.9	7%	0.073	20%	0.195	C	C	.	.	H	α-helix	trans	-62.5	-41.9	179.9	-174	66.5	0	0	0	111.9	Y167 R179 D180 L186 A187 L206 T209 L210 R213	Y167-L183 HydrophobicContact CD2-CB 4.35Å; Y167-L183 HydrophobicContact CE2-CB 4.13Å; Y167-L183 HydrophobicContact CE2-CD1 4.24Å; R179-L183 WeakPolarHBondContact O-CB 3.27Å; R179-L183 PolarHBondContact O-N 3.29Å; D180-L183 PolarHBondContact O-N 2.77Å; L183-L186 PolarHBondContact O-N 3.49Å; L183-A187 VanDerWaalsContact O-CB 3.31Å; L183-A187 WeakPolarHBondContact O-CB 3.48Å; L183-A187 PolarHBondContact O-N 2.92Å; L183-L206 HydrophobicContact CD1-CD1 3.78Å; L183-T209 HydrophobicContact CD1-CG2 3.93Å; L183-T209 HydrophobicContact CD2-CG2 3.91Å; L183-L210 HydrophobicContact CD1-CD2 3.7Å; L183-L210 HydrophobicContact CD1-CG 4.16Å; L183-R213 VanDerWaalsContact CD2-NH1 3.34Å
184	Q	94.6	Very high	92.6	Very high	79 Å²	79	32.6 Å²	32.6	37%	0.369	19%	0.189	S	C	.	.	H	α-helix	trans	-65.1	-44.5	176.8	-178.1	174.8	-28	0	0	111.7	D180 S181 C182 A187 W188	D180-Q184 VanDerWaalsContact O-CB 3.23Å; D180-Q184 WeakPolarHBondContact O-CB 3.42Å; D180-Q184 PolarHBondContact O-N 3.23Å; S181-Q184 PolarHBondContact O-N 3.15Å; C182-Q184 VanDerWaalsContact C-N 3.34Å; C182-Q184 PolarHBondContact O-N 2.88Å; Q184-A187 PolarHBondContact O-N 3.26Å; Q184-W188 HydrophobicContact CG-CD2 3.77Å; Q184-W188 HydrophobicContact CG-CE3 3.99Å; Q184-W188 HydrophobicContact CG-CG 4.38Å; Q184-W188 HydrophobicContact CG-CH2 4.11Å; Q184-W188 HydrophobicContact CG-CZ2 3.84Å; Q184-W188 HydrophobicContact CG-CZ3 4.13Å; Q184-W188 WeakPolarHBondContact O-CB 3.43Å; Q184-W188 PolarHBondContact O-N 3.01Å
185	Y	93.9	Very high	92.4	Very high	34 Å²	34	36.9 Å²	36.9	13%	0.133	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-47.5	175.6	172	-92.9	0	0	0	111.8	L154 A155 V163 S181 C182 A187 W188 N189 V416	L154-Y185 HydrophobicContact CB-CD1 4.17Å; L154-Y185 HydrophobicContact CB-CD2 3.86Å; L154-Y185 HydrophobicContact CB-CE2 4.32Å; L154-Y185 HydrophobicContact CB-CG 3.78Å; L154-Y185 HydrophobicContact CD1-CG 4.38Å; A155-Y185 WeakPolarHBondContact CA-OH 3.39Å; A155-Y185 HydrophobicContact CB-CE2 3.86Å; V163-Y185 HydrophobicContact CB-CD1 4.38Å; V163-Y185 HydrophobicContact CG1-CD1 3.96Å; V163-Y185 HydrophobicContact CG2-CD1 3.95Å; V163-Y185 HydrophobicContact CG2-CE1 3.84Å; S181-Y185 WeakPolarHBondContact O-CB 3.29Å; S181-Y185 PolarHBondContact O-N 3.1Å; C182-Y185 PolarHBondContact O-N 3.45Å; Y185-A187 VanDerWaalsContact C-N 3.32Å; Y185-A187 PolarHBondContact O-N 3.24Å; Y185-W188 PolarHBondContact O-N 3Å; Y185-N189 WeakPolarHBondContact CD2-ND2 3.16Å; Y185-N189 HydrophobicContact CE2-CB 4.22Å; Y185-N189 WeakPolarHBondContact O-CB 3.36Å; Y185-N189 PolarHBondContact O-N 2.96Å; Y185-N189 PolarHBondContact O-ND2 3.2Å; Y185-V416 HydrophobicContact CE2-CG1 4.32Å
186	L	93.9	Very high	91.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-40.8	177.4	-70.5	172	0	0	0	111.6	V163 C182 L183 L190 V193 L206 L210	V163-L186 HydrophobicContact CB-CD2 4.2Å; V163-L186 HydrophobicContact CG1-CD1 4.16Å; V163-L186 HydrophobicContact CG1-CD2 4.01Å; V163-L186 HydrophobicContact CG1-CG 3.82Å; C182-L186 WeakPolarHBondContact O-CB 3.3Å; C182-L186 VanDerWaalsContact O-CG 3.29Å; C182-L186 WeakPolarHBondContact O-CG 3.2Å; C182-L186 PolarHBondContact O-N 3.37Å; L183-L186 PolarHBondContact O-N 3.49Å; L186-L190 WeakPolarHBondContact O-CA 3.4Å; L186-L190 WeakPolarHBondContact O-CB 3.33Å; L186-L190 PolarHBondContact O-N 3.48Å; L186-V193 HydrophobicContact CD2-CG1 4.12Å; L186-V193 HydrophobicContact CD2-CG2 3.88Å; L186-L206 HydrophobicContact CD1-CD1 4.11Å; L186-L206 HydrophobicContact CD1-CD2 3.88Å; L186-L210 HydrophobicContact CB-CD1 4.43Å; L186-L210 HydrophobicContact CB-CD2 4.03Å
187	A	95.1	Very high	91.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-45.5	177.4	0	0	0	0	0	112.3	L183 Q184 Y185 L210 L216 V217	L183-A187 VanDerWaalsContact O-CB 3.31Å; L183-A187 WeakPolarHBondContact O-CB 3.48Å; L183-A187 PolarHBondContact O-N 2.92Å; Q184-A187 PolarHBondContact O-N 3.26Å; Y185-A187 VanDerWaalsContact C-N 3.32Å; Y185-A187 PolarHBondContact O-N 3.24Å; A187-L210 HydrophobicContact CB-CD2 4.4Å; A187-L216 HydrophobicContact CB-CD2 3.72Å; A187-L216 CarbonylContact O-C 3.58Å; A187-L216 WeakPolarHBondContact O-CA 3.49Å; A187-V217 PolarHBondContact O-N 2.97Å
188	W	94.9	Very high	91	Very high	27 Å²	27	32.4 Å²	32.4	10%	0.102	18%	0.177	C	C	.	.	H	α-helix	trans	-82.8	-18.2	-173.7	-66.5	0.9	0	0	0	114.1	Q184 Y185 D215 V217 V417 K418 V420	Q184-W188 HydrophobicContact CG-CD2 3.77Å; Q184-W188 HydrophobicContact CG-CE3 3.99Å; Q184-W188 HydrophobicContact CG-CG 4.38Å; Q184-W188 HydrophobicContact CG-CH2 4.11Å; Q184-W188 HydrophobicContact CG-CZ2 3.84Å; Q184-W188 HydrophobicContact CG-CZ3 4.13Å; Q184-W188 WeakPolarHBondContact O-CB 3.43Å; Q184-W188 PolarHBondContact O-N 3.01Å; Y185-W188 PolarHBondContact O-N 3Å; W188-D215 PolarHBondContact NE1-OD2 2.91Å; W188-V217 HydrophobicContact CB-CG2 4.46Å; W188-V217 VanDerWaalsContact O-CB 3.26Å; W188-V217 WeakPolarHBondContact O-CB 3.33Å; W188-V417 HydrophobicContact CB-CB 3.95Å; W188-V417 HydrophobicContact CB-CG1 3.96Å; W188-V417 HydrophobicContact CD2-CG1 4.36Å; W188-V417 HydrophobicContact CE3-CG1 4.13Å; W188-V417 HydrophobicContact CG-CG1 4.36Å; W188-V417 WeakPolarHBondContact O-CB 3.2Å; W188-V417 WeakPolarHBondContact O-CG2 3.49Å; W188-K418 VanDerWaalsContact CZ3-O 3.27Å; W188-K418 WeakPolarHBondContact CZ3-O 3.36Å; W188-V420 HydrophobicContact CD2-CB 4.45Å; W188-V420 HydrophobicContact CD2-CG2 3.51Å; W188-V420 VanDerWaalsContact CE2-CG2 3.42Å; W188-V420 HydrophobicContact CE3-CG2 3.93Å; W188-V420 HydrophobicContact CG-CG2 3.91Å; W188-V420 HydrophobicContact CH2-CB 4.11Å; W188-V420 HydrophobicContact CH2-CG2 4.07Å; W188-V420 HydrophobicContact CZ2-CB 3.74Å; W188-V420 HydrophobicContact CZ2-CG2 3.72Å; W188-V420 HydrophobicContact CZ3-CG2 4.2Å
189	N	93	Very high	90.9	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.037	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	25.6	179.6	-61.8	-77.5	0	0	0	111.9	Y185 S191 S192 V193 V416 V417	Y185-N189 WeakPolarHBondContact CD2-ND2 3.16Å; Y185-N189 HydrophobicContact CE2-CB 4.22Å; Y185-N189 WeakPolarHBondContact O-CB 3.36Å; Y185-N189 PolarHBondContact O-N 2.96Å; Y185-N189 PolarHBondContact O-ND2 3.2Å; N189-S191 PolarHBondContact O-N 3.21Å; N189-S192 WeakPolarHBondContact O-CB 3.36Å; N189-S192 PolarHBondContact O-N 3.01Å; N189-V193 WeakPolarHBondContact O-CG2 3.44Å; N189-V193 PolarHBondContact O-N 3.48Å; N189-V416 WeakPolarHBondContact OD1-CA 3.49Å; N189-V416 WeakPolarHBondContact OD1-CB 3.19Å; N189-V417 PolarHBondContact ND2-O 3.39Å; N189-V417 PolarHBondContact OD1-N 3.49Å
190	L	92.8	Very high	90.5	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-56.9	-45.7	-170.4	-174	60.3	0	0	0	112.3	L186 S192 V193 L194 W199 L216 V217 L224	L186-L190 WeakPolarHBondContact O-CA 3.4Å; L186-L190 WeakPolarHBondContact O-CB 3.33Å; L186-L190 PolarHBondContact O-N 3.48Å; L190-S192 PolarHBondContact O-N 2.77Å; L190-V193 CarbonylContact O-C 3.59Å; L190-V193 WeakPolarHBondContact O-CA 3.5Å; L190-V193 WeakPolarHBondContact O-CB 3.42Å; L190-V193 PolarHBondContact O-N 3.41Å; L190-L194 HydrophobicContact CD1-CD2 4.17Å; L190-L194 HydrophobicContact CD1-CG 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.39Å; L190-L194 HydrophobicContact CG-CD2 4.49Å; L190-L194 HydrophobicContact CG-CG 4.2Å; L190-L194 VanDerWaalsContact O-CG 3.29Å; L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 3.22Å; L190-W199 HydrophobicContact CD1-CE3 3.88Å; L190-W199 HydrophobicContact CD1-CH2 4.32Å; L190-W199 HydrophobicContact CD1-CZ3 3.5Å; L190-W199 VanDerWaalsContact CD1-CZ3 3.5Å; L190-L216 HydrophobicContact CD2-CB 4.23Å; L190-L216 HydrophobicContact CD2-CD1 3.84Å; L190-L216 HydrophobicContact CD2-CD2 4.31Å; L190-L216 HydrophobicContact CD2-CG 4.36Å; L190-V217 WeakPolarHBondContact CB-O 3.19Å; L190-L224 HydrophobicContact CD2-CD1 3.98Å
191	S	90.8	Very high	90.2	Very high	8 Å²	8	31.2 Å²	31.2	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-56.4	-36.7	178.2	-173.6	0	0	0	0	112.9	N189 Q195 V217 E223	N189-S191 PolarHBondContact O-N 3.21Å; S191-Q195 WeakPolarHBondContact O-CG 3.43Å; S191-Q195 PolarHBondContact O-N 3.12Å; S191-V217 PolarHBondContact N-O 3.3Å; S191-E223 PolarHBondContact OG-OE1 3.02Å
192	S	88.4	Confident	90.1	Very high	55 Å²	55	29.8 Å²	29.8	39%	0.385	17%	0.173	S	C	.	.	H	α-helix	trans	-71.3	-38.1	174.1	-57.4	0	0	0	0	112.4	N189 L190 Q195 S196	N189-S192 WeakPolarHBondContact O-CB 3.36Å; N189-S192 PolarHBondContact O-N 3.01Å; L190-S192 PolarHBondContact O-N 2.77Å; S192-Q195 PolarHBondContact O-N 2.99Å; S192-S196 PolarHBondContact O-N 3.37Å; S192-S196 VanDerWaalsContact O-N 3.14Å
193	V	89.6	Confident	90	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-43	175.5	175.8	0	0	0	0	110.7	L186 N189 L190 Q195 S196 E198	L186-V193 HydrophobicContact CD2-CG1 4.12Å; L186-V193 HydrophobicContact CD2-CG2 3.88Å; N189-V193 WeakPolarHBondContact O-CG2 3.44Å; N189-V193 PolarHBondContact O-N 3.48Å; L190-V193 CarbonylContact O-C 3.59Å; L190-V193 WeakPolarHBondContact O-CA 3.5Å; L190-V193 WeakPolarHBondContact O-CB 3.42Å; L190-V193 PolarHBondContact O-N 3.41Å; V193-Q195 PolarHBondContact O-N 2.94Å; V193-S196 PolarHBondContact O-N 3.02Å; V193-S196 VanDerWaalsContact O-N 3.13Å; V193-S196 PolarHBondContact O-OG 3.14Å; V193-E198 HydrophobicContact CG1-CB 4.24Å; V193-E198 HydrophobicContact CG1-CG 4.43Å
194	L	89.7	Confident	89.9	Confident	31 Å²	31	33.1 Å²	33.1	16%	0.162	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-34.3	176.8	-64.8	-174.2	0	0	0	112.4	L190 W199 E223 A227	L190-L194 HydrophobicContact CD1-CD2 4.17Å; L190-L194 HydrophobicContact CD1-CG 4.32Å; L190-L194 HydrophobicContact CG-CD1 4.39Å; L190-L194 HydrophobicContact CG-CD2 4.49Å; L190-L194 HydrophobicContact CG-CG 4.2Å; L190-L194 VanDerWaalsContact O-CG 3.29Å; L190-L194 WeakPolarHBondContact O-CG 3.33Å; L190-L194 PolarHBondContact O-N 3.22Å; L194-W199 HydrophobicContact CD2-CB 3.92Å; L194-W199 HydrophobicContact CD2-CD2 3.27Å; L194-W199 HydrophobicContact CD2-CE3 3.51Å; L194-W199 HydrophobicContact CD2-CG 3.46Å; L194-W199 VanDerWaalsContact CD2-CG 3.46Å; L194-W199 HydrophobicContact CD2-CZ2 4.33Å; L194-W199 HydrophobicContact CD2-CZ3 4.17Å; L194-E223 HydrophobicContact CD1-CG 3.87Å; L194-A227 HydrophobicContact CD1-CB 3.9Å; L194-A227 HydrophobicContact CD2-CB 3.49Å; L194-A227 VanDerWaalsContact CD2-CB 3.49Å; L194-A227 HydrophobicContact CG-CB 4.2Å
195	Q	84.7	Confident	89.8	Confident	147 Å²	147	35.6 Å²	35.6	69%	0.687	21%	0.209	S	C	*	.	H	α-helix	trans	-79.8	-25.5	178.3	-67.7	170.7	13	0	0	113.5	S191 S192 V193 G197	S191-Q195 WeakPolarHBondContact O-CG 3.43Å; S191-Q195 PolarHBondContact O-N 3.12Å; S192-Q195 PolarHBondContact O-N 2.99Å; V193-Q195 PolarHBondContact O-N 2.94Å; Q195-G197 VanDerWaalsContact C-N 3.34Å; Q195-G197 PolarHBondContact O-N 2.92Å
196	S	79.9	Confident	89.8	Confident	41 Å²	41	34 Å²	34	29%	0.287	20%	0.203	S	C	.	.	S	Bend	trans	-81	-7.5	-173.7	69.8	0	0	0	0	115.1	S192 V193 E198	S192-S196 PolarHBondContact O-N 3.37Å; S192-S196 VanDerWaalsContact O-N 3.14Å; V193-S196 PolarHBondContact O-N 3.02Å; V193-S196 VanDerWaalsContact O-N 3.13Å; V193-S196 PolarHBondContact O-OG 3.14Å; S196-E198 PolarHBondContact O-N 3.27Å; S196-E198 WeakPolarHBondContact OG-CB 3.15Å; S196-E198 PolarHBondContact OG-N 2.89Å
197	G	79	Confident	89.8	Confident	47 Å²	47	34 Å²	34	49%	0.485	20%	0.203	S	C	.	.	S	Bend	trans	78.9	-12	-175.4	0	0	0	0	0	114.8	Q195 W199 V200	Q195-G197 VanDerWaalsContact C-N 3.34Å; Q195-G197 PolarHBondContact O-N 2.92Å; G197-W199 PolarHBondContact O-N 3.34Å; G197-V200 PolarHBondContact O-N 3.13Å
198	E	86.9	Confident	89.8	Confident	10 Å²	10	35.8 Å²	35.8	5%	0.047	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-57.2	-31.7	175	-179.1	166.9	-159.2	0	0	111.9	G161 H162 V163 A164 V193 S196 V200 S201	G161-E198 WeakPolarHBondContact CA-OE1 3.29Å; G161-E198 WeakPolarHBondContact CA-OE2 3.37Å; H162-E198 PolarHBondContact N-OE1 2.97Å; V163-E198 WeakPolarHBondContact CA-OE1 3.33Å; V163-E198 PolarHBondContact N-OE1 2.7Å; A164-E198 HydrophobicContact CB-CG 4.21Å; A164-E198 PolarHBondContact N-OE1 3.45Å; V193-E198 HydrophobicContact CG1-CB 4.24Å; V193-E198 HydrophobicContact CG1-CG 4.43Å; S196-E198 PolarHBondContact O-N 3.27Å; S196-E198 WeakPolarHBondContact OG-CB 3.15Å; S196-E198 PolarHBondContact OG-N 2.89Å; E198-V200 PolarHBondContact O-N 3.32Å; E198-V200 VanDerWaalsContact O-N 3.16Å; E198-S201 PolarHBondContact O-N 3.02Å; E198-S201 PolarHBondContact O-OG 3.48Å
199	W	89.4	Confident	89.7	Confident	8 Å²	8	36.8 Å²	36.8	3%	0.03	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-52	-40.2	-179	-178.4	-106.4	0	0	0	113.8	L190 L194 G197 S201 I202 L207 L210 L224 A227 W231	L190-W199 HydrophobicContact CD1-CE3 3.88Å; L190-W199 HydrophobicContact CD1-CH2 4.32Å; L190-W199 HydrophobicContact CD1-CZ3 3.5Å; L190-W199 VanDerWaalsContact CD1-CZ3 3.5Å; L194-W199 HydrophobicContact CD2-CB 3.92Å; L194-W199 HydrophobicContact CD2-CD2 3.27Å; L194-W199 HydrophobicContact CD2-CE3 3.51Å; L194-W199 HydrophobicContact CD2-CG 3.46Å; L194-W199 VanDerWaalsContact CD2-CG 3.46Å; L194-W199 HydrophobicContact CD2-CZ2 4.33Å; L194-W199 HydrophobicContact CD2-CZ3 4.17Å; G197-W199 PolarHBondContact O-N 3.34Å; W199-S201 VanDerWaalsContact C-N 3.28Å; W199-S201 PolarHBondContact O-N 2.87Å; W199-I202 HydrophobicContact CD2-CD1 4.25Å; W199-I202 HydrophobicContact CE3-CD1 3.48Å; W199-I202 VanDerWaalsContact CE3-CD1 3.48Å; W199-I202 HydrophobicContact CZ3-CD1 3.94Å; W199-I202 WeakPolarHBondContact O-CB 3.3Å; W199-I202 PolarHBondContact O-N 2.64Å; W199-L207 HydrophobicContact CH2-CD1 3.32Å; W199-L207 HydrophobicContact CZ2-CD1 3.24Å; W199-L207 HydrophobicContact CZ3-CD1 4.29Å; W199-L210 HydrophobicContact CZ3-CD1 4.02Å; W199-L224 HydrophobicContact CH2-CD1 4.14Å; W199-L224 HydrophobicContact CZ2-CD1 4.25Å; W199-A227 VanDerWaalsContact NE1-C 3.33Å; W199-A227 PolarHBondContact NE1-O 2.94Å; W199-W231 VanDerWaalsContact O-CD1 3.29Å
200	V	87.7	Confident	89.9	Confident	35 Å²	35	36.5 Å²	36.5	21%	0.212	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-65.6	-34	-179.2	172.1	0	0	0	0	111.8	G197 E198 I202 Q234 N235	G197-V200 PolarHBondContact O-N 3.13Å; E198-V200 PolarHBondContact O-N 3.32Å; E198-V200 VanDerWaalsContact O-N 3.16Å; V200-I202 PolarHBondContact O-N 3.49Å; V200-Q234 HydrophobicContact CG1-CB 4.28Å; V200-Q234 HydrophobicContact CG1-CG 3.8Å; V200-N235 PolarHBondContact O-ND2 3.09Å
201	S	87.4	Confident	89.9	Confident	76 Å²	76	36.6 Å²	36.6	53%	0.531	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-78.1	-6.1	-177	72.8	0	0	0	0	114.1	E198 W199	E198-S201 PolarHBondContact O-N 3.02Å; E198-S201 PolarHBondContact O-OG 3.48Å; W199-S201 VanDerWaalsContact C-N 3.28Å; W199-S201 PolarHBondContact O-N 2.87Å
202	I	91.9	Very high	90	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	25%	0.247	C	C	.	.			trans	-69.3	137.4	-177.5	-71	176	0	0	0	110.8	A164 W199 V200 L206 L207 L210 W231	A164-I202 HydrophobicContact CB-CG1 4.02Å; W199-I202 HydrophobicContact CD2-CD1 4.25Å; W199-I202 HydrophobicContact CE3-CD1 3.48Å; W199-I202 VanDerWaalsContact CE3-CD1 3.48Å; W199-I202 HydrophobicContact CZ3-CD1 3.94Å; W199-I202 WeakPolarHBondContact O-CB 3.3Å; W199-I202 PolarHBondContact O-N 2.64Å; V200-I202 PolarHBondContact O-N 3.49Å; I202-L206 HydrophobicContact CB-CD2 4.46Å; I202-L206 HydrophobicContact CG1-CD2 4.2Å; I202-L206 HydrophobicContact CG2-CB 3.79Å; I202-L206 HydrophobicContact CG2-CD2 3.76Å; I202-L206 HydrophobicContact CG2-CG 3.64Å; I202-L207 HydrophobicContact CG2-CB 4.09Å; I202-L210 HydrophobicContact CD1-CD1 4.35Å; I202-W231 PolarHBondContact O-NE1 2.76Å
203	S	92.3	Very high	90.2	Very high	35 Å²	35	43.1 Å²	43.1	25%	0.245	24%	0.241	C	C	.	.			trans	-65.8	154.2	174.6	78.3	0	0	0	0	112	E168 Q205 L206 L207	E168-S203 WeakPolarHBondContact OE1-CB 3.5Å; E168-S203 PolarHBondContact OE1-OG 3.07Å; S203-Q205 PolarHBondContact O-N 3.27Å; S203-L206 PolarHBondContact O-N 3.08Å; S203-L206 WeakPolarHBondContact OG-CB 3.37Å; S203-L206 PolarHBondContact OG-N 3.44Å; S203-L206 VanDerWaalsContact OG-N 3.12Å; S203-L207 WeakPolarHBondContact O-CB 3.32Å; S203-L207 PolarHBondContact O-N 2.77Å
204	S	92.8	Very high	90.3	Very high	49 Å²	49	45.8 Å²	45.8	34%	0.343	26%	0.259	S	S	.	.	H	α-helix	trans	-58	-33.3	176.1	55.3	0	0	0	0	113.1	M208	S204-M208 WeakPolarHBondContact O-CG 3.37Å; S204-M208 PolarHBondContact O-N 3.14Å
205	Q	92.1	Very high	90.4	Very high	130 Å²	130	46.2 Å²	46.2	61%	0.607	26%	0.261	S	S	*	.	H	α-helix	trans	-71.4	-46.2	179.3	-63.6	-178.8	6	0	0	111.9	S203 L207 M208 T209	S203-Q205 PolarHBondContact O-N 3.27Å; Q205-L207 VanDerWaalsContact C-N 3.35Å; Q205-M208 PolarHBondContact O-N 3.3Å; Q205-T209 WeakPolarHBondContact O-CB 3.47Å; Q205-T209 PolarHBondContact O-N 3.25Å; Q205-T209 PolarHBondContact O-OG1 2.98Å
206	L	93.6	Very high	90.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-42.2	175.6	172.1	57.1	0	0	0	110.7	A164 Y167 L183 L186 I202 S203 M208 T209 L210	A164-L206 HydrophobicContact CB-CD2 4.33Å; Y167-L206 HydrophobicContact CD1-CB 4.01Å; Y167-L206 HydrophobicContact CD1-CD1 3.76Å; Y167-L206 HydrophobicContact CD1-CD2 3.7Å; Y167-L206 HydrophobicContact CD1-CG 4.01Å; Y167-L206 HydrophobicContact CD2-CD1 4.2Å; Y167-L206 HydrophobicContact CE1-CB 3.7Å; Y167-L206 HydrophobicContact CE1-CD1 3.6Å; Y167-L206 HydrophobicContact CE1-CD2 4.23Å; Y167-L206 HydrophobicContact CE1-CG 4.02Å; Y167-L206 HydrophobicContact CE2-CD1 4.06Å; Y167-L206 HydrophobicContact CG-CD1 4.05Å; Y167-L206 HydrophobicContact CG-CD2 4.14Å; L183-L206 HydrophobicContact CD1-CD1 3.78Å; L186-L206 HydrophobicContact CD1-CD1 4.11Å; L186-L206 HydrophobicContact CD1-CD2 3.88Å; I202-L206 HydrophobicContact CB-CD2 4.46Å; I202-L206 HydrophobicContact CG1-CD2 4.2Å; I202-L206 HydrophobicContact CG2-CB 3.79Å; I202-L206 HydrophobicContact CG2-CD2 3.76Å; I202-L206 HydrophobicContact CG2-CG 3.64Å; S203-L206 PolarHBondContact O-N 3.08Å; S203-L206 WeakPolarHBondContact OG-CB 3.37Å; S203-L206 PolarHBondContact OG-N 3.44Å; S203-L206 VanDerWaalsContact OG-N 3.12Å; L206-M208 PolarHBondContact O-N 3.13Å; L206-T209 WeakPolarHBondContact O-CB 3.31Å; L206-T209 PolarHBondContact O-N 2.75Å; L206-L210 HydrophobicContact CD1-CD1 4Å; L206-L210 HydrophobicContact CD1-CG 4.02Å; L206-L210 HydrophobicContact CG-CD1 4.11Å; L206-L210 WeakPolarHBondContact O-CG 3.41Å; L206-L210 PolarHBondContact O-N 2.87Å
207	L	94.6	Very high	91.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.8	-52.1	175.1	175.3	63	0	0	0	111.7	W199 I202 S203 Q205 T209 L210 L211 L228 W231 T245	W199-L207 HydrophobicContact CH2-CD1 3.32Å; W199-L207 HydrophobicContact CZ2-CD1 3.24Å; W199-L207 HydrophobicContact CZ3-CD1 4.29Å; I202-L207 HydrophobicContact CG2-CB 4.09Å; S203-L207 WeakPolarHBondContact O-CB 3.32Å; S203-L207 PolarHBondContact O-N 2.77Å; Q205-L207 VanDerWaalsContact C-N 3.35Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 2.84Å; L207-L210 PolarHBondContact O-N 3.06Å; L207-L211 HydrophobicContact CD1-CD1 4Å; L207-L211 HydrophobicContact CD1-CG 4.04Å; L207-L211 HydrophobicContact CG-CD1 4.03Å; L207-L211 HydrophobicContact CG-CG 4.42Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 3.07Å; L207-L228 HydrophobicContact CD1-CD1 4.35Å; L207-L228 HydrophobicContact CD2-CD1 3.83Å; L207-W231 HydrophobicContact CD2-CD2 3.51Å; L207-W231 HydrophobicContact CD2-CE3 3.36Å; L207-W231 HydrophobicContact CD2-CG 4.23Å; L207-W231 HydrophobicContact CD2-CH2 3.77Å; L207-W231 HydrophobicContact CD2-CZ2 3.9Å; L207-W231 HydrophobicContact CD2-CZ3 3.47Å; L207-W231 VanDerWaalsContact CD2-CZ3 3.47Å; L207-T245 HydrophobicContact CD2-CG2 3.72Å; L207-T245 HydrophobicContact CG-CG2 4.17Å
208	M	94.2	Very high	92.5	Very high	38 Å²	38	35.1 Å²	35.1	19%	0.187	19%	0.193	C	C	.	.	H	α-helix	trans	-59.4	-41.2	178	-78.1	-58.6	-58.6	0	0	112.2	S204 Q205 L206 L210 L211 Q212 N244 T245	S204-M208 WeakPolarHBondContact O-CG 3.37Å; S204-M208 PolarHBondContact O-N 3.14Å; Q205-M208 PolarHBondContact O-N 3.3Å; L206-M208 PolarHBondContact O-N 3.13Å; M208-L210 VanDerWaalsContact C-N 3.34Å; M208-L210 PolarHBondContact O-N 3.32Å; M208-L211 PolarHBondContact O-N 2.88Å; M208-Q212 WeakPolarHBondContact O-CG 3.49Å; M208-Q212 PolarHBondContact O-N 2.91Å; M208-N244 HydrophobicContact CE-CB 4.07Å; M208-N244 HydrophobicContact SD-CB 4.21Å; M208-T245 HydrophobicContact CG-CG2 4.04Å; M208-T245 HydrophobicContact SD-CG2 3.32Å; M208-T245 WeakPolarHBondContact SD-CG2 3.46Å
209	T	94.2	Very high	92.8	Very high	49 Å²	49	38.6 Å²	38.6	30%	0.301	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-42.8	177.6	-55.4	0	0	0	0	111.1	L183 Q205 L206 L207 R213	L183-T209 HydrophobicContact CD1-CG2 3.93Å; L183-T209 HydrophobicContact CD2-CG2 3.91Å; Q205-T209 WeakPolarHBondContact O-CB 3.47Å; Q205-T209 PolarHBondContact O-N 3.25Å; Q205-T209 PolarHBondContact O-OG1 2.98Å; L206-T209 WeakPolarHBondContact O-CB 3.31Å; L206-T209 PolarHBondContact O-N 2.75Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 2.84Å; T209-R213 WeakPolarHBondContact O-CG 3.09Å
210	L	95.3	Very high	93	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-66	-48.5	176.6	-71.8	169.7	0	0	0	111.5	L183 L186 A187 W199 I202 L206 L207 M208 Q212 R213 L216	L183-L210 HydrophobicContact CD1-CD2 3.7Å; L183-L210 HydrophobicContact CD1-CG 4.16Å; L186-L210 HydrophobicContact CB-CD1 4.43Å; L186-L210 HydrophobicContact CB-CD2 4.03Å; A187-L210 HydrophobicContact CB-CD2 4.4Å; W199-L210 HydrophobicContact CZ3-CD1 4.02Å; I202-L210 HydrophobicContact CD1-CD1 4.35Å; L206-L210 HydrophobicContact CD1-CD1 4Å; L206-L210 HydrophobicContact CD1-CG 4.02Å; L206-L210 HydrophobicContact CG-CD1 4.11Å; L206-L210 WeakPolarHBondContact O-CG 3.41Å; L206-L210 PolarHBondContact O-N 2.87Å; L207-L210 PolarHBondContact O-N 3.06Å; M208-L210 VanDerWaalsContact C-N 3.34Å; M208-L210 PolarHBondContact O-N 3.32Å; L210-Q212 PolarHBondContact O-N 2.95Å; L210-Q212 VanDerWaalsContact O-N 3.16Å; L210-R213 WeakPolarHBondContact O-CB 3.09Å; L210-R213 PolarHBondContact O-N 2.88Å; L210-L216 HydrophobicContact CD2-CD2 4.27Å; L210-L216 WeakPolarHBondContact O-CD1 3.33Å
211	L	94	Very high	93.4	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-28.2	-177	-69.3	177.6	0	0	0	113.4	L207 M208 R213 L224 L228 T245 A248 M249 R308	L207-L211 HydrophobicContact CD1-CD1 4Å; L207-L211 HydrophobicContact CD1-CG 4.04Å; L207-L211 HydrophobicContact CG-CD1 4.03Å; L207-L211 HydrophobicContact CG-CG 4.42Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 3.07Å; M208-L211 PolarHBondContact O-N 2.88Å; L211-R213 VanDerWaalsContact C-N 3.35Å; L211-L224 HydrophobicContact CD2-CD1 3.91Å; L211-L224 HydrophobicContact CD2-CD2 3.85Å; L211-L224 HydrophobicContact CD2-CG 3.97Å; L211-L228 HydrophobicContact CD1-CD1 4.28Å; L211-L228 HydrophobicContact CD1-CD2 4.31Å; L211-T245 HydrophobicContact CD1-CG2 4.19Å; L211-A248 HydrophobicContact CB-CB 3.84Å; L211-A248 HydrophobicContact CD1-CB 4.3Å; L211-M249 HydrophobicContact CD2-SD 3.96Å; L211-R308 VanDerWaalsContact O-CZ 3.26Å; L211-R308 PolarHBondContact O-NH1 2.95Å; L211-R308 PolarHBondContact O-NH2 3.19Å
212	Q	92.5	Very high	93.6	Very high	134 Å²	134	37.3 Å²	37.3	63%	0.626	20%	0.198	S	C	*	.	H	α-helix	trans	-75.4	-20.3	177.4	-71.1	176.3	-4.6	0	0	113.9	M208 L210	M208-Q212 WeakPolarHBondContact O-CG 3.49Å; M208-Q212 PolarHBondContact O-N 2.91Å; L210-Q212 PolarHBondContact O-N 2.95Å; L210-Q212 VanDerWaalsContact O-N 3.16Å
213	R	92.9	Very high	93.8	Very high	67 Å²	67	39.1 Å²	39.1	25%	0.253	21%	0.206	S	C	.	.			trans	-76.4	136.8	-172.6	-70.7	176.2	71.3	101.7	-0.3	114	L183 T209 L210 L211 D215 L216 R250 R308	L183-R213 VanDerWaalsContact CD2-NH1 3.34Å; T209-R213 WeakPolarHBondContact O-CG 3.09Å; L210-R213 WeakPolarHBondContact O-CB 3.09Å; L210-R213 PolarHBondContact O-N 2.88Å; L211-R213 VanDerWaalsContact C-N 3.35Å; R213-D215 WeakPolarHBondContact CB-OD1 3.33Å; R213-D215 IonicContact CZ-OD1 2.91Å; R213-D215 IonicContact CZ-OD2 2.8Å; R213-D215 IonicContact NE-OD1 3.44Å; R213-D215 PolarHBondContact NE-OD1 3.2Å; R213-D215 IonicContact NE-OD2 3.99Å; R213-D215 VanDerWaalsContact NH2-CG 3.28Å; R213-D215 IonicContact NH2-OD1 2.7Å; R213-D215 PolarHBondContact NH2-OD1 3.09Å; R213-D215 VanDerWaalsContact NH2-OD1 3.13Å; R213-D215 IonicContact NH2-OD2 3.17Å; R213-D215 PolarHBondContact NH2-OD2 3.35Å; R213-L216 HydrophobicContact CB-CD2 4.05Å; R213-L216 HydrophobicContact CB-CG 4.25Å; R213-R250 PolarHBondContact O-NH2 2.94Å; R213-R308 PolarHBondContact O-NH1 2.85Å
214	S	90.6	Very high	93.9	Very high	58 Å²	58	37.4 Å²	37.4	41%	0.406	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.1	176	-66.5	0	0	0	0	114.8	R250	S214-R250 PolarHBondContact OG-NH2 3.01Å
215	D	92.9	Very high	94	Very high	39 Å²	39	35.1 Å²	35.1	21%	0.209	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	8.2	-176.8	72.7	-36.7	0	0	0	114	W188 R213 V217 N309	W188-D215 PolarHBondContact NE1-OD2 2.91Å; R213-D215 WeakPolarHBondContact CB-OD1 3.33Å; R213-D215 IonicContact CZ-OD1 2.91Å; R213-D215 IonicContact CZ-OD2 2.8Å; R213-D215 IonicContact NE-OD1 3.44Å; R213-D215 PolarHBondContact NE-OD1 3.2Å; R213-D215 IonicContact NE-OD2 3.99Å; R213-D215 VanDerWaalsContact NH2-CG 3.28Å; R213-D215 IonicContact NH2-OD1 2.7Å; R213-D215 PolarHBondContact NH2-OD1 3.09Å; R213-D215 VanDerWaalsContact NH2-OD1 3.13Å; R213-D215 IonicContact NH2-OD2 3.17Å; R213-D215 PolarHBondContact NH2-OD2 3.35Å; D215-V217 PolarHBondContact O-N 3.46Å; D215-N309 WeakPolarHBondContact CA-ND2 3.41Å; D215-N309 PolarHBondContact O-ND2 3.46Å
216	L	95.4	Very high	94.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.			trans	-58.3	135.4	175.3	-55.9	-176.6	0	0	0	110.8	A187 L190 L210 R213 L218 L224 N309	A187-L216 HydrophobicContact CB-CD2 3.72Å; A187-L216 CarbonylContact O-C 3.58Å; A187-L216 WeakPolarHBondContact O-CA 3.49Å; L190-L216 HydrophobicContact CD2-CB 4.23Å; L190-L216 HydrophobicContact CD2-CD1 3.84Å; L190-L216 HydrophobicContact CD2-CD2 4.31Å; L190-L216 HydrophobicContact CD2-CG 4.36Å; L210-L216 HydrophobicContact CD2-CD2 4.27Å; L210-L216 WeakPolarHBondContact O-CD1 3.33Å; R213-L216 HydrophobicContact CB-CD2 4.05Å; R213-L216 HydrophobicContact CB-CG 4.25Å; L216-L218 HydrophobicContact CB-CD2 3.83Å; L216-L218 WeakPolarHBondContact O-CD2 3.44Å; L216-L224 HydrophobicContact CD1-CD2 4.21Å; L216-N309 VanDerWaalsContact O-CB 3.31Å; L216-N309 WeakPolarHBondContact O-CB 3.24Å; L216-N309 PolarHBondContact O-N 3.33Å
217	V	96.1	Very high	94.1	Very high	3 Å²	3	32 Å²	32	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.2	177.5	179.7	0	0	0	0	109.7	A187 W188 L190 S191 D215 N309 L311 L406 V417	A187-V217 PolarHBondContact O-N 2.97Å; W188-V217 HydrophobicContact CB-CG2 4.46Å; W188-V217 VanDerWaalsContact O-CB 3.26Å; W188-V217 WeakPolarHBondContact O-CB 3.33Å; L190-V217 WeakPolarHBondContact CB-O 3.19Å; S191-V217 PolarHBondContact N-O 3.3Å; D215-V217 PolarHBondContact O-N 3.46Å; V217-N309 WeakPolarHBondContact CA-O 3.18Å; V217-N309 HydrophobicContact CB-CB 4.43Å; V217-N309 HydrophobicContact CG2-CB 3.84Å; V217-L311 HydrophobicContact CG1-CD1 3.9Å; V217-L311 HydrophobicContact CG1-CD2 3.75Å; V217-L311 HydrophobicContact CG1-CG 3.87Å; V217-L406 HydrophobicContact CG1-CD1 3.68Å; V217-L406 HydrophobicContact CG2-CD1 4.16Å; V217-L406 HydrophobicContact CG2-CD2 3.99Å; V217-V417 HydrophobicContact CG1-CG2 4.18Å
218	L	95.2	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	170.1	-174.5	64.4	161.5	0	0	0	111.3	L216 S220 L224 R308 N309 Y310 L311	L216-L218 HydrophobicContact CB-CD2 3.83Å; L216-L218 WeakPolarHBondContact O-CD2 3.44Å; L218-S220 WeakPolarHBondContact CD1-O 2.91Å; L218-L224 HydrophobicContact CD1-CB 3.56Å; L218-L224 HydrophobicContact CD1-CD2 4.24Å; L218-L224 HydrophobicContact CD1-CG 4.4Å; L218-R308 HydrophobicContact CD2-CB 4.12Å; L218-N309 PolarHBondContact N-O 3.48Å; L218-Y310 HydrophobicContact CD1-CE1 4.37Å; L218-Y310 HydrophobicContact CD2-CD1 4.09Å; L218-Y310 HydrophobicContact CD2-CE1 4.08Å; L218-Y310 HydrophobicContact CG-CD1 4.03Å; L218-Y310 HydrophobicContact CG-CE1 4.19Å; L218-Y310 CarbonylContact O-C 3.59Å; L218-Y310 VanDerWaalsContact O-CA 3.24Å; L218-Y310 WeakPolarHBondContact O-CA 3.35Å; L218-L311 PolarHBondContact O-N 2.74Å
219	Q	93.9	Very high	94.1	Very high	82 Å²	82	31.9 Å²	31.9	38%	0.383	17%	0.174	S	C	.	.	S	Bend	trans	-69	-46.7	179.5	-63	-60.8	-35.7	0	0	112.2	E223 S312	Q219-E223 WeakPolarHBondContact CA-OE2 3.46Å; Q219-E223 WeakPolarHBondContact CB-OE2 3.14Å; Q219-E223 WeakPolarHBondContact CG-OE2 3.45Å; Q219-E223 PolarHBondContact N-OE2 3.34Å; Q219-S312 VanDerWaalsContact O-CB 3.27Å; Q219-S312 WeakPolarHBondContact O-CB 3.49Å; Q219-S312 PolarHBondContact O-N 3.07Å
220	S	94.1	Very high	94	Very high	40 Å²	40	31.9 Å²	31.9	28%	0.28	18%	0.178	S	C	.	.			trans	-163.2	159.6	-178.7	62.6	0	0	0	0	111.3	L218 M222 E223 L224	L218-S220 WeakPolarHBondContact CD1-O 2.91Å; S220-M222 PolarHBondContact O-N 3.37Å; S220-M222 VanDerWaalsContact O-N 3.16Å; S220-E223 WeakPolarHBondContact O-CB 3.39Å; S220-E223 PolarHBondContact O-N 3.03Å; S220-E223 PolarHBondContact OG-N 2.91Å; S220-L224 PolarHBondContact O-N 3.48Å
221	E	94.9	Very high	94	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-25.9	174.3	-159.8	73.6	-175.9	0	0	112.4	L224 F225 M249 R250 M253 M254 R308 Y310	E221-L224 WeakPolarHBondContact O-CB 3.26Å; E221-L224 PolarHBondContact O-N 3.16Å; E221-F225 PolarHBondContact O-N 3.48Å; E221-M249 HydrophobicContact CG-CE 3.96Å; E221-R250 HydrophobicContact CG-CB 4.08Å; E221-R250 WeakPolarHBondContact OE1-CB 3.4Å; E221-R250 PolarHBondContact OE1-N 3.04Å; E221-M253 HydrophobicContact CB-CB 4.06Å; E221-M253 HydrophobicContact CG-CB 4.41Å; E221-M254 HydrophobicContact CB-CG 4Å; E221-M254 HydrophobicContact CG-CG 4.39Å; E221-R308 IonicContact OE1-CZ 3.85Å; E221-R308 IonicContact OE1-NE 3.84Å; E221-R308 PolarHBondContact OE1-NE 3.4Å; E221-R308 IonicContact OE1-NH2 3.58Å; E221-R308 PolarHBondContact OE1-NH2 3.09Å; E221-R308 IonicContact OE2-NE 3.72Å; E221-R308 PolarHBondContact OE2-NE 2.73Å; E221-R308 VanDerWaalsContact OE2-NE 3.12Å; E221-Y310 HydrophobicContact CB-CE1 4.07Å; E221-Y310 WeakPolarHBondContact OE2-CE1 3.41Å; E221-Y310 PolarHBondContact OE2-OH 3.08Å
222	M	93.1	Very high	94	Very high	51 Å²	51	32.5 Å²	32.5	25%	0.251	18%	0.181	S	C	.	.	H	α-helix	trans	-64.3	-38.7	174.4	-174.4	69.6	-170.7	0	0	112.4	S220 L224 F225 A226 M254 E258 L262	S220-M222 PolarHBondContact O-N 3.37Å; S220-M222 VanDerWaalsContact O-N 3.16Å; M222-L224 VanDerWaalsContact C-N 3.31Å; M222-L224 PolarHBondContact O-N 3.01Å; M222-F225 PolarHBondContact O-N 3.23Å; M222-A226 PolarHBondContact O-N 3.01Å; M222-M254 HydrophobicContact CB-CG 4.49Å; M222-M254 HydrophobicContact CB-SD 4.37Å; M222-M254 HydrophobicContact SD-SD 4Å; M222-E258 HydrophobicContact SD-CB 4.24Å; M222-L262 HydrophobicContact CE-CD1 4.17Å; M222-L262 HydrophobicContact CE-CD2 3.42Å; M222-L262 VanDerWaalsContact CE-CD2 3.42Å; M222-L262 HydrophobicContact CE-CG 3.79Å; M222-L262 HydrophobicContact SD-CD1 3.71Å; M222-L262 HydrophobicContact SD-CD2 4.1Å; M222-L262 HydrophobicContact SD-CG 4Å
223	E	94.4	Very high	94	Very high	42 Å²	42	30.6 Å²	30.6	20%	0.196	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-42.8	174.8	-174.8	-169.5	-159.9	0	0	110.4	S191 L194 Q219 S220 A226 A227	S191-E223 PolarHBondContact OG-OE1 3.02Å; L194-E223 HydrophobicContact CD1-CG 3.87Å; Q219-E223 WeakPolarHBondContact CA-OE2 3.46Å; Q219-E223 WeakPolarHBondContact CB-OE2 3.14Å; Q219-E223 WeakPolarHBondContact CG-OE2 3.45Å; Q219-E223 PolarHBondContact N-OE2 3.34Å; S220-E223 WeakPolarHBondContact O-CB 3.39Å; S220-E223 PolarHBondContact O-N 3.03Å; S220-E223 PolarHBondContact OG-N 2.91Å; E223-A226 PolarHBondContact O-N 3.49Å; E223-A227 WeakPolarHBondContact O-CB 3.23Å; E223-A227 PolarHBondContact O-N 3.44Å
224	L	95.3	Very high	93.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-39.7	176.8	-175.1	60.6	0	0	0	112.2	L190 W199 L211 L216 L218 S220 E221 M222 A227 L228 M249	L190-L224 HydrophobicContact CD2-CD1 3.98Å; W199-L224 HydrophobicContact CH2-CD1 4.14Å; W199-L224 HydrophobicContact CZ2-CD1 4.25Å; L211-L224 HydrophobicContact CD2-CD1 3.91Å; L211-L224 HydrophobicContact CD2-CD2 3.85Å; L211-L224 HydrophobicContact CD2-CG 3.97Å; L216-L224 HydrophobicContact CD1-CD2 4.21Å; L218-L224 HydrophobicContact CD1-CB 3.56Å; L218-L224 HydrophobicContact CD1-CD2 4.24Å; L218-L224 HydrophobicContact CD1-CG 4.4Å; S220-L224 PolarHBondContact O-N 3.48Å; E221-L224 WeakPolarHBondContact O-CB 3.26Å; E221-L224 PolarHBondContact O-N 3.16Å; M222-L224 VanDerWaalsContact C-N 3.31Å; M222-L224 PolarHBondContact O-N 3.01Å; L224-A227 PolarHBondContact O-N 3.28Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 PolarHBondContact O-N 3.45Å; L224-M249 HydrophobicContact CB-CE 3.94Å; L224-M249 HydrophobicContact CD2-CE 4.04Å; L224-M249 HydrophobicContact CD2-SD 4.04Å; L224-M249 HydrophobicContact CG-CE 3.81Å; L224-M249 HydrophobicContact CG-SD 3.9Å
225	F	95	Very high	94	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-48.5	176.3	-176.9	-88.8	0	0	0	111.2	E221 M222 A227 L228 E229 L246 M249 Y251 M254 L262 L269	E221-F225 PolarHBondContact O-N 3.48Å; M222-F225 PolarHBondContact O-N 3.23Å; F225-A227 VanDerWaalsContact C-N 3.3Å; F225-A227 PolarHBondContact O-N 2.94Å; F225-L228 PolarHBondContact O-N 3.3Å; F225-L228 VanDerWaalsContact O-N 3.17Å; F225-E229 HydrophobicContact CE1-CB 4.42Å; F225-E229 PolarHBondContact O-N 3.06Å; F225-L246 HydrophobicContact CE2-CD2 4.08Å; F225-M249 HydrophobicContact CB-CE 3.75Å; F225-M249 HydrophobicContact CD2-CE 4.39Å; F225-M249 HydrophobicContact CD2-CG 4.41Å; F225-Y251 HydrophobicContact CD2-CE1 4.24Å; F225-Y251 HydrophobicContact CE2-CE1 4.07Å; F225-M254 HydrophobicContact CB-SD 4.21Å; F225-M254 HydrophobicContact CD2-CE 4.48Å; F225-L262 HydrophobicContact CD1-CD1 3.84Å; F225-L262 HydrophobicContact CD1-CD2 3.59Å; F225-L262 HydrophobicContact CD1-CG 4.35Å; F225-L262 HydrophobicContact CE1-CD1 4.06Å; F225-L262 HydrophobicContact CE1-CD2 3.51Å; F225-L262 HydrophobicContact CE1-CG 4.31Å; F225-L262 HydrophobicContact CG-CD1 4.14Å; F225-L262 HydrophobicContact CZ-CD2 4.48Å; F225-L269 HydrophobicContact CE2-CD1 3.86Å; F225-L269 HydrophobicContact CZ-CB 4.37Å; F225-L269 HydrophobicContact CZ-CD1 3.84Å
226	A	93.6	Very high	93.8	Very high	49 Å²	49	40.1 Å²	40.1	41%	0.405	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-40.5	179.5	0	0	0	0	0	111.8	M222 E223 E229 A230	M222-A226 PolarHBondContact O-N 3.01Å; E223-A226 PolarHBondContact O-N 3.49Å; A226-E229 PolarHBondContact O-N 2.87Å; A226-A230 PolarHBondContact O-N 3.37Å
227	A	93.9	Very high	93.6	Very high	15 Å²	15	41.4 Å²	41.4	12%	0.124	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-39.8	174.7	0	0	0	0	0	112.8	L194 W199 E223 L224 F225 A230 W231	L194-A227 HydrophobicContact CD1-CB 3.9Å; L194-A227 HydrophobicContact CD2-CB 3.49Å; L194-A227 VanDerWaalsContact CD2-CB 3.49Å; L194-A227 HydrophobicContact CG-CB 4.2Å; W199-A227 VanDerWaalsContact NE1-C 3.33Å; W199-A227 PolarHBondContact NE1-O 2.94Å; E223-A227 WeakPolarHBondContact O-CB 3.23Å; E223-A227 PolarHBondContact O-N 3.44Å; L224-A227 PolarHBondContact O-N 3.28Å; F225-A227 VanDerWaalsContact C-N 3.3Å; F225-A227 PolarHBondContact O-N 2.94Å; A227-A230 PolarHBondContact O-N 3.49Å; A227-W231 PolarHBondContact O-N 2.96Å
228	L	94.7	Very high	93.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-43.7	175.4	175.6	61	0	0	0	111.3	L207 L211 L224 F225 A230 W231 I232 T245 L246 M249	L207-L228 HydrophobicContact CD1-CD1 4.35Å; L207-L228 HydrophobicContact CD2-CD1 3.83Å; L211-L228 HydrophobicContact CD1-CD1 4.28Å; L211-L228 HydrophobicContact CD1-CD2 4.31Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 PolarHBondContact O-N 3.45Å; F225-L228 PolarHBondContact O-N 3.3Å; F225-L228 VanDerWaalsContact O-N 3.17Å; L228-A230 PolarHBondContact O-N 2.82Å; L228-W231 WeakPolarHBondContact O-CB 3.43Å; L228-W231 PolarHBondContact O-N 2.83Å; L228-I232 HydrophobicContact CD1-CD1 4.01Å; L228-I232 HydrophobicContact CD1-CG1 4.13Å; L228-I232 HydrophobicContact CG-CD1 3.94Å; L228-I232 HydrophobicContact CG-CG1 4.46Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 2.85Å; L228-T245 HydrophobicContact CD1-CG2 4.45Å; L228-L246 HydrophobicContact CD2-CD2 4.14Å; L228-M249 HydrophobicContact CD2-CG 3.65Å; L228-M249 HydrophobicContact CD2-SD 3.79Å
229	E	93.4	Very high	93.1	Very high	37 Å²	37	48.8 Å²	48.8	17%	0.173	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-47.4	175.9	176.2	169.8	-129.4	0	0	111.2	F225 A226 W231 I232 I233 S266 V268	F225-E229 HydrophobicContact CE1-CB 4.42Å; F225-E229 PolarHBondContact O-N 3.06Å; A226-E229 PolarHBondContact O-N 2.87Å; E229-W231 VanDerWaalsContact C-N 3.3Å; E229-W231 PolarHBondContact O-N 2.81Å; E229-I232 PolarHBondContact O-N 3.16Å; E229-I233 HydrophobicContact CG-CD1 3.74Å; E229-I233 HydrophobicContact CG-CG1 4.48Å; E229-I233 VanDerWaalsContact O-CG1 3.28Å; E229-I233 WeakPolarHBondContact O-CG1 3.49Å; E229-I233 PolarHBondContact O-N 3.09Å; E229-S266 VanDerWaalsContact OE1-CA 3.27Å; E229-S266 WeakPolarHBondContact OE1-CA 3.28Å; E229-S266 WeakPolarHBondContact OE1-CB 3.49Å; E229-S266 PolarHBondContact OE1-OG 3.35Å; E229-V268 HydrophobicContact CG-CB 4.23Å; E229-V268 HydrophobicContact CG-CG2 3.86Å
230	A	93.1	Very high	92.9	Very high	48 Å²	48	50.5 Å²	50.5	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-41.4	175.6	0	0	0	0	0	112.3	A226 A227 L228 I233 Q234	A226-A230 PolarHBondContact O-N 3.37Å; A227-A230 PolarHBondContact O-N 3.49Å; L228-A230 PolarHBondContact O-N 2.82Å; A230-I233 PolarHBondContact O-N 3.41Å; A230-Q234 WeakPolarHBondContact O-CB 3.32Å; A230-Q234 PolarHBondContact O-N 2.8Å; A230-Q234 VanDerWaalsContact O-N 3.09Å
231	W	94.5	Very high	92.8	Very high	6 Å²	6	50 Å²	50	2%	0.023	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-43.3	177	-175.6	96.8	0	0	0	112.4	W199 I202 L207 A227 L228 E229 Q234 N235 P237	W199-W231 VanDerWaalsContact O-CD1 3.29Å; I202-W231 PolarHBondContact O-NE1 2.76Å; L207-W231 HydrophobicContact CD2-CD2 3.51Å; L207-W231 HydrophobicContact CD2-CE3 3.36Å; L207-W231 HydrophobicContact CD2-CG 4.23Å; L207-W231 HydrophobicContact CD2-CH2 3.77Å; L207-W231 HydrophobicContact CD2-CZ2 3.9Å; L207-W231 HydrophobicContact CD2-CZ3 3.47Å; L207-W231 VanDerWaalsContact CD2-CZ3 3.47Å; A227-W231 PolarHBondContact O-N 2.96Å; L228-W231 WeakPolarHBondContact O-CB 3.43Å; L228-W231 PolarHBondContact O-N 2.83Å; E229-W231 VanDerWaalsContact C-N 3.3Å; E229-W231 PolarHBondContact O-N 2.81Å; W231-Q234 PolarHBondContact O-N 2.96Å; W231-N235 HydrophobicContact CD2-CB 4.44Å; W231-N235 VanDerWaalsContact CE2-ND2 3.34Å; W231-N235 HydrophobicContact CZ2-CB 4.3Å; W231-N235 PolarHBondContact NE1-ND2 3.36Å; W231-N235 WeakPolarHBondContact O-CB 3.49Å; W231-N235 PolarHBondContact O-N 3.19Å; W231-N235 PolarHBondContact O-ND2 3.03Å; W231-P237 HydrophobicContact CE3-CG 4.49Å; W231-P237 HydrophobicContact CH2-CB 4.04Å; W231-P237 HydrophobicContact CH2-CG 4.28Å; W231-P237 HydrophobicContact CZ3-CB 3.96Å; W231-P237 HydrophobicContact CZ3-CG 3.69Å
232	I	93.9	Very high	92.6	Very high	11 Å²	11	50 Å²	50	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-42.7	178.3	-68.8	170.6	0	0	0	110.8	L228 E229 Q234 E236 P237 L246 V268	L228-I232 HydrophobicContact CD1-CD1 4.01Å; L228-I232 HydrophobicContact CD1-CG1 4.13Å; L228-I232 HydrophobicContact CG-CD1 3.94Å; L228-I232 HydrophobicContact CG-CG1 4.46Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 2.85Å; E229-I232 PolarHBondContact O-N 3.16Å; I232-Q234 VanDerWaalsContact C-N 3.31Å; I232-Q234 PolarHBondContact O-N 3.44Å; I232-E236 WeakPolarHBondContact O-CA 3.39Å; I232-E236 PolarHBondContact O-N 3.27Å; I232-P237 HydrophobicContact CG1-CG 4.49Å; I232-P237 HydrophobicContact CG2-CG 4.42Å; I232-P237 WeakPolarHBondContact O-CD 3.38Å; I232-L246 HydrophobicContact CD1-CD1 4.43Å; I232-L246 HydrophobicContact CD1-CD2 4.04Å; I232-L246 HydrophobicContact CD1-CG 3.99Å; I232-V268 HydrophobicContact CB-CG1 4.46Å; I232-V268 HydrophobicContact CB-CG2 4.5Å; I232-V268 HydrophobicContact CD1-CG1 3.91Å; I232-V268 HydrophobicContact CG2-CG1 4Å; I232-V268 HydrophobicContact CG2-CG2 4.13Å
233	I	92.5	Very high	92.6	Very high	94 Å²	94	50.7 Å²	50.7	48%	0.482	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-39.1	179.5	-69.2	167.5	0	0	0	111.1	E229 A230 V268	E229-I233 HydrophobicContact CG-CD1 3.74Å; E229-I233 HydrophobicContact CG-CG1 4.48Å; E229-I233 VanDerWaalsContact O-CG1 3.28Å; E229-I233 WeakPolarHBondContact O-CG1 3.49Å; E229-I233 PolarHBondContact O-N 3.09Å; A230-I233 PolarHBondContact O-N 3.41Å; I233-V268 HydrophobicContact CD1-CG2 4.16Å; I233-V268 HydrophobicContact CG1-CG2 3.75Å
234	Q	92.3	Very high	92.5	Very high	131 Å²	131	52.1 Å²	52.1	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-84.4	-36.4	-174.4	-171.9	161.6	4.8	0	0	113.8	V200 A230 W231 I232	V200-Q234 HydrophobicContact CG1-CB 4.28Å; V200-Q234 HydrophobicContact CG1-CG 3.8Å; A230-Q234 WeakPolarHBondContact O-CB 3.32Å; A230-Q234 PolarHBondContact O-N 2.8Å; A230-Q234 VanDerWaalsContact O-N 3.09Å; W231-Q234 PolarHBondContact O-N 2.96Å; I232-Q234 VanDerWaalsContact C-N 3.31Å; I232-Q234 PolarHBondContact O-N 3.44Å
235	N	90.9	Very high	92.4	Very high	72 Å²	72	52.1 Å²	52.1	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-94.9	-11	-176.6	-69.1	-60.2	0	0	0	113.8	V200 W231	V200-N235 PolarHBondContact O-ND2 3.09Å; W231-N235 HydrophobicContact CD2-CB 4.44Å; W231-N235 VanDerWaalsContact CE2-ND2 3.34Å; W231-N235 HydrophobicContact CZ2-CB 4.3Å; W231-N235 PolarHBondContact NE1-ND2 3.36Å; W231-N235 WeakPolarHBondContact O-CB 3.49Å; W231-N235 PolarHBondContact O-N 3.19Å; W231-N235 PolarHBondContact O-ND2 3.03Å
236	E	90.3	Very high	92.4	Very high	161 Å²	161	52.2 Å²	52.2	75%	0.752	29%	0.29	S	S	*	.			trans	39.2	57.9	-179.1	-62.3	-168.8	132	0	0	113.3	I232	I232-E236 WeakPolarHBondContact O-CA 3.39Å; I232-E236 PolarHBondContact O-N 3.27Å
237	P	90.6	Very high	92.3	Very high	26 Å²	26	54.9 Å²	54.9	17%	0.169	29%	0.29	C	S	.	.			trans	-66.6	165.4	-174.6	33	-40.6	0	0	0	112	W231 I232 T241 A242	W231-P237 HydrophobicContact CE3-CG 4.49Å; W231-P237 HydrophobicContact CH2-CB 4.04Å; W231-P237 HydrophobicContact CH2-CG 4.28Å; W231-P237 HydrophobicContact CZ3-CB 3.96Å; W231-P237 HydrophobicContact CZ3-CG 3.69Å; I232-P237 HydrophobicContact CG1-CG 4.49Å; I232-P237 HydrophobicContact CG2-CG 4.42Å; I232-P237 WeakPolarHBondContact O-CD 3.38Å; P237-T241 HydrophobicContact CB-CG2 4.12Å; P237-A242 HydrophobicContact CG-CB 4.17Å
238	D	90.9	Very high	92.3	Very high	126 Å²	126	55.2 Å²	55.2	67%	0.674	29%	0.293	S	S	*	.			trans	-50.4	143.6	171.5	-60.9	-40.6	0	0	0	111.5	L240 T241 A242	D238-L240 PolarHBondContact O-N 3.28Å; D238-L240 VanDerWaalsContact O-N 3.14Å; D238-T241 WeakPolarHBondContact O-CA 3.29Å; D238-T241 WeakPolarHBondContact O-CB 3.48Å; D238-T241 PolarHBondContact O-N 3.19Å; D238-A242 PolarHBondContact O-N 3.31Å
239	G	88.9	Confident	92.3	Very high	33 Å²	33	55.3 Å²	55.3	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-52.2	-41.7	-177.5	0	0	0	0	0	113.3	T241 A242 E243	G239-T241 PolarHBondContact O-N 2.68Å; G239-A242 PolarHBondContact O-N 3.45Å; G239-E243 WeakPolarHBondContact O-CG 3.49Å; G239-E243 PolarHBondContact O-N 3.39Å
240	L	90.1	Very high	92.3	Very high	117 Å²	117	53.7 Å²	53.7	61%	0.613	29%	0.285	S	S	*	.	H	α-helix	trans	-63.9	-39.7	176.9	-177.9	63.4	0	0	0	112.8	D238 E243 N244	D238-L240 PolarHBondContact O-N 3.28Å; D238-L240 VanDerWaalsContact O-N 3.14Å; L240-E243 PolarHBondContact O-N 3.4Å; L240-N244 WeakPolarHBondContact O-CB 3.26Å; L240-N244 PolarHBondContact O-N 3.31Å; L240-N244 PolarHBondContact O-ND2 2.84Å
241	T	91.8	Very high	92.3	Very high	31 Å²	31	51.4 Å²	51.4	19%	0.19	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-42.1	178	-59.8	0	0	0	0	110.6	P237 D238 G239 E243 N244 T245	P237-T241 HydrophobicContact CB-CG2 4.12Å; D238-T241 WeakPolarHBondContact O-CA 3.29Å; D238-T241 WeakPolarHBondContact O-CB 3.48Å; D238-T241 PolarHBondContact O-N 3.19Å; G239-T241 PolarHBondContact O-N 2.68Å; T241-E243 PolarHBondContact O-N 2.98Å; T241-N244 PolarHBondContact O-N 3.16Å; T241-T245 HydrophobicContact CG2-CG2 4.44Å; T241-T245 WeakPolarHBondContact O-CB 3.36Å; T241-T245 VanDerWaalsContact O-CG2 3.26Å; T241-T245 WeakPolarHBondContact O-CG2 3.49Å; T241-T245 PolarHBondContact O-N 3.17Å; T241-T245 PolarHBondContact O-OG1 2.81Å
242	A	92	Very high	92.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-45.1	173.5	0	0	0	0	0	111.6	P237 D238 G239 T245 L246 Y272	P237-A242 HydrophobicContact CG-CB 4.17Å; D238-A242 PolarHBondContact O-N 3.31Å; G239-A242 PolarHBondContact O-N 3.45Å; A242-T245 WeakPolarHBondContact CA-OG1 3.34Å; A242-T245 PolarHBondContact O-N 3.05Å; A242-T245 PolarHBondContact O-OG1 2.8Å; A242-L246 WeakPolarHBondContact O-CB 3.29Å; A242-L246 VanDerWaalsContact O-CG 3.24Å; A242-L246 WeakPolarHBondContact O-CG 3.4Å; A242-L246 PolarHBondContact O-N 2.82Å; A242-Y272 HydrophobicContact CB-CE1 4.05Å; A242-Y272 HydrophobicContact CB-CE2 3.87Å
243	E	92.5	Very high	92.1	Very high	66 Å²	66	51.4 Å²	51.4	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-64	-45.1	177.6	-72.4	179.8	-140.9	0	0	112.4	G239 L240 T241 T245 L246 R247 Y272 S275	G239-E243 WeakPolarHBondContact O-CG 3.49Å; G239-E243 PolarHBondContact O-N 3.39Å; L240-E243 PolarHBondContact O-N 3.4Å; T241-E243 PolarHBondContact O-N 2.98Å; E243-T245 PolarHBondContact O-N 2.64Å; E243-L246 PolarHBondContact O-N 3.24Å; E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 VanDerWaalsContact O-CG 3.31Å; E243-R247 WeakPolarHBondContact O-CG 3.5Å; E243-R247 PolarHBondContact O-N 2.96Å; E243-Y272 HydrophobicContact CG-CD1 3.48Å; E243-Y272 VanDerWaalsContact CG-CD1 3.48Å; E243-Y272 HydrophobicContact CG-CE1 3.88Å; E243-Y272 HydrophobicContact CG-CG 4.42Å; E243-S275 PolarHBondContact OE2-OG 2.84Å
244	N	93.1	Very high	92.1	Very high	72 Å²	72	47 Å²	47	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-40.4	179.5	-73.8	-25.5	0	0	0	112.5	M208 L240 T241 R247 A248	M208-N244 HydrophobicContact CE-CB 4.07Å; M208-N244 HydrophobicContact SD-CB 4.21Å; L240-N244 WeakPolarHBondContact O-CB 3.26Å; L240-N244 PolarHBondContact O-N 3.31Å; L240-N244 PolarHBondContact O-ND2 2.84Å; T241-N244 PolarHBondContact O-N 3.16Å; N244-R247 PolarHBondContact O-N 3.47Å; N244-A248 PolarHBondContact O-N 2.9Å; N244-A248 VanDerWaalsContact O-N 3.15Å
245	T	93.3	Very high	92	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-43.8	176.6	52.1	0	0	0	0	111.3	L207 M208 L211 L228 T241 A242 E243 A248	L207-T245 HydrophobicContact CD2-CG2 3.72Å; L207-T245 HydrophobicContact CG-CG2 4.17Å; M208-T245 HydrophobicContact CG-CG2 4.04Å; M208-T245 HydrophobicContact SD-CG2 3.32Å; M208-T245 WeakPolarHBondContact SD-CG2 3.46Å; L211-T245 HydrophobicContact CD1-CG2 4.19Å; L228-T245 HydrophobicContact CD1-CG2 4.45Å; T241-T245 HydrophobicContact CG2-CG2 4.44Å; T241-T245 WeakPolarHBondContact O-CB 3.36Å; T241-T245 VanDerWaalsContact O-CG2 3.26Å; T241-T245 WeakPolarHBondContact O-CG2 3.49Å; T241-T245 PolarHBondContact O-N 3.17Å; T241-T245 PolarHBondContact O-OG1 2.81Å; A242-T245 WeakPolarHBondContact CA-OG1 3.34Å; A242-T245 PolarHBondContact O-N 3.05Å; A242-T245 PolarHBondContact O-OG1 2.8Å; E243-T245 PolarHBondContact O-N 2.64Å; T245-A248 WeakPolarHBondContact O-CB 3.47Å; T245-A248 PolarHBondContact O-N 2.8Å
246	L	93.3	Very high	92.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-41.9	175.4	-70.9	169.4	0	0	0	112	F225 L228 I232 A242 E243 A248 M249 Y251 V268 Y272 V276	F225-L246 HydrophobicContact CE2-CD2 4.08Å; L228-L246 HydrophobicContact CD2-CD2 4.14Å; I232-L246 HydrophobicContact CD1-CD1 4.43Å; I232-L246 HydrophobicContact CD1-CD2 4.04Å; I232-L246 HydrophobicContact CD1-CG 3.99Å; A242-L246 WeakPolarHBondContact O-CB 3.29Å; A242-L246 VanDerWaalsContact O-CG 3.24Å; A242-L246 WeakPolarHBondContact O-CG 3.4Å; A242-L246 PolarHBondContact O-N 2.82Å; E243-L246 PolarHBondContact O-N 3.24Å; L246-A248 PolarHBondContact O-N 2.59Å; L246-M249 WeakPolarHBondContact O-CB 3.39Å; L246-M249 PolarHBondContact O-N 3.33Å; L246-M249 VanDerWaalsContact O-N 3.17Å; L246-Y251 WeakPolarHBondContact O-CE2 3.41Å; L246-Y251 PolarHBondContact O-OH 3.42Å; L246-V268 HydrophobicContact CD1-CG1 3.95Å; L246-V268 HydrophobicContact CD2-CG1 4.18Å; L246-Y272 HydrophobicContact CD1-CD2 3.74Å; L246-Y272 HydrophobicContact CD1-CG 3.82Å; L246-V276 HydrophobicContact CB-CG1 3.91Å
247	R	93	Very high	92.1	Very high	105 Å²	105	41.3 Å²	41.3	40%	0.396	21%	0.214	S	C	.	.	H	α-helix	trans	-66	-21.3	177	-72.5	-175.8	74.9	90.6	3.9	113.7	E243 N244 M249 S275 V276 D278 L279	E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 VanDerWaalsContact O-CG 3.31Å; E243-R247 WeakPolarHBondContact O-CG 3.5Å; E243-R247 PolarHBondContact O-N 2.96Å; N244-R247 PolarHBondContact O-N 3.47Å; R247-M249 VanDerWaalsContact C-N 3.27Å; R247-M249 PolarHBondContact O-N 2.93Å; R247-S275 PolarHBondContact NH1-O 2.76Å; R247-V276 HydrophobicContact CG-CG1 4.34Å; R247-D278 IonicContact CZ-OD1 3.87Å; R247-D278 IonicContact CZ-OD2 3.72Å; R247-D278 IonicContact NH1-OD1 2.77Å; R247-D278 PolarHBondContact NH1-OD1 2.76Å; R247-D278 VanDerWaalsContact NH1-OD1 3.17Å; R247-D278 IonicContact NH1-OD2 2.77Å; R247-D278 PolarHBondContact NH1-OD2 2.75Å; R247-D278 VanDerWaalsContact NH1-OD2 3.12Å; R247-D278 IonicContact NH2-OD2 2.64Å; R247-D278 PolarHBondContact NH2-OD2 2.78Å; R247-L279 HydrophobicContact CB-CD1 4.03Å; R247-L279 HydrophobicContact CG-CD1 4.02Å
248	A	93.5	Very high	92.1	Very high	23 Å²	23	42.2 Å²	42.2	19%	0.19	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.6	176.5	0	0	0	0	0	113.6	L211 N244 T245 L246	L211-A248 HydrophobicContact CB-CB 3.84Å; L211-A248 HydrophobicContact CD1-CB 4.3Å; N244-A248 PolarHBondContact O-N 2.9Å; N244-A248 VanDerWaalsContact O-N 3.15Å; T245-A248 WeakPolarHBondContact O-CB 3.47Å; T245-A248 PolarHBondContact O-N 2.8Å; L246-A248 PolarHBondContact O-N 2.59Å
249	M	94.7	Very high	92.2	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.184	C	C	.	.	S	Bend	trans	-73.2	141.5	178.3	-66.5	-60.9	-57.4	0	0	112.3	L211 E221 L224 F225 L228 L246 R247 Y251	L211-M249 HydrophobicContact CD2-SD 3.96Å; E221-M249 HydrophobicContact CG-CE 3.96Å; L224-M249 HydrophobicContact CB-CE 3.94Å; L224-M249 HydrophobicContact CD2-CE 4.04Å; L224-M249 HydrophobicContact CD2-SD 4.04Å; L224-M249 HydrophobicContact CG-CE 3.81Å; L224-M249 HydrophobicContact CG-SD 3.9Å; F225-M249 HydrophobicContact CB-CE 3.75Å; F225-M249 HydrophobicContact CD2-CE 4.39Å; F225-M249 HydrophobicContact CD2-CG 4.41Å; L228-M249 HydrophobicContact CD2-CG 3.65Å; L228-M249 HydrophobicContact CD2-SD 3.79Å; L246-M249 WeakPolarHBondContact O-CB 3.39Å; L246-M249 PolarHBondContact O-N 3.33Å; L246-M249 VanDerWaalsContact O-N 3.17Å; R247-M249 VanDerWaalsContact C-N 3.27Å; R247-M249 PolarHBondContact O-N 2.93Å; M249-Y251 HydrophobicContact CB-CD2 4.29Å; M249-Y251 HydrophobicContact CB-CE1 4.49Å; M249-Y251 HydrophobicContact CB-CE2 3.85Å; M249-Y251 WeakPolarHBondContact O-CD2 3.43Å; M249-Y251 PolarHBondContact O-N 3.01Å; M249-Y251 VanDerWaalsContact O-N 3.16Å
250	R	93.2	Very high	92.2	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.008	20%	0.196	C	C	.	.			trans	-91	72.6	-179	-56.6	176.7	-174.7	-169.2	0.2	111.2	R213 S214 E221 A252 M253 S303 V306 R308	R213-R250 PolarHBondContact O-NH2 2.94Å; S214-R250 PolarHBondContact OG-NH2 3.01Å; E221-R250 HydrophobicContact CG-CB 4.08Å; E221-R250 WeakPolarHBondContact OE1-CB 3.4Å; E221-R250 PolarHBondContact OE1-N 3.04Å; R250-A252 PolarHBondContact O-N 3.22Å; R250-A252 VanDerWaalsContact O-N 3.08Å; R250-M253 HydrophobicContact CB-CB 4.3Å; R250-M253 HydrophobicContact CB-CG 3.8Å; R250-M253 WeakPolarHBondContact O-CB 3.42Å; R250-M253 PolarHBondContact O-N 3.04Å; R250-S303 WeakPolarHBondContact CD-O 3.45Å; R250-S303 WeakPolarHBondContact CG-O 3.36Å; R250-S303 PolarHBondContact NE-O 2.98Å; R250-V306 WeakPolarHBondContact CD-O 3.39Å; R250-V306 PolarHBondContact NH1-O 2.91Å; R250-R308 VanDerWaalsContact CZ-CG 3.49Å
251	Y	93.4	Very high	92.3	Very high	1 Å²	1	43 Å²	43	0%	0.004	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-54.4	-31.3	-176.7	-64.1	-83.4	0	0	0	114.4	F225 L246 M249 M253 M254 L259 L269 V276 L279 L280 S283	F225-Y251 HydrophobicContact CD2-CE1 4.24Å; F225-Y251 HydrophobicContact CE2-CE1 4.07Å; L246-Y251 WeakPolarHBondContact O-CE2 3.41Å; L246-Y251 PolarHBondContact O-OH 3.42Å; M249-Y251 HydrophobicContact CB-CD2 4.29Å; M249-Y251 HydrophobicContact CB-CE1 4.49Å; M249-Y251 HydrophobicContact CB-CE2 3.85Å; M249-Y251 WeakPolarHBondContact O-CD2 3.43Å; M249-Y251 PolarHBondContact O-N 3.01Å; M249-Y251 VanDerWaalsContact O-N 3.16Å; Y251-M253 PolarHBondContact O-N 3.13Å; Y251-M254 HydrophobicContact CD1-CE 3.37Å; Y251-M254 HydrophobicContact CE1-CE 3.98Å; Y251-M254 HydrophobicContact CG-CE 4.03Å; Y251-M254 PolarHBondContact O-N 2.87Å; Y251-L259 HydrophobicContact CD1-CD2 4Å; Y251-L269 HydrophobicContact CE1-CD1 4.09Å; Y251-V276 HydrophobicContact CE2-CB 4.44Å; Y251-V276 HydrophobicContact CE2-CG1 4.35Å; Y251-L279 HydrophobicContact CD2-CB 3.9Å; Y251-L279 HydrophobicContact CD2-CD1 4.18Å; Y251-L279 HydrophobicContact CE2-CB 4.31Å; Y251-L279 HydrophobicContact CE2-CD1 4Å; Y251-L280 HydrophobicContact CD1-CD2 3.77Å; Y251-L280 HydrophobicContact CE1-CD2 4.2Å; Y251-L280 HydrophobicContact CG-CD2 4.23Å; Y251-S283 WeakPolarHBondContact CB-OG 3.19Å
252	A	91.3	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-68.4	-11	176.7	0	0	0	0	0	114	R250 S283 F286 H287 L304 F305	R250-A252 PolarHBondContact O-N 3.22Å; R250-A252 VanDerWaalsContact O-N 3.08Å; A252-S283 PolarHBondContact N-OG 3.02Å; A252-S283 VanDerWaalsContact N-OG 3.1Å; A252-F286 HydrophobicContact CB-CD1 3.85Å; A252-F286 HydrophobicContact CB-CE1 4.3Å; A252-F286 HydrophobicContact CB-CG 4.34Å; A252-H287 PolarHBondContact O-CE1 3.16Å; A252-H287 PolarHBondContact O-NE2 2.7Å; A252-L304 HydrophobicContact CB-CD1 4.14Å; A252-L304 HydrophobicContact CB-CG 4.01Å; A252-F305 HydrophobicContact CB-CD1 3.87Å; A252-F305 HydrophobicContact CB-CE1 3.99Å
253	M	92.6	Very high	92	Very high	17 Å²	17	45.1 Å²	45.1	8%	0.084	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-92.7	1.1	173.4	-56.8	-63.7	105.1	0	0	112.7	E221 R250 Y251 F286 P307 Y310 W315 P339	E221-M253 HydrophobicContact CB-CB 4.06Å; E221-M253 HydrophobicContact CG-CB 4.41Å; R250-M253 HydrophobicContact CB-CB 4.3Å; R250-M253 HydrophobicContact CB-CG 3.8Å; R250-M253 WeakPolarHBondContact O-CB 3.42Å; R250-M253 PolarHBondContact O-N 3.04Å; Y251-M253 PolarHBondContact O-N 3.13Å; M253-F286 HydrophobicContact CE-CE1 4.33Å; M253-P307 HydrophobicContact SD-CB 3.83Å; M253-Y310 HydrophobicContact CB-CE2 4.13Å; M253-Y310 WeakPolarHBondContact CB-OH 3.39Å; M253-Y310 HydrophobicContact CG-CE2 4.24Å; M253-Y310 WeakPolarHBondContact CG-OH 3.42Å; M253-Y310 HydrophobicContact SD-CE2 4.46Å; M253-W315 HydrophobicContact SD-CH2 4.31Å; M253-P339 HydrophobicContact CE-CB 3.4Å; M253-P339 HydrophobicContact CE-CG 3.92Å; M253-P339 HydrophobicContact SD-CB 3.78Å; M253-P339 HydrophobicContact SD-CG 4.24Å
254	M	93	Very high	91.7	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.217	C	C	.	.	S	Bend	trans	-107.2	129.5	174.4	-67.1	-174.7	-84.8	0	0	109.9	E221 M222 F225 Y251 L259 L262 H287	E221-M254 HydrophobicContact CB-CG 4Å; E221-M254 HydrophobicContact CG-CG 4.39Å; M222-M254 HydrophobicContact CB-CG 4.49Å; M222-M254 HydrophobicContact CB-SD 4.37Å; M222-M254 HydrophobicContact SD-SD 4Å; F225-M254 HydrophobicContact CB-SD 4.21Å; F225-M254 HydrophobicContact CD2-CE 4.48Å; Y251-M254 HydrophobicContact CD1-CE 3.37Å; Y251-M254 HydrophobicContact CE1-CE 3.98Å; Y251-M254 HydrophobicContact CG-CE 4.03Å; Y251-M254 PolarHBondContact O-N 2.87Å; M254-L259 HydrophobicContact CB-CD2 3.79Å; M254-L259 HydrophobicContact CB-CG 4.03Å; M254-L259 HydrophobicContact CE-CD2 3.92Å; M254-L259 HydrophobicContact SD-CD2 4.36Å; M254-L262 HydrophobicContact CE-CD1 4.4Å; M254-L262 HydrophobicContact SD-CD1 3.86Å; M254-H287 PolarHBondContact O-NE2 3.45Å
255	P	90.4	Very high	91.6	Very high	31 Å²	31	50.2 Å²	50.2	20%	0.201	23%	0.231	C	C	.	.			trans	-66.1	150.5	-176.4	28.3	-34.7	0	0	0	111.7	R257 E258 L259	P255-R257 HydrophobicContact CB-CG 4.31Å; P255-R257 HydrophobicContact CG-CG 4.28Å; P255-R257 PolarHBondContact O-N 3.4Å; P255-E258 VanDerWaalsContact CD-OE2 3.31Å; P255-E258 WeakPolarHBondContact CD-OE2 3.19Å; P255-E258 HydrophobicContact CG-CB 4.04Å; P255-E258 HydrophobicContact CG-CG 3.97Å; P255-E258 WeakPolarHBondContact CG-OE1 3.49Å; P255-E258 WeakPolarHBondContact CG-OE2 3.35Å; P255-E258 WeakPolarHBondContact O-CB 3.47Å; P255-E258 PolarHBondContact O-N 2.94Å; P255-L259 PolarHBondContact O-N 2.95Å; P255-L259 VanDerWaalsContact O-N 3.11Å
256	P	91.7	Very high	91.5	Very high	38 Å²	38	50.5 Å²	50.5	25%	0.247	23%	0.233	C	C	.	.	H	α-helix	trans	-54.4	-34.5	-174.9	-29.7	35.2	0	0	0	115	E258 L259 F260 Y284 H287 S341	P256-E258 VanDerWaalsContact C-N 3.27Å; P256-E258 PolarHBondContact O-N 3.07Å; P256-L259 PolarHBondContact O-N 2.77Å; P256-F260 WeakPolarHBondContact O-CB 3.48Å; P256-F260 PolarHBondContact O-N 2.74Å; P256-Y284 HydrophobicContact CB-CD1 4.29Å; P256-Y284 HydrophobicContact CB-CE1 4.15Å; P256-H287 HydrophobicContact CG-CB 3.54Å; P256-S341 WeakPolarHBondContact CD-OG 3.41Å
257	R	90.4	Very high	91.3	Very high	176 Å²	176	55.1 Å²	55.1	66%	0.664	26%	0.261	S	S	*	.	H	α-helix	trans	-61.4	-34.7	176.2	68	-178.3	-179.3	-135.6	-5	112.9	P255 R261	P255-R257 HydrophobicContact CB-CG 4.31Å; P255-R257 HydrophobicContact CG-CG 4.28Å; P255-R257 PolarHBondContact O-N 3.4Å; R257-R261 WeakPolarHBondContact O-CG 3.28Å; R257-R261 PolarHBondContact O-N 3.17Å
258	E	91.3	Very high	91.2	Very high	44 Å²	44	50.6 Å²	50.6	21%	0.206	25%	0.245	C	C	.	.	H	α-helix	trans	-81.7	-42.1	179.7	-78.5	158.4	-135.1	0	0	109.6	M222 P255 P256 F260 R261 L262	M222-E258 HydrophobicContact SD-CB 4.24Å; P255-E258 VanDerWaalsContact CD-OE2 3.31Å; P255-E258 WeakPolarHBondContact CD-OE2 3.19Å; P255-E258 HydrophobicContact CG-CB 4.04Å; P255-E258 HydrophobicContact CG-CG 3.97Å; P255-E258 WeakPolarHBondContact CG-OE1 3.49Å; P255-E258 WeakPolarHBondContact CG-OE2 3.35Å; P255-E258 WeakPolarHBondContact O-CB 3.47Å; P255-E258 PolarHBondContact O-N 2.94Å; P256-E258 VanDerWaalsContact C-N 3.27Å; P256-E258 PolarHBondContact O-N 3.07Å; E258-F260 VanDerWaalsContact C-N 3.32Å; E258-F260 PolarHBondContact O-N 3.45Å; E258-R261 WeakPolarHBondContact O-CB 2.9Å; E258-R261 PolarHBondContact O-N 2.91Å; E258-R261 VanDerWaalsContact O-N 3.17Å; E258-L262 WeakPolarHBondContact O-CG 3.21Å; E258-L262 PolarHBondContact O-N 3.28Å
259	L	91.9	Very high	91	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-56.9	-43	172.6	-68	177.7	0	0	0	112.7	Y251 M254 P255 P256 L262 Q263 L280 Y284	Y251-L259 HydrophobicContact CD1-CD2 4Å; M254-L259 HydrophobicContact CB-CD2 3.79Å; M254-L259 HydrophobicContact CB-CG 4.03Å; M254-L259 HydrophobicContact CE-CD2 3.92Å; M254-L259 HydrophobicContact SD-CD2 4.36Å; P255-L259 PolarHBondContact O-N 2.95Å; P255-L259 VanDerWaalsContact O-N 3.11Å; P256-L259 PolarHBondContact O-N 2.77Å; L259-L262 WeakPolarHBondContact O-CB 3.34Å; L259-L262 PolarHBondContact O-N 3.39Å; L259-Q263 WeakPolarHBondContact O-CG 3.31Å; L259-Q263 PolarHBondContact O-N 3.44Å; L259-L280 HydrophobicContact CD2-CD2 4.19Å; L259-Y284 HydrophobicContact CB-CE1 4.13Å; L259-Y284 HydrophobicContact CD1-CE1 4.28Å
260	F	90.1	Very high	90.7	Very high	136 Å²	136	52.3 Å²	52.3	60%	0.596	26%	0.259	S	S	*	.	H	α-helix	trans	-63.6	-42.5	177.5	-170.7	-93.5	0	0	0	111.7	P256 E258 Q263 T264 Y284	P256-F260 WeakPolarHBondContact O-CB 3.48Å; P256-F260 PolarHBondContact O-N 2.74Å; E258-F260 VanDerWaalsContact C-N 3.32Å; E258-F260 PolarHBondContact O-N 3.45Å; F260-Q263 PolarHBondContact O-N 2.88Å; F260-T264 HydrophobicContact CE1-CG2 4.41Å; F260-T264 PolarHBondContact O-N 2.93Å; F260-T264 PolarHBondContact O-OG1 3.21Å; F260-Y284 PolarHBondContact N-OH 3.48Å
261	R	91.1	Very high	90.6	Very high	156 Å²	156	61.3 Å²	61.3	59%	0.589	29%	0.294	S	S	*	.	H	α-helix	trans	-61.8	-45.9	174.9	-74.2	176.1	178.4	-170.5	-0.9	111.2	R257 E258 Q263 T264 Q265	R257-R261 WeakPolarHBondContact O-CG 3.28Å; R257-R261 PolarHBondContact O-N 3.17Å; E258-R261 WeakPolarHBondContact O-CB 2.9Å; E258-R261 PolarHBondContact O-N 2.91Å; E258-R261 VanDerWaalsContact O-N 3.17Å; R261-Q263 VanDerWaalsContact C-N 3.32Å; R261-Q263 PolarHBondContact O-N 3Å; R261-T264 PolarHBondContact O-N 3.47Å; R261-T264 PolarHBondContact O-OG1 2.93Å; R261-Q265 WeakPolarHBondContact O-CB 3.41Å; R261-Q265 WeakPolarHBondContact O-CG 3.43Å; R261-Q265 PolarHBondContact O-N 3.44Å
262	L	90.7	Very high	90.4	Very high	11 Å²	11	62.3 Å²	62.3	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-56.4	-44.7	177.5	-75.5	-180	0	0	0	112	M222 F225 M254 E258 L259 T264 Q265 S266	M222-L262 HydrophobicContact CE-CD1 4.17Å; M222-L262 HydrophobicContact CE-CD2 3.42Å; M222-L262 VanDerWaalsContact CE-CD2 3.42Å; M222-L262 HydrophobicContact CE-CG 3.79Å; M222-L262 HydrophobicContact SD-CD1 3.71Å; M222-L262 HydrophobicContact SD-CD2 4.1Å; M222-L262 HydrophobicContact SD-CG 4Å; F225-L262 HydrophobicContact CD1-CD1 3.84Å; F225-L262 HydrophobicContact CD1-CD2 3.59Å; F225-L262 HydrophobicContact CD1-CG 4.35Å; F225-L262 HydrophobicContact CE1-CD1 4.06Å; F225-L262 HydrophobicContact CE1-CD2 3.51Å; F225-L262 HydrophobicContact CE1-CG 4.31Å; F225-L262 HydrophobicContact CG-CD1 4.14Å; F225-L262 HydrophobicContact CZ-CD2 4.48Å; M254-L262 HydrophobicContact CE-CD1 4.4Å; M254-L262 HydrophobicContact SD-CD1 3.86Å; E258-L262 WeakPolarHBondContact O-CG 3.21Å; E258-L262 PolarHBondContact O-N 3.28Å; L259-L262 WeakPolarHBondContact O-CB 3.34Å; L259-L262 PolarHBondContact O-N 3.39Å; L262-T264 PolarHBondContact O-N 3.46Å; L262-Q265 PolarHBondContact O-N 3.36Å; L262-S266 WeakPolarHBondContact O-CB 3.38Å; L262-S266 PolarHBondContact O-N 2.53Å
263	Q	87.6	Confident	90.2	Very high	64 Å²	64	66.9 Å²	66.9	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-29.4	178.1	-72.3	178.8	1.7	0	0	113.8	L259 F260 R261 L269 Y284	L259-Q263 WeakPolarHBondContact O-CG 3.31Å; L259-Q263 PolarHBondContact O-N 3.44Å; F260-Q263 PolarHBondContact O-N 2.88Å; R261-Q263 VanDerWaalsContact C-N 3.32Å; R261-Q263 PolarHBondContact O-N 3Å; Q263-L269 HydrophobicContact CB-CD2 4.3Å; Q263-L269 HydrophobicContact CG-CD2 3.65Å; Q263-Y284 PolarHBondContact NE2-OH 3.48Å
264	T	86.1	Confident	90.1	Very high	97 Å²	97	72.9 Å²	72.9	60%	0.595	35%	0.347	S	S	*	.	H	α-helix	trans	-90.4	-30.2	179.4	58.2	0	0	0	0	113.9	F260 R261 L262	F260-T264 HydrophobicContact CE1-CG2 4.41Å; F260-T264 PolarHBondContact O-N 2.93Å; F260-T264 PolarHBondContact O-OG1 3.21Å; R261-T264 PolarHBondContact O-N 3.47Å; R261-T264 PolarHBondContact O-OG1 2.93Å; L262-T264 PolarHBondContact O-N 3.46Å
265	Q	90.5	Very high	90	Very high	149 Å²	149	74 Å²	74	70%	0.696	35%	0.354	S	S	*	.	H	α-helix	trans	-103.9	-30.8	-169.6	-67.1	179.1	-19.9	0	0	113.3	R261 L262 T267	R261-Q265 WeakPolarHBondContact O-CB 3.41Å; R261-Q265 WeakPolarHBondContact O-CG 3.43Å; R261-Q265 PolarHBondContact O-N 3.44Å; L262-Q265 PolarHBondContact O-N 3.36Å; Q265-T267 PolarHBondContact O-N 3.39Å
266	S	91.4	Very high	90.1	Very high	5 Å²	5	72.5 Å²	72.5	4%	0.035	35%	0.345	C	S	.	.			trans	-79.9	116.9	-176.9	175.1	0	0	0	0	110.8	E229 L262 V268 L269 A270	E229-S266 VanDerWaalsContact OE1-CA 3.27Å; E229-S266 WeakPolarHBondContact OE1-CA 3.28Å; E229-S266 WeakPolarHBondContact OE1-CB 3.49Å; E229-S266 PolarHBondContact OE1-OG 3.35Å; L262-S266 WeakPolarHBondContact O-CB 3.38Å; L262-S266 PolarHBondContact O-N 2.53Å; S266-V268 VanDerWaalsContact C-N 3.33Å; S266-L269 WeakPolarHBondContact OG-CB 3.31Å; S266-L269 PolarHBondContact OG-N 2.93Å; S266-A270 WeakPolarHBondContact O-CB 3.47Å; S266-A270 PolarHBondContact O-N 3.04Å; S266-A270 VanDerWaalsContact O-N 3.13Å
267	T	89.3	Confident	90.1	Very high	98 Å²	98	76.6 Å²	76.6	60%	0.601	36%	0.355	S	S	*	.	H	α-helix	trans	-70.5	-34.2	175.7	56.3	0	0	0	0	111.2	Q265 A270 R271	Q265-T267 PolarHBondContact O-N 3.39Å; T267-A270 PolarHBondContact O-N 3.27Å; T267-R271 PolarHBondContact O-N 2.75Å
268	V	90.5	Very high	90.2	Very high	10 Å²	10	71.6 Å²	71.6	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-46.2	177.4	176.1	0	0	0	0	110.4	E229 I232 I233 L246 S266 A270 R271 Y272	E229-V268 HydrophobicContact CG-CB 4.23Å; E229-V268 HydrophobicContact CG-CG2 3.86Å; I232-V268 HydrophobicContact CB-CG1 4.46Å; I232-V268 HydrophobicContact CB-CG2 4.5Å; I232-V268 HydrophobicContact CD1-CG1 3.91Å; I232-V268 HydrophobicContact CG2-CG1 4Å; I232-V268 HydrophobicContact CG2-CG2 4.13Å; I233-V268 HydrophobicContact CD1-CG2 4.16Å; I233-V268 HydrophobicContact CG1-CG2 3.75Å; L246-V268 HydrophobicContact CD1-CG1 3.95Å; L246-V268 HydrophobicContact CD2-CG1 4.18Å; S266-V268 VanDerWaalsContact C-N 3.33Å; V268-A270 VanDerWaalsContact C-N 3.32Å; V268-A270 PolarHBondContact O-N 3.34Å; V268-R271 PolarHBondContact O-N 2.95Å; V268-Y272 HydrophobicContact CG1-CD2 4.02Å; V268-Y272 HydrophobicContact CG1-CE2 4.4Å; V268-Y272 WeakPolarHBondContact O-CD2 3.42Å; V268-Y272 PolarHBondContact O-N 2.99Å
269	L	89.4	Confident	90.3	Very high	3 Å²	3	70.7 Å²	70.7	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-36.7	178	-157.2	90.5	0	0	0	111.7	F225 Y251 Q263 S266 R271 Y272 Q273 V276 L280	F225-L269 HydrophobicContact CE2-CD1 3.86Å; F225-L269 HydrophobicContact CZ-CB 4.37Å; F225-L269 HydrophobicContact CZ-CD1 3.84Å; Y251-L269 HydrophobicContact CE1-CD1 4.09Å; Q263-L269 HydrophobicContact CB-CD2 4.3Å; Q263-L269 HydrophobicContact CG-CD2 3.65Å; S266-L269 WeakPolarHBondContact OG-CB 3.31Å; S266-L269 PolarHBondContact OG-N 2.93Å; L269-R271 VanDerWaalsContact C-N 3.33Å; L269-Y272 CarbonylContact O-C 3.57Å; L269-Y272 PolarHBondContact O-N 3.36Å; L269-Q273 WeakPolarHBondContact O-CA 3.36Å; L269-Q273 VanDerWaalsContact O-CB 3.31Å; L269-Q273 WeakPolarHBondContact O-CB 3.27Å; L269-Q273 PolarHBondContact O-N 2.94Å; L269-V276 HydrophobicContact CD1-CG2 4.01Å; L269-V276 HydrophobicContact CG-CG2 4.41Å; L269-L280 HydrophobicContact CD2-CD1 4.24Å
270	A	89.4	Confident	90.3	Very high	58 Å²	58	71 Å²	71	48%	0.479	34%	0.34	S	S	.	.	H	α-helix	trans	-63.1	-39.2	174.7	0	0	0	0	0	112	S266 T267 V268	S266-A270 WeakPolarHBondContact O-CB 3.47Å; S266-A270 PolarHBondContact O-N 3.04Å; S266-A270 VanDerWaalsContact O-N 3.13Å; T267-A270 PolarHBondContact O-N 3.27Å; V268-A270 VanDerWaalsContact C-N 3.32Å; V268-A270 PolarHBondContact O-N 3.34Å
271	R	89.9	Confident	90.4	Very high	192 Å²	192	71.4 Å²	71.4	73%	0.725	34%	0.338	S	S	*	.	H	α-helix	trans	-67.7	-42.7	177.5	-177.8	174.6	177.9	169.5	-2.4	112.9	T267 V268 L269	T267-R271 PolarHBondContact O-N 2.75Å; V268-R271 PolarHBondContact O-N 2.95Å; L269-R271 VanDerWaalsContact C-N 3.33Å
272	Y	90.1	Very high	90.3	Very high	22 Å²	22	65.9 Å²	65.9	9%	0.086	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	22	-176.6	-63.4	-78	0	0	0	113.2	A242 E243 L246 V268 L269 E274 S275 V276	A242-Y272 HydrophobicContact CB-CE1 4.05Å; A242-Y272 HydrophobicContact CB-CE2 3.87Å; E243-Y272 HydrophobicContact CG-CD1 3.48Å; E243-Y272 VanDerWaalsContact CG-CD1 3.48Å; E243-Y272 HydrophobicContact CG-CE1 3.88Å; E243-Y272 HydrophobicContact CG-CG 4.42Å; L246-Y272 HydrophobicContact CD1-CD2 3.74Å; L246-Y272 HydrophobicContact CD1-CG 3.82Å; V268-Y272 HydrophobicContact CG1-CD2 4.02Å; V268-Y272 HydrophobicContact CG1-CE2 4.4Å; V268-Y272 WeakPolarHBondContact O-CD2 3.42Å; V268-Y272 PolarHBondContact O-N 2.99Å; L269-Y272 CarbonylContact O-C 3.57Å; L269-Y272 PolarHBondContact O-N 3.36Å; Y272-E274 PolarHBondContact O-N 2.6Å; Y272-E274 VanDerWaalsContact O-N 3.16Å; Y272-S275 PolarHBondContact O-N 3.45Å; Y272-S275 VanDerWaalsContact O-N 3.07Å; Y272-V276 PolarHBondContact O-N 2.78Å
273	Q	87.8	Confident	90.3	Very high	95 Å²	95	65.3 Å²	65.3	44%	0.444	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-36.7	-171.8	-173.4	-177.2	-11.5	0	0	112.6	L269 S275 V276 R277	L269-Q273 WeakPolarHBondContact O-CA 3.36Å; L269-Q273 VanDerWaalsContact O-CB 3.31Å; L269-Q273 WeakPolarHBondContact O-CB 3.27Å; L269-Q273 PolarHBondContact O-N 2.94Å; Q273-S275 VanDerWaalsContact C-N 3.34Å; Q273-V276 PolarHBondContact O-N 2.8Å; Q273-R277 WeakPolarHBondContact O-CB 3.46Å; Q273-R277 PolarHBondContact O-N 2.87Å
274	E	90	Very high	90.5	Very high	144 Å²	144	65.1 Å²	65.1	67%	0.673	31%	0.314	S	S	*	.	H	α-helix	trans	-64	-41.8	-179.8	-49	-135.9	115.8	0	0	111.4	Y272 V276 R277	Y272-E274 PolarHBondContact O-N 2.6Å; Y272-E274 VanDerWaalsContact O-N 3.16Å; E274-V276 VanDerWaalsContact C-N 3.27Å; E274-V276 PolarHBondContact O-N 2.87Å; E274-R277 VanDerWaalsContact CG-NH2 3.35Å; E274-R277 PolarHBondContact O-N 3.5Å; E274-R277 IonicContact OE1-CZ 2.75Å; E274-R277 IonicContact OE1-NH1 2.7Å; E274-R277 IonicContact OE1-NH2 3.67Å; E274-R277 PolarHBondContact OE1-NH2 2.77Å
275	S	90	Very high	90.7	Very high	24 Å²	24	62.8 Å²	62.8	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-71.8	-15.9	-176.7	-52.4	0	0	0	0	114	E243 R247 Y272 Q273	E243-S275 PolarHBondContact OE2-OG 2.84Å; R247-S275 PolarHBondContact NH1-O 2.76Å; Y272-S275 PolarHBondContact O-N 3.45Å; Y272-S275 VanDerWaalsContact O-N 3.07Å; Q273-S275 VanDerWaalsContact C-N 3.34Å
276	V	92.8	Very high	90.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-118.9	3.1	178.6	-62.5	0	0	0	0	113.4	L246 R247 Y251 L269 Y272 Q273 E274 D278 L279 L280	L246-V276 HydrophobicContact CB-CG1 3.91Å; R247-V276 HydrophobicContact CG-CG1 4.34Å; Y251-V276 HydrophobicContact CE2-CB 4.44Å; Y251-V276 HydrophobicContact CE2-CG1 4.35Å; L269-V276 HydrophobicContact CD1-CG2 4.01Å; L269-V276 HydrophobicContact CG-CG2 4.41Å; Y272-V276 PolarHBondContact O-N 2.78Å; Q273-V276 PolarHBondContact O-N 2.8Å; E274-V276 VanDerWaalsContact C-N 3.27Å; E274-V276 PolarHBondContact O-N 2.87Å; V276-D278 VanDerWaalsContact C-N 3.31Å; V276-D278 PolarHBondContact O-N 2.88Å; V276-L279 PolarHBondContact O-N 2.69Å; V276-L279 VanDerWaalsContact O-N 3.15Å; V276-L280 HydrophobicContact CG2-CD1 3.86Å; V276-L280 HydrophobicContact CG2-CG 4.47Å; V276-L280 WeakPolarHBondContact O-CG 3.46Å; V276-L280 PolarHBondContact O-N 2.99Å
277	R	92.4	Very high	90.6	Very high	124 Å²	124	56 Å²	56	47%	0.468	26%	0.264	S	S	.	.	H	α-helix	trans	-59.8	-41.4	-174.8	-168.8	177	-59.2	169.7	7.2	112.3	Q273 E274 Y281	Q273-R277 WeakPolarHBondContact O-CB 3.46Å; Q273-R277 PolarHBondContact O-N 2.87Å; E274-R277 VanDerWaalsContact CG-NH2 3.35Å; E274-R277 PolarHBondContact O-N 3.5Å; E274-R277 IonicContact OE1-CZ 2.75Å; E274-R277 IonicContact OE1-NH1 2.7Å; E274-R277 IonicContact OE1-NH2 3.67Å; E274-R277 PolarHBondContact OE1-NH2 2.77Å; R277-Y281 VanDerWaalsContact O-CB 3.3Å; R277-Y281 WeakPolarHBondContact O-CB 3.35Å; R277-Y281 PolarHBondContact O-N 3.49Å
278	D	92.4	Very high	90.6	Very high	70 Å²	70	55.8 Å²	55.8	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-48.3	175.1	58.3	-28.2	0	0	0	111.3	R247 V276 Y281 M282	R247-D278 IonicContact CZ-OD1 3.87Å; R247-D278 IonicContact CZ-OD2 3.72Å; R247-D278 IonicContact NH1-OD1 2.77Å; R247-D278 PolarHBondContact NH1-OD1 2.76Å; R247-D278 VanDerWaalsContact NH1-OD1 3.17Å; R247-D278 IonicContact NH1-OD2 2.77Å; R247-D278 PolarHBondContact NH1-OD2 2.75Å; R247-D278 VanDerWaalsContact NH1-OD2 3.12Å; R247-D278 IonicContact NH2-OD2 2.64Å; R247-D278 PolarHBondContact NH2-OD2 2.78Å; V276-D278 VanDerWaalsContact C-N 3.31Å; V276-D278 PolarHBondContact O-N 2.88Å; D278-Y281 PolarHBondContact O-N 2.64Å; D278-M282 WeakPolarHBondContact O-CB 3.2Å; D278-M282 VanDerWaalsContact O-CG 3.3Å; D278-M282 WeakPolarHBondContact O-CG 3.35Å; D278-M282 PolarHBondContact O-N 2.83Å
279	L	92.1	Very high	90.3	Very high	26 Å²	26	56.9 Å²	56.9	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-41.9	179.5	-60.8	177.4	0	0	0	112.3	R247 Y251 V276 M282 S283 L304	R247-L279 HydrophobicContact CB-CD1 4.03Å; R247-L279 HydrophobicContact CG-CD1 4.02Å; Y251-L279 HydrophobicContact CD2-CB 3.9Å; Y251-L279 HydrophobicContact CD2-CD1 4.18Å; Y251-L279 HydrophobicContact CE2-CB 4.31Å; Y251-L279 HydrophobicContact CE2-CD1 4Å; V276-L279 PolarHBondContact O-N 2.69Å; V276-L279 VanDerWaalsContact O-N 3.15Å; L279-M282 PolarHBondContact O-N 3.3Å; L279-S283 WeakPolarHBondContact O-CB 3.16Å; L279-S283 PolarHBondContact O-N 3.12Å; L279-S283 PolarHBondContact O-OG 2.93Å; L279-L304 HydrophobicContact CD2-CD2 4.29Å
280	L	92.4	Very high	90	Very high	7 Å²	7	58.2 Å²	58.2	4%	0.037	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-45.1	175.9	-70.9	167.8	0	0	0	111.1	Y251 L259 L269 V276 S283 Y284	Y251-L280 HydrophobicContact CD1-CD2 3.77Å; Y251-L280 HydrophobicContact CE1-CD2 4.2Å; Y251-L280 HydrophobicContact CG-CD2 4.23Å; L259-L280 HydrophobicContact CD2-CD2 4.19Å; L269-L280 HydrophobicContact CD2-CD1 4.24Å; V276-L280 HydrophobicContact CG2-CD1 3.86Å; V276-L280 HydrophobicContact CG2-CG 4.47Å; V276-L280 WeakPolarHBondContact O-CG 3.46Å; V276-L280 PolarHBondContact O-N 2.99Å; L280-S283 WeakPolarHBondContact O-CB 3.41Å; L280-S283 PolarHBondContact O-N 2.76Å; L280-Y284 WeakPolarHBondContact O-CD2 3.24Å; L280-Y284 PolarHBondContact O-N 3.41Å
281	Y	91.6	Very high	89.5	Confident	145 Å²	145	55.6 Å²	55.6	57%	0.569	26%	0.264	S	S	*	.	H	α-helix	trans	-60	-48.7	177.1	-179.1	-106.8	0	0	0	111.6	R277 D278 S283 Y284 Q285	R277-Y281 VanDerWaalsContact O-CB 3.3Å; R277-Y281 WeakPolarHBondContact O-CB 3.35Å; R277-Y281 PolarHBondContact O-N 3.49Å; D278-Y281 PolarHBondContact O-N 2.64Å; Y281-S283 VanDerWaalsContact C-N 3.27Å; Y281-S283 PolarHBondContact O-N 3.38Å; Y281-Y284 PolarHBondContact O-N 3.16Å; Y281-Q285 HydrophobicContact CD1-CG 4.44Å; Y281-Q285 HydrophobicContact CE1-CG 4.12Å; Y281-Q285 HydrophobicContact CE2-CG 4.47Å; Y281-Q285 VanDerWaalsContact CZ-NE2 3.33Å; Y281-Q285 WeakPolarHBondContact O-CG 3.42Å; Y281-Q285 PolarHBondContact O-N 2.9Å; Y281-Q285 PolarHBondContact OH-NE2 3.19Å; Y281-Q285 VanDerWaalsContact OH-NE2 3.13Å
282	M	89.8	Confident	89	Confident	39 Å²	39	49.5 Å²	49.5	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-38.3	175.6	-71.8	-60.8	-70	0	0	112.2	D278 L279 Q285 F286 M294 F298 L304 F305	D278-M282 WeakPolarHBondContact O-CB 3.2Å; D278-M282 VanDerWaalsContact O-CG 3.3Å; D278-M282 WeakPolarHBondContact O-CG 3.35Å; D278-M282 PolarHBondContact O-N 2.83Å; L279-M282 PolarHBondContact O-N 3.3Å; M282-Q285 PolarHBondContact O-N 2.58Å; M282-Q285 PolarHBondContact SD-OE1 2.8Å; M282-Q285 VanDerWaalsContact SD-OE1 3.32Å; M282-F286 WeakPolarHBondContact O-CB 3.39Å; M282-F286 PolarHBondContact O-N 3.2Å; M282-M294 HydrophobicContact CE-CE 3.34Å; M282-M294 HydrophobicContact SD-CE 4.25Å; M282-F298 HydrophobicContact CE-CB 4.12Å; M282-F298 HydrophobicContact CE-CD1 3.91Å; M282-F298 HydrophobicContact CE-CG 3.98Å; M282-F298 HydrophobicContact SD-CD1 4.34Å; M282-F298 HydrophobicContact SD-CE1 4.42Å; M282-L304 HydrophobicContact CB-CD2 4.47Å; M282-F305 HydrophobicContact CE-CZ 4.35Å
283	S	91.5	Very high	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-42.1	178.1	-57.4	0	0	0	0	112	Y251 A252 L279 L280 Y281 F286 H287	Y251-S283 WeakPolarHBondContact CB-OG 3.19Å; A252-S283 PolarHBondContact N-OG 3.02Å; A252-S283 VanDerWaalsContact N-OG 3.1Å; L279-S283 WeakPolarHBondContact O-CB 3.16Å; L279-S283 PolarHBondContact O-N 3.12Å; L279-S283 PolarHBondContact O-OG 2.93Å; L280-S283 WeakPolarHBondContact O-CB 3.41Å; L280-S283 PolarHBondContact O-N 2.76Å; Y281-S283 VanDerWaalsContact C-N 3.27Å; Y281-S283 PolarHBondContact O-N 3.38Å; S283-F286 WeakPolarHBondContact O-CB 3.45Å; S283-F286 PolarHBondContact O-N 3.02Å; S283-H287 PolarHBondContact O-CD2 3.05Å; S283-H287 PolarHBondContact O-N 3.3Å
284	Y	91.6	Very high	88.2	Confident	60 Å²	60	49.2 Å²	49.2	24%	0.235	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-40.7	174.1	-71.9	-60.4	0	0	0	112.5	P256 L259 F260 Q263 L280 Y281 F286 H287 S288	P256-Y284 HydrophobicContact CB-CD1 4.29Å; P256-Y284 HydrophobicContact CB-CE1 4.15Å; L259-Y284 HydrophobicContact CB-CE1 4.13Å; L259-Y284 HydrophobicContact CD1-CE1 4.28Å; F260-Y284 PolarHBondContact N-OH 3.48Å; Q263-Y284 PolarHBondContact NE2-OH 3.48Å; L280-Y284 WeakPolarHBondContact O-CD2 3.24Å; L280-Y284 PolarHBondContact O-N 3.41Å; Y281-Y284 PolarHBondContact O-N 3.16Å; Y284-F286 VanDerWaalsContact C-N 3.31Å; Y284-F286 PolarHBondContact O-N 3.36Å; Y284-H287 PolarHBondContact O-N 3.46Å; Y284-S288 WeakPolarHBondContact O-CB 3.37Å; Y284-S288 PolarHBondContact O-N 2.94Å; Y284-S288 PolarHBondContact O-OG 3.43Å
285	Q	90	Very high	87.7	Confident	47 Å²	47	43.5 Å²	43.5	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-43.9	174.2	-71.2	-176.8	-46.9	0	0	111.3	Y281 M282 H287 S288 A289 M294	Y281-Q285 HydrophobicContact CD1-CG 4.44Å; Y281-Q285 HydrophobicContact CE1-CG 4.12Å; Y281-Q285 HydrophobicContact CE2-CG 4.47Å; Y281-Q285 VanDerWaalsContact CZ-NE2 3.33Å; Y281-Q285 WeakPolarHBondContact O-CG 3.42Å; Y281-Q285 PolarHBondContact O-N 2.9Å; Y281-Q285 PolarHBondContact OH-NE2 3.19Å; Y281-Q285 VanDerWaalsContact OH-NE2 3.13Å; M282-Q285 PolarHBondContact O-N 2.58Å; M282-Q285 PolarHBondContact SD-OE1 2.8Å; M282-Q285 VanDerWaalsContact SD-OE1 3.32Å; Q285-H287 VanDerWaalsContact C-N 3.32Å; Q285-H287 PolarHBondContact O-N 3.5Å; Q285-S288 PolarHBondContact O-N 3.47Å; Q285-S288 VanDerWaalsContact O-N 3.1Å; Q285-A289 PolarHBondContact O-N 3.07Å; Q285-M294 HydrophobicContact CB-CE 4.2Å
286	F	89.1	Confident	87.3	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-37.5	177.2	175.2	-101.4	0	0	0	113.3	A252 M253 M282 S283 Y284 P291 M294 F305 P339 S340 Y462	A252-F286 HydrophobicContact CB-CD1 3.85Å; A252-F286 HydrophobicContact CB-CE1 4.3Å; A252-F286 HydrophobicContact CB-CG 4.34Å; M253-F286 HydrophobicContact CE-CE1 4.33Å; M282-F286 WeakPolarHBondContact O-CB 3.39Å; M282-F286 PolarHBondContact O-N 3.2Å; S283-F286 WeakPolarHBondContact O-CB 3.45Å; S283-F286 PolarHBondContact O-N 3.02Å; Y284-F286 VanDerWaalsContact C-N 3.31Å; Y284-F286 PolarHBondContact O-N 3.36Å; F286-P291 HydrophobicContact CD2-CG 4.28Å; F286-P291 HydrophobicContact CE2-CB 3.95Å; F286-P291 HydrophobicContact CE2-CG 3.67Å; F286-P291 HydrophobicContact CZ-CG 4.17Å; F286-M294 WeakPolarHBondContact CA-SD 3.32Å; F286-M294 HydrophobicContact CB-CE 4.25Å; F286-M294 HydrophobicContact CB-SD 3.74Å; F286-M294 HydrophobicContact CD2-SD 4.03Å; F286-M294 HydrophobicContact CG-SD 4.41Å; F286-F305 HydrophobicContact CB-CD1 4.37Å; F286-F305 HydrophobicContact CB-CE1 3.8Å; F286-F305 HydrophobicContact CD1-CD1 4.37Å; F286-F305 AromaticContact CD2-CD1 3.5Å; F286-F305 HydrophobicContact CD2-CD1 3.5Å; F286-F305 VanDerWaalsContact CD2-CD1 3.5Å; F286-F305 AromaticContact CD2-CE1 3.68Å; F286-F305 HydrophobicContact CD2-CE1 3.68Å; F286-F305 AromaticContact CE2-CD1 3.76Å; F286-F305 HydrophobicContact CE2-CD1 3.76Å; F286-F305 HydrophobicContact CE2-CE1 4.41Å; F286-F305 AromaticContact CG-CD1 3.83Å; F286-F305 HydrophobicContact CG-CD1 3.83Å; F286-F305 AromaticContact CG-CE1 3.77Å; F286-F305 HydrophobicContact CG-CE1 3.77Å; F286-F305 HydrophobicContact CZ-CD1 4.31Å; F286-P339 HydrophobicContact CE1-CB 3.89Å; F286-P339 HydrophobicContact CZ-CB 3.87Å; F286-P339 HydrophobicContact CZ-CG 4.21Å; F286-S340 WeakPolarHBondContact O-CB 3.43Å; F286-S340 PolarHBondContact O-OG 3.11Å; F286-Y462 HydrophobicContact CE2-CE2 4.18Å; F286-Y462 HydrophobicContact CZ-CE2 4.12Å
287	H	90.7	Very high	86.7	Confident	11 Å²	11	58.4 Å²	58.4	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-77.9	-19.6	175.6	-70	-53.6	0	0	0	114.1	A252 M254 P256 S283 Y284 Q285 S341 H342	A252-H287 PolarHBondContact O-CE1 3.16Å; A252-H287 PolarHBondContact O-NE2 2.7Å; M254-H287 PolarHBondContact O-NE2 3.45Å; P256-H287 HydrophobicContact CG-CB 3.54Å; S283-H287 PolarHBondContact O-CD2 3.05Å; S283-H287 PolarHBondContact O-N 3.3Å; Y284-H287 PolarHBondContact O-N 3.46Å; Q285-H287 VanDerWaalsContact C-N 3.32Å; Q285-H287 PolarHBondContact O-N 3.5Å; H287-S341 PolarHBondContact ND1-N 2.97Å; H287-S341 VanDerWaalsContact ND1-N 3.18Å; H287-S341 PolarHBondContact ND1-OG 3.05Å; H287-H342 PolarHBondContact O-N 3.08Å
288	S	88.9	Confident	86	Confident	94 Å²	94	56.7 Å²	56.7	66%	0.657	28%	0.277	S	S	*	.	H	α-helix	trans	-91.1	-33.4	-176	-57.2	0	0	0	0	113.3	Y284 Q285	Y284-S288 WeakPolarHBondContact O-CB 3.37Å; Y284-S288 PolarHBondContact O-N 2.94Å; Y284-S288 PolarHBondContact O-OG 3.43Å; Q285-S288 PolarHBondContact O-N 3.47Å; Q285-S288 VanDerWaalsContact O-N 3.1Å
289	A	84.9	Confident	85	Confident	33 Å²	33	59 Å²	59	27%	0.273	29%	0.289	S	S	.	.	S	Bend	trans	-112	161.7	-178.2	0	0	0	0	0	112	Q285	Q285-A289 PolarHBondContact O-N 3.07Å
290	S	82.4	Confident	84.1	Confident	30 Å²	30	58 Å²	58	21%	0.21	28%	0.284	C	S	.	.			trans	-65	135.2	171.7	70.9	0	0	0	0	110	L292 Q293 M294	S290-L292 PolarHBondContact O-N 3.22Å; S290-Q293 WeakPolarHBondContact O-CB 3.32Å; S290-Q293 PolarHBondContact O-N 3.02Å; S290-Q293 WeakPolarHBondContact OG-CB 3.38Å; S290-Q293 PolarHBondContact OG-N 3.31Å; S290-M294 PolarHBondContact O-N 2.94Å
291	P	79.2	Confident	83.1	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.019	30%	0.301	C	S	.	.	H	α-helix	trans	-58.2	-31.5	179.6	-33.8	43	0	0	0	113.7	F286 M294 A295 Y462	F286-P291 HydrophobicContact CD2-CG 4.28Å; F286-P291 HydrophobicContact CE2-CB 3.95Å; F286-P291 HydrophobicContact CE2-CG 3.67Å; F286-P291 HydrophobicContact CZ-CG 4.17Å; P291-M294 PolarHBondContact O-N 3.12Å; P291-A295 WeakPolarHBondContact O-CB 3.27Å; P291-A295 PolarHBondContact O-N 3.29Å; P291-Y462 HydrophobicContact CB-CD1 3.96Å; P291-Y462 HydrophobicContact CB-CD2 3.78Å; P291-Y462 HydrophobicContact CB-CE1 3.77Å; P291-Y462 HydrophobicContact CB-CE2 3.56Å; P291-Y462 HydrophobicContact CB-CG 3.97Å; P291-Y462 HydrophobicContact CG-CD2 4.42Å; P291-Y462 HydrophobicContact CG-CE1 3.99Å; P291-Y462 HydrophobicContact CG-CE2 3.7Å; P291-Y462 VanDerWaalsContact CG-CZ 3.48Å; P291-Y462 WeakPolarHBondContact CG-OH 3.3Å
292	L	78.6	Confident	82.5	Confident	64 Å²	64	56.8 Å²	56.8	34%	0.335	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-37.1	173.5	-65.2	173.5	0	0	0	113	S290	S290-L292 PolarHBondContact O-N 3.22Å
293	Q	80.8	Confident	82.2	Confident	103 Å²	103	58.1 Å²	58.1	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-72.2	-40.2	174.9	-175.8	173.3	6.8	0	0	110.8	S290 A295 K296 Y297	S290-Q293 WeakPolarHBondContact O-CB 3.32Å; S290-Q293 PolarHBondContact O-N 3.02Å; S290-Q293 WeakPolarHBondContact OG-CB 3.38Å; S290-Q293 PolarHBondContact OG-N 3.31Å; Q293-A295 VanDerWaalsContact C-N 3.33Å; Q293-A295 PolarHBondContact O-N 3.17Å; Q293-K296 WeakPolarHBondContact O-CB 3.08Å; Q293-K296 PolarHBondContact O-N 3.46Å; Q293-Y297 HydrophobicContact CG-CE2 4.33Å; Q293-Y297 VanDerWaalsContact O-CD2 3.27Å; Q293-Y297 WeakPolarHBondContact O-CD2 2.99Å
294	M	81.1	Confident	82	Confident	9 Å²	9	58.8 Å²	58.8	4%	0.044	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-41.3	176.6	-168.2	169.3	-179.1	0	0	112	M282 Q285 F286 S290 P291 K296 Y297 F298 V300 F305	M282-M294 HydrophobicContact CE-CE 3.34Å; M282-M294 HydrophobicContact SD-CE 4.25Å; Q285-M294 HydrophobicContact CB-CE 4.2Å; F286-M294 WeakPolarHBondContact CA-SD 3.32Å; F286-M294 HydrophobicContact CB-CE 4.25Å; F286-M294 HydrophobicContact CB-SD 3.74Å; F286-M294 HydrophobicContact CD2-SD 4.03Å; F286-M294 HydrophobicContact CG-SD 4.41Å; S290-M294 PolarHBondContact O-N 2.94Å; P291-M294 PolarHBondContact O-N 3.12Å; M294-K296 PolarHBondContact O-N 3.03Å; M294-K296 VanDerWaalsContact O-N 3.12Å; M294-Y297 PolarHBondContact O-N 2.89Å; M294-F298 HydrophobicContact CE-CD2 4.41Å; M294-F298 HydrophobicContact CG-CB 4.44Å; M294-F298 HydrophobicContact CG-CD2 3.84Å; M294-F298 PolarHBondContact O-N 3.39Å; M294-V300 HydrophobicContact CG-CG1 4.12Å; M294-F305 HydrophobicContact CE-CE1 4.28Å; M294-F305 HydrophobicContact CE-CZ 3.99Å
295	A	79.2	Confident	81.7	Confident	24 Å²	24	56.4 Å²	56.4	20%	0.198	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.6	176.7	0	0	0	0	0	114.4	P291 Q293 Y297 L465	P291-A295 WeakPolarHBondContact O-CB 3.27Å; P291-A295 PolarHBondContact O-N 3.29Å; Q293-A295 VanDerWaalsContact C-N 3.33Å; Q293-A295 PolarHBondContact O-N 3.17Å; A295-Y297 VanDerWaalsContact C-N 3.32Å; A295-L465 HydrophobicContact CB-CD1 4.02Å; A295-L465 HydrophobicContact CB-CD2 3.69Å; A295-L465 HydrophobicContact CB-CG 3.93Å
296	K	81.4	Confident	81.6	Confident	165 Å²	165	56 Å²	56	72%	0.717	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-25.6	175.6	-66.1	-179.8	-179.1	-178.3	0	113	Q293 M294	Q293-K296 WeakPolarHBondContact O-CB 3.08Å; Q293-K296 PolarHBondContact O-N 3.46Å; M294-K296 PolarHBondContact O-N 3.03Å; M294-K296 VanDerWaalsContact O-N 3.12Å
297	Y	80.3	Confident	81.7	Confident	172 Å²	172	56 Å²	56	68%	0.675	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-26.5	-171.5	-60.6	-76.5	0	0	0	112.9	Q293 M294 A295	Q293-Y297 HydrophobicContact CG-CE2 4.33Å; Q293-Y297 VanDerWaalsContact O-CD2 3.27Å; Q293-Y297 WeakPolarHBondContact O-CD2 2.99Å; M294-Y297 PolarHBondContact O-N 2.89Å; A295-Y297 VanDerWaalsContact C-N 3.32Å
298	F	78.3	Confident	81.8	Confident	88 Å²	88	55.5 Å²	55.5	39%	0.386	30%	0.297	S	S	.	.	S	Bend	trans	-125.5	147.5	-175.5	-59.4	-80.2	0	0	0	111	M282 M294 V300	M282-F298 HydrophobicContact CE-CB 4.12Å; M282-F298 HydrophobicContact CE-CD1 3.91Å; M282-F298 HydrophobicContact CE-CG 3.98Å; M282-F298 HydrophobicContact SD-CD1 4.34Å; M282-F298 HydrophobicContact SD-CE1 4.42Å; M294-F298 HydrophobicContact CE-CD2 4.41Å; M294-F298 HydrophobicContact CG-CB 4.44Å; M294-F298 HydrophobicContact CG-CD2 3.84Å; M294-F298 PolarHBondContact O-N 3.39Å; F298-V300 HydrophobicContact CB-CG1 4.13Å; F298-V300 PolarHBondContact O-N 3.44Å
299	D	71.8	Confident	82.1	Confident	117 Å²	117	51 Å²	51	63%	0.626	27%	0.266	S	S	*	.			trans	-74.4	110.4	167.4	-172	11.5	0	0	0	108.8	N301	D299-N301 VanDerWaalsContact OD1-CB 3.25Å; D299-N301 WeakPolarHBondContact OD1-CB 2.92Å; D299-N301 PolarHBondContact OD1-N 3.05Å; D299-N301 PolarHBondContact OD1-ND2 3.06Å
300	V	71.9	Confident	82.6	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.036	25%	0.253	C	S	.	.			trans	-107	17.5	177	-32.5	0	0	0	0	112.1	M294 F298 C302 F305 L465	M294-V300 HydrophobicContact CG-CG1 4.12Å; F298-V300 HydrophobicContact CB-CG1 4.13Å; F298-V300 PolarHBondContact O-N 3.44Å; V300-C302 PolarHBondContact O-N 2.86Å; V300-F305 HydrophobicContact CB-CD2 3.42Å; V300-F305 VanDerWaalsContact CB-CD2 3.42Å; V300-F305 HydrophobicContact CB-CE2 3.55Å; V300-F305 HydrophobicContact CB-CG 4.03Å; V300-F305 HydrophobicContact CB-CZ 4.3Å; V300-F305 HydrophobicContact CG1-CD2 4.31Å; V300-F305 HydrophobicContact CG1-CE2 3.97Å; V300-F305 HydrophobicContact CG1-CZ 4.34Å; V300-F305 HydrophobicContact CG2-CD2 4.27Å; V300-F305 HydrophobicContact CG2-CG 4.47Å; V300-F305 WeakPolarHBondContact O-CD2 3.41Å; V300-L465 HydrophobicContact CB-CD1 4.38Å; V300-L465 HydrophobicContact CB-CD2 3.71Å; V300-L465 HydrophobicContact CB-CG 4.48Å; V300-L465 HydrophobicContact CG1-CD2 4.25Å; V300-L465 HydrophobicContact CG2-CB 4.27Å; V300-L465 HydrophobicContact CG2-CD1 2.98Å; V300-L465 HydrophobicContact CG2-CD2 3.04Å; V300-L465 HydrophobicContact CG2-CG 3.39Å
301	N	72.9	Confident	83.1	Confident	74 Å²	74	49.7 Å²	49.7	40%	0.396	25%	0.251	S	S	.	.			trans	-79.8	55.5	167.8	-71	-50.8	0	0	0	113.6	D299 L465 I466	D299-N301 VanDerWaalsContact OD1-CB 3.25Å; D299-N301 WeakPolarHBondContact OD1-CB 2.92Å; D299-N301 PolarHBondContact OD1-N 3.05Å; D299-N301 PolarHBondContact OD1-ND2 3.06Å; N301-L465 VanDerWaalsContact ND2-C 3.33Å; N301-L465 PolarHBondContact ND2-O 3.03Å; N301-L465 VanDerWaalsContact OD1-CA 3.25Å; N301-L465 WeakPolarHBondContact OD1-CA 3.3Å; N301-L465 WeakPolarHBondContact OD1-CB 3.38Å; N301-L465 PolarHBondContact OD1-O 3.32Å; N301-I466 VanDerWaalsContact OD1-CA 3.3Å; N301-I466 WeakPolarHBondContact OD1-CA 3.43Å; N301-I466 PolarHBondContact OD1-N 3.13Å; N301-I466 VanDerWaalsContact OD1-N 3.11Å
302	C	77.8	Confident	83.8	Confident	52 Å²	52	51.4 Å²	51.4	35%	0.351	26%	0.263	S	S	.	.	S	Bend	trans	-135.1	160.5	174.9	63.6	0	0	0	0	110.5	V300 L304 F305	V300-C302 PolarHBondContact O-N 2.86Å; C302-L304 PolarHBondContact O-N 3.47Å; C302-F305 PolarHBondContact O-N 3.26Å; C302-F305 WeakPolarHBondContact SG-CD2 3.32Å; C302-F305 VanDerWaalsContact SG-CE2 3.52Å
303	S	83.9	Confident	84.4	Confident	67 Å²	67	52 Å²	52	47%	0.469	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-56.4	-22.6	179.7	52.7	0	0	0	0	112.9	R250 F305 V306	R250-S303 WeakPolarHBondContact CD-O 3.45Å; R250-S303 WeakPolarHBondContact CG-O 3.36Å; R250-S303 PolarHBondContact NE-O 2.98Å; S303-F305 VanDerWaalsContact C-N 3.27Å; S303-F305 PolarHBondContact O-N 3.38Å; S303-V306 PolarHBondContact O-N 3.46Å
304	L	86.9	Confident	84.9	Confident	15 Å²	15	49.5 Å²	49.5	8%	0.079	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-55.9	-38.4	177.4	-176.6	61	0	0	0	112.8	A252 L279 M282 C302	A252-L304 HydrophobicContact CB-CD1 4.14Å; A252-L304 HydrophobicContact CB-CG 4.01Å; L279-L304 HydrophobicContact CD2-CD2 4.29Å; M282-L304 HydrophobicContact CB-CD2 4.47Å; C302-L304 PolarHBondContact O-N 3.47Å
305	F	86.4	Confident	85.4	Confident	10 Å²	10	50 Å²	50	4%	0.044	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-100.4	2.8	-174.1	-55.7	-70	0	0	0	114	A252 M282 F286 M294 V300 C302 S303	A252-F305 HydrophobicContact CB-CD1 3.87Å; A252-F305 HydrophobicContact CB-CE1 3.99Å; M282-F305 HydrophobicContact CE-CZ 4.35Å; F286-F305 HydrophobicContact CB-CD1 4.37Å; F286-F305 HydrophobicContact CB-CE1 3.8Å; F286-F305 HydrophobicContact CD1-CD1 4.37Å; F286-F305 AromaticContact CD2-CD1 3.5Å; F286-F305 HydrophobicContact CD2-CD1 3.5Å; F286-F305 VanDerWaalsContact CD2-CD1 3.5Å; F286-F305 AromaticContact CD2-CE1 3.68Å; F286-F305 HydrophobicContact CD2-CE1 3.68Å; F286-F305 AromaticContact CE2-CD1 3.76Å; F286-F305 HydrophobicContact CE2-CD1 3.76Å; F286-F305 HydrophobicContact CE2-CE1 4.41Å; F286-F305 AromaticContact CG-CD1 3.83Å; F286-F305 HydrophobicContact CG-CD1 3.83Å; F286-F305 AromaticContact CG-CE1 3.77Å; F286-F305 HydrophobicContact CG-CE1 3.77Å; F286-F305 HydrophobicContact CZ-CD1 4.31Å; M294-F305 HydrophobicContact CE-CE1 4.28Å; M294-F305 HydrophobicContact CE-CZ 3.99Å; V300-F305 HydrophobicContact CB-CD2 3.42Å; V300-F305 VanDerWaalsContact CB-CD2 3.42Å; V300-F305 HydrophobicContact CB-CE2 3.55Å; V300-F305 HydrophobicContact CB-CG 4.03Å; V300-F305 HydrophobicContact CB-CZ 4.3Å; V300-F305 HydrophobicContact CG1-CD2 4.31Å; V300-F305 HydrophobicContact CG1-CE2 3.97Å; V300-F305 HydrophobicContact CG1-CZ 4.34Å; V300-F305 HydrophobicContact CG2-CD2 4.27Å; V300-F305 HydrophobicContact CG2-CG 4.47Å; V300-F305 WeakPolarHBondContact O-CD2 3.41Å; C302-F305 PolarHBondContact O-N 3.26Å; C302-F305 WeakPolarHBondContact SG-CD2 3.32Å; C302-F305 VanDerWaalsContact SG-CE2 3.52Å; S303-F305 VanDerWaalsContact C-N 3.27Å; S303-F305 PolarHBondContact O-N 3.38Å
306	V	87.3	Confident	86	Confident	38 Å²	38	49 Å²	49	23%	0.23	26%	0.263	C	S	.	.	S	Bend	trans	-104.6	121.3	179.7	178.7	0	0	0	0	108.8	R250 S303 L461	R250-V306 WeakPolarHBondContact CD-O 3.39Å; R250-V306 PolarHBondContact NH1-O 2.91Å; S303-V306 PolarHBondContact O-N 3.46Å; V306-L461 HydrophobicContact CG1-CD2 3.9Å
307	P	90.7	Very high	86.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	24%	0.241	C	C	.	.			trans	-66.6	149	176.3	26.3	-33.4	0	0	0	111.8	M253 Y310 W315 K459	M253-P307 HydrophobicContact SD-CB 3.83Å; P307-Y310 HydrophobicContact CB-CD2 4.02Å; P307-Y310 HydrophobicContact CB-CE2 3.66Å; P307-W315 HydrophobicContact CB-CE3 4.24Å; P307-W315 HydrophobicContact CB-CH2 3.9Å; P307-W315 HydrophobicContact CB-CZ2 4.46Å; P307-W315 HydrophobicContact CB-CZ3 3.79Å; P307-W315 HydrophobicContact CG-CE3 4.46Å; P307-W315 HydrophobicContact CG-CH2 4.29Å; P307-W315 HydrophobicContact CG-CZ3 3.85Å; P307-K459 HydrophobicContact CB-CG 4.46Å; P307-K459 HydrophobicContact CG-CB 3.95Å; P307-K459 HydrophobicContact CG-CG 3.94Å
308	R	93.3	Very high	87.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.			trans	-80.8	-170.3	166.1	-57	-175.3	-159.9	-111.5	6.2	110	L211 R213 L218 E221 R250 Y310	L211-R308 VanDerWaalsContact O-CZ 3.26Å; L211-R308 PolarHBondContact O-NH1 2.95Å; L211-R308 PolarHBondContact O-NH2 3.19Å; R213-R308 PolarHBondContact O-NH1 2.85Å; L218-R308 HydrophobicContact CD2-CB 4.12Å; E221-R308 IonicContact OE1-CZ 3.85Å; E221-R308 IonicContact OE1-NE 3.84Å; E221-R308 PolarHBondContact OE1-NE 3.4Å; E221-R308 IonicContact OE1-NH2 3.58Å; E221-R308 PolarHBondContact OE1-NH2 3.09Å; E221-R308 IonicContact OE2-NE 3.72Å; E221-R308 PolarHBondContact OE2-NE 2.73Å; E221-R308 VanDerWaalsContact OE2-NE 3.12Å; R250-R308 VanDerWaalsContact CZ-CG 3.49Å; R308-Y310 VanDerWaalsContact C-N 3.32Å; R308-Y310 HydrophobicContact CB-CD1 4.41Å; R308-Y310 HydrophobicContact CB-CE1 3.86Å; R308-Y310 HydrophobicContact CG-CE1 4.42Å; R308-Y310 PolarHBondContact O-N 3.04Å
309	N	94.8	Very high	88.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	78.6	175	-59.5	-37.6	0	0	0	110.3	D215 L216 V217 L218 K459	D215-N309 WeakPolarHBondContact CA-ND2 3.41Å; D215-N309 PolarHBondContact O-ND2 3.46Å; L216-N309 VanDerWaalsContact O-CB 3.31Å; L216-N309 WeakPolarHBondContact O-CB 3.24Å; L216-N309 PolarHBondContact O-N 3.33Å; V217-N309 WeakPolarHBondContact CA-O 3.18Å; V217-N309 HydrophobicContact CB-CB 4.43Å; V217-N309 HydrophobicContact CG2-CB 3.84Å; L218-N309 PolarHBondContact N-O 3.48Å; N309-K459 WeakPolarHBondContact OD1-CE 3.31Å; N309-K459 PolarHBondContact OD1-NZ 3.29Å
310	Y	94.9	Very high	89.2	Confident	1 Å²	1	34.3 Å²	34.3	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	129.5	179.3	-56.9	-52.4	0	0	0	112.1	L218 E221 M253 P307 R308 S312 W315	L218-Y310 HydrophobicContact CD1-CE1 4.37Å; L218-Y310 HydrophobicContact CD2-CD1 4.09Å; L218-Y310 HydrophobicContact CD2-CE1 4.08Å; L218-Y310 HydrophobicContact CG-CD1 4.03Å; L218-Y310 HydrophobicContact CG-CE1 4.19Å; L218-Y310 CarbonylContact O-C 3.59Å; L218-Y310 VanDerWaalsContact O-CA 3.24Å; L218-Y310 WeakPolarHBondContact O-CA 3.35Å; E221-Y310 HydrophobicContact CB-CE1 4.07Å; E221-Y310 WeakPolarHBondContact OE2-CE1 3.41Å; E221-Y310 PolarHBondContact OE2-OH 3.08Å; M253-Y310 HydrophobicContact CB-CE2 4.13Å; M253-Y310 WeakPolarHBondContact CB-OH 3.39Å; M253-Y310 HydrophobicContact CG-CE2 4.24Å; M253-Y310 WeakPolarHBondContact CG-OH 3.42Å; M253-Y310 HydrophobicContact SD-CE2 4.46Å; P307-Y310 HydrophobicContact CB-CD2 4.02Å; P307-Y310 HydrophobicContact CB-CE2 3.66Å; R308-Y310 VanDerWaalsContact C-N 3.32Å; R308-Y310 HydrophobicContact CB-CD1 4.41Å; R308-Y310 HydrophobicContact CB-CE1 3.86Å; R308-Y310 HydrophobicContact CG-CE1 4.42Å; R308-Y310 PolarHBondContact O-N 3.04Å; Y310-S312 VanDerWaalsContact C-N 3.33Å; Y310-W315 VanDerWaalsContact CB-CD1 3.42Å; Y310-W315 AromaticContact CD2-CD1 3.82Å; Y310-W315 AromaticContact CD2-CD2 3.99Å; Y310-W315 HydrophobicContact CD2-CD2 3.99Å; Y310-W315 AromaticContact CD2-CE2 3.63Å; Y310-W315 HydrophobicContact CD2-CG 4.09Å; Y310-W315 HydrophobicContact CD2-CZ2 4.1Å; Y310-W315 AromaticContact CD2-NE1 3.52Å; Y310-W315 HydrophobicContact CE2-CZ2 4.3Å; Y310-W315 HydrophobicContact CG-CG 4.47Å
311	L	94.3	Very high	90.1	Very high	34 Å²	34	34.1 Å²	34.1	18%	0.178	21%	0.212	C	C	.	.			trans	-84.1	-6.8	178.9	-60.3	173.4	0	0	0	113.2	V217 L218 L406 H455	V217-L311 HydrophobicContact CG1-CD1 3.9Å; V217-L311 HydrophobicContact CG1-CD2 3.75Å; V217-L311 HydrophobicContact CG1-CG 3.87Å; L218-L311 PolarHBondContact O-N 2.74Å; L311-L406 HydrophobicContact CD2-CD1 3.54Å; L311-H455 HydrophobicContact CD2-CB 4.41Å; L311-H455 WeakPolarHBondContact CD2-ND1 3.07Å; L311-H455 PolarHBondContact O-CE1 3.35Å
312	S	92.8	Very high	90.9	Very high	39 Å²	39	35 Å²	35	27%	0.273	22%	0.216	S	C	.	.	S	Bend	trans	-60.7	142.4	175.2	171.2	0	0	0	0	111.6	Q219 Y310 V314 W315 G316	Q219-S312 VanDerWaalsContact O-CB 3.27Å; Q219-S312 WeakPolarHBondContact O-CB 3.49Å; Q219-S312 PolarHBondContact O-N 3.07Å; Y310-S312 VanDerWaalsContact C-N 3.33Å; S312-V314 PolarHBondContact O-N 3.2Å; S312-V314 PolarHBondContact OG-N 2.72Å; S312-W315 PolarHBondContact O-N 2.77Å; S312-G316 PolarHBondContact O-N 2.91Å
313	A	91.3	Very high	91.2	Very high	78 Å²	78	35.8 Å²	35.8	65%	0.645	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-14.4	178.4	0	0	0	0	0	114.2	W315 G316	A313-W315 VanDerWaalsContact C-N 3.29Å; A313-G316 WeakPolarHBondContact CA-O 3.46Å
314	V	90.6	Very high	91.2	Very high	49 Å²	49	32.7 Å²	32.7	30%	0.297	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-33.9	173.4	172.8	0	0	0	0	112.3	S312 T335 Q336	S312-V314 PolarHBondContact O-N 3.2Å; S312-V314 PolarHBondContact OG-N 2.72Å; V314-T335 WeakPolarHBondContact O-CA 3.28Å; V314-T335 WeakPolarHBondContact O-CB 3.37Å; V314-Q336 HydrophobicContact CG1-CB 4.07Å; V314-Q336 HydrophobicContact CG1-CG 3.67Å; V314-Q336 PolarHBondContact O-N 2.86Å
315	W	91.6	Very high	90.8	Very high	21 Å²	21	34 Å²	34	8%	0.08	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-16.7	-171.9	-59.3	99.6	0	0	0	112.8	M253 P307 Y310 S312 A313 P339 V457 V458 P460	M253-W315 HydrophobicContact SD-CH2 4.31Å; P307-W315 HydrophobicContact CB-CE3 4.24Å; P307-W315 HydrophobicContact CB-CH2 3.9Å; P307-W315 HydrophobicContact CB-CZ2 4.46Å; P307-W315 HydrophobicContact CB-CZ3 3.79Å; P307-W315 HydrophobicContact CG-CE3 4.46Å; P307-W315 HydrophobicContact CG-CH2 4.29Å; P307-W315 HydrophobicContact CG-CZ3 3.85Å; Y310-W315 VanDerWaalsContact CB-CD1 3.42Å; Y310-W315 AromaticContact CD2-CD1 3.82Å; Y310-W315 AromaticContact CD2-CD2 3.99Å; Y310-W315 HydrophobicContact CD2-CD2 3.99Å; Y310-W315 AromaticContact CD2-CE2 3.63Å; Y310-W315 HydrophobicContact CD2-CG 4.09Å; Y310-W315 HydrophobicContact CD2-CZ2 4.1Å; Y310-W315 AromaticContact CD2-NE1 3.52Å; Y310-W315 HydrophobicContact CE2-CZ2 4.3Å; Y310-W315 HydrophobicContact CG-CG 4.47Å; S312-W315 PolarHBondContact O-N 2.77Å; A313-W315 VanDerWaalsContact C-N 3.29Å; W315-P339 HydrophobicContact CH2-CB 3.68Å; W315-P339 HydrophobicContact CH2-CG 3.94Å; W315-P339 HydrophobicContact CZ3-CG 4.33Å; W315-V457 HydrophobicContact CB-CG1 4.31Å; W315-V458 PolarHBondContact O-N 3.16Å; W315-P460 HydrophobicContact CE3-CG 4.34Å; W315-P460 HydrophobicContact CZ3-CG 3.61Å
316	G	93.3	Very high	90.3	Very high	3 Å²	3	42.4 Å²	42.4	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	-173.4	-167.8	0	0	0	0	0	114	S312 A313 V456	S312-G316 PolarHBondContact O-N 2.91Å; A313-G316 WeakPolarHBondContact CA-O 3.46Å; G316-V456 CarbonylContact C-O 3.59Å; G316-V456 WeakPolarHBondContact CA-O 3.49Å
317	S	95.2	Very high	89.8	Confident	37 Å²	37	45.3 Å²	45.3	26%	0.259	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	138.7	176.9	-167.2	0	0	0	0	111.1	V456	S317-V456 PolarHBondContact N-O 3.47Å; S317-V456 PolarHBondContact O-N 3.31Å
318	P	95.3	Very high	89.6	Confident	91 Å²	91	49.1 Å²	49.1	59%	0.591	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	141.1	166.7	30.3	-34.1	0	0	0	110
319	W	94.7	Very high	89.5	Confident	20 Å²	20	53.8 Å²	53.8	8%	0.076	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	116.7	179	-175.4	21.3	0	0	0	110.9	I321 R329 T331 A352 F354 L454 V456	W319-I321 HydrophobicContact CD2-CD1 4.02Å; W319-I321 HydrophobicContact CD2-CG1 3.99Å; W319-I321 HydrophobicContact CE3-CD1 4.16Å; W319-I321 HydrophobicContact CG-CG1 4.29Å; W319-I321 HydrophobicContact CH2-CD1 4.27Å; W319-I321 HydrophobicContact CZ2-CD1 4.07Å; W319-I321 HydrophobicContact CZ2-CG1 4.1Å; W319-I321 HydrophobicContact CZ3-CD1 4.28Å; W319-R329 WeakPolarHBondContact CH2-O 3.35Å; W319-R329 HydrophobicContact CZ2-CB 4.11Å; W319-R329 WeakPolarHBondContact CZ2-O 3.41Å; W319-T331 HydrophobicContact CD2-CG2 3.63Å; W319-T331 HydrophobicContact CE3-CG2 4.12Å; W319-T331 HydrophobicContact CG-CG2 3.86Å; W319-T331 HydrophobicContact CH2-CG2 4.33Å; W319-T331 HydrophobicContact CZ2-CG2 3.95Å; W319-T331 HydrophobicContact CZ3-CG2 4.45Å; W319-A352 HydrophobicContact CE3-CB 4.31Å; W319-A352 HydrophobicContact CH2-CB 4.11Å; W319-A352 HydrophobicContact CZ3-CB 3.76Å; W319-F354 HydrophobicContact CH2-CB 3.46Å; W319-F354 VanDerWaalsContact CH2-CB 3.46Å; W319-F354 VanDerWaalsContact CH2-N 3.32Å; W319-F354 HydrophobicContact CZ2-CB 4.05Å; W319-F354 HydrophobicContact CZ3-CB 3.92Å; W319-L454 HydrophobicContact CB-CB 4.43Å; W319-L454 HydrophobicContact CE3-CD1 4.23Å; W319-L454 PolarHBondContact N-O 2.7Å; W319-L454 WeakPolarHBondContact O-CA 3.48Å; W319-L454 WeakPolarHBondContact O-CB 3.41Å; W319-L454 PolarHBondContact O-N 3.12Å; W319-V456 HydrophobicContact CE3-CG2 4.32Å
320	I	94.1	Very high	89.3	Confident	85 Å²	85	58.4 Å²	58.4	44%	0.436	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122	177.8	-55.4	171.2	0	0	0	108.3	F453	I320-F453 HydrophobicContact CD1-CD1 4.07Å; I320-F453 HydrophobicContact CD1-CE1 3.56Å; I320-F453 HydrophobicContact CD1-CZ 4.18Å; I320-F453 HydrophobicContact CG1-CD1 3.8Å; I320-F453 HydrophobicContact CG1-CE1 3.77Å; I320-F453 HydrophobicContact CG1-CG 4.48Å; I320-F453 HydrophobicContact CG1-CZ 4.41Å; I320-F453 HydrophobicContact CG2-CE1 4.28Å; I320-F453 HydrophobicContact CG2-CE2 4.18Å; I320-F453 HydrophobicContact CG2-CZ 4.07Å
321	I	90.9	Very high	89.3	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	103.6	179.9	-64.1	168.6	0	0	0	108.3	W319 P324 R329 F354 S451 L452 L454	W319-I321 HydrophobicContact CD2-CD1 4.02Å; W319-I321 HydrophobicContact CD2-CG1 3.99Å; W319-I321 HydrophobicContact CE3-CD1 4.16Å; W319-I321 HydrophobicContact CG-CG1 4.29Å; W319-I321 HydrophobicContact CH2-CD1 4.27Å; W319-I321 HydrophobicContact CZ2-CD1 4.07Å; W319-I321 HydrophobicContact CZ2-CG1 4.1Å; W319-I321 HydrophobicContact CZ3-CD1 4.28Å; I321-P324 HydrophobicContact CG2-CB 3.81Å; I321-R329 HydrophobicContact CG2-CB 4.49Å; I321-R329 HydrophobicContact CG2-CG 4.04Å; I321-F354 HydrophobicContact CD1-CB 3.54Å; I321-F354 HydrophobicContact CD1-CD1 3.87Å; I321-F354 HydrophobicContact CD1-CD2 3.82Å; I321-F354 HydrophobicContact CD1-CG 3.46Å; I321-F354 VanDerWaalsContact CD1-CG 3.46Å; I321-F354 HydrophobicContact CG2-CD1 4.12Å; I321-F354 HydrophobicContact CG2-CE1 4.29Å; I321-S451 CarbonylContact O-C 3.57Å; I321-S451 VanDerWaalsContact O-CA 3.31Å; I321-S451 WeakPolarHBondContact O-CA 3.45Å; I321-L452 HydrophobicContact CB-CB 4.26Å; I321-L452 HydrophobicContact CD1-CD2 4.38Å; I321-L452 PolarHBondContact N-O 3.17Å; I321-L452 PolarHBondContact O-N 3.09Å; I321-L454 HydrophobicContact CD1-CD1 3.6Å; I321-L454 HydrophobicContact CD1-CG 4.46Å
322	N	89.3	Confident	89.3	Confident	91 Å²	91	62.9 Å²	62.9	49%	0.487	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.5	176.7	-60.6	-38.5	0	0	0	110.5	S451	N322-S451 PolarHBondContact OD1-OG 3.4Å
323	N	84.4	Confident	89.3	Confident	70 Å²	70	61.8 Å²	61.8	37%	0.374	34%	0.343	S	S	.	.	S	Bend	trans	52.1	68.2	-178.2	-61.9	-52.4	0	0	0	112.4	T325 R326 S450	N323-T325 PolarHBondContact O-N 2.71Å; N323-R326 PolarHBondContact O-N 2.88Å; N323-S450 PolarHBondContact N-O 3.35Å; N323-S450 VanDerWaalsContact N-O 3.16Å
324	P	83.1	Confident	89.4	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.013	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.2	-171.3	25	-34	0	0	0	114	I321 F354 P356 L439 L447 S450 L452	I321-P324 HydrophobicContact CG2-CB 3.81Å; P324-F354 HydrophobicContact CB-CE1 3.84Å; P324-F354 HydrophobicContact CB-CZ 4.02Å; P324-F354 WeakPolarHBondContact O-CE1 3.37Å; P324-P356 WeakPolarHBondContact O-CB 3.15Å; P324-P356 VanDerWaalsContact O-CG 3.31Å; P324-P356 WeakPolarHBondContact O-CG 3.45Å; P324-L439 HydrophobicContact CB-CD1 4.4Å; P324-L439 HydrophobicContact CG-CB 4.44Å; P324-L447 HydrophobicContact CG-CD2 3.71Å; P324-S450 WeakPolarHBondContact CD-O 3.46Å; P324-L452 HydrophobicContact CB-CB 4.3Å; P324-L452 HydrophobicContact CG-CB 4.17Å
325	T	79	Confident	89.5	Confident	43 Å²	43	61.2 Å²	61.2	26%	0.264	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.1	-173.3	53.4	0	0	0	0	115.7	N323 L439 Y440	N323-T325 PolarHBondContact O-N 2.71Å; T325-L439 HydrophobicContact CG2-CB 3.89Å; T325-L439 WeakPolarHBondContact CG2-O 3.32Å; T325-Y440 HydrophobicContact CG2-CD1 3.71Å; T325-Y440 HydrophobicContact CG2-CD2 4.4Å; T325-Y440 HydrophobicContact CG2-CE1 3.83Å; T325-Y440 HydrophobicContact CG2-CG 4.01Å
326	R	74.8	Confident	89.3	Confident	185 Å²	185	62 Å²	62	70%	0.698	33%	0.328	S	S	*	.	S	Bend	trans	-90.9	-65.5	-170.9	-68.7	-171	178.6	-168.4	-0.2	113.8	N323	N323-R326 PolarHBondContact O-N 2.88Å
327	D	78.3	Confident	89	Confident	99 Å²	99	62 Å²	62	53%	0.529	33%	0.328	S	S	.	.	S	Bend	trans	-132.5	156.3	-167.8	-58.3	-55.5	0	0	0	110.4	R329	D327-R329 PolarHBondContact O-N 3.18Å
328	D	85.7	Confident	88.5	Confident	82 Å²	82	60.3 Å²	60.3	44%	0.439	32%	0.316	S	S	.	.			trans	-58	136.3	167.2	-72.2	-8.9	0	0	0	109.8	L353 F354 S355 P356	D328-L353 HydrophobicContact CB-CD1 4.09Å; D328-F354 CarbonylContact C-O 3.53Å; D328-F354 WeakPolarHBondContact CA-O 3.4Å; D328-S355 VanDerWaalsContact OD1-CA 3.22Å; D328-S355 WeakPolarHBondContact OD1-CA 3.47Å; D328-S355 WeakPolarHBondContact OD1-CB 3.5Å; D328-S355 PolarHBondContact OD1-OG 3.1Å; D328-P356 WeakPolarHBondContact OD1-CD 3.48Å
329	R	90.6	Very high	87.8	Confident	98 Å²	98	56.3 Å²	56.3	37%	0.37	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.4	178.6	-62.7	-59.8	-169.4	162.9	-0.6	109.7	W319 I321 D327 L353 F354	W319-R329 WeakPolarHBondContact CH2-O 3.35Å; W319-R329 HydrophobicContact CZ2-CB 4.11Å; W319-R329 WeakPolarHBondContact CZ2-O 3.41Å; I321-R329 HydrophobicContact CG2-CB 4.49Å; I321-R329 HydrophobicContact CG2-CG 4.04Å; D327-R329 PolarHBondContact O-N 3.18Å; R329-L353 WeakPolarHBondContact O-CA 3.4Å; R329-F354 PolarHBondContact N-O 2.88Å; R329-F354 PolarHBondContact O-N 3.5Å
330	S	91.8	Very high	87.4	Confident	97 Å²	97	55.4 Å²	55.4	68%	0.678	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	149.4	175.3	58.9	0	0	0	0	111.9	A352	S330-A352 CarbonylContact C-O 3.58Å; S330-A352 WeakPolarHBondContact CA-O 3.39Å
331	T	93.9	Very high	86.9	Confident	49 Å²	49	53.4 Å²	53.4	30%	0.301	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.7	169.3	-170.8	0	0	0	0	109.9	W319 A352	W319-T331 HydrophobicContact CD2-CG2 3.63Å; W319-T331 HydrophobicContact CE3-CG2 4.12Å; W319-T331 HydrophobicContact CG-CG2 3.86Å; W319-T331 HydrophobicContact CH2-CG2 4.33Å; W319-T331 HydrophobicContact CZ2-CG2 3.95Å; W319-T331 HydrophobicContact CZ3-CG2 4.45Å; T331-A352 HydrophobicContact CG2-CB 4.01Å; T331-A352 PolarHBondContact N-O 3.31Å; T331-A352 PolarHBondContact O-N 2.84Å
332	S	93.9	Very high	86.5	Confident	80 Å²	80	57.7 Å²	57.7	56%	0.559	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.9	173.9	61.9	0	0	0	0	110.4	W350	S332-W350 WeakPolarHBondContact CA-O 3.4Å
333	F	94.3	Very high	86	Confident	15 Å²	15	53.9 Å²	53.9	7%	0.066	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	168.4	177	64.1	-86.1	0	0	0	110.9	T335 T349 W350 A352 I387 V456 V458	F333-T335 HydrophobicContact CD2-CG2 3.86Å; F333-T335 HydrophobicContact CE2-CG2 3.67Å; F333-T349 WeakPolarHBondContact O-CA 3.22Å; F333-W350 HydrophobicContact CD1-CB 4.26Å; F333-W350 HydrophobicContact CD2-CB 4.33Å; F333-W350 HydrophobicContact CE1-CB 3.84Å; F333-W350 HydrophobicContact CE2-CB 3.92Å; F333-W350 AromaticContact CE2-CD1 3.78Å; F333-W350 AromaticContact CE2-CG 3.98Å; F333-W350 HydrophobicContact CE2-CG 3.98Å; F333-W350 HydrophobicContact CG-CB 4.49Å; F333-W350 HydrophobicContact CZ-CB 3.64Å; F333-W350 HydrophobicContact CZ-CG 4.02Å; F333-W350 PolarHBondContact N-O 2.93Å; F333-W350 PolarHBondContact O-N 2.86Å; F333-A352 HydrophobicContact CE1-CB 4.13Å; F333-I387 HydrophobicContact CZ-CG2 4.5Å; F333-V456 HydrophobicContact CE1-CB 4.32Å; F333-V456 HydrophobicContact CE1-CG1 4.02Å; F333-V456 HydrophobicContact CE2-CG1 4.4Å; F333-V456 HydrophobicContact CZ-CB 4.13Å; F333-V456 HydrophobicContact CZ-CG1 3.53Å; F333-V458 HydrophobicContact CE2-CG2 3.89Å; F333-V458 HydrophobicContact CZ-CG2 3.97Å
334	Q	92.9	Very high	85.7	Confident	114 Å²	114	52.3 Å²	52.3	53%	0.533	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.6	-178.7	-68.1	-175.2	-15.5	0	0	111.2	V348 T349	Q334-V348 VanDerWaalsContact CA-O 3.28Å; Q334-V348 WeakPolarHBondContact CA-O 3.35Å; Q334-T349 HydrophobicContact CG-CG2 4.41Å; Q334-T349 PolarHBondContact NE2-OG1 3.03Å
335	T	92.2	Very high	85.6	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	168.3	172.9	69.6	0	0	0	0	110.6	V314 F333 R347 V348 W350 V458	V314-T335 WeakPolarHBondContact O-CA 3.28Å; V314-T335 WeakPolarHBondContact O-CB 3.37Å; F333-T335 HydrophobicContact CD2-CG2 3.86Å; F333-T335 HydrophobicContact CE2-CG2 3.67Å; T335-R347 CarbonylContact O-C 3.57Å; T335-R347 VanDerWaalsContact O-CA 3.32Å; T335-R347 WeakPolarHBondContact O-CA 3.49Å; T335-R347 WeakPolarHBondContact O-CD 3.3Å; T335-V348 PolarHBondContact N-O 3.22Å; T335-V348 PolarHBondContact O-N 3.39Å; T335-W350 PolarHBondContact OG1-NE1 2.94Å; T335-V458 HydrophobicContact CG2-CB 4.21Å; T335-V458 HydrophobicContact CG2-CG2 4.3Å
336	Q	88.9	Confident	85.9	Confident	37 Å²	37	58.5 Å²	58.5	17%	0.173	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	151.8	165.5	-80.4	177.5	13.8	0	0	111.3	V314 G338	V314-Q336 HydrophobicContact CG1-CB 4.07Å; V314-Q336 HydrophobicContact CG1-CG 3.67Å; V314-Q336 PolarHBondContact O-N 2.86Å; Q336-G338 VanDerWaalsContact C-N 3.32Å
337	L	85.4	Confident	86.6	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.021	30%	0.301	C	S	.	.	S	Bend	trans	-67.2	-36.1	174.6	179.7	70.9	0	0	0	111.6	D343 K346 V348 D395 F396 F401 P460	L337-D343 HydrophobicContact CB-CB 4.31Å; L337-D343 HydrophobicContact CD2-CB 4.18Å; L337-K346 HydrophobicContact CB-CB 3.91Å; L337-K346 HydrophobicContact CD2-CB 4Å; L337-K346 HydrophobicContact CD2-CD 3.51Å; L337-K346 HydrophobicContact CD2-CG 4.41Å; L337-V348 HydrophobicContact CB-CG2 4.22Å; L337-V348 HydrophobicContact CD1-CG2 3.64Å; L337-D395 HydrophobicContact CD2-CB 4.35Å; L337-F396 HydrophobicContact CD1-CD1 3.52Å; L337-F396 HydrophobicContact CD1-CE1 3.95Å; L337-F401 HydrophobicContact CD1-CZ 4Å; L337-F401 WeakPolarHBondContact O-CE1 3.42Å; L337-P460 WeakPolarHBondContact O-CB 3.5Å
338	G	84.7	Confident	87.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.			trans	-158.7	168.5	-174.3	0	0	0	0	0	112.4	Q336 S340 Y462	Q336-G338 VanDerWaalsContact C-N 3.32Å; G338-S340 VanDerWaalsContact C-N 3.26Å; G338-S340 PolarHBondContact O-N 3.05Å; G338-Y462 VanDerWaalsContact CA-OH 3.3Å; G338-Y462 WeakPolarHBondContact CA-OH 3.41Å
339	P	82.1	Confident	87.5	Confident	8 Å²	8	48.9 Å²	48.9	5%	0.052	27%	0.268	C	S	.	.	S	Bend	trans	-70.6	-19.5	178	-12.5	27.7	0	0	0	114.1	M253 F286 W315 P460 Y462	M253-P339 HydrophobicContact CE-CB 3.4Å; M253-P339 HydrophobicContact CE-CG 3.92Å; M253-P339 HydrophobicContact SD-CB 3.78Å; M253-P339 HydrophobicContact SD-CG 4.24Å; F286-P339 HydrophobicContact CE1-CB 3.89Å; F286-P339 HydrophobicContact CZ-CB 3.87Å; F286-P339 HydrophobicContact CZ-CG 4.21Å; W315-P339 HydrophobicContact CH2-CB 3.68Å; W315-P339 HydrophobicContact CH2-CG 3.94Å; W315-P339 HydrophobicContact CZ3-CG 4.33Å; P339-P460 HydrophobicContact CG-CG 4.19Å; P339-Y462 VanDerWaalsContact CD-CE2 3.47Å; P339-Y462 VanDerWaalsContact CD-OH 3.22Å; P339-Y462 WeakPolarHBondContact CD-OH 3.38Å; P339-Y462 HydrophobicContact CG-CE2 4.17Å
340	S	85.3	Confident	87.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-77.2	144.1	-175.1	177.4	0	0	0	0	110.7	F286 G338 H342 D343	F286-S340 WeakPolarHBondContact O-CB 3.43Å; F286-S340 PolarHBondContact O-OG 3.11Å; G338-S340 VanDerWaalsContact C-N 3.26Å; G338-S340 PolarHBondContact O-N 3.05Å; S340-H342 PolarHBondContact O-N 2.94Å; S340-H342 WeakPolarHBondContact OG-CB 3.32Å; S340-H342 PolarHBondContact OG-N 3.48Å; S340-H342 VanDerWaalsContact OG-N 3.15Å; S340-D343 PolarHBondContact O-N 3.17Å
341	S	84	Confident	87.7	Confident	43 Å²	43	43.1 Å²	43.1	30%	0.301	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-71.1	-16.1	175	-65.2	0	0	0	0	111.8	P256 H287 D343 A344	P256-S341 WeakPolarHBondContact CD-OG 3.41Å; H287-S341 PolarHBondContact ND1-N 2.97Å; H287-S341 VanDerWaalsContact ND1-N 3.18Å; H287-S341 PolarHBondContact ND1-OG 3.05Å; S341-D343 PolarHBondContact O-N 3.22Å; S341-A344 WeakPolarHBondContact O-CB 3.37Å; S341-A344 PolarHBondContact O-N 3.39Å; S341-A344 VanDerWaalsContact O-N 3.1Å
342	H	81.9	Confident	87.7	Confident	92 Å²	92	40.9 Å²	40.9	43%	0.426	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-55.7	-39.1	171.7	-176.2	80.5	0	0	0	111.8	H287 S340	H287-H342 PolarHBondContact O-N 3.08Å; S340-H342 PolarHBondContact O-N 2.94Å; S340-H342 WeakPolarHBondContact OG-CB 3.32Å; S340-H342 PolarHBondContact OG-N 3.48Å; S340-H342 VanDerWaalsContact OG-N 3.15Å
343	D	79.2	Confident	87.6	Confident	11 Å²	11	39.7 Å²	39.7	6%	0.059	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-98.8	15.8	179.6	-63.8	-56.2	0	0	0	112.7	L337 S340 S341 S345 K346	L337-D343 HydrophobicContact CB-CB 4.31Å; L337-D343 HydrophobicContact CD2-CB 4.18Å; S340-D343 PolarHBondContact O-N 3.17Å; S341-D343 PolarHBondContact O-N 3.22Å; D343-S345 PolarHBondContact O-N 3.41Å; D343-S345 VanDerWaalsContact O-N 3.09Å; D343-K346 HydrophobicContact CB-CD 4.32Å; D343-K346 WeakPolarHBondContact O-CB 3.44Å; D343-K346 PolarHBondContact O-N 3.42Å; D343-K346 WeakPolarHBondContact OD1-CD 3.4Å; D343-K346 WeakPolarHBondContact OD1-CE 3.36Å; D343-K346 IonicContact OD1-NZ 2.87Å; D343-K346 PolarHBondContact OD1-NZ 2.87Å
344	A	78.2	Confident	87.4	Confident	38 Å²	38	39 Å²	39	31%	0.314	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.9	-175.3	0	0	0	0	0	114.3	S341 R347	S341-A344 WeakPolarHBondContact O-CB 3.37Å; S341-A344 PolarHBondContact O-N 3.39Å; S341-A344 VanDerWaalsContact O-N 3.1Å; A344-R347 PolarHBondContact O-NH1 3.37Å; A344-R347 PolarHBondContact O-NH2 3.17Å
345	S	81	Confident	87.1	Confident	107 Å²	107	33.6 Å²	33.6	75%	0.748	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.9	173.1	58	0	0	0	0	113	D343	D343-S345 PolarHBondContact O-N 3.41Å; D343-S345 VanDerWaalsContact O-N 3.09Å
346	K	85.9	Confident	86.5	Confident	67 Å²	67	34.2 Å²	34.2	29%	0.291	19%	0.186	S	C	.	.			trans	-85.1	135	-178.5	-58.8	179.7	-171.4	161.9	0	109.7	L337 D343 D395	L337-K346 HydrophobicContact CB-CB 3.91Å; L337-K346 HydrophobicContact CD2-CB 4Å; L337-K346 HydrophobicContact CD2-CD 3.51Å; L337-K346 HydrophobicContact CD2-CG 4.41Å; D343-K346 HydrophobicContact CB-CD 4.32Å; D343-K346 WeakPolarHBondContact O-CB 3.44Å; D343-K346 PolarHBondContact O-N 3.42Å; D343-K346 WeakPolarHBondContact OD1-CD 3.4Å; D343-K346 WeakPolarHBondContact OD1-CE 3.36Å; D343-K346 IonicContact OD1-NZ 2.87Å; D343-K346 PolarHBondContact OD1-NZ 2.87Å; K346-D395 HydrophobicContact CD-CB 4.45Å
347	R	88	Confident	85.4	Confident	121 Å²	121	37.6 Å²	37.6	46%	0.457	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.7	178.7	-68	-71.8	-179.9	-80.4	-4.8	109.2	T335 A344	T335-R347 CarbonylContact O-C 3.57Å; T335-R347 VanDerWaalsContact O-CA 3.32Å; T335-R347 WeakPolarHBondContact O-CA 3.49Å; T335-R347 WeakPolarHBondContact O-CD 3.3Å; A344-R347 PolarHBondContact O-NH1 3.37Å; A344-R347 PolarHBondContact O-NH2 3.17Å
348	V	90.3	Very high	84.1	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.7	173.7	-173.5	0	0	0	0	107.7	Q334 T335 L337 W350 P389 F396 F401	Q334-V348 VanDerWaalsContact CA-O 3.28Å; Q334-V348 WeakPolarHBondContact CA-O 3.35Å; T335-V348 PolarHBondContact N-O 3.22Å; T335-V348 PolarHBondContact O-N 3.39Å; L337-V348 HydrophobicContact CB-CG2 4.22Å; L337-V348 HydrophobicContact CD1-CG2 3.64Å; V348-W350 HydrophobicContact CB-CZ2 4.22Å; V348-W350 HydrophobicContact CG1-CD2 4.19Å; V348-W350 VanDerWaalsContact CG1-CE2 3.48Å; V348-W350 HydrophobicContact CG1-CH2 4.35Å; V348-W350 HydrophobicContact CG1-CZ2 3.57Å; V348-P389 HydrophobicContact CG1-CB 4.21Å; V348-F396 HydrophobicContact CG1-CE1 4.35Å; V348-F396 HydrophobicContact CG1-CZ 4.03Å; V348-F396 HydrophobicContact CG2-CE1 3.87Å; V348-F396 HydrophobicContact CG2-CZ 4.38Å; V348-F401 HydrophobicContact CG2-CZ 4.19Å
349	T	92.5	Very high	82.3	Confident	42 Å²	42	50.7 Å²	50.7	26%	0.258	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.3	172	-57	0	0	0	0	108.6	F333 Q334 A390	F333-T349 WeakPolarHBondContact O-CA 3.22Å; Q334-T349 HydrophobicContact CG-CG2 4.41Å; Q334-T349 PolarHBondContact NE2-OG1 3.03Å; T349-A390 HydrophobicContact CG2-CB 3.92Å; T349-A390 WeakPolarHBondContact O-CB 3.26Å; T349-A390 PolarHBondContact O-N 3.35Å
350	W	93.1	Very high	80.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	137.6	-178.7	-62.7	93.6	0	0	0	110.1	S332 F333 T335 V348 I387 P389 F401 V458	S332-W350 WeakPolarHBondContact CA-O 3.4Å; F333-W350 HydrophobicContact CD1-CB 4.26Å; F333-W350 HydrophobicContact CD2-CB 4.33Å; F333-W350 HydrophobicContact CE1-CB 3.84Å; F333-W350 HydrophobicContact CE2-CB 3.92Å; F333-W350 AromaticContact CE2-CD1 3.78Å; F333-W350 AromaticContact CE2-CG 3.98Å; F333-W350 HydrophobicContact CE2-CG 3.98Å; F333-W350 HydrophobicContact CG-CB 4.49Å; F333-W350 HydrophobicContact CZ-CB 3.64Å; F333-W350 HydrophobicContact CZ-CG 4.02Å; F333-W350 PolarHBondContact N-O 2.93Å; F333-W350 PolarHBondContact O-N 2.86Å; T335-W350 PolarHBondContact OG1-NE1 2.94Å; V348-W350 HydrophobicContact CB-CZ2 4.22Å; V348-W350 HydrophobicContact CG1-CD2 4.19Å; V348-W350 VanDerWaalsContact CG1-CE2 3.48Å; V348-W350 HydrophobicContact CG1-CH2 4.35Å; V348-W350 HydrophobicContact CG1-CZ2 3.57Å; W350-I387 HydrophobicContact CB-CG2 4.39Å; W350-I387 HydrophobicContact CD2-CG2 4.37Å; W350-I387 HydrophobicContact CE3-CG2 3.75Å; W350-I387 HydrophobicContact CZ3-CG2 4.47Å; W350-P389 HydrophobicContact CE3-CB 4.2Å; W350-P389 HydrophobicContact CH2-CB 4.31Å; W350-P389 HydrophobicContact CZ3-CB 3.97Å; W350-P389 HydrophobicContact CZ3-CG 4.23Å; W350-F401 HydrophobicContact CH2-CB 3.72Å; W350-F401 HydrophobicContact CH2-CD1 4.03Å; W350-F401 AromaticContact CH2-CD2 3.66Å; W350-F401 HydrophobicContact CH2-CD2 3.66Å; W350-F401 HydrophobicContact CH2-CE2 4.26Å; W350-F401 AromaticContact CH2-CG 3.53Å; W350-F401 HydrophobicContact CH2-CG 3.53Å; W350-F401 HydrophobicContact CZ2-CB 4.2Å; W350-F401 AromaticContact CZ2-CD1 3.69Å; W350-F401 HydrophobicContact CZ2-CD1 3.69Å; W350-F401 HydrophobicContact CZ2-CD2 4.05Å; W350-F401 AromaticContact CZ2-CE1 3.99Å; W350-F401 HydrophobicContact CZ2-CE1 3.99Å; W350-F401 HydrophobicContact CZ2-CE2 4.34Å; W350-F401 AromaticContact CZ2-CG 3.71Å; W350-F401 HydrophobicContact CZ2-CG 3.71Å; W350-F401 HydrophobicContact CZ2-CZ 4.31Å; W350-V458 HydrophobicContact CD2-CG2 4.32Å; W350-V458 HydrophobicContact CG-CG2 4.49Å; W350-V458 HydrophobicContact CH2-CG1 4.05Å; W350-V458 HydrophobicContact CZ2-CG1 3.51Å
351	N	93.6	Very high	78.3	Confident	75 Å²	75	63.2 Å²	63.2	40%	0.401	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.7	167.4	-65.2	-36.6	0	0	0	107.9	I387 T388 A390	N351-I387 WeakPolarHBondContact O-CA 3.15Å; N351-T388 PolarHBondContact N-O 3.3Å; N351-T388 PolarHBondContact O-N 3.42Å; N351-A390 WeakPolarHBondContact ND2-CB 3.37Å
352	A	93.5	Very high	76.3	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.008	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.1	173.1	0	0	0	0	0	109.6	W319 S330 T331 F333 I386 I387	W319-A352 HydrophobicContact CE3-CB 4.31Å; W319-A352 HydrophobicContact CH2-CB 4.11Å; W319-A352 HydrophobicContact CZ3-CB 3.76Å; S330-A352 CarbonylContact C-O 3.58Å; S330-A352 WeakPolarHBondContact CA-O 3.39Å; T331-A352 HydrophobicContact CG2-CB 4.01Å; T331-A352 PolarHBondContact N-O 3.31Å; T331-A352 PolarHBondContact O-N 2.84Å; F333-A352 HydrophobicContact CE1-CB 4.13Å; A352-I386 CarbonylContact C-O 3.59Å; A352-I386 WeakPolarHBondContact CA-O 3.47Å; A352-I387 HydrophobicContact CB-CG1 4.07Å
353	L	91.9	Very high	74.4	Confident	56 Å²	56	68.9 Å²	68.9	29%	0.293	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.5	176.6	177.9	69.3	0	0	0	108.7	D328 R329 I385 I386	D328-L353 HydrophobicContact CB-CD1 4.09Å; R329-L353 WeakPolarHBondContact O-CA 3.4Å; L353-I385 CarbonylContact O-C 3.47Å; L353-I385 WeakPolarHBondContact O-CA 3.39Å; L353-I386 HydrophobicContact CB-CB 4.46Å; L353-I386 PolarHBondContact N-O 3.17Å; L353-I386 PolarHBondContact O-N 3.3Å
354	F	90.8	Very high	72.6	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.8	170.3	171	-91.7	0	0	0	106.9	W319 I321 P324 D328 R329 P356 P383 I385 F433 L434 L439 L452	W319-F354 HydrophobicContact CH2-CB 3.46Å; W319-F354 VanDerWaalsContact CH2-CB 3.46Å; W319-F354 VanDerWaalsContact CH2-N 3.32Å; W319-F354 HydrophobicContact CZ2-CB 4.05Å; W319-F354 HydrophobicContact CZ3-CB 3.92Å; I321-F354 HydrophobicContact CD1-CB 3.54Å; I321-F354 HydrophobicContact CD1-CD1 3.87Å; I321-F354 HydrophobicContact CD1-CD2 3.82Å; I321-F354 HydrophobicContact CD1-CG 3.46Å; I321-F354 VanDerWaalsContact CD1-CG 3.46Å; I321-F354 HydrophobicContact CG2-CD1 4.12Å; I321-F354 HydrophobicContact CG2-CE1 4.29Å; P324-F354 HydrophobicContact CB-CE1 3.84Å; P324-F354 HydrophobicContact CB-CZ 4.02Å; P324-F354 WeakPolarHBondContact O-CE1 3.37Å; D328-F354 CarbonylContact C-O 3.53Å; D328-F354 WeakPolarHBondContact CA-O 3.4Å; R329-F354 PolarHBondContact N-O 2.88Å; R329-F354 PolarHBondContact O-N 3.5Å; F354-P356 HydrophobicContact CE1-CB 4.03Å; F354-P356 HydrophobicContact CE1-CG 4.44Å; F354-P356 HydrophobicContact CZ-CB 4.37Å; F354-P383 HydrophobicContact CE2-CB 4.33Å; F354-P383 HydrophobicContact CZ-CB 4.45Å; F354-I385 HydrophobicContact CB-CG1 4.22Å; F354-I385 HydrophobicContact CD2-CD1 3.97Å; F354-I385 HydrophobicContact CD2-CG1 3.62Å; F354-I385 HydrophobicContact CG-CG1 4.4Å; F354-F433 HydrophobicContact CD2-CE1 4.41Å; F354-F433 HydrophobicContact CE2-CE1 4.14Å; F354-L434 HydrophobicContact CE2-CD1 4.48Å; F354-L439 HydrophobicContact CZ-CD1 4.29Å; F354-L452 HydrophobicContact CE2-CD2 3.9Å; F354-L452 HydrophobicContact CZ-CD2 4.15Å
355	S	87.1	Confident	70.5	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	115.3	-177.8	-174.4	0	0	0	0	107.5	D328 R357 P383 R384	D328-S355 VanDerWaalsContact OD1-CA 3.22Å; D328-S355 WeakPolarHBondContact OD1-CA 3.47Å; D328-S355 WeakPolarHBondContact OD1-CB 3.5Å; D328-S355 PolarHBondContact OD1-OG 3.1Å; S355-R357 PolarHBondContact O-N 3.33Å; S355-R357 VanDerWaalsContact O-N 3.12Å; S355-R357 WeakPolarHBondContact OG-CG 3.49Å; S355-P383 WeakPolarHBondContact O-CA 3.31Å; S355-R384 PolarHBondContact N-O 3.31Å; S355-R384 PolarHBondContact O-N 3.21Å
356	P	78.5	Confident	68.5	Low	15 Å²	15	85 Å²	85	10%	0.097	42%	0.417	C	S	.	.			trans	-71	-4.5	-176.3	26.1	-32.8	0	0	0	114.3	P324 D328 F354 W358	P324-P356 WeakPolarHBondContact O-CB 3.15Å; P324-P356 VanDerWaalsContact O-CG 3.31Å; P324-P356 WeakPolarHBondContact O-CG 3.45Å; D328-P356 WeakPolarHBondContact OD1-CD 3.48Å; F354-P356 HydrophobicContact CE1-CB 4.03Å; F354-P356 HydrophobicContact CE1-CG 4.44Å; F354-P356 HydrophobicContact CZ-CB 4.37Å; P356-W358 PolarHBondContact O-N 3.32Å
357	R	67	Low	66.2	Low	109 Å²	109	91.8 Å²	91.8	41%	0.411	44%	0.442	S	S	.	.			trans	-35.5	99.7	-150.3	-81.9	-164	-61.3	-175.9	14.3	114.7	S355 G381 R382 R384	S355-R357 PolarHBondContact O-N 3.33Å; S355-R357 VanDerWaalsContact O-N 3.12Å; S355-R357 WeakPolarHBondContact OG-CG 3.49Å; R357-G381 CarbonylContact O-C 3.52Å; R357-G381 WeakPolarHBondContact O-CA 3.32Å; R357-R382 PolarHBondContact O-N 2.89Å; R357-R384 VanDerWaalsContact CZ-NH2 3.28Å
358	W	56.5	Low	63.9	Low	145 Å²	145	92.1 Å²	92.1	55%	0.549	46%	0.458	S	S	.	.	S	Bend		-100.9	126.6	125.7	-66.9	78.7	0	0	0	105.5	P356 G381	P356-W358 PolarHBondContact O-N 3.32Å; W358-G381 PolarHBondContact NE1-O 3.02Å
359	L	48.3	Very low	61.1	Low	134 Å²	134	100.8 Å²	100.8	70%	0.702	50%	0.499	S	S	*	.			trans	-65.9	157.4	-172.7	-96.2	158.3	0	0	0	113
360	P	41.2	Very low	58.8	Low	76 Å²	76	105.1 Å²	105.1	49%	0.494	53%	0.53	S	S	.	.				-111.2	167.8	-109.6	37.3	-26.1	0	0	0	114.5	S362	P360-S362 WeakPolarHBondContact CG-OG 3.33Å; P360-S362 PolarHBondContact O-N 3.37Å
361	L	41.6	Very low	56.5	Low	195 Å²	195	108.9 Å²	108.9	100%	1.021	57%	0.569	S	S	*	*	S	Bend	trans	-66.6	29.5	166.2	-88.5	160.7	0	0	0	114.2
362	S	43.2	Very low	53.7	Low	89 Å²	89	109.8 Å²	109.8	62%	0.622	59%	0.587	S	S	*	*			trans	-137.7	61.3	176.9	59.5	0	0	0	0	113	P360	P360-S362 WeakPolarHBondContact CG-OG 3.33Å; P360-S362 PolarHBondContact O-N 3.37Å
363	M	40	Very low	50.8	Low	165 Å²	165	118.6 Å²	118.6	81%	0.813	63%	0.63	S	S	*	*			trans	-102.8	76.8	141.8	-77.7	-145	-159.7	0	0	109
364	R	41.8	Very low	48	Very low	224 Å²	224	124.4 Å²	124.4	85%	0.845	66%	0.656	S	S	*	*			trans	-105.1	107.6	146.7	-83.7	-169.1	-179.3	-176.3	1.2	106.3	M366	R364-M366 PolarHBondContact O-N 3.06Å
365	P	34.8	Very low	45.3	Very low	103 Å²	103	129 Å²	129	67%	0.669	69%	0.686	S	S	*	*			trans	-68.1	105	167.8	26.2	-26.1	0	0	0	107.4
366	M	37.9	Very low	42.7	Very low	166 Å²	166	135 Å²	135	82%	0.818	72%	0.723	S	S	*	*	S	Bend	trans	-78.1	114.6	149.5	-75.9	-87.4	169.1	0	0	104.2	R364	R364-M366 PolarHBondContact O-N 3.06Å
367	Y	38.1	Very low	40.7	Very low	210 Å²	210	146 Å²	146	82%	0.824	76%	0.763	S	S	*	*	S	Bend	trans	88.4	98.6	-169.9	-60.7	-82.6	0	0	0	115.6	E369	Y367-E369 PolarHBondContact O-N 2.91Å
368	T	39.3	Very low	39.4	Very low	129 Å²	129	146.6 Å²	146.6	79%	0.791	78%	0.778	S	S	*	*			trans	-62.9	104.1	154.6	43.8	0	0	0	0	109.2
369	E	32.3	Very low	38.4	Very low	183 Å²	183	148.4 Å²	148.4	86%	0.855	79%	0.792	S	S	*	*			trans	-115.4	111.6	151.7	-76.4	-156	158.9	0	0	109.1	Y367 G371	Y367-E369 PolarHBondContact O-N 2.91Å; E369-G371 PolarHBondContact O-N 2.78Å
370	S	44.2	Very low	38.5	Very low	132 Å²	132	143.8 Å²	143.8	92%	0.923	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	109.6	174	-59.8	0	0	0	0	109.3
371	G	44.9	Very low	39.5	Very low	79 Å²	79	141.2 Å²	141.2	81%	0.814	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	155.4	-12.2	166.7	0	0	0	0	0	117.8	E369	E369-G371 PolarHBondContact O-N 2.78Å
372	A	34.7	Very low	41.1	Very low	94 Å²	94	138.3 Å²	138.3	78%	0.777	74%	0.74	S	S	*	*	S	Bend	trans	-86.2	124.3	179.2	0	0	0	0	0	111.6	Q374	A372-Q374 PolarHBondContact O-N 2.5Å
373	M	33.3	Very low	43	Very low	186 Å²	186	134.8 Å²	134.8	92%	0.916	72%	0.715	S	S	*	*			trans	-38.5	118.2	170.7	-157.3	170.1	177.5	0	0	110.4	P375	M373-P375 WeakPolarHBondContact O-CD 3.48Å; M373-P375 VanDerWaalsContact O-N 3.12Å
374	Q	33.3	Very low	45.2	Very low	178 Å²	178	128.9 Å²	128.9	83%	0.832	68%	0.684	S	S	*	*			trans	-55	117.9	178.8	-154.2	165.7	19.6	0	0	107.7	A372 T376	A372-Q374 PolarHBondContact O-N 2.5Å; Q374-T376 PolarHBondContact O-N 3.01Å
375	P	33.4	Very low	47.5	Very low	98 Å²	98	118.2 Å²	118.2	64%	0.636	64%	0.643	S	S	*	*			trans	-60.7	121.7	174.9	23	-29.3	0	0	0	106.6	M373 R377	M373-P375 WeakPolarHBondContact O-CD 3.48Å; M373-P375 VanDerWaalsContact O-N 3.12Å; P375-R377 PolarHBondContact O-N 3.43Å
376	T	32.8	Very low	50.1	Low	126 Å²	126	115 Å²	115	77%	0.773	62%	0.621	S	S	*	*			trans	-44.2	131	170.2	32.3	0	0	0	0	108.7	Q374 V378	Q374-T376 PolarHBondContact O-N 3.01Å; T376-V378 PolarHBondContact O-N 3.49Å
377	R	35.9	Very low	52.6	Low	246 Å²	246	107.1 Å²	107.1	93%	0.928	58%	0.582	S	S	*	*			trans	-49.3	107	171.1	-86	179.5	171.4	173.1	-2.8	107.7	P375 E379	P375-R377 PolarHBondContact O-N 3.43Å; R377-E379 PolarHBondContact O-N 3.13Å; R377-E379 VanDerWaalsContact O-N 3.09Å
378	V	40.6	Very low	55.1	Low	121 Å²	121	99.1 Å²	99.1	73%	0.733	56%	0.555	S	S	*	*			trans	-69.6	108.8	169.6	-176.1	0	0	0	0	105.7	T376	T376-V378 PolarHBondContact O-N 3.49Å
379	E	35.6	Very low	57.5	Low	182 Å²	182	95.7 Å²	95.7	85%	0.85	53%	0.534	S	S	*	.			trans	-49.2	138.9	167.3	-75	176.2	137.5	0	0	110.2	R377 G381	R377-E379 PolarHBondContact O-N 3.13Å; R377-E379 VanDerWaalsContact O-N 3.09Å; E379-G381 PolarHBondContact O-N 3.08Å
380	G	50.6	Low	60.1	Low	37 Å²	37	89.1 Å²	89.1	38%	0.381	51%	0.511	S	S	.	.			trans	71.5	43.2	141.4	0	0	0	0	0	117.7	R382	G380-R382 PolarHBondContact O-N 3.12Å
381	G	60.4	Low	61.6	Low	23 Å²	23	87 Å²	87	24%	0.237	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-63	122.9	170.7	0	0	0	0	0	110.2	R357 W358 E379	R357-G381 CarbonylContact O-C 3.52Å; R357-G381 WeakPolarHBondContact O-CA 3.32Å; W358-G381 PolarHBondContact NE1-O 3.02Å; E379-G381 PolarHBondContact O-N 3.08Å
382	R	74.9	Confident	62.6	Low	134 Å²	134	88.9 Å²	88.9	51%	0.506	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-97.8	152.6	177.2	-63	178.7	-179.2	-163.3	-4.7	110.5	R357 G380 R384 D432	R357-R382 PolarHBondContact O-N 2.89Å; G380-R382 PolarHBondContact O-N 3.12Å; R382-R384 PolarHBondContact O-N 3.02Å; R382-D432 IonicContact CZ-OD1 3.41Å; R382-D432 IonicContact NH1-OD1 2.68Å; R382-D432 PolarHBondContact NH1-OD1 3.14Å
383	P	83.7	Confident	64.1	Low	14 Å²	14	86.5 Å²	86.5	9%	0.091	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-54	142.3	167.8	-20.6	31.8	0	0	0	110	F354 S355 F433 L434 L439	F354-P383 HydrophobicContact CE2-CB 4.33Å; F354-P383 HydrophobicContact CZ-CB 4.45Å; S355-P383 WeakPolarHBondContact O-CA 3.31Å; P383-F433 HydrophobicContact CB-CD1 4.24Å; P383-F433 HydrophobicContact CB-CE1 4.37Å; P383-L434 HydrophobicContact CB-CB 4.35Å; P383-L434 HydrophobicContact CG-CB 4.3Å; P383-L439 HydrophobicContact CG-CD1 4.21Å
384	R	86.4	Confident	65.5	Low	41 Å²	41	82 Å²	82	16%	0.155	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151	177.7	67.1	178.2	-172.1	165.3	12	111.8	S355 R357 R382 T427 E428	S355-R384 PolarHBondContact N-O 3.31Å; S355-R384 PolarHBondContact O-N 3.21Å; R357-R384 VanDerWaalsContact CZ-NH2 3.28Å; R382-R384 PolarHBondContact O-N 3.02Å; R384-T427 WeakPolarHBondContact CA-OG1 3.34Å; R384-E428 WeakPolarHBondContact CD-OE1 3.43Å; R384-E428 IonicContact CZ-OE1 3.31Å; R384-E428 IonicContact NE-OE1 3.05Å; R384-E428 IonicContact NH1-OE1 2.75Å; R384-E428 PolarHBondContact NH1-OE1 2.8Å
385	I	89.9	Confident	67	Low	0 Å²	0	77.8 Å²	77.8	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.8	170.5	-67.9	178.2	0	0	0	109.1	L353 F354 I387 V405 F423 S426 T427 F433 L454	L353-I385 CarbonylContact O-C 3.47Å; L353-I385 WeakPolarHBondContact O-CA 3.39Å; F354-I385 HydrophobicContact CB-CG1 4.22Å; F354-I385 HydrophobicContact CD2-CD1 3.97Å; F354-I385 HydrophobicContact CD2-CG1 3.62Å; F354-I385 HydrophobicContact CG-CG1 4.4Å; I385-I387 HydrophobicContact CG2-CD1 4.1Å; I385-I387 HydrophobicContact CG2-CG1 3.85Å; I385-V405 HydrophobicContact CD1-CG1 4.05Å; I385-V405 HydrophobicContact CD1-CG2 4.31Å; I385-V405 HydrophobicContact CG2-CG2 4.36Å; I385-F423 HydrophobicContact CG2-CZ 4.1Å; I385-S426 WeakPolarHBondContact O-CA 3.49Å; I385-S426 PolarHBondContact O-OG 3.36Å; I385-T427 HydrophobicContact CB-CG2 3.95Å; I385-T427 PolarHBondContact N-OG1 3.33Å; I385-T427 PolarHBondContact O-N 3.27Å; I385-T427 PolarHBondContact O-OG1 3.33Å; I385-F433 HydrophobicContact CD1-CE1 3.68Å; I385-F433 HydrophobicContact CD1-CE2 3.99Å; I385-F433 HydrophobicContact CD1-CZ 3.22Å; I385-F433 HydrophobicContact CG1-CD1 4.49Å; I385-F433 HydrophobicContact CG1-CE1 3.68Å; I385-F433 HydrophobicContact CG1-CZ 3.77Å; I385-L454 HydrophobicContact CD1-CD1 3.49Å; I385-L454 VanDerWaalsContact CD1-CD1 3.49Å
386	I	89.9	Confident	68.7	Low	37 Å²	37	74.9 Å²	74.9	19%	0.19	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.8	175.1	-57.6	173.9	0	0	0	107	A352 L353 T388	A352-I386 CarbonylContact C-O 3.59Å; A352-I386 WeakPolarHBondContact CA-O 3.47Å; L353-I386 HydrophobicContact CB-CB 4.46Å; L353-I386 PolarHBondContact N-O 3.17Å; L353-I386 PolarHBondContact O-N 3.3Å; I386-T388 HydrophobicContact CG2-CG2 3.93Å
387	I	91.1	Very high	70.3	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	112.8	176.9	-59.3	165	0	0	0	108.3	F333 W350 N351 A352 I385 K403 V405 F423 Q425 V456	F333-I387 HydrophobicContact CZ-CG2 4.5Å; W350-I387 HydrophobicContact CB-CG2 4.39Å; W350-I387 HydrophobicContact CD2-CG2 4.37Å; W350-I387 HydrophobicContact CE3-CG2 3.75Å; W350-I387 HydrophobicContact CZ3-CG2 4.47Å; N351-I387 WeakPolarHBondContact O-CA 3.15Å; A352-I387 HydrophobicContact CB-CG1 4.07Å; I385-I387 HydrophobicContact CG2-CD1 4.1Å; I385-I387 HydrophobicContact CG2-CG1 3.85Å; I387-K403 HydrophobicContact CB-CG 4.15Å; I387-K403 HydrophobicContact CD1-CB 4Å; I387-K403 HydrophobicContact CD1-CG 4.27Å; I387-K403 HydrophobicContact CG2-CG 4.01Å; I387-V405 HydrophobicContact CD1-CG2 4.12Å; I387-F423 HydrophobicContact CB-CE2 4.36Å; I387-F423 HydrophobicContact CD1-CE2 3.79Å; I387-F423 HydrophobicContact CD1-CZ 3.56Å; I387-F423 HydrophobicContact CG1-CE2 4.17Å; I387-F423 HydrophobicContact CG1-CZ 4.26Å; I387-Q425 PolarHBondContact N-O 3.43Å; I387-V456 HydrophobicContact CD1-CG1 3.39Å; I387-V456 HydrophobicContact CD1-CG2 4.38Å; I387-V456 HydrophobicContact CG1-CG1 4.41Å
388	T	90.4	Very high	72	Confident	42 Å²	42	61.6 Å²	61.6	26%	0.258	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.1	-176.5	49.9	0	0	0	0	110.9	N351 I386 Q425	N351-T388 PolarHBondContact N-O 3.3Å; N351-T388 PolarHBondContact O-N 3.42Å; I386-T388 HydrophobicContact CG2-CG2 3.93Å; T388-Q425 HydrophobicContact CG2-CG 4.16Å
389	P	90.1	Very high	73.8	Confident	56 Å²	56	56.6 Å²	56.6	36%	0.364	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	137.7	172.3	29.7	-32.1	0	0	0	109.4	V348 W350 T391 F396	V348-P389 HydrophobicContact CG1-CB 4.21Å; W350-P389 HydrophobicContact CE3-CB 4.2Å; W350-P389 HydrophobicContact CH2-CB 4.31Å; W350-P389 HydrophobicContact CZ3-CB 3.97Å; W350-P389 HydrophobicContact CZ3-CG 4.23Å; P389-T391 VanDerWaalsContact C-N 3.3Å; P389-T391 PolarHBondContact O-N 3.03Å; P389-F396 HydrophobicContact CB-CE2 4.21Å
390	A	85.2	Confident	76	Confident	45 Å²	45	50 Å²	50	37%	0.372	32%	0.323	S	S	.	.	S	Bend	trans	-71.7	-25.5	-177.5	0	0	0	0	0	113.1	T349 N351	T349-A390 HydrophobicContact CG2-CB 3.92Å; T349-A390 WeakPolarHBondContact O-CB 3.26Å; T349-A390 PolarHBondContact O-N 3.35Å; N351-A390 WeakPolarHBondContact ND2-CB 3.37Å
391	T	75.6	Confident	77.8	Confident	89 Å²	89	48.8 Å²	48.8	55%	0.546	31%	0.307	S	S	.	.	S	Bend	trans	-138.6	132.7	-179.3	53.7	0	0	0	0	108.7	P389 F396	P389-T391 VanDerWaalsContact C-N 3.3Å; P389-T391 PolarHBondContact O-N 3.03Å; T391-F396 WeakPolarHBondContact O-CE2 3.46Å; T391-F396 WeakPolarHBondContact O-CZ 3.43Å
392	S	67.1	Low	79.2	Confident	118 Å²	118	50.2 Å²	50.2	83%	0.825	31%	0.308	S	S	*	.			trans	-85.9	113.3	168.6	54.9	0	0	0	0	109.9
393	S	65.8	Low	80	Confident	44 Å²	44	44.5 Å²	44.5	31%	0.308	29%	0.286	S	S	.	.			trans	-105	148.4	172.3	-177.3	0	0	0	0	110.8	D395 F396	S393-D395 PolarHBondContact O-N 3.15Å; S393-D395 WeakPolarHBondContact OG-CB 3.13Å; S393-D395 VanDerWaalsContact OG-CG 3.28Å; S393-D395 PolarHBondContact OG-N 3.28Å; S393-D395 VanDerWaalsContact OG-N 3.08Å; S393-D395 PolarHBondContact OG-OD2 3.18Å; S393-F396 WeakPolarHBondContact O-CB 3.5Å; S393-F396 WeakPolarHBondContact O-CG 3.45Å; S393-F396 PolarHBondContact O-N 3.29Å; S393-F396 VanDerWaalsContact O-N 3.07Å
394	A	61.8	Low	80.4	Confident	92 Å²	92	43.8 Å²	43.8	76%	0.76	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58.7	-22.1	166	0	0	0	0	0	112	F396 A397	A394-F396 PolarHBondContact O-N 2.66Å; A394-F396 VanDerWaalsContact O-N 3.12Å; A394-A397 VanDerWaalsContact O-CB 3.26Å; A394-A397 WeakPolarHBondContact O-CB 3.4Å; A394-A397 PolarHBondContact O-N 3.13Å; A394-A397 VanDerWaalsContact O-N 3.08Å
395	D	65.9	Low	80.8	Confident	88 Å²	88	41.9 Å²	41.9	47%	0.471	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-61.2	-16.4	173.6	-62.5	-52.5	0	0	0	113.5	L337 K346 S393 A397	L337-D395 HydrophobicContact CD2-CB 4.35Å; K346-D395 HydrophobicContact CD-CB 4.45Å; S393-D395 PolarHBondContact O-N 3.15Å; S393-D395 WeakPolarHBondContact OG-CB 3.13Å; S393-D395 VanDerWaalsContact OG-CG 3.28Å; S393-D395 PolarHBondContact OG-N 3.28Å; S393-D395 VanDerWaalsContact OG-N 3.08Å; S393-D395 PolarHBondContact OG-OD2 3.18Å; D395-A397 PolarHBondContact O-N 3.3Å
396	F	68.5	Low	81.1	Confident	37 Å²	37	41.9 Å²	41.9	16%	0.162	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-80.7	-7.7	177.9	-55.6	-14.2	0	0	0	112.8	L337 V348 P389 T391 S393 A394 G398 V399	L337-F396 HydrophobicContact CD1-CD1 3.52Å; L337-F396 HydrophobicContact CD1-CE1 3.95Å; V348-F396 HydrophobicContact CG1-CE1 4.35Å; V348-F396 HydrophobicContact CG1-CZ 4.03Å; V348-F396 HydrophobicContact CG2-CE1 3.87Å; V348-F396 HydrophobicContact CG2-CZ 4.38Å; P389-F396 HydrophobicContact CB-CE2 4.21Å; T391-F396 WeakPolarHBondContact O-CE2 3.46Å; T391-F396 WeakPolarHBondContact O-CZ 3.43Å; S393-F396 WeakPolarHBondContact O-CB 3.5Å; S393-F396 WeakPolarHBondContact O-CG 3.45Å; S393-F396 PolarHBondContact O-N 3.29Å; S393-F396 VanDerWaalsContact O-N 3.07Å; A394-F396 PolarHBondContact O-N 2.66Å; A394-F396 VanDerWaalsContact O-N 3.12Å; F396-G398 PolarHBondContact O-N 3.04Å; F396-G398 VanDerWaalsContact O-N 3.14Å; F396-V399 PolarHBondContact O-N 3.1Å
397	A	66.6	Low	81.3	Confident	68 Å²	68	40.1 Å²	40.1	56%	0.562	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	122.2	-176.5	0	0	0	0	0	110.8	A394 D395	A394-A397 VanDerWaalsContact O-CB 3.26Å; A394-A397 WeakPolarHBondContact O-CB 3.4Å; A394-A397 PolarHBondContact O-N 3.13Å; A394-A397 VanDerWaalsContact O-N 3.08Å; D395-A397 PolarHBondContact O-N 3.3Å
398	G	71.9	Confident	81.3	Confident	26 Å²	26	41.4 Å²	41.4	27%	0.268	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	2.9	178.6	0	0	0	0	0	115.9	F396 Y462 Q463	F396-G398 PolarHBondContact O-N 3.04Å; F396-G398 VanDerWaalsContact O-N 3.14Å; G398-Y462 WeakPolarHBondContact O-CA 3.36Å; G398-Q463 PolarHBondContact O-N 2.68Å
399	V	77.6	Confident	81.3	Confident	16 Å²	16	39.4 Å²	39.4	10%	0.097	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.9	172.3	-163.9	0	0	0	0	110	F396 F401 P460 Y462	F396-V399 PolarHBondContact O-N 3.1Å; V399-F401 HydrophobicContact CB-CE2 4.43Å; V399-F401 HydrophobicContact CB-CZ 4.27Å; V399-F401 HydrophobicContact CG1-CE1 4.01Å; V399-F401 HydrophobicContact CG1-CE2 4.28Å; V399-F401 HydrophobicContact CG1-CZ 3.86Å; V399-P460 HydrophobicContact CG1-CB 3.69Å; V399-Y462 HydrophobicContact CB-CD1 4.42Å; V399-Y462 HydrophobicContact CB-CE1 4.44Å; V399-Y462 HydrophobicContact CG1-CD1 4.39Å; V399-Y462 HydrophobicContact CG1-CE1 4.27Å; V399-Y462 HydrophobicContact CG2-CD1 3.72Å; V399-Y462 HydrophobicContact CG2-CE1 3.5Å
400	N	83	Confident	81.2	Confident	43 Å²	43	41.6 Å²	41.6	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	153	166.1	-166.6	-13.2	0	0	0	108.9	P460 L461 Q463	N400-P460 CarbonylContact O-C 3.6Å; N400-P460 WeakPolarHBondContact O-CA 3.18Å; N400-L461 PolarHBondContact N-O 3.16Å; N400-L461 PolarHBondContact O-N 3.15Å; N400-L461 VanDerWaalsContact O-O 3.13Å; N400-Q463 HydrophobicContact CB-CB 4.31Å; N400-Q463 HydrophobicContact CB-CG 4.41Å
401	F	87.3	Confident	81.1	Confident	12 Å²	12	41.8 Å²	41.8	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.8	178.8	-60.3	-86.3	0	0	0	109.2	L337 V348 W350 V399 K403 V458 K459 P460	L337-F401 HydrophobicContact CD1-CZ 4Å; L337-F401 WeakPolarHBondContact O-CE1 3.42Å; V348-F401 HydrophobicContact CG2-CZ 4.19Å; W350-F401 HydrophobicContact CH2-CB 3.72Å; W350-F401 HydrophobicContact CH2-CD1 4.03Å; W350-F401 AromaticContact CH2-CD2 3.66Å; W350-F401 HydrophobicContact CH2-CD2 3.66Å; W350-F401 HydrophobicContact CH2-CE2 4.26Å; W350-F401 AromaticContact CH2-CG 3.53Å; W350-F401 HydrophobicContact CH2-CG 3.53Å; W350-F401 HydrophobicContact CZ2-CB 4.2Å; W350-F401 AromaticContact CZ2-CD1 3.69Å; W350-F401 HydrophobicContact CZ2-CD1 3.69Å; W350-F401 HydrophobicContact CZ2-CD2 4.05Å; W350-F401 AromaticContact CZ2-CE1 3.99Å; W350-F401 HydrophobicContact CZ2-CE1 3.99Å; W350-F401 HydrophobicContact CZ2-CE2 4.34Å; W350-F401 AromaticContact CZ2-CG 3.71Å; W350-F401 HydrophobicContact CZ2-CG 3.71Å; W350-F401 HydrophobicContact CZ2-CZ 4.31Å; V399-F401 HydrophobicContact CB-CE2 4.43Å; V399-F401 HydrophobicContact CB-CZ 4.27Å; V399-F401 HydrophobicContact CG1-CE1 4.01Å; V399-F401 HydrophobicContact CG1-CE2 4.28Å; V399-F401 HydrophobicContact CG1-CZ 3.86Å; F401-K403 WeakPolarHBondContact O-CD 3.26Å; F401-K403 WeakPolarHBondContact O-CE 3.4Å; F401-K403 PolarHBondContact O-NZ 2.91Å; F401-V458 HydrophobicContact CB-CG1 3.92Å; F401-V458 HydrophobicContact CD1-CG1 3.76Å; F401-V458 HydrophobicContact CG-CG1 4.2Å; F401-K459 CarbonylContact C-O 3.55Å; F401-K459 WeakPolarHBondContact CA-O 3.27Å; F401-P460 HydrophobicContact CD1-CB 3.97Å; F401-P460 HydrophobicContact CE1-CB 3.87Å
402	Q	90.1	Very high	81.1	Confident	52 Å²	52	42.7 Å²	42.7	24%	0.243	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.6	164.6	178.3	-179.6	77.7	0	0	108.3	K459 L461	Q402-K459 HydrophobicContact CB-CB 4.32Å; Q402-K459 PolarHBondContact N-O 3.26Å; Q402-K459 PolarHBondContact O-N 2.83Å; Q402-K459 VanDerWaalsContact OE1-CE 3.3Å; Q402-L461 HydrophobicContact CB-CD1 3.74Å; Q402-L461 HydrophobicContact CB-CG 4.39Å
403	K	91.7	Very high	81.6	Confident	14 Å²	14	39.9 Å²	39.9	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.8	176.4	-63.7	91.1	-172.2	168.1	0	108.7	I387 F401 N422 F423 H424 V457 V458	I387-K403 HydrophobicContact CB-CG 4.15Å; I387-K403 HydrophobicContact CD1-CB 4Å; I387-K403 HydrophobicContact CD1-CG 4.27Å; I387-K403 HydrophobicContact CG2-CG 4.01Å; F401-K403 WeakPolarHBondContact O-CD 3.26Å; F401-K403 WeakPolarHBondContact O-CE 3.4Å; F401-K403 PolarHBondContact O-NZ 2.91Å; K403-N422 CarbonylContact O-C 3.46Å; K403-N422 WeakPolarHBondContact O-CA 3.37Å; K403-F423 WeakPolarHBondContact CA-O 3.48Å; K403-F423 HydrophobicContact CB-CD2 4.08Å; K403-F423 HydrophobicContact CB-CE2 3.83Å; K403-F423 HydrophobicContact CB-CZ 4.22Å; K403-F423 PolarHBondContact N-O 3.45Å; K403-F423 PolarHBondContact O-N 3.02Å; K403-F423 VanDerWaalsContact O-O 3.13Å; K403-H424 WeakPolarHBondContact CD-O 3.43Å; K403-H424 VanDerWaalsContact CE-O 3.27Å; K403-H424 WeakPolarHBondContact CE-O 3.42Å; K403-H424 PolarHBondContact NZ-O 3.2Å; K403-V457 CarbonylContact C-O 3.6Å; K403-V458 HydrophobicContact CG-CG2 4.3Å
404	T	93.6	Very high	82.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125	179.3	-61.6	0	0	0	0	108.8	L406 V420 Y421 N422 V457 K459	T404-L406 HydrophobicContact CG2-CD2 3.81Å; T404-V420 HydrophobicContact CG2-CG1 3.53Å; T404-Y421 CarbonylContact C-O 3.54Å; T404-Y421 WeakPolarHBondContact CA-O 3.33Å; T404-N422 WeakPolarHBondContact CB-OD1 3.41Å; T404-N422 WeakPolarHBondContact CG2-OD1 3.43Å; T404-N422 PolarHBondContact OG1-OD1 3.49Å; T404-V457 PolarHBondContact N-O 3.07Å; T404-V457 PolarHBondContact O-N 3.48Å; T404-K459 WeakPolarHBondContact OG1-CE 3.49Å; T404-K459 PolarHBondContact OG1-NZ 3.26Å
405	V	94.3	Very high	83.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.5	173.2	175.1	0	0	0	0	108.1	I385 I387 V407 Y421 F423 F433 L454 V456	I385-V405 HydrophobicContact CD1-CG1 4.05Å; I385-V405 HydrophobicContact CD1-CG2 4.31Å; I385-V405 HydrophobicContact CG2-CG2 4.36Å; I387-V405 HydrophobicContact CD1-CG2 4.12Å; V405-V407 HydrophobicContact CG1-CG2 4.46Å; V405-Y421 PolarHBondContact N-O 3.5Å; V405-Y421 PolarHBondContact O-N 2.92Å; V405-F423 HydrophobicContact CB-CE1 4.14Å; V405-F423 HydrophobicContact CG2-CE1 3.48Å; V405-F423 VanDerWaalsContact CG2-CE1 3.48Å; V405-F423 HydrophobicContact CG2-CZ 3.55Å; V405-F433 HydrophobicContact CG1-CE2 4.09Å; V405-L454 HydrophobicContact CG1-CB 4.43Å; V405-L454 HydrophobicContact CG1-CD1 4.4Å; V405-L454 HydrophobicContact CG1-CD2 4.06Å; V405-V456 HydrophobicContact CG2-CG2 4.43Å
406	L	95.2	Very high	84.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.3	171.2	-47.2	177.5	0	0	0	107.8	V217 L311 T404 M408 V417 V420 L454 H455 V457	V217-L406 HydrophobicContact CG1-CD1 3.68Å; V217-L406 HydrophobicContact CG2-CD1 4.16Å; V217-L406 HydrophobicContact CG2-CD2 3.99Å; L311-L406 HydrophobicContact CD2-CD1 3.54Å; T404-L406 HydrophobicContact CG2-CD2 3.81Å; L406-M408 HydrophobicContact CB-SD 4.35Å; L406-V417 HydrophobicContact CB-CG1 4.31Å; L406-V417 HydrophobicContact CD2-CG1 4.48Å; L406-V420 HydrophobicContact CD2-CB 4.17Å; L406-V420 HydrophobicContact CD2-CG1 3.79Å; L406-V420 HydrophobicContact CD2-CG2 3.59Å; L406-L454 CarbonylContact O-C 3.47Å; L406-L454 VanDerWaalsContact O-CA 3.29Å; L406-L454 WeakPolarHBondContact O-CA 3.37Å; L406-H455 HydrophobicContact CB-CB 4.1Å; L406-H455 HydrophobicContact CD1-CB 4.16Å; L406-H455 HydrophobicContact CG-CB 4.41Å; L406-H455 PolarHBondContact N-O 3.07Å; L406-H455 PolarHBondContact O-N 3.44Å; L406-V457 HydrophobicContact CD1-CG2 4.14Å; L406-V457 HydrophobicContact CG-CG2 4.48Å
407	V	93.9	Very high	85.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.4	173.8	-177.6	0	0	0	0	108.1	V405 K418 H419 Y421 F433 L434 Y446 L452 L454	V405-V407 HydrophobicContact CG1-CG2 4.46Å; V407-K418 PolarHBondContact O-N 2.89Å; V407-H419 HydrophobicContact CB-CB 4.17Å; V407-H419 HydrophobicContact CG2-CB 4.37Å; V407-H419 PolarHBondContact N-O 3.15Å; V407-H419 PolarHBondContact O-N 3.03Å; V407-Y421 HydrophobicContact CG2-CD2 3.93Å; V407-Y421 HydrophobicContact CG2-CE2 3.68Å; V407-F433 HydrophobicContact CG2-CE2 4.34Å; V407-L434 HydrophobicContact CG1-CD2 4.1Å; V407-L434 HydrophobicContact CG2-CD2 4.06Å; V407-Y446 HydrophobicContact CG1-CD1 4.1Å; V407-L452 HydrophobicContact CG1-CD1 4.2Å; V407-L454 HydrophobicContact CB-CD2 4.3Å; V407-L454 HydrophobicContact CG1-CD2 4.31Å; V407-L454 HydrophobicContact CG2-CD2 3.82Å
408	M	92.3	Very high	87	Confident	27 Å²	27	34.3 Å²	34.3	13%	0.133	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.7	179.6	-45.9	-61.6	-66.9	0	0	109.8	L406 L415 V416 V417 F453	L406-M408 HydrophobicContact CB-SD 4.35Å; M408-L415 HydrophobicContact CB-CD1 3.63Å; M408-L415 HydrophobicContact CB-CD2 4.39Å; M408-L415 HydrophobicContact CB-CG 3.98Å; M408-L415 HydrophobicContact CE-CD2 4.08Å; M408-L415 HydrophobicContact CE-CG 3.87Å; M408-V416 CarbonylContact C-O 3.59Å; M408-V416 VanDerWaalsContact CA-O 3.3Å; M408-V416 WeakPolarHBondContact CA-O 3.36Å; M408-V417 HydrophobicContact CE-CB 4.5Å; M408-V417 HydrophobicContact CE-CG2 3.64Å; M408-V417 HydrophobicContact SD-CB 4.19Å; M408-V417 HydrophobicContact SD-CG2 3.42Å; M408-V417 WeakPolarHBondContact SD-CG2 3.48Å; M408-F453 HydrophobicContact CB-CB 3.84Å; M408-F453 HydrophobicContact CG-CB 4.37Å; M408-F453 PolarHBondContact N-O 2.81Å
409	A	90.1	Very high	87.9	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.7	175	0	0	0	0	0	109.8	V416 K418 E445	A409-V416 PolarHBondContact N-O 3.49Å; A409-V416 PolarHBondContact O-N 2.91Å; A409-K418 HydrophobicContact CB-CB 3.84Å; A409-K418 HydrophobicContact CB-CD 3.87Å; A409-K418 HydrophobicContact CB-CG 4.44Å; A409-E445 VanDerWaalsContact CB-O 3.23Å; A409-E445 WeakPolarHBondContact CB-O 3.18Å
410	Q	87.1	Confident	88.6	Confident	102 Å²	102	35.5 Å²	35.5	48%	0.477	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	116.3	170.9	-168	174.6	21.7	0	0	109.1	K414 I448	Q410-K414 CarbonylContact C-O 3.56Å; Q410-K414 WeakPolarHBondContact CA-O 3.46Å; Q410-I448 HydrophobicContact CB-CD1 3.84Å; Q410-I448 HydrophobicContact CB-CG1 3.81Å
411	Q	82.8	Confident	89	Confident	49 Å²	49	35.3 Å²	35.3	23%	0.229	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123	172.2	-69	-172.6	-11.8	0	0	108.6	A155 G413 K414 V416	A155-Q411 HydrophobicContact CB-CB 3.57Å; A155-Q411 HydrophobicContact CB-CG 4.43Å; Q411-G413 PolarHBondContact O-N 2.95Å; Q411-G413 VanDerWaalsContact O-N 3.12Å; Q411-K414 PolarHBondContact N-O 3.5Å; Q411-K414 PolarHBondContact O-N 3.44Å; Q411-V416 HydrophobicContact CB-CG2 3.84Å; Q411-V416 HydrophobicContact CG-CG2 3.73Å
412	H	77.6	Confident	89.2	Confident	108 Å²	108	37.6 Å²	37.6	50%	0.5	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	35.9	179.2	-57.6	97.4	0	0	0	114.4	K414	H412-K414 VanDerWaalsContact C-N 3.32Å; H412-K414 PolarHBondContact O-N 2.92Å
413	G	75.9	Confident	89.1	Confident	58 Å²	58	35.2 Å²	35.2	60%	0.598	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	-9	179.7	0	0	0	0	0	115.2	Q411	Q411-G413 PolarHBondContact O-N 2.95Å; Q411-G413 VanDerWaalsContact O-N 3.12Å
414	K	81.1	Confident	88.6	Confident	77 Å²	77	39 Å²	39	34%	0.335	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	145.8	176.1	-67.8	-173.2	177.9	-174.9	0	111.6	D157 Q410 Q411 H412 V416	D157-K414 IonicContact OD1-NZ 2.69Å; D157-K414 PolarHBondContact OD1-NZ 3.2Å; D157-K414 WeakPolarHBondContact OD2-CE 3.17Å; D157-K414 IonicContact OD2-NZ 2.95Å; D157-K414 PolarHBondContact OD2-NZ 3.47Å; Q410-K414 CarbonylContact C-O 3.56Å; Q410-K414 WeakPolarHBondContact CA-O 3.46Å; Q411-K414 PolarHBondContact N-O 3.5Å; Q411-K414 PolarHBondContact O-N 3.44Å; H412-K414 VanDerWaalsContact C-N 3.32Å; H412-K414 PolarHBondContact O-N 2.92Å; K414-V416 HydrophobicContact CB-CG1 4.48Å
415	L	87.3	Confident	87.6	Confident	81 Å²	81	44.5 Å²	44.5	42%	0.424	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.5	172.4	-171.9	71	0	0	0	108.9	M408 I448	M408-L415 HydrophobicContact CB-CD1 3.63Å; M408-L415 HydrophobicContact CB-CD2 4.39Å; M408-L415 HydrophobicContact CB-CG 3.98Å; M408-L415 HydrophobicContact CE-CD2 4.08Å; M408-L415 HydrophobicContact CE-CG 3.87Å; L415-I448 HydrophobicContact CD1-CD1 3.3Å
416	V	91.2	Very high	86.9	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147	-178.6	-63.1	0	0	0	0	111.2	A155 Y185 N189 M408 A409 Q411 K414 K418	A155-V416 HydrophobicContact CB-CG1 3.82Å; A155-V416 HydrophobicContact CB-CG2 4.28Å; Y185-V416 HydrophobicContact CE2-CG1 4.32Å; N189-V416 WeakPolarHBondContact OD1-CA 3.49Å; N189-V416 WeakPolarHBondContact OD1-CB 3.19Å; M408-V416 CarbonylContact C-O 3.59Å; M408-V416 VanDerWaalsContact CA-O 3.3Å; M408-V416 WeakPolarHBondContact CA-O 3.36Å; A409-V416 PolarHBondContact N-O 3.49Å; A409-V416 PolarHBondContact O-N 2.91Å; Q411-V416 HydrophobicContact CB-CG2 3.84Å; Q411-V416 HydrophobicContact CG-CG2 3.73Å; K414-V416 HydrophobicContact CB-CG1 4.48Å; V416-K418 PolarHBondContact O-N 3.39Å
417	V	92.8	Very high	86	Confident	8 Å²	8	45.4 Å²	45.4	5%	0.048	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	114.5	169	-179.2	0	0	0	0	107.9	W188 N189 V217 L406 M408 V420	W188-V417 HydrophobicContact CB-CB 3.95Å; W188-V417 HydrophobicContact CB-CG1 3.96Å; W188-V417 HydrophobicContact CD2-CG1 4.36Å; W188-V417 HydrophobicContact CE3-CG1 4.13Å; W188-V417 HydrophobicContact CG-CG1 4.36Å; W188-V417 WeakPolarHBondContact O-CB 3.2Å; W188-V417 WeakPolarHBondContact O-CG2 3.49Å; N189-V417 PolarHBondContact ND2-O 3.39Å; N189-V417 PolarHBondContact OD1-N 3.49Å; V217-V417 HydrophobicContact CG1-CG2 4.18Å; L406-V417 HydrophobicContact CB-CG1 4.31Å; L406-V417 HydrophobicContact CD2-CG1 4.48Å; M408-V417 HydrophobicContact CE-CB 4.5Å; M408-V417 HydrophobicContact CE-CG2 3.64Å; M408-V417 HydrophobicContact SD-CB 4.19Å; M408-V417 HydrophobicContact SD-CG2 3.42Å; M408-V417 WeakPolarHBondContact SD-CG2 3.48Å; V417-V420 HydrophobicContact CG1-CG2 3.66Å
418	K	90.7	Very high	84.9	Confident	43 Å²	43	51.1 Å²	51.1	19%	0.187	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-32.1	178.4	-172.9	-178.1	166.1	84.9	0	112.5	W188 V407 A409 V416 E445 Y446	W188-K418 VanDerWaalsContact CZ3-O 3.27Å; W188-K418 WeakPolarHBondContact CZ3-O 3.36Å; V407-K418 PolarHBondContact O-N 2.89Å; A409-K418 HydrophobicContact CB-CB 3.84Å; A409-K418 HydrophobicContact CB-CD 3.87Å; A409-K418 HydrophobicContact CB-CG 4.44Å; V416-K418 PolarHBondContact O-N 3.39Å; K418-E445 WeakPolarHBondContact CE-OE1 3.25Å; K418-E445 IonicContact NZ-OE1 3.8Å; K418-E445 PolarHBondContact NZ-OE1 3.34Å; K418-E445 IonicContact NZ-OE2 3.38Å; K418-E445 PolarHBondContact NZ-OE2 3.21Å; K418-Y446 HydrophobicContact CD-CD1 4.43Å; K418-Y446 HydrophobicContact CD-CE1 4.08Å; K418-Y446 VanDerWaalsContact CE-CZ 3.46Å; K418-Y446 WeakPolarHBondContact CE-OH 3.19Å
419	H	91.2	Very high	83.8	Confident	46 Å²	46	54 Å²	54	21%	0.213	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.2	178.3	-71	-81.8	0	0	0	112.1	V407 Y421 Y446	V407-H419 HydrophobicContact CB-CB 4.17Å; V407-H419 HydrophobicContact CG2-CB 4.37Å; V407-H419 PolarHBondContact N-O 3.15Å; V407-H419 PolarHBondContact O-N 3.03Å; H419-Y421 HydrophobicContact CB-CD2 4.27Å; H419-Y421 HydrophobicContact CB-CE2 3.58Å; H419-Y446 AromaticContact CD2-CE1 3.48Å; H419-Y446 VanDerWaalsContact CD2-CE1 3.48Å; H419-Y446 WeakPolarHBondContact CD2-CE1 3.25Å; H419-Y446 AromaticContact NE2-CE1 3.7Å; H419-Y446 AromaticContact NE2-CZ 3.76Å; H419-Y446 PolarHBondContact NE2-OH 2.94Å
420	V	92.3	Very high	82.5	Confident	21 Å²	21	58 Å²	58	13%	0.127	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	115.8	177	179.2	0	0	0	0	108.9	W188 T404 L406 V417	W188-V420 HydrophobicContact CD2-CB 4.45Å; W188-V420 HydrophobicContact CD2-CG2 3.51Å; W188-V420 VanDerWaalsContact CE2-CG2 3.42Å; W188-V420 HydrophobicContact CE3-CG2 3.93Å; W188-V420 HydrophobicContact CG-CG2 3.91Å; W188-V420 HydrophobicContact CH2-CB 4.11Å; W188-V420 HydrophobicContact CH2-CG2 4.07Å; W188-V420 HydrophobicContact CZ2-CB 3.74Å; W188-V420 HydrophobicContact CZ2-CG2 3.72Å; W188-V420 HydrophobicContact CZ3-CG2 4.2Å; T404-V420 HydrophobicContact CG2-CG1 3.53Å; L406-V420 HydrophobicContact CD2-CB 4.17Å; L406-V420 HydrophobicContact CD2-CG1 3.79Å; L406-V420 HydrophobicContact CD2-CG2 3.59Å; V417-V420 HydrophobicContact CG1-CG2 3.66Å
421	Y	91.6	Very high	81.1	Confident	39 Å²	39	55 Å²	55	15%	0.153	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.2	179.9	-62.3	-81.7	0	0	0	110.6	T404 V405 V407 H419 F433 L434	T404-Y421 CarbonylContact C-O 3.54Å; T404-Y421 WeakPolarHBondContact CA-O 3.33Å; V405-Y421 PolarHBondContact N-O 3.5Å; V405-Y421 PolarHBondContact O-N 2.92Å; V407-Y421 HydrophobicContact CG2-CD2 3.93Å; V407-Y421 HydrophobicContact CG2-CE2 3.68Å; H419-Y421 HydrophobicContact CB-CD2 4.27Å; H419-Y421 HydrophobicContact CB-CE2 3.58Å; Y421-F433 HydrophobicContact CD1-CD2 4.15Å; Y421-F433 AromaticContact CD2-CD2 3.54Å; Y421-F433 HydrophobicContact CD2-CD2 3.54Å; Y421-F433 AromaticContact CD2-CE2 3.68Å; Y421-F433 HydrophobicContact CD2-CE2 3.68Å; Y421-F433 HydrophobicContact CE1-CD2 4.36Å; Y421-F433 AromaticContact CE2-CD2 3.76Å; Y421-F433 HydrophobicContact CE2-CD2 3.76Å; Y421-F433 AromaticContact CE2-CE2 3.93Å; Y421-F433 HydrophobicContact CE2-CE2 3.93Å; Y421-F433 AromaticContact CG-CD2 3.73Å; Y421-F433 HydrophobicContact CG-CD2 3.73Å; Y421-F433 HydrophobicContact CG-CE2 4.26Å; Y421-L434 PolarHBondContact OH-N 3.22Å
422	N	90.3	Very high	80.6	Confident	61 Å²	61	57.1 Å²	57.1	33%	0.326	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	112.3	-175.7	-62	-60.8	0	0	0	112.3	K403 T404 N430	K403-N422 CarbonylContact O-C 3.46Å; K403-N422 WeakPolarHBondContact O-CA 3.37Å; T404-N422 WeakPolarHBondContact CB-OD1 3.41Å; T404-N422 WeakPolarHBondContact CG2-OD1 3.43Å; T404-N422 PolarHBondContact OG1-OD1 3.49Å; N422-N430 VanDerWaalsContact C-ND2 3.3Å; N422-N430 PolarHBondContact O-ND2 3.18Å
423	F	87.4	Confident	80.9	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	165.6	-176.4	52.5	-88.9	0	0	0	112.6	I385 I387 K403 V405 S426 T427	I385-F423 HydrophobicContact CG2-CZ 4.1Å; I387-F423 HydrophobicContact CB-CE2 4.36Å; I387-F423 HydrophobicContact CD1-CE2 3.79Å; I387-F423 HydrophobicContact CD1-CZ 3.56Å; I387-F423 HydrophobicContact CG1-CE2 4.17Å; I387-F423 HydrophobicContact CG1-CZ 4.26Å; K403-F423 WeakPolarHBondContact CA-O 3.48Å; K403-F423 HydrophobicContact CB-CD2 4.08Å; K403-F423 HydrophobicContact CB-CE2 3.83Å; K403-F423 HydrophobicContact CB-CZ 4.22Å; K403-F423 PolarHBondContact N-O 3.45Å; K403-F423 PolarHBondContact O-N 3.02Å; K403-F423 VanDerWaalsContact O-O 3.13Å; V405-F423 HydrophobicContact CB-CE1 4.14Å; V405-F423 HydrophobicContact CG2-CE1 3.48Å; V405-F423 VanDerWaalsContact CG2-CE1 3.48Å; V405-F423 HydrophobicContact CG2-CZ 3.55Å; F423-S426 WeakPolarHBondContact CB-O 3.24Å; F423-T427 HydrophobicContact CD1-CG2 3.61Å; F423-T427 HydrophobicContact CE1-CG2 3.35Å; F423-T427 HydrophobicContact CE2-CG2 4.45Å; F423-T427 HydrophobicContact CG-CG2 4.27Å; F423-T427 HydrophobicContact CZ-CG2 3.8Å
424	H	81.8	Confident	81.3	Confident	94 Å²	94	49.7 Å²	49.7	44%	0.435	25%	0.253	S	S	.	.	S	Bend	trans	-91.5	-39.3	-179.6	-63.2	85.3	0	0	0	113.1	K403 E429	K403-H424 WeakPolarHBondContact CD-O 3.43Å; K403-H424 VanDerWaalsContact CE-O 3.27Å; K403-H424 WeakPolarHBondContact CE-O 3.42Å; K403-H424 PolarHBondContact NZ-O 3.2Å; H424-E429 WeakPolarHBondContact CB-OE2 3.16Å; H424-E429 IonicContact CG-OE2 3.12Å; H424-E429 PolarHBondContact N-OE2 2.66Å; H424-E429 IonicContact ND1-OE2 2.81Å; H424-E429 PolarHBondContact ND1-OE2 3.01Å
425	Q	73.9	Confident	81.1	Confident	116 Å²	116	48.3 Å²	48.3	54%	0.542	26%	0.256	S	S	.	.	S	Bend	trans	-136.3	-44.7	180	-174.8	176.6	0	0	0	111.3	I387 T388 E429	I387-Q425 PolarHBondContact N-O 3.43Å; T388-Q425 HydrophobicContact CG2-CG 4.16Å; Q425-E429 WeakPolarHBondContact CA-OE1 3.43Å; Q425-E429 WeakPolarHBondContact CB-OE1 3.31Å; Q425-E429 PolarHBondContact N-OE1 3.11Å
426	S	78.1	Confident	80.6	Confident	13 Å²	13	52.3 Å²	52.3	9%	0.091	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-137.8	150.9	178.4	-176.4	0	0	0	0	112	I385 F423 E428 E429	I385-S426 WeakPolarHBondContact O-CA 3.49Å; I385-S426 PolarHBondContact O-OG 3.36Å; F423-S426 WeakPolarHBondContact CB-O 3.24Å; S426-E428 PolarHBondContact O-N 3.14Å; S426-E428 VanDerWaalsContact O-N 3.13Å; S426-E428 PolarHBondContact OG-N 2.97Å; S426-E429 PolarHBondContact N-OE1 2.75Å; S426-E429 WeakPolarHBondContact O-CB 3.34Å; S426-E429 WeakPolarHBondContact O-CG 3.48Å; S426-E429 PolarHBondContact O-N 3.47Å
427	T	76.5	Confident	80	Confident	6 Å²	6	52.8 Å²	52.8	4%	0.037	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-61.4	-14.2	170.2	55.6	0	0	0	0	114	R384 I385 F423 E429 N430 G431 F433	R384-T427 WeakPolarHBondContact CA-OG1 3.34Å; I385-T427 HydrophobicContact CB-CG2 3.95Å; I385-T427 PolarHBondContact N-OG1 3.33Å; I385-T427 PolarHBondContact O-N 3.27Å; I385-T427 PolarHBondContact O-OG1 3.33Å; F423-T427 HydrophobicContact CD1-CG2 3.61Å; F423-T427 HydrophobicContact CE1-CG2 3.35Å; F423-T427 HydrophobicContact CE2-CG2 4.45Å; F423-T427 HydrophobicContact CG-CG2 4.27Å; F423-T427 HydrophobicContact CZ-CG2 3.8Å; T427-E429 PolarHBondContact O-N 3.06Å; T427-N430 PolarHBondContact O-N 3.41Å; T427-G431 PolarHBondContact O-N 2.9Å; T427-F433 HydrophobicContact CG2-CB 3.94Å; T427-F433 HydrophobicContact CG2-CD1 4.27Å; T427-F433 HydrophobicContact CG2-CD2 3.76Å; T427-F433 HydrophobicContact CG2-CE2 4.38Å; T427-F433 HydrophobicContact CG2-CG 3.71Å
428	E	70.3	Confident	79.3	Confident	120 Å²	120	56.5 Å²	56.5	56%	0.561	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61.4	-25.7	173.2	-69.2	179.7	-174.3	0	0	112.2	R384 S426 N430 G431	R384-E428 WeakPolarHBondContact CD-OE1 3.43Å; R384-E428 IonicContact CZ-OE1 3.31Å; R384-E428 IonicContact NE-OE1 3.05Å; R384-E428 IonicContact NH1-OE1 2.75Å; R384-E428 PolarHBondContact NH1-OE1 2.8Å; S426-E428 PolarHBondContact O-N 3.14Å; S426-E428 VanDerWaalsContact O-N 3.13Å; S426-E428 PolarHBondContact OG-N 2.97Å; E428-N430 VanDerWaalsContact C-N 3.3Å; E428-N430 PolarHBondContact O-N 3.48Å; E428-G431 PolarHBondContact O-N 3.06Å
429	E	69.8	Low	78.8	Confident	88 Å²	88	55.1 Å²	55.1	41%	0.411	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-64.8	-31.7	177.6	-66.4	162.8	-146.9	0	0	113.5	H424 Q425 S426 T427	H424-E429 WeakPolarHBondContact CB-OE2 3.16Å; H424-E429 IonicContact CG-OE2 3.12Å; H424-E429 PolarHBondContact N-OE2 2.66Å; H424-E429 IonicContact ND1-OE2 2.81Å; H424-E429 PolarHBondContact ND1-OE2 3.01Å; Q425-E429 WeakPolarHBondContact CA-OE1 3.43Å; Q425-E429 WeakPolarHBondContact CB-OE1 3.31Å; Q425-E429 PolarHBondContact N-OE1 3.11Å; S426-E429 PolarHBondContact N-OE1 2.75Å; S426-E429 WeakPolarHBondContact O-CB 3.34Å; S426-E429 WeakPolarHBondContact O-CG 3.48Å; S426-E429 PolarHBondContact O-N 3.47Å; T427-E429 PolarHBondContact O-N 3.06Å
430	N	63.3	Low	78	Confident	83 Å²	83	59.7 Å²	59.7	44%	0.444	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-103.1	-2.8	-176.1	-64.1	-23.3	0	0	0	113.3	N422 T427 E428 D432	N422-N430 VanDerWaalsContact C-ND2 3.3Å; N422-N430 PolarHBondContact O-ND2 3.18Å; T427-N430 PolarHBondContact O-N 3.41Å; E428-N430 VanDerWaalsContact C-N 3.3Å; E428-N430 PolarHBondContact O-N 3.48Å; N430-D432 PolarHBondContact O-N 3.33Å
431	G	58.4	Low	77.4	Confident	39 Å²	39	66.5 Å²	66.5	40%	0.402	33%	0.33	S	S	.	.	S	Bend	trans	34.4	65	176	0	0	0	0	0	116.3	T427 E428	T427-G431 PolarHBondContact O-N 2.9Å; E428-G431 PolarHBondContact O-N 3.06Å
432	D	71.8	Confident	76.5	Confident	95 Å²	95	74.6 Å²	74.6	51%	0.508	36%	0.361	S	S	.	.			trans	-176.1	23	163.6	-87.2	-25.3	0	0	0	113.4	R382 N430 L434 A435	R382-D432 IonicContact CZ-OD1 3.41Å; R382-D432 IonicContact NH1-OD1 2.68Å; R382-D432 PolarHBondContact NH1-OD1 3.14Å; N430-D432 PolarHBondContact O-N 3.33Å; D432-L434 PolarHBondContact O-N 3.07Å; D432-L434 VanDerWaalsContact O-N 3.1Å; D432-A435 HydrophobicContact CB-CB 4.35Å; D432-A435 PolarHBondContact O-N 3.05Å
433	F	83.3	Confident	75.9	Confident	7 Å²	7	77.4 Å²	77.4	3%	0.031	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	117.9	-178.1	178.1	-104.2	0	0	0	112	F354 P383 I385 V405 V407 Y421 T427 A435	F354-F433 HydrophobicContact CD2-CE1 4.41Å; F354-F433 HydrophobicContact CE2-CE1 4.14Å; P383-F433 HydrophobicContact CB-CD1 4.24Å; P383-F433 HydrophobicContact CB-CE1 4.37Å; I385-F433 HydrophobicContact CD1-CE1 3.68Å; I385-F433 HydrophobicContact CD1-CE2 3.99Å; I385-F433 HydrophobicContact CD1-CZ 3.22Å; I385-F433 HydrophobicContact CG1-CD1 4.49Å; I385-F433 HydrophobicContact CG1-CE1 3.68Å; I385-F433 HydrophobicContact CG1-CZ 3.77Å; V405-F433 HydrophobicContact CG1-CE2 4.09Å; V407-F433 HydrophobicContact CG2-CE2 4.34Å; Y421-F433 HydrophobicContact CD1-CD2 4.15Å; Y421-F433 AromaticContact CD2-CD2 3.54Å; Y421-F433 HydrophobicContact CD2-CD2 3.54Å; Y421-F433 AromaticContact CD2-CE2 3.68Å; Y421-F433 HydrophobicContact CD2-CE2 3.68Å; Y421-F433 HydrophobicContact CE1-CD2 4.36Å; Y421-F433 AromaticContact CE2-CD2 3.76Å; Y421-F433 HydrophobicContact CE2-CD2 3.76Å; Y421-F433 AromaticContact CE2-CE2 3.93Å; Y421-F433 HydrophobicContact CE2-CE2 3.93Å; Y421-F433 AromaticContact CG-CD2 3.73Å; Y421-F433 HydrophobicContact CG-CD2 3.73Å; Y421-F433 HydrophobicContact CG-CE2 4.26Å; T427-F433 HydrophobicContact CG2-CB 3.94Å; T427-F433 HydrophobicContact CG2-CD1 4.27Å; T427-F433 HydrophobicContact CG2-CD2 3.76Å; T427-F433 HydrophobicContact CG2-CE2 4.38Å; T427-F433 HydrophobicContact CG2-CG 3.71Å; F433-A435 PolarHBondContact O-N 3.25Å; F433-A435 VanDerWaalsContact O-N 3.1Å
434	L	83.5	Confident	75.7	Confident	2 Å²	2	78 Å²	78	1%	0.01	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	29.3	-177.3	-65	179.8	0	0	0	113.6	F354 P383 V407 Y421 D432 E436 A437 L439 Y446 L452	F354-L434 HydrophobicContact CE2-CD1 4.48Å; P383-L434 HydrophobicContact CB-CB 4.35Å; P383-L434 HydrophobicContact CG-CB 4.3Å; V407-L434 HydrophobicContact CG1-CD2 4.1Å; V407-L434 HydrophobicContact CG2-CD2 4.06Å; Y421-L434 PolarHBondContact OH-N 3.22Å; D432-L434 PolarHBondContact O-N 3.07Å; D432-L434 VanDerWaalsContact O-N 3.1Å; L434-E436 VanDerWaalsContact C-N 3.28Å; L434-E436 PolarHBondContact O-N 3.01Å; L434-A437 HydrophobicContact CB-CB 3.93Å; L434-A437 HydrophobicContact CD2-CB 3.94Å; L434-A437 HydrophobicContact CG-CB 4.47Å; L434-A437 PolarHBondContact O-N 3.03Å; L434-A437 VanDerWaalsContact O-N 3.1Å; L434-L439 HydrophobicContact CD1-CD1 4.35Å; L434-Y446 HydrophobicContact CD2-CD1 3.79Å; L434-Y446 HydrophobicContact CD2-CE1 4.01Å; L434-L452 HydrophobicContact CD1-CD1 4.38Å; L434-L452 HydrophobicContact CD1-CD2 3.84Å
435	A	77.3	Confident	75.8	Confident	49 Å²	49	78.4 Å²	78.4	41%	0.405	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-37.2	-177.9	0	0	0	0	0	112.6	D432 F433	D432-A435 HydrophobicContact CB-CB 4.35Å; D432-A435 PolarHBondContact O-N 3.05Å; F433-A435 PolarHBondContact O-N 3.25Å; F433-A435 VanDerWaalsContact O-N 3.1Å
436	E	76.4	Confident	76.4	Confident	165 Å²	165	73.1 Å²	73.1	77%	0.771	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.4	178.4	-59.7	-178.8	172.8	0	0	113.2	L434 N438	L434-E436 VanDerWaalsContact C-N 3.28Å; L434-E436 PolarHBondContact O-N 3.01Å; E436-N438 PolarHBondContact O-N 3.1Å
437	A	78.7	Confident	76.8	Confident	12 Å²	12	73.4 Å²	73.4	10%	0.099	36%	0.362	C	S	.	.			trans	-85.5	111.6	-173.7	0	0	0	0	0	111.4	L434 L439 Y446	L434-A437 HydrophobicContact CB-CB 3.93Å; L434-A437 HydrophobicContact CD2-CB 3.94Å; L434-A437 HydrophobicContact CG-CB 4.47Å; L434-A437 PolarHBondContact O-N 3.03Å; L434-A437 VanDerWaalsContact O-N 3.1Å; A437-L439 HydrophobicContact CB-CD2 4.09Å; A437-L439 HydrophobicContact CB-CG 4.41Å; A437-L439 PolarHBondContact O-N 3.39Å; A437-Y446 HydrophobicContact CB-CD1 3.78Å; A437-Y446 HydrophobicContact CB-CD2 3.53Å; A437-Y446 HydrophobicContact CB-CE1 3.94Å; A437-Y446 HydrophobicContact CB-CE2 3.75Å; A437-Y446 HydrophobicContact CB-CG 3.57Å
438	N	78.4	Confident	77.3	Confident	86 Å²	86	74 Å²	74	46%	0.46	37%	0.365	S	S	.	.			trans	-82.1	82.6	173.1	-167.2	-25.1	0	0	0	111.3	E436 Y440 R441 S444	E436-N438 PolarHBondContact O-N 3.1Å; N438-Y440 PolarHBondContact O-N 3.29Å; N438-Y440 VanDerWaalsContact O-N 3.16Å; N438-Y440 PolarHBondContact OD1-N 3.05Å; N438-R441 PolarHBondContact O-N 3.33Å; N438-S444 WeakPolarHBondContact O-CB 3.36Å; N438-S444 PolarHBondContact O-OG 3.04Å
439	L	80.1	Confident	78	Confident	14 Å²	14	75.4 Å²	75.4	7%	0.073	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-9.5	-176.6	-57.1	178.4	0	0	0	114.6	P324 T325 F354 P383 L434 A437 L447	P324-L439 HydrophobicContact CB-CD1 4.4Å; P324-L439 HydrophobicContact CG-CB 4.44Å; T325-L439 HydrophobicContact CG2-CB 3.89Å; T325-L439 WeakPolarHBondContact CG2-O 3.32Å; F354-L439 HydrophobicContact CZ-CD1 4.29Å; P383-L439 HydrophobicContact CG-CD1 4.21Å; L434-L439 HydrophobicContact CD1-CD1 4.35Å; A437-L439 HydrophobicContact CB-CD2 4.09Å; A437-L439 HydrophobicContact CB-CG 4.41Å; A437-L439 PolarHBondContact O-N 3.39Å; L439-L447 HydrophobicContact CD2-CD2 4.05Å; L439-L447 HydrophobicContact CD2-CG 4.44Å; L439-L447 WeakPolarHBondContact O-CD1 3.3Å
440	Y	75.9	Confident	78.8	Confident	142 Å²	142	72.8 Å²	72.8	56%	0.557	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-26.3	176.8	-65.7	-84.5	0	0	0	112.9	T325 N438 R442	T325-Y440 HydrophobicContact CG2-CD1 3.71Å; T325-Y440 HydrophobicContact CG2-CD2 4.4Å; T325-Y440 HydrophobicContact CG2-CE1 3.83Å; T325-Y440 HydrophobicContact CG2-CG 4.01Å; N438-Y440 PolarHBondContact O-N 3.29Å; N438-Y440 VanDerWaalsContact O-N 3.16Å; N438-Y440 PolarHBondContact OD1-N 3.05Å; Y440-R442 PolarHBondContact O-N 2.91Å
441	R	78.3	Confident	80.1	Confident	164 Å²	164	69.5 Å²	69.5	62%	0.619	35%	0.352	S	S	*	.			trans	-78.5	119.1	175	-116.3	179.5	179.3	175.4	-0.4	108.7	N438 T443 S444	N438-R441 PolarHBondContact O-N 3.33Å; R441-T443 PolarHBondContact O-N 3.39Å; R441-T443 VanDerWaalsContact O-N 3.14Å; R441-S444 WeakPolarHBondContact O-CB 3.35Å; R441-S444 PolarHBondContact O-N 3.47Å
442	R	73.8	Confident	81.7	Confident	210 Å²	210	67.7 Å²	67.7	79%	0.792	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.9	172.4	-68.7	-173	-178.6	-179.6	0.3	113	Y440 S444	Y440-R442 PolarHBondContact O-N 2.91Å; R442-S444 PolarHBondContact O-N 2.98Å
443	T	77.8	Confident	82.7	Confident	119 Å²	119	65.7 Å²	65.7	73%	0.73	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	10.1	175.7	62.5	0	0	0	0	112.9	R441 E445	R441-T443 PolarHBondContact O-N 3.39Å; R441-T443 VanDerWaalsContact O-N 3.14Å; T443-E445 PolarHBondContact O-N 2.7Å
444	S	82.9	Confident	83.3	Confident	15 Å²	15	65.6 Å²	65.6	11%	0.105	32%	0.319	C	S	.	.			trans	-64.1	131.6	175.9	-176.9	0	0	0	0	109.8	N438 R441 R442 Y446 L447	N438-S444 WeakPolarHBondContact O-CB 3.36Å; N438-S444 PolarHBondContact O-OG 3.04Å; R441-S444 WeakPolarHBondContact O-CB 3.35Å; R441-S444 PolarHBondContact O-N 3.47Å; R442-S444 PolarHBondContact O-N 2.98Å; S444-Y446 PolarHBondContact O-N 3.24Å; S444-Y446 PolarHBondContact OG-N 2.97Å; S444-L447 PolarHBondContact O-N 3.5Å
445	E	84.3	Confident	83.9	Confident	101 Å²	101	66.4 Å²	66.4	47%	0.472	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.8	175.9	55.7	172.3	-169.2	0	0	113.7	A409 K418 T443	A409-E445 VanDerWaalsContact CB-O 3.23Å; A409-E445 WeakPolarHBondContact CB-O 3.18Å; K418-E445 WeakPolarHBondContact CE-OE1 3.25Å; K418-E445 IonicContact NZ-OE1 3.8Å; K418-E445 PolarHBondContact NZ-OE1 3.34Å; K418-E445 IonicContact NZ-OE2 3.38Å; K418-E445 PolarHBondContact NZ-OE2 3.21Å; T443-E445 PolarHBondContact O-N 2.7Å
446	Y	85.3	Confident	84.7	Confident	6 Å²	6	64.1 Å²	64.1	2%	0.024	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.5	177.4	-64.6	-95.8	0	0	0	113.2	V407 K418 H419 L434 A437 S444 L452	V407-Y446 HydrophobicContact CG1-CD1 4.1Å; K418-Y446 HydrophobicContact CD-CD1 4.43Å; K418-Y446 HydrophobicContact CD-CE1 4.08Å; K418-Y446 VanDerWaalsContact CE-CZ 3.46Å; K418-Y446 WeakPolarHBondContact CE-OH 3.19Å; H419-Y446 AromaticContact CD2-CE1 3.48Å; H419-Y446 VanDerWaalsContact CD2-CE1 3.48Å; H419-Y446 WeakPolarHBondContact CD2-CE1 3.25Å; H419-Y446 AromaticContact NE2-CE1 3.7Å; H419-Y446 AromaticContact NE2-CZ 3.76Å; H419-Y446 PolarHBondContact NE2-OH 2.94Å; L434-Y446 HydrophobicContact CD2-CD1 3.79Å; L434-Y446 HydrophobicContact CD2-CE1 4.01Å; A437-Y446 HydrophobicContact CB-CD1 3.78Å; A437-Y446 HydrophobicContact CB-CD2 3.53Å; A437-Y446 HydrophobicContact CB-CE1 3.94Å; A437-Y446 HydrophobicContact CB-CE2 3.75Å; A437-Y446 HydrophobicContact CB-CG 3.57Å; S444-Y446 PolarHBondContact O-N 3.24Å; S444-Y446 PolarHBondContact OG-N 2.97Å; Y446-L452 WeakPolarHBondContact O-CD1 3.35Å
447	L	87.3	Confident	85.6	Confident	19 Å²	19	56.2 Å²	56.2	10%	0.099	27%	0.267	C	S	.	.			trans	-113.6	137.5	-177.5	-61.8	179.2	0	0	0	110.7	P324 L439 S444 S451 L452	P324-L447 HydrophobicContact CG-CD2 3.71Å; L439-L447 HydrophobicContact CD2-CD2 4.05Å; L439-L447 HydrophobicContact CD2-CG 4.44Å; L439-L447 WeakPolarHBondContact O-CD1 3.3Å; S444-L447 PolarHBondContact O-N 3.5Å; L447-S451 WeakPolarHBondContact CA-O 3.5Å; L447-L452 HydrophobicContact CD2-CB 4.1Å
448	I	86.7	Confident	86.3	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.087	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-119	116.3	172.1	-51.5	173.7	0	0	0	105.4	Q410 L415 S450 S451 F453	Q410-I448 HydrophobicContact CB-CD1 3.84Å; Q410-I448 HydrophobicContact CB-CG1 3.81Å; L415-I448 HydrophobicContact CD1-CD1 3.3Å; I448-S450 VanDerWaalsContact C-N 3.25Å; I448-S450 PolarHBondContact O-N 2.93Å; I448-S451 PolarHBondContact N-O 3.15Å; I448-S451 WeakPolarHBondContact O-CA 3.48Å; I448-S451 WeakPolarHBondContact O-CB 3.44Å; I448-S451 PolarHBondContact O-N 2.94Å; I448-F453 HydrophobicContact CB-CD2 3.81Å; I448-F453 HydrophobicContact CB-CE2 3.6Å; I448-F453 HydrophobicContact CB-CZ 4.49Å; I448-F453 HydrophobicContact CD1-CD2 3.81Å; I448-F453 HydrophobicContact CD1-CE2 4.21Å; I448-F453 HydrophobicContact CD1-CG 4.13Å; I448-F453 HydrophobicContact CG1-CD2 4.07Å; I448-F453 HydrophobicContact CG1-CE2 4.33Å; I448-F453 HydrophobicContact CG2-CE2 4.12Å
449	D	85.6	Confident	86.9	Confident	150 Å²	150	52 Å²	52	80%	0.802	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	39.3	-175.7	-60.5	-37.3	0	0	0	114.4	S451	D449-S451 PolarHBondContact O-N 2.94Å
450	S	86.1	Confident	87.2	Confident	34 Å²	34	51.4 Å²	51.4	24%	0.238	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	15.7	-174.7	-46.5	0	0	0	0	115.2	N323 P324 I448	N323-S450 PolarHBondContact N-O 3.35Å; N323-S450 VanDerWaalsContact N-O 3.16Å; P324-S450 WeakPolarHBondContact CD-O 3.46Å; I448-S450 VanDerWaalsContact C-N 3.25Å; I448-S450 PolarHBondContact O-N 2.93Å
451	S	90.3	Very high	87.5	Confident	14 Å²	14	45.9 Å²	45.9	10%	0.098	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.2	176	-62.9	0	0	0	0	111.3	I321 N322 L447 I448 D449	I321-S451 CarbonylContact O-C 3.57Å; I321-S451 VanDerWaalsContact O-CA 3.31Å; I321-S451 WeakPolarHBondContact O-CA 3.45Å; N322-S451 PolarHBondContact OD1-OG 3.4Å; L447-S451 WeakPolarHBondContact CA-O 3.5Å; I448-S451 PolarHBondContact N-O 3.15Å; I448-S451 WeakPolarHBondContact O-CA 3.48Å; I448-S451 WeakPolarHBondContact O-CB 3.44Å; I448-S451 PolarHBondContact O-N 2.94Å; D449-S451 PolarHBondContact O-N 2.94Å
452	L	91.5	Very high	87.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	123.1	174	177.1	68.6	0	0	0	108.6	I321 P324 F354 V407 L434 Y446 L447 L454	I321-L452 HydrophobicContact CB-CB 4.26Å; I321-L452 HydrophobicContact CD1-CD2 4.38Å; I321-L452 PolarHBondContact N-O 3.17Å; I321-L452 PolarHBondContact O-N 3.09Å; P324-L452 HydrophobicContact CB-CB 4.3Å; P324-L452 HydrophobicContact CG-CB 4.17Å; F354-L452 HydrophobicContact CE2-CD2 3.9Å; F354-L452 HydrophobicContact CZ-CD2 4.15Å; V407-L452 HydrophobicContact CG1-CD1 4.2Å; L434-L452 HydrophobicContact CD1-CD1 4.38Å; L434-L452 HydrophobicContact CD1-CD2 3.84Å; Y446-L452 WeakPolarHBondContact O-CD1 3.35Å; L447-L452 HydrophobicContact CD2-CB 4.1Å; L452-L454 HydrophobicContact CD1-CD2 4.16Å; L452-L454 HydrophobicContact CD2-CD1 4.14Å; L452-L454 HydrophobicContact CD2-CD2 4.02Å; L452-L454 HydrophobicContact CD2-CG 4.17Å; L452-L454 HydrophobicContact CG-CD1 4.5Å; L452-L454 HydrophobicContact CG-CD2 3.84Å; L452-L454 HydrophobicContact CG-CG 4.01Å
453	F	94.3	Very high	86.5	Confident	53 Å²	53	33.9 Å²	33.9	23%	0.232	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	115	-179.3	-76.7	-108.3	0	0	0	109.6	I320 M408 I448	I320-F453 HydrophobicContact CD1-CD1 4.07Å; I320-F453 HydrophobicContact CD1-CE1 3.56Å; I320-F453 HydrophobicContact CD1-CZ 4.18Å; I320-F453 HydrophobicContact CG1-CD1 3.8Å; I320-F453 HydrophobicContact CG1-CE1 3.77Å; I320-F453 HydrophobicContact CG1-CG 4.48Å; I320-F453 HydrophobicContact CG1-CZ 4.41Å; I320-F453 HydrophobicContact CG2-CE1 4.28Å; I320-F453 HydrophobicContact CG2-CE2 4.18Å; I320-F453 HydrophobicContact CG2-CZ 4.07Å; M408-F453 HydrophobicContact CB-CB 3.84Å; M408-F453 HydrophobicContact CG-CB 4.37Å; M408-F453 PolarHBondContact N-O 2.81Å; I448-F453 HydrophobicContact CB-CD2 3.81Å; I448-F453 HydrophobicContact CB-CE2 3.6Å; I448-F453 HydrophobicContact CB-CZ 4.49Å; I448-F453 HydrophobicContact CD1-CD2 3.81Å; I448-F453 HydrophobicContact CD1-CE2 4.21Å; I448-F453 HydrophobicContact CD1-CG 4.13Å; I448-F453 HydrophobicContact CG1-CD2 4.07Å; I448-F453 HydrophobicContact CG1-CE2 4.33Å; I448-F453 HydrophobicContact CG2-CE2 4.12Å
454	L	94.9	Very high	85.2	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.7	178.5	-55.7	-179.9	0	0	0	110	W319 I321 I385 V405 L406 V407 L452	W319-L454 HydrophobicContact CB-CB 4.43Å; W319-L454 HydrophobicContact CE3-CD1 4.23Å; W319-L454 PolarHBondContact N-O 2.7Å; W319-L454 WeakPolarHBondContact O-CA 3.48Å; W319-L454 WeakPolarHBondContact O-CB 3.41Å; W319-L454 PolarHBondContact O-N 3.12Å; I321-L454 HydrophobicContact CD1-CD1 3.6Å; I321-L454 HydrophobicContact CD1-CG 4.46Å; I385-L454 HydrophobicContact CD1-CD1 3.49Å; I385-L454 VanDerWaalsContact CD1-CD1 3.49Å; V405-L454 HydrophobicContact CG1-CB 4.43Å; V405-L454 HydrophobicContact CG1-CD1 4.4Å; V405-L454 HydrophobicContact CG1-CD2 4.06Å; L406-L454 CarbonylContact O-C 3.47Å; L406-L454 VanDerWaalsContact O-CA 3.29Å; L406-L454 WeakPolarHBondContact O-CA 3.37Å; V407-L454 HydrophobicContact CB-CD2 4.3Å; V407-L454 HydrophobicContact CG1-CD2 4.31Å; V407-L454 HydrophobicContact CG2-CD2 3.82Å; L452-L454 HydrophobicContact CD1-CD2 4.16Å; L452-L454 HydrophobicContact CD2-CD1 4.14Å; L452-L454 HydrophobicContact CD2-CD2 4.02Å; L452-L454 HydrophobicContact CD2-CG 4.17Å; L452-L454 HydrophobicContact CG-CD1 4.5Å; L452-L454 HydrophobicContact CG-CD2 3.84Å; L452-L454 HydrophobicContact CG-CG 4.01Å
455	H	95.7	Very high	83.5	Confident	19 Å²	19	32.4 Å²	32.4	9%	0.088	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122	161.9	-163.8	127.1	0	0	0	108.3	L311 L406	L311-H455 HydrophobicContact CD2-CB 4.41Å; L311-H455 WeakPolarHBondContact CD2-ND1 3.07Å; L311-H455 PolarHBondContact O-CE1 3.35Å; L406-H455 HydrophobicContact CB-CB 4.1Å; L406-H455 HydrophobicContact CD1-CB 4.16Å; L406-H455 HydrophobicContact CG-CB 4.41Å; L406-H455 PolarHBondContact N-O 3.07Å; L406-H455 PolarHBondContact O-N 3.44Å
456	V	95.3	Very high	81.7	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.8	178.3	-178.9	0	0	0	0	108.6	G316 S317 W319 F333 I387 V405 V458	G316-V456 CarbonylContact C-O 3.59Å; G316-V456 WeakPolarHBondContact CA-O 3.49Å; S317-V456 PolarHBondContact N-O 3.47Å; S317-V456 PolarHBondContact O-N 3.31Å; W319-V456 HydrophobicContact CE3-CG2 4.32Å; F333-V456 HydrophobicContact CE1-CB 4.32Å; F333-V456 HydrophobicContact CE1-CG1 4.02Å; F333-V456 HydrophobicContact CE2-CG1 4.4Å; F333-V456 HydrophobicContact CZ-CB 4.13Å; F333-V456 HydrophobicContact CZ-CG1 3.53Å; I387-V456 HydrophobicContact CD1-CG1 3.39Å; I387-V456 HydrophobicContact CD1-CG2 4.38Å; I387-V456 HydrophobicContact CG1-CG1 4.41Å; V405-V456 HydrophobicContact CG2-CG2 4.43Å; V456-V458 HydrophobicContact CG1-CG2 4.43Å
457	V	95.1	Very high	79.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.1	175.1	-176.2	0	0	0	0	108.6	W315 K403 T404 L406 K459	W315-V457 HydrophobicContact CB-CG1 4.31Å; K403-V457 CarbonylContact C-O 3.6Å; T404-V457 PolarHBondContact N-O 3.07Å; T404-V457 PolarHBondContact O-N 3.48Å; L406-V457 HydrophobicContact CD1-CG2 4.14Å; L406-V457 HydrophobicContact CG-CG2 4.48Å; V457-K459 HydrophobicContact CG1-CG 4.25Å
458	V	93.1	Very high	76.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	112.6	177.4	-176	0	0	0	0	108.6	W315 F333 T335 W350 F401 K403 V456 P460	W315-V458 PolarHBondContact O-N 3.16Å; F333-V458 HydrophobicContact CE2-CG2 3.89Å; F333-V458 HydrophobicContact CZ-CG2 3.97Å; T335-V458 HydrophobicContact CG2-CB 4.21Å; T335-V458 HydrophobicContact CG2-CG2 4.3Å; W350-V458 HydrophobicContact CD2-CG2 4.32Å; W350-V458 HydrophobicContact CG-CG2 4.49Å; W350-V458 HydrophobicContact CH2-CG1 4.05Å; W350-V458 HydrophobicContact CZ2-CG1 3.51Å; F401-V458 HydrophobicContact CB-CG1 3.92Å; F401-V458 HydrophobicContact CD1-CG1 3.76Å; F401-V458 HydrophobicContact CG-CG1 4.2Å; K403-V458 HydrophobicContact CG-CG2 4.3Å; V456-V458 HydrophobicContact CG1-CG2 4.43Å; V458-P460 VanDerWaalsContact O-CD 3.24Å; V458-P460 WeakPolarHBondContact O-CD 3.4Å
459	K	90.3	Very high	74.2	Confident	10 Å²	10	51.6 Å²	51.6	4%	0.043	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	105.5	-179.3	-73.4	177	-83.9	178.3	0	110.1	P307 N309 F401 Q402 T404 V457 L461	P307-K459 HydrophobicContact CB-CG 4.46Å; P307-K459 HydrophobicContact CG-CB 3.95Å; P307-K459 HydrophobicContact CG-CG 3.94Å; N309-K459 WeakPolarHBondContact OD1-CE 3.31Å; N309-K459 PolarHBondContact OD1-NZ 3.29Å; F401-K459 CarbonylContact C-O 3.55Å; F401-K459 WeakPolarHBondContact CA-O 3.27Å; Q402-K459 HydrophobicContact CB-CB 4.32Å; Q402-K459 PolarHBondContact N-O 3.26Å; Q402-K459 PolarHBondContact O-N 2.83Å; Q402-K459 VanDerWaalsContact OE1-CE 3.3Å; T404-K459 WeakPolarHBondContact OG1-CE 3.49Å; T404-K459 PolarHBondContact OG1-NZ 3.26Å; V457-K459 HydrophobicContact CG1-CG 4.25Å; K459-L461 PolarHBondContact O-N 2.95Å
460	P	87.2	Confident	71.6	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	128.6	168.2	27.6	-34.4	0	0	0	110.6	W315 L337 P339 V399 N400 F401 V458	W315-P460 HydrophobicContact CE3-CG 4.34Å; W315-P460 HydrophobicContact CZ3-CG 3.61Å; L337-P460 WeakPolarHBondContact O-CB 3.5Å; P339-P460 HydrophobicContact CG-CG 4.19Å; V399-P460 HydrophobicContact CG1-CB 3.69Å; N400-P460 CarbonylContact O-C 3.6Å; N400-P460 WeakPolarHBondContact O-CA 3.18Å; F401-P460 HydrophobicContact CD1-CB 3.97Å; F401-P460 HydrophobicContact CE1-CB 3.87Å; V458-P460 VanDerWaalsContact O-CD 3.24Å; V458-P460 WeakPolarHBondContact O-CD 3.4Å
461	L	82.4	Confident	70.9	Confident	26 Å²	26	56.8 Å²	56.8	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.4	178.7	-58.3	178.2	0	0	0	107.8	V306 N400 Q402 K459 Q463	V306-L461 HydrophobicContact CG1-CD2 3.9Å; N400-L461 PolarHBondContact N-O 3.16Å; N400-L461 PolarHBondContact O-N 3.15Å; N400-L461 VanDerWaalsContact O-O 3.13Å; Q402-L461 HydrophobicContact CB-CD1 3.74Å; Q402-L461 HydrophobicContact CB-CG 4.39Å; K459-L461 PolarHBondContact O-N 2.95Å; L461-Q463 PolarHBondContact O-N 3.12Å
462	Y	75	Confident	69.9	Low	11 Å²	11	59 Å²	59	4%	0.043	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	115.3	177.7	-62.8	-72.7	0	0	0	109.9	F286 P291 G338 P339 G398 V399 T464 L465	F286-Y462 HydrophobicContact CE2-CE2 4.18Å; F286-Y462 HydrophobicContact CZ-CE2 4.12Å; P291-Y462 HydrophobicContact CB-CD1 3.96Å; P291-Y462 HydrophobicContact CB-CD2 3.78Å; P291-Y462 HydrophobicContact CB-CE1 3.77Å; P291-Y462 HydrophobicContact CB-CE2 3.56Å; P291-Y462 HydrophobicContact CB-CG 3.97Å; P291-Y462 HydrophobicContact CG-CD2 4.42Å; P291-Y462 HydrophobicContact CG-CE1 3.99Å; P291-Y462 HydrophobicContact CG-CE2 3.7Å; P291-Y462 VanDerWaalsContact CG-CZ 3.48Å; P291-Y462 WeakPolarHBondContact CG-OH 3.3Å; G338-Y462 VanDerWaalsContact CA-OH 3.3Å; G338-Y462 WeakPolarHBondContact CA-OH 3.41Å; P339-Y462 VanDerWaalsContact CD-CE2 3.47Å; P339-Y462 VanDerWaalsContact CD-OH 3.22Å; P339-Y462 WeakPolarHBondContact CD-OH 3.38Å; P339-Y462 HydrophobicContact CG-CE2 4.17Å; G398-Y462 WeakPolarHBondContact O-CA 3.36Å; V399-Y462 HydrophobicContact CB-CD1 4.42Å; V399-Y462 HydrophobicContact CB-CE1 4.44Å; V399-Y462 HydrophobicContact CG1-CD1 4.39Å; V399-Y462 HydrophobicContact CG1-CE1 4.27Å; V399-Y462 HydrophobicContact CG2-CD1 3.72Å; V399-Y462 HydrophobicContact CG2-CE1 3.5Å; Y462-T464 PolarHBondContact O-N 3.21Å; Y462-L465 VanDerWaalsContact CB-CD1 3.42Å; Y462-L465 WeakPolarHBondContact O-CB 3.27Å; Y462-L465 PolarHBondContact O-N 3.47Å
463	Q	55.5	Low	68.7	Low	111 Å²	111	62.3 Å²	62.3	52%	0.519	33%	0.325	S	S	.	.	H	α-helix	trans	-78.4	-20.9	-162.9	-158.5	171.5	3.6	0	0	114.1	G398 N400 L461 L465	G398-Q463 PolarHBondContact O-N 2.68Å; N400-Q463 HydrophobicContact CB-CB 4.31Å; N400-Q463 HydrophobicContact CB-CG 4.41Å; L461-Q463 PolarHBondContact O-N 3.12Å; Q463-L465 PolarHBondContact O-N 2.93Å
464	T	49.5	Very low	67.2	Low	89 Å²	89	62.8 Å²	62.8	55%	0.546	33%	0.33	S	S	.	.	H	α-helix	trans	-69.5	3.9	173.8	47.6	0	0	0	0	113.8	Y462	Y462-T464 PolarHBondContact O-N 3.21Å
465	L	48.5	Very low	65.4	Low	13 Å²	13	66.4 Å²	66.4	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-106.6	-55.4	-178.2	-66.6	137.5	0	0	0	108.1	A295 V300 N301 Y462 Q463 T467	A295-L465 HydrophobicContact CB-CD1 4.02Å; A295-L465 HydrophobicContact CB-CD2 3.69Å; A295-L465 HydrophobicContact CB-CG 3.93Å; V300-L465 HydrophobicContact CB-CD1 4.38Å; V300-L465 HydrophobicContact CB-CD2 3.71Å; V300-L465 HydrophobicContact CB-CG 4.48Å; V300-L465 HydrophobicContact CG1-CD2 4.25Å; V300-L465 HydrophobicContact CG2-CB 4.27Å; V300-L465 HydrophobicContact CG2-CD1 2.98Å; V300-L465 HydrophobicContact CG2-CD2 3.04Å; V300-L465 HydrophobicContact CG2-CG 3.39Å; N301-L465 VanDerWaalsContact ND2-C 3.33Å; N301-L465 PolarHBondContact ND2-O 3.03Å; N301-L465 VanDerWaalsContact OD1-CA 3.25Å; N301-L465 WeakPolarHBondContact OD1-CA 3.3Å; N301-L465 WeakPolarHBondContact OD1-CB 3.38Å; N301-L465 PolarHBondContact OD1-O 3.32Å; Y462-L465 VanDerWaalsContact CB-CD1 3.42Å; Y462-L465 WeakPolarHBondContact O-CB 3.27Å; Y462-L465 PolarHBondContact O-N 3.47Å; Q463-L465 PolarHBondContact O-N 2.93Å; L465-T467 VanDerWaalsContact C-N 3.3Å; L465-T467 PolarHBondContact O-N 2.77Å
466	I	46.5	Very low	63.4	Low	102 Å²	102	69.6 Å²	69.6	52%	0.523	37%	0.367	S	S	.	.	H	α-helix	trans	-70.9	-16.9	-163	-60.9	173.2	0	0	0	114.8	N301	N301-I466 VanDerWaalsContact OD1-CA 3.3Å; N301-I466 WeakPolarHBondContact OD1-CA 3.43Å; N301-I466 PolarHBondContact OD1-N 3.13Å; N301-I466 VanDerWaalsContact OD1-N 3.11Å
467	T	37.8	Very low	61.1	Low	108 Å²	108	74.5 Å²	74.5	66%	0.663	39%	0.393	S	S	*	.	S	Bend	trans	-153.7	108.7	170.9	48.5	0	0	0	0	113.1	L465	L465-T467 VanDerWaalsContact C-N 3.3Å; L465-T467 PolarHBondContact O-N 2.77Å
468	T	34.2	Very low	58.5	Low	127 Å²	127	80.2 Å²	80.2	78%	0.779	42%	0.423	S	S	*	.				-171.6	87	117.3	46.8	0	0	0	0	109.3
469	K	29.7	Very low	55.6	Low	210 Å²	210	86.9 Å²	86.9	91%	0.913	46%	0.458	S	S	*	.			trans	-125.7	105	139.9	-87.3	-173.9	176.4	176	0	105.8
470	N	31	Very low	52.5	Low	235 Å²	235	93.9 Å²	93.9	100%	1.257	50%	0.496	S	S	*	.			trans	-65.5	0	162.3	-77.6	-11.8	0	0	0	109.8

Retrieved 470 of 470 residues in 243.3 ms (Link to these results)

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