A0A087XHG5_POEFO Loading...

Ubiquitin-like protease family profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XHG5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 380 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	39.4	Very low	30.2	Very low	243 Å²	243	167.5 Å²	167.5	100%	1.197	85%	0.854	S	S	*	*				0	70.3	0	-71.1	176.3	175	0	0	106.8
2	A	30.7	Very low	30.5	Very low	103 Å²	103	161.6 Å²	161.6	85%	0.851	84%	0.839	S	S	*	*				78.7	92.8	86	0	0	0	0	0	112.1
3	E	34.2	Very low	31.1	Very low	187 Å²	187	158.2 Å²	158.2	87%	0.874	83%	0.834	S	S	*	*			trans	-60.7	147.2	156.1	-66.2	175.3	123.2	0	0	110.4
4	Y	26.6	Very low	31.7	Very low	234 Å²	234	155.1 Å²	155.1	92%	0.918	82%	0.824	S	S	*	*			trans	-154.5	130.7	148.1	-126.1	-89.1	0	0	0	111.7
5	K	33.9	Very low	32.1	Very low	184 Å²	184	151.7 Å²	151.7	80%	0.8	81%	0.806	S	S	*	*			trans	-86.1	157.1	177.9	-72.3	169.9	172.6	170.8	0	112
6	Q	30	Very low	32.6	Very low	182 Å²	182	156.6 Å²	156.6	85%	0.85	81%	0.81	S	S	*	*			trans	167.7	158.2	133.3	-97.5	171.5	-17.9	0	0	109.5
7	H	26.6	Very low	32.9	Very low	143 Å²	143	150.7 Å²	150.7	66%	0.662	79%	0.785	S	S	*	*			cis	-173.3	132	-44	-137.2	-57.3	0	0	0	105.9
8	R	26.6	Very low	33.3	Very low	223 Å²	223	149.3 Å²	149.3	84%	0.842	77%	0.774	S	S	*	*			trans	53	141.1	153	-76.2	172.3	178	-178.8	-2.6	119.4
9	S	25.8	Very low	34	Very low	115 Å²	115	143.5 Å²	143.5	80%	0.804	75%	0.754	S	S	*	*			cis	-145.7	129.4	46.7	58.4	0	0	0	0	114.1
10	S	28.4	Very low	34.5	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	74%	0.743	S	S	*	*			trans	-82.9	117.2	160.9	55.6	0	0	0	0	109.6
11	S	30	Very low	34.9	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	74%	0.738	S	S	*	*			trans	-101.1	91.6	155.5	60.8	0	0	0	0	107.5
12	S	34.1	Very low	35.2	Very low	97 Å²	97	135 Å²	135	68%	0.678	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-59	146.5	164.4	46.4	0	0	0	0	109.7
13	P	37.4	Very low	35.8	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58.3	141.8	170.4	10	-6	0	0	0	108.9	D15	P13-D15 PolarHBondContact O-N 3.08Å; P13-D15 VanDerWaalsContact O-N 3.1Å
14	V	40.5	Very low	36.1	Very low	115 Å²	115	132.7 Å²	132.7	70%	0.697	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-47.4	119.3	179.7	-176.6	0	0	0	0	109.1	W16 Q18	V14-W16 PolarHBondContact O-N 3.45Å; V14-Q18 HydrophobicContact CG1-CB 4.21Å
15	D	37.8	Very low	36.8	Very low	103 Å²	103	126.8 Å²	126.8	55%	0.551	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-60.3	129.8	177.2	-178.4	12.3	0	0	0	109	P13 S17 Q18	P13-D15 PolarHBondContact O-N 3.08Å; P13-D15 VanDerWaalsContact O-N 3.1Å; D15-S17 PolarHBondContact O-N 2.82Å; D15-S17 PolarHBondContact OD1-N 3.42Å; D15-S17 WeakPolarHBondContact OD2-CB 3.34Å; D15-S17 PolarHBondContact OD2-OG 3.38Å; D15-Q18 PolarHBondContact O-N 3.45Å
16	W	39.2	Very low	37	Very low	231 Å²	231	121.4 Å²	121.4	88%	0.875	66%	0.66	S	S	*	*	H	α-helix	trans	-54	-24	-179.9	-77.5	93.8	0	0	0	112.4	V14 Q18 G19 L20	V14-W16 PolarHBondContact O-N 3.45Å; W16-Q18 VanDerWaalsContact C-N 3.28Å; W16-Q18 PolarHBondContact O-N 3.43Å; W16-G19 PolarHBondContact O-N 3.47Å; W16-L20 PolarHBondContact O-N 3.44Å
17	S	38	Very low	37.4	Very low	56 Å²	56	118.5 Å²	118.5	39%	0.392	66%	0.657	S	S	.	*	H	α-helix	trans	-61	-30.9	173.2	74.4	0	0	0	0	113.7	D15 L21	D15-S17 PolarHBondContact O-N 2.82Å; D15-S17 PolarHBondContact OD1-N 3.42Å; D15-S17 WeakPolarHBondContact OD2-CB 3.34Å; D15-S17 PolarHBondContact OD2-OG 3.38Å; S17-L21 PolarHBondContact O-N 3.17Å
18	Q	39.9	Very low	38.1	Very low	126 Å²	126	116.8 Å²	116.8	59%	0.589	66%	0.661	S	S	*	*	H	α-helix	trans	-77.8	-27.8	177.2	-68.2	-142.4	-16.4	0	0	113.1	V14 D15 W16 L20 L21	V14-Q18 HydrophobicContact CG1-CB 4.21Å; D15-Q18 PolarHBondContact O-N 3.45Å; W16-Q18 VanDerWaalsContact C-N 3.28Å; W16-Q18 PolarHBondContact O-N 3.43Å; Q18-L20 VanDerWaalsContact C-N 3.3Å; Q18-L21 PolarHBondContact O-N 3.19Å
19	G	47.6	Very low	39.2	Very low	38 Å²	38	111.9 Å²	111.9	39%	0.392	66%	0.658	S	S	.	*	H	α-helix	trans	-66.7	-32.7	172.4	0	0	0	0	0	112.7	W16	W16-G19 PolarHBondContact O-N 3.47Å
20	L	43.8	Very low	40.5	Very low	99 Å²	99	110.8 Å²	110.8	52%	0.518	64%	0.643	S	S	.	*	H	α-helix	trans	-72.2	-32.7	175.4	-74.1	167.4	0	0	0	112.8	W16 Q18 L22 L23 H24	W16-L20 PolarHBondContact O-N 3.44Å; Q18-L20 VanDerWaalsContact C-N 3.3Å; L20-L22 VanDerWaalsContact C-N 3.31Å; L20-L22 PolarHBondContact O-N 3.41Å; L20-L23 HydrophobicContact CD2-CD1 4.28Å; L20-L23 PolarHBondContact O-N 3.21Å; L20-H24 PolarHBondContact O-CD2 2.89Å; L20-H24 PolarHBondContact O-N 3.27Å
21	L	42.1	Very low	41.9	Very low	123 Å²	123	108.7 Å²	108.7	64%	0.644	62%	0.623	S	S	*	*	H	α-helix	trans	-65.6	-31.7	177	-98.1	147	0	0	0	113.2	S17 Q18 L23 H24	S17-L21 PolarHBondContact O-N 3.17Å; Q18-L21 PolarHBondContact O-N 3.19Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-H24 PolarHBondContact O-N 2.58Å
22	L	45.6	Very low	42.8	Very low	131 Å²	131	112.5 Å²	112.5	69%	0.686	62%	0.619	S	S	*	*	H	α-helix	trans	-72.6	-23.4	174.7	-79.5	161.4	0	0	0	113.4	L20 T25	L20-L22 VanDerWaalsContact C-N 3.31Å; L20-L22 PolarHBondContact O-N 3.41Å; L22-T25 PolarHBondContact O-OG1 3.09Å; L22-T25 VanDerWaalsContact O-OG1 3.08Å
23	L	44.2	Very low	43.5	Very low	83 Å²	83	111.2 Å²	111.2	44%	0.435	60%	0.602	S	S	.	*	H	α-helix	trans	-78.3	-23.6	175.7	-74.3	163.6	0	0	0	112.7	L20 L21	L20-L23 HydrophobicContact CD2-CD1 4.28Å; L20-L23 PolarHBondContact O-N 3.21Å; L21-L23 VanDerWaalsContact C-N 3.33Å
24	H	40.5	Very low	44	Very low	158 Å²	158	109.8 Å²	109.8	73%	0.731	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-5	179.9	-74.9	-64.6	0	0	0	114.6	L20 L21	L20-H24 PolarHBondContact O-CD2 2.89Å; L20-H24 PolarHBondContact O-N 3.27Å; L21-H24 PolarHBondContact O-N 2.58Å
25	T	40.4	Very low	44.6	Very low	109 Å²	109	108.7 Å²	108.7	67%	0.669	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-3.9	172.9	40	0	0	0	0	114.2	L22 P27	L22-T25 PolarHBondContact O-OG1 3.09Å; L22-T25 VanDerWaalsContact O-OG1 3.08Å; T25-P27 WeakPolarHBondContact O-CD 3.47Å
26	C	37.6	Very low	45	Very low	71 Å²	71	106.3 Å²	106.3	48%	0.48	58%	0.578	S	S	.	*	S	Bend	trans	-82.5	117	175.3	-80.3	0	0	0	0	110.7
27	P	39.1	Very low	45.3	Very low	122 Å²	122	100.9 Å²	100.9	79%	0.792	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-67.9	142.3	172.5	27.4	-30.8	0	0	0	110.8	T25	T25-P27 WeakPolarHBondContact O-CD 3.47Å
28	S	40.6	Very low	45.5	Very low	107 Å²	107	103.8 Å²	103.8	75%	0.748	58%	0.576	S	S	*	*	S	Bend	trans	-47.7	151.7	179	159.8	0	0	0	0	115
29	P	50.8	Low	45.3	Very low	120 Å²	120	100.8 Å²	100.8	78%	0.779	58%	0.579	S	S	*	*	P	Polyproline II helix	cis	-103.7	119.6	7.4	17.6	1.6	0	0	0	112.4	D31	P29-D31 PolarHBondContact O-N 2.97Å
30	L	51.9	Low	44.7	Very low	91 Å²	91	106 Å²	106	48%	0.476	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-64.8	127.5	165.3	-80.1	157.2	0	0	0	108.8	R32 L34	L30-R32 PolarHBondContact O-N 3.21Å; L30-L34 HydrophobicContact CD2-CD1 4.33Å
31	D	59.8	Low	44.3	Very low	68 Å²	68	107.2 Å²	107.2	36%	0.364	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-58.7	132.4	-173.9	-159.7	-21.1	0	0	0	111.1	P29 H33 L34	P29-D31 PolarHBondContact O-N 2.97Å; D31-H33 PolarHBondContact O-N 2.9Å; D31-H33 PolarHBondContact OD1-N 3.04Å; D31-L34 PolarHBondContact O-N 2.95Å
32	R	48.3	Very low	43.9	Very low	196 Å²	196	105.7 Å²	105.7	74%	0.74	62%	0.615	S	S	*	*	H	α-helix	trans	-56.7	-21.6	179.4	-158.9	-178.6	-169.8	175.9	8.5	111.5	L30	L30-R32 PolarHBondContact O-N 3.21Å
33	H	48.3	Very low	43.4	Very low	70 Å²	70	107.8 Å²	107.8	32%	0.324	62%	0.618	S	S	.	*	H	α-helix	trans	-75.2	-35.4	177.8	-171.2	72.6	0	0	0	114.2	D31 L35 G36 L37 F89	D31-H33 PolarHBondContact O-N 2.9Å; D31-H33 PolarHBondContact OD1-N 3.04Å; H33-L35 PolarHBondContact O-N 3.13Å; H33-G36 WeakPolarHBondContact O-CA 3.43Å; H33-G36 PolarHBondContact O-N 2.82Å; H33-L37 PolarHBondContact O-N 3.05Å; H33-L37 VanDerWaalsContact O-N 3.15Å; H33-F89 AromaticContact CD2-CE2 3.87Å; H33-F89 AromaticContact CD2-CZ 3.64Å; H33-F89 AromaticContact CE1-CE2 3.34Å; H33-F89 WeakPolarHBondContact CE1-CE2 3.42Å; H33-F89 AromaticContact CE1-CZ 3.77Å; H33-F89 AromaticContact ND1-CE2 3.79Å; H33-F89 AromaticContact NE2-CE2 3.39Å; H33-F89 WeakPolarHBondContact NE2-CE2 3.38Å; H33-F89 AromaticContact NE2-CZ 3.28Å; H33-F89 VanDerWaalsContact NE2-CZ 3.28Å; H33-F89 WeakPolarHBondContact NE2-CZ 3.43Å
34	L	49	Very low	42.9	Very low	88 Å²	88	110 Å²	110	46%	0.461	64%	0.637	S	S	.	*	H	α-helix	trans	-64.1	-33.1	175.4	-80.4	168	0	0	0	111.7	L30 D31 G36 L37 L38	L30-L34 HydrophobicContact CD2-CD1 4.33Å; D31-L34 PolarHBondContact O-N 2.95Å; L34-G36 VanDerWaalsContact C-N 3.29Å; L34-G36 PolarHBondContact O-N 3.25Å; L34-L37 HydrophobicContact CD2-CD1 4.5Å; L34-L37 PolarHBondContact O-N 3Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 3.26Å
35	L	51.8	Low	42.5	Very low	92 Å²	92	106 Å²	106	48%	0.482	64%	0.638	S	S	.	*	H	α-helix	trans	-67.6	-30.5	172.4	-66.9	171.4	0	0	0	112.4	H33 L38 H40	H33-L35 PolarHBondContact O-N 3.13Å; L35-L38 PolarHBondContact O-N 3.08Å; L35-H40 PolarHBondContact O-N 3.31Å
36	G	47.2	Very low	42.1	Very low	54 Å²	54	110.4 Å²	110.4	56%	0.557	65%	0.652	S	S	*	*	H	α-helix	trans	-68	-39.6	174	0	0	0	0	0	112.9	H33 L34 L38 G39	H33-G36 WeakPolarHBondContact O-CA 3.43Å; H33-G36 PolarHBondContact O-N 2.82Å; L34-G36 VanDerWaalsContact C-N 3.29Å; L34-G36 PolarHBondContact O-N 3.25Å; G36-L38 PolarHBondContact O-N 3.03Å; G36-G39 PolarHBondContact O-N 3.5Å
37	L	45.1	Very low	42	Very low	117 Å²	117	113.1 Å²	113.1	61%	0.613	67%	0.671	S	S	*	*	H	α-helix	trans	-67.5	-23.5	175.7	-71.5	170	0	0	0	113.2	H33 L34	H33-L37 PolarHBondContact O-N 3.05Å; H33-L37 VanDerWaalsContact O-N 3.15Å; L34-L37 HydrophobicContact CD2-CD1 4.5Å; L34-L37 PolarHBondContact O-N 3Å
38	L	42.9	Very low	41.6	Very low	116 Å²	116	112.6 Å²	112.6	61%	0.607	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	7.9	177.9	-66.5	171.7	0	0	0	113.9	L34 L35 G36 H40	L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 3.26Å; L35-L38 PolarHBondContact O-N 3.08Å; G36-L38 PolarHBondContact O-N 3.03Å; L38-H40 VanDerWaalsContact C-N 3.31Å; L38-H40 PolarHBondContact O-N 2.73Å
39	G	35.6	Very low	41.5	Very low	64 Å²	64	112.6 Å²	112.6	66%	0.66	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.1	12.8	172.8	0	0	0	0	0	115.4	G36 S41	G36-G39 PolarHBondContact O-N 3.5Å; G39-S41 PolarHBondContact O-N 3.41Å
40	H	35.3	Very low	40.6	Very low	146 Å²	146	111.1 Å²	111.1	68%	0.676	68%	0.675	S	S	*	*			trans	-94.6	80.2	175.1	-70.2	-31.8	0	0	0	111.2	L35 L38	L35-H40 PolarHBondContact O-N 3.31Å; L38-H40 VanDerWaalsContact C-N 3.31Å; L38-H40 PolarHBondContact O-N 2.73Å
41	S	34	Very low	39.9	Very low	125 Å²	125	115.1 Å²	115.1	87%	0.874	69%	0.691	S	S	*	*			trans	-96.4	96.6	159.9	-170	0	0	0	0	108.9	G39	G39-S41 PolarHBondContact O-N 3.41Å
42	A	33.9	Very low	38.6	Very low	91 Å²	91	123 Å²	123	75%	0.752	72%	0.716	S	S	*	*			trans	-115.4	110.2	166.7	0	0	0	0	0	109.1
43	K	35.4	Very low	38.1	Very low	176 Å²	176	120.8 Å²	120.8	77%	0.765	72%	0.719	S	S	*	*			trans	-127.9	119.4	149.2	-77.7	-168.2	178.6	-178.6	0	108
44	P	32.8	Very low	37.7	Very low	129 Å²	129	122.6 Å²	122.6	84%	0.838	74%	0.739	S	S	*	*			trans	-73.5	143.1	161.6	31.3	-28.3	0	0	0	108.7
45	G	33.1	Very low	37.4	Very low	73 Å²	73	122.8 Å²	122.8	75%	0.753	75%	0.754	S	S	*	*			trans	-72.6	169.6	-158.9	0	0	0	0	0	117.4
46	Q	31.1	Very low	37	Very low	202 Å²	202	122.1 Å²	122.1	94%	0.944	77%	0.769	S	S	*	*			trans	-152.2	112.2	138	-103.1	176.5	30.2	0	0	107.5
47	S	35.9	Very low	37.4	Very low	128 Å²	128	128.5 Å²	128.5	90%	0.895	78%	0.784	S	S	*	*			trans	-79.4	115.8	171.7	49.1	0	0	0	0	109.6
48	S	31.9	Very low	37.9	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	79%	0.794	S	S	*	*			trans	-129.4	108.8	149.2	71.9	0	0	0	0	107.8	A50	S48-A50 PolarHBondContact O-N 3.2Å
49	A	37.6	Very low	39.2	Very low	106 Å²	106	129.3 Å²	129.3	88%	0.876	79%	0.789	S	S	*	*			trans	-63.4	104	176.3	0	0	0	0	0	109.9
50	A	31.7	Very low	41.4	Very low	89 Å²	89	131 Å²	131	74%	0.736	79%	0.787	S	S	*	*			trans	-112.7	94.8	152.8	0	0	0	0	0	106.1	S48 R52	S48-A50 PolarHBondContact O-N 3.2Å; A50-R52 PolarHBondContact O-N 2.76Å
51	Q	36.8	Very low	44	Very low	175 Å²	175	129.8 Å²	129.8	82%	0.818	78%	0.776	S	S	*	*			trans	-54.7	100.5	168.2	-98	159.4	-51.4	0	0	108.9	N53	Q51-N53 PolarHBondContact O-N 2.93Å
52	R	33.8	Very low	46.6	Very low	235 Å²	235	124.9 Å²	124.9	89%	0.887	74%	0.74	S	S	*	*			trans	-80.6	99.2	154.2	-85	-175.7	176	-177.1	-1.2	106.8	A50 S54	A50-R52 PolarHBondContact O-N 2.76Å; R52-S54 PolarHBondContact O-N 3.39Å; R52-S54 VanDerWaalsContact O-N 3.08Å
53	N	37.5	Very low	49.4	Very low	148 Å²	148	120.5 Å²	120.5	79%	0.791	70%	0.704	S	S	*	*			trans	-63	99.6	161.6	-77.8	-21.8	0	0	0	108.3	Q51	Q51-N53 PolarHBondContact O-N 2.93Å
54	S	40.5	Very low	52.1	Low	108 Å²	108	114 Å²	114	76%	0.755	68%	0.676	S	S	*	*			trans	-109.2	81.5	158.9	58.3	0	0	0	0	107.9	R52 G56	R52-S54 PolarHBondContact O-N 3.39Å; R52-S54 VanDerWaalsContact O-N 3.08Å; S54-G56 PolarHBondContact O-N 3.38Å
55	A	41.5	Very low	55	Low	93 Å²	93	107.8 Å²	107.8	77%	0.769	64%	0.636	S	S	*	*			trans	-68.6	116.1	168.9	0	0	0	0	0	109.1	Q57	A55-Q57 PolarHBondContact O-N 3.35Å
56	G	44.2	Very low	57.7	Low	78 Å²	78	105 Å²	105	80%	0.804	60%	0.604	S	S	*	*			trans	57.8	27	144.2	0	0	0	0	0	120	S54 Q58	S54-G56 PolarHBondContact O-N 3.38Å; G56-Q58 PolarHBondContact O-N 3.35Å
57	Q	55.3	Low	60.3	Low	187 Å²	187	98.1 Å²	98.1	87%	0.874	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-70	116.4	167.5	-86.2	177.5	-31.1	0	0	109.1	A55	A55-Q57 PolarHBondContact O-N 3.35Å
58	Q	55.6	Low	62.5	Low	173 Å²	173	97 Å²	97	81%	0.808	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-61.6	146.2	168.9	-72.9	-167.8	-12.8	0	0	109.3	G56 T60	G56-Q58 PolarHBondContact O-N 3.35Å; Q58-T60 PolarHBondContact O-N 3.39Å
59	P	70.4	Confident	64.7	Low	78 Å²	78	96.7 Å²	96.7	51%	0.506	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-47.9	130.7	176	-27.8	34.5	0	0	0	111	R61 T77 E79	P59-R61 PolarHBondContact O-N 3.49Å; P59-R61 VanDerWaalsContact O-N 3.09Å; P59-T77 HydrophobicContact CB-CG2 3.78Å; P59-E79 WeakPolarHBondContact CB-OE2 3.16Å
60	T	81.9	Confident	66.7	Low	100 Å²	100	94.3 Å²	94.3	61%	0.613	54%	0.535	S	S	*	.			trans	-74.1	108.5	-179.2	-56.4	0	0	0	0	107.9	Q58 L62 T77 Q78	Q58-T60 PolarHBondContact O-N 3.39Å; T60-L62 PolarHBondContact O-N 3.02Å; T60-T77 CarbonylContact O-C 3.58Å; T60-T77 VanDerWaalsContact O-CA 3.32Å; T60-T77 WeakPolarHBondContact O-CA 3.29Å; T60-T77 WeakPolarHBondContact O-CB 3.33Å; T60-Q78 PolarHBondContact O-N 2.83Å
61	R	88.2	Confident	68.7	Low	120 Å²	120	96.5 Å²	96.5	45%	0.453	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	125	176.7	170.1	176.8	167.6	-157.3	-8.2	109.5	P59 Q64 T75	P59-R61 PolarHBondContact O-N 3.49Å; P59-R61 VanDerWaalsContact O-N 3.09Å; R61-Q64 VanDerWaalsContact CZ-CG 3.48Å; R61-Q64 VanDerWaalsContact CZ-NE2 3.3Å; R61-Q64 VanDerWaalsContact NH2-OE1 3.1Å; R61-T75 HydrophobicContact CB-CG2 4.29Å; R61-T75 HydrophobicContact CG-CG2 3.7Å
62	L	89.5	Confident	70.7	Confident	21 Å²	21	90.4 Å²	90.4	11%	0.11	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-62.9	176.9	-163.8	80.5	0	0	0	110.4	T60 L76 L81 L363 E367	T60-L62 PolarHBondContact O-N 3.02Å; L62-L76 WeakPolarHBondContact CA-O 3.4Å; L62-L76 WeakPolarHBondContact CB-O 3.35Å; L62-L76 PolarHBondContact N-O 3.36Å; L62-L81 HydrophobicContact CD2-CB 4.5Å; L62-L81 HydrophobicContact CD2-CD1 4.36Å; L62-L81 HydrophobicContact CD2-CD2 4.27Å; L62-L363 HydrophobicContact CD2-CB 4.31Å; L62-E367 HydrophobicContact CD1-CG 4.4Å; L62-E367 WeakPolarHBondContact CD1-OE1 3.3Å; L62-E367 WeakPolarHBondContact CD1-OE2 3.5Å; L62-E367 HydrophobicContact CG-CG 4.31Å
63	I	93	Very high	73.3	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	164.4	-177.4	64	168.7	0	0	0	112.7	L76 F97 L363 L366 E367	I63-L76 HydrophobicContact CD1-CD1 4.14Å; I63-L76 HydrophobicContact CD1-CD2 4.49Å; I63-L76 HydrophobicContact CG1-CB 3.79Å; I63-L76 HydrophobicContact CG1-CD1 3.85Å; I63-L76 HydrophobicContact CG1-CG 4.24Å; I63-L76 PolarHBondContact N-O 3.36Å; I63-L76 PolarHBondContact O-N 3.45Å; I63-F97 HydrophobicContact CD1-CE2 4.25Å; I63-L363 HydrophobicContact CD1-CD2 3.58Å; I63-L363 HydrophobicContact CG1-CD2 4.42Å; I63-L366 HydrophobicContact CD1-CB 4.07Å; I63-L366 HydrophobicContact CD1-CD1 4.14Å; I63-E367 HydrophobicContact CG2-CB 3.52Å; I63-E367 HydrophobicContact CG2-CG 4.11Å
64	Q	92.6	Very high	75.9	Confident	38 Å²	38	78 Å²	78	18%	0.178	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137	160	-88.4	176.3	0.4	0	0	110.8	R61 R73 M74 T75 Q370	R61-Q64 VanDerWaalsContact CZ-CG 3.48Å; R61-Q64 VanDerWaalsContact CZ-NE2 3.3Å; R61-Q64 VanDerWaalsContact NH2-OE1 3.1Å; Q64-R73 HydrophobicContact CB-CG 4.28Å; Q64-R73 HydrophobicContact CG-CG 4.44Å; Q64-M74 CarbonylContact C-O 3.59Å; Q64-M74 WeakPolarHBondContact CA-O 3.3Å; Q64-T75 PolarHBondContact NE2-OG1 3.45Å; Q64-Q370 VanDerWaalsContact N-OE1 3.11Å; Q64-Q370 PolarHBondContact O-NE2 2.96Å; Q64-Q370 PolarHBondContact O-OE1 2.99Å
65	Y	93.3	Very high	78.4	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131.8	-178.7	-168.8	-96.5	0	0	0	112.5	R73 M74 F97 K100 Y101 L104 E105 L366	Y65-R73 CarbonylContact O-C 3.45Å; Y65-R73 WeakPolarHBondContact O-CA 3.45Å; Y65-M74 PolarHBondContact N-O 2.99Å; Y65-M74 PolarHBondContact O-N 2.87Å; Y65-F97 AromaticContact CD1-CD2 3.74Å; Y65-F97 HydrophobicContact CD1-CD2 3.74Å; Y65-F97 AromaticContact CD1-CE2 3.93Å; Y65-F97 HydrophobicContact CD1-CE2 3.93Å; Y65-F97 HydrophobicContact CD2-CD2 4.46Å; Y65-F97 AromaticContact CD2-CE2 3.91Å; Y65-F97 HydrophobicContact CD2-CE2 3.91Å; Y65-F97 HydrophobicContact CE1-CD2 4.48Å; Y65-F97 HydrophobicContact CE1-CE2 4.45Å; Y65-F97 HydrophobicContact CE2-CE2 4.43Å; Y65-F97 AromaticContact CG-CD2 3.75Å; Y65-F97 HydrophobicContact CG-CD2 3.75Å; Y65-F97 AromaticContact CG-CE2 3.65Å; Y65-F97 HydrophobicContact CG-CE2 3.65Å; Y65-K100 HydrophobicContact CD1-CD 4.46Å; Y65-K100 HydrophobicContact CE1-CB 4.27Å; Y65-K100 HydrophobicContact CE1-CD 4.41Å; Y65-K100 HydrophobicContact CE1-CG 4.07Å; Y65-Y101 WeakPolarHBondContact OH-CA 3.17Å; Y65-L104 HydrophobicContact CE1-CD1 4.27Å; Y65-E105 WeakPolarHBondContact CE2-OE1 3.42Å; Y65-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y65-E105 VanDerWaalsContact OH-CD 3.31Å; Y65-E105 PolarHBondContact OH-OE1 2.92Å; Y65-L366 HydrophobicContact CD2-CD1 4.26Å; Y65-L366 HydrophobicContact CE2-CD1 4.44Å
66	P	90	Very high	81	Confident	13 Å²	13	71.5 Å²	71.5	8%	0.084	41%	0.407	C	S	.	.	S	Bend	cis	-64.1	159.8	-8.2	-22.3	35.8	0	0	0	113	V68 R73 K100 L104	P66-V68 VanDerWaalsContact C-N 3.3Å; P66-V68 PolarHBondContact O-N 3.26Å; P66-R73 PolarHBondContact O-NE 3.1Å; P66-K100 HydrophobicContact CG-CD 4.36Å; P66-L104 HydrophobicContact CB-CD1 4.39Å; P66-L104 HydrophobicContact CG-CD1 3.51Å
67	V	85.2	Confident	83.5	Confident	58 Å²	58	69 Å²	69	35%	0.352	38%	0.376	S	S	.	.	S	Bend	trans	-59.9	-43.2	178.2	-178.4	0	0	0	0	110.4	R73 Q370	V67-R73 PolarHBondContact O-NH2 3.42Å; V67-Q370 HydrophobicContact CG2-CG 4.17Å
68	V	82.4	Confident	85.3	Confident	106 Å²	106	63.5 Å²	63.5	64%	0.642	35%	0.351	S	S	*	.	S	Bend	trans	-68.9	133.3	176.4	-178.3	0	0	0	0	110.2	P66 C70 R73	P66-V68 VanDerWaalsContact C-N 3.3Å; P66-V68 PolarHBondContact O-N 3.26Å; V68-C70 PolarHBondContact O-N 3.38Å; V68-R73 VanDerWaalsContact C-NH2 3.3Å
69	P	78.1	Confident	87.2	Confident	104 Å²	104	59.6 Å²	59.6	68%	0.675	33%	0.333	S	S	*	.			trans	-61	113.4	175.9	-16.8	25.2	0	0	0	110.3	R73	P69-R73 VanDerWaalsContact CA-CZ 3.49Å
70	C	78.6	Confident	88.4	Confident	57 Å²	57	56.6 Å²	56.6	39%	0.385	31%	0.313	S	S	.	.			trans	-144.5	159.4	179.7	73.3	0	0	0	0	110.7	V68 G72 R73	V68-C70 PolarHBondContact O-N 3.38Å; C70-G72 PolarHBondContact O-N 3.42Å; C70-R73 WeakPolarHBondContact O-CB 3.33Å; C70-R73 PolarHBondContact O-N 3.44Å; C70-R73 VanDerWaalsContact O-N 3.09Å
71	I	74.2	Confident	89.1	Confident	135 Å²	135	52.4 Å²	52.4	69%	0.692	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	131.2	172	-62	176	0	0	0	108.9
72	G	78.3	Confident	89.4	Confident	46 Å²	46	50.2 Å²	50.2	47%	0.474	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	22.6	-176.1	0	0	0	0	0	114.2	C70 K100	C70-G72 PolarHBondContact O-N 3.42Å; G72-K100 PolarHBondContact O-NZ 2.98Å
73	R	88.8	Confident	89.7	Confident	83 Å²	83	49.9 Å²	49.9	31%	0.313	28%	0.283	S	S	.	.			trans	-60.3	137.1	163	179.5	-172.7	-87.4	-174.8	-4.4	109.6	Q64 Y65 P66 V67 V68 P69 C70	Q64-R73 HydrophobicContact CB-CG 4.28Å; Q64-R73 HydrophobicContact CG-CG 4.44Å; Y65-R73 CarbonylContact O-C 3.45Å; Y65-R73 WeakPolarHBondContact O-CA 3.45Å; P66-R73 PolarHBondContact O-NE 3.1Å; V67-R73 PolarHBondContact O-NH2 3.42Å; V68-R73 VanDerWaalsContact C-NH2 3.3Å; P69-R73 VanDerWaalsContact CA-CZ 3.49Å; C70-R73 WeakPolarHBondContact O-CB 3.33Å; C70-R73 PolarHBondContact O-N 3.44Å; C70-R73 VanDerWaalsContact O-N 3.09Å
74	M	92	Very high	89.9	Confident	39 Å²	39	49.9 Å²	49.9	19%	0.192	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.4	178.9	-63	173.4	-66	0	0	109.3	Q64 Y65 L76 D96 F97 K100	Q64-M74 CarbonylContact C-O 3.59Å; Q64-M74 WeakPolarHBondContact CA-O 3.3Å; Y65-M74 PolarHBondContact N-O 2.99Å; Y65-M74 PolarHBondContact O-N 2.87Å; M74-L76 HydrophobicContact CB-CD1 4.48Å; M74-D96 HydrophobicContact CE-CB 4.46Å; M74-D96 HydrophobicContact SD-CB 3.63Å; M74-F97 HydrophobicContact CE-CB 4.33Å; M74-K100 HydrophobicContact CE-CB 4.1Å; M74-K100 HydrophobicContact CE-CD 3.7Å
75	T	94.1	Very high	90.1	Very high	65 Å²	65	52 Å²	52	40%	0.399	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.6	170.3	-59.9	0	0	0	0	107.1	R61 Q64	R61-T75 HydrophobicContact CB-CG2 4.29Å; R61-T75 HydrophobicContact CG-CG2 3.7Å; Q64-T75 PolarHBondContact NE2-OG1 3.45Å
76	L	95.5	Very high	90.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.5	174.7	-67.8	90.1	0	0	0	108.7	L62 I63 M74 D80 V93 I94 F97 L363	L62-L76 WeakPolarHBondContact CA-O 3.4Å; L62-L76 WeakPolarHBondContact CB-O 3.35Å; L62-L76 PolarHBondContact N-O 3.36Å; I63-L76 HydrophobicContact CD1-CD1 4.14Å; I63-L76 HydrophobicContact CD1-CD2 4.49Å; I63-L76 HydrophobicContact CG1-CB 3.79Å; I63-L76 HydrophobicContact CG1-CD1 3.85Å; I63-L76 HydrophobicContact CG1-CG 4.24Å; I63-L76 PolarHBondContact N-O 3.36Å; I63-L76 PolarHBondContact O-N 3.45Å; M74-L76 HydrophobicContact CB-CD1 4.48Å; L76-D80 WeakPolarHBondContact CA-OD2 3.24Å; L76-V93 HydrophobicContact CD2-CG1 4.21Å; L76-V93 HydrophobicContact CG-CG1 3.77Å; L76-I94 HydrophobicContact CD2-CD1 4.21Å; L76-F97 HydrophobicContact CD1-CB 4.42Å; L76-F97 HydrophobicContact CD1-CD2 3.97Å; L76-F97 HydrophobicContact CD1-CG 4.35Å; L76-F97 HydrophobicContact CD2-CB 3.81Å; L76-F97 HydrophobicContact CD2-CD1 4.01Å; L76-F97 HydrophobicContact CD2-CD2 3.9Å; L76-F97 HydrophobicContact CD2-CG 3.6Å; L76-L363 HydrophobicContact CD2-CD1 4.45Å; L76-L363 HydrophobicContact CD2-CD2 3.49Å; L76-L363 VanDerWaalsContact CD2-CD2 3.49Å
77	T	96.1	Very high	90.4	Very high	25 Å²	25	58.3 Å²	58.3	15%	0.153	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	171.8	-178.7	75.5	0	0	0	0	111.5	P59 T60 E79 D80 L81	P59-T77 HydrophobicContact CB-CG2 3.78Å; T60-T77 CarbonylContact O-C 3.58Å; T60-T77 VanDerWaalsContact O-CA 3.32Å; T60-T77 WeakPolarHBondContact O-CA 3.29Å; T60-T77 WeakPolarHBondContact O-CB 3.33Å; T77-E79 WeakPolarHBondContact CB-OE2 3.47Å; T77-E79 PolarHBondContact O-N 3.09Å; T77-E79 PolarHBondContact OG1-N 3.16Å; T77-E79 PolarHBondContact OG1-OE2 3.05Å; T77-D80 PolarHBondContact N-OD2 2.8Å; T77-D80 WeakPolarHBondContact O-CB 3.43Å; T77-D80 PolarHBondContact O-N 3.19Å; T77-D80 PolarHBondContact OG1-OD2 3.08Å; T77-L81 PolarHBondContact O-N 3.22Å
78	Q	94.1	Very high	90.9	Very high	72 Å²	72	60.6 Å²	60.6	34%	0.336	36%	0.36	S	S	.	.	H	α-helix	trans	-59	-38	174	-177.9	56.8	51.3	0	0	111.8	T60 D80 L81 D82	T60-Q78 PolarHBondContact O-N 2.83Å; Q78-D80 VanDerWaalsContact C-N 3.26Å; Q78-D80 PolarHBondContact O-N 3.25Å; Q78-L81 WeakPolarHBondContact O-CA 2.91Å; Q78-L81 VanDerWaalsContact O-CB 3.25Å; Q78-L81 WeakPolarHBondContact O-CB 3.49Å; Q78-L81 PolarHBondContact O-N 3.06Å; Q78-D82 PolarHBondContact NE2-OD1 2.73Å; Q78-D82 VanDerWaalsContact O-CG 3.23Å; Q78-D82 PolarHBondContact O-N 3.05Å
79	E	94.4	Very high	91.6	Very high	91 Å²	91	58.2 Å²	58.2	43%	0.425	34%	0.341	S	S	.	.	H	α-helix	trans	-65	-30.9	178.3	-58.2	77.9	-173.8	0	0	112.3	P59 T77 L81 D82	P59-E79 WeakPolarHBondContact CB-OE2 3.16Å; T77-E79 WeakPolarHBondContact CB-OE2 3.47Å; T77-E79 PolarHBondContact O-N 3.09Å; T77-E79 PolarHBondContact OG1-N 3.16Å; T77-E79 PolarHBondContact OG1-OE2 3.05Å; E79-L81 VanDerWaalsContact C-N 3.34Å; E79-D82 PolarHBondContact O-N 2.94Å
80	D	96.6	Very high	92.5	Very high	16 Å²	16	53.5 Å²	53.5	9%	0.086	31%	0.31	C	S	.	.	H	α-helix	trans	-68.3	-35.8	171.7	-61.2	-48.1	0	0	0	111.4	L76 T77 Q78 D82 C83 N91 V93 I94	L76-D80 WeakPolarHBondContact CA-OD2 3.24Å; T77-D80 PolarHBondContact N-OD2 2.8Å; T77-D80 WeakPolarHBondContact O-CB 3.43Å; T77-D80 PolarHBondContact O-N 3.19Å; T77-D80 PolarHBondContact OG1-OD2 3.08Å; Q78-D80 VanDerWaalsContact C-N 3.26Å; Q78-D80 PolarHBondContact O-N 3.25Å; D80-D82 VanDerWaalsContact C-N 3.33Å; D80-C83 PolarHBondContact O-N 2.9Å; D80-C83 PolarHBondContact O-SG 3.37Å; D80-N91 PolarHBondContact OD1-ND2 2.86Å; D80-V93 HydrophobicContact CB-CG1 4.34Å; D80-V93 WeakPolarHBondContact OD1-CB 3.41Å; D80-V93 WeakPolarHBondContact OD2-CG1 3.2Å; D80-I94 HydrophobicContact CB-CD1 4.12Å; D80-I94 HydrophobicContact CB-CG1 4.39Å; D80-I94 WeakPolarHBondContact O-CD1 3.44Å; D80-I94 WeakPolarHBondContact O-CG1 3.49Å
81	L	95.6	Very high	93.5	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-38.5	175.6	-167.2	69.6	0	0	0	111.1	L62 T77 Q78 E79 C83 L84 R360 L363 L364	L62-L81 HydrophobicContact CD2-CB 4.5Å; L62-L81 HydrophobicContact CD2-CD1 4.36Å; L62-L81 HydrophobicContact CD2-CD2 4.27Å; T77-L81 PolarHBondContact O-N 3.22Å; Q78-L81 WeakPolarHBondContact O-CA 2.91Å; Q78-L81 VanDerWaalsContact O-CB 3.25Å; Q78-L81 WeakPolarHBondContact O-CB 3.49Å; Q78-L81 PolarHBondContact O-N 3.06Å; E79-L81 VanDerWaalsContact C-N 3.34Å; L81-C83 VanDerWaalsContact C-N 3.25Å; L81-C83 PolarHBondContact O-N 3.19Å; L81-L84 HydrophobicContact CD1-CD1 4.08Å; L81-L84 VanDerWaalsContact O-CB 3.31Å; L81-L84 WeakPolarHBondContact O-CB 3.2Å; L81-L84 PolarHBondContact O-N 3.1Å; L81-L84 VanDerWaalsContact O-N 3.1Å; L81-R360 HydrophobicContact CD1-CB 4.43Å; L81-R360 HydrophobicContact CD1-CG 4Å; L81-L363 HydrophobicContact CD1-CB 3.93Å; L81-L363 HydrophobicContact CD1-CD1 3.56Å; L81-L363 HydrophobicContact CD1-CG 4.39Å; L81-L364 HydrophobicContact CD2-CD2 4Å
82	D	94.8	Very high	94.6	Very high	74 Å²	74	48.4 Å²	48.4	40%	0.396	28%	0.281	S	S	.	.	H	α-helix	trans	-63.6	-29.9	-178.5	-60.8	-16.9	0	0	0	111.9	Q78 E79 D80 L84 D85	Q78-D82 PolarHBondContact NE2-OD1 2.73Å; Q78-D82 VanDerWaalsContact O-CG 3.23Å; Q78-D82 PolarHBondContact O-N 3.05Å; E79-D82 PolarHBondContact O-N 2.94Å; D80-D82 VanDerWaalsContact C-N 3.33Å; D82-L84 PolarHBondContact O-N 2.68Å; D82-L84 VanDerWaalsContact O-N 3.08Å; D82-D85 VanDerWaalsContact O-CB 3.3Å; D82-D85 WeakPolarHBondContact O-CB 3.22Å; D82-D85 PolarHBondContact O-N 3.15Å
83	C	95.7	Very high	95.5	Very high	14 Å²	14	48.3 Å²	48.3	10%	0.095	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-9.9	177	87.3	0	0	0	0	114.1	D80 L81 E88 I94 R356	D80-C83 PolarHBondContact O-N 2.9Å; D80-C83 PolarHBondContact O-SG 3.37Å; L81-C83 VanDerWaalsContact C-N 3.25Å; L81-C83 PolarHBondContact O-N 3.19Å; C83-E88 WeakPolarHBondContact O-CB 3.4Å; C83-I94 WeakPolarHBondContact SG-CG1 3.17Å; C83-R356 PolarHBondContact O-NH1 2.95Å
84	L	97.6	Very high	95.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.8	171.3	-66.8	162.3	0	0	0	112.6	L81 D82 L90 I94 R356 I359 R360 L363	L81-L84 HydrophobicContact CD1-CD1 4.08Å; L81-L84 VanDerWaalsContact O-CB 3.31Å; L81-L84 WeakPolarHBondContact O-CB 3.2Å; L81-L84 PolarHBondContact O-N 3.1Å; L81-L84 VanDerWaalsContact O-N 3.1Å; D82-L84 PolarHBondContact O-N 2.68Å; D82-L84 VanDerWaalsContact O-N 3.08Å; L84-L90 HydrophobicContact CD2-CD2 3.81Å; L84-I94 HydrophobicContact CD1-CD1 4.28Å; L84-I94 HydrophobicContact CD2-CG2 3.97Å; L84-R356 WeakPolarHBondContact O-CB 3.03Å; L84-R356 WeakPolarHBondContact O-CD 3.45Å; L84-I359 HydrophobicContact CD1-CB 4.22Å; L84-I359 HydrophobicContact CD1-CG2 3.75Å; L84-I359 HydrophobicContact CD2-CB 3.91Å; L84-I359 HydrophobicContact CD2-CD1 4.14Å; L84-I359 HydrophobicContact CD2-CG2 3.87Å; L84-I359 HydrophobicContact CG-CG2 4.48Å; L84-R360 HydrophobicContact CD1-CB 4.19Å; L84-R360 PolarHBondContact O-NH1 3.25Å; L84-R360 PolarHBondContact O-NH2 3.45Å; L84-L363 HydrophobicContact CD1-CD1 3.81Å
85	D	96.8	Very high	96.3	Very high	81 Å²	81	42.5 Å²	42.5	43%	0.433	25%	0.247	S	C	.	.	S	Bend	trans	-64.1	156.3	173.7	-73.7	-9.4	0	0	0	111.4	D82 G87 E88 R356 R360	D82-D85 VanDerWaalsContact O-CB 3.3Å; D82-D85 WeakPolarHBondContact O-CB 3.22Å; D82-D85 PolarHBondContact O-N 3.15Å; D85-G87 PolarHBondContact O-N 3.27Å; D85-E88 HydrophobicContact CB-CG 4.11Å; D85-E88 PolarHBondContact O-N 2.91Å; D85-R356 PolarHBondContact O-NH1 2.99Å; D85-R360 VanDerWaalsContact N-NH2 3.17Å; D85-R360 IonicContact OD1-CZ 3.03Å; D85-R360 IonicContact OD1-NH2 2.68Å; D85-R360 PolarHBondContact OD1-NH2 3.48Å
86	A	94.6	Very high	96.4	Very high	98 Å²	98	40.1 Å²	40.1	81%	0.81	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	130.6	-179.3	0	0	0	0	0	110.2	E88	A86-E88 VanDerWaalsContact C-N 3.34Å
87	G	94.3	Very high	96.6	Very high	48 Å²	48	40.1 Å²	40.1	50%	0.495	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	-14.5	-179.2	0	0	0	0	0	114.7	D85 S316	D85-G87 PolarHBondContact O-N 3.27Å; G87-S316 VanDerWaalsContact C-OG 3.24Å; G87-S316 WeakPolarHBondContact CA-OG 3.24Å; G87-S316 WeakPolarHBondContact O-CB 3.07Å; G87-S316 PolarHBondContact O-OG 2.65Å
88	E	96.6	Very high	96.6	Very high	106 Å²	106	39.4 Å²	39.4	50%	0.495	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-84.8	146.5	-178.9	-66.2	-56.7	133.3	0	0	112.9	C83 D85 A86 R356	C83-E88 WeakPolarHBondContact O-CB 3.4Å; D85-E88 HydrophobicContact CB-CG 4.11Å; D85-E88 PolarHBondContact O-N 2.91Å; A86-E88 VanDerWaalsContact C-N 3.34Å; E88-R356 VanDerWaalsContact O-CZ 3.22Å; E88-R356 PolarHBondContact O-NH1 3.47Å; E88-R356 PolarHBondContact O-NH2 2.86Å
89	F	96.9	Very high	96.8	Very high	57 Å²	57	36 Å²	36	25%	0.25	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-75.4	134.3	172.4	-71.5	-85.8	0	0	0	110.4	H33 N91	H33-F89 AromaticContact CD2-CE2 3.87Å; H33-F89 AromaticContact CD2-CZ 3.64Å; H33-F89 AromaticContact CE1-CE2 3.34Å; H33-F89 WeakPolarHBondContact CE1-CE2 3.42Å; H33-F89 AromaticContact CE1-CZ 3.77Å; H33-F89 AromaticContact ND1-CE2 3.79Å; H33-F89 AromaticContact NE2-CE2 3.39Å; H33-F89 WeakPolarHBondContact NE2-CE2 3.38Å; H33-F89 AromaticContact NE2-CZ 3.28Å; H33-F89 VanDerWaalsContact NE2-CZ 3.28Å; H33-F89 WeakPolarHBondContact NE2-CZ 3.43Å; F89-N91 PolarHBondContact O-N 3.28Å
90	L	98.3	Very high	96.8	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-64.6	135.7	170.3	-57.7	-166.9	0	0	0	110.2	L84 I94 I95 W175 V320 L323	L84-L90 HydrophobicContact CD2-CD2 3.81Å; L90-I94 HydrophobicContact CD1-CG2 4.17Å; L90-I94 HydrophobicContact CD2-CG2 4.37Å; L90-I95 HydrophobicContact CB-CD1 4.11Å; L90-I95 HydrophobicContact CB-CG1 4.35Å; L90-I95 HydrophobicContact CD1-CD1 4.04Å; L90-W175 PolarHBondContact O-NE1 3.31Å; L90-V320 HydrophobicContact CD1-CG2 3.87Å; L90-V320 HydrophobicContact CD2-CG2 4.38Å; L90-V320 HydrophobicContact CG-CG2 4.16Å; L90-L323 HydrophobicContact CD1-CD1 3.83Å
91	N	97.6	Very high	96.8	Very high	45 Å²	45	34.8 Å²	34.8	24%	0.241	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-87.9	171.5	177.4	76	15.3	0	0	0	112.2	D80 F89 V93 I94 I95	D80-N91 PolarHBondContact OD1-ND2 2.86Å; F89-N91 PolarHBondContact O-N 3.28Å; N91-V93 VanDerWaalsContact C-N 3.26Å; N91-V93 PolarHBondContact O-N 2.97Å; N91-V93 WeakPolarHBondContact OD1-CB 3.34Å; N91-V93 PolarHBondContact OD1-N 2.93Å; N91-V93 VanDerWaalsContact OD1-N 3.07Å; N91-I94 PolarHBondContact O-N 3.4Å; N91-I94 PolarHBondContact OD1-N 3.1Å; N91-I95 WeakPolarHBondContact O-CG1 3.44Å; N91-I95 PolarHBondContact O-N 3Å
92	D	97.7	Very high	96.8	Very high	41 Å²	41	34.3 Å²	34.3	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-56.3	-39.9	179.7	-68.1	-61.4	0	0	0	112.6	I95 D96 S120 F121 W175	D92-I95 PolarHBondContact O-N 3.06Å; D92-D96 WeakPolarHBondContact O-CB 3.14Å; D92-D96 PolarHBondContact O-N 2.89Å; D92-S120 WeakPolarHBondContact CB-OG 3.33Å; D92-S120 WeakPolarHBondContact OD1-CB 3.37Å; D92-S120 PolarHBondContact OD1-OG 3.26Å; D92-F121 HydrophobicContact CB-CE2 4.06Å; D92-F121 HydrophobicContact CB-CZ 4.45Å; D92-W175 WeakPolarHBondContact OD1-CH2 3.47Å
93	V	97.4	Very high	96.7	Very high	43 Å²	43	32.4 Å²	32.4	26%	0.261	19%	0.189	S	C	.	.	H	α-helix	trans	-65.1	-46.4	-175.6	179.1	0	0	0	0	111	L76 D80 N91 F97	L76-V93 HydrophobicContact CD2-CG1 4.21Å; L76-V93 HydrophobicContact CG-CG1 3.77Å; D80-V93 HydrophobicContact CB-CG1 4.34Å; D80-V93 WeakPolarHBondContact OD1-CB 3.41Å; D80-V93 WeakPolarHBondContact OD2-CG1 3.2Å; N91-V93 VanDerWaalsContact C-N 3.26Å; N91-V93 PolarHBondContact O-N 2.97Å; N91-V93 WeakPolarHBondContact OD1-CB 3.34Å; N91-V93 PolarHBondContact OD1-N 2.93Å; N91-V93 VanDerWaalsContact OD1-N 3.07Å; V93-F97 WeakPolarHBondContact O-CB 3.28Å; V93-F97 PolarHBondContact O-N 2.74Å
94	I	98.4	Very high	96.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-40.6	177.7	-67.4	-53.9	0	0	0	111.5	L76 D80 C83 L84 L90 N91 Y98 I359 L363	L76-I94 HydrophobicContact CD2-CD1 4.21Å; D80-I94 HydrophobicContact CB-CD1 4.12Å; D80-I94 HydrophobicContact CB-CG1 4.39Å; D80-I94 WeakPolarHBondContact O-CD1 3.44Å; D80-I94 WeakPolarHBondContact O-CG1 3.49Å; C83-I94 WeakPolarHBondContact SG-CG1 3.17Å; L84-I94 HydrophobicContact CD1-CD1 4.28Å; L84-I94 HydrophobicContact CD2-CG2 3.97Å; L90-I94 HydrophobicContact CD1-CG2 4.17Å; L90-I94 HydrophobicContact CD2-CG2 4.37Å; N91-I94 PolarHBondContact O-N 3.4Å; N91-I94 PolarHBondContact OD1-N 3.1Å; I94-Y98 WeakPolarHBondContact O-CB 3.34Å; I94-Y98 PolarHBondContact O-N 2.89Å; I94-I359 HydrophobicContact CG2-CG2 4.37Å; I94-L363 HydrophobicContact CD1-CD1 3.82Å
95	I	98.6	Very high	96.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-53.3	177	-65.2	-65.2	0	0	0	110.5	L90 N91 D92 Y98 L99 P168 W175 L322 L323	L90-I95 HydrophobicContact CB-CD1 4.11Å; L90-I95 HydrophobicContact CB-CG1 4.35Å; L90-I95 HydrophobicContact CD1-CD1 4.04Å; N91-I95 WeakPolarHBondContact O-CG1 3.44Å; N91-I95 PolarHBondContact O-N 3Å; D92-I95 PolarHBondContact O-N 3.06Å; I95-Y98 PolarHBondContact O-N 2.93Å; I95-L99 HydrophobicContact CG2-CD1 3.92Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 VanDerWaalsContact O-CG 3.29Å; I95-L99 WeakPolarHBondContact O-CG 3.42Å; I95-L99 PolarHBondContact O-N 3.3Å; I95-L99 VanDerWaalsContact O-N 3.08Å; I95-P168 HydrophobicContact CG2-CB 3.85Å; I95-P168 HydrophobicContact CG2-CG 4.34Å; I95-W175 HydrophobicContact CG1-CD2 4.31Å; I95-W175 HydrophobicContact CG1-CH2 4.31Å; I95-W175 HydrophobicContact CG1-CZ2 4.05Å; I95-W175 HydrophobicContact CG2-CZ3 4.36Å; I95-L322 HydrophobicContact CD1-CD2 4.38Å; I95-L322 HydrophobicContact CG2-CD2 4.17Å; I95-L323 HydrophobicContact CD1-CD1 4.14Å; I95-L323 HydrophobicContact CD1-CD2 4.01Å; I95-L323 HydrophobicContact CD1-CG 3.88Å; I95-L323 HydrophobicContact CG2-CD2 4.45Å
96	D	97.9	Very high	95.4	Very high	16 Å²	16	38.7 Å²	38.7	9%	0.086	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-41.4	-176.9	-74.2	-12.7	0	0	0	111.8	M74 D92 K100 S119 S120	M74-D96 HydrophobicContact CE-CB 4.46Å; M74-D96 HydrophobicContact SD-CB 3.63Å; D92-D96 WeakPolarHBondContact O-CB 3.14Å; D92-D96 PolarHBondContact O-N 2.89Å; D96-K100 VanDerWaalsContact O-CB 3.26Å; D96-K100 WeakPolarHBondContact O-CB 3.45Å; D96-K100 PolarHBondContact O-N 3.24Å; D96-S119 WeakPolarHBondContact OD1-CA 3.46Å; D96-S119 WeakPolarHBondContact OD2-CB 3.3Å; D96-S120 PolarHBondContact OD1-N 3.19Å; D96-S120 PolarHBondContact OD2-N 2.93Å
97	F	97.7	Very high	94.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.4	-55.6	174.2	161.3	-102.8	0	0	0	111.6	I63 Y65 M74 L76 V93 L99 K100 Y101 I359 L362 L363 L366	I63-F97 HydrophobicContact CD1-CE2 4.25Å; Y65-F97 AromaticContact CD1-CD2 3.74Å; Y65-F97 HydrophobicContact CD1-CD2 3.74Å; Y65-F97 AromaticContact CD1-CE2 3.93Å; Y65-F97 HydrophobicContact CD1-CE2 3.93Å; Y65-F97 HydrophobicContact CD2-CD2 4.46Å; Y65-F97 AromaticContact CD2-CE2 3.91Å; Y65-F97 HydrophobicContact CD2-CE2 3.91Å; Y65-F97 HydrophobicContact CE1-CD2 4.48Å; Y65-F97 HydrophobicContact CE1-CE2 4.45Å; Y65-F97 HydrophobicContact CE2-CE2 4.43Å; Y65-F97 AromaticContact CG-CD2 3.75Å; Y65-F97 HydrophobicContact CG-CD2 3.75Å; Y65-F97 AromaticContact CG-CE2 3.65Å; Y65-F97 HydrophobicContact CG-CE2 3.65Å; M74-F97 HydrophobicContact CE-CB 4.33Å; L76-F97 HydrophobicContact CD1-CB 4.42Å; L76-F97 HydrophobicContact CD1-CD2 3.97Å; L76-F97 HydrophobicContact CD1-CG 4.35Å; L76-F97 HydrophobicContact CD2-CB 3.81Å; L76-F97 HydrophobicContact CD2-CD1 4.01Å; L76-F97 HydrophobicContact CD2-CD2 3.9Å; L76-F97 HydrophobicContact CD2-CG 3.6Å; V93-F97 WeakPolarHBondContact O-CB 3.28Å; V93-F97 PolarHBondContact O-N 2.74Å; F97-L99 PolarHBondContact O-N 2.92Å; F97-K100 PolarHBondContact O-N 2.7Å; F97-Y101 WeakPolarHBondContact O-CB 3.32Å; F97-Y101 PolarHBondContact O-N 2.98Å; F97-I359 HydrophobicContact CE1-CG2 4.46Å; F97-L362 HydrophobicContact CE1-CD2 4.11Å; F97-L362 HydrophobicContact CZ-CD2 3.95Å; F97-L362 HydrophobicContact CZ-CG 4.27Å; F97-L363 HydrophobicContact CD1-CD2 3.87Å; F97-L363 HydrophobicContact CD2-CD2 4.43Å; F97-L363 HydrophobicContact CE1-CD2 3.36Å; F97-L363 HydrophobicContact CE1-CG 3.95Å; F97-L363 HydrophobicContact CE2-CD2 3.98Å; F97-L363 HydrophobicContact CG-CD2 4.39Å; F97-L363 HydrophobicContact CZ-CD2 3.43Å; F97-L363 VanDerWaalsContact CZ-CD2 3.43Å; F97-L363 HydrophobicContact CZ-CG 4.3Å; F97-L366 HydrophobicContact CE2-CD1 3.91Å; F97-L366 HydrophobicContact CZ-CD1 3.75Å
98	Y	98.1	Very high	93.4	Very high	10 Å²	10	35.1 Å²	35.1	4%	0.039	18%	0.183	C	C	.	.	H	α-helix	trans	-70.1	-38.8	-171	-166	-106.1	0	0	0	111.5	I94 I95 K100 Y101 L102 L323 K355 I359 L362	I94-Y98 WeakPolarHBondContact O-CB 3.34Å; I94-Y98 PolarHBondContact O-N 2.89Å; I95-Y98 PolarHBondContact O-N 2.93Å; Y98-K100 VanDerWaalsContact C-N 3.31Å; Y98-K100 PolarHBondContact O-N 3.5Å; Y98-Y101 HydrophobicContact CD2-CD1 4.21Å; Y98-Y101 HydrophobicContact CE2-CD1 4.1Å; Y98-Y101 HydrophobicContact CE2-CE1 4.47Å; Y98-Y101 WeakPolarHBondContact O-CB 3.45Å; Y98-Y101 PolarHBondContact O-N 2.69Å; Y98-L102 HydrophobicContact CD1-CD1 3.87Å; Y98-L102 HydrophobicContact CD1-CG 4.06Å; Y98-L102 HydrophobicContact CE1-CD1 3.84Å; Y98-L102 HydrophobicContact CE1-CD2 4.02Å; Y98-L102 HydrophobicContact CE1-CG 3.96Å; Y98-L102 VanDerWaalsContact O-CG 3.29Å; Y98-L102 WeakPolarHBondContact O-CG 3.46Å; Y98-L102 PolarHBondContact O-N 2.86Å; Y98-L323 HydrophobicContact CD1-CB 3.82Å; Y98-L323 HydrophobicContact CD1-CD1 3.8Å; Y98-L323 HydrophobicContact CD1-CD2 3.94Å; Y98-L323 HydrophobicContact CD1-CG 4.05Å; Y98-L323 HydrophobicContact CE1-CB 4.2Å; Y98-L323 HydrophobicContact CG-CD1 4.03Å; Y98-L323 HydrophobicContact CG-CD2 4.47Å; Y98-K355 HydrophobicContact CE1-CD 4.24Å; Y98-I359 HydrophobicContact CD1-CD1 4.47Å; Y98-I359 HydrophobicContact CD2-CD1 4.27Å; Y98-I359 HydrophobicContact CD2-CG1 3.69Å; Y98-I359 HydrophobicContact CD2-CG2 4.32Å; Y98-I359 HydrophobicContact CE2-CD1 4.46Å; Y98-I359 HydrophobicContact CE2-CG1 3.62Å; Y98-I359 HydrophobicContact CG-CD1 4.24Å; Y98-I359 HydrophobicContact CG-CG1 4.17Å; Y98-L362 HydrophobicContact CD2-CD2 4.12Å; Y98-L362 HydrophobicContact CE2-CD2 3.97Å
99	L	97.5	Very high	92.9	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-41.7	172.9	-72	178.4	0	0	0	112.1	I95 F97 L102 L103 V117 P168 L322 L323 A326	I95-L99 HydrophobicContact CG2-CD1 3.92Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 VanDerWaalsContact O-CG 3.29Å; I95-L99 WeakPolarHBondContact O-CG 3.42Å; I95-L99 PolarHBondContact O-N 3.3Å; I95-L99 VanDerWaalsContact O-N 3.08Å; F97-L99 PolarHBondContact O-N 2.92Å; L99-L102 PolarHBondContact O-N 3.03Å; L99-L103 WeakPolarHBondContact O-CD1 3.27Å; L99-L103 PolarHBondContact O-N 2.98Å; L99-V117 HydrophobicContact CB-CG2 3.83Å; L99-V117 HydrophobicContact CD1-CG2 3.87Å; L99-V117 HydrophobicContact CG-CG2 4.36Å; L99-P168 HydrophobicContact CD1-CB 3.99Å; L99-P168 HydrophobicContact CD1-CG 3.8Å; L99-L322 HydrophobicContact CD1-CD2 4.22Å; L99-L322 HydrophobicContact CD2-CD2 4.37Å; L99-L323 HydrophobicContact CD2-CD2 3.92Å; L99-L323 HydrophobicContact CG-CD2 3.77Å; L99-A326 HydrophobicContact CD2-CB 3.4Å
100	K	95.1	Very high	92.6	Very high	40 Å²	40	34.4 Å²	34.4	17%	0.174	20%	0.201	C	C	.	.	H	α-helix	trans	-65.4	-43.5	176.1	-168.9	170.7	-174.3	165.2	0	111.5	Y65 P66 G72 M74 D96 F97 Y98 L102 L103 L104	Y65-K100 HydrophobicContact CD1-CD 4.46Å; Y65-K100 HydrophobicContact CE1-CB 4.27Å; Y65-K100 HydrophobicContact CE1-CD 4.41Å; Y65-K100 HydrophobicContact CE1-CG 4.07Å; P66-K100 HydrophobicContact CG-CD 4.36Å; G72-K100 PolarHBondContact O-NZ 2.98Å; M74-K100 HydrophobicContact CE-CB 4.1Å; M74-K100 HydrophobicContact CE-CD 3.7Å; D96-K100 VanDerWaalsContact O-CB 3.26Å; D96-K100 WeakPolarHBondContact O-CB 3.45Å; D96-K100 PolarHBondContact O-N 3.24Å; F97-K100 PolarHBondContact O-N 2.7Å; Y98-K100 VanDerWaalsContact C-N 3.31Å; Y98-K100 PolarHBondContact O-N 3.5Å; K100-L102 VanDerWaalsContact C-N 3.34Å; K100-L102 PolarHBondContact O-N 3.31Å; K100-L103 PolarHBondContact O-N 3.08Å; K100-L104 HydrophobicContact CD-CD1 4.35Å; K100-L104 HydrophobicContact CG-CD1 3.78Å; K100-L104 HydrophobicContact CG-CG 4.29Å; K100-L104 WeakPolarHBondContact O-CG 3.18Å; K100-L104 PolarHBondContact O-N 2.99Å
101	Y	95.8	Very high	92.4	Very high	40 Å²	40	34.7 Å²	34.7	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-56.5	-46.7	174.8	169.5	-101.3	0	0	0	111.8	Y65 F97 Y98 L103 L104 E105 G106 L362	Y65-Y101 WeakPolarHBondContact OH-CA 3.17Å; F97-Y101 WeakPolarHBondContact O-CB 3.32Å; F97-Y101 PolarHBondContact O-N 2.98Å; Y98-Y101 HydrophobicContact CD2-CD1 4.21Å; Y98-Y101 HydrophobicContact CE2-CD1 4.1Å; Y98-Y101 HydrophobicContact CE2-CE1 4.47Å; Y98-Y101 WeakPolarHBondContact O-CB 3.45Å; Y98-Y101 PolarHBondContact O-N 2.69Å; Y101-L103 PolarHBondContact O-N 3.15Å; Y101-L104 PolarHBondContact O-N 3.37Å; Y101-E105 HydrophobicContact CD2-CB 3.92Å; Y101-E105 HydrophobicContact CE2-CB 3.69Å; Y101-E105 PolarHBondContact O-N 3.3Å; Y101-G106 PolarHBondContact O-N 3.36Å; Y101-L362 HydrophobicContact CD1-CD2 3.51Å; Y101-L362 HydrophobicContact CD2-CD1 4.45Å; Y101-L362 HydrophobicContact CD2-CD2 4.03Å; Y101-L362 HydrophobicContact CE1-CD1 4.35Å; Y101-L362 HydrophobicContact CE1-CD2 3.47Å; Y101-L362 VanDerWaalsContact CE1-CD2 3.47Å; Y101-L362 HydrophobicContact CE2-CD1 3.82Å; Y101-L362 HydrophobicContact CE2-CD2 4.01Å; Y101-L362 HydrophobicContact CG-CD2 3.8Å
102	L	95.6	Very high	92.2	Very high	1 Å²	1	33 Å²	33	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-34.6	179.5	-73.2	175.7	0	0	0	113.4	Y98 L99 K100 V107 A326 E327 L330	Y98-L102 HydrophobicContact CD1-CD1 3.87Å; Y98-L102 HydrophobicContact CD1-CG 4.06Å; Y98-L102 HydrophobicContact CE1-CD1 3.84Å; Y98-L102 HydrophobicContact CE1-CD2 4.02Å; Y98-L102 HydrophobicContact CE1-CG 3.96Å; Y98-L102 VanDerWaalsContact O-CG 3.29Å; Y98-L102 WeakPolarHBondContact O-CG 3.46Å; Y98-L102 PolarHBondContact O-N 2.86Å; L99-L102 PolarHBondContact O-N 3.03Å; K100-L102 VanDerWaalsContact C-N 3.34Å; K100-L102 PolarHBondContact O-N 3.31Å; L102-V107 HydrophobicContact CD2-CG2 4.25Å; L102-A326 HydrophobicContact CD1-CB 4.19Å; L102-E327 HydrophobicContact CD1-CB 3.92Å; L102-E327 HydrophobicContact CD2-CB 3.98Å; L102-E327 HydrophobicContact CD2-CG 3.79Å; L102-L330 HydrophobicContact CB-CD1 3.7Å; L102-L330 HydrophobicContact CD1-CD1 4.37Å
103	L	93.1	Very high	92	Very high	34 Å²	34	38 Å²	38	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-84.1	-32.6	-179.9	-90.5	70.8	0	0	0	113.5	L99 K100 Y101 A112 V117 L330	L99-L103 WeakPolarHBondContact O-CD1 3.27Å; L99-L103 PolarHBondContact O-N 2.98Å; K100-L103 PolarHBondContact O-N 3.08Å; Y101-L103 PolarHBondContact O-N 3.15Å; L103-A112 HydrophobicContact CG-CB 4.32Å; L103-V117 HydrophobicContact CD2-CB 3.96Å; L103-V117 HydrophobicContact CD2-CG1 3.84Å; L103-L330 HydrophobicContact CD1-CD1 3.8Å
104	L	90.9	Very high	92	Very high	100 Å²	100	40.8 Å²	40.8	52%	0.524	22%	0.223	S	C	.	.	H	α-helix	trans	-89.8	-43.9	-175.1	-66.3	-178.5	0	0	0	113.4	Y65 P66 K100 Y101	Y65-L104 HydrophobicContact CE1-CD1 4.27Å; P66-L104 HydrophobicContact CB-CD1 4.39Å; P66-L104 HydrophobicContact CG-CD1 3.51Å; K100-L104 HydrophobicContact CD-CD1 4.35Å; K100-L104 HydrophobicContact CG-CD1 3.78Å; K100-L104 HydrophobicContact CG-CG 4.29Å; K100-L104 WeakPolarHBondContact O-CG 3.18Å; K100-L104 PolarHBondContact O-N 2.99Å; Y101-L104 PolarHBondContact O-N 3.37Å
105	E	88.6	Confident	91.9	Very high	102 Å²	102	41.1 Å²	41.1	48%	0.477	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-11.9	-169.5	-70.5	171.1	-125.2	0	0	113	Y65 Y101	Y65-E105 WeakPolarHBondContact CE2-OE1 3.42Å; Y65-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y65-E105 VanDerWaalsContact OH-CD 3.31Å; Y65-E105 PolarHBondContact OH-OE1 2.92Å; Y101-E105 HydrophobicContact CD2-CB 3.92Å; Y101-E105 HydrophobicContact CE2-CB 3.69Å; Y101-E105 PolarHBondContact O-N 3.3Å
106	G	82.4	Confident	91.9	Very high	26 Å²	26	42.9 Å²	42.9	27%	0.268	23%	0.233	S	C	.	.	S	Bend	trans	-79.1	-154.9	-177.8	0	0	0	0	0	113.5	Y101 G108	Y101-G106 PolarHBondContact O-N 3.36Å; G106-G108 VanDerWaalsContact C-N 3.29Å; G106-G108 PolarHBondContact O-N 3.42Å
107	V	77.5	Confident	91.9	Very high	68 Å²	68	43.5 Å²	43.5	41%	0.412	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	6.9	-168	-67.4	0	0	0	0	114.4	L102 G109 E327 Q331	L102-V107 HydrophobicContact CD2-CG2 4.25Å; V107-G109 PolarHBondContact O-N 2.91Å; V107-E327 HydrophobicContact CG2-CG 3.83Å; V107-Q331 HydrophobicContact CB-CG 3.66Å; V107-Q331 HydrophobicContact CG1-CG 4.43Å; V107-Q331 HydrophobicContact CG2-CG 3.36Å
108	G	70.3	Confident	91.9	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.031	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-11.6	-165.7	0	0	0	0	0	116.7	G106 T110 V111 A112	G106-G108 VanDerWaalsContact C-N 3.29Å; G106-G108 PolarHBondContact O-N 3.42Å; G108-T110 PolarHBondContact O-N 2.71Å; G108-V111 WeakPolarHBondContact O-CA 3.23Å; G108-V111 WeakPolarHBondContact O-CB 3.46Å; G108-V111 PolarHBondContact O-N 3.48Å; G108-A112 PolarHBondContact O-N 3.37Å
109	G	85.8	Confident	91.8	Very high	50 Å²	50	45 Å²	45	52%	0.515	25%	0.249	S	C	.	.	H	α-helix	trans	43.9	-128.1	171.9	0	0	0	0	0	114.3	V107 V111 A112	V107-G109 PolarHBondContact O-N 2.91Å; G109-V111 VanDerWaalsContact C-N 3.32Å; G109-V111 PolarHBondContact O-N 2.71Å; G109-A112 PolarHBondContact O-N 3.48Å
110	T	89.4	Confident	91.8	Very high	98 Å²	98	45.2 Å²	45.2	60%	0.601	25%	0.251	S	S	*	.	H	α-helix	trans	-70.3	-24.6	179.3	58.8	0	0	0	0	113.7	G108 R114	G108-T110 PolarHBondContact O-N 2.71Å; T110-R114 PolarHBondContact O-NE 3.07Å
111	V	94.4	Very high	91.9	Very high	10 Å²	10	47.2 Å²	47.2	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-70.2	-43.4	176.6	-175.6	0	0	0	0	109.7	G108 G109 Q113 R114 S115 F164 F329 L330 P333	G108-V111 WeakPolarHBondContact O-CA 3.23Å; G108-V111 WeakPolarHBondContact O-CB 3.46Å; G108-V111 PolarHBondContact O-N 3.48Å; G109-V111 VanDerWaalsContact C-N 3.32Å; G109-V111 PolarHBondContact O-N 2.71Å; V111-Q113 VanDerWaalsContact C-N 3.34Å; V111-Q113 PolarHBondContact O-N 2.78Å; V111-R114 CarbonylContact O-C 3.57Å; V111-R114 PolarHBondContact O-N 3.26Å; V111-S115 WeakPolarHBondContact O-CB 3.42Å; V111-S115 PolarHBondContact O-N 3.15Å; V111-S115 VanDerWaalsContact O-N 3.14Å; V111-S115 PolarHBondContact O-OG 3.12Å; V111-F164 HydrophobicContact CG1-CD2 3.82Å; V111-F164 HydrophobicContact CG1-CE2 3.85Å; V111-F329 HydrophobicContact CG1-CD1 4.48Å; V111-F329 HydrophobicContact CG1-CE1 4.45Å; V111-L330 HydrophobicContact CB-CD2 4.33Å; V111-L330 HydrophobicContact CG1-CD2 3.94Å; V111-P333 HydrophobicContact CG2-CB 4.28Å; V111-P333 HydrophobicContact CG2-CG 3.89Å
112	A	93.8	Very high	92	Very high	10 Å²	10	45.4 Å²	45.4	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-42	177.9	0	0	0	0	0	112.6	L103 G108 G109 R114 S115 L330	L103-A112 HydrophobicContact CG-CB 4.32Å; G108-A112 PolarHBondContact O-N 3.37Å; G109-A112 PolarHBondContact O-N 3.48Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 2.84Å; A112-S115 WeakPolarHBondContact O-CB 3.36Å; A112-S115 PolarHBondContact O-N 3.1Å; A112-L330 HydrophobicContact CB-CD2 4.43Å
113	Q	93.8	Very high	92.1	Very high	146 Å²	146	45.8 Å²	45.8	68%	0.682	25%	0.254	S	S	*	.	H	α-helix	trans	-61.4	-35.5	178.7	-65.8	175.1	6.2	0	0	112.9	V111 S115 K162	V111-Q113 VanDerWaalsContact C-N 3.34Å; V111-Q113 PolarHBondContact O-N 2.78Å; Q113-S115 VanDerWaalsContact C-N 3.26Å; Q113-K162 PolarHBondContact O-NZ 2.92Å
114	R	96.4	Very high	92.2	Very high	102 Å²	102	49.4 Å²	49.4	39%	0.385	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	5.3	176.4	-60.4	-175.6	-63.4	148.5	11.8	112.9	T110 V111 A112 K162 D163 F164	T110-R114 PolarHBondContact O-NE 3.07Å; V111-R114 CarbonylContact O-C 3.57Å; V111-R114 PolarHBondContact O-N 3.26Å; A112-R114 VanDerWaalsContact C-N 3.26Å; A112-R114 PolarHBondContact O-N 2.84Å; R114-K162 CarbonylContact O-C 3.43Å; R114-K162 WeakPolarHBondContact O-CA 3.19Å; R114-K162 WeakPolarHBondContact O-CB 3.31Å; R114-D163 HydrophobicContact CB-CB 4.15Å; R114-D163 IonicContact CZ-OD2 2.6Å; R114-D163 IonicContact NE-OD2 3.4Å; R114-D163 IonicContact NH1-OD2 2.77Å; R114-D163 PolarHBondContact NH1-OD2 3.14Å; R114-D163 IonicContact NH2-OD2 3.97Å; R114-D163 PolarHBondContact O-N 3.13Å; R114-F164 PolarHBondContact O-N 2.86Å
115	S	97.9	Very high	92.4	Very high	7 Å²	7	47.9 Å²	47.9	5%	0.049	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	161.8	-179.4	-59.5	0	0	0	0	112.2	V111 A112 Q113 F164	V111-S115 WeakPolarHBondContact O-CB 3.42Å; V111-S115 PolarHBondContact O-N 3.15Å; V111-S115 VanDerWaalsContact O-N 3.14Å; V111-S115 PolarHBondContact O-OG 3.12Å; A112-S115 WeakPolarHBondContact O-CB 3.36Å; A112-S115 PolarHBondContact O-N 3.1Å; Q113-S115 VanDerWaalsContact C-N 3.26Å; S115-F164 CarbonylContact C-O 3.48Å; S115-F164 WeakPolarHBondContact CA-O 3.44Å
116	H	97.7	Very high	92.8	Very high	36 Å²	36	43.1 Å²	43.1	17%	0.167	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.4	164.7	176.8	73.7	0	0	0	108.6	F118 K162 F164 L165 F166	H116-F118 AromaticContact CD2-CD2 3.9Å; H116-F118 AromaticContact CD2-CE2 3.78Å; H116-F118 AromaticContact CD2-CZ 3.98Å; H116-F118 AromaticContact NE2-CD1 3.98Å; H116-F118 AromaticContact NE2-CE1 3.95Å; H116-K162 HydrophobicContact CB-CG 4.21Å; H116-F164 PolarHBondContact N-O 3.45Å; H116-L165 HydrophobicContact CB-CD2 3.88Å; H116-L165 CarbonylContact O-C 3.59Å; H116-L165 WeakPolarHBondContact O-CA 3.23Å; H116-F166 PolarHBondContact O-N 3.24Å
117	V	97.4	Very high	93.3	Very high	30 Å²	30	43.7 Å²	43.7	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.1	174	67.9	0	0	0	0	110.1	L99 L103 F166	L99-V117 HydrophobicContact CB-CG2 3.83Å; L99-V117 HydrophobicContact CD1-CG2 3.87Å; L99-V117 HydrophobicContact CG-CG2 4.36Å; L103-V117 HydrophobicContact CD2-CB 3.96Å; L103-V117 HydrophobicContact CD2-CG1 3.84Å; V117-F166 HydrophobicContact CB-CB 4.13Å; V117-F166 HydrophobicContact CG2-CB 3.75Å
118	F	98.3	Very high	94	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.018	23%	0.232	C	C	.	.			trans	-82.2	146.6	169.8	-72.9	-83.9	0	0	0	109.7	H116 F122 W153 T154 I159 L165 F166 V167 P168 Y282	H116-F118 AromaticContact CD2-CD2 3.9Å; H116-F118 AromaticContact CD2-CE2 3.78Å; H116-F118 AromaticContact CD2-CZ 3.98Å; H116-F118 AromaticContact NE2-CD1 3.98Å; H116-F118 AromaticContact NE2-CE1 3.95Å; F118-F122 HydrophobicContact CB-CB 3.78Å; F118-F122 HydrophobicContact CB-CD1 3.95Å; F118-F122 HydrophobicContact CB-CG 3.92Å; F118-F122 HydrophobicContact CD1-CB 3.91Å; F118-F122 AromaticContact CD1-CD1 3.84Å; F118-F122 HydrophobicContact CD1-CD1 3.84Å; F118-F122 AromaticContact CD1-CD2 3.43Å; F118-F122 HydrophobicContact CD1-CD2 3.43Å; F118-F122 VanDerWaalsContact CD1-CD2 3.43Å; F118-F122 HydrophobicContact CD1-CE1 4.22Å; F118-F122 AromaticContact CD1-CE2 3.85Å; F118-F122 HydrophobicContact CD1-CE2 3.85Å; F118-F122 AromaticContact CD1-CG 3.42Å; F118-F122 HydrophobicContact CD1-CG 3.42Å; F118-F122 VanDerWaalsContact CD1-CG 3.42Å; F118-F122 HydrophobicContact CD1-CZ 4.22Å; F118-F122 HydrophobicContact CD2-CD1 4.36Å; F118-F122 HydrophobicContact CD2-CE1 4.43Å; F118-F122 HydrophobicContact CE1-CD1 4.43Å; F118-F122 AromaticContact CE1-CD2 3.68Å; F118-F122 HydrophobicContact CE1-CD2 3.68Å; F118-F122 HydrophobicContact CE1-CE1 4.39Å; F118-F122 AromaticContact CE1-CE2 3.62Å; F118-F122 HydrophobicContact CE1-CE2 3.62Å; F118-F122 HydrophobicContact CE1-CG 4.09Å; F118-F122 AromaticContact CE1-CZ 4Å; F118-F122 HydrophobicContact CE1-CZ 4Å; F118-F122 HydrophobicContact CG-CB 4.18Å; F118-F122 AromaticContact CG-CD1 3.8Å; F118-F122 HydrophobicContact CG-CD1 3.8Å; F118-F122 HydrophobicContact CG-CD2 4.24Å; F118-F122 HydrophobicContact CG-CE1 4.25Å; F118-F122 AromaticContact CG-CG 3.8Å; F118-F122 HydrophobicContact CG-CG 3.8Å; F118-F122 HydrophobicContact CZ-CE2 4.24Å; F118-F122 HydrophobicContact CZ-CZ 4.2Å; F118-W153 HydrophobicContact CD1-CB 4.24Å; F118-W153 AromaticContact CD1-CD1 3.85Å; F118-W153 HydrophobicContact CD1-CG 4.38Å; F118-W153 HydrophobicContact CE1-CB 4.09Å; F118-T154 HydrophobicContact CE1-CG2 3.95Å; F118-T154 HydrophobicContact CZ-CG2 3.99Å; F118-I159 HydrophobicContact CZ-CG2 4.29Å; F118-L165 HydrophobicContact CE2-CB 4.14Å; F118-L165 HydrophobicContact CE2-CD1 4.32Å; F118-F166 PolarHBondContact N-O 2.81Å; F118-V167 HydrophobicContact CD2-CG2 3.65Å; F118-V167 HydrophobicContact CE2-CG2 4.27Å; F118-V167 HydrophobicContact CG-CG2 4.4Å; F118-P168 WeakPolarHBondContact O-CD 3.38Å; F118-P168 WeakPolarHBondContact O-CG 2.99Å; F118-Y282 HydrophobicContact CZ-CE1 4.06Å
119	S	96.9	Very high	94.4	Very high	36 Å²	36	52.8 Å²	52.8	25%	0.252	27%	0.269	S	S	.	.			trans	-67.8	157.9	167.7	60.9	0	0	0	0	111.3	D96 F121 F122 W153	D96-S119 WeakPolarHBondContact OD1-CA 3.46Å; D96-S119 WeakPolarHBondContact OD2-CB 3.3Å; S119-F121 PolarHBondContact O-N 3.31Å; S119-F121 VanDerWaalsContact O-N 3.09Å; S119-F122 VanDerWaalsContact O-CB 3.25Å; S119-F122 WeakPolarHBondContact O-CB 3.45Å; S119-F122 PolarHBondContact O-N 2.9Å; S119-W153 PolarHBondContact OG-NE1 3.3Å
120	S	96.7	Very high	93.6	Very high	7 Å²	7	54 Å²	54	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-27	177.9	74.7	0	0	0	0	113.2	D92 D96 F122	D92-S120 WeakPolarHBondContact CB-OG 3.33Å; D92-S120 WeakPolarHBondContact OD1-CB 3.37Å; D92-S120 PolarHBondContact OD1-OG 3.26Å; D96-S120 PolarHBondContact OD1-N 3.19Å; D96-S120 PolarHBondContact OD2-N 2.93Å; S120-F122 VanDerWaalsContact C-N 3.28Å; S120-F122 PolarHBondContact O-N 3.18Å
121	F	96.8	Very high	92.2	Very high	82 Å²	82	52.7 Å²	52.7	36%	0.36	26%	0.257	S	S	.	.	H	α-helix	trans	-68.2	-23.8	176.1	-70.3	-89.6	0	0	0	113.8	D92 S119 K124 Q125 W153	D92-F121 HydrophobicContact CB-CE2 4.06Å; D92-F121 HydrophobicContact CB-CZ 4.45Å; S119-F121 PolarHBondContact O-N 3.31Å; S119-F121 VanDerWaalsContact O-N 3.09Å; F121-K124 HydrophobicContact CD1-CD 4.25Å; F121-K124 PolarHBondContact O-N 3.01Å; F121-Q125 WeakPolarHBondContact O-CB 3.44Å; F121-Q125 VanDerWaalsContact O-CG 3.32Å; F121-Q125 WeakPolarHBondContact O-CG 3.32Å; F121-Q125 PolarHBondContact O-N 2.74Å; F121-W153 HydrophobicContact CB-CZ2 4.15Å
122	F	98.2	Very high	90	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-56.3	-58.1	-179.8	168	-105	0	0	0	111.4	F118 S119 S120 K124 Q125 L126 V150 W153 V167 Y282	F118-F122 HydrophobicContact CB-CB 3.78Å; F118-F122 HydrophobicContact CB-CD1 3.95Å; F118-F122 HydrophobicContact CB-CG 3.92Å; F118-F122 HydrophobicContact CD1-CB 3.91Å; F118-F122 AromaticContact CD1-CD1 3.84Å; F118-F122 HydrophobicContact CD1-CD1 3.84Å; F118-F122 AromaticContact CD1-CD2 3.43Å; F118-F122 HydrophobicContact CD1-CD2 3.43Å; F118-F122 VanDerWaalsContact CD1-CD2 3.43Å; F118-F122 HydrophobicContact CD1-CE1 4.22Å; F118-F122 AromaticContact CD1-CE2 3.85Å; F118-F122 HydrophobicContact CD1-CE2 3.85Å; F118-F122 AromaticContact CD1-CG 3.42Å; F118-F122 HydrophobicContact CD1-CG 3.42Å; F118-F122 VanDerWaalsContact CD1-CG 3.42Å; F118-F122 HydrophobicContact CD1-CZ 4.22Å; F118-F122 HydrophobicContact CD2-CD1 4.36Å; F118-F122 HydrophobicContact CD2-CE1 4.43Å; F118-F122 HydrophobicContact CE1-CD1 4.43Å; F118-F122 AromaticContact CE1-CD2 3.68Å; F118-F122 HydrophobicContact CE1-CD2 3.68Å; F118-F122 HydrophobicContact CE1-CE1 4.39Å; F118-F122 AromaticContact CE1-CE2 3.62Å; F118-F122 HydrophobicContact CE1-CE2 3.62Å; F118-F122 HydrophobicContact CE1-CG 4.09Å; F118-F122 AromaticContact CE1-CZ 4Å; F118-F122 HydrophobicContact CE1-CZ 4Å; F118-F122 HydrophobicContact CG-CB 4.18Å; F118-F122 AromaticContact CG-CD1 3.8Å; F118-F122 HydrophobicContact CG-CD1 3.8Å; F118-F122 HydrophobicContact CG-CD2 4.24Å; F118-F122 HydrophobicContact CG-CE1 4.25Å; F118-F122 AromaticContact CG-CG 3.8Å; F118-F122 HydrophobicContact CG-CG 3.8Å; F118-F122 HydrophobicContact CZ-CE2 4.24Å; F118-F122 HydrophobicContact CZ-CZ 4.2Å; S119-F122 VanDerWaalsContact O-CB 3.25Å; S119-F122 WeakPolarHBondContact O-CB 3.45Å; S119-F122 PolarHBondContact O-N 2.9Å; S120-F122 VanDerWaalsContact C-N 3.28Å; S120-F122 PolarHBondContact O-N 3.18Å; F122-K124 VanDerWaalsContact C-N 3.32Å; F122-K124 PolarHBondContact O-N 2.63Å; F122-Q125 PolarHBondContact O-N 2.96Å; F122-L126 HydrophobicContact CE1-CD2 4.22Å; F122-L126 HydrophobicContact CZ-CD2 4.11Å; F122-L126 WeakPolarHBondContact O-CB 3.12Å; F122-L126 PolarHBondContact O-N 3.45Å; F122-V150 HydrophobicContact CD2-CB 3.96Å; F122-V150 HydrophobicContact CD2-CG1 4.13Å; F122-V150 HydrophobicContact CD2-CG2 4.35Å; F122-V150 HydrophobicContact CE2-CB 3.97Å; F122-V150 HydrophobicContact CE2-CG1 4.42Å; F122-V150 HydrophobicContact CE2-CG2 3.85Å; F122-W153 HydrophobicContact CD2-CB 4.32Å; F122-W153 HydrophobicContact CD2-CG 4.07Å; F122-V167 HydrophobicContact CD1-CG1 3.93Å; F122-V167 HydrophobicContact CE1-CG1 4.21Å; F122-V167 HydrophobicContact CE1-CG2 4.39Å; F122-Y282 HydrophobicContact CE2-CD1 4.42Å; F122-Y282 HydrophobicContact CE2-CD2 4.09Å; F122-Y282 HydrophobicContact CE2-CE1 4.12Å; F122-Y282 AromaticContact CE2-CE2 3.79Å; F122-Y282 HydrophobicContact CE2-CE2 3.79Å; F122-Y282 HydrophobicContact CE2-CG 4.4Å; F122-Y282 AromaticContact CE2-CZ 3.81Å; F122-Y282 AromaticContact CZ-CD1 3.72Å; F122-Y282 HydrophobicContact CZ-CD1 3.72Å; F122-Y282 HydrophobicContact CZ-CD2 4.04Å; F122-Y282 AromaticContact CZ-CE1 3.71Å; F122-Y282 HydrophobicContact CZ-CE1 3.71Å; F122-Y282 HydrophobicContact CZ-CE2 4.05Å; F122-Y282 AromaticContact CZ-CG 3.88Å; F122-Y282 HydrophobicContact CZ-CG 3.88Å; F122-Y282 AromaticContact CZ-CZ 3.89Å
123	Y	97.4	Very high	88.3	Confident	9 Å²	9	61 Å²	61	4%	0.035	34%	0.335	C	S	.	.	H	α-helix	trans	-69.3	-34.8	-177.5	-177.6	-94.6	0	0	0	111.5	Q125 L126 S127 V169 V275 L278	Y123-Q125 VanDerWaalsContact C-N 3.34Å; Y123-Q125 PolarHBondContact O-N 3.37Å; Y123-L126 HydrophobicContact CD2-CD2 4.41Å; Y123-L126 PolarHBondContact O-N 3.46Å; Y123-S127 VanDerWaalsContact O-CB 3.28Å; Y123-S127 WeakPolarHBondContact O-CB 3.48Å; Y123-S127 PolarHBondContact O-N 2.98Å; Y123-S127 PolarHBondContact O-OG 3.1Å; Y123-V169 HydrophobicContact CD1-CB 4.29Å; Y123-V169 HydrophobicContact CD1-CG1 3.46Å; Y123-V169 VanDerWaalsContact CD1-CG1 3.46Å; Y123-V169 HydrophobicContact CD1-CG2 4.07Å; Y123-V169 HydrophobicContact CD2-CG2 4.27Å; Y123-V169 HydrophobicContact CE1-CG1 3.57Å; Y123-V169 HydrophobicContact CG-CG1 4.15Å; Y123-V169 HydrophobicContact CG-CG2 3.87Å; Y123-V275 HydrophobicContact CD2-CG1 4.31Å; Y123-V275 HydrophobicContact CE1-CG2 4.4Å; Y123-V275 HydrophobicContact CE2-CB 4.17Å; Y123-V275 HydrophobicContact CE2-CG1 3.65Å; Y123-V275 HydrophobicContact CE2-CG2 4.39Å; Y123-V275 WeakPolarHBondContact OH-CA 3.38Å; Y123-V275 WeakPolarHBondContact OH-CG2 3.47Å; Y123-L278 HydrophobicContact CE2-CB 4.38Å; Y123-L278 HydrophobicContact CE2-CD1 4.25Å
124	K	95.3	Very high	86.6	Confident	109 Å²	109	59.8 Å²	59.8	47%	0.474	33%	0.329	S	S	.	.	H	α-helix	trans	-54.3	-50	173.2	-172.4	175.7	-178.2	174	0	111	F121 F122 S127 C128	F121-K124 HydrophobicContact CD1-CD 4.25Å; F121-K124 PolarHBondContact O-N 3.01Å; F122-K124 VanDerWaalsContact C-N 3.32Å; F122-K124 PolarHBondContact O-N 2.63Å; K124-S127 PolarHBondContact O-OG 3.37Å; K124-C128 PolarHBondContact O-N 3.49Å; K124-C128 PolarHBondContact O-SG 2.6Å
125	Q	96.1	Very high	84.6	Confident	69 Å²	69	59.9 Å²	59.9	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-73.2	-35.1	179.4	-65.8	-57.4	-19.8	0	0	113.8	F121 F122 Y123 S127 C128 R149 V150	F121-Q125 WeakPolarHBondContact O-CB 3.44Å; F121-Q125 VanDerWaalsContact O-CG 3.32Å; F121-Q125 WeakPolarHBondContact O-CG 3.32Å; F121-Q125 PolarHBondContact O-N 2.74Å; F122-Q125 PolarHBondContact O-N 2.96Å; Y123-Q125 VanDerWaalsContact C-N 3.34Å; Y123-Q125 PolarHBondContact O-N 3.37Å; Q125-S127 VanDerWaalsContact C-N 3.34Å; Q125-C128 WeakPolarHBondContact O-CB 3.1Å; Q125-R149 PolarHBondContact O-NE 3.1Å; Q125-R149 VanDerWaalsContact O-NE 3.08Å; Q125-V150 HydrophobicContact CB-CG1 3.69Å
126	L	96	Very high	82.5	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-43.1	175.6	-176.8	68.9	0	0	0	111.2	F122 Y123 R146 R149 V150 L278 Y282	F122-L126 HydrophobicContact CE1-CD2 4.22Å; F122-L126 HydrophobicContact CZ-CD2 4.11Å; F122-L126 WeakPolarHBondContact O-CB 3.12Å; F122-L126 PolarHBondContact O-N 3.45Å; Y123-L126 HydrophobicContact CD2-CD2 4.41Å; Y123-L126 PolarHBondContact O-N 3.46Å; L126-R146 HydrophobicContact CD1-CB 3.97Å; L126-R146 PolarHBondContact O-NH1 3.26Å; L126-R146 VanDerWaalsContact O-NH1 3.09Å; L126-R149 PolarHBondContact O-NH2 3.31Å; L126-V150 HydrophobicContact CB-CG1 4.35Å; L126-V150 HydrophobicContact CD1-CG2 3.97Å; L126-L278 HydrophobicContact CD2-CB 4.32Å; L126-Y282 HydrophobicContact CD1-CD2 4.26Å; L126-Y282 HydrophobicContact CD1-CG 4.42Å
127	S	94.1	Very high	80.4	Confident	37 Å²	37	67 Å²	67	26%	0.259	39%	0.391	S	S	.	.	H	α-helix	trans	-80.4	-15.7	-176.3	63.6	0	0	0	0	114.4	Y123 K124 Q125 R129 R146	Y123-S127 VanDerWaalsContact O-CB 3.28Å; Y123-S127 WeakPolarHBondContact O-CB 3.48Å; Y123-S127 PolarHBondContact O-N 2.98Å; Y123-S127 PolarHBondContact O-OG 3.1Å; K124-S127 PolarHBondContact O-OG 3.37Å; Q125-S127 VanDerWaalsContact C-N 3.34Å; S127-R129 PolarHBondContact O-N 3.25Å; S127-R146 PolarHBondContact O-NH1 3.29Å; S127-R146 VanDerWaalsContact O-NH1 3.13Å
128	C	90.8	Very high	78.5	Confident	48 Å²	48	71.8 Å²	71.8	32%	0.324	42%	0.423	S	S	.	.			trans	-43.7	124.7	174.2	-77.6	0	0	0	0	111.7	K124 Q125 R146 R149	K124-C128 PolarHBondContact O-N 3.49Å; K124-C128 PolarHBondContact O-SG 2.6Å; Q125-C128 WeakPolarHBondContact O-CB 3.1Å; C128-R146 PolarHBondContact O-NH1 2.85Å; C128-R149 PolarHBondContact O-NH2 3.49Å
129	R	79.6	Confident	76.7	Confident	215 Å²	215	81 Å²	81	81%	0.811	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-81.4	150.5	174.6	-65.3	-174.4	176.3	-167.2	-1.6	109.1	S127	S127-R129 PolarHBondContact O-N 3.25Å
130	R	68.9	Low	75	Confident	75 Å²	75	82.7 Å²	82.7	28%	0.283	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-59.1	147.2	170.7	-71.5	-172.9	177.8	160.3	-0	109.5	T145	R130-T145 PolarHBondContact NH2-OG1 2.67Å
131	A	59.7	Low	74	Confident	70 Å²	70	85.4 Å²	85.4	58%	0.579	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-64.5	142.8	170.9	0	0	0	0	0	109.3	G133 E134	A131-G133 PolarHBondContact O-N 3.15Å; A131-E134 PolarHBondContact O-N 3.27Å
132	A	48.6	Very low	73.4	Confident	114 Å²	114	84.6 Å²	84.6	94%	0.942	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	110.7	175.1	0	0	0	0	0	109.1
133	G	57	Low	72.9	Confident	81 Å²	81	86.8 Å²	86.8	84%	0.835	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.3	-9.7	178.3	0	0	0	0	0	116.2	A131 S135	A131-G133 PolarHBondContact O-N 3.15Å; G133-S135 PolarHBondContact O-N 2.81Å
134	E	58.7	Low	72.6	Confident	120 Å²	120	88.7 Å²	88.7	56%	0.561	51%	0.509	S	S	*	.			trans	-73.7	112.9	170.2	-74	-178.9	164.2	0	0	109.5	A131 D136	A131-E134 PolarHBondContact O-N 3.27Å; E134-D136 PolarHBondContact O-N 3.33Å
135	S	55.1	Low	72.5	Confident	104 Å²	104	85.2 Å²	85.2	73%	0.727	50%	0.496	S	S	*	.			trans	-51	138.6	-177.7	69.2	0	0	0	0	111.7	G133 A137	G133-S135 PolarHBondContact O-N 2.81Å; S135-A137 VanDerWaalsContact C-N 3.3Å; S135-A137 PolarHBondContact O-N 3.49Å
136	D	53.7	Low	72.4	Confident	139 Å²	139	83.2 Å²	83.2	74%	0.743	49%	0.486	S	S	*	.			trans	-59.6	91.7	168.5	-76	-38	0	0	0	109.7	E134 P138	E134-D136 PolarHBondContact O-N 3.33Å; D136-P138 WeakPolarHBondContact O-CD 3.46Å; D136-P138 WeakPolarHBondContact O-CG 3.5Å; D136-P138 VanDerWaalsContact O-N 3.11Å
137	A	54.3	Low	72.4	Confident	53 Å²	53	83.3 Å²	83.3	44%	0.438	49%	0.486	S	S	.	.			trans	-60.8	111.1	163.9	0	0	0	0	0	106.5	S135 F139	S135-A137 VanDerWaalsContact C-N 3.3Å; S135-A137 PolarHBondContact O-N 3.49Å; A137-F139 PolarHBondContact O-N 3.41Å
138	P	55.9	Low	72.4	Confident	131 Å²	131	86.5 Å²	86.5	85%	0.851	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	6.2	-161.4	-20.7	32.8	0	0	0	115.9	D136	D136-P138 WeakPolarHBondContact O-CD 3.46Å; D136-P138 WeakPolarHBondContact O-CG 3.5Å; D136-P138 VanDerWaalsContact O-N 3.11Å
139	F	61.5	Low	72.6	Confident	197 Å²	197	87.7 Å²	87.7	86%	0.864	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	-9.1	-163.9	-128.8	-95.2	0	0	0	115.9	A137 P141	A137-F139 PolarHBondContact O-N 3.41Å; F139-P141 WeakPolarHBondContact O-CD 3.48Å
140	V	61.5	Low	73.4	Confident	73 Å²	73	77.5 Å²	77.5	44%	0.442	46%	0.456	S	S	.	.	S	Bend	trans	-105.8	112.5	-178.7	-176.2	0	0	0	0	109.7	D142 H144	V140-D142 PolarHBondContact O-N 3.11Å; V140-H144 HydrophobicContact CG1-CB 3.65Å
141	P	74.2	Confident	74.7	Confident	64 Å²	64	78.7 Å²	78.7	42%	0.416	46%	0.464	S	S	.	.			trans	-56.2	140	175.1	-24.7	33.7	0	0	0	111.5	F139 H143 H144	F139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-H143 WeakPolarHBondContact CB-CE1 3.31Å; P141-H143 WeakPolarHBondContact CB-NE2 3.25Å; P141-H143 PolarHBondContact O-N 2.97Å; P141-H144 WeakPolarHBondContact O-CB 3.4Å; P141-H144 PolarHBondContact O-N 3.39Å
142	D	84.6	Confident	76.4	Confident	65 Å²	65	79.2 Å²	79.2	35%	0.348	46%	0.46	S	S	.	.	H	α-helix	trans	-49.5	-38.3	-176.2	178.8	49.4	0	0	0	112.7	V140 H144 T145 R146	V140-D142 PolarHBondContact O-N 3.11Å; D142-H144 VanDerWaalsContact C-N 3.3Å; D142-H144 PolarHBondContact O-N 3.04Å; D142-T145 PolarHBondContact O-N 3.26Å; D142-R146 VanDerWaalsContact CG-NE 3.33Å; D142-R146 VanDerWaalsContact O-CG 3.31Å; D142-R146 WeakPolarHBondContact O-CG 3.44Å; D142-R146 PolarHBondContact O-N 3.34Å; D142-R146 IonicContact OD1-CZ 3.32Å; D142-R146 IonicContact OD1-NE 3.98Å; D142-R146 PolarHBondContact OD1-NE 3.49Å; D142-R146 IonicContact OD1-NH2 2.78Å; D142-R146 PolarHBondContact OD1-NH2 2.77Å; D142-R146 IonicContact OD2-CZ 2.77Å; D142-R146 IonicContact OD2-NE 2.65Å; D142-R146 PolarHBondContact OD2-NE 3.48Å; D142-R146 IonicContact OD2-NH2 3.81Å; D142-R146 PolarHBondContact OD2-NH2 3.23Å; D142-R146 VanDerWaalsContact OD2-NH2 3.14Å
143	H	87.4	Confident	78.7	Confident	48 Å²	48	77.7 Å²	77.7	22%	0.222	43%	0.43	C	S	.	.	H	α-helix	trans	-61.5	-32	178.8	56	-110.9	0	0	0	114.1	P141 R146 H147 V285	P141-H143 WeakPolarHBondContact CB-CE1 3.31Å; P141-H143 WeakPolarHBondContact CB-NE2 3.25Å; P141-H143 PolarHBondContact O-N 2.97Å; H143-R146 PolarHBondContact O-N 2.94Å; H143-H147 VanDerWaalsContact O-CB 3.28Å; H143-H147 WeakPolarHBondContact O-CB 3.43Å; H143-H147 PolarHBondContact O-N 3.25Å; H143-V285 HydrophobicContact CB-CG2 4.26Å; H143-V285 WeakPolarHBondContact CD2-CG2 3.29Å
144	H	92.5	Very high	80.6	Confident	49 Å²	49	73.9 Å²	73.9	23%	0.227	39%	0.39	C	S	.	.	H	α-helix	trans	-68	-45.4	176.1	-79.6	84.2	0	0	0	111	V140 P141 D142 R146 H147 Q148 E288	V140-H144 HydrophobicContact CG1-CB 3.65Å; P141-H144 WeakPolarHBondContact O-CB 3.4Å; P141-H144 PolarHBondContact O-N 3.39Å; D142-H144 VanDerWaalsContact C-N 3.3Å; D142-H144 PolarHBondContact O-N 3.04Å; H144-R146 VanDerWaalsContact C-N 3.32Å; H144-R146 PolarHBondContact O-N 2.99Å; H144-H147 PolarHBondContact O-N 3.4Å; H144-Q148 WeakPolarHBondContact O-CG 3.44Å; H144-Q148 PolarHBondContact O-N 3.35Å; H144-E288 IonicContact NE2-OE2 3.68Å
145	T	91.6	Very high	82.3	Confident	36 Å²	36	74.7 Å²	74.7	22%	0.221	39%	0.388	C	S	.	.	H	α-helix	trans	-63.1	-40.5	176.9	-53.4	0	0	0	0	111.5	R130 D142 Q148	R130-T145 PolarHBondContact NH2-OG1 2.67Å; D142-T145 PolarHBondContact O-N 3.26Å; T145-Q148 PolarHBondContact O-N 3.44Å
146	R	94.1	Very high	84.1	Confident	26 Å²	26	75.3 Å²	75.3	10%	0.098	38%	0.383	C	S	.	.	H	α-helix	trans	-63.2	-45.1	175.4	-64.9	-177.3	179.7	-78.1	-12.2	112	L126 S127 C128 D142 H143 H144 Q148 R149	L126-R146 HydrophobicContact CD1-CB 3.97Å; L126-R146 PolarHBondContact O-NH1 3.26Å; L126-R146 VanDerWaalsContact O-NH1 3.09Å; S127-R146 PolarHBondContact O-NH1 3.29Å; S127-R146 VanDerWaalsContact O-NH1 3.13Å; C128-R146 PolarHBondContact O-NH1 2.85Å; D142-R146 VanDerWaalsContact CG-NE 3.33Å; D142-R146 VanDerWaalsContact O-CG 3.31Å; D142-R146 WeakPolarHBondContact O-CG 3.44Å; D142-R146 PolarHBondContact O-N 3.34Å; D142-R146 IonicContact OD1-CZ 3.32Å; D142-R146 IonicContact OD1-NE 3.98Å; D142-R146 PolarHBondContact OD1-NE 3.49Å; D142-R146 IonicContact OD1-NH2 2.78Å; D142-R146 PolarHBondContact OD1-NH2 2.77Å; D142-R146 IonicContact OD2-CZ 2.77Å; D142-R146 IonicContact OD2-NE 2.65Å; D142-R146 PolarHBondContact OD2-NE 3.48Å; D142-R146 IonicContact OD2-NH2 3.81Å; D142-R146 PolarHBondContact OD2-NH2 3.23Å; D142-R146 VanDerWaalsContact OD2-NH2 3.14Å; H143-R146 PolarHBondContact O-N 2.94Å; H144-R146 VanDerWaalsContact C-N 3.32Å; H144-R146 PolarHBondContact O-N 2.99Å; R146-Q148 VanDerWaalsContact C-N 3.33Å; R146-Q148 PolarHBondContact O-N 3.09Å; R146-R149 PolarHBondContact O-N 3.37Å
147	H	96.4	Very high	86	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.019	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-42.6	177.4	175.6	-80	0	0	0	112	H143 H144 R149 V150 K151 Y282 V285 E286	H143-H147 VanDerWaalsContact O-CB 3.28Å; H143-H147 WeakPolarHBondContact O-CB 3.43Å; H143-H147 PolarHBondContact O-N 3.25Å; H144-H147 PolarHBondContact O-N 3.4Å; H147-R149 PolarHBondContact O-N 3.28Å; H147-V150 CarbonylContact O-C 3.58Å; H147-V150 WeakPolarHBondContact O-CG2 3.35Å; H147-V150 PolarHBondContact O-N 2.77Å; H147-K151 PolarHBondContact O-N 3.32Å; H147-Y282 AromaticContact CD2-CD2 3.7Å; H147-Y282 AromaticContact CD2-CE2 3.71Å; H147-V285 HydrophobicContact CB-CB 3.89Å; H147-V285 HydrophobicContact CB-CG1 3.69Å; H147-V285 HydrophobicContact CB-CG2 4.21Å; H147-E286 IonicContact CD2-OE2 2.86Å; H147-E286 IonicContact CE1-OE2 3.22Å; H147-E286 IonicContact NE2-OE2 3.51Å; H147-E286 PolarHBondContact NE2-OE2 3.22Å
148	Q	94.9	Very high	88.1	Confident	104 Å²	104	69.8 Å²	69.8	49%	0.486	35%	0.347	S	S	.	.	H	α-helix	trans	-54.4	-30.9	179.4	-74.3	-63.5	-31	0	0	113.7	H144 T145 R146 V150 K151	H144-Q148 WeakPolarHBondContact O-CG 3.44Å; H144-Q148 PolarHBondContact O-N 3.35Å; T145-Q148 PolarHBondContact O-N 3.44Å; R146-Q148 VanDerWaalsContact C-N 3.33Å; R146-Q148 PolarHBondContact O-N 3.09Å; Q148-V150 VanDerWaalsContact C-N 3.31Å; Q148-K151 WeakPolarHBondContact O-CG 3.39Å; Q148-K151 VanDerWaalsContact OE1-CD 3.29Å
149	R	95.1	Very high	90.1	Very high	74 Å²	74	63.6 Å²	63.6	28%	0.279	31%	0.307	S	S	.	.	H	α-helix	trans	-72.8	-23	177.6	-63.8	-171.5	-67	-109.9	5.9	113.8	Q125 L126 C128 R146 H147	Q125-R149 PolarHBondContact O-NE 3.1Å; Q125-R149 VanDerWaalsContact O-NE 3.08Å; L126-R149 PolarHBondContact O-NH2 3.31Å; C128-R149 PolarHBondContact O-NH2 3.49Å; R146-R149 PolarHBondContact O-N 3.37Å; H147-R149 PolarHBondContact O-N 3.28Å
150	V	96.6	Very high	91.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-120.6	5.8	-175.9	-62.7	0	0	0	0	113.2	F122 Q125 L126 H147 Q148 T152 W153 Y282	F122-V150 HydrophobicContact CD2-CB 3.96Å; F122-V150 HydrophobicContact CD2-CG1 4.13Å; F122-V150 HydrophobicContact CD2-CG2 4.35Å; F122-V150 HydrophobicContact CE2-CB 3.97Å; F122-V150 HydrophobicContact CE2-CG1 4.42Å; F122-V150 HydrophobicContact CE2-CG2 3.85Å; Q125-V150 HydrophobicContact CB-CG1 3.69Å; L126-V150 HydrophobicContact CB-CG1 4.35Å; L126-V150 HydrophobicContact CD1-CG2 3.97Å; H147-V150 CarbonylContact O-C 3.58Å; H147-V150 WeakPolarHBondContact O-CG2 3.35Å; H147-V150 PolarHBondContact O-N 2.77Å; Q148-V150 VanDerWaalsContact C-N 3.31Å; V150-T152 PolarHBondContact O-N 3.45Å; V150-W153 HydrophobicContact CB-CE3 4.23Å; V150-W153 WeakPolarHBondContact O-CB 3.22Å; V150-W153 PolarHBondContact O-N 3.02Å; V150-Y282 HydrophobicContact CG2-CD2 3.87Å; V150-Y282 HydrophobicContact CG2-CE2 3.89Å
151	K	96	Very high	93.6	Very high	101 Å²	101	55 Å²	55	44%	0.439	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-26.7	-175.9	70.8	-178.6	170.8	-171.7	0	114.5	H147 Q148	H147-K151 PolarHBondContact O-N 3.32Å; Q148-K151 WeakPolarHBondContact O-CG 3.39Å; Q148-K151 VanDerWaalsContact OE1-CD 3.29Å
152	T	95.6	Very high	94.8	Very high	81 Å²	81	54.2 Å²	54.2	50%	0.497	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-18.7	-178.1	52.1	0	0	0	0	112.8	V150 T154 R155	V150-T152 PolarHBondContact O-N 3.45Å; T152-T154 PolarHBondContact O-N 3.29Å; T152-R155 WeakPolarHBondContact O-CB 3.37Å; T152-R155 PolarHBondContact O-N 3.26Å; T152-R155 VanDerWaalsContact O-N 3.11Å
153	W	96.4	Very high	95.5	Very high	82 Å²	82	52.5 Å²	52.5	31%	0.311	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-30.6	-179.2	-94.8	-108	0	0	0	112.4	F118 S119 F121 F122 V150	F118-W153 HydrophobicContact CD1-CB 4.24Å; F118-W153 AromaticContact CD1-CD1 3.85Å; F118-W153 HydrophobicContact CD1-CG 4.38Å; F118-W153 HydrophobicContact CE1-CB 4.09Å; S119-W153 PolarHBondContact OG-NE1 3.3Å; F121-W153 HydrophobicContact CB-CZ2 4.15Å; F122-W153 HydrophobicContact CD2-CB 4.32Å; F122-W153 HydrophobicContact CD2-CG 4.07Å; V150-W153 HydrophobicContact CB-CE3 4.23Å; V150-W153 WeakPolarHBondContact O-CB 3.22Å; V150-W153 PolarHBondContact O-N 3.02Å
154	T	96.5	Very high	96	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	6.4	179.5	51.9	0	0	0	0	113.1	F118 T152 D156 V157 I159 Y282 E286 R290	F118-T154 HydrophobicContact CE1-CG2 3.95Å; F118-T154 HydrophobicContact CZ-CG2 3.99Å; T152-T154 PolarHBondContact O-N 3.29Å; T154-D156 PolarHBondContact O-N 3Å; T154-V157 HydrophobicContact CG2-CG1 4.33Å; T154-V157 CarbonylContact O-C 3.43Å; T154-V157 PolarHBondContact O-N 2.88Å; T154-I159 HydrophobicContact CG2-CD1 4.28Å; T154-I159 HydrophobicContact CG2-CG1 4.4Å; T154-I159 HydrophobicContact CG2-CG2 3.43Å; T154-I159 VanDerWaalsContact CG2-CG2 3.43Å; T154-Y282 WeakPolarHBondContact CG2-OH 3.44Å; T154-E286 WeakPolarHBondContact CB-OE1 3.43Å; T154-E286 PolarHBondContact OG1-OE1 2.92Å; T154-E286 PolarHBondContact OG1-OE2 2.8Å; T154-R290 PolarHBondContact O-NH2 3.34Å; T154-R290 PolarHBondContact OG1-NH2 2.81Å
155	R	94.1	Very high	96.3	Very high	138 Å²	138	48.1 Å²	48.1	52%	0.521	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	-48.5	-171.2	-174.2	-176.4	64.3	-158.7	-7.3	112.7	T152 R290	T152-R155 WeakPolarHBondContact O-CB 3.37Å; T152-R155 PolarHBondContact O-N 3.26Å; T152-R155 VanDerWaalsContact O-N 3.11Å; R155-R290 PolarHBondContact O-NH1 2.81Å
156	D	92.8	Very high	96.6	Very high	116 Å²	116	46.5 Å²	46.5	62%	0.62	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	17.5	-172.6	-50.6	-42.9	0	0	0	113	T154	T154-D156 PolarHBondContact O-N 3Å
157	V	95.1	Very high	96.9	Very high	31 Å²	31	45.3 Å²	45.3	19%	0.188	22%	0.219	C	C	.	.			trans	-144	132.5	179.1	59.1	0	0	0	0	112.4	T154 I159	T154-V157 HydrophobicContact CG2-CG1 4.33Å; T154-V157 CarbonylContact O-C 3.43Å; T154-V157 PolarHBondContact O-N 2.88Å; V157-I159 HydrophobicContact CG1-CG2 4.27Å; V157-I159 PolarHBondContact O-N 3.08Å
158	D	97.6	Very high	97	Very high	46 Å²	46	45.1 Å²	45.1	25%	0.246	22%	0.218	C	C	.	.			trans	-86.9	98.4	168.2	-178.4	8.3	0	0	0	110.6	F160 S161 R291	D158-F160 PolarHBondContact O-N 3.44Å; D158-F160 PolarHBondContact OD1-N 3.48Å; D158-F160 VanDerWaalsContact OD1-N 3.08Å; D158-S161 WeakPolarHBondContact O-CB 3.21Å; D158-S161 PolarHBondContact O-N 2.65Å; D158-S161 VanDerWaalsContact O-N 3.17Å; D158-S161 PolarHBondContact O-OG 2.8Å; D158-R291 IonicContact OD1-CZ 3.51Å; D158-R291 IonicContact OD1-NH1 3.74Å; D158-R291 PolarHBondContact OD1-NH1 3.31Å; D158-R291 IonicContact OD1-NH2 2.92Å; D158-R291 PolarHBondContact OD1-NH2 3.44Å; D158-R291 IonicContact OD2-CZ 3.42Å; D158-R291 VanDerWaalsContact OD2-CZ 3.23Å; D158-R291 IonicContact OD2-NH1 2.67Å; D158-R291 PolarHBondContact OD2-NH1 3.04Å; D158-R291 IonicContact OD2-NH2 3.25Å; D158-R291 PolarHBondContact OD2-NH2 3.45Å
159	I	98.3	Very high	97.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66.3	-18.4	-178.9	60.2	164.4	0	0	0	113.9	F118 T154 V157 S161 K162 L165 P183 Y282 L283 E286	F118-I159 HydrophobicContact CZ-CG2 4.29Å; T154-I159 HydrophobicContact CG2-CD1 4.28Å; T154-I159 HydrophobicContact CG2-CG1 4.4Å; T154-I159 HydrophobicContact CG2-CG2 3.43Å; T154-I159 VanDerWaalsContact CG2-CG2 3.43Å; V157-I159 HydrophobicContact CG1-CG2 4.27Å; V157-I159 PolarHBondContact O-N 3.08Å; I159-S161 VanDerWaalsContact C-N 3.29Å; I159-K162 WeakPolarHBondContact O-CB 3.43Å; I159-K162 PolarHBondContact O-N 2.78Å; I159-L165 HydrophobicContact CB-CD1 4.03Å; I159-L165 HydrophobicContact CB-CD2 3.86Å; I159-L165 HydrophobicContact CD1-CD1 4.01Å; I159-L165 HydrophobicContact CG1-CD1 4.5Å; I159-L165 HydrophobicContact CG2-CD2 4.16Å; I159-P183 WeakPolarHBondContact O-CG 3.45Å; I159-Y282 HydrophobicContact CD1-CE1 3.77Å; I159-L283 HydrophobicContact CD1-CD2 3.95Å; I159-E286 HydrophobicContact CD1-CB 4.48Å; I159-E286 HydrophobicContact CD1-CG 3.8Å; I159-E286 HydrophobicContact CG1-CG 4.11Å
160	F	98.5	Very high	97.2	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.044	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-82.9	-10	177.5	-59	-70.8	0	0	0	113	D158 K162 P183 G184 L283 E286 W287 R290 F297	D158-F160 PolarHBondContact O-N 3.44Å; D158-F160 PolarHBondContact OD1-N 3.48Å; D158-F160 VanDerWaalsContact OD1-N 3.08Å; F160-K162 VanDerWaalsContact C-N 3.3Å; F160-P183 HydrophobicContact CD1-CB 3.96Å; F160-P183 HydrophobicContact CE1-CB 4.31Å; F160-G184 WeakPolarHBondContact O-CA 3.37Å; F160-L283 HydrophobicContact CE1-CD2 4.1Å; F160-L283 HydrophobicContact CZ-CD2 4.43Å; F160-L283 WeakPolarHBondContact CZ-O 3.5Å; F160-E286 HydrophobicContact CE2-CB 4.17Å; F160-E286 HydrophobicContact CE2-CG 3.87Å; F160-E286 HydrophobicContact CZ-CB 4.11Å; F160-E286 HydrophobicContact CZ-CG 4.22Å; F160-W287 HydrophobicContact CB-CE3 4.34Å; F160-W287 HydrophobicContact CB-CZ3 4.15Å; F160-W287 AromaticContact CD1-CE3 3.49Å; F160-W287 HydrophobicContact CD1-CE3 3.49Å; F160-W287 VanDerWaalsContact CD1-CE3 3.49Å; F160-W287 AromaticContact CD1-CZ3 3.89Å; F160-W287 HydrophobicContact CD1-CZ3 3.89Å; F160-W287 HydrophobicContact CD2-CE3 4.02Å; F160-W287 HydrophobicContact CE1-CB 4.22Å; F160-W287 AromaticContact CE1-CE3 3.69Å; F160-W287 HydrophobicContact CE1-CE3 3.69Å; F160-W287 HydrophobicContact CE2-CB 3.97Å; F160-W287 HydrophobicContact CE2-CE3 4.19Å; F160-W287 AromaticContact CG-CE3 3.67Å; F160-W287 HydrophobicContact CG-CE3 3.67Å; F160-W287 AromaticContact CG-CZ3 3.96Å; F160-W287 HydrophobicContact CG-CZ3 3.96Å; F160-W287 HydrophobicContact CZ-CB 3.63Å; F160-W287 HydrophobicContact CZ-CE3 4.05Å; F160-W287 VanDerWaalsContact CZ-N 3.33Å; F160-R290 HydrophobicContact CD2-CB 4.38Å; F160-R290 HydrophobicContact CD2-CG 4.49Å; F160-R290 HydrophobicContact CE2-CB 4.42Å; F160-R290 HydrophobicContact CE2-CG 4.37Å; F160-F297 HydrophobicContact CE1-CE2 4.45Å; F160-F297 AromaticContact CE1-CZ 3.89Å; F160-F297 HydrophobicContact CE1-CZ 3.89Å
161	S	98.1	Very high	97	Very high	79 Å²	79	43 Å²	43	55%	0.552	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-83.1	-8.2	168.1	73.5	0	0	0	0	113.1	D158 I159	D158-S161 WeakPolarHBondContact O-CB 3.21Å; D158-S161 PolarHBondContact O-N 2.65Å; D158-S161 VanDerWaalsContact O-N 3.17Å; D158-S161 PolarHBondContact O-OG 2.8Å; I159-S161 VanDerWaalsContact C-N 3.29Å
162	K	98.5	Very high	96.8	Very high	48 Å²	48	43.1 Å²	43.1	21%	0.209	23%	0.233	C	C	.	.			trans	-92.6	150.6	-178.2	-58.4	-59.8	-172.5	177.3	0	110.8	Q113 R114 H116 I159 F160 L165 P183	Q113-K162 PolarHBondContact O-NZ 2.92Å; R114-K162 CarbonylContact O-C 3.43Å; R114-K162 WeakPolarHBondContact O-CA 3.19Å; R114-K162 WeakPolarHBondContact O-CB 3.31Å; H116-K162 HydrophobicContact CB-CG 4.21Å; I159-K162 WeakPolarHBondContact O-CB 3.43Å; I159-K162 PolarHBondContact O-N 2.78Å; F160-K162 VanDerWaalsContact C-N 3.3Å; K162-L165 HydrophobicContact CB-CD2 3.82Å; K162-L165 HydrophobicContact CG-CD2 4.29Å; K162-P183 WeakPolarHBondContact O-CD 3.43Å
163	D	98.4	Very high	96.6	Very high	30 Å²	30	41.7 Å²	41.7	16%	0.16	23%	0.229	C	C	.	.	S	Bend	trans	-83.5	-36.7	172.4	-76.2	4.9	0	0	0	111.1	R114 C181 F182	R114-D163 HydrophobicContact CB-CB 4.15Å; R114-D163 IonicContact CZ-OD2 2.6Å; R114-D163 IonicContact NE-OD2 3.4Å; R114-D163 IonicContact NH1-OD2 2.77Å; R114-D163 PolarHBondContact NH1-OD2 3.14Å; R114-D163 IonicContact NH2-OD2 3.97Å; R114-D163 PolarHBondContact O-N 3.13Å; D163-C181 CarbonylContact O-C 3.58Å; D163-C181 WeakPolarHBondContact O-CA 3.47Å; D163-F182 HydrophobicContact CB-CD1 4.06Å; D163-F182 HydrophobicContact CB-CE1 3.88Å; D163-F182 PolarHBondContact O-N 3.05Å
164	F	98.8	Very high	96.6	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128	-173.1	-50	-66.4	0	0	0	111.7	V111 R114 S115 H116 F166 V179 V180 C181 F182 F329 F337	V111-F164 HydrophobicContact CG1-CD2 3.82Å; V111-F164 HydrophobicContact CG1-CE2 3.85Å; R114-F164 PolarHBondContact O-N 2.86Å; S115-F164 CarbonylContact C-O 3.48Å; S115-F164 WeakPolarHBondContact CA-O 3.44Å; H116-F164 PolarHBondContact N-O 3.45Å; F164-F166 HydrophobicContact CB-CD2 4.5Å; F164-F166 HydrophobicContact CB-CE2 3.93Å; F164-F166 HydrophobicContact CB-CZ 4.5Å; F164-V179 HydrophobicContact CB-CG1 4.21Å; F164-V179 HydrophobicContact CD1-CG1 4.41Å; F164-V180 CarbonylContact C-O 3.58Å; F164-V180 WeakPolarHBondContact CA-O 3.41Å; F164-C181 HydrophobicContact CD1-CB 4.29Å; F164-C181 HydrophobicContact CE1-CB 4.39Å; F164-F182 HydrophobicContact CE1-CE1 4.42Å; F164-F182 HydrophobicContact CE1-CE2 4.16Å; F164-F182 AromaticContact CE1-CZ 3.91Å; F164-F182 HydrophobicContact CE1-CZ 3.91Å; F164-F182 HydrophobicContact CZ-CE1 4.31Å; F164-F182 AromaticContact CZ-CZ 3.92Å; F164-F182 HydrophobicContact CZ-CZ 3.92Å; F164-F329 AromaticContact CD1-CE1 3.7Å; F164-F329 HydrophobicContact CD1-CE1 3.7Å; F164-F329 AromaticContact CD1-CZ 3.57Å; F164-F329 HydrophobicContact CD1-CZ 3.57Å; F164-F329 AromaticContact CD2-CE1 3.93Å; F164-F329 HydrophobicContact CD2-CE1 3.93Å; F164-F329 AromaticContact CE1-CE1 3.82Å; F164-F329 HydrophobicContact CE1-CE1 3.82Å; F164-F329 AromaticContact CE1-CZ 3.58Å; F164-F329 HydrophobicContact CE1-CZ 3.58Å; F164-F329 HydrophobicContact CE2-CE1 4.03Å; F164-F329 AromaticContact CG-CE1 3.76Å; F164-F329 HydrophobicContact CG-CE1 3.76Å; F164-F329 HydrophobicContact CG-CZ 4.12Å; F164-F329 AromaticContact CZ-CE1 3.97Å; F164-F329 HydrophobicContact CZ-CE1 3.97Å; F164-F329 HydrophobicContact CZ-CZ 4.1Å; F164-F337 HydrophobicContact CE1-CE1 4.18Å; F164-F337 AromaticContact CE1-CZ 3.68Å; F164-F337 HydrophobicContact CE1-CZ 3.68Å; F164-F337 HydrophobicContact CZ-CZ 4.18Å
165	L	98.8	Very high	96.7	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	110.6	170.8	-42.8	177.1	0	0	0	108.9	H116 F118 I159 K162 V179 V180 P183 L283	H116-L165 HydrophobicContact CB-CD2 3.88Å; H116-L165 CarbonylContact O-C 3.59Å; H116-L165 WeakPolarHBondContact O-CA 3.23Å; F118-L165 HydrophobicContact CE2-CB 4.14Å; F118-L165 HydrophobicContact CE2-CD1 4.32Å; I159-L165 HydrophobicContact CB-CD1 4.03Å; I159-L165 HydrophobicContact CB-CD2 3.86Å; I159-L165 HydrophobicContact CD1-CD1 4.01Å; I159-L165 HydrophobicContact CG1-CD1 4.5Å; I159-L165 HydrophobicContact CG2-CD2 4.16Å; K162-L165 HydrophobicContact CB-CD2 3.82Å; K162-L165 HydrophobicContact CG-CD2 4.29Å; L165-V179 CarbonylContact O-C 3.58Å; L165-V179 WeakPolarHBondContact O-CA 3.42Å; L165-V180 HydrophobicContact CB-CB 3.98Å; L165-V180 HydrophobicContact CB-CG2 4.41Å; L165-V180 HydrophobicContact CD1-CB 4.12Å; L165-V180 HydrophobicContact CD1-CG1 4.34Å; L165-V180 HydrophobicContact CG-CB 4.19Å; L165-V180 PolarHBondContact N-O 3.36Å; L165-V180 PolarHBondContact O-N 3.49Å; L165-P183 HydrophobicContact CD1-CB 4.42Å; L165-P183 HydrophobicContact CD1-CG 3.98Å; L165-P183 HydrophobicContact CG-CG 4.18Å; L165-L283 HydrophobicContact CD1-CD2 4.23Å
166	F	98.8	Very high	96.9	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	123.7	175.6	-66.2	-94	0	0	0	109.4	H116 V117 F118 F164 L177 V179 A326 F329 L330	H116-F166 PolarHBondContact O-N 3.24Å; V117-F166 HydrophobicContact CB-CB 4.13Å; V117-F166 HydrophobicContact CG2-CB 3.75Å; F118-F166 PolarHBondContact N-O 2.81Å; F164-F166 HydrophobicContact CB-CD2 4.5Å; F164-F166 HydrophobicContact CB-CE2 3.93Å; F164-F166 HydrophobicContact CB-CZ 4.5Å; F166-L177 HydrophobicContact CD1-CD1 4.32Å; F166-L177 HydrophobicContact CD1-CD2 4.14Å; F166-L177 HydrophobicContact CE1-CD2 4.5Å; F166-V179 HydrophobicContact CD1-CG2 3.9Å; F166-V179 HydrophobicContact CE1-CG1 4.45Å; F166-V179 HydrophobicContact CE1-CG2 4.02Å; F166-A326 HydrophobicContact CD1-CB 4.31Å; F166-A326 HydrophobicContact CE1-CB 4.32Å; F166-F329 HydrophobicContact CE1-CB 4.19Å; F166-F329 HydrophobicContact CE1-CD1 4.25Å; F166-F329 HydrophobicContact CE1-CG 4.18Å; F166-F329 HydrophobicContact CZ-CB 4.36Å; F166-F329 AromaticContact CZ-CD1 3.71Å; F166-F329 HydrophobicContact CZ-CD1 3.71Å; F166-F329 HydrophobicContact CZ-CE1 4.31Å; F166-F329 HydrophobicContact CZ-CG 4.1Å; F166-L330 HydrophobicContact CE2-CD2 4.17Å; F166-L330 HydrophobicContact CZ-CD2 4.04Å; F166-L330 HydrophobicContact CZ-CG 4.21Å
167	V	98.8	Very high	97.2	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	98.4	179.7	-177.7	0	0	0	0	108.2	F118 F122 V169 V178	F118-V167 HydrophobicContact CD2-CG2 3.65Å; F118-V167 HydrophobicContact CE2-CG2 4.27Å; F118-V167 HydrophobicContact CG-CG2 4.4Å; F122-V167 HydrophobicContact CD1-CG1 3.93Å; F122-V167 HydrophobicContact CE1-CG1 4.21Å; F122-V167 HydrophobicContact CE1-CG2 4.39Å; V167-V169 HydrophobicContact CG1-CG2 4.04Å; V167-V178 HydrophobicContact CB-CB 4.2Å; V167-V178 PolarHBondContact N-O 3.19Å; V167-V178 PolarHBondContact O-N 2.95Å
168	P	98.7	Very high	97.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	133.5	170.2	27.2	-31.6	0	0	0	109.7	I95 L99 F118 W175 L322	I95-P168 HydrophobicContact CG2-CB 3.85Å; I95-P168 HydrophobicContact CG2-CG 4.34Å; L99-P168 HydrophobicContact CD1-CB 3.99Å; L99-P168 HydrophobicContact CD1-CG 3.8Å; F118-P168 WeakPolarHBondContact O-CD 3.38Å; F118-P168 WeakPolarHBondContact O-CG 2.99Å; P168-W175 HydrophobicContact CB-CZ3 4.22Å; P168-L322 HydrophobicContact CB-CD1 3.99Å; P168-L322 HydrophobicContact CB-CD2 4.35Å
169	V	98.3	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.5	-179.9	-179.6	0	0	0	0	110.1	Y123 V167 K171 W175 F176 V178 V275	Y123-V169 HydrophobicContact CD1-CB 4.29Å; Y123-V169 HydrophobicContact CD1-CG1 3.46Å; Y123-V169 VanDerWaalsContact CD1-CG1 3.46Å; Y123-V169 HydrophobicContact CD1-CG2 4.07Å; Y123-V169 HydrophobicContact CD2-CG2 4.27Å; Y123-V169 HydrophobicContact CE1-CG1 3.57Å; Y123-V169 HydrophobicContact CG-CG1 4.15Å; Y123-V169 HydrophobicContact CG-CG2 3.87Å; V167-V169 HydrophobicContact CG1-CG2 4.04Å; V169-K171 HydrophobicContact CG1-CD 4.46Å; V169-K171 HydrophobicContact CG1-CG 4.08Å; V169-W175 WeakPolarHBondContact O-CA 3.4Å; V169-F176 HydrophobicContact CB-CD1 4.39Å; V169-F176 HydrophobicContact CB-CD2 4.13Å; V169-F176 HydrophobicContact CB-CE1 3.93Å; V169-F176 HydrophobicContact CB-CE2 3.66Å; V169-F176 HydrophobicContact CB-CG 4.48Å; V169-F176 HydrophobicContact CB-CZ 3.55Å; V169-F176 HydrophobicContact CG1-CD1 4.42Å; V169-F176 HydrophobicContact CG1-CE1 3.54Å; V169-F176 HydrophobicContact CG1-CE2 3.82Å; V169-F176 HydrophobicContact CG1-CZ 3.18Å; V169-F176 HydrophobicContact CG2-CE2 4.1Å; V169-F176 HydrophobicContact CG2-CZ 4.32Å; V169-F176 PolarHBondContact N-O 2.99Å; V169-F176 PolarHBondContact O-N 2.92Å; V169-V178 HydrophobicContact CG2-CG2 3.99Å; V169-V275 HydrophobicContact CG2-CG1 4.17Å
170	N	96.1	Very high	97.4	Very high	65 Å²	65	22.8 Å²	22.8	35%	0.348	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.3	168	-168.5	-19	0	0	0	109.7	A173 H174 W175	N170-A173 WeakPolarHBondContact OD1-CA 3.49Å; N170-A173 PolarHBondContact OD1-N 2.89Å; N170-H174 WeakPolarHBondContact CA-O 3.29Å; N170-H174 PolarHBondContact OD1-N 2.95Å; N170-W175 HydrophobicContact CB-CD2 3.88Å; N170-W175 HydrophobicContact CB-CE3 3.65Å; N170-W175 HydrophobicContact CB-CH2 3.7Å; N170-W175 HydrophobicContact CB-CZ2 3.92Å; N170-W175 HydrophobicContact CB-CZ3 3.57Å; N170-W175 WeakPolarHBondContact ND2-CZ2 3.4Å
171	K	93.1	Very high	97.5	Very high	70 Å²	70	22.3 Å²	22.3	30%	0.304	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.8	170.3	-75	-179.8	68.3	-165.8	0	109	V169 A173 H174 F176 V275	V169-K171 HydrophobicContact CG1-CD 4.46Å; V169-K171 HydrophobicContact CG1-CG 4.08Å; K171-A173 VanDerWaalsContact C-N 3.33Å; K171-A173 PolarHBondContact O-N 3.42Å; K171-H174 PolarHBondContact N-O 3.44Å; K171-H174 WeakPolarHBondContact O-CB 3.4Å; K171-H174 PolarHBondContact O-N 3.16Å; K171-F176 HydrophobicContact CB-CE1 4.35Å; K171-F176 HydrophobicContact CD-CE1 4.23Å; K171-F176 HydrophobicContact CD-CZ 4.19Å; K171-F176 HydrophobicContact CG-CE1 4.31Å; K171-V275 HydrophobicContact CD-CG2 3.88Å
172	A	90.8	Very high	97.5	Very high	103 Å²	103	19 Å²	19	85%	0.851	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	50	177.5	0	0	0	0	0	113	H174	A172-H174 PolarHBondContact O-N 3.01Å
173	A	92.8	Very high	97.5	Very high	50 Å²	50	16.7 Å²	16.7	41%	0.413	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	17.8	-177.9	0	0	0	0	0	115.3	N170 K171	N170-A173 WeakPolarHBondContact OD1-CA 3.49Å; N170-A173 PolarHBondContact OD1-N 2.89Å; K171-A173 VanDerWaalsContact C-N 3.33Å; K171-A173 PolarHBondContact O-N 3.42Å
174	H	96.3	Very high	97.4	Very high	9 Å²	9	16.4 Å²	16.4	4%	0.042	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.5	175.9	-179.8	49.6	0	0	0	111.4	N170 K171 A172 D265 L269 C318	N170-H174 WeakPolarHBondContact CA-O 3.29Å; N170-H174 PolarHBondContact OD1-N 2.95Å; K171-H174 PolarHBondContact N-O 3.44Å; K171-H174 WeakPolarHBondContact O-CB 3.4Å; K171-H174 PolarHBondContact O-N 3.16Å; A172-H174 PolarHBondContact O-N 3.01Å; H174-D265 IonicContact CD2-OD2 3.34Å; H174-D265 IonicContact CE1-OD1 3.45Å; H174-D265 PolarHBondContact CE1-OD1 3.32Å; H174-D265 VanDerWaalsContact NE2-CG 3.3Å; H174-D265 IonicContact NE2-OD1 3.14Å; H174-D265 PolarHBondContact NE2-OD1 3.48Å; H174-D265 IonicContact NE2-OD2 2.71Å; H174-D265 PolarHBondContact NE2-OD2 2.81Å; H174-L269 HydrophobicContact CB-CD1 4.18Å; H174-C318 WeakPolarHBondContact ND1-CB 3.29Å
175	W	98.1	Very high	97.3	Very high	4 Å²	4	18 Å²	18	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	134.1	176.3	-74.1	112	0	0	0	111.8	L90 D92 I95 P168 V169 N170 C318 L322	L90-W175 PolarHBondContact O-NE1 3.31Å; D92-W175 WeakPolarHBondContact OD1-CH2 3.47Å; I95-W175 HydrophobicContact CG1-CD2 4.31Å; I95-W175 HydrophobicContact CG1-CH2 4.31Å; I95-W175 HydrophobicContact CG1-CZ2 4.05Å; I95-W175 HydrophobicContact CG2-CZ3 4.36Å; P168-W175 HydrophobicContact CB-CZ3 4.22Å; V169-W175 WeakPolarHBondContact O-CA 3.4Å; N170-W175 HydrophobicContact CB-CD2 3.88Å; N170-W175 HydrophobicContact CB-CE3 3.65Å; N170-W175 HydrophobicContact CB-CH2 3.7Å; N170-W175 HydrophobicContact CB-CZ2 3.92Å; N170-W175 HydrophobicContact CB-CZ3 3.57Å; N170-W175 WeakPolarHBondContact ND2-CZ2 3.4Å; W175-C318 HydrophobicContact CB-CB 4.2Å; W175-C318 PolarHBondContact N-SG 2.94Å; W175-L322 HydrophobicContact CB-CD1 3.91Å; W175-L322 HydrophobicContact CD2-CD1 4.32Å; W175-L322 HydrophobicContact CE3-CD1 3.75Å; W175-L322 HydrophobicContact CG-CD1 4.43Å
176	F	98.4	Very high	97	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	160	168.1	61	-85.5	0	0	0	110.5	V169 K171 V178 V263 M264 D265 H272 V275 L322	V169-F176 HydrophobicContact CB-CD1 4.39Å; V169-F176 HydrophobicContact CB-CD2 4.13Å; V169-F176 HydrophobicContact CB-CE1 3.93Å; V169-F176 HydrophobicContact CB-CE2 3.66Å; V169-F176 HydrophobicContact CB-CG 4.48Å; V169-F176 HydrophobicContact CB-CZ 3.55Å; V169-F176 HydrophobicContact CG1-CD1 4.42Å; V169-F176 HydrophobicContact CG1-CE1 3.54Å; V169-F176 HydrophobicContact CG1-CE2 3.82Å; V169-F176 HydrophobicContact CG1-CZ 3.18Å; V169-F176 HydrophobicContact CG2-CE2 4.1Å; V169-F176 HydrophobicContact CG2-CZ 4.32Å; V169-F176 PolarHBondContact N-O 2.99Å; V169-F176 PolarHBondContact O-N 2.92Å; K171-F176 HydrophobicContact CB-CE1 4.35Å; K171-F176 HydrophobicContact CD-CE1 4.23Å; K171-F176 HydrophobicContact CD-CZ 4.19Å; K171-F176 HydrophobicContact CG-CE1 4.31Å; F176-V178 HydrophobicContact CD2-CG2 4.13Å; F176-V178 HydrophobicContact CE2-CG2 3.86Å; F176-V263 HydrophobicContact CD2-CG1 3.94Å; F176-V263 HydrophobicContact CE2-CG1 4.3Å; F176-M264 WeakPolarHBondContact CB-O 3.47Å; F176-D265 HydrophobicContact CB-CB 4.02Å; F176-H272 AromaticContact CD2-CD2 4Å; F176-H272 AromaticContact CE2-CD2 3.7Å; F176-H272 AromaticContact CZ-CD2 3.92Å; F176-V275 HydrophobicContact CE2-CG1 4.3Å; F176-V275 HydrophobicContact CE2-CG2 4.35Å; F176-V275 HydrophobicContact CZ-CG2 3.88Å; F176-L322 WeakPolarHBondContact O-CD1 3.49Å
177	L	98.8	Very high	96.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.2	-177.8	-172.2	60	0	0	0	110.7	F166 V179 M264 L322 F325 A326	F166-L177 HydrophobicContact CD1-CD1 4.32Å; F166-L177 HydrophobicContact CD1-CD2 4.14Å; F166-L177 HydrophobicContact CE1-CD2 4.5Å; L177-V179 HydrophobicContact CD2-CG2 3.97Å; L177-V179 HydrophobicContact CG-CG2 3.96Å; L177-M264 HydrophobicContact CB-CB 4.31Å; L177-M264 HydrophobicContact CD2-SD 4.2Å; L177-M264 PolarHBondContact N-O 2.98Å; L177-M264 PolarHBondContact O-N 3.45Å; L177-L322 HydrophobicContact CB-CG 4.08Å; L177-L322 HydrophobicContact CD1-CD2 4.33Å; L177-L322 HydrophobicContact CD1-CG 4.42Å; L177-F325 HydrophobicContact CD2-CB 3.93Å; L177-A326 HydrophobicContact CD2-CB 4Å
178	V	98.8	Very high	96.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.9	163.9	178.8	0	0	0	0	109.3	V167 V169 F176 I261 L262 V263 V275 I279	V167-V178 HydrophobicContact CB-CB 4.2Å; V167-V178 PolarHBondContact N-O 3.19Å; V167-V178 PolarHBondContact O-N 2.95Å; V169-V178 HydrophobicContact CG2-CG2 3.99Å; F176-V178 HydrophobicContact CD2-CG2 4.13Å; F176-V178 HydrophobicContact CE2-CG2 3.86Å; V178-I261 HydrophobicContact CG1-CG2 3.43Å; V178-I261 VanDerWaalsContact CG1-CG2 3.43Å; V178-L262 CarbonylContact C-O 3.43Å; V178-L262 VanDerWaalsContact CA-O 3.3Å; V178-L262 WeakPolarHBondContact CA-O 3.43Å; V178-V263 HydrophobicContact CG2-CG1 4.49Å; V178-V263 HydrophobicContact CG2-CG2 4.33Å; V178-V275 HydrophobicContact CG2-CG1 3.98Å; V178-I279 HydrophobicContact CB-CD1 4.23Å; V178-I279 HydrophobicContact CG1-CD1 3.62Å; V178-I279 HydrophobicContact CG2-CD1 4.45Å
179	V	98.8	Very high	96.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	111.3	174	-170.6	0	0	0	0	109.3	F164 L165 F166 L177 C181 L262 M264 F329	F164-V179 HydrophobicContact CB-CG1 4.21Å; F164-V179 HydrophobicContact CD1-CG1 4.41Å; L165-V179 CarbonylContact O-C 3.58Å; L165-V179 WeakPolarHBondContact O-CA 3.42Å; F166-V179 HydrophobicContact CD1-CG2 3.9Å; F166-V179 HydrophobicContact CE1-CG1 4.45Å; F166-V179 HydrophobicContact CE1-CG2 4.02Å; L177-V179 HydrophobicContact CD2-CG2 3.97Å; L177-V179 HydrophobicContact CG-CG2 3.96Å; V179-C181 PolarHBondContact O-N 3.08Å; V179-L262 HydrophobicContact CB-CB 4.29Å; V179-L262 PolarHBondContact N-O 2.99Å; V179-L262 PolarHBondContact O-N 2.88Å; V179-M264 HydrophobicContact CG2-CE 4.13Å; V179-F329 HydrophobicContact CG1-CE2 4.35Å; V179-F329 HydrophobicContact CG1-CZ 4.38Å
180	V	98.9	Very high	96.3	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.9	169.9	-173.7	0	0	0	0	107.7	F164 L165 P183 I261 I279 L283 M302	F164-V180 CarbonylContact C-O 3.58Å; F164-V180 WeakPolarHBondContact CA-O 3.41Å; L165-V180 HydrophobicContact CB-CB 3.98Å; L165-V180 HydrophobicContact CB-CG2 4.41Å; L165-V180 HydrophobicContact CD1-CB 4.12Å; L165-V180 HydrophobicContact CD1-CG1 4.34Å; L165-V180 HydrophobicContact CG-CB 4.19Å; L165-V180 PolarHBondContact N-O 3.36Å; L165-V180 PolarHBondContact O-N 3.49Å; V180-P183 HydrophobicContact CG1-CB 4Å; V180-P183 HydrophobicContact CG1-CG 4.47Å; V180-I261 HydrophobicContact CG2-CG1 4.49Å; V180-I279 HydrophobicContact CG2-CG2 3.67Å; V180-L283 HydrophobicContact CG1-CD1 3.87Å; V180-M302 HydrophobicContact CG1-CE 4.29Å; V180-M302 HydrophobicContact CG1-SD 4.32Å
181	C	98.7	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133	-177.8	-55.2	0	0	0	0	109.7	D163 F164 V179 P259 C260 F337	D163-C181 CarbonylContact O-C 3.58Å; D163-C181 WeakPolarHBondContact O-CA 3.47Å; F164-C181 HydrophobicContact CD1-CB 4.29Å; F164-C181 HydrophobicContact CE1-CB 4.39Å; V179-C181 PolarHBondContact O-N 3.08Å; C181-P259 WeakPolarHBondContact O-CA 3.39Å; C181-C260 PolarHBondContact N-O 3.31Å; C181-C260 PolarHBondContact O-N 2.79Å; C181-C260 VanDerWaalsContact O-N 3.07Å; C181-F337 HydrophobicContact CB-CD1 4.13Å; C181-F337 HydrophobicContact CB-CE1 3.85Å; C181-F337 VanDerWaalsContact SG-CE1 3.59Å
182	F	98.5	Very high	96.4	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.035	27%	0.266	C	S	.	.			trans	46.4	53.2	177.3	-48.1	-74.8	0	0	0	114.3	D163 F164 G184 L185 K257 R258 F337	D163-F182 HydrophobicContact CB-CD1 4.06Å; D163-F182 HydrophobicContact CB-CE1 3.88Å; D163-F182 PolarHBondContact O-N 3.05Å; F164-F182 HydrophobicContact CE1-CE1 4.42Å; F164-F182 HydrophobicContact CE1-CE2 4.16Å; F164-F182 AromaticContact CE1-CZ 3.91Å; F164-F182 HydrophobicContact CE1-CZ 3.91Å; F164-F182 HydrophobicContact CZ-CE1 4.31Å; F164-F182 AromaticContact CZ-CZ 3.92Å; F164-F182 HydrophobicContact CZ-CZ 3.92Å; F182-G184 PolarHBondContact O-N 3.45Å; F182-G184 VanDerWaalsContact O-N 3.1Å; F182-L185 HydrophobicContact CB-CB 4Å; F182-L185 HydrophobicContact CB-CD1 3.51Å; F182-L185 HydrophobicContact CB-CG 3.72Å; F182-L185 HydrophobicContact CD1-CD1 3.99Å; F182-L185 HydrophobicContact CD2-CD1 4.49Å; F182-L185 HydrophobicContact CG-CD1 3.74Å; F182-L185 HydrophobicContact CG-CG 4.39Å; F182-L185 PolarHBondContact O-N 3.47Å; F182-K257 HydrophobicContact CD2-CB 4.4Å; F182-K257 HydrophobicContact CE1-CD 3.91Å; F182-K257 HydrophobicContact CE1-CG 4.39Å; F182-K257 HydrophobicContact CE2-CB 4.15Å; F182-K257 HydrophobicContact CE2-CG 4.14Å; F182-K257 HydrophobicContact CZ-CB 4.31Å; F182-K257 HydrophobicContact CZ-CD 3.88Å; F182-K257 HydrophobicContact CZ-CG 3.89Å; F182-R258 WeakPolarHBondContact CD2-O 3.5Å; F182-F337 HydrophobicContact CE2-CD1 4.21Å; F182-F337 AromaticContact CE2-CD2 3.67Å; F182-F337 HydrophobicContact CE2-CD2 3.67Å; F182-F337 AromaticContact CE2-CE1 3.99Å; F182-F337 HydrophobicContact CE2-CE1 3.99Å; F182-F337 AromaticContact CE2-CE2 3.43Å; F182-F337 HydrophobicContact CE2-CE2 3.43Å; F182-F337 VanDerWaalsContact CE2-CE2 3.43Å; F182-F337 HydrophobicContact CE2-CG 4.07Å; F182-F337 AromaticContact CE2-CZ 3.6Å; F182-F337 HydrophobicContact CE2-CZ 3.6Å; F182-F337 HydrophobicContact CZ-CD2 4.33Å; F182-F337 AromaticContact CZ-CE2 3.76Å; F182-F337 HydrophobicContact CZ-CE2 3.76Å; F182-F337 HydrophobicContact CZ-CZ 4.02Å
183	P	98.2	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.1	-178.3	27.7	-37.7	0	0	0	113.2	I159 F160 K162 L165 V180 L283 R295 M302	I159-P183 WeakPolarHBondContact O-CG 3.45Å; F160-P183 HydrophobicContact CD1-CB 3.96Å; F160-P183 HydrophobicContact CE1-CB 4.31Å; K162-P183 WeakPolarHBondContact O-CD 3.43Å; L165-P183 HydrophobicContact CD1-CB 4.42Å; L165-P183 HydrophobicContact CD1-CG 3.98Å; L165-P183 HydrophobicContact CG-CG 4.18Å; V180-P183 HydrophobicContact CG1-CB 4Å; V180-P183 HydrophobicContact CG1-CG 4.47Å; P183-L283 HydrophobicContact CB-CD2 4.46Å; P183-R295 PolarHBondContact O-NH1 3.49Å; P183-M302 HydrophobicContact CB-CE 4.43Å
184	G	97.6	Very high	95.8	Very high	24 Å²	24	47.5 Å²	47.5	25%	0.247	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-29.5	175.3	0	0	0	0	0	114.9	F160 F182 E186 R295	F160-G184 WeakPolarHBondContact O-CA 3.37Å; F182-G184 PolarHBondContact O-N 3.45Å; F182-G184 VanDerWaalsContact O-N 3.1Å; G184-E186 PolarHBondContact O-N 3Å; G184-R295 PolarHBondContact O-NH1 2.81Å
185	L	97	Very high	94.3	Very high	37 Å²	37	48.3 Å²	48.3	19%	0.194	26%	0.257	C	S	.	.			trans	-70.1	127.4	-174.4	-73.8	-175.1	0	0	0	111.7	F182 G187 K257 P259 R295	F182-L185 HydrophobicContact CB-CB 4Å; F182-L185 HydrophobicContact CB-CD1 3.51Å; F182-L185 HydrophobicContact CB-CG 3.72Å; F182-L185 HydrophobicContact CD1-CD1 3.99Å; F182-L185 HydrophobicContact CD2-CD1 4.49Å; F182-L185 HydrophobicContact CG-CD1 3.74Å; F182-L185 HydrophobicContact CG-CG 4.39Å; F182-L185 PolarHBondContact O-N 3.47Å; L185-G187 VanDerWaalsContact C-N 3.32Å; L185-G187 PolarHBondContact O-N 3.41Å; L185-K257 HydrophobicContact CD1-CB 4.12Å; L185-P259 WeakPolarHBondContact O-CG 3.39Å; L185-R295 PolarHBondContact O-NH2 3.41Å
186	E	91.5	Very high	92.3	Very high	167 Å²	167	52.6 Å²	52.6	78%	0.78	30%	0.303	S	S	*	.			trans	-70.2	-27.8	-178.6	-65.7	-172.2	171	0	0	113.6	G184	G184-E186 PolarHBondContact O-N 3Å
187	G	92.6	Very high	90	Very high	34 Å²	34	55.6 Å²	55.6	35%	0.351	33%	0.328	S	S	.	.	S	Bend	trans	-156.8	-170.3	-175.7	0	0	0	0	0	113.1	L185 P259	L185-G187 VanDerWaalsContact C-N 3.32Å; L185-G187 PolarHBondContact O-N 3.41Å; G187-P259 WeakPolarHBondContact O-CD 3.36Å
188	V	95.8	Very high	87.3	Confident	88 Å²	88	63.6 Å²	63.6	53%	0.533	37%	0.365	S	S	.	.			trans	-74.1	135	177.8	-175.2	0	0	0	0	109.5	T256 K257 R258	V188-T256 HydrophobicContact CG1-CG2 3.3Å; V188-K257 CarbonylContact C-O 3.47Å; V188-K257 WeakPolarHBondContact CA-O 3.47Å; V188-R258 HydrophobicContact CB-CB 4.38Å; V188-R258 HydrophobicContact CG1-CB 4.41Å; V188-R258 HydrophobicContact CG2-CB 3.9Å
189	Q	96.4	Very high	84.4	Confident	89 Å²	89	70.6 Å²	70.6	42%	0.416	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.4	173.8	-67	-177.9	-15.8	0	0	109.5	T256 K257	Q189-T256 CarbonylContact O-C 3.59Å; Q189-T256 WeakPolarHBondContact O-CA 3.14Å; Q189-K257 PolarHBondContact N-O 3.5Å; Q189-K257 PolarHBondContact O-N 3.28Å
190	T	96.4	Very high	81.3	Confident	95 Å²	95	79.1 Å²	79.1	58%	0.583	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.4	172.6	-59.2	0	0	0	0	108	T254 V255	T190-T254 HydrophobicContact CG2-CG2 4.43Å; T190-V255 WeakPolarHBondContact CA-O 3.42Å
191	E	94.5	Very high	78.3	Confident	68 Å²	68	84.5 Å²	84.5	32%	0.318	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148	-178.4	-65.2	178.7	-173.5	0	0	110	T254 V255 K257	E191-T254 CarbonylContact O-C 3.52Å; E191-T254 WeakPolarHBondContact O-CA 3.45Å; E191-T254 WeakPolarHBondContact O-CB 3.11Å; E191-V255 PolarHBondContact N-O 3.02Å; E191-V255 PolarHBondContact O-N 2.9Å; E191-K257 WeakPolarHBondContact OE1-CD 3.32Å; E191-K257 WeakPolarHBondContact OE1-CE 3.45Å; E191-K257 IonicContact OE1-NZ 2.77Å; E191-K257 PolarHBondContact OE1-NZ 2.84Å; E191-K257 WeakPolarHBondContact OE2-CE 3.48Å; E191-K257 IonicContact OE2-NZ 2.69Å; E191-K257 PolarHBondContact OE2-NZ 3.44Å
192	E	94.9	Very high	75.5	Confident	167 Å²	167	89.8 Å²	89.8	78%	0.78	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.6	167.9	-66.6	-172.4	173.4	0	0	110
193	F	91.8	Very high	72.2	Confident	29 Å²	29	92.2 Å²	92.2	13%	0.127	55%	0.548	C	S	.	.			trans	-121.3	112.1	-177.9	-178.5	-106.2	0	0	0	109.7	L247 C250 K252 K253 V255 V335	F193-L247 HydrophobicContact CE2-CD1 3.94Å; F193-L247 HydrophobicContact CZ-CD1 4.01Å; F193-C250 HydrophobicContact CD1-CB 4.45Å; F193-C250 HydrophobicContact CE1-CB 3.78Å; F193-C250 HydrophobicContact CZ-CB 4.22Å; F193-K252 WeakPolarHBondContact CD1-O 3.49Å; F193-K253 PolarHBondContact N-O 3.3Å; F193-V255 HydrophobicContact CB-CB 4.32Å; F193-V255 HydrophobicContact CB-CG1 3.6Å; F193-V255 HydrophobicContact CB-CG2 4Å; F193-V255 HydrophobicContact CD1-CG1 4.07Å; F193-V255 HydrophobicContact CD2-CG1 4.01Å; F193-V255 HydrophobicContact CD2-CG2 4.23Å; F193-V255 HydrophobicContact CG-CG1 3.62Å; F193-V255 HydrophobicContact CG-CG2 4.37Å; F193-V335 HydrophobicContact CE2-CB 4.03Å; F193-V335 HydrophobicContact CE2-CG1 4Å; F193-V335 HydrophobicContact CE2-CG2 3.94Å; F193-V335 HydrophobicContact CZ-CG1 4.49Å; F193-V335 HydrophobicContact CZ-CG2 3.94Å
194	Q	80.7	Confident	69.3	Low	175 Å²	175	98.3 Å²	98.3	82%	0.818	59%	0.588	S	S	*	*			trans	-93.1	104	171.5	-64.4	-179.9	6.3	0	0	107.9	G196	Q194-G196 PolarHBondContact O-N 3.27Å
195	S	65.2	Low	66.5	Low	25 Å²	25	100.7 Å²	100.7	18%	0.175	61%	0.613	C	S	.	*			trans	-69.7	129.7	169.7	94.5	0	0	0	0	107.9	A197 R239	S195-A197 PolarHBondContact O-N 3.43Å; S195-R239 PolarHBondContact OG-NH1 3.14Å; S195-R239 PolarHBondContact OG-NH2 3.32Å
196	G	55.2	Low	63.4	Low	95 Å²	95	106.4 Å²	106.4	98%	0.979	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	27.5	-176.4	0	0	0	0	0	116	Q194	Q194-G196 PolarHBondContact O-N 3.27Å
197	A	49.1	Very low	60.8	Low	65 Å²	65	107.5 Å²	107.5	54%	0.537	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.7	3.2	-178.3	0	0	0	0	0	113.9	S195 R239	S195-A197 PolarHBondContact O-N 3.43Å; A197-R239 VanDerWaalsContact CB-NH1 3.33Å
198	E	43	Very low	57.7	Low	168 Å²	168	115.4 Å²	115.4	79%	0.785	67%	0.674	S	S	*	*	S	Bend	trans	-108.8	6.5	-175.3	-71.4	-171.2	167.2	0	0	115.9
199	N	37.9	Very low	54.4	Low	147 Å²	147	119.1 Å²	119.1	79%	0.786	69%	0.69	S	S	*	*			trans	-120.7	68.4	175	-76.6	-21.8	0	0	0	112.7
200	E	32.9	Very low	51.2	Low	178 Å²	178	123.3 Å²	123.3	83%	0.832	71%	0.711	S	S	*	*			trans	-126.3	98	147.9	-86.7	-67.7	146.3	0	0	106.2	A202	E200-A202 PolarHBondContact O-N 3.01Å
201	P	37.6	Very low	47.9	Very low	115 Å²	115	127.6 Å²	127.6	75%	0.747	73%	0.725	S	S	*	*			trans	-71.6	115.5	167.2	17.8	-8.5	0	0	0	107.6	G203	P201-G203 PolarHBondContact O-N 3.43Å
202	A	39.5	Very low	45.2	Very low	111 Å²	111	129.1 Å²	129.1	92%	0.917	74%	0.741	S	S	*	*			trans	-59.4	91.6	159.9	0	0	0	0	0	108.6	E200	E200-A202 PolarHBondContact O-N 3.01Å
203	G	29.4	Very low	42	Very low	59 Å²	59	126.4 Å²	126.4	61%	0.608	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-103.3	135.4	173.3	0	0	0	0	0	110.5	P201	P201-G203 PolarHBondContact O-N 3.43Å
204	P	36.6	Very low	38.9	Very low	128 Å²	128	128.4 Å²	128.4	83%	0.831	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.9	151.8	-173.9	32.1	-33.2	0	0	0	110.8
205	G	38.9	Very low	36.4	Very low	75 Å²	75	126.3 Å²	126.3	77%	0.773	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-51.8	141.3	-176.5	0	0	0	0	0	113.7
206	N	30.9	Very low	34.5	Very low	157 Å²	157	128.8 Å²	128.8	84%	0.84	81%	0.809	S	S	*	*			trans	-143.8	122.6	150.7	-104.9	-11.3	0	0	0	109	F208	N206-F208 PolarHBondContact O-N 2.89Å
207	Q	37.6	Very low	33.2	Very low	189 Å²	189	132.1 Å²	132.1	88%	0.883	81%	0.805	S	S	*	*			trans	-51.5	126.3	160.1	-77.9	165.2	-13.4	0	0	108.8
208	F	27.5	Very low	32.1	Very low	201 Å²	201	137.9 Å²	137.9	88%	0.882	82%	0.821	S	S	*	*			trans	-135.9	121.8	153	-115.9	-89.9	0	0	0	110	N206	N206-F208 PolarHBondContact O-N 2.89Å
209	L	27.3	Very low	31.4	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	82%	0.823	S	S	*	*			trans	-62.9	143.1	-175.9	-78.5	139.6	0	0	0	112
210	M	27.8	Very low	30.7	Very low	176 Å²	176	137.2 Å²	137.2	87%	0.867	82%	0.822	S	S	*	*			trans	-62.5	142.1	164.3	-151.8	176.9	-173.1	0	0	110.1
211	E	27.6	Very low	30.3	Very low	185 Å²	185	137.6 Å²	137.6	86%	0.864	83%	0.826	S	S	*	*			trans	-160.6	149.4	141.6	-96.1	-67.5	122.9	0	0	109.3
212	P	37.8	Very low	29.8	Very low	101 Å²	101	140.6 Å²	140.6	66%	0.656	83%	0.828	S	S	*	*			trans	-116.9	152.6	-159.8	38.4	-23.9	0	0	0	114.8
213	A	27.5	Very low	29.1	Very low	109 Å²	109	138 Å²	138	90%	0.901	81%	0.811	S	S	*	*			trans	-176.8	137.2	154.5	0	0	0	0	0	107.7
214	G	26.3	Very low	29.2	Very low	71 Å²	71	141.5 Å²	141.5	73%	0.732	82%	0.821	S	S	*	*			cis	177.1	142.9	-0.2	0	0	0	0	0	107.6
215	S	28.5	Very low	28.7	Very low	132 Å²	132	141.1 Å²	141.1	92%	0.923	82%	0.82	S	S	*	*			trans	46.9	110	151.8	-177.4	0	0	0	0	120.8
216	G	25.7	Very low	28.6	Very low	76 Å²	76	142.6 Å²	142.6	78%	0.784	83%	0.825	S	S	*	*			trans	-171.4	99	155	0	0	0	0	0	112.2
217	N	29	Very low	28.4	Very low	166 Å²	166	138.8 Å²	138.8	89%	0.888	82%	0.822	S	S	*	*			trans	-42.2	135.3	-176.9	-82.7	-18.3	0	0	0	117.1
218	Q	25.8	Very low	28.2	Very low	186 Å²	186	134 Å²	134	87%	0.869	82%	0.823	S	S	*	*				-162.9	114.5	125.7	-120.4	173.1	16.1	0	0	113.7
219	V	27.3	Very low	28.4	Very low	136 Å²	136	129.5 Å²	129.5	82%	0.824	82%	0.817	S	S	*	*			trans	54.7	112.9	142.4	-173.7	0	0	0	0	119
220	Q	24.4	Very low	28.7	Very low	165 Å²	165	131 Å²	131	77%	0.771	82%	0.819	S	S	*	*			trans	-59	125.5	170.9	-70.9	168.4	-31.6	0	0	112.4
221	M	23.6	Very low	29.1	Very low	185 Å²	185	133.4 Å²	133.4	91%	0.911	82%	0.819	S	S	*	*			trans	-102.8	113.1	153.2	-159.2	84.5	80	0	0	106.6	G223	M221-G223 PolarHBondContact O-N 2.95Å
222	F	27.6	Very low	29.4	Very low	179 Å²	179	129.1 Å²	129.1	79%	0.785	82%	0.815	S	S	*	*			trans	-63	127	177.7	-95.9	-101	0	0	0	110.8
223	G	24.3	Very low	29.4	Very low	55 Å²	55	128.9 Å²	128.9	57%	0.567	82%	0.822	S	S	*	*			trans	-67.5	169.3	149.1	0	0	0	0	0	109.3	M221	M221-G223 PolarHBondContact O-N 2.95Å
224	V	31.3	Very low	30.4	Very low	134 Å²	134	127.4 Å²	127.4	81%	0.812	81%	0.809	S	S	*	*			cis	-164.1	151.4	41.6	-177.8	0	0	0	0	104.1
225	C	27.1	Very low	31.6	Very low	120 Å²	120	132.4 Å²	132.4	81%	0.811	81%	0.814	S	S	*	*				-173.2	127	91.6	-82.9	0	0	0	0	112
226	A	35.9	Very low	33.4	Very low	106 Å²	106	132 Å²	132	88%	0.876	81%	0.808	S	S	*	*			trans	-61.6	134.3	164.1	0	0	0	0	0	111.2
227	G	26.3	Very low	35.6	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	79%	0.788	S	S	*	*			trans	-135.4	113.9	161	0	0	0	0	0	107.2
228	G	34.4	Very low	38	Very low	87 Å²	87	128.3 Å²	128.3	90%	0.897	77%	0.767	S	S	*	*			trans	-62.4	135.6	-167	0	0	0	0	0	115
229	S	30.1	Very low	40.5	Very low	108 Å²	108	123.4 Å²	123.4	76%	0.755	74%	0.74	S	S	*	*			trans	-149.7	106.7	140	-175	0	0	0	0	105.8	R231	S229-R231 VanDerWaalsContact C-N 3.27Å; S229-R231 PolarHBondContact O-N 2.85Å
230	E	33.6	Very low	42.8	Very low	196 Å²	196	121.9 Å²	121.9	92%	0.916	74%	0.736	S	S	*	*			trans	-58.8	93.1	170	-71	172.2	126.3	0	0	108.1	A232	E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 2.99Å
231	R	37.8	Very low	45.6	Very low	227 Å²	227	119.5 Å²	119.5	86%	0.857	72%	0.724	S	S	*	*			trans	-69.3	99.4	157.6	-81.3	-178.3	174.2	-176.8	-2.4	105.6	S229 A233	S229-R231 VanDerWaalsContact C-N 3.27Å; S229-R231 PolarHBondContact O-N 2.85Å; R231-A233 PolarHBondContact O-N 2.98Å
232	A	33.1	Very low	48.9	Very low	95 Å²	95	111.9 Å²	111.9	79%	0.785	69%	0.687	S	S	*	*			trans	-48.1	109	163.5	0	0	0	0	0	107.5	E230 A234	E230-A232 VanDerWaalsContact C-N 3.3Å; E230-A232 PolarHBondContact O-N 2.99Å; A232-A234 PolarHBondContact O-N 3.21Å
233	A	38.2	Very low	52.1	Low	97 Å²	97	103.5 Å²	103.5	80%	0.802	65%	0.651	S	S	*	*			trans	-61.6	108.6	173.3	0	0	0	0	0	106.1	R231 E235	R231-A233 PolarHBondContact O-N 2.98Å; A233-E235 PolarHBondContact O-N 3.37Å
234	A	48.4	Very low	55.5	Low	77 Å²	77	104.4 Å²	104.4	64%	0.636	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-52.8	128	175	0	0	0	0	0	108.2	A232	A232-A234 PolarHBondContact O-N 3.21Å
235	E	51.6	Low	58.5	Low	177 Å²	177	98.4 Å²	98.4	83%	0.827	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-50.9	137	178.6	-71.7	-168.4	157.5	0	0	110.4	A233 R237	A233-E235 PolarHBondContact O-N 3.37Å; E235-R237 PolarHBondContact O-N 2.91Å
236	P	65.1	Low	61.8	Low	124 Å²	124	92.7 Å²	92.7	81%	0.805	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.8	179.9	21.8	-29.4	0	0	0	109.8
237	R	73.8	Confident	64.6	Low	98 Å²	98	91 Å²	91	37%	0.37	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-57.6	138.9	179.2	-75.8	-174.6	-75.8	161.7	-3	110.2	E235 R239 G345 W346	E235-R237 PolarHBondContact O-N 2.91Å; R237-R239 PolarHBondContact O-N 3.44Å; R237-G345 PolarHBondContact NH1-O 2.92Å; R237-G345 VanDerWaalsContact NH1-O 3.08Å; R237-W346 PolarHBondContact NH1-O 2.71Å; R237-W346 PolarHBondContact NH2-O 3.34Å
238	P	79.1	Confident	67.7	Low	66 Å²	66	91.9 Å²	91.9	43%	0.429	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-54.8	137.2	175.8	-23	31.5	0	0	0	111.1	S240 Q241	P238-S240 PolarHBondContact O-N 3.11Å; P238-S240 VanDerWaalsContact O-N 3.09Å; P238-Q241 HydrophobicContact CB-CG 4.34Å; P238-Q241 WeakPolarHBondContact O-CB 3.38Å; P238-Q241 PolarHBondContact O-N 2.96Å
239	R	77.2	Confident	70.6	Confident	83 Å²	83	87.8 Å²	87.8	31%	0.313	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-56.3	-29.4	-179.4	-168	171.1	-176.4	-178.2	-1.3	113.3	S195 A197 R237 Q241 L242 L248 C250	S195-R239 PolarHBondContact OG-NH1 3.14Å; S195-R239 PolarHBondContact OG-NH2 3.32Å; A197-R239 VanDerWaalsContact CB-NH1 3.33Å; R237-R239 PolarHBondContact O-N 3.44Å; R239-Q241 PolarHBondContact O-N 2.99Å; R239-L242 PolarHBondContact O-N 2.93Å; R239-L242 VanDerWaalsContact O-N 3.16Å; R239-L248 WeakPolarHBondContact CG-O 3.09Å; R239-L248 PolarHBondContact NE-O 2.85Å; R239-L248 VanDerWaalsContact NE-O 3.09Å; R239-C250 PolarHBondContact NH2-O 2.95Å
240	S	76.3	Confident	73.6	Confident	104 Å²	104	82.7 Å²	82.7	73%	0.727	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-64.3	-19.2	175	55.2	0	0	0	0	114.3	P238	P238-S240 PolarHBondContact O-N 3.11Å; P238-S240 VanDerWaalsContact O-N 3.09Å
241	Q	83.4	Confident	76.4	Confident	114 Å²	114	80.7 Å²	80.7	53%	0.533	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-95.1	-7.2	177.3	-60.2	-179.7	5.8	0	0	112.7	P238 R239	P238-Q241 HydrophobicContact CB-CG 4.34Å; P238-Q241 WeakPolarHBondContact O-CB 3.38Å; P238-Q241 PolarHBondContact O-N 2.96Å; R239-Q241 PolarHBondContact O-N 2.99Å
242	L	92.1	Very high	79.1	Confident	25 Å²	25	74.4 Å²	74.4	13%	0.131	43%	0.425	C	S	.	.	S	Bend	trans	-87.7	151.1	179	-63	175	0	0	0	110.9	R239 L248	R239-L242 PolarHBondContact O-N 2.93Å; R239-L242 VanDerWaalsContact O-N 3.16Å; L242-L248 HydrophobicContact CD1-CB 3.64Å
243	P	95.1	Very high	82	Confident	4 Å²	4	78.6 Å²	78.6	3%	0.026	43%	0.426	C	S	.	.			trans	-59.6	132.6	178.6	-26.1	35.9	0	0	0	113.4	C245 S246 G249 R342 L343 W346	P243-C245 PolarHBondContact O-N 2.75Å; P243-C245 VanDerWaalsContact O-N 3.14Å; P243-S246 PolarHBondContact O-N 3.31Å; P243-S246 VanDerWaalsContact O-N 3.07Å; P243-S246 PolarHBondContact O-OG 3.07Å; P243-G249 WeakPolarHBondContact O-CA 3.2Å; P243-R342 WeakPolarHBondContact CB-O 3.48Å; P243-L343 HydrophobicContact CB-CD2 3.7Å; P243-L343 HydrophobicContact CG-CD2 4.04Å; P243-W346 HydrophobicContact CG-CB 4.09Å; P243-W346 HydrophobicContact CG-CG 4.2Å
244	P	94.6	Very high	84.8	Confident	74 Å²	74	77.4 Å²	77.4	48%	0.481	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.9	-175.2	28.6	-36.5	0	0	0	114	C250	P244-C250 WeakPolarHBondContact O-CA 3.46Å; P244-C250 WeakPolarHBondContact O-CB 3.4Å
245	C	94.9	Very high	87.1	Confident	7 Å²	7	74 Å²	74	5%	0.047	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-1.4	175.4	59.5	0	0	0	0	113.5	P243 V334 V335 D336 L341 L343	P243-C245 PolarHBondContact O-N 2.75Å; P243-C245 VanDerWaalsContact O-N 3.14Å; C245-V334 HydrophobicContact CB-CG1 4.33Å; C245-V334 CarbonylContact O-C 3.58Å; C245-V334 WeakPolarHBondContact O-CA 3.35Å; C245-V335 WeakPolarHBondContact O-CG2 3.32Å; C245-V335 PolarHBondContact O-N 3.29Å; C245-D336 HydrophobicContact CB-CB 4.36Å; C245-D336 WeakPolarHBondContact CB-O 3.37Å; C245-D336 PolarHBondContact O-N 3.09Å; C245-L341 HydrophobicContact CB-CD2 4.04Å; C245-L343 VanDerWaalsContact SG-CD2 3.57Å
246	S	95.8	Very high	89.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-92.4	160.7	-179.1	87	0	0	0	0	112.5	P243 L248 G249 C250 N332 P333	P243-S246 PolarHBondContact O-N 3.31Å; P243-S246 VanDerWaalsContact O-N 3.07Å; P243-S246 PolarHBondContact O-OG 3.07Å; S246-L248 VanDerWaalsContact C-N 3.32Å; S246-L248 PolarHBondContact O-N 3.39Å; S246-G249 PolarHBondContact O-N 3.2Å; S246-G249 VanDerWaalsContact O-N 3.12Å; S246-G249 PolarHBondContact OG-N 3.41Å; S246-C250 WeakPolarHBondContact O-CB 3.5Å; S246-C250 PolarHBondContact O-N 3.4Å; S246-N332 VanDerWaalsContact CB-OD1 3.27Å; S246-N332 WeakPolarHBondContact CB-OD1 3.37Å; S246-N332 VanDerWaalsContact OG-CG 3.24Å; S246-N332 PolarHBondContact OG-ND2 3.33Å; S246-N332 PolarHBondContact OG-OD1 3.34Å; S246-P333 CarbonylContact C-O 3.6Å; S246-P333 VanDerWaalsContact CA-O 3.23Å; S246-P333 WeakPolarHBondContact CA-O 3.4Å
247	L	94.6	Very high	90.8	Very high	72 Å²	72	62.8 Å²	62.8	38%	0.377	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-49.2	-179.1	178.9	65.4	0	0	0	113	F193 N332 P333 V335	F193-L247 HydrophobicContact CE2-CD1 3.94Å; F193-L247 HydrophobicContact CZ-CD1 4.01Å; L247-N332 PolarHBondContact N-OD1 2.99Å; L247-N332 VanDerWaalsContact N-OD1 3.13Å; L247-P333 HydrophobicContact CB-CG 4.1Å; L247-P333 HydrophobicContact CD2-CG 4.27Å; L247-P333 PolarHBondContact N-O 2.85Å; L247-V335 HydrophobicContact CB-CG1 3.83Å; L247-V335 HydrophobicContact CD1-CG1 3.93Å
248	L	93.1	Very high	91.9	Very high	95 Å²	95	60.1 Å²	60.1	50%	0.497	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-23.4	-177.3	-58.7	179.8	0	0	0	113.1	R239 L242 S246 N332	R239-L248 WeakPolarHBondContact CG-O 3.09Å; R239-L248 PolarHBondContact NE-O 2.85Å; R239-L248 VanDerWaalsContact NE-O 3.09Å; L242-L248 HydrophobicContact CD1-CB 3.64Å; S246-L248 VanDerWaalsContact C-N 3.32Å; S246-L248 PolarHBondContact O-N 3.39Å; L248-N332 WeakPolarHBondContact CB-OD1 3.25Å; L248-N332 HydrophobicContact CD1-CB 4.11Å; L248-N332 HydrophobicContact CG-CB 4.31Å; L248-N332 WeakPolarHBondContact CG-OD1 3.36Å; L248-N332 PolarHBondContact N-OD1 2.96Å
249	G	94	Very high	92.8	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.01	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-20.6	-176.2	0	0	0	0	0	114.9	P243 S246	P243-G249 WeakPolarHBondContact O-CA 3.2Å; S246-G249 PolarHBondContact O-N 3.2Å; S246-G249 VanDerWaalsContact O-N 3.12Å; S246-G249 PolarHBondContact OG-N 3.41Å
250	C	94.2	Very high	93.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.276	C	S	.	.			trans	-67	132.5	-177.5	-175.9	0	0	0	0	111.7	F193 R239 P244 S246 K252 V335	F193-C250 HydrophobicContact CD1-CB 4.45Å; F193-C250 HydrophobicContact CE1-CB 3.78Å; F193-C250 HydrophobicContact CZ-CB 4.22Å; R239-C250 PolarHBondContact NH2-O 2.95Å; P244-C250 WeakPolarHBondContact O-CA 3.46Å; P244-C250 WeakPolarHBondContact O-CB 3.4Å; S246-C250 WeakPolarHBondContact O-CB 3.5Å; S246-C250 PolarHBondContact O-N 3.4Å; C250-K252 PolarHBondContact SG-N 2.63Å; C250-V335 HydrophobicContact CB-CG2 3.67Å
251	Q	93	Very high	94.9	Very high	154 Å²	154	48.7 Å²	48.7	72%	0.72	24%	0.241	S	C	*	.			trans	-116.9	4.9	178.7	-62.4	175.7	42.4	0	0	112.3
252	K	93.4	Very high	95.6	Very high	96 Å²	96	43.2 Å²	43.2	42%	0.417	22%	0.216	S	C	.	.			trans	-76	142.2	179.8	-59.9	-177	175.7	-177.2	0	109.8	F193 C250 T254 D336	F193-K252 WeakPolarHBondContact CD1-O 3.49Å; C250-K252 PolarHBondContact SG-N 2.63Å; K252-T254 WeakPolarHBondContact CB-O 3.49Å; K252-T254 PolarHBondContact O-N 3.3Å; K252-D336 WeakPolarHBondContact CE-OD2 3.5Å; K252-D336 IonicContact NZ-OD1 3.76Å; K252-D336 IonicContact NZ-OD2 2.89Å; K252-D336 PolarHBondContact NZ-OD2 3.37Å
253	K	94.6	Very high	95.9	Very high	183 Å²	183	42.1 Å²	42.1	80%	0.796	21%	0.21	S	C	*	.	S	Bend	trans	-70.7	-22.7	170.3	-65.8	-172.8	176	-173.3	0	112.9	F193	F193-K253 PolarHBondContact N-O 3.3Å
254	T	96.3	Very high	96	Very high	72 Å²	72	41.9 Å²	41.9	44%	0.442	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.9	178.9	56.9	0	0	0	0	109.5	T190 E191 K252	T190-T254 HydrophobicContact CG2-CG2 4.43Å; E191-T254 CarbonylContact O-C 3.52Å; E191-T254 WeakPolarHBondContact O-CA 3.45Å; E191-T254 WeakPolarHBondContact O-CB 3.11Å; K252-T254 WeakPolarHBondContact CB-O 3.49Å; K252-T254 PolarHBondContact O-N 3.3Å
255	V	97	Very high	96.1	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.03	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	155.8	178.3	-64.4	0	0	0	0	110.8	T190 E191 F193 V335 D336	T190-V255 WeakPolarHBondContact CA-O 3.42Å; E191-V255 PolarHBondContact N-O 3.02Å; E191-V255 PolarHBondContact O-N 2.9Å; F193-V255 HydrophobicContact CB-CB 4.32Å; F193-V255 HydrophobicContact CB-CG1 3.6Å; F193-V255 HydrophobicContact CB-CG2 4Å; F193-V255 HydrophobicContact CD1-CG1 4.07Å; F193-V255 HydrophobicContact CD2-CG1 4.01Å; F193-V255 HydrophobicContact CD2-CG2 4.23Å; F193-V255 HydrophobicContact CG-CG1 3.62Å; F193-V255 HydrophobicContact CG-CG2 4.37Å; V255-V335 WeakPolarHBondContact CB-O 3.32Å; V255-V335 HydrophobicContact CG1-CG2 4.15Å; V255-V335 WeakPolarHBondContact CG2-O 3.5Å; V255-D336 HydrophobicContact CB-CB 4.12Å; V255-D336 HydrophobicContact CG1-CB 4.06Å
256	T	97.1	Very high	96.2	Very high	22 Å²	22	38.1 Å²	38.1	14%	0.135	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.8	-179.7	-54.4	0	0	0	0	111.1	V188 Q189 D336 F337	V188-T256 HydrophobicContact CG1-CG2 3.3Å; Q189-T256 CarbonylContact O-C 3.59Å; Q189-T256 WeakPolarHBondContact O-CA 3.14Å; T256-D336 WeakPolarHBondContact CB-OD1 3.34Å; T256-D336 PolarHBondContact N-OD1 3.35Å; T256-F337 WeakPolarHBondContact O-CB 3.38Å; T256-F337 WeakPolarHBondContact O-CD2 3.44Å; T256-F337 PolarHBondContact O-N 3.34Å
257	K	97.3	Very high	96.1	Very high	43 Å²	43	40.8 Å²	40.8	19%	0.187	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	142.9	164.5	-66.3	-176.4	-175.3	161.7	0	109.9	F182 L185 V188 Q189 E191	F182-K257 HydrophobicContact CD2-CB 4.4Å; F182-K257 HydrophobicContact CE1-CD 3.91Å; F182-K257 HydrophobicContact CE1-CG 4.39Å; F182-K257 HydrophobicContact CE2-CB 4.15Å; F182-K257 HydrophobicContact CE2-CG 4.14Å; F182-K257 HydrophobicContact CZ-CB 4.31Å; F182-K257 HydrophobicContact CZ-CD 3.88Å; F182-K257 HydrophobicContact CZ-CG 3.89Å; L185-K257 HydrophobicContact CD1-CB 4.12Å; V188-K257 CarbonylContact C-O 3.47Å; V188-K257 WeakPolarHBondContact CA-O 3.47Å; Q189-K257 PolarHBondContact N-O 3.5Å; Q189-K257 PolarHBondContact O-N 3.28Å; E191-K257 WeakPolarHBondContact OE1-CD 3.32Å; E191-K257 WeakPolarHBondContact OE1-CE 3.45Å; E191-K257 IonicContact OE1-NZ 2.77Å; E191-K257 PolarHBondContact OE1-NZ 2.84Å; E191-K257 WeakPolarHBondContact OE2-CE 3.48Å; E191-K257 IonicContact OE2-NZ 2.69Å; E191-K257 PolarHBondContact OE2-NZ 3.44Å
258	R	96.5	Very high	95.6	Very high	43 Å²	43	42.5 Å²	42.5	16%	0.162	20%	0.203	C	C	.	.			trans	-158.9	151.3	175.7	59.7	179.4	62.1	157.5	3.3	112	F182 V188 C260 F337 D338	F182-R258 WeakPolarHBondContact CD2-O 3.5Å; V188-R258 HydrophobicContact CB-CB 4.38Å; V188-R258 HydrophobicContact CG1-CB 4.41Å; V188-R258 HydrophobicContact CG2-CB 3.9Å; R258-C260 HydrophobicContact CG-CB 4.44Å; R258-C260 PolarHBondContact O-N 2.88Å; R258-F337 WeakPolarHBondContact CD-O 3.44Å; R258-F337 HydrophobicContact CG-CB 3.99Å; R258-D338 IonicContact CZ-OD1 3.46Å; R258-D338 VanDerWaalsContact CZ-OD1 3.25Å; R258-D338 IonicContact NH1-OD1 3.23Å; R258-D338 PolarHBondContact NH1-OD1 3.28Å; R258-D338 IonicContact NH2-OD1 2.75Å; R258-D338 PolarHBondContact NH2-OD1 2.92Å
259	P	97.9	Very high	94.8	Very high	6 Å²	6	43.5 Å²	43.5	4%	0.039	21%	0.208	C	C	.	.			trans	-61.2	117.5	167.3	26.2	-34.5	0	0	0	110.2	C181 L185 G187 S301 M302	C181-P259 WeakPolarHBondContact O-CA 3.39Å; L185-P259 WeakPolarHBondContact O-CG 3.39Å; G187-P259 WeakPolarHBondContact O-CD 3.36Å; P259-S301 WeakPolarHBondContact CG-O 3.47Å; P259-M302 HydrophobicContact CB-CE 3.74Å; P259-M302 HydrophobicContact CB-CG 4.47Å
260	C	98.3	Very high	94	Very high	6 Å²	6	46 Å²	46	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	164.8	177.6	64.3	0	0	0	0	112.8	C181 R258 R303	C181-C260 PolarHBondContact N-O 3.31Å; C181-C260 PolarHBondContact O-N 2.79Å; C181-C260 VanDerWaalsContact O-N 3.07Å; R258-C260 HydrophobicContact CG-CB 4.44Å; R258-C260 PolarHBondContact O-N 2.88Å; C260-R303 CarbonylContact C-O 3.17Å; C260-R303 VanDerWaalsContact CA-O 3.29Å; C260-R303 WeakPolarHBondContact CA-O 3.39Å; C260-R303 VanDerWaalsContact CB-O 3.27Å; C260-R303 WeakPolarHBondContact CB-O 3.11Å
261	I	98.6	Very high	93.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112	174.5	-59	175	0	0	0	108.1	V178 V180 C276 I279 R280 M302 R303 S304 C305	V178-I261 HydrophobicContact CG1-CG2 3.43Å; V178-I261 VanDerWaalsContact CG1-CG2 3.43Å; V180-I261 HydrophobicContact CG2-CG1 4.49Å; I261-C276 HydrophobicContact CD1-CB 4.35Å; I261-I279 HydrophobicContact CD1-CB 4.35Å; I261-I279 HydrophobicContact CD1-CG2 3.98Å; I261-R280 HydrophobicContact CD1-CG 3.76Å; I261-M302 HydrophobicContact CD1-CG 4.45Å; I261-M302 HydrophobicContact CD1-SD 4.13Å; I261-M302 HydrophobicContact CG1-CG 4.04Å; I261-M302 HydrophobicContact CG1-SD 3.9Å; I261-R303 PolarHBondContact N-O 2.85Å; I261-S304 CarbonylContact O-C 3.5Å; I261-S304 WeakPolarHBondContact O-CA 3.13Å; I261-C305 PolarHBondContact O-N 3.45Å
262	L	98.4	Very high	93.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	137.1	175.7	-53.3	-169.7	0	0	0	109.8	V178 V179 M264 C305 F329 F337 L341	V178-L262 CarbonylContact C-O 3.43Å; V178-L262 VanDerWaalsContact CA-O 3.3Å; V178-L262 WeakPolarHBondContact CA-O 3.43Å; V179-L262 HydrophobicContact CB-CB 4.29Å; V179-L262 PolarHBondContact N-O 2.99Å; V179-L262 PolarHBondContact O-N 2.88Å; L262-M264 HydrophobicContact CB-CE 4.28Å; L262-M264 HydrophobicContact CD1-CE 4.24Å; L262-C305 WeakPolarHBondContact CA-O 3.36Å; L262-C305 HydrophobicContact CD2-CB 4.05Å; L262-F329 HydrophobicContact CD1-CE2 4.28Å; L262-F337 HydrophobicContact CD1-CD1 4.35Å; L262-F337 HydrophobicContact CD1-CE1 4.11Å; L262-L341 HydrophobicContact CD1-CD1 3.86Å; L262-L341 HydrophobicContact CD2-CD1 3.34Å; L262-L341 HydrophobicContact CG-CD1 4.23Å
263	V	98.3	Very high	93.9	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.1	173.5	-172.8	0	0	0	0	109.2	F176 V178 H272 C305 C307	F176-V263 HydrophobicContact CD2-CG1 3.94Å; F176-V263 HydrophobicContact CE2-CG1 4.3Å; V178-V263 HydrophobicContact CG2-CG1 4.49Å; V178-V263 HydrophobicContact CG2-CG2 4.33Å; V263-H272 HydrophobicContact CG1-CB 4.07Å; V263-H272 HydrophobicContact CG2-CB 4.17Å; V263-C305 PolarHBondContact N-O 3.04Å; V263-C307 PolarHBondContact O-N 3.27Å
264	M	98.1	Very high	93.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	109.5	180	-57.5	169.3	-169.1	0	0	108.4	F176 L177 V179 L262 C307 V309 F325 F329 L343 W346	F176-M264 WeakPolarHBondContact CB-O 3.47Å; L177-M264 HydrophobicContact CB-CB 4.31Å; L177-M264 HydrophobicContact CD2-SD 4.2Å; L177-M264 PolarHBondContact N-O 2.98Å; L177-M264 PolarHBondContact O-N 3.45Å; V179-M264 HydrophobicContact CG2-CE 4.13Å; L262-M264 HydrophobicContact CB-CE 4.28Å; L262-M264 HydrophobicContact CD1-CE 4.24Å; M264-C307 HydrophobicContact CG-CB 4.21Å; M264-V309 HydrophobicContact CB-CG1 4.05Å; M264-V309 HydrophobicContact CG-CG1 3.94Å; M264-F325 HydrophobicContact CB-CB 4.46Å; M264-F325 HydrophobicContact CB-CD2 3.65Å; M264-F325 HydrophobicContact CB-CE2 4.05Å; M264-F325 HydrophobicContact CB-CG 4.04Å; M264-F325 HydrophobicContact SD-CB 3.88Å; M264-F325 HydrophobicContact SD-CG 4.31Å; M264-F329 HydrophobicContact CE-CD2 3.9Å; M264-F329 HydrophobicContact CE-CE2 4.29Å; M264-L343 HydrophobicContact CE-CD1 4.45Å; M264-W346 HydrophobicContact CE-CH2 3.96Å; M264-W346 HydrophobicContact CE-CZ3 3.94Å; M264-W346 HydrophobicContact SD-CH2 4.33Å; M264-W346 HydrophobicContact SD-CZ3 3.81Å
265	D	97.7	Very high	93.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.			trans	-131.1	123.1	-173.9	-173.6	-22.6	0	0	0	108.8	H174 F176 L267 K268 H272 V309 Q311	H174-D265 IonicContact CD2-OD2 3.34Å; H174-D265 IonicContact CE1-OD1 3.45Å; H174-D265 PolarHBondContact CE1-OD1 3.32Å; H174-D265 VanDerWaalsContact NE2-CG 3.3Å; H174-D265 IonicContact NE2-OD1 3.14Å; H174-D265 PolarHBondContact NE2-OD1 3.48Å; H174-D265 IonicContact NE2-OD2 2.71Å; H174-D265 PolarHBondContact NE2-OD2 2.81Å; F176-D265 HydrophobicContact CB-CB 4.02Å; D265-L267 PolarHBondContact OD1-N 2.93Å; D265-K268 VanDerWaalsContact CG-N 3.28Å; D265-K268 PolarHBondContact OD1-N 3.2Å; D265-H272 IonicContact OD2-CD2 3.75Å; D265-H272 IonicContact OD2-CE1 3.38Å; D265-H272 PolarHBondContact OD2-CE1 2.87Å; D265-H272 IonicContact OD2-NE2 3.16Å; D265-H272 PolarHBondContact OD2-NE2 3.32Å; D265-V309 WeakPolarHBondContact O-CG2 3.46Å; D265-Q311 PolarHBondContact O-NE2 2.88Å
266	S	96.8	Very high	94	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.014	19%	0.186	C	C	.	.	S	Bend	trans	-81.6	-11.7	-177.1	52.7	0	0	0	0	114.2	Q311 Q312	S266-Q311 WeakPolarHBondContact O-CA 3.43Å; S266-Q311 PolarHBondContact O-OE1 2.88Å; S266-Q311 VanDerWaalsContact O-OE1 3.1Å; S266-Q312 PolarHBondContact O-N 2.91Å; S266-Q312 PolarHBondContact OG-OE1 2.88Å
267	L	92.1	Very high	94	Very high	56 Å²	56	39.5 Å²	39.5	29%	0.293	20%	0.201	S	C	.	.	S	Bend	trans	-123.6	-23	179.7	-71.6	178.7	0	0	0	114.3	D265 L269 Q312	D265-L267 PolarHBondContact OD1-N 2.93Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 HydrophobicContact CB-CD1 4.26Å; L267-L269 HydrophobicContact CB-CD2 3.9Å; L267-L269 HydrophobicContact CB-CG 3.63Å; L267-L269 HydrophobicContact CD1-CD1 3.77Å; L267-L269 HydrophobicContact CD1-CD2 4.31Å; L267-L269 HydrophobicContact CD1-CG 4.05Å; L267-L269 HydrophobicContact CG-CG 4.5Å; L267-L269 PolarHBondContact O-N 3.38Å; L267-Q312 VanDerWaalsContact CD1-NE2 3.3Å; L267-Q312 HydrophobicContact CD2-CG 3.36Å; L267-Q312 VanDerWaalsContact CG-CD 3.44Å; L267-Q312 HydrophobicContact CG-CG 3.73Å; L267-Q312 VanDerWaalsContact CG-NE2 3.32Å
268	K	84.5	Confident	94	Very high	107 Å²	107	38.1 Å²	38.1	47%	0.465	20%	0.196	S	C	.	.			trans	53.7	40	-177.8	-58.2	179.8	-179.3	179.8	0	113.7	D265 S270	D265-K268 VanDerWaalsContact CG-N 3.28Å; D265-K268 PolarHBondContact OD1-N 3.2Å; K268-S270 VanDerWaalsContact C-N 3.29Å; K268-S270 PolarHBondContact O-N 3.23Å
269	L	76.9	Confident	94.1	Very high	116 Å²	116	36.2 Å²	36.2	61%	0.607	19%	0.189	S	C	*	.			trans	-68.5	-21.3	-173.7	-62.1	-179.7	0	0	0	114.7	H174 L267	H174-L269 HydrophobicContact CB-CD1 4.18Å; L267-L269 VanDerWaalsContact C-N 3.29Å; L267-L269 HydrophobicContact CB-CD1 4.26Å; L267-L269 HydrophobicContact CB-CD2 3.9Å; L267-L269 HydrophobicContact CB-CG 3.63Å; L267-L269 HydrophobicContact CD1-CD1 3.77Å; L267-L269 HydrophobicContact CD1-CD2 4.31Å; L267-L269 HydrophobicContact CD1-CG 4.05Å; L267-L269 HydrophobicContact CG-CG 4.5Å; L267-L269 PolarHBondContact O-N 3.38Å
270	S	78	Confident	94.1	Very high	53 Å²	53	36.8 Å²	36.8	37%	0.371	19%	0.19	S	C	.	.	S	Bend	trans	-153.3	164	-174.4	68.1	0	0	0	0	113.1	K268 H272	K268-S270 VanDerWaalsContact C-N 3.29Å; K268-S270 PolarHBondContact O-N 3.23Å; S270-H272 PolarHBondContact O-CE1 3.25Å; S270-H272 VanDerWaalsContact O-CE1 3.26Å; S270-H272 PolarHBondContact O-NE2 3.06Å
271	S	89.1	Confident	94.1	Very high	71 Å²	71	37 Å²	37	50%	0.497	19%	0.194	S	C	.	.			trans	-65.5	140.3	169	168.3	0	0	0	0	111.2	D273	S271-D273 WeakPolarHBondContact OG-CB 3.38Å; S271-D273 VanDerWaalsContact OG-CG 3.24Å; S271-D273 PolarHBondContact OG-N 3.45Å; S271-D273 VanDerWaalsContact OG-N 3.11Å; S271-D273 PolarHBondContact OG-OD2 3.17Å
272	H	94.6	Very high	94.1	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.056	20%	0.195	C	C	.	.			trans	-101.1	6.8	177	-44.7	99.8	0	0	0	112.8	F176 V263 D265 S270 D274 V275 C276	F176-H272 AromaticContact CD2-CD2 4Å; F176-H272 AromaticContact CE2-CD2 3.7Å; F176-H272 AromaticContact CZ-CD2 3.92Å; V263-H272 HydrophobicContact CG1-CB 4.07Å; V263-H272 HydrophobicContact CG2-CB 4.17Å; D265-H272 IonicContact OD2-CD2 3.75Å; D265-H272 IonicContact OD2-CE1 3.38Å; D265-H272 PolarHBondContact OD2-CE1 2.87Å; D265-H272 IonicContact OD2-NE2 3.16Å; D265-H272 PolarHBondContact OD2-NE2 3.32Å; S270-H272 PolarHBondContact O-CE1 3.25Å; S270-H272 VanDerWaalsContact O-CE1 3.26Å; S270-H272 PolarHBondContact O-NE2 3.06Å; H272-D274 PolarHBondContact O-N 3.47Å; H272-V275 WeakPolarHBondContact O-CB 3.47Å; H272-V275 PolarHBondContact O-N 3.08Å; H272-V275 VanDerWaalsContact O-N 3.16Å; H272-C276 PolarHBondContact O-N 3.28Å; H272-C276 PolarHBondContact O-SG 3.13Å
273	D	94.5	Very high	94.1	Very high	109 Å²	109	37.2 Å²	37.2	58%	0.583	20%	0.195	S	C	*	.	H	α-helix	trans	-61.2	-43.6	-174.4	-67.9	-38.9	0	0	0	112.2	S271 V275 C276 R277	S271-D273 WeakPolarHBondContact OG-CB 3.38Å; S271-D273 VanDerWaalsContact OG-CG 3.24Å; S271-D273 PolarHBondContact OG-N 3.45Å; S271-D273 VanDerWaalsContact OG-N 3.11Å; S271-D273 PolarHBondContact OG-OD2 3.17Å; D273-V275 VanDerWaalsContact C-N 3.32Å; D273-V275 PolarHBondContact O-N 2.91Å; D273-C276 PolarHBondContact O-N 3.43Å; D273-R277 WeakPolarHBondContact O-CB 3.41Å; D273-R277 PolarHBondContact O-N 2.61Å
274	D	94.6	Very high	94.1	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-39.2	176.8	-95.4	-35.8	0	0	0	112.6	H272 R277 L278	H272-D274 PolarHBondContact O-N 3.47Å; D274-R277 PolarHBondContact O-N 3.43Å; D274-R277 IonicContact OD1-CZ 3.98Å; D274-R277 IonicContact OD1-NE 3.93Å; D274-R277 PolarHBondContact OD1-NE 3.2Å; D274-R277 VanDerWaalsContact OD1-NE 3.16Å; D274-R277 IonicContact OD1-NH2 3.28Å; D274-R277 PolarHBondContact OD1-NH2 3.46Å; D274-L278 WeakPolarHBondContact O-CB 3.49Å; D274-L278 VanDerWaalsContact O-CG 3.28Å; D274-L278 WeakPolarHBondContact O-CG 3.27Å; D274-L278 PolarHBondContact O-N 3.35Å
275	V	96.3	Very high	94.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-49.8	177	176.9	0	0	0	0	109.1	Y123 V169 K171 F176 V178 H272 D273 R277 L278 I279	Y123-V275 HydrophobicContact CD2-CG1 4.31Å; Y123-V275 HydrophobicContact CE1-CG2 4.4Å; Y123-V275 HydrophobicContact CE2-CB 4.17Å; Y123-V275 HydrophobicContact CE2-CG1 3.65Å; Y123-V275 HydrophobicContact CE2-CG2 4.39Å; Y123-V275 WeakPolarHBondContact OH-CA 3.38Å; Y123-V275 WeakPolarHBondContact OH-CG2 3.47Å; V169-V275 HydrophobicContact CG2-CG1 4.17Å; K171-V275 HydrophobicContact CD-CG2 3.88Å; F176-V275 HydrophobicContact CE2-CG1 4.3Å; F176-V275 HydrophobicContact CE2-CG2 4.35Å; F176-V275 HydrophobicContact CZ-CG2 3.88Å; V178-V275 HydrophobicContact CG2-CG1 3.98Å; H272-V275 WeakPolarHBondContact O-CB 3.47Å; H272-V275 PolarHBondContact O-N 3.08Å; H272-V275 VanDerWaalsContact O-N 3.16Å; D273-V275 VanDerWaalsContact C-N 3.32Å; D273-V275 PolarHBondContact O-N 2.91Å; V275-R277 VanDerWaalsContact C-N 3.34Å; V275-R277 PolarHBondContact O-N 3.3Å; V275-L278 PolarHBondContact O-N 2.79Å; V275-I279 HydrophobicContact CG1-CD1 3.95Å; V275-I279 WeakPolarHBondContact O-CG1 3.09Å; V275-I279 PolarHBondContact O-N 2.91Å
276	C	97.9	Very high	94.1	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-39.1	179.1	-62.5	0	0	0	0	111.8	I261 H272 D273 I279 R280 S304	I261-C276 HydrophobicContact CD1-CB 4.35Å; H272-C276 PolarHBondContact O-N 3.28Å; H272-C276 PolarHBondContact O-SG 3.13Å; D273-C276 PolarHBondContact O-N 3.43Å; C276-I279 PolarHBondContact O-N 3.44Å; C276-R280 WeakPolarHBondContact O-CG 3.38Å; C276-R280 PolarHBondContact O-N 3.12Å; C276-S304 VanDerWaalsContact SG-CB 3.51Å
277	R	97.4	Very high	94.2	Very high	120 Å²	120	40.7 Å²	40.7	45%	0.453	21%	0.21	S	C	.	.	H	α-helix	trans	-62	-45.2	175.5	-176.8	-171.8	59.1	70.3	2.9	111.5	D273 D274 V275 R280 G281	D273-R277 WeakPolarHBondContact O-CB 3.41Å; D273-R277 PolarHBondContact O-N 2.61Å; D274-R277 PolarHBondContact O-N 3.43Å; D274-R277 IonicContact OD1-CZ 3.98Å; D274-R277 IonicContact OD1-NE 3.93Å; D274-R277 PolarHBondContact OD1-NE 3.2Å; D274-R277 VanDerWaalsContact OD1-NE 3.16Å; D274-R277 IonicContact OD1-NH2 3.28Å; D274-R277 PolarHBondContact OD1-NH2 3.46Å; V275-R277 VanDerWaalsContact C-N 3.34Å; V275-R277 PolarHBondContact O-N 3.3Å; R277-R280 PolarHBondContact O-N 2.81Å; R277-G281 PolarHBondContact O-N 3.07Å
278	L	97.6	Very high	94.4	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.073	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-42.2	178	-71.3	175.9	0	0	0	112	Y123 L126 D274 V275 G281 Y282	Y123-L278 HydrophobicContact CE2-CB 4.38Å; Y123-L278 HydrophobicContact CE2-CD1 4.25Å; L126-L278 HydrophobicContact CD2-CB 4.32Å; D274-L278 WeakPolarHBondContact O-CB 3.49Å; D274-L278 VanDerWaalsContact O-CG 3.28Å; D274-L278 WeakPolarHBondContact O-CG 3.27Å; D274-L278 PolarHBondContact O-N 3.35Å; V275-L278 PolarHBondContact O-N 2.79Å; L278-G281 PolarHBondContact O-N 2.85Å; L278-Y282 PolarHBondContact O-N 3.21Å
279	I	98.5	Very high	95	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-44.6	176.4	-69.8	170.3	0	0	0	111	V178 V180 I261 V275 C276 G281 Y282 L283	V178-I279 HydrophobicContact CB-CD1 4.23Å; V178-I279 HydrophobicContact CG1-CD1 3.62Å; V178-I279 HydrophobicContact CG2-CD1 4.45Å; V180-I279 HydrophobicContact CG2-CG2 3.67Å; I261-I279 HydrophobicContact CD1-CB 4.35Å; I261-I279 HydrophobicContact CD1-CG2 3.98Å; V275-I279 HydrophobicContact CG1-CD1 3.95Å; V275-I279 WeakPolarHBondContact O-CG1 3.09Å; V275-I279 PolarHBondContact O-N 2.91Å; C276-I279 PolarHBondContact O-N 3.44Å; I279-G281 VanDerWaalsContact C-N 3.34Å; I279-G281 PolarHBondContact O-N 2.86Å; I279-Y282 WeakPolarHBondContact O-CB 3.43Å; I279-Y282 PolarHBondContact O-N 2.82Å; I279-L283 HydrophobicContact CG2-CD1 4.11Å; I279-L283 HydrophobicContact CG2-CG 4.41Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 3.03Å
280	R	98.3	Very high	95.9	Very high	17 Å²	17	37.4 Å²	37.4	6%	0.064	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-44.4	174.2	-74.6	-178.1	-165.3	105.1	-1.7	112.4	I261 C276 R277 Y282 L283 Q284 F297 M302 S304	I261-R280 HydrophobicContact CD1-CG 3.76Å; C276-R280 WeakPolarHBondContact O-CG 3.38Å; C276-R280 PolarHBondContact O-N 3.12Å; R277-R280 PolarHBondContact O-N 2.81Å; R280-Y282 VanDerWaalsContact C-N 3.33Å; R280-Y282 PolarHBondContact O-N 3.08Å; R280-L283 PolarHBondContact O-N 2.8Å; R280-Q284 PolarHBondContact O-N 3.49Å; R280-F297 HydrophobicContact CB-CB 4.14Å; R280-F297 WeakPolarHBondContact CB-O 3.46Å; R280-F297 VanDerWaalsContact CD-O 3.25Å; R280-F297 WeakPolarHBondContact CD-O 3.29Å; R280-F297 HydrophobicContact CG-CB 4.29Å; R280-M302 PolarHBondContact NE-O 2.81Å; R280-M302 PolarHBondContact NH2-O 3.49Å; R280-S304 PolarHBondContact NH2-OG 2.86Å
281	G	97.6	Very high	96.8	Very high	12 Å²	12	39.1 Å²	39.1	12%	0.124	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-40.6	175.9	0	0	0	0	0	112.7	R277 L278 I279 Q284 V285	R277-G281 PolarHBondContact O-N 3.07Å; L278-G281 PolarHBondContact O-N 2.85Å; I279-G281 VanDerWaalsContact C-N 3.34Å; I279-G281 PolarHBondContact O-N 2.86Å; G281-Q284 PolarHBondContact O-N 3.49Å; G281-V285 PolarHBondContact O-N 2.98Å
282	Y	98.5	Very high	97.2	Very high	3 Å²	3	43.7 Å²	43.7	1%	0.012	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-49.2	172.8	166	-100.4	0	0	0	112.1	F118 F122 L126 H147 V150 T154 I159 L278 I279 R280 Q284 V285 E286	F118-Y282 HydrophobicContact CZ-CE1 4.06Å; F122-Y282 HydrophobicContact CE2-CD1 4.42Å; F122-Y282 HydrophobicContact CE2-CD2 4.09Å; F122-Y282 HydrophobicContact CE2-CE1 4.12Å; F122-Y282 AromaticContact CE2-CE2 3.79Å; F122-Y282 HydrophobicContact CE2-CE2 3.79Å; F122-Y282 HydrophobicContact CE2-CG 4.4Å; F122-Y282 AromaticContact CE2-CZ 3.81Å; F122-Y282 AromaticContact CZ-CD1 3.72Å; F122-Y282 HydrophobicContact CZ-CD1 3.72Å; F122-Y282 HydrophobicContact CZ-CD2 4.04Å; F122-Y282 AromaticContact CZ-CE1 3.71Å; F122-Y282 HydrophobicContact CZ-CE1 3.71Å; F122-Y282 HydrophobicContact CZ-CE2 4.05Å; F122-Y282 AromaticContact CZ-CG 3.88Å; F122-Y282 HydrophobicContact CZ-CG 3.88Å; F122-Y282 AromaticContact CZ-CZ 3.89Å; L126-Y282 HydrophobicContact CD1-CD2 4.26Å; L126-Y282 HydrophobicContact CD1-CG 4.42Å; H147-Y282 AromaticContact CD2-CD2 3.7Å; H147-Y282 AromaticContact CD2-CE2 3.71Å; V150-Y282 HydrophobicContact CG2-CD2 3.87Å; V150-Y282 HydrophobicContact CG2-CE2 3.89Å; T154-Y282 WeakPolarHBondContact CG2-OH 3.44Å; I159-Y282 HydrophobicContact CD1-CE1 3.77Å; L278-Y282 PolarHBondContact O-N 3.21Å; I279-Y282 WeakPolarHBondContact O-CB 3.43Å; I279-Y282 PolarHBondContact O-N 2.82Å; R280-Y282 VanDerWaalsContact C-N 3.33Å; R280-Y282 PolarHBondContact O-N 3.08Å; Y282-Q284 VanDerWaalsContact C-N 3.27Å; Y282-Q284 PolarHBondContact O-N 2.96Å; Y282-V285 PolarHBondContact O-N 3.39Å; Y282-E286 HydrophobicContact CE1-CB 4.47Å; Y282-E286 HydrophobicContact CE2-CB 4.37Å; Y282-E286 WeakPolarHBondContact O-CB 3.21Å; Y282-E286 PolarHBondContact O-N 2.76Å
283	L	98.5	Very high	97.3	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-36.5	179.9	-67.7	172.1	0	0	0	112.1	I159 F160 L165 V180 P183 I279 R280 W287 F297 M302	I159-L283 HydrophobicContact CD1-CD2 3.95Å; F160-L283 HydrophobicContact CE1-CD2 4.1Å; F160-L283 HydrophobicContact CZ-CD2 4.43Å; F160-L283 WeakPolarHBondContact CZ-O 3.5Å; L165-L283 HydrophobicContact CD1-CD2 4.23Å; V180-L283 HydrophobicContact CG1-CD1 3.87Å; P183-L283 HydrophobicContact CB-CD2 4.46Å; I279-L283 HydrophobicContact CG2-CD1 4.11Å; I279-L283 HydrophobicContact CG2-CG 4.41Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 3.03Å; R280-L283 PolarHBondContact O-N 2.8Å; L283-W287 WeakPolarHBondContact O-CB 3.42Å; L283-W287 PolarHBondContact O-N 2.94Å; L283-F297 HydrophobicContact CB-CD1 4.36Å; L283-F297 HydrophobicContact CB-CD2 3.97Å; L283-F297 HydrophobicContact CB-CE1 4.47Å; L283-F297 HydrophobicContact CB-CE2 4.09Å; L283-F297 HydrophobicContact CB-CG 4.1Å; L283-F297 HydrophobicContact CB-CZ 4.33Å; L283-F297 HydrophobicContact CD1-CD1 4.45Å; L283-M302 HydrophobicContact CD1-CE 4.08Å; L283-M302 HydrophobicContact CD1-SD 3.63Å
284	Q	97.8	Very high	97.3	Very high	47 Å²	47	48.3 Å²	48.3	22%	0.22	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-47.9	176.8	178.9	166.7	-27.8	0	0	112.1	R280 G281 Y282 W287 E288 F297	R280-Q284 PolarHBondContact O-N 3.49Å; G281-Q284 PolarHBondContact O-N 3.49Å; Y282-Q284 VanDerWaalsContact C-N 3.27Å; Y282-Q284 PolarHBondContact O-N 2.96Å; Q284-W287 PolarHBondContact O-N 3.32Å; Q284-E288 PolarHBondContact O-N 3.28Å; Q284-E288 VanDerWaalsContact O-N 3.14Å; Q284-F297 HydrophobicContact CB-CD2 4.11Å
285	V	98	Very high	97.4	Very high	3 Å²	3	46 Å²	46	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-43.1	178.7	-175.2	0	0	0	0	111.2	H143 H147 G281 Y282 W287 E288 V289	H143-V285 HydrophobicContact CB-CG2 4.26Å; H143-V285 WeakPolarHBondContact CD2-CG2 3.29Å; H147-V285 HydrophobicContact CB-CB 3.89Å; H147-V285 HydrophobicContact CB-CG1 3.69Å; H147-V285 HydrophobicContact CB-CG2 4.21Å; G281-V285 PolarHBondContact O-N 2.98Å; Y282-V285 PolarHBondContact O-N 3.39Å; V285-W287 VanDerWaalsContact C-N 3.26Å; V285-W287 PolarHBondContact O-N 3.39Å; V285-E288 PolarHBondContact O-N 3.44Å; V285-V289 HydrophobicContact CG1-CG2 4.33Å; V285-V289 VanDerWaalsContact O-CG2 3.3Å; V285-V289 WeakPolarHBondContact O-CG2 3.35Å; V285-V289 PolarHBondContact O-N 3.01Å
286	E	98.4	Very high	97.3	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-36.3	178.6	-172.1	63.1	-164.7	0	0	111	H147 T154 I159 F160 Y282 V289 R290	H147-E286 IonicContact CD2-OE2 2.86Å; H147-E286 IonicContact CE1-OE2 3.22Å; H147-E286 IonicContact NE2-OE2 3.51Å; H147-E286 PolarHBondContact NE2-OE2 3.22Å; T154-E286 WeakPolarHBondContact CB-OE1 3.43Å; T154-E286 PolarHBondContact OG1-OE1 2.92Å; T154-E286 PolarHBondContact OG1-OE2 2.8Å; I159-E286 HydrophobicContact CD1-CB 4.48Å; I159-E286 HydrophobicContact CD1-CG 3.8Å; I159-E286 HydrophobicContact CG1-CG 4.11Å; F160-E286 HydrophobicContact CE2-CB 4.17Å; F160-E286 HydrophobicContact CE2-CG 3.87Å; F160-E286 HydrophobicContact CZ-CB 4.11Å; F160-E286 HydrophobicContact CZ-CG 4.22Å; Y282-E286 HydrophobicContact CE1-CB 4.47Å; Y282-E286 HydrophobicContact CE2-CB 4.37Å; Y282-E286 WeakPolarHBondContact O-CB 3.21Å; Y282-E286 PolarHBondContact O-N 2.76Å; E286-V289 PolarHBondContact O-N 2.86Å; E286-R290 HydrophobicContact CG-CG 4.29Å; E286-R290 WeakPolarHBondContact O-CB 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.3Å; E286-R290 PolarHBondContact O-N 2.69Å; E286-R290 IonicContact OE1-CZ 2.81Å; E286-R290 IonicContact OE1-NE 3.11Å; E286-R290 PolarHBondContact OE1-NE 3.23Å; E286-R290 IonicContact OE1-NH2 2.66Å; E286-R290 PolarHBondContact OE1-NH2 2.66Å
287	W	98.1	Very high	97.2	Very high	24 Å²	24	51.9 Å²	51.9	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-48.9	174.4	-179.4	-81	0	0	0	111.1	F160 L283 Q284 V285 V289 R290 R291 T293 R295 F297	F160-W287 HydrophobicContact CB-CE3 4.34Å; F160-W287 HydrophobicContact CB-CZ3 4.15Å; F160-W287 AromaticContact CD1-CE3 3.49Å; F160-W287 HydrophobicContact CD1-CE3 3.49Å; F160-W287 VanDerWaalsContact CD1-CE3 3.49Å; F160-W287 AromaticContact CD1-CZ3 3.89Å; F160-W287 HydrophobicContact CD1-CZ3 3.89Å; F160-W287 HydrophobicContact CD2-CE3 4.02Å; F160-W287 HydrophobicContact CE1-CB 4.22Å; F160-W287 AromaticContact CE1-CE3 3.69Å; F160-W287 HydrophobicContact CE1-CE3 3.69Å; F160-W287 HydrophobicContact CE2-CB 3.97Å; F160-W287 HydrophobicContact CE2-CE3 4.19Å; F160-W287 AromaticContact CG-CE3 3.67Å; F160-W287 HydrophobicContact CG-CE3 3.67Å; F160-W287 AromaticContact CG-CZ3 3.96Å; F160-W287 HydrophobicContact CG-CZ3 3.96Å; F160-W287 HydrophobicContact CZ-CB 3.63Å; F160-W287 HydrophobicContact CZ-CE3 4.05Å; F160-W287 VanDerWaalsContact CZ-N 3.33Å; L283-W287 WeakPolarHBondContact O-CB 3.42Å; L283-W287 PolarHBondContact O-N 2.94Å; Q284-W287 PolarHBondContact O-N 3.32Å; V285-W287 VanDerWaalsContact C-N 3.26Å; V285-W287 PolarHBondContact O-N 3.39Å; W287-V289 VanDerWaalsContact C-N 3.3Å; W287-V289 PolarHBondContact O-N 2.82Å; W287-R290 PolarHBondContact O-N 3.31Å; W287-R291 HydrophobicContact CD2-CB 4.28Å; W287-R291 HydrophobicContact CD2-CG 3.78Å; W287-R291 HydrophobicContact CE3-CG 4.1Å; W287-R291 HydrophobicContact CG-CB 4.42Å; W287-R291 HydrophobicContact CG-CG 4.27Å; W287-R291 HydrophobicContact CH2-CG 4.21Å; W287-R291 HydrophobicContact CZ2-CB 4.33Å; W287-R291 HydrophobicContact CZ2-CG 3.89Å; W287-R291 HydrophobicContact CZ3-CG 4.3Å; W287-R291 WeakPolarHBondContact O-CA 3.18Å; W287-R291 VanDerWaalsContact O-CB 3.31Å; W287-R291 WeakPolarHBondContact O-CB 3.45Å; W287-R291 PolarHBondContact O-N 2.6Å; W287-T293 PolarHBondContact NE1-OG1 2.96Å; W287-R295 HydrophobicContact CD2-CB 3.9Å; W287-R295 HydrophobicContact CD2-CG 4.4Å; W287-R295 HydrophobicContact CG-CB 3.71Å; W287-R295 VanDerWaalsContact CH2-NH1 3.29Å; W287-R295 HydrophobicContact CZ2-CB 4.46Å; W287-F297 HydrophobicContact CB-CE2 3.89Å; W287-F297 HydrophobicContact CB-CZ 4.46Å; W287-F297 HydrophobicContact CD2-CZ 4.46Å; W287-F297 HydrophobicContact CE3-CZ 4.08Å; W287-F297 HydrophobicContact CG-CE2 4.27Å
288	E	97.3	Very high	97.1	Very high	69 Å²	69	47.3 Å²	47.3	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-57.5	-44.8	176.6	-175.5	-179.8	161.8	0	0	111.6	H144 Q284 V285 R290 K292 T293 L294	H144-E288 IonicContact NE2-OE2 3.68Å; Q284-E288 PolarHBondContact O-N 3.28Å; Q284-E288 VanDerWaalsContact O-N 3.14Å; V285-E288 PolarHBondContact O-N 3.44Å; E288-R290 PolarHBondContact O-N 3.09Å; E288-K292 VanDerWaalsContact O-CA 3.23Å; E288-K292 WeakPolarHBondContact O-CA 3.33Å; E288-K292 PolarHBondContact O-N 2.82Å; E288-T293 WeakPolarHBondContact CA-O 3.11Å; E288-L294 HydrophobicContact CG-CD2 4.08Å
289	V	96.6	Very high	97	Very high	61 Å²	61	50.9 Å²	50.9	37%	0.37	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-43.5	177.9	170.1	0	0	0	0	111.7	V285 E286 W287 K292	V285-V289 HydrophobicContact CG1-CG2 4.33Å; V285-V289 VanDerWaalsContact O-CG2 3.3Å; V285-V289 WeakPolarHBondContact O-CG2 3.35Å; V285-V289 PolarHBondContact O-N 3.01Å; E286-V289 PolarHBondContact O-N 2.86Å; W287-V289 VanDerWaalsContact C-N 3.3Å; W287-V289 PolarHBondContact O-N 2.82Å; V289-K292 WeakPolarHBondContact O-CE 3.38Å; V289-K292 PolarHBondContact O-NZ 3.16Å
290	R	97	Very high	96.7	Very high	79 Å²	79	55.5 Å²	55.5	30%	0.298	30%	0.295	S	S	.	.	H	α-helix	trans	-85.4	-39.2	-173.3	-67.7	-71.2	171.8	179.3	-5.9	114.4	T154 R155 F160 E286 W287 E288	T154-R290 PolarHBondContact O-NH2 3.34Å; T154-R290 PolarHBondContact OG1-NH2 2.81Å; R155-R290 PolarHBondContact O-NH1 2.81Å; F160-R290 HydrophobicContact CD2-CB 4.38Å; F160-R290 HydrophobicContact CD2-CG 4.49Å; F160-R290 HydrophobicContact CE2-CB 4.42Å; F160-R290 HydrophobicContact CE2-CG 4.37Å; E286-R290 HydrophobicContact CG-CG 4.29Å; E286-R290 WeakPolarHBondContact O-CB 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.3Å; E286-R290 PolarHBondContact O-N 2.69Å; E286-R290 IonicContact OE1-CZ 2.81Å; E286-R290 IonicContact OE1-NE 3.11Å; E286-R290 PolarHBondContact OE1-NE 3.23Å; E286-R290 IonicContact OE1-NH2 2.66Å; E286-R290 PolarHBondContact OE1-NH2 2.66Å; W287-R290 PolarHBondContact O-N 3.31Å; E288-R290 PolarHBondContact O-N 3.09Å
291	R	97.1	Very high	96.5	Very high	90 Å²	90	57.4 Å²	57.4	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-103.3	-10.9	-172.7	-60.8	-66.5	-174.2	-104	3.6	113	D158 W287 T293	D158-R291 IonicContact OD1-CZ 3.51Å; D158-R291 IonicContact OD1-NH1 3.74Å; D158-R291 PolarHBondContact OD1-NH1 3.31Å; D158-R291 IonicContact OD1-NH2 2.92Å; D158-R291 PolarHBondContact OD1-NH2 3.44Å; D158-R291 IonicContact OD2-CZ 3.42Å; D158-R291 VanDerWaalsContact OD2-CZ 3.23Å; D158-R291 IonicContact OD2-NH1 2.67Å; D158-R291 PolarHBondContact OD2-NH1 3.04Å; D158-R291 IonicContact OD2-NH2 3.25Å; D158-R291 PolarHBondContact OD2-NH2 3.45Å; W287-R291 HydrophobicContact CD2-CB 4.28Å; W287-R291 HydrophobicContact CD2-CG 3.78Å; W287-R291 HydrophobicContact CE3-CG 4.1Å; W287-R291 HydrophobicContact CG-CB 4.42Å; W287-R291 HydrophobicContact CG-CG 4.27Å; W287-R291 HydrophobicContact CH2-CG 4.21Å; W287-R291 HydrophobicContact CZ2-CB 4.33Å; W287-R291 HydrophobicContact CZ2-CG 3.89Å; W287-R291 HydrophobicContact CZ3-CG 4.3Å; W287-R291 WeakPolarHBondContact O-CA 3.18Å; W287-R291 VanDerWaalsContact O-CB 3.31Å; W287-R291 WeakPolarHBondContact O-CB 3.45Å; W287-R291 PolarHBondContact O-N 2.6Å; R291-T293 WeakPolarHBondContact CB-OG1 3.39Å; R291-T293 PolarHBondContact O-N 3.14Å; R291-T293 VanDerWaalsContact O-N 3.13Å
292	K	96.8	Very high	96.4	Very high	167 Å²	167	56.8 Å²	56.8	73%	0.726	31%	0.305	S	S	*	.	S	Bend	trans	55.6	26.5	-176.9	-51.2	-53.7	-173.2	-165.1	0	113.2	E288 V289	E288-K292 VanDerWaalsContact O-CA 3.23Å; E288-K292 WeakPolarHBondContact O-CA 3.33Å; E288-K292 PolarHBondContact O-N 2.82Å; V289-K292 WeakPolarHBondContact O-CE 3.38Å; V289-K292 PolarHBondContact O-NZ 3.16Å
293	T	97	Very high	96.3	Very high	73 Å²	73	63.8 Å²	63.8	45%	0.448	33%	0.331	S	S	.	.	S	Bend	trans	-133.8	159.1	178.8	54.3	0	0	0	0	109.2	W287 E288 R291	W287-T293 PolarHBondContact NE1-OG1 2.96Å; E288-T293 WeakPolarHBondContact CA-O 3.11Å; R291-T293 WeakPolarHBondContact CB-OG1 3.39Å; R291-T293 PolarHBondContact O-N 3.14Å; R291-T293 VanDerWaalsContact O-N 3.13Å
294	L	94.6	Very high	96.2	Very high	144 Å²	144	65.5 Å²	65.5	75%	0.754	34%	0.343	S	S	*	.			trans	-90.6	132.2	176.6	-60.8	178.4	0	0	0	110	E288	E288-L294 HydrophobicContact CG-CD2 4.08Å
295	R	95.5	Very high	96.1	Very high	36 Å²	36	64.1 Å²	64.1	14%	0.136	34%	0.338	C	S	.	.			trans	-137.2	123.1	171.2	-179.5	174.8	171.8	175	-1.8	110.3	P183 G184 L185 W287 F297	P183-R295 PolarHBondContact O-NH1 3.49Å; G184-R295 PolarHBondContact O-NH1 2.81Å; L185-R295 PolarHBondContact O-NH2 3.41Å; W287-R295 HydrophobicContact CD2-CB 3.9Å; W287-R295 HydrophobicContact CD2-CG 4.4Å; W287-R295 HydrophobicContact CG-CB 3.71Å; W287-R295 VanDerWaalsContact CH2-NH1 3.29Å; W287-R295 HydrophobicContact CZ2-CB 4.46Å; R295-F297 HydrophobicContact CB-CE2 4.13Å; R295-F297 HydrophobicContact CG-CD2 4.36Å; R295-F297 HydrophobicContact CG-CE2 3.85Å; R295-F297 HydrophobicContact CG-CZ 4.03Å; R295-F297 WeakPolarHBondContact O-CD2 3.32Å
296	L	94.6	Very high	95.9	Very high	116 Å²	116	67.4 Å²	67.4	61%	0.607	36%	0.358	S	S	*	.			trans	-85.5	115.8	178.8	-176.6	63.9	0	0	0	110.9	A298 S301	L296-A298 HydrophobicContact CD2-CB 4.18Å; L296-A298 HydrophobicContact CG-CB 4.06Å; L296-A298 PolarHBondContact O-N 3.19Å; L296-S301 PolarHBondContact O-OG 3.39Å
297	F	96.1	Very high	95.9	Very high	8 Å²	8	67.3 Å²	67.3	4%	0.035	36%	0.358	C	S	.	.			trans	-93.8	81.8	169.8	-65.9	-89.2	0	0	0	109	F160 R280 L283 Q284 W287 R295 M302	F160-F297 HydrophobicContact CE1-CE2 4.45Å; F160-F297 AromaticContact CE1-CZ 3.89Å; F160-F297 HydrophobicContact CE1-CZ 3.89Å; R280-F297 HydrophobicContact CB-CB 4.14Å; R280-F297 WeakPolarHBondContact CB-O 3.46Å; R280-F297 VanDerWaalsContact CD-O 3.25Å; R280-F297 WeakPolarHBondContact CD-O 3.29Å; R280-F297 HydrophobicContact CG-CB 4.29Å; L283-F297 HydrophobicContact CB-CD1 4.36Å; L283-F297 HydrophobicContact CB-CD2 3.97Å; L283-F297 HydrophobicContact CB-CE1 4.47Å; L283-F297 HydrophobicContact CB-CE2 4.09Å; L283-F297 HydrophobicContact CB-CG 4.1Å; L283-F297 HydrophobicContact CB-CZ 4.33Å; L283-F297 HydrophobicContact CD1-CD1 4.45Å; Q284-F297 HydrophobicContact CB-CD2 4.11Å; W287-F297 HydrophobicContact CB-CE2 3.89Å; W287-F297 HydrophobicContact CB-CZ 4.46Å; W287-F297 HydrophobicContact CD2-CZ 4.46Å; W287-F297 HydrophobicContact CE3-CZ 4.08Å; W287-F297 HydrophobicContact CG-CE2 4.27Å; R295-F297 HydrophobicContact CB-CE2 4.13Å; R295-F297 HydrophobicContact CG-CD2 4.36Å; R295-F297 HydrophobicContact CG-CE2 3.85Å; R295-F297 HydrophobicContact CG-CZ 4.03Å; R295-F297 WeakPolarHBondContact O-CD2 3.32Å; F297-M302 HydrophobicContact CD1-CB 4.43Å; F297-M302 HydrophobicContact CD1-CE 3.49Å; F297-M302 VanDerWaalsContact CD1-CE 3.49Å; F297-M302 HydrophobicContact CD1-SD 3.83Å; F297-M302 HydrophobicContact CE1-CE 3.6Å; F297-M302 HydrophobicContact CE1-SD 4.49Å
298	A	94.8	Very high	95.8	Very high	25 Å²	25	67.8 Å²	67.8	21%	0.207	37%	0.365	C	S	.	.			trans	-93.2	162.3	178	0	0	0	0	0	111.2	L296 A300 S301 M302	L296-A298 HydrophobicContact CD2-CB 4.18Å; L296-A298 HydrophobicContact CG-CB 4.06Å; L296-A298 PolarHBondContact O-N 3.19Å; A298-A300 PolarHBondContact O-N 3.31Å; A298-A300 VanDerWaalsContact O-N 3.11Å; A298-S301 PolarHBondContact N-OG 3.2Å; A298-S301 PolarHBondContact O-N 2.64Å; A298-S301 PolarHBondContact O-OG 3.07Å; A298-M302 PolarHBondContact O-N 2.72Å
299	P	95.2	Very high	95.8	Very high	88 Å²	88	64.6 Å²	64.6	57%	0.571	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.9	172.8	-27.4	36	0	0	0	114.2	R303	P299-R303 WeakPolarHBondContact O-CA 3.21Å
300	A	93	Very high	95.8	Very high	101 Å²	101	62.2 Å²	62.2	84%	0.835	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-38.7	175.9	0	0	0	0	0	113.2	A298	A298-A300 PolarHBondContact O-N 3.31Å; A298-A300 VanDerWaalsContact O-N 3.11Å
301	S	92.9	Very high	95.7	Very high	56 Å²	56	61.5 Å²	61.5	39%	0.392	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-27.2	-178.6	58.7	0	0	0	0	113.4	P259 L296 A298	P259-S301 WeakPolarHBondContact CG-O 3.47Å; L296-S301 PolarHBondContact O-OG 3.39Å; A298-S301 PolarHBondContact N-OG 3.2Å; A298-S301 PolarHBondContact O-N 2.64Å; A298-S301 PolarHBondContact O-OG 3.07Å
302	M	96.7	Very high	95.6	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	-136.7	85.3	176.2	-175.8	177.3	-85.2	0	0	109.6	V180 P183 P259 I261 R280 L283 F297 A298	V180-M302 HydrophobicContact CG1-CE 4.29Å; V180-M302 HydrophobicContact CG1-SD 4.32Å; P183-M302 HydrophobicContact CB-CE 4.43Å; P259-M302 HydrophobicContact CB-CE 3.74Å; P259-M302 HydrophobicContact CB-CG 4.47Å; I261-M302 HydrophobicContact CD1-CG 4.45Å; I261-M302 HydrophobicContact CD1-SD 4.13Å; I261-M302 HydrophobicContact CG1-CG 4.04Å; I261-M302 HydrophobicContact CG1-SD 3.9Å; R280-M302 PolarHBondContact NE-O 2.81Å; R280-M302 PolarHBondContact NH2-O 3.49Å; L283-M302 HydrophobicContact CD1-CE 4.08Å; L283-M302 HydrophobicContact CD1-SD 3.63Å; F297-M302 HydrophobicContact CD1-CB 4.43Å; F297-M302 HydrophobicContact CD1-CE 3.49Å; F297-M302 VanDerWaalsContact CD1-CE 3.49Å; F297-M302 HydrophobicContact CD1-SD 3.83Å; F297-M302 HydrophobicContact CE1-CE 3.6Å; F297-M302 HydrophobicContact CE1-SD 4.49Å; A298-M302 PolarHBondContact O-N 2.72Å
303	R	95.8	Very high	95.4	Very high	150 Å²	150	53.6 Å²	53.6	57%	0.566	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	139.8	-177.2	-172.2	179.1	-67	-173.9	0.7	110.9	C260 I261 P299	C260-R303 CarbonylContact C-O 3.17Å; C260-R303 VanDerWaalsContact CA-O 3.29Å; C260-R303 WeakPolarHBondContact CA-O 3.39Å; C260-R303 VanDerWaalsContact CB-O 3.27Å; C260-R303 WeakPolarHBondContact CB-O 3.11Å; I261-R303 PolarHBondContact N-O 2.85Å; P299-R303 WeakPolarHBondContact O-CA 3.21Å
304	S	96.4	Very high	95.2	Very high	37 Å²	37	52.5 Å²	52.5	26%	0.259	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	139.1	167.7	38.9	0	0	0	0	110	I261 C276 R280	I261-S304 CarbonylContact O-C 3.5Å; I261-S304 WeakPolarHBondContact O-CA 3.13Å; C276-S304 VanDerWaalsContact SG-CB 3.51Å; R280-S304 PolarHBondContact NH2-OG 2.86Å
305	C	95.2	Very high	95.1	Very high	17 Å²	17	47 Å²	47	12%	0.115	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	114	178	-171.9	0	0	0	0	109.8	I261 L262 V263 C307	I261-C305 PolarHBondContact O-N 3.45Å; L262-C305 WeakPolarHBondContact CA-O 3.36Å; L262-C305 HydrophobicContact CD2-CB 4.05Å; V263-C305 PolarHBondContact N-O 3.04Å; C305-C307 PolarHBondContact O-N 3.38Å
306	T	95.7	Very high	95	Very high	72 Å²	72	45.6 Å²	45.6	44%	0.442	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	112.8	165.8	-52.7	0	0	0	0	108.3
307	C	96.5	Very high	95.2	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.249	C	C	.	.			trans	-76.9	146.4	-176.7	-62.1	0	0	0	0	110.2	V263 M264 C305 V309 L343	V263-C307 PolarHBondContact O-N 3.27Å; M264-C307 HydrophobicContact CG-CB 4.21Å; C305-C307 PolarHBondContact O-N 3.38Å; C307-V309 HydrophobicContact CB-CG1 3.78Å; C307-V309 PolarHBondContact O-N 3.42Å; C307-L343 HydrophobicContact CB-CD1 4.08Å
308	S	96.3	Very high	95.2	Very high	34 Å²	34	40.6 Å²	40.6	24%	0.238	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-86.1	104.7	169.9	-56	0	0	0	0	108.1	L341 L343 E344	S308-L341 PolarHBondContact N-O 2.98Å; S308-L343 CarbonylContact O-C 3.55Å; S308-L343 WeakPolarHBondContact O-CA 3.48Å; S308-L343 WeakPolarHBondContact O-CB 3.42Å; S308-L343 PolarHBondContact O-N 3.44Å; S308-E344 WeakPolarHBondContact CB-OE1 3.41Å; S308-E344 PolarHBondContact O-N 3.42Å
309	V	97.2	Very high	95.4	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.018	24%	0.238	C	C	.	.			trans	-120.2	164.2	-171.6	-65.7	0	0	0	0	110.8	M264 D265 C307 Q311 F325 L343	M264-V309 HydrophobicContact CB-CG1 4.05Å; M264-V309 HydrophobicContact CG-CG1 3.94Å; D265-V309 WeakPolarHBondContact O-CG2 3.46Å; C307-V309 HydrophobicContact CB-CG1 3.78Å; C307-V309 PolarHBondContact O-N 3.42Å; V309-Q311 PolarHBondContact O-N 2.82Å; V309-Q311 PolarHBondContact O-NE2 3.06Å; V309-F325 HydrophobicContact CB-CD1 4.33Å; V309-F325 HydrophobicContact CB-CE1 3.67Å; V309-F325 HydrophobicContact CB-CZ 3.91Å; V309-F325 HydrophobicContact CG1-CE1 4.36Å; V309-F325 HydrophobicContact CG2-CE1 3.84Å; V309-F325 HydrophobicContact CG2-CE2 4.16Å; V309-F325 HydrophobicContact CG2-CZ 3.51Å; V309-L343 HydrophobicContact CG1-CB 4.14Å; V309-L343 HydrophobicContact CG1-CD1 4.37Å
310	P	96.9	Very high	95.6	Very high	10 Å²	10	35.2 Å²	35.2	7%	0.065	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-50.5	125.2	170.2	-26.8	34.3	0	0	0	110.7	Y321 L343 E344 F347	P310-Y321 HydrophobicContact CB-CE1 4.16Å; P310-Y321 WeakPolarHBondContact O-CD1 3.4Å; P310-L343 WeakPolarHBondContact CD-O 3.38Å; P310-E344 WeakPolarHBondContact CG-O 3.42Å; P310-F347 HydrophobicContact CB-CD2 4.35Å; P310-F347 HydrophobicContact CB-CE1 4.48Å; P310-F347 HydrophobicContact CB-CE2 3.72Å; P310-F347 HydrophobicContact CB-CZ 3.82Å; P310-F347 HydrophobicContact CG-CD1 4.17Å; P310-F347 HydrophobicContact CG-CD2 4.18Å; P310-F347 HydrophobicContact CG-CE1 3.86Å; P310-F347 HydrophobicContact CG-CE2 3.86Å; P310-F347 HydrophobicContact CG-CG 4.34Å; P310-F347 HydrophobicContact CG-CZ 3.71Å
311	Q	96.4	Very high	95.8	Very high	64 Å²	64	30.5 Å²	30.5	30%	0.299	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-93.6	144.5	179.9	-58.6	-64.1	-76	0	0	109.8	D265 S266 V309	D265-Q311 PolarHBondContact O-NE2 2.88Å; S266-Q311 WeakPolarHBondContact O-CA 3.43Å; S266-Q311 PolarHBondContact O-OE1 2.88Å; S266-Q311 VanDerWaalsContact O-OE1 3.1Å; V309-Q311 PolarHBondContact O-N 2.82Å; V309-Q311 PolarHBondContact O-NE2 3.06Å
312	Q	94.7	Very high	96.1	Very high	17 Å²	17	27.9 Å²	27.9	8%	0.079	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-77.1	157.1	177.1	72.9	-171.4	48.3	0	0	111.5	S266 L267 N314 Y321	S266-Q312 PolarHBondContact O-N 2.91Å; S266-Q312 PolarHBondContact OG-OE1 2.88Å; L267-Q312 VanDerWaalsContact CD1-NE2 3.3Å; L267-Q312 HydrophobicContact CD2-CG 3.36Å; L267-Q312 VanDerWaalsContact CG-CD 3.44Å; L267-Q312 HydrophobicContact CG-CG 3.73Å; L267-Q312 VanDerWaalsContact CG-NE2 3.32Å; Q312-N314 WeakPolarHBondContact CG-O 3.38Å; Q312-N314 PolarHBondContact NE2-O 2.91Å; Q312-Y321 HydrophobicContact CB-CD2 3.66Å; Q312-Y321 HydrophobicContact CB-CE1 4.28Å; Q312-Y321 HydrophobicContact CB-CE2 3.34Å; Q312-Y321 HydrophobicContact CB-CG 4.25Å
313	D	91.6	Very high	96.2	Very high	75 Å²	75	27.9 Å²	27.9	40%	0.401	15%	0.153	S	C	.	.	S	Bend	trans	-114.4	7.8	-179.7	56.2	1.2	0	0	0	113.1	R349 R353	D313-R349 IonicContact OD2-NH1 3.62Å; D313-R353 IonicContact OD2-CZ 3.85Å; D313-R353 IonicContact OD2-NH2 2.82Å; D313-R353 PolarHBondContact OD2-NH2 2.75Å
314	N	93.3	Very high	96.3	Very high	49 Å²	49	21 Å²	21	26%	0.262	13%	0.127	S	C	.	.	S	Bend	trans	-137.2	174.2	179.5	66.2	71.8	0	0	0	112.1	Q312 S316 D317	Q312-N314 WeakPolarHBondContact CG-O 3.38Å; Q312-N314 PolarHBondContact NE2-O 2.91Å; N314-S316 PolarHBondContact OD1-N 2.71Å; N314-D317 PolarHBondContact ND2-OD2 2.85Å; N314-D317 WeakPolarHBondContact OD1-CB 3.4Å; N314-D317 VanDerWaalsContact OD1-CG 3.26Å; N314-D317 PolarHBondContact OD1-N 2.8Å; N314-D317 PolarHBondContact OD1-OD2 2.97Å
315	G	92.1	Very high	96.4	Very high	29 Å²	29	19.2 Å²	19.2	30%	0.299	12%	0.115	S	C	.	.	S	Bend	trans	-85	-18.1	-173	0	0	0	0	0	116.6
316	S	94.5	Very high	96.6	Very high	7 Å²	7	18.5 Å²	18.5	5%	0.049	11%	0.11	C	C	.	.	S	Bend	trans	-121.5	-9.6	-166.4	53.2	0	0	0	0	115.6	G87 N314 C318	G87-S316 VanDerWaalsContact C-OG 3.24Å; G87-S316 WeakPolarHBondContact CA-OG 3.24Å; G87-S316 WeakPolarHBondContact O-CB 3.07Å; G87-S316 PolarHBondContact O-OG 2.65Å; N314-S316 PolarHBondContact OD1-N 2.71Å; S316-C318 VanDerWaalsContact C-N 3.27Å; S316-C318 PolarHBondContact O-N 3.09Å
317	D	97.1	Very high	96.7	Very high	18 Å²	18	16 Å²	16	10%	0.096	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	11.7	-177.1	-76	-18.5	0	0	0	115	N314 G319 V320 Y321 R356	N314-D317 PolarHBondContact ND2-OD2 2.85Å; N314-D317 WeakPolarHBondContact OD1-CB 3.4Å; N314-D317 VanDerWaalsContact OD1-CG 3.26Å; N314-D317 PolarHBondContact OD1-N 2.8Å; N314-D317 PolarHBondContact OD1-OD2 2.97Å; D317-G319 PolarHBondContact O-N 3.34Å; D317-V320 HydrophobicContact CB-CB 4.04Å; D317-V320 HydrophobicContact CB-CG2 4.41Å; D317-V320 WeakPolarHBondContact O-CA 3.4Å; D317-V320 WeakPolarHBondContact O-CB 3.41Å; D317-V320 PolarHBondContact O-N 2.87Å; D317-Y321 HydrophobicContact CB-CD2 4.04Å; D317-Y321 HydrophobicContact CB-CE2 4.17Å; D317-Y321 WeakPolarHBondContact O-CD2 3.41Å; D317-Y321 PolarHBondContact O-N 3.11Å; D317-R356 IonicContact OD1-CZ 3.55Å; D317-R356 VanDerWaalsContact OD1-CZ 3.26Å; D317-R356 IonicContact OD1-NE 3Å; D317-R356 PolarHBondContact OD1-NE 2.97Å; D317-R356 IonicContact OD1-NH2 3.63Å; D317-R356 PolarHBondContact OD1-NH2 3.47Å
318	C	97.7	Very high	96.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-56.9	-37.9	179.5	59.1	0	0	0	0	112.6	H174 W175 S316 Y321 L322	H174-C318 WeakPolarHBondContact ND1-CB 3.29Å; W175-C318 HydrophobicContact CB-CB 4.2Å; W175-C318 PolarHBondContact N-SG 2.94Å; S316-C318 VanDerWaalsContact C-N 3.27Å; S316-C318 PolarHBondContact O-N 3.09Å; C318-Y321 PolarHBondContact O-N 3.43Å; C318-L322 WeakPolarHBondContact O-CB 3.43Å; C318-L322 PolarHBondContact O-N 3.37Å
319	G	98.4	Very high	96.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.2	-37.9	173	0	0	0	0	0	113	D317 L322 L323	D317-G319 PolarHBondContact O-N 3.34Å; G319-L322 WeakPolarHBondContact O-CB 3.42Å; G319-L322 PolarHBondContact O-N 2.99Å; G319-L323 WeakPolarHBondContact O-CG 3.33Å; G319-L323 PolarHBondContact O-N 3.28Å; G319-L323 VanDerWaalsContact O-N 3.11Å
320	V	98.6	Very high	96.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.7	-44.8	176.1	168.5	0	0	0	0	110.8	L90 D317 L323 Q324 A352 K355 R356	L90-V320 HydrophobicContact CD1-CG2 3.87Å; L90-V320 HydrophobicContact CD2-CG2 4.38Å; L90-V320 HydrophobicContact CG-CG2 4.16Å; D317-V320 HydrophobicContact CB-CB 4.04Å; D317-V320 HydrophobicContact CB-CG2 4.41Å; D317-V320 WeakPolarHBondContact O-CA 3.4Å; D317-V320 WeakPolarHBondContact O-CB 3.41Å; D317-V320 PolarHBondContact O-N 2.87Å; V320-L323 PolarHBondContact O-N 2.93Å; V320-Q324 WeakPolarHBondContact O-CB 3.36Å; V320-Q324 PolarHBondContact O-N 3.31Å; V320-A352 HydrophobicContact CG1-CB 4.3Å; V320-A352 VanDerWaalsContact CG1-O 3.22Å; V320-A352 WeakPolarHBondContact CG1-O 3.49Å; V320-K355 HydrophobicContact CG1-CB 3.61Å; V320-K355 HydrophobicContact CG1-CG 4.01Å; V320-R356 HydrophobicContact CG2-CG 3.78Å
321	Y	98.6	Very high	96.7	Very high	1 Å²	1	18.6 Å²	18.6	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-65.3	-40.3	176.5	-85.2	-101.9	0	0	0	111.7	P310 Q312 D317 C318 L323 Q324 F325 F347 A352	P310-Y321 HydrophobicContact CB-CE1 4.16Å; P310-Y321 WeakPolarHBondContact O-CD1 3.4Å; Q312-Y321 HydrophobicContact CB-CD2 3.66Å; Q312-Y321 HydrophobicContact CB-CE1 4.28Å; Q312-Y321 HydrophobicContact CB-CE2 3.34Å; Q312-Y321 HydrophobicContact CB-CG 4.25Å; D317-Y321 HydrophobicContact CB-CD2 4.04Å; D317-Y321 HydrophobicContact CB-CE2 4.17Å; D317-Y321 WeakPolarHBondContact O-CD2 3.41Å; D317-Y321 PolarHBondContact O-N 3.11Å; C318-Y321 PolarHBondContact O-N 3.43Å; Y321-L323 VanDerWaalsContact C-N 3.33Å; Y321-L323 PolarHBondContact O-N 2.92Å; Y321-Q324 PolarHBondContact O-N 3.44Å; Y321-F325 HydrophobicContact CD1-CE1 4.18Å; Y321-F325 AromaticContact CD1-CZ 3.92Å; Y321-F325 HydrophobicContact CD1-CZ 3.92Å; Y321-F325 HydrophobicContact CG-CZ 4.43Å; Y321-F325 WeakPolarHBondContact O-CD2 3.2Å; Y321-F325 WeakPolarHBondContact O-CG 3.39Å; Y321-F325 PolarHBondContact O-N 3.38Å; Y321-F347 HydrophobicContact CD1-CE2 4.19Å; Y321-F347 HydrophobicContact CD1-CZ 4.15Å; Y321-F347 HydrophobicContact CE1-CE2 4.07Å; Y321-F347 HydrophobicContact CE1-CZ 4.45Å; Y321-A352 HydrophobicContact CD2-CB 4.22Å; Y321-A352 HydrophobicContact CE1-CB 4.22Å; Y321-A352 HydrophobicContact CE2-CB 3.74Å
322	L	98.7	Very high	96.6	Very high	1 Å²	1	16 Å²	16	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-52.7	-50.7	172.5	-178.8	165.1	0	0	0	111.2	I95 L99 P168 W175 F176 L177 C318 G319 F325 A326	I95-L322 HydrophobicContact CD1-CD2 4.38Å; I95-L322 HydrophobicContact CG2-CD2 4.17Å; L99-L322 HydrophobicContact CD1-CD2 4.22Å; L99-L322 HydrophobicContact CD2-CD2 4.37Å; P168-L322 HydrophobicContact CB-CD1 3.99Å; P168-L322 HydrophobicContact CB-CD2 4.35Å; W175-L322 HydrophobicContact CB-CD1 3.91Å; W175-L322 HydrophobicContact CD2-CD1 4.32Å; W175-L322 HydrophobicContact CE3-CD1 3.75Å; W175-L322 HydrophobicContact CG-CD1 4.43Å; F176-L322 WeakPolarHBondContact O-CD1 3.49Å; L177-L322 HydrophobicContact CB-CG 4.08Å; L177-L322 HydrophobicContact CD1-CD2 4.33Å; L177-L322 HydrophobicContact CD1-CG 4.42Å; C318-L322 WeakPolarHBondContact O-CB 3.43Å; C318-L322 PolarHBondContact O-N 3.37Å; G319-L322 WeakPolarHBondContact O-CB 3.42Å; G319-L322 PolarHBondContact O-N 2.99Å; L322-F325 PolarHBondContact O-N 2.91Å; L322-A326 PolarHBondContact O-N 3Å; L322-A326 VanDerWaalsContact O-N 3.14Å
323	L	98.8	Very high	96.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.1	-41.1	179.5	-66.1	-177.1	0	0	0	112.2	L90 I95 Y98 L99 G319 V320 Y321 F325 A326 E327 I359	L90-L323 HydrophobicContact CD1-CD1 3.83Å; I95-L323 HydrophobicContact CD1-CD1 4.14Å; I95-L323 HydrophobicContact CD1-CD2 4.01Å; I95-L323 HydrophobicContact CD1-CG 3.88Å; I95-L323 HydrophobicContact CG2-CD2 4.45Å; Y98-L323 HydrophobicContact CD1-CB 3.82Å; Y98-L323 HydrophobicContact CD1-CD1 3.8Å; Y98-L323 HydrophobicContact CD1-CD2 3.94Å; Y98-L323 HydrophobicContact CD1-CG 4.05Å; Y98-L323 HydrophobicContact CE1-CB 4.2Å; Y98-L323 HydrophobicContact CG-CD1 4.03Å; Y98-L323 HydrophobicContact CG-CD2 4.47Å; L99-L323 HydrophobicContact CD2-CD2 3.92Å; L99-L323 HydrophobicContact CG-CD2 3.77Å; G319-L323 WeakPolarHBondContact O-CG 3.33Å; G319-L323 PolarHBondContact O-N 3.28Å; G319-L323 VanDerWaalsContact O-N 3.11Å; V320-L323 PolarHBondContact O-N 2.93Å; Y321-L323 VanDerWaalsContact C-N 3.33Å; Y321-L323 PolarHBondContact O-N 2.92Å; L323-F325 PolarHBondContact O-N 3.39Å; L323-A326 PolarHBondContact O-N 3.16Å; L323-E327 PolarHBondContact O-N 3.22Å; L323-I359 HydrophobicContact CD1-CD1 3.55Å
324	Q	98.6	Very high	96.9	Very high	5 Å²	5	12.3 Å²	12.3	2%	0.023	7%	0.071	C	C	.	.	H	α-helix	trans	-67.3	-33.9	176.9	-173.5	62	76.1	0	0	112.4	V320 Y321 E327 S328 F347	V320-Q324 WeakPolarHBondContact O-CB 3.36Å; V320-Q324 PolarHBondContact O-N 3.31Å; Y321-Q324 PolarHBondContact O-N 3.44Å; Q324-E327 PolarHBondContact NE2-OE2 3.45Å; Q324-S328 PolarHBondContact NE2-OG 3.18Å; Q324-S328 VanDerWaalsContact O-CB 3.31Å; Q324-S328 WeakPolarHBondContact O-CB 3.35Å; Q324-S328 PolarHBondContact O-N 3.18Å; Q324-S328 PolarHBondContact O-OG 3.43Å; Q324-F347 HydrophobicContact CB-CE1 4.3Å; Q324-F347 HydrophobicContact CB-CE2 4.32Å; Q324-F347 HydrophobicContact CB-CZ 4.01Å; Q324-F347 HydrophobicContact CG-CD1 3.7Å; Q324-F347 HydrophobicContact CG-CD2 3.66Å; Q324-F347 HydrophobicContact CG-CE1 3.57Å; Q324-F347 HydrophobicContact CG-CE2 3.53Å; Q324-F347 HydrophobicContact CG-CG 3.73Å; Q324-F347 HydrophobicContact CG-CZ 3.47Å; Q324-F347 VanDerWaalsContact CG-CZ 3.47Å
325	F	98.6	Very high	97	Very high	1 Å²	1	11 Å²	11	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-62.2	-47.2	172.4	-62.7	-37	0	0	0	110.9	L177 M264 V309 Y321 L322 L323 S328 F329 F347	L177-F325 HydrophobicContact CD2-CB 3.93Å; M264-F325 HydrophobicContact CB-CB 4.46Å; M264-F325 HydrophobicContact CB-CD2 3.65Å; M264-F325 HydrophobicContact CB-CE2 4.05Å; M264-F325 HydrophobicContact CB-CG 4.04Å; M264-F325 HydrophobicContact SD-CB 3.88Å; M264-F325 HydrophobicContact SD-CG 4.31Å; V309-F325 HydrophobicContact CB-CD1 4.33Å; V309-F325 HydrophobicContact CB-CE1 3.67Å; V309-F325 HydrophobicContact CB-CZ 3.91Å; V309-F325 HydrophobicContact CG1-CE1 4.36Å; V309-F325 HydrophobicContact CG2-CE1 3.84Å; V309-F325 HydrophobicContact CG2-CE2 4.16Å; V309-F325 HydrophobicContact CG2-CZ 3.51Å; Y321-F325 HydrophobicContact CD1-CE1 4.18Å; Y321-F325 AromaticContact CD1-CZ 3.92Å; Y321-F325 HydrophobicContact CD1-CZ 3.92Å; Y321-F325 HydrophobicContact CG-CZ 4.43Å; Y321-F325 WeakPolarHBondContact O-CD2 3.2Å; Y321-F325 WeakPolarHBondContact O-CG 3.39Å; Y321-F325 PolarHBondContact O-N 3.38Å; L322-F325 PolarHBondContact O-N 2.91Å; L323-F325 PolarHBondContact O-N 3.39Å; F325-S328 PolarHBondContact O-N 2.88Å; F325-F329 WeakPolarHBondContact O-CB 3.42Å; F325-F329 PolarHBondContact O-N 3.22Å; F325-F347 AromaticContact CD1-CE1 3.64Å; F325-F347 HydrophobicContact CD1-CE1 3.64Å; F325-F347 AromaticContact CD1-CZ 3.72Å; F325-F347 HydrophobicContact CD1-CZ 3.72Å; F325-F347 AromaticContact CE1-CE1 3.9Å; F325-F347 HydrophobicContact CE1-CE1 3.9Å; F325-F347 AromaticContact CE1-CZ 3.56Å; F325-F347 HydrophobicContact CE1-CZ 3.56Å
326	A	98.4	Very high	97.3	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.008	5%	0.051	C	C	.	.	H	α-helix	trans	-61.3	-47.3	178.4	0	0	0	0	0	111.8	L99 L102 F166 L177 L322 L323 S328 F329 L330	L99-A326 HydrophobicContact CD2-CB 3.4Å; L102-A326 HydrophobicContact CD1-CB 4.19Å; F166-A326 HydrophobicContact CD1-CB 4.31Å; F166-A326 HydrophobicContact CE1-CB 4.32Å; L177-A326 HydrophobicContact CD2-CB 4Å; L322-A326 PolarHBondContact O-N 3Å; L322-A326 VanDerWaalsContact O-N 3.14Å; L323-A326 PolarHBondContact O-N 3.16Å; A326-S328 PolarHBondContact O-N 3.35Å; A326-F329 WeakPolarHBondContact O-CB 3.25Å; A326-F329 PolarHBondContact O-N 2.97Å; A326-L330 VanDerWaalsContact O-CG 3.29Å; A326-L330 WeakPolarHBondContact O-CG 3.45Å; A326-L330 PolarHBondContact O-N 3.46Å
327	E	98	Very high	97.4	Very high	21 Å²	21	9.6 Å²	9.6	10%	0.098	5%	0.049	C	C	.	.	H	α-helix	trans	-61.3	-44.1	177.6	-173.5	-179.5	-168.2	0	0	112.2	L102 V107 L323 Q324 F329 L330 Q331 K355	L102-E327 HydrophobicContact CD1-CB 3.92Å; L102-E327 HydrophobicContact CD2-CB 3.98Å; L102-E327 HydrophobicContact CD2-CG 3.79Å; V107-E327 HydrophobicContact CG2-CG 3.83Å; L323-E327 PolarHBondContact O-N 3.22Å; Q324-E327 PolarHBondContact NE2-OE2 3.45Å; E327-F329 VanDerWaalsContact C-N 3.32Å; E327-F329 PolarHBondContact O-N 2.76Å; E327-L330 PolarHBondContact O-N 2.65Å; E327-L330 VanDerWaalsContact O-N 3.16Å; E327-Q331 HydrophobicContact CG-CG 4.5Å; E327-Q331 WeakPolarHBondContact O-CG 3.33Å; E327-Q331 PolarHBondContact O-N 3.44Å; E327-Q331 PolarHBondContact OE1-NE2 3.04Å; E327-K355 IonicContact OE1-NZ 3.26Å; E327-K355 IonicContact OE2-NZ 2.74Å; E327-K355 PolarHBondContact OE2-NZ 3.42Å
328	S	97.3	Very high	97.2	Very high	5 Å²	5	12 Å²	12	4%	0.035	6%	0.062	C	C	.	.	H	α-helix	trans	-66.4	-36.2	179.7	-50.9	0	0	0	0	111.9	Q324 F325 A326 L330 N332 W346 F347	Q324-S328 PolarHBondContact NE2-OG 3.18Å; Q324-S328 VanDerWaalsContact O-CB 3.31Å; Q324-S328 WeakPolarHBondContact O-CB 3.35Å; Q324-S328 PolarHBondContact O-N 3.18Å; Q324-S328 PolarHBondContact O-OG 3.43Å; F325-S328 PolarHBondContact O-N 2.88Å; A326-S328 PolarHBondContact O-N 3.35Å; S328-L330 VanDerWaalsContact C-N 3.33Å; S328-N332 CarbonylContact O-C 3.58Å; S328-N332 PolarHBondContact O-N 3.1Å; S328-W346 PolarHBondContact O-NE1 3.14Å; S328-F347 WeakPolarHBondContact OG-CD1 3.31Å
329	F	97.8	Very high	96.9	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62	-42.6	172.3	-164.8	-70.9	0	0	0	111.3	V111 F164 F166 V179 L262 M264 F325 A326 E327 P333 V334 W346	V111-F329 HydrophobicContact CG1-CD1 4.48Å; V111-F329 HydrophobicContact CG1-CE1 4.45Å; F164-F329 AromaticContact CD1-CE1 3.7Å; F164-F329 HydrophobicContact CD1-CE1 3.7Å; F164-F329 AromaticContact CD1-CZ 3.57Å; F164-F329 HydrophobicContact CD1-CZ 3.57Å; F164-F329 AromaticContact CD2-CE1 3.93Å; F164-F329 HydrophobicContact CD2-CE1 3.93Å; F164-F329 AromaticContact CE1-CE1 3.82Å; F164-F329 HydrophobicContact CE1-CE1 3.82Å; F164-F329 AromaticContact CE1-CZ 3.58Å; F164-F329 HydrophobicContact CE1-CZ 3.58Å; F164-F329 HydrophobicContact CE2-CE1 4.03Å; F164-F329 AromaticContact CG-CE1 3.76Å; F164-F329 HydrophobicContact CG-CE1 3.76Å; F164-F329 HydrophobicContact CG-CZ 4.12Å; F164-F329 AromaticContact CZ-CE1 3.97Å; F164-F329 HydrophobicContact CZ-CE1 3.97Å; F164-F329 HydrophobicContact CZ-CZ 4.1Å; F166-F329 HydrophobicContact CE1-CB 4.19Å; F166-F329 HydrophobicContact CE1-CD1 4.25Å; F166-F329 HydrophobicContact CE1-CG 4.18Å; F166-F329 HydrophobicContact CZ-CB 4.36Å; F166-F329 AromaticContact CZ-CD1 3.71Å; F166-F329 HydrophobicContact CZ-CD1 3.71Å; F166-F329 HydrophobicContact CZ-CE1 4.31Å; F166-F329 HydrophobicContact CZ-CG 4.1Å; V179-F329 HydrophobicContact CG1-CE2 4.35Å; V179-F329 HydrophobicContact CG1-CZ 4.38Å; L262-F329 HydrophobicContact CD1-CE2 4.28Å; M264-F329 HydrophobicContact CE-CD2 3.9Å; M264-F329 HydrophobicContact CE-CE2 4.29Å; F325-F329 WeakPolarHBondContact O-CB 3.42Å; F325-F329 PolarHBondContact O-N 3.22Å; A326-F329 WeakPolarHBondContact O-CB 3.25Å; A326-F329 PolarHBondContact O-N 2.97Å; E327-F329 VanDerWaalsContact C-N 3.32Å; E327-F329 PolarHBondContact O-N 2.76Å; F329-P333 HydrophobicContact CD1-CB 4.3Å; F329-P333 HydrophobicContact CE1-CB 4.17Å; F329-P333 WeakPolarHBondContact O-CA 3.49Å; F329-P333 VanDerWaalsContact O-CB 3.23Å; F329-P333 WeakPolarHBondContact O-CB 3.28Å; F329-P333 VanDerWaalsContact O-N 3.13Å; F329-V334 HydrophobicContact CD2-CG2 4.38Å; F329-V334 HydrophobicContact CE2-CB 4.21Å; F329-V334 HydrophobicContact CE2-CG2 3.93Å; F329-V334 HydrophobicContact CZ-CB 4.49Å; F329-W346 VanDerWaalsContact CA-CZ2 3.46Å; F329-W346 HydrophobicContact CB-CH2 3.87Å; F329-W346 HydrophobicContact CB-CZ2 3.97Å; F329-W346 AromaticContact CD2-CH2 3.67Å; F329-W346 HydrophobicContact CD2-CH2 3.67Å; F329-W346 HydrophobicContact CD2-CZ2 4.16Å; F329-W346 HydrophobicContact CG-CH2 4.18Å; F329-W346 HydrophobicContact CG-CZ2 4.37Å
330	L	96.6	Very high	96.7	Very high	4 Å²	4	18 Å²	18	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-71	-35.6	-178.8	-71.5	170.4	0	0	0	112.5	L102 L103 V111 A112 F166 A326 E327 S328	L102-L330 HydrophobicContact CB-CD1 3.7Å; L102-L330 HydrophobicContact CD1-CD1 4.37Å; L103-L330 HydrophobicContact CD1-CD1 3.8Å; V111-L330 HydrophobicContact CB-CD2 4.33Å; V111-L330 HydrophobicContact CG1-CD2 3.94Å; A112-L330 HydrophobicContact CB-CD2 4.43Å; F166-L330 HydrophobicContact CE2-CD2 4.17Å; F166-L330 HydrophobicContact CZ-CD2 4.04Å; F166-L330 HydrophobicContact CZ-CG 4.21Å; A326-L330 VanDerWaalsContact O-CG 3.29Å; A326-L330 WeakPolarHBondContact O-CG 3.45Å; A326-L330 PolarHBondContact O-N 3.46Å; E327-L330 PolarHBondContact O-N 2.65Å; E327-L330 VanDerWaalsContact O-N 3.16Å; S328-L330 VanDerWaalsContact C-N 3.33Å
331	Q	94.1	Very high	96.5	Very high	92 Å²	92	18.1 Å²	18.1	43%	0.43	10%	0.101	S	C	.	.	H	α-helix	trans	-78.8	-41.6	178.5	-71.9	174.1	-11.7	0	0	113.8	V107 E327	V107-Q331 HydrophobicContact CB-CG 3.66Å; V107-Q331 HydrophobicContact CG1-CG 4.43Å; V107-Q331 HydrophobicContact CG2-CG 3.36Å; E327-Q331 HydrophobicContact CG-CG 4.5Å; E327-Q331 WeakPolarHBondContact O-CG 3.33Å; E327-Q331 PolarHBondContact O-N 3.44Å; E327-Q331 PolarHBondContact OE1-NE2 3.04Å
332	N	94.8	Very high	96.4	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.053	13%	0.127	C	C	.	.	S	Bend	trans	-139.5	73.6	-174.4	177.3	23.6	0	0	0	108.1	S246 L247 L248 S328 W346	S246-N332 VanDerWaalsContact CB-OD1 3.27Å; S246-N332 WeakPolarHBondContact CB-OD1 3.37Å; S246-N332 VanDerWaalsContact OG-CG 3.24Å; S246-N332 PolarHBondContact OG-ND2 3.33Å; S246-N332 PolarHBondContact OG-OD1 3.34Å; L247-N332 PolarHBondContact N-OD1 2.99Å; L247-N332 VanDerWaalsContact N-OD1 3.13Å; L248-N332 WeakPolarHBondContact CB-OD1 3.25Å; L248-N332 HydrophobicContact CD1-CB 4.11Å; L248-N332 HydrophobicContact CG-CB 4.31Å; L248-N332 WeakPolarHBondContact CG-OD1 3.36Å; L248-N332 PolarHBondContact N-OD1 2.96Å; S328-N332 CarbonylContact O-C 3.58Å; S328-N332 PolarHBondContact O-N 3.1Å; N332-W346 PolarHBondContact O-NE1 3.3Å; N332-W346 VanDerWaalsContact O-NE1 3.1Å
333	P	95.5	Very high	96.3	Very high	11 Å²	11	24.7 Å²	24.7	7%	0.071	13%	0.126	C	C	.	.			trans	-64.3	157.1	-170.8	27.2	-37	0	0	0	112.1	V111 S246 L247 F329 V335	V111-P333 HydrophobicContact CG2-CB 4.28Å; V111-P333 HydrophobicContact CG2-CG 3.89Å; S246-P333 CarbonylContact C-O 3.6Å; S246-P333 VanDerWaalsContact CA-O 3.23Å; S246-P333 WeakPolarHBondContact CA-O 3.4Å; L247-P333 HydrophobicContact CB-CG 4.1Å; L247-P333 HydrophobicContact CD2-CG 4.27Å; L247-P333 PolarHBondContact N-O 2.85Å; F329-P333 HydrophobicContact CD1-CB 4.3Å; F329-P333 HydrophobicContact CE1-CB 4.17Å; F329-P333 WeakPolarHBondContact O-CA 3.49Å; F329-P333 VanDerWaalsContact O-CB 3.23Å; F329-P333 WeakPolarHBondContact O-CB 3.28Å; F329-P333 VanDerWaalsContact O-N 3.13Å; P333-V335 PolarHBondContact O-N 3.4Å
334	V	96.9	Very high	96.1	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-64.5	129	164	-177.5	0	0	0	0	108	C245 F329 D336 F337 L341 L343 W346	C245-V334 HydrophobicContact CB-CG1 4.33Å; C245-V334 CarbonylContact O-C 3.58Å; C245-V334 WeakPolarHBondContact O-CA 3.35Å; F329-V334 HydrophobicContact CD2-CG2 4.38Å; F329-V334 HydrophobicContact CE2-CB 4.21Å; F329-V334 HydrophobicContact CE2-CG2 3.93Å; F329-V334 HydrophobicContact CZ-CB 4.49Å; V334-D336 WeakPolarHBondContact CG1-O 3.46Å; V334-F337 HydrophobicContact CB-CE1 3.94Å; V334-F337 HydrophobicContact CB-CE2 4.3Å; V334-F337 HydrophobicContact CB-CZ 3.76Å; V334-F337 HydrophobicContact CG1-CD1 4.03Å; V334-F337 HydrophobicContact CG1-CD2 4.22Å; V334-F337 HydrophobicContact CG1-CE1 3.83Å; V334-F337 HydrophobicContact CG1-CE2 4.02Å; V334-F337 HydrophobicContact CG1-CG 4.22Å; V334-F337 HydrophobicContact CG1-CZ 3.82Å; V334-F337 WeakPolarHBondContact O-CE2 3.45Å; V334-F337 WeakPolarHBondContact O-CZ 3.36Å; V334-L341 HydrophobicContact CG1-CD2 4.12Å; V334-L343 HydrophobicContact CG2-CD1 4.19Å; V334-L343 HydrophobicContact CG2-CD2 4.1Å; V334-W346 HydrophobicContact CG2-CH2 4.29Å; V334-W346 HydrophobicContact CG2-CZ2 4.36Å
335	V	96.4	Very high	95.8	Very high	20 Å²	20	30.6 Å²	30.6	12%	0.121	16%	0.162	C	C	.	.			trans	-112	-26.6	177.3	-64.2	0	0	0	0	112	F193 C245 L247 C250 V255 P333	F193-V335 HydrophobicContact CE2-CB 4.03Å; F193-V335 HydrophobicContact CE2-CG1 4Å; F193-V335 HydrophobicContact CE2-CG2 3.94Å; F193-V335 HydrophobicContact CZ-CG1 4.49Å; F193-V335 HydrophobicContact CZ-CG2 3.94Å; C245-V335 WeakPolarHBondContact O-CG2 3.32Å; C245-V335 PolarHBondContact O-N 3.29Å; L247-V335 HydrophobicContact CB-CG1 3.83Å; L247-V335 HydrophobicContact CD1-CG1 3.93Å; C250-V335 HydrophobicContact CB-CG2 3.67Å; V255-V335 WeakPolarHBondContact CB-O 3.32Å; V255-V335 HydrophobicContact CG1-CG2 4.15Å; V255-V335 WeakPolarHBondContact CG2-O 3.5Å; P333-V335 PolarHBondContact O-N 3.4Å
336	D	97.2	Very high	95.6	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.027	16%	0.162	C	C	.	.			trans	-114.7	110	176.9	-175.1	49.1	0	0	0	110.5	C245 K252 V255 T256 V334 D338 L341	C245-D336 HydrophobicContact CB-CB 4.36Å; C245-D336 WeakPolarHBondContact CB-O 3.37Å; C245-D336 PolarHBondContact O-N 3.09Å; K252-D336 WeakPolarHBondContact CE-OD2 3.5Å; K252-D336 IonicContact NZ-OD1 3.76Å; K252-D336 IonicContact NZ-OD2 2.89Å; K252-D336 PolarHBondContact NZ-OD2 3.37Å; V255-D336 HydrophobicContact CB-CB 4.12Å; V255-D336 HydrophobicContact CG1-CB 4.06Å; T256-D336 WeakPolarHBondContact CB-OD1 3.34Å; T256-D336 PolarHBondContact N-OD1 3.35Å; V334-D336 WeakPolarHBondContact CG1-O 3.46Å; D336-D338 VanDerWaalsContact C-N 3.31Å; D336-D338 PolarHBondContact O-N 3.03Å; D336-L341 WeakPolarHBondContact O-CD2 3.28Å
337	F	97.2	Very high	95.5	Very high	3 Å²	3	31.1 Å²	31.1	1%	0.013	16%	0.164	C	C	.	.			trans	-96.2	24.5	-172.8	-66	-98.4	0	0	0	112.5	F164 C181 F182 T256 R258 L262 V334 P339	F164-F337 HydrophobicContact CE1-CE1 4.18Å; F164-F337 AromaticContact CE1-CZ 3.68Å; F164-F337 HydrophobicContact CE1-CZ 3.68Å; F164-F337 HydrophobicContact CZ-CZ 4.18Å; C181-F337 HydrophobicContact CB-CD1 4.13Å; C181-F337 HydrophobicContact CB-CE1 3.85Å; C181-F337 VanDerWaalsContact SG-CE1 3.59Å; F182-F337 HydrophobicContact CE2-CD1 4.21Å; F182-F337 AromaticContact CE2-CD2 3.67Å; F182-F337 HydrophobicContact CE2-CD2 3.67Å; F182-F337 AromaticContact CE2-CE1 3.99Å; F182-F337 HydrophobicContact CE2-CE1 3.99Å; F182-F337 AromaticContact CE2-CE2 3.43Å; F182-F337 HydrophobicContact CE2-CE2 3.43Å; F182-F337 VanDerWaalsContact CE2-CE2 3.43Å; F182-F337 HydrophobicContact CE2-CG 4.07Å; F182-F337 AromaticContact CE2-CZ 3.6Å; F182-F337 HydrophobicContact CE2-CZ 3.6Å; F182-F337 HydrophobicContact CZ-CD2 4.33Å; F182-F337 AromaticContact CZ-CE2 3.76Å; F182-F337 HydrophobicContact CZ-CE2 3.76Å; F182-F337 HydrophobicContact CZ-CZ 4.02Å; T256-F337 WeakPolarHBondContact O-CB 3.38Å; T256-F337 WeakPolarHBondContact O-CD2 3.44Å; T256-F337 PolarHBondContact O-N 3.34Å; R258-F337 WeakPolarHBondContact CD-O 3.44Å; R258-F337 HydrophobicContact CG-CB 3.99Å; L262-F337 HydrophobicContact CD1-CD1 4.35Å; L262-F337 HydrophobicContact CD1-CE1 4.11Å; V334-F337 HydrophobicContact CB-CE1 3.94Å; V334-F337 HydrophobicContact CB-CE2 4.3Å; V334-F337 HydrophobicContact CB-CZ 3.76Å; V334-F337 HydrophobicContact CG1-CD1 4.03Å; V334-F337 HydrophobicContact CG1-CD2 4.22Å; V334-F337 HydrophobicContact CG1-CE1 3.83Å; V334-F337 HydrophobicContact CG1-CE2 4.02Å; V334-F337 HydrophobicContact CG1-CG 4.22Å; V334-F337 HydrophobicContact CG1-CZ 3.82Å; V334-F337 WeakPolarHBondContact O-CE2 3.45Å; V334-F337 WeakPolarHBondContact O-CZ 3.36Å; F337-P339 WeakPolarHBondContact O-CD 3.39Å
338	D	94.1	Very high	95.3	Very high	69 Å²	69	32.8 Å²	32.8	37%	0.369	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-86.2	118.1	173.5	-161.1	44.8	0	0	0	110.7	R258 D336	R258-D338 IonicContact CZ-OD1 3.46Å; R258-D338 VanDerWaalsContact CZ-OD1 3.25Å; R258-D338 IonicContact NH1-OD1 3.23Å; R258-D338 PolarHBondContact NH1-OD1 3.28Å; R258-D338 IonicContact NH2-OD1 2.75Å; R258-D338 PolarHBondContact NH2-OD1 2.92Å; D336-D338 VanDerWaalsContact C-N 3.31Å; D336-D338 PolarHBondContact O-N 3.03Å
339	P	91.4	Very high	95	Very high	39 Å²	39	39.1 Å²	39.1	25%	0.253	20%	0.2	S	C	.	.	S	Bend	trans	-66.9	151.8	179.6	-21.5	34.1	0	0	0	112.7	F337	F337-P339 WeakPolarHBondContact O-CD 3.39Å
340	P	94.1	Very high	94.8	Very high	86 Å²	86	45 Å²	45	56%	0.558	23%	0.227	S	C	*	.	S	Bend	cis	-81.7	136	2.3	31.4	-34.2	0	0	0	113.2	R342	P340-R342 PolarHBondContact O-N 3.46Å
341	L	94.6	Very high	94.7	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	25%	0.247	C	C	.	.			trans	-82.9	102.4	174.7	-62.9	177.4	0	0	0	110.5	C245 L262 S308 V334 D336	C245-L341 HydrophobicContact CB-CD2 4.04Å; L262-L341 HydrophobicContact CD1-CD1 3.86Å; L262-L341 HydrophobicContact CD2-CD1 3.34Å; L262-L341 HydrophobicContact CG-CD1 4.23Å; S308-L341 PolarHBondContact N-O 2.98Å; V334-L341 HydrophobicContact CG1-CD2 4.12Å; D336-L341 WeakPolarHBondContact O-CD2 3.28Å
342	R	94.9	Very high	94.8	Very high	141 Å²	141	45.8 Å²	45.8	53%	0.532	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-97.5	106.6	179.4	-73.2	-174.9	-78	-131.2	-0.4	110	P243 P340 E344	P243-R342 WeakPolarHBondContact CB-O 3.48Å; P340-R342 PolarHBondContact O-N 3.46Å; R342-E344 VanDerWaalsContact C-OE2 3.22Å; R342-E344 VanDerWaalsContact CA-OE2 3.24Å; R342-E344 WeakPolarHBondContact CA-OE2 3.42Å; R342-E344 VanDerWaalsContact CB-OE2 3.3Å; R342-E344 WeakPolarHBondContact CB-OE2 3.42Å
343	L	96.5	Very high	94.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.			trans	-123.7	13.4	-173.4	-63.7	167.3	0	0	0	111.5	P243 C245 M264 C307 S308 V309 P310 V334 G345 W346	P243-L343 HydrophobicContact CB-CD2 3.7Å; P243-L343 HydrophobicContact CG-CD2 4.04Å; C245-L343 VanDerWaalsContact SG-CD2 3.57Å; M264-L343 HydrophobicContact CE-CD1 4.45Å; C307-L343 HydrophobicContact CB-CD1 4.08Å; S308-L343 CarbonylContact O-C 3.55Å; S308-L343 WeakPolarHBondContact O-CA 3.48Å; S308-L343 WeakPolarHBondContact O-CB 3.42Å; S308-L343 PolarHBondContact O-N 3.44Å; V309-L343 HydrophobicContact CG1-CB 4.14Å; V309-L343 HydrophobicContact CG1-CD1 4.37Å; P310-L343 WeakPolarHBondContact CD-O 3.38Å; V334-L343 HydrophobicContact CG2-CD1 4.19Å; V334-L343 HydrophobicContact CG2-CD2 4.1Å; L343-G345 PolarHBondContact O-N 3.02Å; L343-W346 HydrophobicContact CB-CD2 4.45Å; L343-W346 HydrophobicContact CB-CE3 4.01Å; L343-W346 HydrophobicContact CB-CZ3 4.42Å; L343-W346 HydrophobicContact CD1-CE3 4.07Å; L343-W346 HydrophobicContact CD1-CH2 3.89Å; L343-W346 HydrophobicContact CD1-CZ3 3.62Å; L343-W346 HydrophobicContact CD2-CD2 4.2Å; L343-W346 HydrophobicContact CD2-CE3 4.27Å; L343-W346 HydrophobicContact CD2-CH2 4.3Å; L343-W346 HydrophobicContact CD2-CZ2 4.27Å; L343-W346 HydrophobicContact CD2-CZ3 4.36Å; L343-W346 HydrophobicContact CG-CE3 4.35Å; L343-W346 HydrophobicContact CG-CZ3 4.36Å; L343-W346 VanDerWaalsContact O-CB 3.29Å; L343-W346 WeakPolarHBondContact O-CB 3.34Å; L343-W346 PolarHBondContact O-N 3.2Å
344	E	94.8	Very high	94.8	Very high	97 Å²	97	55.5 Å²	55.5	45%	0.453	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.5	-174.1	-59.4	91.4	148.9	0	0	113.2	S308 P310 R342	S308-E344 WeakPolarHBondContact CB-OE1 3.41Å; S308-E344 PolarHBondContact O-N 3.42Å; P310-E344 WeakPolarHBondContact CG-O 3.42Å; R342-E344 VanDerWaalsContact C-OE2 3.22Å; R342-E344 VanDerWaalsContact CA-OE2 3.24Å; R342-E344 WeakPolarHBondContact CA-OE2 3.42Å; R342-E344 VanDerWaalsContact CB-OE2 3.3Å; R342-E344 WeakPolarHBondContact CB-OE2 3.42Å
345	G	93.4	Very high	94.8	Very high	31 Å²	31	55.4 Å²	55.4	32%	0.32	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	9.3	176.5	0	0	0	0	0	115.4	R237 L343 F347	R237-G345 PolarHBondContact NH1-O 2.92Å; R237-G345 VanDerWaalsContact NH1-O 3.08Å; L343-G345 PolarHBondContact O-N 3.02Å; G345-F347 VanDerWaalsContact C-N 3.28Å; G345-F347 PolarHBondContact O-N 3.29Å
346	W	94.6	Very high	94.9	Very high	3 Å²	3	55.2 Å²	55.2	1%	0.011	26%	0.261	C	S	.	.	S	Bend	trans	-58	-41.1	-170.1	-147	-7.4	0	0	0	113.1	R237 P243 M264 S328 F329 N332 V334 L343	R237-W346 PolarHBondContact NH1-O 2.71Å; R237-W346 PolarHBondContact NH2-O 3.34Å; P243-W346 HydrophobicContact CG-CB 4.09Å; P243-W346 HydrophobicContact CG-CG 4.2Å; M264-W346 HydrophobicContact CE-CH2 3.96Å; M264-W346 HydrophobicContact CE-CZ3 3.94Å; M264-W346 HydrophobicContact SD-CH2 4.33Å; M264-W346 HydrophobicContact SD-CZ3 3.81Å; S328-W346 PolarHBondContact O-NE1 3.14Å; F329-W346 VanDerWaalsContact CA-CZ2 3.46Å; F329-W346 HydrophobicContact CB-CH2 3.87Å; F329-W346 HydrophobicContact CB-CZ2 3.97Å; F329-W346 AromaticContact CD2-CH2 3.67Å; F329-W346 HydrophobicContact CD2-CH2 3.67Å; F329-W346 HydrophobicContact CD2-CZ2 4.16Å; F329-W346 HydrophobicContact CG-CH2 4.18Å; F329-W346 HydrophobicContact CG-CZ2 4.37Å; N332-W346 PolarHBondContact O-NE1 3.3Å; N332-W346 VanDerWaalsContact O-NE1 3.1Å; V334-W346 HydrophobicContact CG2-CH2 4.29Å; V334-W346 HydrophobicContact CG2-CZ2 4.36Å; L343-W346 HydrophobicContact CB-CD2 4.45Å; L343-W346 HydrophobicContact CB-CE3 4.01Å; L343-W346 HydrophobicContact CB-CZ3 4.42Å; L343-W346 HydrophobicContact CD1-CE3 4.07Å; L343-W346 HydrophobicContact CD1-CH2 3.89Å; L343-W346 HydrophobicContact CD1-CZ3 3.62Å; L343-W346 HydrophobicContact CD2-CD2 4.2Å; L343-W346 HydrophobicContact CD2-CE3 4.27Å; L343-W346 HydrophobicContact CD2-CH2 4.3Å; L343-W346 HydrophobicContact CD2-CZ2 4.27Å; L343-W346 HydrophobicContact CD2-CZ3 4.36Å; L343-W346 HydrophobicContact CG-CE3 4.35Å; L343-W346 HydrophobicContact CG-CZ3 4.36Å; L343-W346 VanDerWaalsContact O-CB 3.29Å; L343-W346 WeakPolarHBondContact O-CB 3.34Å; L343-W346 PolarHBondContact O-N 3.2Å
347	F	95.5	Very high	94.9	Very high	10 Å²	10	59.6 Å²	59.6	4%	0.044	28%	0.284	C	S	.	.	S	Bend	trans	-147.5	149.1	175.4	51.4	-92.6	0	0	0	110.5	P310 Y321 Q324 F325 S328 G345 R351 A352	P310-F347 HydrophobicContact CB-CD2 4.35Å; P310-F347 HydrophobicContact CB-CE1 4.48Å; P310-F347 HydrophobicContact CB-CE2 3.72Å; P310-F347 HydrophobicContact CB-CZ 3.82Å; P310-F347 HydrophobicContact CG-CD1 4.17Å; P310-F347 HydrophobicContact CG-CD2 4.18Å; P310-F347 HydrophobicContact CG-CE1 3.86Å; P310-F347 HydrophobicContact CG-CE2 3.86Å; P310-F347 HydrophobicContact CG-CG 4.34Å; P310-F347 HydrophobicContact CG-CZ 3.71Å; Y321-F347 HydrophobicContact CD1-CE2 4.19Å; Y321-F347 HydrophobicContact CD1-CZ 4.15Å; Y321-F347 HydrophobicContact CE1-CE2 4.07Å; Y321-F347 HydrophobicContact CE1-CZ 4.45Å; Q324-F347 HydrophobicContact CB-CE1 4.3Å; Q324-F347 HydrophobicContact CB-CE2 4.32Å; Q324-F347 HydrophobicContact CB-CZ 4.01Å; Q324-F347 HydrophobicContact CG-CD1 3.7Å; Q324-F347 HydrophobicContact CG-CD2 3.66Å; Q324-F347 HydrophobicContact CG-CE1 3.57Å; Q324-F347 HydrophobicContact CG-CE2 3.53Å; Q324-F347 HydrophobicContact CG-CG 3.73Å; Q324-F347 HydrophobicContact CG-CZ 3.47Å; Q324-F347 VanDerWaalsContact CG-CZ 3.47Å; F325-F347 AromaticContact CD1-CE1 3.64Å; F325-F347 HydrophobicContact CD1-CE1 3.64Å; F325-F347 AromaticContact CD1-CZ 3.72Å; F325-F347 HydrophobicContact CD1-CZ 3.72Å; F325-F347 AromaticContact CE1-CE1 3.9Å; F325-F347 HydrophobicContact CE1-CE1 3.9Å; F325-F347 AromaticContact CE1-CZ 3.56Å; F325-F347 HydrophobicContact CE1-CZ 3.56Å; S328-F347 WeakPolarHBondContact OG-CD1 3.31Å; G345-F347 VanDerWaalsContact C-N 3.28Å; G345-F347 PolarHBondContact O-N 3.29Å; F347-R351 HydrophobicContact CB-CB 4.26Å; F347-R351 HydrophobicContact CB-CG 4.39Å; F347-R351 HydrophobicContact CD2-CB 4.47Å; F347-A352 HydrophobicContact CE2-CB 4.31Å
348	P	94.3	Very high	95	Very high	57 Å²	57	62.1 Å²	62.1	37%	0.37	30%	0.296	S	S	.	.			trans	-70.7	150.7	171.7	31.4	-34.5	0	0	0	110.1	Q350 R351	P348-Q350 PolarHBondContact O-N 3.04Å; P348-R351 HydrophobicContact CG-CG 3.87Å; P348-R351 WeakPolarHBondContact O-CB 3.48Å; P348-R351 PolarHBondContact O-N 2.73Å
349	R	91.5	Very high	95.1	Very high	138 Å²	138	58.9 Å²	58.9	52%	0.521	28%	0.278	S	S	.	.	H	α-helix	trans	-54.2	-31.1	-179.7	-67.1	-174	-177.4	179.6	4.2	113.8	D313 R351 A352 R353	D313-R349 IonicContact OD2-NH1 3.62Å; R349-R351 PolarHBondContact O-N 3.46Å; R349-A352 PolarHBondContact O-N 3.08Å; R349-A352 VanDerWaalsContact O-N 3.13Å; R349-R353 PolarHBondContact O-N 3.09Å; R349-R353 VanDerWaalsContact O-N 3.08Å
350	Q	92.8	Very high	95.5	Very high	122 Å²	122	59.2 Å²	59.2	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-57.3	-34.1	177.1	-174.3	175.6	1.7	0	0	112.7	P348 R353 Q354	P348-Q350 PolarHBondContact O-N 3.04Å; Q350-R353 PolarHBondContact O-N 3.13Å; Q350-Q354 HydrophobicContact CG-CG 4.39Å; Q350-Q354 VanDerWaalsContact NE2-NE2 3.11Å; Q350-Q354 WeakPolarHBondContact O-CG 3.49Å; Q350-Q354 PolarHBondContact O-N 3.45Å
351	R	94.9	Very high	95.6	Very high	113 Å²	113	58.5 Å²	58.5	43%	0.426	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-43.2	176.4	-73.1	-68.5	-170.9	171.7	3	112	F347 P348 R349 Q354 K355	F347-R351 HydrophobicContact CB-CB 4.26Å; F347-R351 HydrophobicContact CB-CG 4.39Å; F347-R351 HydrophobicContact CD2-CB 4.47Å; P348-R351 HydrophobicContact CG-CG 3.87Å; P348-R351 WeakPolarHBondContact O-CB 3.48Å; P348-R351 PolarHBondContact O-N 2.73Å; R349-R351 PolarHBondContact O-N 3.46Å; R351-Q354 PolarHBondContact O-N 3.46Å; R351-K355 PolarHBondContact O-N 3.04Å
352	A	94.8	Very high	95.8	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-43.3	174.5	0	0	0	0	0	111.2	V320 Y321 F347 R349 Q354 K355	V320-A352 HydrophobicContact CG1-CB 4.3Å; V320-A352 VanDerWaalsContact CG1-O 3.22Å; V320-A352 WeakPolarHBondContact CG1-O 3.49Å; Y321-A352 HydrophobicContact CD2-CB 4.22Å; Y321-A352 HydrophobicContact CE1-CB 4.22Å; Y321-A352 HydrophobicContact CE2-CB 3.74Å; F347-A352 HydrophobicContact CE2-CB 4.31Å; R349-A352 PolarHBondContact O-N 3.08Å; R349-A352 VanDerWaalsContact O-N 3.13Å; A352-Q354 VanDerWaalsContact C-N 3.3Å; A352-Q354 PolarHBondContact O-N 3.17Å; A352-K355 WeakPolarHBondContact O-CB 3.22Å; A352-K355 PolarHBondContact O-N 2.91Å; A352-K355 VanDerWaalsContact O-N 3.1Å
353	R	93.3	Very high	95.8	Very high	148 Å²	148	51.9 Å²	51.9	56%	0.558	25%	0.247	S	C	*	.	H	α-helix	trans	-61.1	-35.3	179.3	-68.9	179	-179.3	175.3	-1.3	113.6	D313 R349 Q350 K355	D313-R353 IonicContact OD2-CZ 3.85Å; D313-R353 IonicContact OD2-NH2 2.82Å; D313-R353 PolarHBondContact OD2-NH2 2.75Å; R349-R353 PolarHBondContact O-N 3.09Å; R349-R353 VanDerWaalsContact O-N 3.08Å; Q350-R353 PolarHBondContact O-N 3.13Å; R353-K355 VanDerWaalsContact C-N 3.34Å
354	Q	96.8	Very high	95.8	Very high	77 Å²	77	54.3 Å²	54.3	36%	0.36	26%	0.26	S	S	.	.	H	α-helix	trans	-82.1	-13.8	178.8	-69.8	173	-16	0	0	113.1	Q350 R351 A352 R356 D357 E358	Q350-Q354 HydrophobicContact CG-CG 4.39Å; Q350-Q354 VanDerWaalsContact NE2-NE2 3.11Å; Q350-Q354 WeakPolarHBondContact O-CG 3.49Å; Q350-Q354 PolarHBondContact O-N 3.45Å; R351-Q354 PolarHBondContact O-N 3.46Å; A352-Q354 VanDerWaalsContact C-N 3.3Å; A352-Q354 PolarHBondContact O-N 3.17Å; Q354-R356 VanDerWaalsContact C-N 3.33Å; Q354-R356 PolarHBondContact O-N 2.65Å; Q354-D357 PolarHBondContact O-N 3.36Å; Q354-D357 VanDerWaalsContact O-N 3.15Å; Q354-E358 WeakPolarHBondContact O-CG 3.44Å; Q354-E358 PolarHBondContact O-N 3.08Å
355	K	97.7	Very high	95.9	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-39	-170	-169.1	56.5	56	-168.7	0	113.4	Y98 V320 E327 R351 A352 R353 D357 E358 I359	Y98-K355 HydrophobicContact CE1-CD 4.24Å; V320-K355 HydrophobicContact CG1-CB 3.61Å; V320-K355 HydrophobicContact CG1-CG 4.01Å; E327-K355 IonicContact OE1-NZ 3.26Å; E327-K355 IonicContact OE2-NZ 2.74Å; E327-K355 PolarHBondContact OE2-NZ 3.42Å; R351-K355 PolarHBondContact O-N 3.04Å; A352-K355 WeakPolarHBondContact O-CB 3.22Å; A352-K355 PolarHBondContact O-N 2.91Å; A352-K355 VanDerWaalsContact O-N 3.1Å; R353-K355 VanDerWaalsContact C-N 3.34Å; K355-D357 VanDerWaalsContact C-N 3.33Å; K355-D357 PolarHBondContact O-N 2.9Å; K355-E358 WeakPolarHBondContact CE-OE2 3.39Å; K355-E358 IonicContact NZ-OE2 2.6Å; K355-E358 PolarHBondContact NZ-OE2 3.34Å; K355-E358 PolarHBondContact O-N 3.24Å; K355-I359 HydrophobicContact CD-CD1 4.23Å; K355-I359 HydrophobicContact CD-CG1 4.27Å; K355-I359 HydrophobicContact CG-CD1 3.87Å; K355-I359 HydrophobicContact CG-CG1 4.35Å; K355-I359 VanDerWaalsContact O-CG1 3.24Å; K355-I359 WeakPolarHBondContact O-CG1 3.4Å; K355-I359 PolarHBondContact O-N 2.77Å
356	R	98.1	Very high	95.9	Very high	16 Å²	16	55.1 Å²	55.1	6%	0.06	25%	0.25	C	S	.	.	H	α-helix	trans	-57.6	-47.7	177.5	-73.2	178.3	-179.5	-84.9	-7.1	111.2	C83 L84 D85 E88 D317 V320 Q354 I359 R360	C83-R356 PolarHBondContact O-NH1 2.95Å; L84-R356 WeakPolarHBondContact O-CB 3.03Å; L84-R356 WeakPolarHBondContact O-CD 3.45Å; D85-R356 PolarHBondContact O-NH1 2.99Å; E88-R356 VanDerWaalsContact O-CZ 3.22Å; E88-R356 PolarHBondContact O-NH1 3.47Å; E88-R356 PolarHBondContact O-NH2 2.86Å; D317-R356 IonicContact OD1-CZ 3.55Å; D317-R356 VanDerWaalsContact OD1-CZ 3.26Å; D317-R356 IonicContact OD1-NE 3Å; D317-R356 PolarHBondContact OD1-NE 2.97Å; D317-R356 IonicContact OD1-NH2 3.63Å; D317-R356 PolarHBondContact OD1-NH2 3.47Å; V320-R356 HydrophobicContact CG2-CG 3.78Å; Q354-R356 VanDerWaalsContact C-N 3.33Å; Q354-R356 PolarHBondContact O-N 2.65Å; R356-I359 PolarHBondContact O-N 3.4Å; R356-R360 WeakPolarHBondContact O-CB 3.28Å; R356-R360 PolarHBondContact O-N 2.63Å
357	D	98.1	Very high	95.9	Very high	97 Å²	97	57.3 Å²	57.3	52%	0.519	26%	0.261	S	S	.	.	H	α-helix	trans	-70.2	-35.3	178.8	-65.3	-30.1	0	0	0	112.5	Q354 K355 R360 S361	Q354-D357 PolarHBondContact O-N 3.36Å; Q354-D357 VanDerWaalsContact O-N 3.15Å; K355-D357 VanDerWaalsContact C-N 3.33Å; K355-D357 PolarHBondContact O-N 2.9Å; D357-R360 IonicContact OD1-NH1 3.77Å; D357-R360 PolarHBondContact OD1-NH1 3.34Å; D357-S361 WeakPolarHBondContact O-CB 3.26Å; D357-S361 PolarHBondContact O-N 3.25Å; D357-S361 PolarHBondContact O-OG 3.39Å
358	E	97.9	Very high	95.8	Very high	56 Å²	56	64.3 Å²	64.3	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-61.5	-45.8	173.3	-71.3	177.1	-176.2	0	0	111.6	Q354 K355 S361 L362	Q354-E358 WeakPolarHBondContact O-CG 3.44Å; Q354-E358 PolarHBondContact O-N 3.08Å; K355-E358 WeakPolarHBondContact CE-OE2 3.39Å; K355-E358 IonicContact NZ-OE2 2.6Å; K355-E358 PolarHBondContact NZ-OE2 3.34Å; K355-E358 PolarHBondContact O-N 3.24Å; E358-S361 PolarHBondContact O-N 3.14Å; E358-L362 WeakPolarHBondContact O-CB 3.28Å; E358-L362 PolarHBondContact O-N 2.67Å
359	I	98.1	Very high	95.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-46.2	177.7	-62.5	166.7	0	0	0	110.4	L84 I94 F97 Y98 L323 K355 R356 S361 L362 L363	L84-I359 HydrophobicContact CD1-CB 4.22Å; L84-I359 HydrophobicContact CD1-CG2 3.75Å; L84-I359 HydrophobicContact CD2-CB 3.91Å; L84-I359 HydrophobicContact CD2-CD1 4.14Å; L84-I359 HydrophobicContact CD2-CG2 3.87Å; L84-I359 HydrophobicContact CG-CG2 4.48Å; I94-I359 HydrophobicContact CG2-CG2 4.37Å; F97-I359 HydrophobicContact CE1-CG2 4.46Å; Y98-I359 HydrophobicContact CD1-CD1 4.47Å; Y98-I359 HydrophobicContact CD2-CD1 4.27Å; Y98-I359 HydrophobicContact CD2-CG1 3.69Å; Y98-I359 HydrophobicContact CD2-CG2 4.32Å; Y98-I359 HydrophobicContact CE2-CD1 4.46Å; Y98-I359 HydrophobicContact CE2-CG1 3.62Å; Y98-I359 HydrophobicContact CG-CD1 4.24Å; Y98-I359 HydrophobicContact CG-CG1 4.17Å; L323-I359 HydrophobicContact CD1-CD1 3.55Å; K355-I359 HydrophobicContact CD-CD1 4.23Å; K355-I359 HydrophobicContact CD-CG1 4.27Å; K355-I359 HydrophobicContact CG-CD1 3.87Å; K355-I359 HydrophobicContact CG-CG1 4.35Å; K355-I359 VanDerWaalsContact O-CG1 3.24Å; K355-I359 WeakPolarHBondContact O-CG1 3.4Å; K355-I359 PolarHBondContact O-N 2.77Å; R356-I359 PolarHBondContact O-N 3.4Å; I359-S361 VanDerWaalsContact C-N 3.32Å; I359-S361 PolarHBondContact O-N 2.67Å; I359-L362 WeakPolarHBondContact O-CB 3.42Å; I359-L362 PolarHBondContact O-N 3.2Å; I359-L362 VanDerWaalsContact O-N 3.1Å; I359-L363 HydrophobicContact CG2-CD1 4.18Å; I359-L363 HydrophobicContact CG2-CG 4.47Å; I359-L363 WeakPolarHBondContact O-CG 3.41Å; I359-L363 PolarHBondContact O-N 3.49Å
360	R	98.1	Very high	95.7	Very high	46 Å²	46	57.8 Å²	57.8	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-56.4	-47.5	176.3	-179.4	-176.7	-74.6	99.4	1.5	111	L81 L84 D85 R356 D357 L362 L363 L364	L81-R360 HydrophobicContact CD1-CB 4.43Å; L81-R360 HydrophobicContact CD1-CG 4Å; L84-R360 HydrophobicContact CD1-CB 4.19Å; L84-R360 PolarHBondContact O-NH1 3.25Å; L84-R360 PolarHBondContact O-NH2 3.45Å; D85-R360 VanDerWaalsContact N-NH2 3.17Å; D85-R360 IonicContact OD1-CZ 3.03Å; D85-R360 IonicContact OD1-NH2 2.68Å; D85-R360 PolarHBondContact OD1-NH2 3.48Å; R356-R360 WeakPolarHBondContact O-CB 3.28Å; R356-R360 PolarHBondContact O-N 2.63Å; D357-R360 IonicContact OD1-NH1 3.77Å; D357-R360 PolarHBondContact OD1-NH1 3.34Å; R360-L362 VanDerWaalsContact C-N 3.27Å; R360-L362 PolarHBondContact O-N 3.11Å; R360-L363 PolarHBondContact O-N 2.92Å; R360-L364 HydrophobicContact CG-CD1 4.18Å; R360-L364 WeakPolarHBondContact O-CG 3.5Å; R360-L364 PolarHBondContact O-N 3.04Å
361	S	97.9	Very high	95.5	Very high	71 Å²	71	55.9 Å²	55.9	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-31.9	178.5	-60.5	0	0	0	0	112.7	D357 E358 I359 R365	D357-S361 WeakPolarHBondContact O-CB 3.26Å; D357-S361 PolarHBondContact O-N 3.25Å; D357-S361 PolarHBondContact O-OG 3.39Å; E358-S361 PolarHBondContact O-N 3.14Å; I359-S361 VanDerWaalsContact C-N 3.32Å; I359-S361 PolarHBondContact O-N 2.67Å; S361-R365 WeakPolarHBondContact O-CB 3.36Å; S361-R365 PolarHBondContact O-N 2.87Å
362	L	96.9	Very high	95.2	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-49.2	172.6	172.9	64.8	0	0	0	111.4	F97 Y98 Y101 E358 I359 R360 L364 R365 L366	F97-L362 HydrophobicContact CE1-CD2 4.11Å; F97-L362 HydrophobicContact CZ-CD2 3.95Å; F97-L362 HydrophobicContact CZ-CG 4.27Å; Y98-L362 HydrophobicContact CD2-CD2 4.12Å; Y98-L362 HydrophobicContact CE2-CD2 3.97Å; Y101-L362 HydrophobicContact CD1-CD2 3.51Å; Y101-L362 HydrophobicContact CD2-CD1 4.45Å; Y101-L362 HydrophobicContact CD2-CD2 4.03Å; Y101-L362 HydrophobicContact CE1-CD1 4.35Å; Y101-L362 HydrophobicContact CE1-CD2 3.47Å; Y101-L362 VanDerWaalsContact CE1-CD2 3.47Å; Y101-L362 HydrophobicContact CE2-CD1 3.82Å; Y101-L362 HydrophobicContact CE2-CD2 4.01Å; Y101-L362 HydrophobicContact CG-CD2 3.8Å; E358-L362 WeakPolarHBondContact O-CB 3.28Å; E358-L362 PolarHBondContact O-N 2.67Å; I359-L362 WeakPolarHBondContact O-CB 3.42Å; I359-L362 PolarHBondContact O-N 3.2Å; I359-L362 VanDerWaalsContact O-N 3.1Å; R360-L362 VanDerWaalsContact C-N 3.27Å; R360-L362 PolarHBondContact O-N 3.11Å; L362-L364 PolarHBondContact O-N 3.01Å; L362-R365 VanDerWaalsContact CD1-NH1 3.32Å; L362-R365 WeakPolarHBondContact O-CB 3.31Å; L362-R365 PolarHBondContact O-N 3.31Å; L362-R365 VanDerWaalsContact O-N 3.15Å; L362-L366 HydrophobicContact CD1-CD1 4.03Å; L362-L366 HydrophobicContact CD1-CG 4.08Å; L362-L366 HydrophobicContact CG-CD1 4.07Å; L362-L366 HydrophobicContact CG-CG 4.49Å; L362-L366 WeakPolarHBondContact O-CG 3.2Å; L362-L366 PolarHBondContact O-N 3.28Å
363	L	96.7	Very high	94.7	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-49.5	-179.7	-71.3	173	0	0	0	112.1	L62 I63 L76 L81 L84 I94 F97 I359 R360 R365 L366 E367	L62-L363 HydrophobicContact CD2-CB 4.31Å; I63-L363 HydrophobicContact CD1-CD2 3.58Å; I63-L363 HydrophobicContact CG1-CD2 4.42Å; L76-L363 HydrophobicContact CD2-CD1 4.45Å; L76-L363 HydrophobicContact CD2-CD2 3.49Å; L76-L363 VanDerWaalsContact CD2-CD2 3.49Å; L81-L363 HydrophobicContact CD1-CB 3.93Å; L81-L363 HydrophobicContact CD1-CD1 3.56Å; L81-L363 HydrophobicContact CD1-CG 4.39Å; L84-L363 HydrophobicContact CD1-CD1 3.81Å; I94-L363 HydrophobicContact CD1-CD1 3.82Å; F97-L363 HydrophobicContact CD1-CD2 3.87Å; F97-L363 HydrophobicContact CD2-CD2 4.43Å; F97-L363 HydrophobicContact CE1-CD2 3.36Å; F97-L363 HydrophobicContact CE1-CG 3.95Å; F97-L363 HydrophobicContact CE2-CD2 3.98Å; F97-L363 HydrophobicContact CG-CD2 4.39Å; F97-L363 HydrophobicContact CZ-CD2 3.43Å; F97-L363 VanDerWaalsContact CZ-CD2 3.43Å; F97-L363 HydrophobicContact CZ-CG 4.3Å; I359-L363 HydrophobicContact CG2-CD1 4.18Å; I359-L363 HydrophobicContact CG2-CG 4.47Å; I359-L363 WeakPolarHBondContact O-CG 3.41Å; I359-L363 PolarHBondContact O-N 3.49Å; R360-L363 PolarHBondContact O-N 2.92Å; L363-R365 PolarHBondContact O-N 3.02Å; L363-L366 PolarHBondContact O-N 2.89Å; L363-E367 WeakPolarHBondContact O-CB 3.39Å; L363-E367 PolarHBondContact O-N 3.02Å
364	L	95.7	Very high	94	Very high	51 Å²	51	57.5 Å²	57.5	27%	0.267	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-29.6	178	-65.9	176.1	0	0	0	112.7	L81 R360 L362 R368	L81-L364 HydrophobicContact CD2-CD2 4Å; R360-L364 HydrophobicContact CG-CD1 4.18Å; R360-L364 WeakPolarHBondContact O-CG 3.5Å; R360-L364 PolarHBondContact O-N 3.04Å; L362-L364 PolarHBondContact O-N 3.01Å; L364-R368 WeakPolarHBondContact O-CG 3.09Å; L364-R368 PolarHBondContact O-N 2.84Å
365	R	95.9	Very high	93.1	Very high	125 Å²	125	58.7 Å²	58.7	47%	0.472	29%	0.289	S	S	.	.	H	α-helix	trans	-73	-44.2	175.3	-166.3	-161.9	-33.3	129.9	11.2	111.3	S361 L362 L363 E367 R368 A369	S361-R365 WeakPolarHBondContact O-CB 3.36Å; S361-R365 PolarHBondContact O-N 2.87Å; L362-R365 VanDerWaalsContact CD1-NH1 3.32Å; L362-R365 WeakPolarHBondContact O-CB 3.31Å; L362-R365 PolarHBondContact O-N 3.31Å; L362-R365 VanDerWaalsContact O-N 3.15Å; L363-R365 PolarHBondContact O-N 3.02Å; R365-E367 VanDerWaalsContact C-N 3.29Å; R365-E367 PolarHBondContact O-N 3.47Å; R365-R368 PolarHBondContact O-N 3.23Å; R365-A369 PolarHBondContact O-N 2.85Å; R365-A369 VanDerWaalsContact O-N 3.08Å
366	L	94.4	Very high	91.9	Very high	20 Å²	20	64.7 Å²	64.7	11%	0.105	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-37	176.7	-69.5	174.9	0	0	0	111.3	I63 Y65 F97 L362 L363 A369 Q370	I63-L366 HydrophobicContact CD1-CB 4.07Å; I63-L366 HydrophobicContact CD1-CD1 4.14Å; Y65-L366 HydrophobicContact CD2-CD1 4.26Å; Y65-L366 HydrophobicContact CE2-CD1 4.44Å; F97-L366 HydrophobicContact CE2-CD1 3.91Å; F97-L366 HydrophobicContact CZ-CD1 3.75Å; L362-L366 HydrophobicContact CD1-CD1 4.03Å; L362-L366 HydrophobicContact CD1-CG 4.08Å; L362-L366 HydrophobicContact CG-CD1 4.07Å; L362-L366 HydrophobicContact CG-CG 4.49Å; L362-L366 WeakPolarHBondContact O-CG 3.2Å; L362-L366 PolarHBondContact O-N 3.28Å; L363-L366 PolarHBondContact O-N 2.89Å; L366-A369 PolarHBondContact O-N 3.48Å; L366-Q370 WeakPolarHBondContact O-CG 3.49Å; L366-Q370 PolarHBondContact O-N 3.02Å
367	E	93.9	Very high	90.6	Very high	49 Å²	49	70.2 Å²	70.2	23%	0.229	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-52.2	174.3	-176.1	-174	-157.3	0	0	111.9	L62 I63 L363 R365 A369 Q370 L371	L62-E367 HydrophobicContact CD1-CG 4.4Å; L62-E367 WeakPolarHBondContact CD1-OE1 3.3Å; L62-E367 WeakPolarHBondContact CD1-OE2 3.5Å; L62-E367 HydrophobicContact CG-CG 4.31Å; I63-E367 HydrophobicContact CG2-CB 3.52Å; I63-E367 HydrophobicContact CG2-CG 4.11Å; L363-E367 WeakPolarHBondContact O-CB 3.39Å; L363-E367 PolarHBondContact O-N 3.02Å; R365-E367 VanDerWaalsContact C-N 3.29Å; R365-E367 PolarHBondContact O-N 3.47Å; E367-A369 VanDerWaalsContact C-N 3.26Å; E367-A369 PolarHBondContact O-N 3.3Å; E367-Q370 PolarHBondContact O-N 3.22Å; E367-Q370 VanDerWaalsContact O-N 3.17Å; E367-L371 HydrophobicContact CG-CD1 4.17Å; E367-L371 WeakPolarHBondContact O-CG 3.36Å; E367-L371 PolarHBondContact O-N 3.44Å
368	R	93.9	Very high	88.9	Confident	156 Å²	156	69.3 Å²	69.3	59%	0.589	35%	0.354	S	S	*	.	H	α-helix	trans	-58.5	-39.6	176.9	-68.7	174.9	-147.7	157.5	3.8	112.3	L364 R365 L371 N372	L364-R368 WeakPolarHBondContact O-CG 3.09Å; L364-R368 PolarHBondContact O-N 2.84Å; R365-R368 PolarHBondContact O-N 3.23Å; R368-L371 PolarHBondContact O-N 3.45Å; R368-N372 WeakPolarHBondContact O-CB 3.48Å; R368-N372 PolarHBondContact O-N 3.02Å; R368-N372 PolarHBondContact O-ND2 3.25Å; R368-N372 PolarHBondContact O-OD1 3.45Å
369	A	91.5	Very high	87.2	Confident	44 Å²	44	74.8 Å²	74.8	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-46.5	176.9	0	0	0	0	0	111.7	R365 L366 E367 L371 N372 E373	R365-A369 PolarHBondContact O-N 2.85Å; R365-A369 VanDerWaalsContact O-N 3.08Å; L366-A369 PolarHBondContact O-N 3.48Å; E367-A369 VanDerWaalsContact C-N 3.26Å; E367-A369 PolarHBondContact O-N 3.3Å; A369-L371 PolarHBondContact O-N 3.04Å; A369-N372 PolarHBondContact O-N 2.76Å; A369-E373 PolarHBondContact O-N 3.39Å; A369-E373 VanDerWaalsContact O-N 3.08Å
370	Q	91.5	Very high	84.8	Confident	15 Å²	15	86.3 Å²	86.3	7%	0.07	43%	0.429	C	S	.	.	H	α-helix	trans	-66	-35.9	178.7	-71.2	-178.9	34.3	0	0	113.1	Q64 V67 L366 E367 Q374	Q64-Q370 VanDerWaalsContact N-OE1 3.11Å; Q64-Q370 PolarHBondContact O-NE2 2.96Å; Q64-Q370 PolarHBondContact O-OE1 2.99Å; V67-Q370 HydrophobicContact CG2-CG 4.17Å; L366-Q370 WeakPolarHBondContact O-CG 3.49Å; L366-Q370 PolarHBondContact O-N 3.02Å; E367-Q370 PolarHBondContact O-N 3.22Å; E367-Q370 VanDerWaalsContact O-N 3.17Å; Q370-Q374 VanDerWaalsContact O-CG 3.3Å; Q370-Q374 WeakPolarHBondContact O-CG 3.48Å; Q370-Q374 PolarHBondContact O-N 2.86Å; Q370-Q374 VanDerWaalsContact O-N 3.12Å
371	L	89.1	Confident	84.1	Confident	82 Å²	82	88.3 Å²	88.3	43%	0.429	44%	0.442	S	S	.	.	H	α-helix	trans	-66.4	-40.4	174.6	-72.1	171.4	0	0	0	111.8	E367 R368 A369 Q374 N375	E367-L371 HydrophobicContact CG-CD1 4.17Å; E367-L371 WeakPolarHBondContact O-CG 3.36Å; E367-L371 PolarHBondContact O-N 3.44Å; R368-L371 PolarHBondContact O-N 3.45Å; A369-L371 PolarHBondContact O-N 3.04Å; L371-Q374 PolarHBondContact O-N 2.92Å; L371-N375 VanDerWaalsContact O-CG 3.24Å; L371-N375 PolarHBondContact O-N 3.43Å; L371-N375 PolarHBondContact O-ND2 3.39Å
372	N	88.3	Confident	83.4	Confident	96 Å²	96	89.2 Å²	89.2	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-65.9	-40.5	178.2	-71.4	-9.5	0	0	0	112.1	R368 A369 N375 Q376	R368-N372 WeakPolarHBondContact O-CB 3.48Å; R368-N372 PolarHBondContact O-N 3.02Å; R368-N372 PolarHBondContact O-ND2 3.25Å; R368-N372 PolarHBondContact O-OD1 3.45Å; A369-N372 PolarHBondContact O-N 2.76Å; N372-N375 PolarHBondContact O-N 3.5Å; N372-Q376 WeakPolarHBondContact O-CG 3.36Å; N372-Q376 PolarHBondContact O-N 3.22Å; N372-Q376 VanDerWaalsContact O-N 3.13Å
373	E	84.3	Confident	82.7	Confident	96 Å²	96	93.9 Å²	93.9	45%	0.449	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-44.6	175.3	-72.1	173.9	179	0	0	111.5	A369 N375 Q376 D377	A369-E373 PolarHBondContact O-N 3.39Å; A369-E373 VanDerWaalsContact O-N 3.08Å; E373-N375 VanDerWaalsContact C-N 3.3Å; E373-N375 PolarHBondContact O-N 3.23Å; E373-Q376 PolarHBondContact O-N 2.78Å; E373-D377 PolarHBondContact O-N 3.28Å
374	Q	79.6	Confident	81.9	Confident	104 Å²	104	99.4 Å²	99.4	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-36.7	177.1	-74.7	171.6	21.1	0	0	113.1	Q370 L371 A378	Q370-Q374 VanDerWaalsContact O-CG 3.3Å; Q370-Q374 WeakPolarHBondContact O-CG 3.48Å; Q370-Q374 PolarHBondContact O-N 2.86Å; Q370-Q374 VanDerWaalsContact O-N 3.12Å; L371-Q374 PolarHBondContact O-N 2.92Å; Q374-A378 WeakPolarHBondContact O-CB 3.23Å; Q374-A378 PolarHBondContact O-N 2.95Å
375	N	76.8	Confident	81	Confident	102 Å²	102	102.4 Å²	102.4	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-71.7	-34.3	177.6	-69.7	-20.8	0	0	0	112	L371 N372 E373 A378	L371-N375 VanDerWaalsContact O-CG 3.24Å; L371-N375 PolarHBondContact O-N 3.43Å; L371-N375 PolarHBondContact O-ND2 3.39Å; N372-N375 PolarHBondContact O-N 3.5Å; E373-N375 VanDerWaalsContact C-N 3.3Å; E373-N375 PolarHBondContact O-N 3.23Å; N375-A378 PolarHBondContact O-N 2.83Å
376	Q	72.6	Confident	80	Confident	127 Å²	127	100.9 Å²	100.9	59%	0.593	51%	0.505	S	S	*	.	H	α-helix	trans	-69.7	-39.4	175.7	-72.7	175.1	15	0	0	112.1	N372 E373 A378 E379	N372-Q376 WeakPolarHBondContact O-CG 3.36Å; N372-Q376 PolarHBondContact O-N 3.22Å; N372-Q376 VanDerWaalsContact O-N 3.13Å; E373-Q376 PolarHBondContact O-N 2.78Å; Q376-A378 PolarHBondContact O-N 2.82Å; Q376-E379 PolarHBondContact O-N 3.13Å
377	D	71.3	Confident	79	Confident	132 Å²	132	106.6 Å²	106.6	71%	0.706	53%	0.534	S	S	*	.	H	α-helix	trans	-69.9	-20.3	176.7	-73.7	-19.6	0	0	0	113.2	E373	E373-D377 PolarHBondContact O-N 3.28Å
378	A	63.3	Low	77.8	Confident	78 Å²	78	111.1 Å²	111.1	65%	0.645	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-12.7	179.1	0	0	0	0	0	114	Q374 N375 Q376	Q374-A378 WeakPolarHBondContact O-CB 3.23Å; Q374-A378 PolarHBondContact O-N 2.95Å; N375-A378 PolarHBondContact O-N 2.83Å; Q376-A378 PolarHBondContact O-N 2.82Å
379	E	60.4	Low	76.5	Confident	170 Å²	170	107.3 Å²	107.3	79%	0.794	56%	0.555	S	S	*	*			trans	-93.5	-3.7	179.1	-74.4	-174.3	163.5	0	0	113.7	Q376	Q376-E379 PolarHBondContact O-N 3.13Å
380	F	49	Very low	75.1	Confident	242 Å²	242	113.1 Å²	113.1	100%	1.061	57%	0.572	S	S	*	*			trans	-111.9	0	172.2	-75.5	-84	0	0	0	111.2

Retrieved 380 of 380 residues in 812.8 ms (Link to these results)

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