A0A087X8Q4_POEFO Loading...

Si:dkey-260j18.2

AlphaFold DB , UniProt , Accession A0A087X8Q4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 652 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	28.6	Very low	238 Å²	238	142.7 Å²	142.7	100%	1.172	83%	0.828	S	S	*	*				0	101.2	0	-76.7	170.4	171.7	0	0	107.9
2	N	26.3	Very low	28.6	Very low	166 Å²	166	149 Å²	149	89%	0.888	83%	0.828	S	S	*	*			trans	-143.8	108.6	170.8	-94.6	-16.5	0	0	0	107.1
3	A	28.2	Very low	28.6	Very low	104 Å²	104	145.3 Å²	145.3	86%	0.86	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.7	124.9	178.5	0	0	0	0	0	109.7
4	V	29.7	Very low	28.5	Very low	144 Å²	144	148.1 Å²	148.1	87%	0.873	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-91.2	117.4	174.7	176.6	0	0	0	0	107.7
5	R	32.3	Very low	28.7	Very low	245 Å²	245	146.2 Å²	146.2	93%	0.925	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.1	121	171.6	-73.7	-175.5	-178.6	-166.1	-0.4	109.4
6	G	27.9	Very low	28.6	Very low	77 Å²	77	152.8 Å²	152.8	79%	0.794	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-78.8	126.5	167.2	0	0	0	0	0	110.4
7	G	28.9	Very low	28.6	Very low	72 Å²	72	155.2 Å²	155.2	74%	0.742	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-97.4	119.4	173.6	0	0	0	0	0	110.7
8	T	28.3	Very low	28.7	Very low	141 Å²	141	155.6 Å²	155.6	87%	0.865	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.6	135.8	168.9	15.9	0	0	0	0	110
9	V	26.6	Very low	28.9	Very low	114 Å²	114	151.3 Å²	151.3	69%	0.691	83%	0.827	S	S	*	*			trans	-111	97.8	-177.2	-176.8	0	0	0	0	110.2	R556	V9-R556 PolarHBondContact O-NH1 3.1Å
10	T	27	Very low	29	Very low	120 Å²	120	152.4 Å²	152.4	74%	0.736	83%	0.832	S	S	*	*			trans	-74.7	146	177.2	47.4	0	0	0	0	112.3	R556	T10-R556 VanDerWaalsContact C-NH2 3.34Å; T10-R556 PolarHBondContact O-NH2 3.28Å
11	W	27.1	Very low	29.1	Very low	149 Å²	149	148.9 Å²	148.9	56%	0.564	83%	0.831	S	S	*	*			trans	-115.9	134.3	172.1	-169.2	70.6	0	0	0	109.2
12	R	29.3	Very low	28.9	Very low	218 Å²	218	141.5 Å²	141.5	82%	0.823	82%	0.816	S	S	*	*			trans	-129.9	139.7	174.2	-72.1	-172.7	178.9	-170.6	-1.3	109.4
13	P	28	Very low	29.2	Very low	101 Å²	101	137.9 Å²	137.9	66%	0.656	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.6	137.6	166.8	32	-29.5	0	0	0	110.2
14	Q	27.2	Very low	29.3	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-98	128.9	170.3	-83.4	-170.2	-36.5	0	0	110
15	P	31.3	Very low	29.5	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-79.4	155.6	159.8	3	14.8	0	0	0	111
16	W	27.3	Very low	30.2	Very low	251 Å²	251	132.7 Å²	132.7	95%	0.951	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.8	138.4	179.7	-76.8	48.1	0	0	0	111.8
17	Q	29	Very low	30.4	Very low	195 Å²	195	137 Å²	137	91%	0.911	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-94.3	120.9	168.2	-78.1	178.8	-15.5	0	0	109.2
18	D	30.2	Very low	30.5	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-92.6	137.4	152.7	-78.6	-36.1	0	0	0	108.3
19	G	32.1	Very low	30.7	Very low	74 Å²	74	139.3 Å²	139.3	76%	0.763	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-88.3	140.2	-177.1	0	0	0	0	0	113.4
20	D	30.8	Very low	31.1	Very low	173 Å²	173	139.5 Å²	139.5	93%	0.925	82%	0.816	S	S	*	*			trans	-174.1	129.9	143.9	-111.4	-17.3	0	0	0	104
21	G	31.1	Very low	31.6	Very low	79 Å²	79	141.9 Å²	141.9	81%	0.814	82%	0.824	S	S	*	*			cis	115	108.6	45.5	0	0	0	0	0	107
22	G	29.4	Very low	32	Very low	83 Å²	83	139.8 Å²	139.8	86%	0.856	83%	0.832	S	S	*	*			trans	133	118.8	162.8	0	0	0	0	0	116
23	G	31.2	Very low	32.7	Very low	90 Å²	90	139.2 Å²	139.2	93%	0.928	84%	0.839	S	S	*	*			trans	-73.2	174.9	-176.6	0	0	0	0	0	116.5
24	G	29.9	Very low	33	Very low	81 Å²	81	142.6 Å²	142.6	84%	0.835	85%	0.846	S	S	*	*			trans	164.5	107.3	169.1	0	0	0	0	0	112.4
25	E	34.6	Very low	33.6	Very low	198 Å²	198	141.9 Å²	141.9	93%	0.925	84%	0.843	S	S	*	*			trans	-72.7	174.2	177.2	-101.8	-168.8	170.1	0	0	113.8
26	P	48.2	Very low	33.7	Very low	104 Å²	104	144.3 Å²	144.3	68%	0.675	85%	0.849	S	S	*	*			trans	-102.4	157.8	-144.1	39.6	-34.5	0	0	0	114.5
27	L	31.5	Very low	34.2	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	84%	0.839	S	S	*	*			trans	-148.5	118	161	-76.9	176.7	0	0	0	113.7
28	S	31	Very low	34.9	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	83%	0.832	S	S	*	*			trans	28.4	125.1	140.7	63.7	0	0	0	0	123.4
29	D	31.6	Very low	35.6	Very low	161 Å²	161	136.6 Å²	136.6	86%	0.861	83%	0.831	S	S	*	*			trans	25.3	118.5	133.2	-64.5	-15.3	0	0	0	120.2
30	S	34.8	Very low	36.3	Very low	118 Å²	118	137.3 Å²	137.3	83%	0.825	82%	0.817	S	S	*	*				-162.6	136.1	128.4	44.3	0	0	0	0	111.5
31	D	37.3	Very low	37.4	Very low	171 Å²	171	134.1 Å²	134.1	91%	0.914	81%	0.809	S	S	*	*			trans	-62.3	133.3	179.8	-68.2	-54.8	0	0	0	113.6
32	S	36	Very low	39	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	81%	0.807	S	S	*	*			trans	-154.3	121.3	151.6	47.8	0	0	0	0	109.7	E34	S32-E34 PolarHBondContact O-N 3.28Å
33	E	44.6	Very low	40.5	Very low	206 Å²	206	135.1 Å²	135.1	96%	0.963	78%	0.783	S	S	*	*			trans	-68.2	100.7	174.4	-62.7	175.5	153.5	0	0	109.5
34	E	34.3	Very low	42.5	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.804	76%	0.762	S	S	*	*			trans	-119.2	131	163.3	-72	-165.9	164.7	0	0	108.7	S32 D36	S32-E34 PolarHBondContact O-N 3.28Å; E34-D36 PolarHBondContact O-N 3.13Å
35	E	40.3	Very low	44.9	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	76%	0.755	S	S	*	*			trans	-54	123.5	177.6	-63.7	-178.8	154	0	0	110	F37	E35-F37 VanDerWaalsContact C-N 3.3Å; E35-F37 PolarHBondContact O-N 3.11Å
36	D	33.1	Very low	47	Very low	170 Å²	170	129.4 Å²	129.4	91%	0.909	73%	0.731	S	S	*	*			trans	-56.4	86.1	177.7	-89.4	-38.1	0	0	0	111.1	E34 P38	E34-D36 PolarHBondContact O-N 3.13Å; D36-P38 WeakPolarHBondContact O-CD 3.37Å
37	F	38.6	Very low	48.4	Very low	170 Å²	170	128.9 Å²	128.9	75%	0.746	72%	0.723	S	S	*	*			trans	-78	117.2	152.2	-78.8	-86.9	0	0	0	106.5	E35 D39	E35-F37 VanDerWaalsContact C-N 3.3Å; E35-F37 PolarHBondContact O-N 3.11Å; F37-D39 PolarHBondContact O-N 3.02Å
38	P	42.1	Very low	50.8	Low	117 Å²	117	128.8 Å²	128.8	76%	0.76	71%	0.712	S	S	*	*			trans	-62.5	108.5	175.1	22.2	-29	0	0	0	109	D36 D40	D36-P38 WeakPolarHBondContact O-CD 3.37Å; P38-D40 PolarHBondContact O-N 3.19Å
39	D	46.4	Very low	53.3	Low	159 Å²	159	128.1 Å²	128.1	85%	0.85	70%	0.7	S	S	*	*			trans	-65.4	94.1	171.6	-165.8	19	0	0	0	108	F37	F37-D39 PolarHBondContact O-N 3.02Å
40	D	44.9	Very low	55.8	Low	88 Å²	88	123.2 Å²	123.2	47%	0.471	68%	0.676	S	S	.	*			trans	-125.5	73.5	-171.2	-152.4	11.2	0	0	0	111.3	P38 T42 T43	P38-D40 PolarHBondContact O-N 3.19Å; D40-T42 PolarHBondContact O-N 2.67Å; D40-T43 WeakPolarHBondContact CB-OG1 2.98Å; D40-T43 VanDerWaalsContact OD2-CB 3.32Å; D40-T43 WeakPolarHBondContact OD2-CB 3.21Å; D40-T43 WeakPolarHBondContact OD2-CG2 3.11Å; D40-T43 PolarHBondContact OD2-OG1 3.09Å
41	S	54.7	Low	58.1	Low	106 Å²	106	123.2 Å²	123.2	74%	0.741	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	68.9	160.2	55.5	0	0	0	0	109.7
42	T	64.9	Low	60.4	Low	126 Å²	126	116.2 Å²	116.2	77%	0.773	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	174.5	7.3	151.4	32.6	0	0	0	0	114.7	D40 P44	D40-T42 PolarHBondContact O-N 2.67Å; T42-P44 WeakPolarHBondContact O-CD 3.17Å
43	T	59.9	Low	62.9	Low	57 Å²	57	113.3 Å²	113.3	35%	0.35	61%	0.607	S	S	.	*			trans	-66.1	125.5	172.4	15.4	0	0	0	0	110.9	D40 L45	D40-T43 WeakPolarHBondContact CB-OG1 2.98Å; D40-T43 VanDerWaalsContact OD2-CB 3.32Å; D40-T43 WeakPolarHBondContact OD2-CB 3.21Å; D40-T43 WeakPolarHBondContact OD2-CG2 3.11Å; D40-T43 PolarHBondContact OD2-OG1 3.09Å; T43-L45 PolarHBondContact O-N 2.74Å
44	P	75.1	Confident	64.9	Low	77 Å²	77	105.9 Å²	105.9	50%	0.5	57%	0.571	S	S	.	*			trans	-56	137	173.1	-22	32.1	0	0	0	109.9	T42 G46 D47 Y48	T42-P44 WeakPolarHBondContact O-CD 3.17Å; P44-G46 PolarHBondContact O-N 3.09Å; P44-D47 PolarHBondContact O-N 3.36Å; P44-Y48 PolarHBondContact O-N 2.95Å
45	L	78.9	Confident	67.4	Low	130 Å²	130	102.9 Å²	102.9	68%	0.681	56%	0.557	S	S	*	*	H	α-helix	trans	-49	-33	-179.7	178.7	63.7	0	0	0	113.1	T43 I49	T43-L45 PolarHBondContact O-N 2.74Å; L45-I49 HydrophobicContact CD1-CD1 4.08Å; L45-I49 HydrophobicContact CD1-CG1 4.3Å; L45-I49 HydrophobicContact CG-CD1 3.86Å; L45-I49 HydrophobicContact CG-CG1 4.49Å; L45-I49 VanDerWaalsContact O-CG1 3.25Å; L45-I49 WeakPolarHBondContact O-CG1 3.49Å; L45-I49 PolarHBondContact O-N 2.99Å
46	G	78.4	Confident	69.8	Low	42 Å²	42	97 Å²	97	43%	0.433	53%	0.531	S	S	.	.	H	α-helix	trans	-61.5	-42.4	175.8	0	0	0	0	0	113.8	P44 I49 T50	P44-G46 PolarHBondContact O-N 3.09Å; G46-I49 PolarHBondContact O-N 3.2Å; G46-T50 WeakPolarHBondContact O-CG2 3.42Å; G46-T50 PolarHBondContact O-N 3.5Å; G46-T50 PolarHBondContact O-OG1 3.47Å
47	D	77.5	Confident	72.4	Confident	93 Å²	93	90 Å²	90	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-73.2	-34.3	-178.6	-65	-24	0	0	0	111.3	P44 T50 H51	P44-D47 PolarHBondContact O-N 3.36Å; D47-T50 WeakPolarHBondContact CA-OG1 3.44Å; D47-T50 PolarHBondContact O-OG1 3.49Å; D47-H51 VanDerWaalsContact O-CB 3.27Å; D47-H51 WeakPolarHBondContact O-CB 3.45Å; D47-H51 PolarHBondContact O-N 2.87Å
48	Y	82.1	Confident	74.7	Confident	168 Å²	168	86.9 Å²	86.9	66%	0.659	49%	0.485	S	S	*	.	H	α-helix	trans	-64.8	-42.9	172.9	-168.1	-91.3	0	0	0	111.5	P44 G52	P44-Y48 PolarHBondContact O-N 2.95Å; Y48-G52 PolarHBondContact O-N 2.94Å
49	I	84.4	Confident	76.9	Confident	84 Å²	84	84 Å²	84	43%	0.431	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-45.2	177.6	-69.3	168.3	0	0	0	111.2	L45 G46 G52 L53	L45-I49 HydrophobicContact CD1-CD1 4.08Å; L45-I49 HydrophobicContact CD1-CG1 4.3Å; L45-I49 HydrophobicContact CG-CD1 3.86Å; L45-I49 HydrophobicContact CG-CG1 4.49Å; L45-I49 VanDerWaalsContact O-CG1 3.25Å; L45-I49 WeakPolarHBondContact O-CG1 3.49Å; L45-I49 PolarHBondContact O-N 2.99Å; G46-I49 PolarHBondContact O-N 3.2Å; I49-G52 PolarHBondContact O-N 3.23Å; I49-L53 HydrophobicContact CG2-CD1 3.75Å; I49-L53 HydrophobicContact CG2-CG 4.25Å; I49-L53 WeakPolarHBondContact O-CB 3.19Å; I49-L53 VanDerWaalsContact O-CG 3.26Å; I49-L53 WeakPolarHBondContact O-CG 3.38Å; I49-L53 PolarHBondContact O-N 2.9Å
50	T	83.1	Confident	78.9	Confident	59 Å²	59	82.4 Å²	82.4	36%	0.362	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-40.5	178.8	50.3	0	0	0	0	111.5	G46 D47 L53 K54	G46-T50 WeakPolarHBondContact O-CG2 3.42Å; G46-T50 PolarHBondContact O-N 3.5Å; G46-T50 PolarHBondContact O-OG1 3.47Å; D47-T50 WeakPolarHBondContact CA-OG1 3.44Å; D47-T50 PolarHBondContact O-OG1 3.49Å; T50-L53 PolarHBondContact O-N 3.39Å; T50-K54 WeakPolarHBondContact O-CB 3.38Å; T50-K54 PolarHBondContact O-N 3.33Å
51	H	84	Confident	80.9	Confident	118 Å²	118	83.5 Å²	83.5	55%	0.546	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-46.6	174.9	-165.4	71.2	0	0	0	111.9	D47 L53 K54 Q55	D47-H51 VanDerWaalsContact O-CB 3.27Å; D47-H51 WeakPolarHBondContact O-CB 3.45Å; D47-H51 PolarHBondContact O-N 2.87Å; H51-L53 PolarHBondContact O-N 2.89Å; H51-K54 PolarHBondContact O-N 2.79Å; H51-Q55 PolarHBondContact CD2-NE2 3.05Å; H51-Q55 PolarHBondContact NE2-NE2 3.19Å; H51-Q55 WeakPolarHBondContact O-CG 3.34Å; H51-Q55 PolarHBondContact O-N 3.2Å
52	G	86.3	Confident	82.4	Confident	24 Å²	24	85.1 Å²	85.1	25%	0.247	46%	0.46	C	S	.	.	H	α-helix	trans	-61.4	-43.7	176.1	0	0	0	0	0	113	Y48 I49 K54 Q55 L56	Y48-G52 PolarHBondContact O-N 2.94Å; I49-G52 PolarHBondContact O-N 3.23Å; G52-K54 VanDerWaalsContact C-N 3.29Å; G52-K54 PolarHBondContact O-N 3.38Å; G52-Q55 PolarHBondContact O-N 3.25Å; G52-L56 WeakPolarHBondContact O-CG 3.38Å; G52-L56 PolarHBondContact O-N 3.41Å
53	L	86.6	Confident	83.4	Confident	43 Å²	43	80.4 Å²	80.4	23%	0.225	43%	0.432	C	S	.	.	H	α-helix	trans	-63.5	-35.1	175.7	-74.3	171.6	0	0	0	112.4	I49 T50 H51 L56 L57 L80 Y122	I49-L53 HydrophobicContact CG2-CD1 3.75Å; I49-L53 HydrophobicContact CG2-CG 4.25Å; I49-L53 WeakPolarHBondContact O-CB 3.19Å; I49-L53 VanDerWaalsContact O-CG 3.26Å; I49-L53 WeakPolarHBondContact O-CG 3.38Å; I49-L53 PolarHBondContact O-N 2.9Å; T50-L53 PolarHBondContact O-N 3.39Å; H51-L53 PolarHBondContact O-N 2.89Å; L53-L56 HydrophobicContact CD2-CD1 4.48Å; L53-L57 PolarHBondContact O-N 2.81Å; L53-L57 VanDerWaalsContact O-N 3.09Å; L53-L80 HydrophobicContact CD1-CD1 4.07Å; L53-L80 HydrophobicContact CD1-CD2 4.45Å; L53-Y122 HydrophobicContact CB-CD1 4.19Å; L53-Y122 HydrophobicContact CB-CE1 4.48Å
54	K	86.6	Confident	84.8	Confident	49 Å²	49	81.2 Å²	81.2	21%	0.213	43%	0.434	C	S	.	.	H	α-helix	trans	-68.9	-42	175.3	-176.1	60.9	172	75	0	111.8	T50 H51 G52 L56 L57 D58 T123	T50-K54 WeakPolarHBondContact O-CB 3.38Å; T50-K54 PolarHBondContact O-N 3.33Å; H51-K54 PolarHBondContact O-N 2.79Å; G52-K54 VanDerWaalsContact C-N 3.29Å; G52-K54 PolarHBondContact O-N 3.38Å; K54-L56 VanDerWaalsContact C-N 3.32Å; K54-L56 PolarHBondContact O-N 2.89Å; K54-L57 HydrophobicContact CD-CD2 4.34Å; K54-L57 WeakPolarHBondContact O-CB 3.49Å; K54-L57 PolarHBondContact O-N 3.38Å; K54-D58 IonicContact NZ-OD1 3.11Å; K54-D58 PolarHBondContact NZ-OD1 3.17Å; K54-D58 IonicContact NZ-OD2 2.62Å; K54-D58 PolarHBondContact NZ-OD2 2.71Å; K54-D58 PolarHBondContact O-N 2.98Å; K54-T123 HydrophobicContact CD-CG2 4.17Å; K54-T123 HydrophobicContact CG-CG2 4.43Å
55	Q	88.1	Confident	85.5	Confident	109 Å²	109	77.6 Å²	77.6	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-60.6	-42	174.5	-70.6	178.6	-3.1	0	0	111.7	H51 G52 L57 D58 A59	H51-Q55 PolarHBondContact CD2-NE2 3.05Å; H51-Q55 PolarHBondContact NE2-NE2 3.19Å; H51-Q55 WeakPolarHBondContact O-CG 3.34Å; H51-Q55 PolarHBondContact O-N 3.2Å; G52-Q55 PolarHBondContact O-N 3.25Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.28Å; Q55-D58 PolarHBondContact O-N 2.81Å; Q55-A59 WeakPolarHBondContact O-CB 3.33Å; Q55-A59 PolarHBondContact O-N 2.94Å
56	L	89.2	Confident	86.1	Confident	47 Å²	47	72.7 Å²	72.7	25%	0.246	39%	0.386	C	S	.	.	H	α-helix	trans	-61.2	-40.8	174.9	-71.2	172.1	0	0	0	112.1	G52 L53 K54 Q60 Q61 L62	G52-L56 WeakPolarHBondContact O-CG 3.38Å; G52-L56 PolarHBondContact O-N 3.41Å; L53-L56 HydrophobicContact CD2-CD1 4.48Å; K54-L56 VanDerWaalsContact C-N 3.32Å; K54-L56 PolarHBondContact O-N 2.89Å; L56-Q60 PolarHBondContact O-N 3.46Å; L56-Q61 HydrophobicContact CD2-CB 3.91Å; L56-Q61 PolarHBondContact O-N 3.12Å; L56-L62 HydrophobicContact CD1-CD1 4.43Å; L56-L62 HydrophobicContact CD2-CD1 4.41Å
57	L	88.4	Confident	86.7	Confident	23 Å²	23	70.7 Å²	70.7	12%	0.12	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-45.2	174.7	-178.6	68.1	0	0	0	111.9	L53 K54 Q55 A59 Q60 M75 I118 Y122	L53-L57 PolarHBondContact O-N 2.81Å; L53-L57 VanDerWaalsContact O-N 3.09Å; K54-L57 HydrophobicContact CD-CD2 4.34Å; K54-L57 WeakPolarHBondContact O-CB 3.49Å; K54-L57 PolarHBondContact O-N 3.38Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.28Å; L57-A59 VanDerWaalsContact C-N 3.33Å; L57-A59 PolarHBondContact O-N 3.36Å; L57-Q60 PolarHBondContact O-N 2.9Å; L57-M75 WeakPolarHBondContact CD1-O 3.45Å; L57-I118 HydrophobicContact CD2-CG2 3.97Å; L57-Y122 HydrophobicContact CB-CD1 4.11Å; L57-Y122 HydrophobicContact CB-CE1 3.79Å; L57-Y122 HydrophobicContact CD1-CE1 4.34Å; L57-Y122 HydrophobicContact CD1-CE2 4.37Å; L57-Y122 HydrophobicContact CD2-CD1 3.99Å; L57-Y122 HydrophobicContact CD2-CD2 3.81Å; L57-Y122 HydrophobicContact CD2-CE1 3.98Å; L57-Y122 HydrophobicContact CD2-CE2 3.77Å; L57-Y122 HydrophobicContact CD2-CG 3.9Å; L57-Y122 HydrophobicContact CG-CE1 4.26Å
58	D	87.4	Confident	87.3	Confident	106 Å²	106	67.9 Å²	67.9	57%	0.567	35%	0.35	S	S	*	.	H	α-helix	trans	-67.3	-35.4	-178.6	-69.5	-22.5	0	0	0	112.1	K54 Q55 Q60	K54-D58 IonicContact NZ-OD1 3.11Å; K54-D58 PolarHBondContact NZ-OD1 3.17Å; K54-D58 IonicContact NZ-OD2 2.62Å; K54-D58 PolarHBondContact NZ-OD2 2.71Å; K54-D58 PolarHBondContact O-N 2.98Å; Q55-D58 PolarHBondContact O-N 2.81Å; D58-Q60 PolarHBondContact O-N 3.35Å
59	A	88.3	Confident	87.7	Confident	55 Å²	55	59.9 Å²	59.9	46%	0.455	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-3.7	172	0	0	0	0	0	113.6	Q55 L57 Q61	Q55-A59 WeakPolarHBondContact O-CB 3.33Å; Q55-A59 PolarHBondContact O-N 2.94Å; L57-A59 VanDerWaalsContact C-N 3.33Å; L57-A59 PolarHBondContact O-N 3.36Å; A59-Q61 HydrophobicContact CB-CG 3.82Å; A59-Q61 PolarHBondContact O-N 2.97Å
60	Q	87.1	Confident	87.7	Confident	127 Å²	127	62.9 Å²	62.9	59%	0.593	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	33	-173.9	-59	-176	-14.9	0	0	113.8	L56 L57 D58 M75	L56-Q60 PolarHBondContact O-N 3.46Å; L57-Q60 PolarHBondContact O-N 2.9Å; D58-Q60 PolarHBondContact O-N 3.35Å; Q60-M75 HydrophobicContact CB-CE 4.33Å
61	Q	86.9	Confident	87.6	Confident	111 Å²	111	63 Å²	63	52%	0.519	34%	0.344	S	S	.	.			trans	-91.5	141.1	-179.6	-68	178.8	-7.7	0	0	110.5	L56 A59 C63 H77	L56-Q61 HydrophobicContact CD2-CB 3.91Å; L56-Q61 PolarHBondContact O-N 3.12Å; A59-Q61 HydrophobicContact CB-CG 3.82Å; A59-Q61 PolarHBondContact O-N 2.97Å; Q61-C63 PolarHBondContact O-N 3.18Å; Q61-H77 PolarHBondContact O-NE2 2.86Å
62	L	86.6	Confident	87.9	Confident	139 Å²	139	61.6 Å²	61.6	73%	0.728	34%	0.336	S	S	*	.	S	Bend	trans	60.4	11.5	176.9	-53.2	175.3	0	0	0	115.7	L56 D64 H77	L56-L62 HydrophobicContact CD1-CD1 4.43Å; L56-L62 HydrophobicContact CD2-CD1 4.41Å; L62-D64 PolarHBondContact O-N 2.89Å; L62-H77 PolarHBondContact O-CD2 2.79Å
63	C	87.3	Confident	88.1	Confident	27 Å²	27	66.5 Å²	66.5	18%	0.182	35%	0.351	C	S	.	.			trans	-65.3	117.5	172.7	-65.7	0	0	0	0	111	Q61 M75 C76	Q61-C63 PolarHBondContact O-N 3.18Å; C63-M75 HydrophobicContact CB-CB 3.88Å; C63-M75 HydrophobicContact CB-CE 3.7Å; C63-C76 WeakPolarHBondContact CA-O 3.49Å
64	D	89.1	Confident	88.4	Confident	74 Å²	74	65.6 Å²	65.6	40%	0.396	35%	0.345	S	S	.	.			trans	-109	2.4	-174.6	61.5	-15.1	0	0	0	113.2	L62 C76 H77 R78	L62-D64 PolarHBondContact O-N 2.89Å; D64-C76 PolarHBondContact N-O 3.08Å; D64-H77 WeakPolarHBondContact OD1-CA 3.22Å; D64-R78 WeakPolarHBondContact OD1-CG 3.28Å; D64-R78 PolarHBondContact OD1-N 3.44Å; D64-R78 WeakPolarHBondContact OD2-CB 3.47Å; D64-R78 WeakPolarHBondContact OD2-CG 3.27Å
65	V	89.6	Confident	88.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.012	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	146.7	172.5	62.1	0	0	0	0	112.3	L67 M75 C76 R78 L81 F92 I104	V65-L67 HydrophobicContact CG2-CD2 4.1Å; V65-M75 WeakPolarHBondContact O-CA 3.49Å; V65-C76 HydrophobicContact CG1-CB 4.05Å; V65-C76 VanDerWaalsContact CG1-O 3.3Å; V65-C76 WeakPolarHBondContact CG1-O 3.44Å; V65-C76 PolarHBondContact N-O 2.87Å; V65-C76 PolarHBondContact O-N 3.32Å; V65-R78 HydrophobicContact CB-CG 3.5Å; V65-R78 VanDerWaalsContact CB-CG 3.5Å; V65-R78 HydrophobicContact CG1-CB 4.47Å; V65-R78 HydrophobicContact CG1-CG 3.5Å; V65-R78 VanDerWaalsContact CG1-CG 3.5Å; V65-R78 HydrophobicContact CG2-CG 4.39Å; V65-L81 HydrophobicContact CG1-CD1 4.13Å; V65-F92 HydrophobicContact CG2-CZ 4.49Å; V65-I104 HydrophobicContact CG2-CD1 3.74Å; V65-I104 HydrophobicContact CG2-CG1 4.2Å
66	T	91.2	Very high	88.7	Confident	26 Å²	26	61.4 Å²	61.4	16%	0.16	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.5	172	-57.6	0	0	0	0	110.3	K73 F74 N102 E103 I104	T66-K73 HydrophobicContact CG2-CB 3.91Å; T66-K73 HydrophobicContact CG2-CD 4.25Å; T66-K73 HydrophobicContact CG2-CG 4.22Å; T66-F74 CarbonylContact C-O 3.59Å; T66-F74 WeakPolarHBondContact CA-O 3.46Å; T66-N102 PolarHBondContact N-O 2.95Å; T66-E103 CarbonylContact O-C 3.48Å; T66-E103 WeakPolarHBondContact O-CA 3.25Å; T66-I104 PolarHBondContact O-N 2.75Å
67	L	90.2	Very high	88.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.4	175.2	-53.8	178.6	0	0	0	109.2	V65 F74 L81 F88 I104 L106 M114	V65-L67 HydrophobicContact CG2-CD2 4.1Å; L67-F74 HydrophobicContact CB-CB 4.35Å; L67-F74 PolarHBondContact N-O 3.44Å; L67-F74 PolarHBondContact O-N 3.44Å; L67-L81 HydrophobicContact CD1-CD1 3.97Å; L67-F88 HydrophobicContact CD1-CZ 4.26Å; L67-F88 HydrophobicContact CD2-CE1 4.32Å; L67-I104 CarbonylContact C-O 3.58Å; L67-I104 WeakPolarHBondContact CA-O 3.42Å; L67-I104 HydrophobicContact CD2-CB 3.98Å; L67-I104 HydrophobicContact CD2-CD1 4.47Å; L67-I104 HydrophobicContact CD2-CG2 4.37Å; L67-L106 HydrophobicContact CB-CD1 4.46Å; L67-L106 HydrophobicContact CD1-CD1 4.36Å; L67-L106 HydrophobicContact CD2-CD1 4.44Å; L67-M114 HydrophobicContact CB-CE 4.41Å; L67-M114 HydrophobicContact CD1-CE 3.2Å; L67-M114 HydrophobicContact CG-CE 4.39Å
68	L	90.4	Very high	88.9	Confident	35 Å²	35	60.7 Å²	60.7	18%	0.183	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.2	177.2	-171.3	78.8	0	0	0	109.3	K72 K73 I104 R105 L106	L68-K72 WeakPolarHBondContact CA-O 3.21Å; L68-K73 HydrophobicContact CD1-CG 3.65Å; L68-I104 PolarHBondContact N-O 2.88Å; L68-R105 HydrophobicContact CB-CG 4.26Å; L68-R105 HydrophobicContact CD2-CG 3.87Å; L68-R105 WeakPolarHBondContact O-CA 3.47Å; L68-L106 PolarHBondContact O-N 3.09Å
69	V	90.3	Very high	89	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	115.3	-179.2	-174.5	0	0	0	0	108.8	G71 K72 F74 L106 V109 P111 M114	V69-G71 PolarHBondContact O-N 3.21Å; V69-K72 PolarHBondContact N-O 2.78Å; V69-K72 PolarHBondContact O-N 3.42Å; V69-F74 HydrophobicContact CB-CE2 4.14Å; V69-F74 HydrophobicContact CG2-CD2 4.26Å; V69-F74 HydrophobicContact CG2-CE2 4.27Å; V69-L106 HydrophobicContact CG2-CB 4.23Å; V69-L106 HydrophobicContact CG2-CD1 4.46Å; V69-V109 HydrophobicContact CG1-CB 4.44Å; V69-V109 WeakPolarHBondContact CG1-O 3.44Å; V69-P111 HydrophobicContact CG1-CG 4.28Å; V69-M114 HydrophobicContact CG2-CB 4.27Å; V69-M114 HydrophobicContact CG2-CG 3.9Å
70	E	86	Confident	89.1	Confident	146 Å²	146	59.5 Å²	59.5	68%	0.682	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	35	-177.7	-58.7	-172	152.5	0	0	114.1	P111	E70-P111 HydrophobicContact CB-CG 4.01Å; E70-P111 WeakPolarHBondContact OE2-CD 3.46Å
71	G	80.6	Confident	89.2	Confident	62 Å²	62	53.6 Å²	53.6	64%	0.639	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-10.4	-179.3	0	0	0	0	0	115.9	V69	V69-G71 PolarHBondContact O-N 3.21Å
72	K	89.9	Confident	89.4	Confident	89 Å²	89	49 Å²	49	39%	0.387	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	132.8	171.2	-169.4	172.8	173	-171.7	0	110	L68 V69 F74 P111 E115	L68-K72 WeakPolarHBondContact CA-O 3.21Å; V69-K72 PolarHBondContact N-O 2.78Å; V69-K72 PolarHBondContact O-N 3.42Å; K72-F74 HydrophobicContact CB-CE2 4Å; K72-F74 HydrophobicContact CB-CZ 4.42Å; K72-F74 HydrophobicContact CD-CE1 4.11Å; K72-F74 HydrophobicContact CD-CE2 3.95Å; K72-F74 HydrophobicContact CD-CZ 3.48Å; K72-F74 VanDerWaalsContact CD-CZ 3.48Å; K72-F74 HydrophobicContact CG-CD2 4.47Å; K72-F74 HydrophobicContact CG-CE1 4.48Å; K72-F74 HydrophobicContact CG-CE2 3.82Å; K72-F74 HydrophobicContact CG-CZ 3.85Å; K72-P111 HydrophobicContact CB-CB 4.28Å; K72-P111 HydrophobicContact CB-CG 4.46Å; K72-P111 HydrophobicContact CD-CB 3.96Å; K72-E115 IonicContact NZ-OE2 2.72Å; K72-E115 PolarHBondContact NZ-OE2 3.03Å
73	K	91.3	Very high	89.5	Confident	127 Å²	127	45.2 Å²	45.2	55%	0.552	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.2	178.1	-66.2	-169.8	178.6	-155	0	110.6	T66 L68 E103	T66-K73 HydrophobicContact CG2-CB 3.91Å; T66-K73 HydrophobicContact CG2-CD 4.25Å; T66-K73 HydrophobicContact CG2-CG 4.22Å; L68-K73 HydrophobicContact CD1-CG 3.65Å; K73-E103 IonicContact NZ-OE1 3.9Å; K73-E103 PolarHBondContact NZ-OE1 3.17Å
74	F	91.2	Very high	89.6	Confident	23 Å²	23	46.2 Å²	46.2	10%	0.101	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.3	175.7	-63.2	-88	0	0	0	110	T66 L67 V69 K72 P111 M114 E115 I118	T66-F74 CarbonylContact C-O 3.59Å; T66-F74 WeakPolarHBondContact CA-O 3.46Å; L67-F74 HydrophobicContact CB-CB 4.35Å; L67-F74 PolarHBondContact N-O 3.44Å; L67-F74 PolarHBondContact O-N 3.44Å; V69-F74 HydrophobicContact CB-CE2 4.14Å; V69-F74 HydrophobicContact CG2-CD2 4.26Å; V69-F74 HydrophobicContact CG2-CE2 4.27Å; K72-F74 HydrophobicContact CB-CE2 4Å; K72-F74 HydrophobicContact CB-CZ 4.42Å; K72-F74 HydrophobicContact CD-CE1 4.11Å; K72-F74 HydrophobicContact CD-CE2 3.95Å; K72-F74 HydrophobicContact CD-CZ 3.48Å; K72-F74 VanDerWaalsContact CD-CZ 3.48Å; K72-F74 HydrophobicContact CG-CD2 4.47Å; K72-F74 HydrophobicContact CG-CE1 4.48Å; K72-F74 HydrophobicContact CG-CE2 3.82Å; K72-F74 HydrophobicContact CG-CZ 3.85Å; F74-P111 HydrophobicContact CE2-CB 4.41Å; F74-P111 HydrophobicContact CZ-CB 4.25Å; F74-P111 WeakPolarHBondContact CZ-O 3.35Å; F74-M114 HydrophobicContact CD2-CG 4.41Å; F74-M114 HydrophobicContact CE2-CB 4.37Å; F74-M114 HydrophobicContact CE2-CG 4.36Å; F74-M114 HydrophobicContact CZ-CB 4.49Å; F74-E115 HydrophobicContact CE1-CB 4.09Å; F74-E115 HydrophobicContact CZ-CB 4.48Å; F74-I118 HydrophobicContact CB-CD1 3.72Å; F74-I118 HydrophobicContact CD1-CD1 3.78Å; F74-I118 HydrophobicContact CG-CD1 3.83Å
75	M	90.6	Very high	89.8	Confident	70 Å²	70	42.8 Å²	42.8	35%	0.345	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	133.2	175.3	-68	179.4	58.4	0	0	109.9	L57 Q60 C63 V65	L57-M75 WeakPolarHBondContact CD1-O 3.45Å; Q60-M75 HydrophobicContact CB-CE 4.33Å; C63-M75 HydrophobicContact CB-CB 3.88Å; C63-M75 HydrophobicContact CB-CE 3.7Å; V65-M75 WeakPolarHBondContact O-CA 3.49Å
76	C	92.1	Very high	89.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	171.9	-174	-73	0	0	0	0	111.6	C63 D64 V65 L81	C63-C76 WeakPolarHBondContact CA-O 3.49Å; D64-C76 PolarHBondContact N-O 3.08Å; V65-C76 HydrophobicContact CG1-CB 4.05Å; V65-C76 VanDerWaalsContact CG1-O 3.3Å; V65-C76 WeakPolarHBondContact CG1-O 3.44Å; V65-C76 PolarHBondContact N-O 2.87Å; V65-C76 PolarHBondContact O-N 3.32Å; C76-L81 HydrophobicContact CB-CD1 3.78Å
77	H	92	Very high	89.9	Confident	13 Å²	13	47.7 Å²	47.7	6%	0.06	26%	0.262	C	S	.	.			trans	-99.3	122.4	174.4	-56.5	91.3	0	0	0	111.6	Q61 L62 D64 V79 L80 L81 Y122	Q61-H77 PolarHBondContact O-NE2 2.86Å; L62-H77 PolarHBondContact O-CD2 2.79Å; D64-H77 WeakPolarHBondContact OD1-CA 3.22Å; H77-V79 VanDerWaalsContact C-N 3.31Å; H77-V79 HydrophobicContact CB-CG1 4.43Å; H77-V79 PolarHBondContact O-N 2.89Å; H77-L80 HydrophobicContact CB-CB 4.34Å; H77-L80 PolarHBondContact O-N 3.23Å; H77-L81 PolarHBondContact O-N 2.62Å; H77-Y122 PolarHBondContact N-OH 3.06Å; H77-Y122 AromaticContact ND1-CE1 3.61Å; H77-Y122 AromaticContact ND1-CZ 3.67Å; H77-Y122 PolarHBondContact ND1-OH 3.04Å
78	R	89.8	Confident	89.9	Confident	43 Å²	43	47.8 Å²	47.8	16%	0.162	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-41.4	-178.9	-66.8	178.5	82.6	161.7	2.8	111.9	D64 V65 L80 L81 A82 F92 S99	D64-R78 WeakPolarHBondContact OD1-CG 3.28Å; D64-R78 PolarHBondContact OD1-N 3.44Å; D64-R78 WeakPolarHBondContact OD2-CB 3.47Å; D64-R78 WeakPolarHBondContact OD2-CG 3.27Å; V65-R78 HydrophobicContact CB-CG 3.5Å; V65-R78 VanDerWaalsContact CB-CG 3.5Å; V65-R78 HydrophobicContact CG1-CB 4.47Å; V65-R78 HydrophobicContact CG1-CG 3.5Å; V65-R78 VanDerWaalsContact CG1-CG 3.5Å; V65-R78 HydrophobicContact CG2-CG 4.39Å; R78-L80 VanDerWaalsContact C-N 3.32Å; R78-L80 PolarHBondContact O-N 3.05Å; R78-L81 PolarHBondContact O-N 3.35Å; R78-A82 VanDerWaalsContact O-CB 3.27Å; R78-A82 WeakPolarHBondContact O-CB 3.3Å; R78-A82 PolarHBondContact O-N 2.92Å; R78-F92 HydrophobicContact CB-CD2 3.7Å; R78-F92 HydrophobicContact CB-CE2 3.77Å; R78-F92 HydrophobicContact CB-CG 4.46Å; R78-F92 HydrophobicContact CG-CD2 4.12Å; R78-F92 HydrophobicContact CG-CE2 3.97Å; R78-F92 HydrophobicContact CG-CZ 4.28Å; R78-S99 PolarHBondContact NH1-O 3.47Å; R78-S99 VanDerWaalsContact NH1-O 3.09Å; R78-S99 PolarHBondContact NH2-O 3.28Å
79	V	88.7	Confident	89.9	Confident	108 Å²	108	51.9 Å²	51.9	66%	0.655	28%	0.276	S	S	*	.	H	α-helix	trans	-60.1	-42.8	-178.7	65.5	0	0	0	0	111.6	H77 A83	H77-V79 VanDerWaalsContact C-N 3.31Å; H77-V79 HydrophobicContact CB-CG1 4.43Å; H77-V79 PolarHBondContact O-N 2.89Å; V79-A83 VanDerWaalsContact O-CB 3.28Å; V79-A83 WeakPolarHBondContact O-CB 3.48Å; V79-A83 PolarHBondContact O-N 2.85Å
80	L	89.4	Confident	89.8	Confident	27 Å²	27	54.8 Å²	54.8	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-72.4	-44.4	-178.3	-170.6	66.1	0	0	0	111.2	L53 H77 R78 A82 A83 V84 V121 Y122	L53-L80 HydrophobicContact CD1-CD1 4.07Å; L53-L80 HydrophobicContact CD1-CD2 4.45Å; H77-L80 HydrophobicContact CB-CB 4.34Å; H77-L80 PolarHBondContact O-N 3.23Å; R78-L80 VanDerWaalsContact C-N 3.32Å; R78-L80 PolarHBondContact O-N 3.05Å; L80-A82 VanDerWaalsContact C-N 3.35Å; L80-A82 PolarHBondContact O-N 3.03Å; L80-A83 WeakPolarHBondContact O-CB 3.48Å; L80-A83 PolarHBondContact O-N 2.98Å; L80-V84 PolarHBondContact O-N 3.47Å; L80-V84 VanDerWaalsContact O-N 3.08Å; L80-V121 HydrophobicContact CD2-CG1 3.85Å; L80-V121 HydrophobicContact CG-CG1 3.74Å; L80-Y122 HydrophobicContact CD2-CD1 3.47Å; L80-Y122 VanDerWaalsContact CD2-CD1 3.47Å; L80-Y122 HydrophobicContact CD2-CD2 3.75Å; L80-Y122 HydrophobicContact CD2-CE1 3.4Å; L80-Y122 VanDerWaalsContact CD2-CE1 3.4Å; L80-Y122 HydrophobicContact CD2-CE2 3.72Å; L80-Y122 HydrophobicContact CD2-CG 3.66Å
81	L	90.1	Very high	89.8	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-44.4	175.1	-71.2	172.9	0	0	0	111.5	V65 L67 C76 H77 R78 A83 V84 S85 F88 F92 V121	V65-L81 HydrophobicContact CG1-CD1 4.13Å; L67-L81 HydrophobicContact CD1-CD1 3.97Å; C76-L81 HydrophobicContact CB-CD1 3.78Å; H77-L81 PolarHBondContact O-N 2.62Å; R78-L81 PolarHBondContact O-N 3.35Å; L81-A83 VanDerWaalsContact C-N 3.35Å; L81-V84 PolarHBondContact O-N 3.22Å; L81-S85 VanDerWaalsContact O-CB 3.31Å; L81-S85 WeakPolarHBondContact O-CB 3.12Å; L81-S85 PolarHBondContact O-N 3.14Å; L81-F88 HydrophobicContact CB-CB 4.06Å; L81-F88 HydrophobicContact CB-CD2 4.01Å; L81-F88 HydrophobicContact CB-CG 4.08Å; L81-F88 HydrophobicContact CD2-CD2 4.1Å; L81-F88 HydrophobicContact CD2-CE2 4.09Å; L81-F92 HydrophobicContact CB-CE2 4.01Å; L81-F92 HydrophobicContact CD1-CE2 4.47Å; L81-F92 HydrophobicContact CD1-CZ 4.43Å; L81-V121 HydrophobicContact CD2-CG1 4.36Å
82	A	90.5	Very high	90.1	Very high	15 Å²	15	47.5 Å²	47.5	12%	0.124	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-30.2	175.9	0	0	0	0	0	113.3	R78 L80 R89 F92	R78-A82 VanDerWaalsContact O-CB 3.27Å; R78-A82 WeakPolarHBondContact O-CB 3.3Å; R78-A82 PolarHBondContact O-N 2.92Å; L80-A82 VanDerWaalsContact C-N 3.35Å; L80-A82 PolarHBondContact O-N 3.03Å; A82-R89 HydrophobicContact CB-CB 4.07Å; A82-R89 HydrophobicContact CB-CG 4.35Å; A82-R89 WeakPolarHBondContact O-CB 3.4Å; A82-R89 PolarHBondContact O-NE 3.4Å; A82-R89 PolarHBondContact O-NH2 3.16Å; A82-F92 HydrophobicContact CB-CD2 4.07Å
83	A	90.1	Very high	89.9	Confident	59 Å²	59	48.4 Å²	48.4	49%	0.488	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-43.5	175.6	0	0	0	0	0	111.1	V79 L80 L81 R89	V79-A83 VanDerWaalsContact O-CB 3.28Å; V79-A83 WeakPolarHBondContact O-CB 3.48Å; V79-A83 PolarHBondContact O-N 2.85Å; L80-A83 WeakPolarHBondContact O-CB 3.48Å; L80-A83 PolarHBondContact O-N 2.98Å; L81-A83 VanDerWaalsContact C-N 3.35Å; A83-R89 PolarHBondContact O-NH2 3Å
84	V	88.8	Confident	89.4	Confident	48 Å²	48	43.7 Å²	43.7	29%	0.291	25%	0.245	S	C	.	.	H	α-helix	trans	-90.3	-30	-173.4	-179.1	0	0	0	0	113.4	L80 L81 V121 V145	L80-V84 PolarHBondContact O-N 3.47Å; L80-V84 VanDerWaalsContact O-N 3.08Å; L81-V84 PolarHBondContact O-N 3.22Å; V84-V121 HydrophobicContact CB-CG1 4.39Å; V84-V121 HydrophobicContact CB-CG2 4.49Å; V84-V121 HydrophobicContact CG1-CG2 4.15Å; V84-V121 HydrophobicContact CG2-CG1 4.17Å; V84-V145 HydrophobicContact CG1-CG1 4.07Å
85	S	93.1	Very high	88.3	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.014	28%	0.279	C	S	.	.			trans	-119.4	119.1	-176.4	165	0	0	0	0	111.6	L81 Y87 F88 R89 L143	L81-S85 VanDerWaalsContact O-CB 3.31Å; L81-S85 WeakPolarHBondContact O-CB 3.12Å; L81-S85 PolarHBondContact O-N 3.14Å; S85-Y87 PolarHBondContact O-N 2.96Å; S85-Y87 WeakPolarHBondContact OG-CB 3.48Å; S85-Y87 PolarHBondContact OG-N 2.85Å; S85-F88 PolarHBondContact O-N 2.87Å; S85-F88 WeakPolarHBondContact OG-CD2 3.38Å; S85-F88 PolarHBondContact OG-N 2.94Å; S85-F88 VanDerWaalsContact OG-N 3.12Å; S85-R89 WeakPolarHBondContact O-CB 3.49Å; S85-R89 PolarHBondContact O-N 2.57Å; S85-L143 WeakPolarHBondContact CB-O 3.22Å; S85-L143 PolarHBondContact OG-O 3.43Å
86	P	92.4	Very high	87.5	Confident	59 Å²	59	50.3 Å²	50.3	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-64	-27.8	172	-17.9	30.2	0	0	0	113.2	R89 A90 Q144	P86-R89 PolarHBondContact O-N 3.24Å; P86-A90 WeakPolarHBondContact O-CB 3.19Å; P86-A90 PolarHBondContact O-N 2.83Å; P86-Q144 WeakPolarHBondContact CD-O 3.43Å; P86-Q144 HydrophobicContact CG-CB 4.46Å
87	Y	90.8	Very high	86.2	Confident	73 Å²	73	55.2 Å²	55.2	29%	0.286	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-52.8	173	171.9	-96.7	0	0	0	111.4	S85 R89 A90 M91 L106 L143	S85-Y87 PolarHBondContact O-N 2.96Å; S85-Y87 WeakPolarHBondContact OG-CB 3.48Å; S85-Y87 PolarHBondContact OG-N 2.85Å; Y87-R89 VanDerWaalsContact C-N 3.32Å; Y87-R89 PolarHBondContact O-N 2.97Å; Y87-A90 PolarHBondContact O-N 2.89Å; Y87-M91 HydrophobicContact CD1-CE 4.4Å; Y87-M91 HydrophobicContact CE1-CE 3.46Å; Y87-M91 VanDerWaalsContact CE1-CE 3.46Å; Y87-M91 HydrophobicContact CE2-CE 4.29Å; Y87-M91 VanDerWaalsContact CZ-CE 3.4Å; Y87-M91 WeakPolarHBondContact O-CB 3.33Å; Y87-M91 PolarHBondContact O-N 2.97Å; Y87-M91 WeakPolarHBondContact OH-CE 3.42Å; Y87-L106 HydrophobicContact CE1-CD2 4.24Å; Y87-L143 HydrophobicContact CD1-CD2 3.99Å; Y87-L143 HydrophobicContact CE1-CD2 3.92Å
88	F	90.2	Very high	85.1	Confident	2 Å²	2	59 Å²	59	1%	0.009	34%	0.336	C	S	.	.	H	α-helix	trans	-67.1	-34.4	176.7	-72.1	-57.5	0	0	0	112	L67 L81 S85 M91 F92 L106 M114 L143	L67-F88 HydrophobicContact CD1-CZ 4.26Å; L67-F88 HydrophobicContact CD2-CE1 4.32Å; L81-F88 HydrophobicContact CB-CB 4.06Å; L81-F88 HydrophobicContact CB-CD2 4.01Å; L81-F88 HydrophobicContact CB-CG 4.08Å; L81-F88 HydrophobicContact CD2-CD2 4.1Å; L81-F88 HydrophobicContact CD2-CE2 4.09Å; S85-F88 PolarHBondContact O-N 2.87Å; S85-F88 WeakPolarHBondContact OG-CD2 3.38Å; S85-F88 PolarHBondContact OG-N 2.94Å; S85-F88 VanDerWaalsContact OG-N 3.12Å; F88-M91 HydrophobicContact CD1-SD 4.36Å; F88-M91 PolarHBondContact O-N 3.4Å; F88-F92 HydrophobicContact CB-CD2 4.42Å; F88-F92 HydrophobicContact CB-CE2 3.9Å; F88-F92 HydrophobicContact CB-CZ 4.12Å; F88-F92 HydrophobicContact CD1-CE1 4.32Å; F88-F92 HydrophobicContact CD1-CE2 4.44Å; F88-F92 AromaticContact CD1-CZ 3.83Å; F88-F92 HydrophobicContact CD1-CZ 3.83Å; F88-F92 HydrophobicContact CG-CE2 4.46Å; F88-F92 HydrophobicContact CG-CZ 4.28Å; F88-F92 WeakPolarHBondContact O-CB 3.42Å; F88-F92 WeakPolarHBondContact O-CD2 3.38Å; F88-F92 WeakPolarHBondContact O-CG 3.26Å; F88-F92 PolarHBondContact O-N 3.09Å; F88-L106 HydrophobicContact CE1-CD1 4.33Å; F88-L106 HydrophobicContact CE1-CD2 4.48Å; F88-L106 HydrophobicContact CZ-CD1 4.08Å; F88-M114 HydrophobicContact CZ-CE 4.37Å; F88-L143 HydrophobicContact CE2-CD2 4.14Å; F88-L143 HydrophobicContact CZ-CD2 3.84Å
89	R	89.9	Confident	84.1	Confident	121 Å²	121	58 Å²	58	46%	0.457	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-54.1	173.4	-169	178.2	-60.3	-178.4	2.9	111.1	A82 A83 S85 P86 Y87 M91 F92 T93	A82-R89 HydrophobicContact CB-CB 4.07Å; A82-R89 HydrophobicContact CB-CG 4.35Å; A82-R89 WeakPolarHBondContact O-CB 3.4Å; A82-R89 PolarHBondContact O-NE 3.4Å; A82-R89 PolarHBondContact O-NH2 3.16Å; A83-R89 PolarHBondContact O-NH2 3Å; S85-R89 WeakPolarHBondContact O-CB 3.49Å; S85-R89 PolarHBondContact O-N 2.57Å; P86-R89 PolarHBondContact O-N 3.24Å; Y87-R89 VanDerWaalsContact C-N 3.32Å; Y87-R89 PolarHBondContact O-N 2.97Å; R89-M91 VanDerWaalsContact C-N 3.29Å; R89-M91 PolarHBondContact O-N 3.21Å; R89-F92 PolarHBondContact O-N 3.49Å; R89-T93 HydrophobicContact CG-CG2 4.43Å; R89-T93 WeakPolarHBondContact O-CB 3.31Å; R89-T93 WeakPolarHBondContact O-CG2 3.32Å; R89-T93 PolarHBondContact O-N 3.03Å; R89-T93 PolarHBondContact O-OG1 3.45Å
90	A	87.9	Confident	83.3	Confident	60 Å²	60	62.8 Å²	62.8	50%	0.496	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-41.2	178.9	0	0	0	0	0	111.4	P86 Y87 F92 S94	P86-A90 WeakPolarHBondContact O-CB 3.19Å; P86-A90 PolarHBondContact O-N 2.83Å; Y87-A90 PolarHBondContact O-N 2.89Å; A90-F92 PolarHBondContact O-N 3.47Å; A90-S94 WeakPolarHBondContact O-CB 3.32Å; A90-S94 PolarHBondContact O-N 3.21Å
91	M	86.5	Confident	82.8	Confident	31 Å²	31	65.4 Å²	65.4	15%	0.153	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-42.2	177.2	-174.9	-177.6	-72	0	0	112.7	Y87 F88 R89 E98 I104	Y87-M91 HydrophobicContact CD1-CE 4.4Å; Y87-M91 HydrophobicContact CE1-CE 3.46Å; Y87-M91 VanDerWaalsContact CE1-CE 3.46Å; Y87-M91 HydrophobicContact CE2-CE 4.29Å; Y87-M91 VanDerWaalsContact CZ-CE 3.4Å; Y87-M91 WeakPolarHBondContact O-CB 3.33Å; Y87-M91 PolarHBondContact O-N 2.97Å; Y87-M91 WeakPolarHBondContact OH-CE 3.42Å; F88-M91 HydrophobicContact CD1-SD 4.36Å; F88-M91 PolarHBondContact O-N 3.4Å; R89-M91 VanDerWaalsContact C-N 3.29Å; R89-M91 PolarHBondContact O-N 3.21Å; M91-E98 HydrophobicContact CG-CB 4.21Å; M91-I104 HydrophobicContact CE-CG2 4.4Å; M91-I104 HydrophobicContact SD-CD1 3.8Å; M91-I104 HydrophobicContact SD-CG2 3.77Å
92	F	87	Confident	82.3	Confident	24 Å²	24	70.5 Å²	70.5	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-84.4	-25	-175.7	-58.4	-19.8	0	0	0	114	V65 R78 L81 A82 F88 R89 A90 I104	V65-F92 HydrophobicContact CG2-CZ 4.49Å; R78-F92 HydrophobicContact CB-CD2 3.7Å; R78-F92 HydrophobicContact CB-CE2 3.77Å; R78-F92 HydrophobicContact CB-CG 4.46Å; R78-F92 HydrophobicContact CG-CD2 4.12Å; R78-F92 HydrophobicContact CG-CE2 3.97Å; R78-F92 HydrophobicContact CG-CZ 4.28Å; L81-F92 HydrophobicContact CB-CE2 4.01Å; L81-F92 HydrophobicContact CD1-CE2 4.47Å; L81-F92 HydrophobicContact CD1-CZ 4.43Å; A82-F92 HydrophobicContact CB-CD2 4.07Å; F88-F92 HydrophobicContact CB-CD2 4.42Å; F88-F92 HydrophobicContact CB-CE2 3.9Å; F88-F92 HydrophobicContact CB-CZ 4.12Å; F88-F92 HydrophobicContact CD1-CE1 4.32Å; F88-F92 HydrophobicContact CD1-CE2 4.44Å; F88-F92 AromaticContact CD1-CZ 3.83Å; F88-F92 HydrophobicContact CD1-CZ 3.83Å; F88-F92 HydrophobicContact CG-CE2 4.46Å; F88-F92 HydrophobicContact CG-CZ 4.28Å; F88-F92 WeakPolarHBondContact O-CB 3.42Å; F88-F92 WeakPolarHBondContact O-CD2 3.38Å; F88-F92 WeakPolarHBondContact O-CG 3.26Å; F88-F92 PolarHBondContact O-N 3.09Å; R89-F92 PolarHBondContact O-N 3.49Å; A90-F92 PolarHBondContact O-N 3.47Å; F92-I104 HydrophobicContact CD1-CD1 4.24Å; F92-I104 HydrophobicContact CE1-CD1 3.39Å; F92-I104 HydrophobicContact CZ-CD1 4.21Å
93	T	85.3	Confident	82	Confident	108 Å²	108	74.3 Å²	74.3	66%	0.663	40%	0.399	S	S	*	.	H	α-helix	trans	-99.4	-6.5	179.6	65.2	0	0	0	0	113.8	R89	R89-T93 HydrophobicContact CG-CG2 4.43Å; R89-T93 WeakPolarHBondContact O-CB 3.31Å; R89-T93 WeakPolarHBondContact O-CG2 3.32Å; R89-T93 PolarHBondContact O-N 3.03Å; R89-T93 PolarHBondContact O-OG1 3.45Å
94	S	80.8	Confident	81.9	Confident	29 Å²	29	72 Å²	72	20%	0.203	38%	0.378	C	S	.	.	S	Bend	trans	-71.3	146.9	176.2	174	0	0	0	0	112	A90 L96 S99	A90-S94 WeakPolarHBondContact O-CB 3.32Å; A90-S94 PolarHBondContact O-N 3.21Å; S94-L96 PolarHBondContact O-N 3.4Å; S94-L96 VanDerWaalsContact O-N 3.13Å; S94-L96 WeakPolarHBondContact OG-CD1 3.41Å; S94-L96 WeakPolarHBondContact OG-CG 3.45Å; S94-L96 PolarHBondContact OG-N 2.87Å; S94-S99 WeakPolarHBondContact O-CB 3.26Å; S94-S99 PolarHBondContact O-OG 3.06Å; S94-S99 VanDerWaalsContact O-OG 3.11Å
95	P	69	Low	81.8	Confident	124 Å²	124	78.8 Å²	78.8	81%	0.805	40%	0.399	S	S	*	.	S	Bend	trans	-70.2	-0.6	173.7	30.3	-36.7	0	0	0	114.2
96	L	73.9	Confident	81.4	Confident	108 Å²	108	79.2 Å²	79.2	57%	0.565	40%	0.401	S	S	*	.	S	Bend	trans	-71.4	162.8	-179.6	-62.4	169.1	0	0	0	112.4	S94 E98 S99	S94-L96 PolarHBondContact O-N 3.4Å; S94-L96 VanDerWaalsContact O-N 3.13Å; S94-L96 WeakPolarHBondContact OG-CD1 3.41Å; S94-L96 WeakPolarHBondContact OG-CG 3.45Å; S94-L96 PolarHBondContact OG-N 2.87Å; L96-E98 WeakPolarHBondContact CB-OE2 3.42Å; L96-E98 PolarHBondContact O-N 2.91Å; L96-S99 WeakPolarHBondContact O-CB 3.36Å; L96-S99 PolarHBondContact O-N 3.49Å; L96-S99 VanDerWaalsContact O-N 3.09Å; L96-S99 PolarHBondContact O-OG 3.4Å
97	V	65	Low	80.7	Confident	103 Å²	103	83.6 Å²	83.6	62%	0.624	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-60.6	-31.2	-171.2	-178	0	0	0	0	111.9	S99 R100 L101	V97-S99 PolarHBondContact O-N 3Å; V97-R100 PolarHBondContact O-N 2.97Å; V97-L101 PolarHBondContact O-N 3.26Å
98	E	67.8	Low	80.1	Confident	91 Å²	91	87.4 Å²	87.4	43%	0.425	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-60.1	-27	178.9	-63.2	78.9	-176.1	0	0	112.6	M91 L96 R100 L101	M91-E98 HydrophobicContact CG-CB 4.21Å; L96-E98 WeakPolarHBondContact CB-OE2 3.42Å; L96-E98 PolarHBondContact O-N 2.91Å; E98-R100 PolarHBondContact O-N 2.92Å; E98-L101 PolarHBondContact O-N 2.96Å
99	S	68.4	Low	79.9	Confident	23 Å²	23	87.6 Å²	87.6	16%	0.161	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-67.1	-24.8	174.2	67.6	0	0	0	0	113	R78 S94 L96 V97	R78-S99 PolarHBondContact NH1-O 3.47Å; R78-S99 VanDerWaalsContact NH1-O 3.09Å; R78-S99 PolarHBondContact NH2-O 3.28Å; S94-S99 WeakPolarHBondContact O-CB 3.26Å; S94-S99 PolarHBondContact O-OG 3.06Å; S94-S99 VanDerWaalsContact O-OG 3.11Å; L96-S99 WeakPolarHBondContact O-CB 3.36Å; L96-S99 PolarHBondContact O-N 3.49Å; L96-S99 VanDerWaalsContact O-N 3.09Å; L96-S99 PolarHBondContact O-OG 3.4Å; V97-S99 PolarHBondContact O-N 3Å
100	R	71.8	Confident	79.9	Confident	208 Å²	208	84.2 Å²	84.2	79%	0.785	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-97.9	-6.5	-176.6	-56.9	-175.4	-174.8	-170.8	0.8	113.2	V97 E98	V97-R100 PolarHBondContact O-N 2.97Å; E98-R100 PolarHBondContact O-N 2.92Å
101	L	78.7	Confident	80	Confident	83 Å²	83	82.7 Å²	82.7	44%	0.435	42%	0.416	S	S	.	.			trans	-85.9	134	179.3	-65	176.8	0	0	0	110.6	V97 E98	V97-L101 PolarHBondContact O-N 3.26Å; E98-L101 PolarHBondContact O-N 2.96Å
102	N	79.4	Confident	80.1	Confident	110 Å²	110	84.5 Å²	84.5	59%	0.588	43%	0.432	S	S	*	.	S	Bend	trans	-85.6	-17.4	172.4	-65.4	-11.4	0	0	0	112	T66	T66-N102 PolarHBondContact N-O 2.95Å
103	E	86.1	Confident	80.3	Confident	95 Å²	95	83.6 Å²	83.6	44%	0.444	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.7	175.7	-64.9	-165.5	152.7	0	0	110.3	T66 K73	T66-E103 CarbonylContact O-C 3.48Å; T66-E103 WeakPolarHBondContact O-CA 3.25Å; K73-E103 IonicContact NZ-OE1 3.9Å; K73-E103 PolarHBondContact NZ-OE1 3.17Å
104	I	86.8	Confident	80.6	Confident	11 Å²	11	78.5 Å²	78.5	6%	0.056	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.5	-175.9	-59.6	176.5	0	0	0	109	V65 T66 L67 L68 M91 F92 L106	V65-I104 HydrophobicContact CG2-CD1 3.74Å; V65-I104 HydrophobicContact CG2-CG1 4.2Å; T66-I104 PolarHBondContact O-N 2.75Å; L67-I104 CarbonylContact C-O 3.58Å; L67-I104 WeakPolarHBondContact CA-O 3.42Å; L67-I104 HydrophobicContact CD2-CB 3.98Å; L67-I104 HydrophobicContact CD2-CD1 4.47Å; L67-I104 HydrophobicContact CD2-CG2 4.37Å; L68-I104 PolarHBondContact N-O 2.88Å; M91-I104 HydrophobicContact CE-CG2 4.4Å; M91-I104 HydrophobicContact SD-CD1 3.8Å; M91-I104 HydrophobicContact SD-CG2 3.77Å; F92-I104 HydrophobicContact CD1-CD1 4.24Å; F92-I104 HydrophobicContact CE1-CD1 3.39Å; F92-I104 HydrophobicContact CZ-CD1 4.21Å; I104-L106 HydrophobicContact CG2-CD2 4.43Å
105	R	86	Confident	81	Confident	190 Å²	190	81.9 Å²	81.9	72%	0.717	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.5	178.6	-58.1	-170.2	174.5	170.5	-1.7	109.6	L68	L68-R105 HydrophobicContact CB-CG 4.26Å; L68-R105 HydrophobicContact CD2-CG 3.87Å; L68-R105 WeakPolarHBondContact O-CA 3.47Å
106	L	85.1	Confident	82	Confident	11 Å²	11	77.3 Å²	77.3	6%	0.058	38%	0.379	C	S	.	.			trans	-108.8	115.2	173.2	-62.8	171.5	0	0	0	108.3	L67 L68 V69 Y87 F88 I104 M114	L67-L106 HydrophobicContact CB-CD1 4.46Å; L67-L106 HydrophobicContact CD1-CD1 4.36Å; L67-L106 HydrophobicContact CD2-CD1 4.44Å; L68-L106 PolarHBondContact O-N 3.09Å; V69-L106 HydrophobicContact CG2-CB 4.23Å; V69-L106 HydrophobicContact CG2-CD1 4.46Å; Y87-L106 HydrophobicContact CE1-CD2 4.24Å; F88-L106 HydrophobicContact CE1-CD1 4.33Å; F88-L106 HydrophobicContact CE1-CD2 4.48Å; F88-L106 HydrophobicContact CZ-CD1 4.08Å; I104-L106 HydrophobicContact CG2-CD2 4.43Å; L106-M114 HydrophobicContact CD1-CE 3.72Å; L106-M114 HydrophobicContact CD1-SD 4.21Å
107	E	77.6	Confident	82.9	Confident	150 Å²	150	72.2 Å²	72.2	70%	0.701	35%	0.353	S	S	*	.			trans	-91	145.8	175	-61.9	179	-179.6	0	0	109.2	R142	E107-R142 PolarHBondContact O-NH2 3.12Å
108	E	79.2	Confident	84.1	Confident	153 Å²	153	67.9 Å²	67.9	72%	0.715	33%	0.326	S	S	*	.	S	Bend	trans	73.6	27.1	175.2	-46.6	176	153.4	0	0	116.1	R142	E108-R142 IonicContact OE2-CZ 3.07Å; E108-R142 IonicContact OE2-NH1 2.79Å; E108-R142 PolarHBondContact OE2-NH1 3.31Å; E108-R142 IonicContact OE2-NH2 3.1Å; E108-R142 PolarHBondContact OE2-NH2 2.81Å
109	V	86.1	Confident	85.1	Confident	6 Å²	6	68 Å²	68	4%	0.036	33%	0.326	C	S	.	.			trans	-127.6	137.5	166.8	-177.1	0	0	0	0	108.3	V69 V113 M114 A139	V69-V109 HydrophobicContact CG1-CB 4.44Å; V69-V109 WeakPolarHBondContact CG1-O 3.44Å; V109-V113 HydrophobicContact CG1-CB 4.27Å; V109-V113 HydrophobicContact CG1-CG1 4.09Å; V109-M114 HydrophobicContact CG1-CB 4.14Å; V109-M114 HydrophobicContact CG1-SD 4.47Å; V109-A139 HydrophobicContact CG1-CB 4.23Å; V109-A139 HydrophobicContact CG2-CB 4.46Å
110	T	89	Confident	86.2	Confident	51 Å²	51	67.9 Å²	67.9	31%	0.313	32%	0.323	S	S	.	.			trans	-80.1	148.1	176	58.3	0	0	0	0	110.8	S112 V113 M114	T110-S112 VanDerWaalsContact C-N 3.26Å; T110-S112 PolarHBondContact O-N 3.44Å; T110-S112 PolarHBondContact OG1-OG 3.02Å; T110-V113 PolarHBondContact O-N 3.29Å; T110-V113 WeakPolarHBondContact OG1-CB 3.13Å; T110-V113 WeakPolarHBondContact OG1-CG2 3.41Å; T110-M114 PolarHBondContact O-N 3Å
111	P	89.9	Confident	87.1	Confident	27 Å²	27	58.7 Å²	58.7	18%	0.175	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-33	-178.7	-26.5	32.8	0	0	0	114.5	V69 E70 K72 F74 E115	V69-P111 HydrophobicContact CG1-CG 4.28Å; E70-P111 HydrophobicContact CB-CG 4.01Å; E70-P111 WeakPolarHBondContact OE2-CD 3.46Å; K72-P111 HydrophobicContact CB-CB 4.28Å; K72-P111 HydrophobicContact CB-CG 4.46Å; K72-P111 HydrophobicContact CD-CB 3.96Å; F74-P111 HydrophobicContact CE2-CB 4.41Å; F74-P111 HydrophobicContact CZ-CB 4.25Å; F74-P111 WeakPolarHBondContact CZ-O 3.35Å; P111-E115 WeakPolarHBondContact O-CB 3.33Å; P111-E115 PolarHBondContact O-N 3.44Å
112	S	89.2	Confident	87.6	Confident	70 Å²	70	54.9 Å²	54.9	49%	0.49	27%	0.27	S	S	.	.	H	α-helix	trans	-68.6	-40.9	177.9	52	0	0	0	0	112.6	T110 E115 T116	T110-S112 VanDerWaalsContact C-N 3.26Å; T110-S112 PolarHBondContact O-N 3.44Å; T110-S112 PolarHBondContact OG1-OG 3.02Å; S112-E115 PolarHBondContact O-N 3.43Å; S112-T116 PolarHBondContact O-N 3.09Å; S112-T116 PolarHBondContact O-OG1 3.21Å
113	V	90.7	Very high	87.9	Confident	5 Å²	5	52 Å²	52	3%	0.03	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-43.4	175.6	171.1	0	0	0	0	109.8	V109 T110 E115 T116 V117 D135 L136 A139	V109-V113 HydrophobicContact CG1-CB 4.27Å; V109-V113 HydrophobicContact CG1-CG1 4.09Å; T110-V113 PolarHBondContact O-N 3.29Å; T110-V113 WeakPolarHBondContact OG1-CB 3.13Å; T110-V113 WeakPolarHBondContact OG1-CG2 3.41Å; V113-E115 VanDerWaalsContact C-N 3.32Å; V113-E115 PolarHBondContact O-N 3.48Å; V113-T116 WeakPolarHBondContact O-CB 2.89Å; V113-T116 PolarHBondContact O-N 3.44Å; V113-T116 VanDerWaalsContact O-N 3.12Å; V113-V117 HydrophobicContact CG1-CG2 4.45Å; V113-V117 WeakPolarHBondContact O-CG2 3.4Å; V113-V117 PolarHBondContact O-N 3.01Å; V113-D135 HydrophobicContact CG2-CB 3.77Å; V113-L136 HydrophobicContact CG1-CB 4.43Å; V113-L136 HydrophobicContact CG1-CD1 3.75Å; V113-A139 HydrophobicContact CG1-CB 3.46Å; V113-A139 VanDerWaalsContact CG1-CB 3.46Å
114	M	91.6	Very high	87.9	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-40.9	178.2	-168.6	64.5	-176.3	0	0	112.4	L67 V69 F74 F88 L106 V109 T110 T116 V117 I118 L143	L67-M114 HydrophobicContact CB-CE 4.41Å; L67-M114 HydrophobicContact CD1-CE 3.2Å; L67-M114 HydrophobicContact CG-CE 4.39Å; V69-M114 HydrophobicContact CG2-CB 4.27Å; V69-M114 HydrophobicContact CG2-CG 3.9Å; F74-M114 HydrophobicContact CD2-CG 4.41Å; F74-M114 HydrophobicContact CE2-CB 4.37Å; F74-M114 HydrophobicContact CE2-CG 4.36Å; F74-M114 HydrophobicContact CZ-CB 4.49Å; F88-M114 HydrophobicContact CZ-CE 4.37Å; L106-M114 HydrophobicContact CD1-CE 3.72Å; L106-M114 HydrophobicContact CD1-SD 4.21Å; V109-M114 HydrophobicContact CG1-CB 4.14Å; V109-M114 HydrophobicContact CG1-SD 4.47Å; T110-M114 PolarHBondContact O-N 3Å; M114-T116 VanDerWaalsContact C-N 3.28Å; M114-T116 PolarHBondContact O-N 2.86Å; M114-V117 PolarHBondContact O-N 3.03Å; M114-I118 HydrophobicContact CE-CD1 4.1Å; M114-I118 HydrophobicContact CE-CG1 4.11Å; M114-I118 HydrophobicContact CG-CD1 3.99Å; M114-I118 HydrophobicContact CG-CG1 4.47Å; M114-I118 VanDerWaalsContact O-CG1 3.32Å; M114-I118 WeakPolarHBondContact O-CG1 3.43Å; M114-I118 PolarHBondContact O-N 2.85Å; M114-L143 HydrophobicContact SD-CD1 4.09Å
115	E	90.4	Very high	87.6	Confident	99 Å²	99	56.2 Å²	56.2	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-40.8	175.2	-172.8	164.7	176.1	0	0	111.7	K72 F74 P111 S112 V113 I118 Q119	K72-E115 IonicContact NZ-OE2 2.72Å; K72-E115 PolarHBondContact NZ-OE2 3.03Å; F74-E115 HydrophobicContact CE1-CB 4.09Å; F74-E115 HydrophobicContact CZ-CB 4.48Å; P111-E115 WeakPolarHBondContact O-CB 3.33Å; P111-E115 PolarHBondContact O-N 3.44Å; S112-E115 PolarHBondContact O-N 3.43Å; V113-E115 VanDerWaalsContact C-N 3.32Å; V113-E115 PolarHBondContact O-N 3.48Å; E115-I118 PolarHBondContact O-N 2.96Å; E115-Q119 WeakPolarHBondContact O-CB 3.45Å; E115-Q119 PolarHBondContact O-N 3.3Å
116	T	90.3	Very high	87.5	Confident	28 Å²	28	48.2 Å²	48.2	17%	0.172	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-40.3	175.9	-50.8	0	0	0	0	112	S112 V113 M114 Q119 F120 A126 L136	S112-T116 PolarHBondContact O-N 3.09Å; S112-T116 PolarHBondContact O-OG1 3.21Å; V113-T116 WeakPolarHBondContact O-CB 2.89Å; V113-T116 PolarHBondContact O-N 3.44Å; V113-T116 VanDerWaalsContact O-N 3.12Å; M114-T116 VanDerWaalsContact C-N 3.28Å; M114-T116 PolarHBondContact O-N 2.86Å; T116-Q119 PolarHBondContact O-N 2.82Å; T116-F120 WeakPolarHBondContact O-CB 3.22Å; T116-F120 PolarHBondContact O-N 3.2Å; T116-A126 HydrophobicContact CG2-CB 4.24Å; T116-L136 HydrophobicContact CG2-CD1 4.17Å; T116-L136 HydrophobicContact CG2-CD2 3.84Å
117	V	91.6	Very high	87.1	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-46.5	175.1	174.5	0	0	0	0	110.6	V113 M114 F120 V121 L136 L143 V145 L148	V113-V117 HydrophobicContact CG1-CG2 4.45Å; V113-V117 WeakPolarHBondContact O-CG2 3.4Å; V113-V117 PolarHBondContact O-N 3.01Å; M114-V117 PolarHBondContact O-N 3.03Å; V117-F120 PolarHBondContact O-N 3.05Å; V117-V121 WeakPolarHBondContact O-CG2 3.37Å; V117-V121 PolarHBondContact O-N 3.03Å; V117-L136 HydrophobicContact CG2-CD1 3.59Å; V117-L143 HydrophobicContact CG1-CD1 4.09Å; V117-V145 HydrophobicContact CG1-CG2 4.31Å; V117-L148 HydrophobicContact CB-CD2 4.39Å; V117-L148 HydrophobicContact CG1-CD2 4.45Å; V117-L148 HydrophobicContact CG2-CD2 3.89Å
118	I	90.8	Very high	87.4	Confident	12 Å²	12	45.2 Å²	45.2	6%	0.062	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-48.2	177.5	-67.8	166	0	0	0	109.4	L57 F74 M114 E115 F120 V121 Y122	L57-I118 HydrophobicContact CD2-CG2 3.97Å; F74-I118 HydrophobicContact CB-CD1 3.72Å; F74-I118 HydrophobicContact CD1-CD1 3.78Å; F74-I118 HydrophobicContact CG-CD1 3.83Å; M114-I118 HydrophobicContact CE-CD1 4.1Å; M114-I118 HydrophobicContact CE-CG1 4.11Å; M114-I118 HydrophobicContact CG-CD1 3.99Å; M114-I118 HydrophobicContact CG-CG1 4.47Å; M114-I118 VanDerWaalsContact O-CG1 3.32Å; M114-I118 WeakPolarHBondContact O-CG1 3.43Å; M114-I118 PolarHBondContact O-N 2.85Å; E115-I118 PolarHBondContact O-N 2.96Å; I118-F120 VanDerWaalsContact C-N 3.28Å; I118-F120 PolarHBondContact O-N 3.43Å; I118-V121 PolarHBondContact O-N 3.23Å; I118-V121 VanDerWaalsContact O-N 3.1Å; I118-Y122 HydrophobicContact CG2-CD2 4.06Å; I118-Y122 HydrophobicContact CG2-CE2 3.96Å; I118-Y122 VanDerWaalsContact O-CD2 3.26Å; I118-Y122 WeakPolarHBondContact O-CD2 3.35Å; I118-Y122 PolarHBondContact O-N 3.41Å
119	Q	89.3	Confident	87.7	Confident	94 Å²	94	40.1 Å²	40.1	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-53.8	-48.2	176.6	-174.9	175.2	5.5	0	0	111.1	E115 T116 V121 Y122 T123	E115-Q119 WeakPolarHBondContact O-CB 3.45Å; E115-Q119 PolarHBondContact O-N 3.3Å; T116-Q119 PolarHBondContact O-N 2.82Å; Q119-V121 PolarHBondContact O-N 2.92Å; Q119-Y122 PolarHBondContact O-N 3.12Å; Q119-T123 HydrophobicContact CG-CG2 4.33Å; Q119-T123 PolarHBondContact O-N 3.49Å; Q119-T123 PolarHBondContact O-OG1 2.88Å
120	F	91	Very high	87.4	Confident	19 Å²	19	45 Å²	45	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-40	177.7	-179.3	-94.6	0	0	0	113.5	T116 V117 I118 Y122 G124 E125 A126 V145 P147 L148	T116-F120 WeakPolarHBondContact O-CB 3.22Å; T116-F120 PolarHBondContact O-N 3.2Å; V117-F120 PolarHBondContact O-N 3.05Å; I118-F120 VanDerWaalsContact C-N 3.28Å; I118-F120 PolarHBondContact O-N 3.43Å; F120-Y122 PolarHBondContact O-N 3.39Å; F120-G124 VanDerWaalsContact CE2-O 3.26Å; F120-G124 WeakPolarHBondContact CE2-O 3.34Å; F120-G124 VanDerWaalsContact O-CA 3.22Å; F120-G124 WeakPolarHBondContact O-CA 3.5Å; F120-G124 PolarHBondContact O-N 2.81Å; F120-E125 WeakPolarHBondContact CA-O 3.45Å; F120-A126 HydrophobicContact CB-CB 4.3Å; F120-A126 HydrophobicContact CD2-CB 3.79Å; F120-A126 HydrophobicContact CG-CB 4.41Å; F120-V145 HydrophobicContact CD1-CG1 4.11Å; F120-V145 HydrophobicContact CE1-CG1 4.06Å; F120-P147 HydrophobicContact CE1-CB 4.19Å; F120-P147 HydrophobicContact CZ-CB 4.02Å; F120-L148 HydrophobicContact CB-CD1 4.34Å; F120-L148 HydrophobicContact CB-CD2 4.37Å; F120-L148 HydrophobicContact CD1-CB 3.79Å; F120-L148 HydrophobicContact CD1-CD1 4.17Å; F120-L148 HydrophobicContact CD1-CD2 4.17Å; F120-L148 HydrophobicContact CD1-CG 4.27Å; F120-L148 HydrophobicContact CD2-CD1 3.85Å; F120-L148 HydrophobicContact CE1-CB 3.65Å; F120-L148 HydrophobicContact CE1-CD1 4.47Å; F120-L148 HydrophobicContact CE2-CD1 4.15Å; F120-L148 HydrophobicContact CG-CB 4.34Å; F120-L148 HydrophobicContact CG-CD1 3.84Å; F120-L148 HydrophobicContact CG-CD2 4.29Å; F120-L148 HydrophobicContact CG-CG 4.39Å; F120-L148 HydrophobicContact CZ-CB 4.08Å; F120-L148 HydrophobicContact CZ-CD1 4.45Å
121	V	90.4	Very high	87.1	Confident	15 Å²	15	50.9 Å²	50.9	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-32.7	178.7	167.2	0	0	0	0	111.9	L80 L81 V84 V117 I118 Q119	L80-V121 HydrophobicContact CD2-CG1 3.85Å; L80-V121 HydrophobicContact CG-CG1 3.74Å; L81-V121 HydrophobicContact CD2-CG1 4.36Å; V84-V121 HydrophobicContact CB-CG1 4.39Å; V84-V121 HydrophobicContact CB-CG2 4.49Å; V84-V121 HydrophobicContact CG1-CG2 4.15Å; V84-V121 HydrophobicContact CG2-CG1 4.17Å; V117-V121 WeakPolarHBondContact O-CG2 3.37Å; V117-V121 PolarHBondContact O-N 3.03Å; I118-V121 PolarHBondContact O-N 3.23Å; I118-V121 VanDerWaalsContact O-N 3.1Å; Q119-V121 PolarHBondContact O-N 2.92Å
122	Y	88.7	Confident	86.9	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-93.3	-33.6	-178.6	-74.8	-104	0	0	0	113.5	L53 L57 H77 L80 I118 Q119 F120	L53-Y122 HydrophobicContact CB-CD1 4.19Å; L53-Y122 HydrophobicContact CB-CE1 4.48Å; L57-Y122 HydrophobicContact CB-CD1 4.11Å; L57-Y122 HydrophobicContact CB-CE1 3.79Å; L57-Y122 HydrophobicContact CD1-CE1 4.34Å; L57-Y122 HydrophobicContact CD1-CE2 4.37Å; L57-Y122 HydrophobicContact CD2-CD1 3.99Å; L57-Y122 HydrophobicContact CD2-CD2 3.81Å; L57-Y122 HydrophobicContact CD2-CE1 3.98Å; L57-Y122 HydrophobicContact CD2-CE2 3.77Å; L57-Y122 HydrophobicContact CD2-CG 3.9Å; L57-Y122 HydrophobicContact CG-CE1 4.26Å; H77-Y122 PolarHBondContact N-OH 3.06Å; H77-Y122 AromaticContact ND1-CE1 3.61Å; H77-Y122 AromaticContact ND1-CZ 3.67Å; H77-Y122 PolarHBondContact ND1-OH 3.04Å; L80-Y122 HydrophobicContact CD2-CD1 3.47Å; L80-Y122 VanDerWaalsContact CD2-CD1 3.47Å; L80-Y122 HydrophobicContact CD2-CD2 3.75Å; L80-Y122 HydrophobicContact CD2-CE1 3.4Å; L80-Y122 VanDerWaalsContact CD2-CE1 3.4Å; L80-Y122 HydrophobicContact CD2-CE2 3.72Å; L80-Y122 HydrophobicContact CD2-CG 3.66Å; I118-Y122 HydrophobicContact CG2-CD2 4.06Å; I118-Y122 HydrophobicContact CG2-CE2 3.96Å; I118-Y122 VanDerWaalsContact O-CD2 3.26Å; I118-Y122 WeakPolarHBondContact O-CD2 3.35Å; I118-Y122 PolarHBondContact O-N 3.41Å; Q119-Y122 PolarHBondContact O-N 3.12Å; F120-Y122 PolarHBondContact O-N 3.39Å
123	T	86.8	Confident	86.9	Confident	51 Å²	51	48.4 Å²	48.4	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-106.1	-18.5	-174.7	67.9	0	0	0	0	113.9	K54 Q119 E125	K54-T123 HydrophobicContact CD-CG2 4.17Å; K54-T123 HydrophobicContact CG-CG2 4.43Å; Q119-T123 HydrophobicContact CG-CG2 4.33Å; Q119-T123 PolarHBondContact O-N 3.49Å; Q119-T123 PolarHBondContact O-OG1 2.88Å; T123-E125 PolarHBondContact O-N 2.87Å; T123-E125 PolarHBondContact OG1-N 3.33Å; T123-E125 VanDerWaalsContact OG1-N 3.13Å; T123-E125 PolarHBondContact OG1-O 3.18Å
124	G	84.6	Confident	86.8	Confident	49 Å²	49	52.1 Å²	52.1	51%	0.505	30%	0.295	S	S	.	.	S	Bend	trans	72.1	4.4	-169.1	0	0	0	0	0	114.3	F120	F120-G124 VanDerWaalsContact CE2-O 3.26Å; F120-G124 WeakPolarHBondContact CE2-O 3.34Å; F120-G124 VanDerWaalsContact O-CA 3.22Å; F120-G124 WeakPolarHBondContact O-CA 3.5Å; F120-G124 PolarHBondContact O-N 2.81Å
125	E	82.3	Confident	86.8	Confident	145 Å²	145	56.2 Å²	56.2	68%	0.678	32%	0.317	S	S	*	.			trans	-117.5	135	-177.1	-62.1	-170.1	159.1	0	0	111.3	F120 T123	F120-E125 WeakPolarHBondContact CA-O 3.45Å; T123-E125 PolarHBondContact O-N 2.87Å; T123-E125 PolarHBondContact OG1-N 3.33Å; T123-E125 VanDerWaalsContact OG1-N 3.13Å; T123-E125 PolarHBondContact OG1-O 3.18Å
126	A	82.3	Confident	86.8	Confident	21 Å²	21	51.6 Å²	51.6	17%	0.174	30%	0.295	C	S	.	.			trans	-126.9	127.1	175.1	0	0	0	0	0	110.4	T116 F120 L128 L148 L151	T116-A126 HydrophobicContact CG2-CB 4.24Å; F120-A126 HydrophobicContact CB-CB 4.3Å; F120-A126 HydrophobicContact CD2-CB 3.79Å; F120-A126 HydrophobicContact CG-CB 4.41Å; A126-L128 PolarHBondContact O-N 3.23Å; A126-L148 HydrophobicContact CB-CD1 3.72Å; A126-L151 HydrophobicContact CB-CD2 4.17Å
127	G	78.4	Confident	86.9	Confident	60 Å²	60	50.2 Å²	50.2	62%	0.619	29%	0.287	S	S	*	.			trans	-76.9	99.4	170.8	0	0	0	0	0	110.6
128	L	83.7	Confident	86.9	Confident	39 Å²	39	52.5 Å²	52.5	20%	0.204	30%	0.301	C	S	.	.			trans	-88	134	177.2	-62	-175.4	0	0	0	112	A126 L136 L151 F155	A126-L128 PolarHBondContact O-N 3.23Å; L128-L136 HydrophobicContact CD2-CD2 3.41Å; L128-L136 VanDerWaalsContact CD2-CD2 3.41Å; L128-L151 HydrophobicContact CD1-CD2 3.44Å; L128-L151 VanDerWaalsContact CD1-CD2 3.44Å; L128-L151 HydrophobicContact CD1-CG 4.32Å; L128-L151 HydrophobicContact CD2-CD2 4.09Å; L128-L151 HydrophobicContact CG-CD2 3.8Å; L128-F155 HydrophobicContact CB-CD1 4.17Å; L128-F155 HydrophobicContact CB-CD2 4.13Å; L128-F155 HydrophobicContact CB-CE1 4.19Å; L128-F155 HydrophobicContact CB-CE2 4.15Å; L128-F155 HydrophobicContact CB-CG 4.13Å; L128-F155 HydrophobicContact CB-CZ 4.18Å; L128-F155 HydrophobicContact CD1-CB 3.36Å; L128-F155 HydrophobicContact CD1-CD1 4.01Å; L128-F155 HydrophobicContact CD1-CD2 3.92Å; L128-F155 HydrophobicContact CD1-CG 3.5Å; L128-F155 VanDerWaalsContact CD1-CG 3.5Å
129	S	84.9	Confident	86.9	Confident	45 Å²	45	52.1 Å²	52.1	32%	0.315	30%	0.299	S	S	.	.			trans	-123.8	162.7	166.7	85	0	0	0	0	110	E131 T132 A133	S129-E131 PolarHBondContact O-N 3.39Å; S129-E131 PolarHBondContact OG-N 3.1Å; S129-T132 PolarHBondContact N-OG1 2.85Å; S129-T132 PolarHBondContact O-N 3.3Å; S129-T132 PolarHBondContact OG-N 2.92Å; S129-T132 PolarHBondContact OG-OG1 2.81Å; S129-T132 VanDerWaalsContact OG-OG1 3.05Å; S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 3.01Å
130	L	80.6	Confident	87.1	Confident	110 Å²	110	47.6 Å²	47.6	58%	0.576	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-25	177.5	-69.4	171.1	0	0	0	112.9	F155 H159	L130-F155 HydrophobicContact CD2-CE1 4.07Å; L130-F155 HydrophobicContact CD2-CZ 4.34Å; L130-H159 HydrophobicContact CD2-CB 3.63Å
131	E	82.6	Confident	87.1	Confident	174 Å²	174	49.1 Å²	49.1	81%	0.813	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-33.8	-179.4	-63	176.6	-176.6	0	0	111.6	S129	S129-E131 PolarHBondContact O-N 3.39Å; S129-E131 PolarHBondContact OG-N 3.1Å
132	T	85.4	Confident	87.1	Confident	45 Å²	45	53.2 Å²	53.2	28%	0.276	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-16.4	-176.4	61.3	0	0	0	0	113.9	S129 E134 D135 L136	S129-T132 PolarHBondContact N-OG1 2.85Å; S129-T132 PolarHBondContact O-N 3.3Å; S129-T132 PolarHBondContact OG-N 2.92Å; S129-T132 PolarHBondContact OG-OG1 2.81Å; S129-T132 VanDerWaalsContact OG-OG1 3.05Å; T132-E134 PolarHBondContact O-N 2.73Å; T132-D135 PolarHBondContact O-N 2.86Å; T132-L136 WeakPolarHBondContact O-CB 2.94Å; T132-L136 PolarHBondContact O-N 2.98Å
133	A	88.4	Confident	87.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-34.9	-172.3	0	0	0	0	0	113.8	S129 F137 F155 L156	S129-A133 WeakPolarHBondContact O-CB 3.27Å; S129-A133 PolarHBondContact O-N 3.01Å; A133-F137 WeakPolarHBondContact O-CB 3.32Å; A133-F137 PolarHBondContact O-N 2.92Å; A133-F155 HydrophobicContact CB-CD1 3.69Å; A133-F155 HydrophobicContact CB-CE1 3.81Å; A133-L156 HydrophobicContact CB-CD2 3.71Å; A133-L156 HydrophobicContact CB-CG 4.37Å
134	E	89.4	Confident	87.5	Confident	82 Å²	82	54.6 Å²	54.6	38%	0.383	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-51.9	177	-65	-174	-173.6	0	0	110.5	T132 L136 F137 V138 L156 L171	T132-E134 PolarHBondContact O-N 2.73Å; E134-L136 VanDerWaalsContact C-N 3.33Å; E134-L136 PolarHBondContact O-N 2.6Å; E134-F137 WeakPolarHBondContact O-CB 3.45Å; E134-F137 PolarHBondContact O-N 3.31Å; E134-F137 VanDerWaalsContact O-N 3.16Å; E134-V138 WeakPolarHBondContact O-CG2 3.46Å; E134-V138 PolarHBondContact O-N 3.01Å; E134-L156 HydrophobicContact CG-CD2 4.02Å; E134-L171 HydrophobicContact CB-CD2 4.25Å; E134-L171 HydrophobicContact CG-CD2 4.07Å
135	D	90.1	Very high	87.9	Confident	87 Å²	87	52.3 Å²	52.3	47%	0.465	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-40.3	179.2	-64.1	-23.9	0	0	0	112.2	V113 T132 V138 A139	V113-D135 HydrophobicContact CG2-CB 3.77Å; T132-D135 PolarHBondContact O-N 2.86Å; D135-V138 PolarHBondContact O-N 2.9Å; D135-A139 WeakPolarHBondContact O-CB 3.5Å; D135-A139 PolarHBondContact O-N 3.27Å
136	L	92.1	Very high	88.3	Confident	2 Å²	2	50 Å²	50	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-37	177	-170.9	65.3	0	0	0	111.9	V113 T116 V117 L128 T132 E134 A139 A140 L148	V113-L136 HydrophobicContact CG1-CB 4.43Å; V113-L136 HydrophobicContact CG1-CD1 3.75Å; T116-L136 HydrophobicContact CG2-CD1 4.17Å; T116-L136 HydrophobicContact CG2-CD2 3.84Å; V117-L136 HydrophobicContact CG2-CD1 3.59Å; L128-L136 HydrophobicContact CD2-CD2 3.41Å; L128-L136 VanDerWaalsContact CD2-CD2 3.41Å; T132-L136 WeakPolarHBondContact O-CB 2.94Å; T132-L136 PolarHBondContact O-N 2.98Å; E134-L136 VanDerWaalsContact C-N 3.33Å; E134-L136 PolarHBondContact O-N 2.6Å; L136-A139 PolarHBondContact O-N 3.19Å; L136-A140 WeakPolarHBondContact O-CB 3.36Å; L136-A140 PolarHBondContact O-N 3.42Å; L136-L148 HydrophobicContact CD1-CD2 4.04Å; L136-L148 HydrophobicContact CD2-CD1 4.15Å; L136-L148 HydrophobicContact CG-CD1 4.5Å; L136-L148 HydrophobicContact CG-CD2 4.33Å; L136-L148 HydrophobicContact CG-CG 4.49Å
137	F	91.6	Very high	88.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-45.6	173.7	174.1	-96.8	0	0	0	111.5	A133 E134 A140 N141 Q149 C152 L156 L171 H175 D177	A133-F137 WeakPolarHBondContact O-CB 3.32Å; A133-F137 PolarHBondContact O-N 2.92Å; E134-F137 WeakPolarHBondContact O-CB 3.45Å; E134-F137 PolarHBondContact O-N 3.31Å; E134-F137 VanDerWaalsContact O-N 3.16Å; F137-A140 PolarHBondContact O-N 2.7Å; F137-N141 WeakPolarHBondContact O-CB 3.41Å; F137-N141 PolarHBondContact O-N 2.98Å; F137-Q149 HydrophobicContact CD2-CG 3.98Å; F137-Q149 HydrophobicContact CE2-CG 3.65Å; F137-Q149 HydrophobicContact CZ-CG 4.46Å; F137-C152 HydrophobicContact CB-CB 3.84Å; F137-C152 HydrophobicContact CD2-CB 4.02Å; F137-C152 HydrophobicContact CG-CB 4.44Å; F137-L156 HydrophobicContact CB-CD1 4.01Å; F137-L156 HydrophobicContact CD2-CD1 4.31Å; F137-L156 HydrophobicContact CG-CD1 4.04Å; F137-L171 HydrophobicContact CD1-CD1 4.2Å; F137-L171 HydrophobicContact CD1-CD2 3.96Å; F137-L171 HydrophobicContact CD1-CG 3.99Å; F137-L171 HydrophobicContact CE1-CD2 4.39Å; F137-L171 HydrophobicContact CE1-CG 4.07Å; F137-H175 HydrophobicContact CE1-CB 3.59Å; F137-H175 AromaticContact CE1-CD2 3.94Å; F137-H175 AromaticContact CE1-CG 3.83Å; F137-H175 HydrophobicContact CZ-CB 3.97Å; F137-D177 HydrophobicContact CZ-CB 3.94Å
138	V	91.4	Very high	89.2	Confident	49 Å²	49	49.8 Å²	49.8	30%	0.297	26%	0.257	S	S	.	.	H	α-helix	trans	-59.5	-48.8	175.9	175.7	0	0	0	0	110.5	E134 D135 N141 R142 L171	E134-V138 WeakPolarHBondContact O-CG2 3.46Å; E134-V138 PolarHBondContact O-N 3.01Å; D135-V138 PolarHBondContact O-N 2.9Å; V138-N141 PolarHBondContact O-N 3.29Å; V138-R142 WeakPolarHBondContact O-CB 3.17Å; V138-R142 PolarHBondContact O-N 3.14Å; V138-L171 HydrophobicContact CG2-CD1 3.68Å
139	A	91.6	Very high	89.5	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-64.6	-42.9	179.7	0	0	0	0	0	112.2	V109 V113 D135 L136 N141 R142 L143	V109-A139 HydrophobicContact CG1-CB 4.23Å; V109-A139 HydrophobicContact CG2-CB 4.46Å; V113-A139 HydrophobicContact CG1-CB 3.46Å; V113-A139 VanDerWaalsContact CG1-CB 3.46Å; D135-A139 WeakPolarHBondContact O-CB 3.5Å; D135-A139 PolarHBondContact O-N 3.27Å; L136-A139 PolarHBondContact O-N 3.19Å; A139-N141 PolarHBondContact O-N 3.01Å; A139-R142 PolarHBondContact O-N 3.23Å; A139-L143 WeakPolarHBondContact O-CB 3.49Å; A139-L143 WeakPolarHBondContact O-CG 3.33Å; A139-L143 PolarHBondContact O-N 3.42Å
140	A	92.4	Very high	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-41.9	178.3	0	0	0	0	0	111.8	L136 F137 Q144 V145 L148 Q149	L136-A140 WeakPolarHBondContact O-CB 3.36Å; L136-A140 PolarHBondContact O-N 3.42Å; F137-A140 PolarHBondContact O-N 2.7Å; A140-Q144 CarbonylContact O-C 3.58Å; A140-Q144 WeakPolarHBondContact O-CA 3.15Å; A140-Q144 PolarHBondContact O-N 3.47Å; A140-V145 PolarHBondContact O-N 3.4Å; A140-L148 HydrophobicContact CB-CB 4.08Å; A140-L148 HydrophobicContact CB-CD2 4.03Å; A140-L148 HydrophobicContact CB-CG 3.9Å; A140-Q149 HydrophobicContact CB-CB 4.09Å
141	N	91.1	Very high	90	Very high	51 Å²	51	48.1 Å²	48.1	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-43.4	175.3	-178.4	77.2	0	0	0	111.7	F137 V138 A139 Q144 Q149 H175	F137-N141 WeakPolarHBondContact O-CB 3.41Å; F137-N141 PolarHBondContact O-N 2.98Å; V138-N141 PolarHBondContact O-N 3.29Å; A139-N141 PolarHBondContact O-N 3.01Å; N141-Q144 PolarHBondContact O-N 3.37Å; N141-Q149 HydrophobicContact CB-CG 4.5Å; N141-Q149 PolarHBondContact OD1-NE2 3.08Å; N141-H175 PolarHBondContact ND2-ND1 3.38Å
142	R	90.6	Very high	90.4	Very high	100 Å²	100	39.8 Å²	39.8	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-47.5	178.1	-175.8	-171.6	-177.9	105.1	-15.9	112	E107 E108 V138 A139 Q144	E107-R142 PolarHBondContact O-NH2 3.12Å; E108-R142 IonicContact OE2-CZ 3.07Å; E108-R142 IonicContact OE2-NH1 2.79Å; E108-R142 PolarHBondContact OE2-NH1 3.31Å; E108-R142 IonicContact OE2-NH2 3.1Å; E108-R142 PolarHBondContact OE2-NH2 2.81Å; V138-R142 WeakPolarHBondContact O-CB 3.17Å; V138-R142 PolarHBondContact O-N 3.14Å; A139-R142 PolarHBondContact O-N 3.23Å; R142-Q144 PolarHBondContact O-N 2.99Å
143	L	91.9	Very high	90.6	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	0.9	177.5	-61.5	176.4	0	0	0	112.5	S85 Y87 F88 M114 V117 A139 V145	S85-L143 WeakPolarHBondContact CB-O 3.22Å; S85-L143 PolarHBondContact OG-O 3.43Å; Y87-L143 HydrophobicContact CD1-CD2 3.99Å; Y87-L143 HydrophobicContact CE1-CD2 3.92Å; F88-L143 HydrophobicContact CE2-CD2 4.14Å; F88-L143 HydrophobicContact CZ-CD2 3.84Å; M114-L143 HydrophobicContact SD-CD1 4.09Å; V117-L143 HydrophobicContact CG1-CD1 4.09Å; A139-L143 WeakPolarHBondContact O-CB 3.49Å; A139-L143 WeakPolarHBondContact O-CG 3.33Å; A139-L143 PolarHBondContact O-N 3.42Å; L143-V145 HydrophobicContact CB-CG2 4.12Å; L143-V145 PolarHBondContact O-N 2.9Å
144	Q	92.6	Very high	90.5	Very high	82 Å²	82	44.6 Å²	44.6	38%	0.383	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	35.4	179	-56.6	178.9	6.2	0	0	114	P86 A140 N141 R142 M146	P86-Q144 WeakPolarHBondContact CD-O 3.43Å; P86-Q144 HydrophobicContact CG-CB 4.46Å; A140-Q144 CarbonylContact O-C 3.58Å; A140-Q144 WeakPolarHBondContact O-CA 3.15Å; A140-Q144 PolarHBondContact O-N 3.47Å; N141-Q144 PolarHBondContact O-N 3.37Å; R142-Q144 PolarHBondContact O-N 2.99Å; Q144-M146 VanDerWaalsContact C-N 3.32Å; Q144-M146 PolarHBondContact O-N 3.48Å; Q144-M146 VanDerWaalsContact O-N 3.14Å
145	V	92.9	Very high	90.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.21	C	C	.	.			trans	-86.1	76.5	173.2	-173.4	0	0	0	0	108.3	V84 V117 F120 A140 L143 L148 Q149	V84-V145 HydrophobicContact CG1-CG1 4.07Å; V117-V145 HydrophobicContact CG1-CG2 4.31Å; F120-V145 HydrophobicContact CD1-CG1 4.11Å; F120-V145 HydrophobicContact CE1-CG1 4.06Å; A140-V145 PolarHBondContact O-N 3.4Å; L143-V145 HydrophobicContact CB-CG2 4.12Å; L143-V145 PolarHBondContact O-N 2.9Å; V145-L148 HydrophobicContact CB-CB 4.16Å; V145-L148 HydrophobicContact CG1-CB 3.59Å; V145-L148 HydrophobicContact CG1-CD2 4.34Å; V145-L148 WeakPolarHBondContact O-CB 3.26Å; V145-L148 PolarHBondContact O-N 2.95Å; V145-L148 VanDerWaalsContact O-N 3.09Å; V145-Q149 PolarHBondContact O-N 2.82Å
146	M	89.4	Confident	90.4	Very high	98 Å²	98	38.7 Å²	38.7	48%	0.483	19%	0.188	S	C	.	.	H	α-helix	trans	-54.4	-43.4	-171.6	-59.7	-56.7	-57.4	0	0	114.5	Q144 L148 Q149 D150	Q144-M146 VanDerWaalsContact C-N 3.32Å; Q144-M146 PolarHBondContact O-N 3.48Å; Q144-M146 VanDerWaalsContact O-N 3.14Å; M146-L148 VanDerWaalsContact C-N 3.27Å; M146-L148 PolarHBondContact O-N 3.45Å; M146-Q149 WeakPolarHBondContact O-CB 3.4Å; M146-Q149 PolarHBondContact O-N 3.15Å; M146-Q149 PolarHBondContact SD-OE1 2.9Å; M146-D150 PolarHBondContact O-N 3.49Å
147	P	90.1	Very high	90.2	Very high	75 Å²	75	42.3 Å²	42.3	49%	0.487	20%	0.204	S	C	.	.	H	α-helix	trans	-63	-34.1	179.1	-23.1	35.3	0	0	0	113.1	F120 L151	F120-P147 HydrophobicContact CE1-CB 4.19Å; F120-P147 HydrophobicContact CZ-CB 4.02Å; P147-L151 WeakPolarHBondContact O-CB 3.25Å; P147-L151 PolarHBondContact O-N 3.31Å; P147-L151 VanDerWaalsContact O-N 3.14Å
148	L	90.9	Very high	90	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-72.8	-41.2	176.7	-176.5	56.4	0	0	0	111.1	V117 F120 A126 L136 A140 V145 M146 D150 L151 C152	V117-L148 HydrophobicContact CB-CD2 4.39Å; V117-L148 HydrophobicContact CG1-CD2 4.45Å; V117-L148 HydrophobicContact CG2-CD2 3.89Å; F120-L148 HydrophobicContact CB-CD1 4.34Å; F120-L148 HydrophobicContact CB-CD2 4.37Å; F120-L148 HydrophobicContact CD1-CB 3.79Å; F120-L148 HydrophobicContact CD1-CD1 4.17Å; F120-L148 HydrophobicContact CD1-CD2 4.17Å; F120-L148 HydrophobicContact CD1-CG 4.27Å; F120-L148 HydrophobicContact CD2-CD1 3.85Å; F120-L148 HydrophobicContact CE1-CB 3.65Å; F120-L148 HydrophobicContact CE1-CD1 4.47Å; F120-L148 HydrophobicContact CE2-CD1 4.15Å; F120-L148 HydrophobicContact CG-CB 4.34Å; F120-L148 HydrophobicContact CG-CD1 3.84Å; F120-L148 HydrophobicContact CG-CD2 4.29Å; F120-L148 HydrophobicContact CG-CG 4.39Å; F120-L148 HydrophobicContact CZ-CB 4.08Å; F120-L148 HydrophobicContact CZ-CD1 4.45Å; A126-L148 HydrophobicContact CB-CD1 3.72Å; L136-L148 HydrophobicContact CD1-CD2 4.04Å; L136-L148 HydrophobicContact CD2-CD1 4.15Å; L136-L148 HydrophobicContact CG-CD1 4.5Å; L136-L148 HydrophobicContact CG-CD2 4.33Å; L136-L148 HydrophobicContact CG-CG 4.49Å; A140-L148 HydrophobicContact CB-CB 4.08Å; A140-L148 HydrophobicContact CB-CD2 4.03Å; A140-L148 HydrophobicContact CB-CG 3.9Å; V145-L148 HydrophobicContact CB-CB 4.16Å; V145-L148 HydrophobicContact CG1-CB 3.59Å; V145-L148 HydrophobicContact CG1-CD2 4.34Å; V145-L148 WeakPolarHBondContact O-CB 3.26Å; V145-L148 PolarHBondContact O-N 2.95Å; V145-L148 VanDerWaalsContact O-N 3.09Å; M146-L148 VanDerWaalsContact C-N 3.27Å; M146-L148 PolarHBondContact O-N 3.45Å; L148-D150 VanDerWaalsContact C-N 3.34Å; L148-D150 PolarHBondContact O-N 2.85Å; L148-L151 HydrophobicContact CD1-CD2 4.24Å; L148-L151 PolarHBondContact O-N 3.23Å; L148-C152 PolarHBondContact O-N 2.9Å; L148-C152 PolarHBondContact O-SG 3.28Å
149	Q	90.1	Very high	89.8	Confident	14 Å²	14	50.7 Å²	50.7	7%	0.065	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-46.3	174.7	-178.1	-177.5	9.6	0	0	111.2	F137 A140 N141 V145 M146 L151 C152 S153	F137-Q149 HydrophobicContact CD2-CG 3.98Å; F137-Q149 HydrophobicContact CE2-CG 3.65Å; F137-Q149 HydrophobicContact CZ-CG 4.46Å; A140-Q149 HydrophobicContact CB-CB 4.09Å; N141-Q149 HydrophobicContact CB-CG 4.5Å; N141-Q149 PolarHBondContact OD1-NE2 3.08Å; V145-Q149 PolarHBondContact O-N 2.82Å; M146-Q149 WeakPolarHBondContact O-CB 3.4Å; M146-Q149 PolarHBondContact O-N 3.15Å; M146-Q149 PolarHBondContact SD-OE1 2.9Å; Q149-L151 VanDerWaalsContact C-N 3.33Å; Q149-L151 PolarHBondContact O-N 3.32Å; Q149-C152 PolarHBondContact O-N 3.14Å; Q149-S153 WeakPolarHBondContact O-CB 3.21Å; Q149-S153 PolarHBondContact O-N 2.99Å
150	D	87.9	Confident	89.7	Confident	80 Å²	80	52.1 Å²	52.1	43%	0.428	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-41.4	177.4	-83.3	-10.4	0	0	0	112.1	M146 L148 S153 R154	M146-D150 PolarHBondContact O-N 3.49Å; L148-D150 VanDerWaalsContact C-N 3.34Å; L148-D150 PolarHBondContact O-N 2.85Å; D150-S153 PolarHBondContact O-N 3.22Å; D150-R154 VanDerWaalsContact O-CG 3.27Å; D150-R154 WeakPolarHBondContact O-CG 3.07Å; D150-R154 PolarHBondContact O-N 3.13Å
151	L	88.4	Confident	89.6	Confident	65 Å²	65	54.3 Å²	54.3	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-43.9	177.2	179.8	136	0	0	0	111.4	A126 L128 P147 L148 Q149 R154 F155	A126-L151 HydrophobicContact CB-CD2 4.17Å; L128-L151 HydrophobicContact CD1-CD2 3.44Å; L128-L151 VanDerWaalsContact CD1-CD2 3.44Å; L128-L151 HydrophobicContact CD1-CG 4.32Å; L128-L151 HydrophobicContact CD2-CD2 4.09Å; L128-L151 HydrophobicContact CG-CD2 3.8Å; P147-L151 WeakPolarHBondContact O-CB 3.25Å; P147-L151 PolarHBondContact O-N 3.31Å; P147-L151 VanDerWaalsContact O-N 3.14Å; L148-L151 HydrophobicContact CD1-CD2 4.24Å; L148-L151 PolarHBondContact O-N 3.23Å; Q149-L151 VanDerWaalsContact C-N 3.33Å; Q149-L151 PolarHBondContact O-N 3.32Å; L151-R154 PolarHBondContact O-N 3.32Å; L151-F155 PolarHBondContact O-N 3.02Å; L151-F155 VanDerWaalsContact O-N 3.11Å
152	C	90.6	Very high	89.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-45.4	175.1	-62.4	0	0	0	0	111.7	F137 L148 Q149 R154 F155 L156	F137-C152 HydrophobicContact CB-CB 3.84Å; F137-C152 HydrophobicContact CD2-CB 4.02Å; F137-C152 HydrophobicContact CG-CB 4.44Å; L148-C152 PolarHBondContact O-N 2.9Å; L148-C152 PolarHBondContact O-SG 3.28Å; Q149-C152 PolarHBondContact O-N 3.14Å; C152-R154 VanDerWaalsContact C-N 3.32Å; C152-R154 PolarHBondContact O-N 3.28Å; C152-F155 PolarHBondContact O-N 3.43Å; C152-F155 VanDerWaalsContact O-N 3.16Å; C152-L156 WeakPolarHBondContact O-CB 3.37Å; C152-L156 VanDerWaalsContact O-CG 3.28Å; C152-L156 WeakPolarHBondContact O-CG 3.43Å; C152-L156 PolarHBondContact O-N 2.92Å
153	S	89.4	Confident	89.5	Confident	5 Å²	5	54.1 Å²	54.1	4%	0.035	27%	0.265	C	S	.	.	H	α-helix	trans	-56	-45.1	177.5	177	0	0	0	0	112	Q149 D150 L156 F157 D177	Q149-S153 WeakPolarHBondContact O-CB 3.21Å; Q149-S153 PolarHBondContact O-N 2.99Å; D150-S153 PolarHBondContact O-N 3.22Å; S153-L156 PolarHBondContact O-N 3.34Å; S153-F157 VanDerWaalsContact O-CB 3.3Å; S153-F157 WeakPolarHBondContact O-CB 3.08Å; S153-F157 PolarHBondContact O-N 2.83Å; S153-D177 WeakPolarHBondContact CB-OD2 3.37Å; S153-D177 PolarHBondContact OG-OD2 3.32Å
154	R	86.3	Confident	89.4	Confident	141 Å²	141	56.1 Å²	56.1	53%	0.532	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-43.9	177	-71.7	173.1	-165.9	-179.1	7.3	111.9	D150 L151 C152 F157 E158	D150-R154 VanDerWaalsContact O-CG 3.27Å; D150-R154 WeakPolarHBondContact O-CG 3.07Å; D150-R154 PolarHBondContact O-N 3.13Å; L151-R154 PolarHBondContact O-N 3.32Å; C152-R154 VanDerWaalsContact C-N 3.32Å; C152-R154 PolarHBondContact O-N 3.28Å; R154-F157 WeakPolarHBondContact O-CB 3.48Å; R154-F157 PolarHBondContact O-N 3.15Å; R154-E158 WeakPolarHBondContact O-CG 3.47Å; R154-E158 PolarHBondContact O-N 3.3Å
155	F	88.3	Confident	89.4	Confident	41 Å²	41	52.2 Å²	52.2	18%	0.18	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-47.4	176.9	-178.8	-96.5	0	0	0	111.8	L128 L130 A133 L151 C152 F157 E158 H159	L128-F155 HydrophobicContact CB-CD1 4.17Å; L128-F155 HydrophobicContact CB-CD2 4.13Å; L128-F155 HydrophobicContact CB-CE1 4.19Å; L128-F155 HydrophobicContact CB-CE2 4.15Å; L128-F155 HydrophobicContact CB-CG 4.13Å; L128-F155 HydrophobicContact CB-CZ 4.18Å; L128-F155 HydrophobicContact CD1-CB 3.36Å; L128-F155 HydrophobicContact CD1-CD1 4.01Å; L128-F155 HydrophobicContact CD1-CD2 3.92Å; L128-F155 HydrophobicContact CD1-CG 3.5Å; L128-F155 VanDerWaalsContact CD1-CG 3.5Å; L130-F155 HydrophobicContact CD2-CE1 4.07Å; L130-F155 HydrophobicContact CD2-CZ 4.34Å; A133-F155 HydrophobicContact CB-CD1 3.69Å; A133-F155 HydrophobicContact CB-CE1 3.81Å; L151-F155 PolarHBondContact O-N 3.02Å; L151-F155 VanDerWaalsContact O-N 3.11Å; C152-F155 PolarHBondContact O-N 3.43Å; C152-F155 VanDerWaalsContact O-N 3.16Å; F155-F157 VanDerWaalsContact C-N 3.28Å; F155-F157 PolarHBondContact O-N 2.66Å; F155-E158 PolarHBondContact O-N 2.96Å; F155-E158 VanDerWaalsContact O-N 3.17Å; F155-H159 AromaticContact CD2-CD2 3.83Å; F155-H159 AromaticContact CE1-CD2 3.88Å; F155-H159 AromaticContact CE2-CD2 3.55Å; F155-H159 AromaticContact CE2-NE2 3.41Å; F155-H159 WeakPolarHBondContact CE2-NE2 3.17Å; F155-H159 AromaticContact CZ-CD2 3.58Å; F155-H159 AromaticContact CZ-NE2 3.65Å; F155-H159 PolarHBondContact O-CD2 2.85Å; F155-H159 VanDerWaalsContact O-CD2 3.31Å; F155-H159 PolarHBondContact O-N 2.72Å; F155-H159 VanDerWaalsContact O-N 3.08Å
156	L	89.8	Confident	89.2	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-38.5	175.6	-66.2	172	0	0	0	111.5	A133 E134 F137 C152 S153 H159 L160 M168 L171 L180	A133-L156 HydrophobicContact CB-CD2 3.71Å; A133-L156 HydrophobicContact CB-CG 4.37Å; E134-L156 HydrophobicContact CG-CD2 4.02Å; F137-L156 HydrophobicContact CB-CD1 4.01Å; F137-L156 HydrophobicContact CD2-CD1 4.31Å; F137-L156 HydrophobicContact CG-CD1 4.04Å; C152-L156 WeakPolarHBondContact O-CB 3.37Å; C152-L156 VanDerWaalsContact O-CG 3.28Å; C152-L156 WeakPolarHBondContact O-CG 3.43Å; C152-L156 PolarHBondContact O-N 2.92Å; S153-L156 PolarHBondContact O-N 3.34Å; L156-H159 CarbonylContact O-C 3.57Å; L156-H159 PolarHBondContact O-N 3.24Å; L156-L160 PolarHBondContact O-N 2.92Å; L156-L160 VanDerWaalsContact O-N 3.11Å; L156-M168 HydrophobicContact CB-CE 3.85Å; L156-M168 HydrophobicContact CB-SD 3.99Å; L156-M168 HydrophobicContact CD1-SD 4.48Å; L156-M168 HydrophobicContact CD2-CE 3.48Å; L156-M168 VanDerWaalsContact CD2-CE 3.48Å; L156-M168 HydrophobicContact CD2-SD 4.01Å; L156-M168 HydrophobicContact CG-CE 4.2Å; L156-M168 HydrophobicContact CG-SD 4.37Å; L156-L171 HydrophobicContact CD1-CD2 4.01Å; L156-L180 HydrophobicContact CB-CD1 4.38Å; L156-L180 HydrophobicContact CB-CD2 4.2Å; L156-L180 HydrophobicContact CD1-CD2 4.24Å
157	F	87.9	Confident	89.2	Confident	77 Å²	77	49.5 Å²	49.5	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-40.9	174.8	172.4	-92.2	0	0	0	112.9	S153 R154 F155 H159 L160 L179 L180 A183	S153-F157 VanDerWaalsContact O-CB 3.3Å; S153-F157 WeakPolarHBondContact O-CB 3.08Å; S153-F157 PolarHBondContact O-N 2.83Å; R154-F157 WeakPolarHBondContact O-CB 3.48Å; R154-F157 PolarHBondContact O-N 3.15Å; F155-F157 VanDerWaalsContact C-N 3.28Å; F155-F157 PolarHBondContact O-N 2.66Å; F157-H159 VanDerWaalsContact C-N 3.29Å; F157-H159 PolarHBondContact O-N 2.9Å; F157-L160 VanDerWaalsContact O-CB 3.3Å; F157-L160 WeakPolarHBondContact O-CB 3.19Å; F157-L160 PolarHBondContact O-N 3.27Å; F157-L179 HydrophobicContact CB-CD2 3.92Å; F157-L179 HydrophobicContact CD2-CD2 3.59Å; F157-L179 HydrophobicContact CE2-CD2 4.26Å; F157-L179 HydrophobicContact CG-CD2 3.78Å; F157-L180 HydrophobicContact CB-CD1 4.36Å; F157-A183 HydrophobicContact CD2-CB 3.45Å; F157-A183 VanDerWaalsContact CD2-CB 3.45Å; F157-A183 HydrophobicContact CE2-CB 3.4Å; F157-A183 VanDerWaalsContact CE2-CB 3.4Å
158	E	85.9	Confident	89.2	Confident	142 Å²	142	46.1 Å²	46.1	66%	0.664	23%	0.231	S	C	*	.	H	α-helix	trans	-67.4	-31.9	178.1	-73.9	-171.3	165.8	0	0	112.7	R154 F155	R154-E158 WeakPolarHBondContact O-CG 3.47Å; R154-E158 PolarHBondContact O-N 3.3Å; F155-E158 PolarHBondContact O-N 2.96Å; F155-E158 VanDerWaalsContact O-N 3.17Å
159	H	87.4	Confident	89.1	Confident	83 Å²	83	47.1 Å²	47.1	38%	0.384	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	14.1	177.1	-69.3	-75.7	0	0	0	114.1	L130 F155 L156 F157 S161 N164	L130-H159 HydrophobicContact CD2-CB 3.63Å; F155-H159 AromaticContact CD2-CD2 3.83Å; F155-H159 AromaticContact CE1-CD2 3.88Å; F155-H159 AromaticContact CE2-CD2 3.55Å; F155-H159 AromaticContact CE2-NE2 3.41Å; F155-H159 WeakPolarHBondContact CE2-NE2 3.17Å; F155-H159 AromaticContact CZ-CD2 3.58Å; F155-H159 AromaticContact CZ-NE2 3.65Å; F155-H159 PolarHBondContact O-CD2 2.85Å; F155-H159 VanDerWaalsContact O-CD2 3.31Å; F155-H159 PolarHBondContact O-N 2.72Å; F155-H159 VanDerWaalsContact O-N 3.08Å; L156-H159 CarbonylContact O-C 3.57Å; L156-H159 PolarHBondContact O-N 3.24Å; F157-H159 VanDerWaalsContact C-N 3.29Å; F157-H159 PolarHBondContact O-N 2.9Å; H159-S161 PolarHBondContact O-N 3.26Å; H159-N164 PolarHBondContact O-ND2 3.33Å
160	L	90	Very high	89.1	Confident	35 Å²	35	49 Å²	49	18%	0.183	25%	0.25	C	C	.	.			trans	-67.8	126.8	175.2	-173.9	70.1	0	0	0	111.2	L156 F157 C165 M168 A183 L187	L156-L160 PolarHBondContact O-N 2.92Å; L156-L160 VanDerWaalsContact O-N 3.11Å; F157-L160 VanDerWaalsContact O-CB 3.3Å; F157-L160 WeakPolarHBondContact O-CB 3.19Å; F157-L160 PolarHBondContact O-N 3.27Å; L160-C165 HydrophobicContact CD1-CB 4.24Å; L160-M168 HydrophobicContact CD1-CB 3.85Å; L160-M168 HydrophobicContact CD1-CG 3.87Å; L160-A183 HydrophobicContact CD2-CB 3.89Å; L160-L187 HydrophobicContact CD2-CB 4.37Å; L160-L187 HydrophobicContact CD2-CD2 4.03Å; L160-L187 HydrophobicContact CG-CD2 3.77Å
161	S	91	Very high	89.1	Confident	46 Å²	46	46.3 Å²	46.3	32%	0.322	24%	0.235	S	C	.	.			trans	-134.5	169.5	-176.7	77.8	0	0	0	0	111	H159 E163 N164 C165 L187	H159-S161 PolarHBondContact O-N 3.26Å; S161-E163 PolarHBondContact O-N 2.95Å; S161-E163 PolarHBondContact OG-N 2.91Å; S161-N164 WeakPolarHBondContact CA-OD1 3.21Å; S161-N164 PolarHBondContact N-OD1 3.07Å; S161-N164 PolarHBondContact O-OD1 2.87Å; S161-N164 PolarHBondContact OG-N 3.5Å; S161-N164 PolarHBondContact OG-OD1 3.47Å; S161-C165 VanDerWaalsContact O-CB 3.26Å; S161-C165 WeakPolarHBondContact O-CB 3.42Å; S161-C165 PolarHBondContact O-N 3.44Å; S161-L187 VanDerWaalsContact C-CD2 3.45Å; S161-L187 WeakPolarHBondContact O-CD2 3.35Å
162	V	90.1	Very high	89.3	Confident	21 Å²	21	43.2 Å²	43.2	13%	0.127	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.5	177.6	-175.8	0	0	0	0	111.6	C165 H191 R194 V195 Q198	V162-C165 PolarHBondContact O-SG 3.04Å; V162-H191 HydrophobicContact CG1-CB 4.04Å; V162-H191 HydrophobicContact CG2-CB 4.13Å; V162-R194 HydrophobicContact CG1-CB 4.31Å; V162-R194 HydrophobicContact CG1-CG 3.98Å; V162-V195 HydrophobicContact CG1-CG2 3.81Å; V162-Q198 PolarHBondContact O-NE2 3.31Å
163	E	89.2	Confident	89.2	Confident	125 Å²	125	47.6 Å²	47.6	58%	0.584	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-38.2	-176.3	-72.1	168.6	-162.7	0	0	112.8	S161 R194	S161-E163 PolarHBondContact O-N 2.95Å; S161-E163 PolarHBondContact OG-N 2.91Å; E163-R194 IonicContact OE1-NH2 2.62Å; E163-R194 PolarHBondContact OE1-NH2 3.08Å
164	N	89.6	Confident	89.1	Confident	44 Å²	44	51 Å²	51	24%	0.235	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-1.7	179.5	64.8	-0.8	0	0	0	114.1	H159 S161 L166 G167 M168	H159-N164 PolarHBondContact O-ND2 3.33Å; S161-N164 WeakPolarHBondContact CA-OD1 3.21Å; S161-N164 PolarHBondContact N-OD1 3.07Å; S161-N164 PolarHBondContact O-OD1 2.87Å; S161-N164 PolarHBondContact OG-N 3.5Å; S161-N164 PolarHBondContact OG-OD1 3.47Å; N164-L166 VanDerWaalsContact C-N 3.31Å; N164-L166 PolarHBondContact O-N 3.04Å; N164-G167 PolarHBondContact O-N 2.93Å; N164-M168 HydrophobicContact CB-CG 4.39Å; N164-M168 WeakPolarHBondContact O-CB 3.27Å; N164-M168 VanDerWaalsContact O-CG 3.27Å; N164-M168 WeakPolarHBondContact O-CG 3.12Å; N164-M168 PolarHBondContact O-N 3.04Å
165	C	91.3	Very high	89.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-33.3	-171.2	62.8	0	0	0	0	115.2	L160 S161 V162 Y169 L187 V188	L160-C165 HydrophobicContact CD1-CB 4.24Å; S161-C165 VanDerWaalsContact O-CB 3.26Å; S161-C165 WeakPolarHBondContact O-CB 3.42Å; S161-C165 PolarHBondContact O-N 3.44Å; V162-C165 PolarHBondContact O-SG 3.04Å; C165-Y169 VanDerWaalsContact O-CB 3.29Å; C165-Y169 WeakPolarHBondContact O-CB 3.3Å; C165-Y169 PolarHBondContact O-N 3.41Å; C165-L187 HydrophobicContact CB-CD2 4.12Å; C165-V188 HydrophobicContact CB-CG2 4.15Å
166	L	89.9	Confident	89.2	Confident	9 Å²	9	51.4 Å²	51.4	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-75.9	-39.9	178.7	-67.2	178.4	0	0	0	112	N164 Y169 S170 V188 V195 D200 F201 L204	N164-L166 VanDerWaalsContact C-N 3.31Å; N164-L166 PolarHBondContact O-N 3.04Å; L166-Y169 WeakPolarHBondContact O-CB 3.23Å; L166-Y169 PolarHBondContact O-N 3.44Å; L166-S170 PolarHBondContact O-N 3.16Å; L166-V188 HydrophobicContact CD2-CG1 4.5Å; L166-V188 HydrophobicContact CD2-CG2 3.8Å; L166-V195 HydrophobicContact CD1-CG1 3.54Å; L166-V195 HydrophobicContact CD2-CG1 3.81Å; L166-V195 HydrophobicContact CG-CG1 3.68Å; L166-D200 HydrophobicContact CB-CB 4.04Å; L166-D200 HydrophobicContact CD1-CB 3.87Å; L166-F201 HydrophobicContact CD1-CB 3.91Å; L166-F201 VanDerWaalsContact CD1-N 3.33Å; L166-L204 HydrophobicContact CD2-CD1 4.21Å; L166-L204 HydrophobicContact CD2-CD2 4.3Å
167	G	88.3	Confident	89	Confident	33 Å²	33	52.1 Å²	52.1	34%	0.34	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-49.8	171.6	0	0	0	0	0	111.4	N164 Y169 S170 L171	N164-G167 PolarHBondContact O-N 2.93Å; G167-Y169 VanDerWaalsContact C-N 3.28Å; G167-Y169 PolarHBondContact O-N 2.54Å; G167-S170 WeakPolarHBondContact O-CB 3.14Å; G167-S170 PolarHBondContact O-N 3.38Å; G167-S170 VanDerWaalsContact O-N 3.08Å; G167-L171 PolarHBondContact O-N 2.98Å
168	M	90.4	Very high	89	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.02	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-35.9	175.6	-68.2	-69.8	-163.7	0	0	112.9	L156 L160 N164 A172 L180	L156-M168 HydrophobicContact CB-CE 3.85Å; L156-M168 HydrophobicContact CB-SD 3.99Å; L156-M168 HydrophobicContact CD1-SD 4.48Å; L156-M168 HydrophobicContact CD2-CE 3.48Å; L156-M168 VanDerWaalsContact CD2-CE 3.48Å; L156-M168 HydrophobicContact CD2-SD 4.01Å; L156-M168 HydrophobicContact CG-CE 4.2Å; L156-M168 HydrophobicContact CG-SD 4.37Å; L160-M168 HydrophobicContact CD1-CB 3.85Å; L160-M168 HydrophobicContact CD1-CG 3.87Å; N164-M168 HydrophobicContact CB-CG 4.39Å; N164-M168 WeakPolarHBondContact O-CB 3.27Å; N164-M168 VanDerWaalsContact O-CG 3.27Å; N164-M168 WeakPolarHBondContact O-CG 3.12Å; N164-M168 PolarHBondContact O-N 3.04Å; M168-A172 WeakPolarHBondContact O-CB 3.34Å; M168-A172 PolarHBondContact O-N 3.5Å; M168-L180 HydrophobicContact CB-CD1 4.48Å; M168-L180 HydrophobicContact SD-CD2 4.13Å
169	Y	90.1	Very high	89	Confident	20 Å²	20	50.8 Å²	50.8	8%	0.078	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-46.7	173.3	169.5	-96.1	0	0	0	111.7	C165 L166 G167 A172 R173 L181 L185 L204 T208	C165-Y169 VanDerWaalsContact O-CB 3.29Å; C165-Y169 WeakPolarHBondContact O-CB 3.3Å; C165-Y169 PolarHBondContact O-N 3.41Å; L166-Y169 WeakPolarHBondContact O-CB 3.23Å; L166-Y169 PolarHBondContact O-N 3.44Å; G167-Y169 VanDerWaalsContact C-N 3.28Å; G167-Y169 PolarHBondContact O-N 2.54Å; Y169-A172 PolarHBondContact O-N 3.44Å; Y169-R173 WeakPolarHBondContact O-CB 3.22Å; Y169-R173 PolarHBondContact O-N 3.35Å; Y169-L181 HydrophobicContact CD2-CD1 3.59Å; Y169-L181 HydrophobicContact CD2-CG 4.49Å; Y169-L181 HydrophobicContact CE2-CD1 3.37Å; Y169-L181 HydrophobicContact CE2-CG 4.29Å; Y169-L185 HydrophobicContact CD2-CD1 4.45Å; Y169-L185 HydrophobicContact CD2-CD2 3.67Å; Y169-L185 HydrophobicContact CD2-CG 3.69Å; Y169-L185 HydrophobicContact CE2-CD1 3.94Å; Y169-L185 HydrophobicContact CE2-CD2 3.42Å; Y169-L185 VanDerWaalsContact CE2-CD2 3.42Å; Y169-L185 HydrophobicContact CE2-CG 3.6Å; Y169-L204 HydrophobicContact CD1-CD2 4.43Å; Y169-L204 HydrophobicContact CE1-CD2 4.48Å; Y169-T208 HydrophobicContact CE1-CG2 3.62Å; Y169-T208 WeakPolarHBondContact OH-CG2 3.41Å; Y169-T208 PolarHBondContact OH-OG1 2.83Å
170	S	89.3	Confident	89.1	Confident	55 Å²	55	46.9 Å²	46.9	39%	0.385	25%	0.25	S	S	.	.	H	α-helix	trans	-61.2	-47.7	178	-168.2	0	0	0	0	111.1	L166 G167 A172 R173 S174	L166-S170 PolarHBondContact O-N 3.16Å; G167-S170 WeakPolarHBondContact O-CB 3.14Å; G167-S170 PolarHBondContact O-N 3.38Å; G167-S170 VanDerWaalsContact O-N 3.08Å; S170-A172 PolarHBondContact O-N 3.4Å; S170-R173 PolarHBondContact O-N 3.49Å; S170-S174 PolarHBondContact O-N 3.16Å; S170-S174 PolarHBondContact O-OG 3.36Å; S170-S174 VanDerWaalsContact O-OG 3.08Å
171	L	89	Confident	89.1	Confident	22 Å²	22	46.6 Å²	46.6	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-58	-50.5	176.6	-175.3	69.2	0	0	0	111.6	E134 F137 V138 L156 G167 R173 S174 H175	E134-L171 HydrophobicContact CB-CD2 4.25Å; E134-L171 HydrophobicContact CG-CD2 4.07Å; F137-L171 HydrophobicContact CD1-CD1 4.2Å; F137-L171 HydrophobicContact CD1-CD2 3.96Å; F137-L171 HydrophobicContact CD1-CG 3.99Å; F137-L171 HydrophobicContact CE1-CD2 4.39Å; F137-L171 HydrophobicContact CE1-CG 4.07Å; V138-L171 HydrophobicContact CG2-CD1 3.68Å; L156-L171 HydrophobicContact CD1-CD2 4.01Å; G167-L171 PolarHBondContact O-N 2.98Å; L171-R173 VanDerWaalsContact C-N 3.28Å; L171-R173 PolarHBondContact O-N 3.11Å; L171-S174 PolarHBondContact O-N 2.95Å; L171-H175 PolarHBondContact O-CD2 3.07Å; L171-H175 VanDerWaalsContact O-CD2 3.31Å; L171-H175 PolarHBondContact O-N 3.2Å; L171-H175 VanDerWaalsContact O-N 3.12Å
172	A	90.6	Very high	89	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-36.3	179.7	0	0	0	0	0	112.5	M168 Y169 S170 H176 D177 L180 L181	M168-A172 WeakPolarHBondContact O-CB 3.34Å; M168-A172 PolarHBondContact O-N 3.5Å; Y169-A172 PolarHBondContact O-N 3.44Å; S170-A172 PolarHBondContact O-N 3.4Å; A172-H176 CarbonylContact O-C 3.52Å; A172-H176 WeakPolarHBondContact O-CA 3.48Å; A172-H176 PolarHBondContact O-N 2.75Å; A172-D177 HydrophobicContact CB-CB 4.4Å; A172-D177 PolarHBondContact O-N 3.04Å; A172-L180 HydrophobicContact CB-CB 3.86Å; A172-L180 HydrophobicContact CB-CD2 4.09Å; A172-L180 HydrophobicContact CB-CG 3.96Å; A172-L181 HydrophobicContact CB-CB 3.96Å; A172-L181 HydrophobicContact CB-CD1 4.32Å
173	R	88.8	Confident	88.9	Confident	92 Å²	92	52 Å²	52	35%	0.347	26%	0.262	S	S	.	.	H	α-helix	trans	-68.1	-44.9	177.6	-175.4	174	67.2	176.7	4.2	111.8	Y169 S170 L171 H175 H176 L181 D205 T208	Y169-R173 WeakPolarHBondContact O-CB 3.22Å; Y169-R173 PolarHBondContact O-N 3.35Å; S170-R173 PolarHBondContact O-N 3.49Å; L171-R173 VanDerWaalsContact C-N 3.28Å; L171-R173 PolarHBondContact O-N 3.11Å; R173-H175 VanDerWaalsContact C-N 3.25Å; R173-H175 PolarHBondContact O-N 2.86Å; R173-H176 PolarHBondContact O-N 3Å; R173-H176 PolarHBondContact O-ND1 3.05Å; R173-L181 HydrophobicContact CB-CD1 3.96Å; R173-D205 IonicContact CZ-OD1 3.37Å; R173-D205 IonicContact NH1-OD1 3.91Å; R173-D205 PolarHBondContact NH1-OD1 3.22Å; R173-D205 IonicContact NH1-OD2 3.31Å; R173-D205 IonicContact NH2-OD1 2.7Å; R173-D205 PolarHBondContact NH2-OD1 2.97Å; R173-D205 VanDerWaalsContact NH2-OD1 3.15Å; R173-T208 PolarHBondContact NH1-OG1 2.76Å
174	S	87.8	Confident	89	Confident	78 Å²	78	46 Å²	46	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-63.9	-30.7	179.6	-61.1	0	0	0	0	112.8	S170 L171	S170-S174 PolarHBondContact O-N 3.16Å; S170-S174 PolarHBondContact O-OG 3.36Å; S170-S174 VanDerWaalsContact O-OG 3.08Å; L171-S174 PolarHBondContact O-N 2.95Å
175	H	88.1	Confident	89	Confident	36 Å²	36	46.6 Å²	46.6	17%	0.167	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	12	-179	-65.6	-73.1	0	0	0	114.3	F137 N141 L171 R173 D177	F137-H175 HydrophobicContact CE1-CB 3.59Å; F137-H175 AromaticContact CE1-CD2 3.94Å; F137-H175 AromaticContact CE1-CG 3.83Å; F137-H175 HydrophobicContact CZ-CB 3.97Å; N141-H175 PolarHBondContact ND2-ND1 3.38Å; L171-H175 PolarHBondContact O-CD2 3.07Å; L171-H175 VanDerWaalsContact O-CD2 3.31Å; L171-H175 PolarHBondContact O-N 3.2Å; L171-H175 VanDerWaalsContact O-N 3.12Å; R173-H175 VanDerWaalsContact C-N 3.25Å; R173-H175 PolarHBondContact O-N 2.86Å; H175-D177 PolarHBondContact O-N 3.37Å; H175-D177 VanDerWaalsContact O-N 3.14Å
176	H	87.8	Confident	88.9	Confident	154 Å²	154	54.1 Å²	54.1	71%	0.713	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	26.7	176.8	-51.7	-45.7	0	0	0	115.8	A172 R173 Q178	A172-H176 CarbonylContact O-C 3.52Å; A172-H176 WeakPolarHBondContact O-CA 3.48Å; A172-H176 PolarHBondContact O-N 2.75Å; R173-H176 PolarHBondContact O-N 3Å; R173-H176 PolarHBondContact O-ND1 3.05Å; H176-Q178 PolarHBondContact O-N 3.23Å
177	D	87.3	Confident	88.9	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.102	27%	0.271	C	S	.	.			trans	-79	104.6	176.8	-176.1	-26	0	0	0	111.3	F137 S153 A172 H175 L179 L180 L181	F137-D177 HydrophobicContact CZ-CB 3.94Å; S153-D177 WeakPolarHBondContact CB-OD2 3.37Å; S153-D177 PolarHBondContact OG-OD2 3.32Å; A172-D177 HydrophobicContact CB-CB 4.4Å; A172-D177 PolarHBondContact O-N 3.04Å; H175-D177 PolarHBondContact O-N 3.37Å; H175-D177 VanDerWaalsContact O-N 3.14Å; D177-L179 PolarHBondContact O-N 3.2Å; D177-L179 WeakPolarHBondContact OD1-CB 3.44Å; D177-L179 PolarHBondContact OD1-N 3.42Å; D177-L180 HydrophobicContact CB-CB 4.43Å; D177-L180 PolarHBondContact OD1-N 3.26Å; D177-L181 WeakPolarHBondContact O-CB 3.5Å; D177-L181 PolarHBondContact O-N 3.27Å
178	Q	88.1	Confident	89.1	Confident	103 Å²	103	53.7 Å²	53.7	48%	0.481	26%	0.255	S	S	.	.	H	α-helix	trans	-69.7	-29.5	-177.9	-66.2	-62.1	-37.4	0	0	114	H176 R182	H176-Q178 PolarHBondContact O-N 3.23Å; Q178-R182 WeakPolarHBondContact O-CB 3.38Å; Q178-R182 WeakPolarHBondContact O-CD 3.48Å; Q178-R182 WeakPolarHBondContact O-CG 3.39Å; Q178-R182 PolarHBondContact O-N 3.05Å; Q178-R182 VanDerWaalsContact O-N 3.15Å
179	L	85.9	Confident	89.1	Confident	88 Å²	88	54 Å²	54	46%	0.461	26%	0.258	S	S	.	.	H	α-helix	trans	-71.2	-52.5	-177.3	-176.5	150.9	0	0	0	109.3	F157 D177 A183	F157-L179 HydrophobicContact CB-CD2 3.92Å; F157-L179 HydrophobicContact CD2-CD2 3.59Å; F157-L179 HydrophobicContact CE2-CD2 4.26Å; F157-L179 HydrophobicContact CG-CD2 3.78Å; D177-L179 PolarHBondContact O-N 3.2Å; D177-L179 WeakPolarHBondContact OD1-CB 3.44Å; D177-L179 PolarHBondContact OD1-N 3.42Å; L179-A183 WeakPolarHBondContact O-CB 3.45Å; L179-A183 PolarHBondContact O-N 3.16Å; L179-A183 VanDerWaalsContact O-N 3.1Å
180	L	89	Confident	89	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-41.5	179.3	-170.3	61.1	0	0	0	110.8	L156 F157 M168 A172 D177 R182 A183 S184	L156-L180 HydrophobicContact CB-CD1 4.38Å; L156-L180 HydrophobicContact CB-CD2 4.2Å; L156-L180 HydrophobicContact CD1-CD2 4.24Å; F157-L180 HydrophobicContact CB-CD1 4.36Å; M168-L180 HydrophobicContact CB-CD1 4.48Å; M168-L180 HydrophobicContact SD-CD2 4.13Å; A172-L180 HydrophobicContact CB-CB 3.86Å; A172-L180 HydrophobicContact CB-CD2 4.09Å; A172-L180 HydrophobicContact CB-CG 3.96Å; D177-L180 HydrophobicContact CB-CB 4.43Å; D177-L180 PolarHBondContact OD1-N 3.26Å; L180-R182 PolarHBondContact O-N 3.32Å; L180-A183 WeakPolarHBondContact O-CB 3.21Å; L180-A183 PolarHBondContact O-N 2.85Å; L180-S184 WeakPolarHBondContact O-CB 3.27Å; L180-S184 PolarHBondContact O-N 3.41Å; L180-S184 PolarHBondContact O-OG 3.01Å
181	L	90.1	Very high	89.1	Confident	29 Å²	29	59.2 Å²	59.2	15%	0.152	28%	0.277	C	S	.	.	H	α-helix	trans	-57.1	-51	178	-173.4	78.6	0	0	0	112.2	Y169 A172 R173 D177 A183 S184 L185	Y169-L181 HydrophobicContact CD2-CD1 3.59Å; Y169-L181 HydrophobicContact CD2-CG 4.49Å; Y169-L181 HydrophobicContact CE2-CD1 3.37Å; Y169-L181 HydrophobicContact CE2-CG 4.29Å; A172-L181 HydrophobicContact CB-CB 3.96Å; A172-L181 HydrophobicContact CB-CD1 4.32Å; R173-L181 HydrophobicContact CB-CD1 3.96Å; D177-L181 WeakPolarHBondContact O-CB 3.5Å; D177-L181 PolarHBondContact O-N 3.27Å; L181-A183 VanDerWaalsContact C-N 3.32Å; L181-A183 PolarHBondContact O-N 3.14Å; L181-S184 PolarHBondContact O-N 3.2Å; L181-L185 HydrophobicContact CG-CD1 4.42Å; L181-L185 WeakPolarHBondContact O-CB 3.48Å; L181-L185 WeakPolarHBondContact O-CG 3.39Å; L181-L185 PolarHBondContact O-N 3.41Å
182	R	88.3	Confident	89.2	Confident	169 Å²	169	58.2 Å²	58.2	64%	0.638	27%	0.272	S	S	*	.	H	α-helix	trans	-66.6	-34.9	179.9	-72.2	174.6	177.3	-175	-1.5	112	Q178 L180 R186	Q178-R182 WeakPolarHBondContact O-CB 3.38Å; Q178-R182 WeakPolarHBondContact O-CD 3.48Å; Q178-R182 WeakPolarHBondContact O-CG 3.39Å; Q178-R182 PolarHBondContact O-N 3.05Å; Q178-R182 VanDerWaalsContact O-N 3.15Å; L180-R182 PolarHBondContact O-N 3.32Å; R182-R186 VanDerWaalsContact O-CB 3.27Å; R182-R186 WeakPolarHBondContact O-CB 3.35Å; R182-R186 PolarHBondContact O-N 3.27Å; R182-R186 VanDerWaalsContact O-N 3.13Å
183	A	88	Confident	89.2	Confident	11 Å²	11	59.8 Å²	59.8	9%	0.091	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-48.7	176.8	0	0	0	0	0	111.7	F157 L160 L179 L180 L181 R186 L187	F157-A183 HydrophobicContact CD2-CB 3.45Å; F157-A183 VanDerWaalsContact CD2-CB 3.45Å; F157-A183 HydrophobicContact CE2-CB 3.4Å; F157-A183 VanDerWaalsContact CE2-CB 3.4Å; L160-A183 HydrophobicContact CD2-CB 3.89Å; L179-A183 WeakPolarHBondContact O-CB 3.45Å; L179-A183 PolarHBondContact O-N 3.16Å; L179-A183 VanDerWaalsContact O-N 3.1Å; L180-A183 WeakPolarHBondContact O-CB 3.21Å; L180-A183 PolarHBondContact O-N 2.85Å; L181-A183 VanDerWaalsContact C-N 3.32Å; L181-A183 PolarHBondContact O-N 3.14Å; A183-R186 PolarHBondContact O-N 3.38Å; A183-L187 PolarHBondContact O-N 2.92Å
184	S	92	Very high	89.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-50.2	178.4	-60.4	0	0	0	0	111.4	L180 L181 R186 L187 V188	L180-S184 WeakPolarHBondContact O-CB 3.27Å; L180-S184 PolarHBondContact O-N 3.41Å; L180-S184 PolarHBondContact O-OG 3.01Å; L181-S184 PolarHBondContact O-N 3.2Å; S184-R186 VanDerWaalsContact C-N 3.3Å; S184-R186 PolarHBondContact O-N 3.3Å; S184-L187 PolarHBondContact O-N 3Å; S184-L187 VanDerWaalsContact O-N 3.08Å; S184-V188 VanDerWaalsContact O-CG2 3.32Å; S184-V188 WeakPolarHBondContact O-CG2 3.34Å; S184-V188 PolarHBondContact O-N 3.34Å
185	L	89.6	Confident	89.5	Confident	56 Å²	56	58.1 Å²	58.1	29%	0.293	26%	0.264	S	S	.	.	H	α-helix	trans	-59.1	-39.5	176.8	-76.3	176.2	0	0	0	112.8	Y169 L181 L187 V188 A189 L212	Y169-L185 HydrophobicContact CD2-CD1 4.45Å; Y169-L185 HydrophobicContact CD2-CD2 3.67Å; Y169-L185 HydrophobicContact CD2-CG 3.69Å; Y169-L185 HydrophobicContact CE2-CD1 3.94Å; Y169-L185 HydrophobicContact CE2-CD2 3.42Å; Y169-L185 VanDerWaalsContact CE2-CD2 3.42Å; Y169-L185 HydrophobicContact CE2-CG 3.6Å; L181-L185 HydrophobicContact CG-CD1 4.42Å; L181-L185 WeakPolarHBondContact O-CB 3.48Å; L181-L185 WeakPolarHBondContact O-CG 3.39Å; L181-L185 PolarHBondContact O-N 3.41Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L185-L187 PolarHBondContact O-N 2.95Å; L185-V188 PolarHBondContact O-N 2.8Å; L185-A189 VanDerWaalsContact O-CB 3.31Å; L185-A189 WeakPolarHBondContact O-CB 3.29Å; L185-A189 PolarHBondContact O-N 3.36Å; L185-L212 HydrophobicContact CD2-CD2 3.72Å; L185-L212 HydrophobicContact CD2-CG 4.49Å
186	R	88.8	Confident	89.7	Confident	159 Å²	159	56.9 Å²	56.9	60%	0.6	26%	0.26	S	S	*	.	H	α-helix	trans	-64.1	-40.5	176.7	-175.1	-174.1	-58.9	164.9	3	111.4	R182 A183 S184 Q190	R182-R186 VanDerWaalsContact O-CB 3.27Å; R182-R186 WeakPolarHBondContact O-CB 3.35Å; R182-R186 PolarHBondContact O-N 3.27Å; R182-R186 VanDerWaalsContact O-N 3.13Å; A183-R186 PolarHBondContact O-N 3.38Å; S184-R186 VanDerWaalsContact C-N 3.3Å; S184-R186 PolarHBondContact O-N 3.3Å; R186-Q190 WeakPolarHBondContact O-CB 3.47Å; R186-Q190 VanDerWaalsContact O-CG 3.26Å; R186-Q190 WeakPolarHBondContact O-CG 3.32Å; R186-Q190 PolarHBondContact O-N 3.16Å
187	L	90.3	Very high	89.8	Confident	31 Å²	31	58.7 Å²	58.7	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-70.6	-42.3	179.2	-167	66.9	0	0	0	111.6	L160 S161 C165 A183 S184 L185 A189 Q190 H191	L160-L187 HydrophobicContact CD2-CB 4.37Å; L160-L187 HydrophobicContact CD2-CD2 4.03Å; L160-L187 HydrophobicContact CG-CD2 3.77Å; S161-L187 VanDerWaalsContact C-CD2 3.45Å; S161-L187 WeakPolarHBondContact O-CD2 3.35Å; C165-L187 HydrophobicContact CB-CD2 4.12Å; A183-L187 PolarHBondContact O-N 2.92Å; S184-L187 PolarHBondContact O-N 3Å; S184-L187 VanDerWaalsContact O-N 3.08Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L185-L187 PolarHBondContact O-N 2.95Å; L187-A189 VanDerWaalsContact C-N 3.33Å; L187-A189 PolarHBondContact O-N 3.05Å; L187-Q190 PolarHBondContact O-N 2.6Å; L187-H191 PolarHBondContact O-N 3.18Å
188	V	91.6	Very high	90	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-56.3	-48.9	172.3	171.2	0	0	0	0	110.1	C165 L166 S184 L185 Q190 H191 F192 V195 L212	C165-V188 HydrophobicContact CB-CG2 4.15Å; L166-V188 HydrophobicContact CD2-CG1 4.5Å; L166-V188 HydrophobicContact CD2-CG2 3.8Å; S184-V188 VanDerWaalsContact O-CG2 3.32Å; S184-V188 WeakPolarHBondContact O-CG2 3.34Å; S184-V188 PolarHBondContact O-N 3.34Å; L185-V188 PolarHBondContact O-N 2.8Å; V188-Q190 PolarHBondContact O-N 2.9Å; V188-H191 CarbonylContact O-C 3.59Å; V188-H191 PolarHBondContact O-N 2.81Å; V188-F192 WeakPolarHBondContact O-CA 3.49Å; V188-F192 WeakPolarHBondContact O-CB 3.27Å; V188-F192 PolarHBondContact O-N 3.43Å; V188-V195 HydrophobicContact CG1-CG1 4.21Å; V188-V195 HydrophobicContact CG2-CG1 4.4Å; V188-L212 HydrophobicContact CG1-CD1 4.15Å; V188-L212 HydrophobicContact CG1-CD2 4.07Å
189	A	89.9	Confident	90	Very high	10 Å²	10	62.6 Å²	62.6	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-43.7	178.8	0	0	0	0	0	111.8	L185 L187 H191 G219	L185-A189 VanDerWaalsContact O-CB 3.31Å; L185-A189 WeakPolarHBondContact O-CB 3.29Å; L185-A189 PolarHBondContact O-N 3.36Å; L187-A189 VanDerWaalsContact C-N 3.33Å; L187-A189 PolarHBondContact O-N 3.05Å; A189-H191 PolarHBondContact O-N 3.33Å; A189-G219 WeakPolarHBondContact O-CA 3.44Å; A189-G219 PolarHBondContact O-N 2.77Å
190	Q	89.1	Confident	90.1	Very high	101 Å²	101	61.8 Å²	61.8	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-67.7	-30.8	-179.1	-75.9	176.3	14.6	0	0	114.4	R186 L187 V188	R186-Q190 WeakPolarHBondContact O-CB 3.47Å; R186-Q190 VanDerWaalsContact O-CG 3.26Å; R186-Q190 WeakPolarHBondContact O-CG 3.32Å; R186-Q190 PolarHBondContact O-N 3.16Å; L187-Q190 PolarHBondContact O-N 2.6Å; V188-Q190 PolarHBondContact O-N 2.9Å
191	H	90.4	Very high	90.2	Very high	84 Å²	84	61.8 Å²	61.8	39%	0.389	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	31.1	-175.7	-66.6	-60.9	0	0	0	112.9	V162 L187 V188 A189 R194 V195	V162-H191 HydrophobicContact CG1-CB 4.04Å; V162-H191 HydrophobicContact CG2-CB 4.13Å; L187-H191 PolarHBondContact O-N 3.18Å; V188-H191 CarbonylContact O-C 3.59Å; V188-H191 PolarHBondContact O-N 2.81Å; A189-H191 PolarHBondContact O-N 3.33Å; H191-R194 PolarHBondContact O-N 3.45Å; H191-V195 PolarHBondContact O-N 3.13Å; H191-V195 VanDerWaalsContact O-N 3.14Å
192	F	92.6	Very high	90.1	Very high	1 Å²	1	61.3 Å²	61.3	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-51.6	-45.4	-172.4	-176.2	-96.7	0	0	0	114.5	V188 R194 V195 A196 F201 L213 L218 V220 A229	V188-F192 WeakPolarHBondContact O-CA 3.49Å; V188-F192 WeakPolarHBondContact O-CB 3.27Å; V188-F192 PolarHBondContact O-N 3.43Å; F192-R194 PolarHBondContact O-N 3.15Å; F192-V195 PolarHBondContact O-N 3Å; F192-V195 VanDerWaalsContact O-N 3.11Å; F192-A196 HydrophobicContact CE1-CB 4.23Å; F192-A196 HydrophobicContact CZ-CB 4.39Å; F192-A196 WeakPolarHBondContact O-CB 3.47Å; F192-A196 PolarHBondContact O-N 3.45Å; F192-F201 AromaticContact CE2-CE2 3.85Å; F192-F201 HydrophobicContact CE2-CE2 3.85Å; F192-F201 HydrophobicContact CE2-CZ 4.21Å; F192-F201 HydrophobicContact CZ-CE2 4.21Å; F192-F201 HydrophobicContact CZ-CZ 4.11Å; F192-L213 HydrophobicContact CE1-CD2 4.5Å; F192-L213 HydrophobicContact CE2-CD2 4.23Å; F192-L213 HydrophobicContact CZ-CD2 3.69Å; F192-L218 HydrophobicContact CB-CD1 3.81Å; F192-L218 HydrophobicContact CB-CG 4.03Å; F192-L218 HydrophobicContact CD1-CD1 4.31Å; F192-L218 HydrophobicContact CD1-CD2 4Å; F192-L218 HydrophobicContact CD1-CG 4.21Å; F192-L218 HydrophobicContact CD2-CD1 3.55Å; F192-L218 HydrophobicContact CD2-CG 4.33Å; F192-L218 HydrophobicContact CE1-CD2 4.17Å; F192-L218 HydrophobicContact CE2-CD1 4.14Å; F192-L218 HydrophobicContact CG-CD1 3.63Å; F192-L218 HydrophobicContact CG-CD2 4.17Å; F192-L218 HydrophobicContact CG-CG 3.93Å; F192-L218 HydrophobicContact CZ-CD2 4.49Å; F192-V220 HydrophobicContact CB-CG1 4.35Å; F192-V220 HydrophobicContact CD1-CG1 3.5Å; F192-V220 HydrophobicContact CE1-CG1 4.22Å; F192-V220 HydrophobicContact CG-CG1 4.29Å; F192-A229 HydrophobicContact CE1-CB 3.73Å; F192-A229 HydrophobicContact CZ-CB 3.76Å
193	P	90.4	Very high	90.1	Very high	34 Å²	34	59.6 Å²	59.6	22%	0.221	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-29.9	-179	-25.2	35.7	0	0	0	114.1	R197 G219 V220 E225	P193-R197 WeakPolarHBondContact O-CG 3.35Å; P193-G219 WeakPolarHBondContact CD-O 3.48Å; P193-V220 HydrophobicContact CG-CG1 4.3Å; P193-E225 WeakPolarHBondContact CG-OE2 3.3Å
194	R	91.1	Very high	90.1	Very high	135 Å²	135	59.7 Å²	59.7	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-79.2	-40.3	176	-178.3	171.3	166.8	-176.3	-1.7	111	V162 E163 H191 F192 R197	V162-R194 HydrophobicContact CG1-CB 4.31Å; V162-R194 HydrophobicContact CG1-CG 3.98Å; E163-R194 IonicContact OE1-NH2 2.62Å; E163-R194 PolarHBondContact OE1-NH2 3.08Å; H191-R194 PolarHBondContact O-N 3.45Å; F192-R194 PolarHBondContact O-N 3.15Å; R194-R197 PolarHBondContact O-N 2.96Å
195	V	92.1	Very high	89.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.9	-41.5	179.5	177	0	0	0	0	111.4	V162 L166 V188 H191 F192 R197 Q198 F201	V162-V195 HydrophobicContact CG1-CG2 3.81Å; L166-V195 HydrophobicContact CD1-CG1 3.54Å; L166-V195 HydrophobicContact CD2-CG1 3.81Å; L166-V195 HydrophobicContact CG-CG1 3.68Å; V188-V195 HydrophobicContact CG1-CG1 4.21Å; V188-V195 HydrophobicContact CG2-CG1 4.4Å; H191-V195 PolarHBondContact O-N 3.13Å; H191-V195 VanDerWaalsContact O-N 3.14Å; F192-V195 PolarHBondContact O-N 3Å; F192-V195 VanDerWaalsContact O-N 3.11Å; V195-R197 PolarHBondContact O-N 3.31Å; V195-Q198 WeakPolarHBondContact O-CB 3.43Å; V195-Q198 PolarHBondContact O-N 2.99Å; V195-F201 HydrophobicContact CG1-CD2 4.45Å
196	A	90.8	Very high	89.7	Confident	9 Å²	9	64.3 Å²	64.3	7%	0.074	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.8	178.7	0	0	0	0	0	114.1	F192 F201 A229 R232	F192-A196 HydrophobicContact CE1-CB 4.23Å; F192-A196 HydrophobicContact CZ-CB 4.39Å; F192-A196 WeakPolarHBondContact O-CB 3.47Å; F192-A196 PolarHBondContact O-N 3.45Å; A196-F201 HydrophobicContact CB-CE1 4.43Å; A196-F201 HydrophobicContact CB-CE2 4.4Å; A196-F201 HydrophobicContact CB-CZ 4.33Å; A196-A229 HydrophobicContact CB-CB 3.84Å; A196-R232 PolarHBondContact O-NE 3.23Å
197	R	91.1	Very high	89.6	Confident	192 Å²	192	58.6 Å²	58.6	73%	0.725	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-19.9	176.8	-65.2	176.2	-173.2	-170.8	0.6	113.2	P193 R194 V195 R232	P193-R197 WeakPolarHBondContact O-CG 3.35Å; R194-R197 PolarHBondContact O-N 2.96Å; V195-R197 PolarHBondContact O-N 3.31Å; R197-R232 PolarHBondContact O-NH2 3.43Å
198	Q	91.9	Very high	89.4	Confident	35 Å²	35	57.7 Å²	57.7	16%	0.164	28%	0.278	C	S	.	.	S	Bend	trans	-67.8	157.5	-178.4	-66.5	168.7	-18.8	0	0	111.1	V162 V195	V162-Q198 PolarHBondContact O-NE2 3.31Å; V195-Q198 WeakPolarHBondContact O-CB 3.43Å; V195-Q198 PolarHBondContact O-N 2.99Å
199	K	87.4	Confident	89.4	Confident	170 Å²	170	57.6 Å²	57.6	74%	0.739	28%	0.278	S	S	*	.	S	Bend	trans	-70.6	-38.3	177.6	-67.4	-177.3	179.3	179	0	111.1	F201 L202	K199-F201 PolarHBondContact O-N 3.23Å; K199-F201 VanDerWaalsContact O-N 3.14Å; K199-L202 VanDerWaalsContact O-CB 3.29Å; K199-L202 WeakPolarHBondContact O-CB 3.3Å; K199-L202 WeakPolarHBondContact O-CG 3.46Å; K199-L202 PolarHBondContact O-N 2.85Å
200	D	87.4	Confident	89.3	Confident	71 Å²	71	57.5 Å²	57.5	38%	0.38	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-60.8	-26	-179.2	-55.3	-2.5	0	0	0	112.6	L166 L202 L203	L166-D200 HydrophobicContact CB-CB 4.04Å; L166-D200 HydrophobicContact CD1-CB 3.87Å; D200-L202 PolarHBondContact O-N 2.9Å; D200-L203 WeakPolarHBondContact O-CB 3.28Å; D200-L203 PolarHBondContact O-N 3.45Å
201	F	90.6	Very high	89.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-60.9	-31.5	174.7	-176.8	-97.8	0	0	0	112.2	L166 F192 V195 A196 K199 L203 L204 L209 A229 W233	L166-F201 HydrophobicContact CD1-CB 3.91Å; L166-F201 VanDerWaalsContact CD1-N 3.33Å; F192-F201 AromaticContact CE2-CE2 3.85Å; F192-F201 HydrophobicContact CE2-CE2 3.85Å; F192-F201 HydrophobicContact CE2-CZ 4.21Å; F192-F201 HydrophobicContact CZ-CE2 4.21Å; F192-F201 HydrophobicContact CZ-CZ 4.11Å; V195-F201 HydrophobicContact CG1-CD2 4.45Å; A196-F201 HydrophobicContact CB-CE1 4.43Å; A196-F201 HydrophobicContact CB-CE2 4.4Å; A196-F201 HydrophobicContact CB-CZ 4.33Å; K199-F201 PolarHBondContact O-N 3.23Å; K199-F201 VanDerWaalsContact O-N 3.14Å; F201-L203 PolarHBondContact O-N 3.1Å; F201-L204 HydrophobicContact CD2-CD1 3.65Å; F201-L204 HydrophobicContact CE2-CD1 3.87Å; F201-L204 HydrophobicContact CG-CD1 4.34Å; F201-L204 WeakPolarHBondContact O-CB 3.49Å; F201-L204 WeakPolarHBondContact O-CG 3.49Å; F201-L204 PolarHBondContact O-N 2.86Å; F201-L209 HydrophobicContact CE1-CD1 4.39Å; F201-L209 HydrophobicContact CE2-CD1 4.04Å; F201-L209 HydrophobicContact CZ-CD1 3.53Å; F201-A229 HydrophobicContact CE1-CB 4.27Å; F201-A229 HydrophobicContact CZ-CB 4.14Å; F201-W233 HydrophobicContact CE1-CB 4.21Å
202	L	88.8	Confident	89.1	Confident	19 Å²	19	53.2 Å²	53.2	10%	0.099	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-72.3	-15.4	178.8	-51.6	177.1	0	0	0	112.5	K199 D200 R232 H236 R241	K199-L202 VanDerWaalsContact O-CB 3.29Å; K199-L202 WeakPolarHBondContact O-CB 3.3Å; K199-L202 WeakPolarHBondContact O-CG 3.46Å; K199-L202 PolarHBondContact O-N 2.85Å; D200-L202 PolarHBondContact O-N 2.9Å; L202-R232 HydrophobicContact CD2-CG 3.95Å; L202-H236 HydrophobicContact CB-CB 4.4Å; L202-H236 HydrophobicContact CD1-CB 4.43Å; L202-H236 HydrophobicContact CD2-CB 4.36Å; L202-R241 VanDerWaalsContact O-CZ 3.3Å; L202-R241 PolarHBondContact O-NH1 3.08Å; L202-R241 PolarHBondContact O-NH2 3.02Å
203	L	87.6	Confident	89	Confident	132 Å²	132	53.2 Å²	53.2	69%	0.691	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-88.5	-4.5	179.1	-56.6	177	0	0	0	112.9	D200 F201	D200-L203 WeakPolarHBondContact O-CB 3.28Å; D200-L203 PolarHBondContact O-N 3.45Å; F201-L203 PolarHBondContact O-N 3.1Å
204	L	87.9	Confident	88.9	Confident	13 Å²	13	54.1 Å²	54.1	7%	0.068	27%	0.274	C	S	.	.			trans	-67.4	144.3	177.5	-66.2	176.2	0	0	0	111.7	L166 Y169 F201 T208 L212 W233	L166-L204 HydrophobicContact CD2-CD1 4.21Å; L166-L204 HydrophobicContact CD2-CD2 4.3Å; Y169-L204 HydrophobicContact CD1-CD2 4.43Å; Y169-L204 HydrophobicContact CE1-CD2 4.48Å; F201-L204 HydrophobicContact CD2-CD1 3.65Å; F201-L204 HydrophobicContact CE2-CD1 3.87Å; F201-L204 HydrophobicContact CG-CD1 4.34Å; F201-L204 WeakPolarHBondContact O-CB 3.49Å; F201-L204 WeakPolarHBondContact O-CG 3.49Å; F201-L204 PolarHBondContact O-N 2.86Å; L204-T208 HydrophobicContact CD2-CG2 4.32Å; L204-L212 HydrophobicContact CD1-CD1 4.23Å; L204-W233 PolarHBondContact O-NE1 2.95Å
205	D	87.7	Confident	88.8	Confident	54 Å²	54	49.2 Å²	49.2	29%	0.289	26%	0.261	S	S	.	.			trans	-75.4	155.3	170.1	56.7	-75.7	0	0	0	112	R173 G207 T208 L209	R173-D205 IonicContact CZ-OD1 3.37Å; R173-D205 IonicContact NH1-OD1 3.91Å; R173-D205 PolarHBondContact NH1-OD1 3.22Å; R173-D205 IonicContact NH1-OD2 3.31Å; R173-D205 IonicContact NH2-OD1 2.7Å; R173-D205 PolarHBondContact NH2-OD1 2.97Å; R173-D205 VanDerWaalsContact NH2-OD1 3.15Å; D205-G207 VanDerWaalsContact C-N 3.28Å; D205-G207 PolarHBondContact O-N 3.09Å; D205-T208 PolarHBondContact O-N 3.48Å; D205-T208 WeakPolarHBondContact OD1-CB 3.42Å; D205-T208 PolarHBondContact OD1-OG1 3.25Å; D205-T208 VanDerWaalsContact OD2-CB 3.25Å; D205-T208 WeakPolarHBondContact OD2-CB 3.48Å; D205-T208 PolarHBondContact OD2-N 2.94Å; D205-T208 PolarHBondContact OD2-OG1 2.88Å; D205-L209 PolarHBondContact O-N 3.28Å
206	H	86.3	Confident	88.6	Confident	100 Å²	100	53 Å²	53	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-36.7	-177.6	73.3	-88	0	0	0	112.8	G210 W233 H244	H206-G210 PolarHBondContact O-N 3.36Å; H206-W233 HydrophobicContact CB-CH2 3.78Å; H206-W233 HydrophobicContact CB-CZ2 4.13Å; H206-H244 HydrophobicContact CB-CB 4.38Å
207	G	86.2	Confident	88.5	Confident	38 Å²	38	61 Å²	61	39%	0.392	31%	0.309	S	S	.	.	H	α-helix	trans	-68.2	-45	-178.4	0	0	0	0	0	112	D205 G210 S211	D205-G207 VanDerWaalsContact C-N 3.28Å; D205-G207 PolarHBondContact O-N 3.09Å; G207-G210 PolarHBondContact O-N 3.44Å; G207-S211 WeakPolarHBondContact O-CB 3.5Å; G207-S211 PolarHBondContact O-N 3.35Å
208	T	87.2	Confident	88.5	Confident	12 Å²	12	51.9 Å²	51.9	7%	0.074	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-44.6	175.2	-61.5	0	0	0	0	111.4	Y169 R173 L204 D205 S211 L212	Y169-T208 HydrophobicContact CE1-CG2 3.62Å; Y169-T208 WeakPolarHBondContact OH-CG2 3.41Å; Y169-T208 PolarHBondContact OH-OG1 2.83Å; R173-T208 PolarHBondContact NH1-OG1 2.76Å; L204-T208 HydrophobicContact CD2-CG2 4.32Å; D205-T208 PolarHBondContact O-N 3.48Å; D205-T208 WeakPolarHBondContact OD1-CB 3.42Å; D205-T208 PolarHBondContact OD1-OG1 3.25Å; D205-T208 VanDerWaalsContact OD2-CB 3.25Å; D205-T208 WeakPolarHBondContact OD2-CB 3.48Å; D205-T208 PolarHBondContact OD2-N 2.94Å; D205-T208 PolarHBondContact OD2-OG1 2.88Å; T208-S211 PolarHBondContact O-N 3.31Å; T208-L212 HydrophobicContact CG2-CD1 4.27Å; T208-L212 WeakPolarHBondContact O-CG 3.31Å; T208-L212 PolarHBondContact O-N 2.82Å
209	L	90.3	Very high	88.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-47.4	176.1	-178.6	60	0	0	0	110.9	F201 D205 S211 L212 L213 W233 L248	F201-L209 HydrophobicContact CE1-CD1 4.39Å; F201-L209 HydrophobicContact CE2-CD1 4.04Å; F201-L209 HydrophobicContact CZ-CD1 3.53Å; D205-L209 PolarHBondContact O-N 3.28Å; L209-S211 VanDerWaalsContact C-N 3.33Å; L209-S211 PolarHBondContact O-N 3.08Å; L209-L212 WeakPolarHBondContact O-CB 3.42Å; L209-L212 PolarHBondContact O-N 3.27Å; L209-L213 HydrophobicContact CD1-CD1 4.33Å; L209-L213 HydrophobicContact CD1-CD2 4.16Å; L209-L213 HydrophobicContact CD1-CG 4.04Å; L209-L213 HydrophobicContact CG-CD1 4.26Å; L209-L213 HydrophobicContact CG-CG 4.28Å; L209-L213 WeakPolarHBondContact O-CG 3.2Å; L209-L213 PolarHBondContact O-N 3.37Å; L209-W233 HydrophobicContact CD2-CB 3.92Å; L209-W233 HydrophobicContact CD2-CD2 3.5Å; L209-W233 HydrophobicContact CD2-CE3 3.83Å; L209-W233 HydrophobicContact CD2-CG 3.53Å; L209-L248 HydrophobicContact CB-CD2 4.44Å; L209-L248 HydrophobicContact CD2-CD1 3.82Å; L209-L248 HydrophobicContact CD2-CD2 4.21Å; L209-L248 HydrophobicContact CG-CD2 4.07Å
210	G	87.8	Confident	88.5	Confident	8 Å²	8	42.8 Å²	42.8	8%	0.082	24%	0.239	C	C	.	.	H	α-helix	trans	-57.2	-43.6	175.6	0	0	0	0	0	112.7	H206 G207 L212 L213 S214	H206-G210 PolarHBondContact O-N 3.36Å; G207-G210 PolarHBondContact O-N 3.44Å; G210-L212 VanDerWaalsContact C-N 3.32Å; G210-L212 PolarHBondContact O-N 3.11Å; G210-L213 PolarHBondContact O-N 3.44Å; G210-S214 WeakPolarHBondContact O-CB 3.46Å; G210-S214 PolarHBondContact O-N 2.69Å; G210-S214 PolarHBondContact O-OG 3.1Å
211	S	87.9	Confident	88.5	Confident	81 Å²	81	43 Å²	43	57%	0.566	24%	0.24	S	C	*	.	H	α-helix	trans	-64.3	-32.6	174.9	-176.4	0	0	0	0	113.4	G207 T208 L209 S214	G207-S211 WeakPolarHBondContact O-CB 3.5Å; G207-S211 PolarHBondContact O-N 3.35Å; T208-S211 PolarHBondContact O-N 3.31Å; L209-S211 VanDerWaalsContact C-N 3.33Å; L209-S211 PolarHBondContact O-N 3.08Å; S211-S214 PolarHBondContact O-OG 3.39Å
212	L	89.1	Confident	88.4	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-72.2	-44.1	174.6	-73.9	170.9	0	0	0	111	L185 V188 L204 T208 L209 G210 S215	L185-L212 HydrophobicContact CD2-CD2 3.72Å; L185-L212 HydrophobicContact CD2-CG 4.49Å; V188-L212 HydrophobicContact CG1-CD1 4.15Å; V188-L212 HydrophobicContact CG1-CD2 4.07Å; L204-L212 HydrophobicContact CD1-CD1 4.23Å; T208-L212 HydrophobicContact CG2-CD1 4.27Å; T208-L212 WeakPolarHBondContact O-CG 3.31Å; T208-L212 PolarHBondContact O-N 2.82Å; L209-L212 WeakPolarHBondContact O-CB 3.42Å; L209-L212 PolarHBondContact O-N 3.27Å; G210-L212 VanDerWaalsContact C-N 3.32Å; G210-L212 PolarHBondContact O-N 3.11Å; L212-S215 WeakPolarHBondContact O-CB 3.43Å; L212-S215 PolarHBondContact O-N 3.15Å
213	L	89.6	Confident	88.4	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-71.2	-28.4	-178.3	-62.2	-167.1	0	0	0	113	F192 L209 G210 S215 V226 A230 L248 H251 R285	F192-L213 HydrophobicContact CE1-CD2 4.5Å; F192-L213 HydrophobicContact CE2-CD2 4.23Å; F192-L213 HydrophobicContact CZ-CD2 3.69Å; L209-L213 HydrophobicContact CD1-CD1 4.33Å; L209-L213 HydrophobicContact CD1-CD2 4.16Å; L209-L213 HydrophobicContact CD1-CG 4.04Å; L209-L213 HydrophobicContact CG-CD1 4.26Å; L209-L213 HydrophobicContact CG-CG 4.28Å; L209-L213 WeakPolarHBondContact O-CG 3.2Å; L209-L213 PolarHBondContact O-N 3.37Å; G210-L213 PolarHBondContact O-N 3.44Å; L213-S215 VanDerWaalsContact C-N 3.27Å; L213-S215 PolarHBondContact O-N 3.03Å; L213-V226 HydrophobicContact CD1-CG1 4.24Å; L213-V226 HydrophobicContact CD2-CG1 3.84Å; L213-V226 HydrophobicContact CG-CG1 4.4Å; L213-A230 HydrophobicContact CD1-CB 4.03Å; L213-L248 HydrophobicContact CD1-CB 4.38Å; L213-L248 HydrophobicContact CD1-CD2 4.26Å; L213-H251 HydrophobicContact CB-CB 4.12Å; L213-R285 VanDerWaalsContact O-CZ 3.27Å; L213-R285 PolarHBondContact O-NH1 3.4Å; L213-R285 PolarHBondContact O-NH2 2.74Å
214	S	89.4	Confident	88.4	Confident	53 Å²	53	36.8 Å²	36.8	37%	0.371	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-19.6	175.1	65.8	0	0	0	0	113.3	G210 S211 R253	G210-S214 WeakPolarHBondContact O-CB 3.46Å; G210-S214 PolarHBondContact O-N 2.69Å; G210-S214 PolarHBondContact O-OG 3.1Å; S211-S214 PolarHBondContact O-OG 3.39Å; S214-R253 PolarHBondContact O-NH2 2.88Å
215	S	88.7	Confident	88.5	Confident	32 Å²	32	39 Å²	39	22%	0.224	22%	0.219	C	C	.	.			trans	-70.9	130.6	-173.4	-177	0	0	0	0	114.2	L212 L213 R217 R285	L212-S215 WeakPolarHBondContact O-CB 3.43Å; L212-S215 PolarHBondContact O-N 3.15Å; L213-S215 VanDerWaalsContact C-N 3.27Å; L213-S215 PolarHBondContact O-N 3.03Å; S215-R217 PolarHBondContact O-N 3.15Å; S215-R217 PolarHBondContact OG-N 3.4Å; S215-R285 PolarHBondContact O-NH1 3.14Å
216	D	88.1	Confident	88.6	Confident	80 Å²	80	36.6 Å²	36.6	43%	0.428	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.6	171	-69.8	-35.5	0	0	0	113.5	L218 R253 R285 E286	D216-L218 PolarHBondContact O-N 2.58Å; D216-R253 IonicContact OD1-CZ 3.37Å; D216-R253 IonicContact OD1-NH1 3.61Å; D216-R253 PolarHBondContact OD1-NH1 2.85Å; D216-R253 IonicContact OD1-NH2 2.66Å; D216-R253 PolarHBondContact OD1-NH2 2.73Å; D216-R285 CarbonylContact O-C 3.57Å; D216-R285 WeakPolarHBondContact O-CA 3.33Å; D216-E286 PolarHBondContact O-N 2.89Å
217	R	87.8	Confident	88.8	Confident	178 Å²	178	32.2 Å²	32.2	67%	0.672	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	9	-176.3	-69.9	-171.1	-85.3	-102.1	2	113.8	S215 G219	S215-R217 PolarHBondContact O-N 3.15Å; S215-R217 PolarHBondContact OG-N 3.4Å; R217-G219 PolarHBondContact O-N 3.43Å
218	L	90.5	Very high	88.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.181	C	C	.	.			trans	-70.6	128.6	180	-153.4	72.4	0	0	0	111	F192 D216 V220 V226 R285 E286 G287	F192-L218 HydrophobicContact CB-CD1 3.81Å; F192-L218 HydrophobicContact CB-CG 4.03Å; F192-L218 HydrophobicContact CD1-CD1 4.31Å; F192-L218 HydrophobicContact CD1-CD2 4Å; F192-L218 HydrophobicContact CD1-CG 4.21Å; F192-L218 HydrophobicContact CD2-CD1 3.55Å; F192-L218 HydrophobicContact CD2-CG 4.33Å; F192-L218 HydrophobicContact CE1-CD2 4.17Å; F192-L218 HydrophobicContact CE2-CD1 4.14Å; F192-L218 HydrophobicContact CG-CD1 3.63Å; F192-L218 HydrophobicContact CG-CD2 4.17Å; F192-L218 HydrophobicContact CG-CG 3.93Å; F192-L218 HydrophobicContact CZ-CD2 4.49Å; D216-L218 PolarHBondContact O-N 2.58Å; L218-V220 HydrophobicContact CB-CG2 4.41Å; L218-V220 HydrophobicContact CD2-CG1 3.69Å; L218-V220 HydrophobicContact CD2-CG2 4.04Å; L218-V220 HydrophobicContact CG-CG1 3.94Å; L218-V220 HydrophobicContact CG-CG2 4.36Å; L218-V220 PolarHBondContact O-N 3.05Å; L218-V220 VanDerWaalsContact O-N 3.11Å; L218-V226 HydrophobicContact CD2-CG2 3.68Å; L218-R285 WeakPolarHBondContact O-CB 3.45Å; L218-E286 PolarHBondContact O-N 3.09Å; L218-G287 PolarHBondContact O-N 3.36Å
219	G	89.7	Confident	89.1	Confident	14 Å²	14	32.5 Å²	32.5	14%	0.144	18%	0.179	C	C	.	.			trans	-84.8	50.8	-179.2	0	0	0	0	0	113.1	A189 P193 R217	A189-G219 WeakPolarHBondContact O-CA 3.44Å; A189-G219 PolarHBondContact O-N 2.77Å; P193-G219 WeakPolarHBondContact CD-O 3.48Å; R217-G219 PolarHBondContact O-N 3.43Å
220	V	90.5	Very high	89.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.			trans	-100.8	149.3	177.7	-68.7	0	0	0	0	112	F192 P193 L218 E225 V226 R285 G287 M288	F192-V220 HydrophobicContact CB-CG1 4.35Å; F192-V220 HydrophobicContact CD1-CG1 3.5Å; F192-V220 HydrophobicContact CE1-CG1 4.22Å; F192-V220 HydrophobicContact CG-CG1 4.29Å; P193-V220 HydrophobicContact CG-CG1 4.3Å; L218-V220 HydrophobicContact CB-CG2 4.41Å; L218-V220 HydrophobicContact CD2-CG1 3.69Å; L218-V220 HydrophobicContact CD2-CG2 4.04Å; L218-V220 HydrophobicContact CG-CG1 3.94Å; L218-V220 HydrophobicContact CG-CG2 4.36Å; L218-V220 PolarHBondContact O-N 3.05Å; L218-V220 VanDerWaalsContact O-N 3.11Å; V220-E225 WeakPolarHBondContact CA-OE2 3.37Å; V220-E225 HydrophobicContact CB-CB 4.46Å; V220-E225 HydrophobicContact CG1-CB 4.27Å; V220-V226 HydrophobicContact CB-CG2 4.42Å; V220-V226 HydrophobicContact CG1-CG2 4.04Å; V220-V226 HydrophobicContact CG2-CG2 3.96Å; V220-R285 HydrophobicContact CG2-CB 4.08Å; V220-R285 HydrophobicContact CG2-CG 4.33Å; V220-G287 CarbonylContact O-C 3.58Å; V220-G287 VanDerWaalsContact O-CA 3.23Å; V220-G287 WeakPolarHBondContact O-CA 3.19Å; V220-M288 HydrophobicContact CG2-CE 4.36Å; V220-M288 WeakPolarHBondContact O-CG 3.34Å; V220-M288 PolarHBondContact O-N 2.97Å
221	D	87.3	Confident	89.2	Confident	75 Å²	75	35.3 Å²	35.3	40%	0.401	19%	0.187	S	C	.	.	S	Bend	trans	-89.8	-29	-178.1	-79.7	14.4	0	0	0	112.6	E225 K633 H635	D221-E225 PolarHBondContact N-OE2 2.92Å; D221-K633 IonicContact OD1-NZ 3.82Å; D221-K633 PolarHBondContact OD1-NZ 2.82Å; D221-K633 IonicContact OD2-NZ 3.22Å; D221-K633 PolarHBondContact OD2-NZ 3.27Å; D221-H635 PolarHBondContact O-NE2 3.42Å
222	S	88.4	Confident	89.3	Confident	14 Å²	14	36.3 Å²	36.3	10%	0.098	18%	0.179	C	C	.	.	S	Bend	trans	-144.8	161.1	170.9	87.3	0	0	0	0	111.1	A224 E225 E261	S222-A224 PolarHBondContact O-N 3.49Å; S222-A224 WeakPolarHBondContact OG-CB 3.47Å; S222-A224 PolarHBondContact OG-N 3.25Å; S222-E225 PolarHBondContact O-N 3.14Å; S222-E261 VanDerWaalsContact CB-OE1 3.25Å; S222-E261 WeakPolarHBondContact CB-OE1 3.36Å; S222-E261 PolarHBondContact OG-OE1 3.22Å
223	E	88.8	Confident	89.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-17.6	173.5	-70	-67.8	148.9	0	0	112.2	E225 V226 Y227 L252 R253 L256 L257 R285 M288	E223-E225 PolarHBondContact O-N 2.92Å; E223-V226 WeakPolarHBondContact O-CB 3.38Å; E223-V226 PolarHBondContact O-N 2.74Å; E223-V226 VanDerWaalsContact O-N 3.1Å; E223-Y227 PolarHBondContact O-N 3.29Å; E223-Y227 VanDerWaalsContact O-N 3.07Å; E223-L252 HydrophobicContact CB-CD1 3.91Å; E223-L252 WeakPolarHBondContact O-CD1 3.07Å; E223-R253 HydrophobicContact CG-CB 4Å; E223-R253 PolarHBondContact OE2-N 3.17Å; E223-L256 HydrophobicContact CG-CB 4.04Å; E223-L257 HydrophobicContact CB-CD2 3.58Å; E223-L257 HydrophobicContact CB-CG 4.06Å; E223-R285 VanDerWaalsContact OE1-CD 3.25Å; E223-R285 WeakPolarHBondContact OE1-CD 3.45Å; E223-R285 IonicContact OE1-CZ 3.95Å; E223-R285 IonicContact OE1-NE 3.29Å; E223-R285 PolarHBondContact OE1-NE 3.24Å; E223-R285 IonicContact OE1-NH2 3.02Å; E223-R285 IonicContact OE2-CZ 2.76Å; E223-R285 IonicContact OE2-NE 3.56Å; E223-R285 PolarHBondContact OE2-NE 3.37Å; E223-R285 IonicContact OE2-NH2 3.88Å; E223-R285 PolarHBondContact OE2-NH2 2.86Å; E223-M288 HydrophobicContact CG-CE 3.79Å
224	A	87.3	Confident	89.5	Confident	6 Å²	6	36 Å²	36	5%	0.05	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-33.1	175.2	0	0	0	0	0	111.6	S222 V226 Y227 D228 L257 E261	S222-A224 PolarHBondContact O-N 3.49Å; S222-A224 WeakPolarHBondContact OG-CB 3.47Å; S222-A224 PolarHBondContact OG-N 3.25Å; A224-V226 VanDerWaalsContact C-N 3.28Å; A224-V226 PolarHBondContact O-N 3.45Å; A224-Y227 PolarHBondContact O-N 3.02Å; A224-D228 WeakPolarHBondContact O-CB 3.4Å; A224-D228 PolarHBondContact O-N 2.94Å; A224-L257 HydrophobicContact CB-CD2 4.24Å; A224-E261 HydrophobicContact CB-CB 4.37Å; A224-E261 HydrophobicContact CB-CG 3.87Å; A224-E261 VanDerWaalsContact CB-OE1 3.26Å; A224-E261 WeakPolarHBondContact CB-OE1 3.46Å
225	E	89.9	Confident	89.5	Confident	60 Å²	60	38 Å²	38	28%	0.28	18%	0.18	S	C	.	.	H	α-helix	trans	-65.2	-33	174.6	-61.2	-174.2	149.7	0	0	112.3	P193 V220 D221 S222 E223 A229	P193-E225 WeakPolarHBondContact CG-OE2 3.3Å; V220-E225 WeakPolarHBondContact CA-OE2 3.37Å; V220-E225 HydrophobicContact CB-CB 4.46Å; V220-E225 HydrophobicContact CG1-CB 4.27Å; D221-E225 PolarHBondContact N-OE2 2.92Å; S222-E225 PolarHBondContact O-N 3.14Å; E223-E225 PolarHBondContact O-N 2.92Å; E225-A229 WeakPolarHBondContact O-CB 3.24Å; E225-A229 PolarHBondContact O-N 3.02Å; E225-A229 VanDerWaalsContact O-N 3.08Å
226	V	90.9	Very high	89.5	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-68.7	-45.8	175.5	173.3	0	0	0	0	110.2	L213 L218 V220 E223 A224 A229 A230 L252	L213-V226 HydrophobicContact CD1-CG1 4.24Å; L213-V226 HydrophobicContact CD2-CG1 3.84Å; L213-V226 HydrophobicContact CG-CG1 4.4Å; L218-V226 HydrophobicContact CD2-CG2 3.68Å; V220-V226 HydrophobicContact CB-CG2 4.42Å; V220-V226 HydrophobicContact CG1-CG2 4.04Å; V220-V226 HydrophobicContact CG2-CG2 3.96Å; E223-V226 WeakPolarHBondContact O-CB 3.38Å; E223-V226 PolarHBondContact O-N 2.74Å; E223-V226 VanDerWaalsContact O-N 3.1Å; A224-V226 VanDerWaalsContact C-N 3.28Å; A224-V226 PolarHBondContact O-N 3.45Å; V226-A229 PolarHBondContact O-N 3.31Å; V226-A230 PolarHBondContact O-N 3.4Å; V226-L252 HydrophobicContact CB-CD1 4.15Å; V226-L252 HydrophobicContact CG1-CD1 4.1Å
227	Y	89.1	Confident	89.6	Confident	8 Å²	8	41.4 Å²	41.4	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-61.5	-49	175.5	172.2	-99.5	0	0	0	112	E223 A224 A229 A230 R231 M245 L249 L265 E268 L269	E223-Y227 PolarHBondContact O-N 3.29Å; E223-Y227 VanDerWaalsContact O-N 3.07Å; A224-Y227 PolarHBondContact O-N 3.02Å; Y227-A229 VanDerWaalsContact C-N 3.26Å; Y227-A229 PolarHBondContact O-N 2.87Å; Y227-A230 PolarHBondContact O-N 3.26Å; Y227-R231 WeakPolarHBondContact O-CB 3.44Å; Y227-R231 PolarHBondContact O-N 3.06Å; Y227-M245 HydrophobicContact CE2-CE 4.19Å; Y227-L249 HydrophobicContact CD2-CD2 3.71Å; Y227-L249 HydrophobicContact CE2-CD2 4.03Å; Y227-L265 HydrophobicContact CD1-CD1 4.08Å; Y227-L265 HydrophobicContact CD1-CD2 4.11Å; Y227-L265 HydrophobicContact CD1-CG 3.93Å; Y227-L265 HydrophobicContact CD2-CD2 3.87Å; Y227-L265 HydrophobicContact CD2-CG 4.32Å; Y227-L265 HydrophobicContact CE1-CD1 4.4Å; Y227-L265 HydrophobicContact CE1-CG 4.03Å; Y227-L265 HydrophobicContact CE2-CD2 4.35Å; Y227-L265 HydrophobicContact CE2-CG 4.42Å; Y227-L265 HydrophobicContact CG-CD1 4.48Å; Y227-L265 HydrophobicContact CG-CD2 3.73Å; Y227-L265 HydrophobicContact CG-CG 4.07Å; Y227-E268 VanDerWaalsContact CE1-OE2 3.23Å; Y227-E268 WeakPolarHBondContact CE1-OE2 3.29Å; Y227-E268 PolarHBondContact OH-OE2 3.08Å; Y227-L269 HydrophobicContact CE2-CD1 3.9Å; Y227-L269 HydrophobicContact CE2-CD2 4.27Å; Y227-L269 HydrophobicContact CE2-CG 4.26Å
228	D	89.8	Confident	89.5	Confident	52 Å²	52	36 Å²	36	28%	0.278	18%	0.178	S	C	.	.	H	α-helix	trans	-61.3	-35.9	179.7	-76.7	-29	0	0	0	111.3	A224 R231 R232 R264	A224-D228 WeakPolarHBondContact O-CB 3.4Å; A224-D228 PolarHBondContact O-N 2.94Å; D228-R231 IonicContact OD1-CZ 2.78Å; D228-R231 IonicContact OD1-NH2 3.11Å; D228-R232 VanDerWaalsContact O-CB 3.28Å; D228-R232 WeakPolarHBondContact O-CB 3.28Å; D228-R232 PolarHBondContact O-N 3.33Å; D228-R264 IonicContact OD1-CZ 3.1Å; D228-R264 IonicContact OD1-NH1 2.73Å; D228-R264 IonicContact OD1-NH2 3.36Å; D228-R264 PolarHBondContact OD1-NH2 3.18Å; D228-R264 IonicContact OD2-NH1 2.86Å; D228-R264 PolarHBondContact OD2-NH1 2.82Å; D228-R264 IonicContact OD2-NH2 2.61Å
229	A	91.1	Very high	89.2	Confident	4 Å²	4	44 Å²	44	3%	0.033	22%	0.22	C	C	.	.	H	α-helix	trans	-67.6	-45.8	174.3	0	0	0	0	0	112.7	F192 A196 F201 E225 V226 Y227 R232 W233	F192-A229 HydrophobicContact CE1-CB 3.73Å; F192-A229 HydrophobicContact CZ-CB 3.76Å; A196-A229 HydrophobicContact CB-CB 3.84Å; F201-A229 HydrophobicContact CE1-CB 4.27Å; F201-A229 HydrophobicContact CZ-CB 4.14Å; E225-A229 WeakPolarHBondContact O-CB 3.24Å; E225-A229 PolarHBondContact O-N 3.02Å; E225-A229 VanDerWaalsContact O-N 3.08Å; V226-A229 PolarHBondContact O-N 3.31Å; Y227-A229 VanDerWaalsContact C-N 3.26Å; Y227-A229 PolarHBondContact O-N 2.87Å; A229-R232 PolarHBondContact O-N 2.99Å; A229-W233 PolarHBondContact O-N 2.87Å; A229-W233 VanDerWaalsContact O-N 3.09Å
230	A	90.4	Very high	89	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.017	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-43.6	176.7	0	0	0	0	0	111.5	L213 V226 Y227 W233 A234 M245	L213-A230 HydrophobicContact CD1-CB 4.03Å; V226-A230 PolarHBondContact O-N 3.4Å; Y227-A230 PolarHBondContact O-N 3.26Å; A230-W233 PolarHBondContact O-N 3.3Å; A230-A234 PolarHBondContact O-N 2.88Å; A230-M245 HydrophobicContact CB-SD 4.41Å
231	R	88.8	Confident	88.9	Confident	65 Å²	65	49.7 Å²	49.7	25%	0.245	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-49.8	176.9	-170.2	-177.9	72.9	179.4	3.3	111.4	Y227 D228 W233 A234 E235 M245 E268	Y227-R231 WeakPolarHBondContact O-CB 3.44Å; Y227-R231 PolarHBondContact O-N 3.06Å; D228-R231 IonicContact OD1-CZ 2.78Å; D228-R231 IonicContact OD1-NH2 3.11Å; R231-W233 VanDerWaalsContact C-N 3.27Å; R231-W233 PolarHBondContact O-N 3.41Å; R231-A234 PolarHBondContact O-N 3.14Å; R231-A234 VanDerWaalsContact O-N 3.08Å; R231-E235 HydrophobicContact CG-CG 4.36Å; R231-E235 WeakPolarHBondContact CG-OE1 3.32Å; R231-E235 IonicContact NE-OE1 2.8Å; R231-E235 PolarHBondContact NE-OE1 3.25Å; R231-E235 WeakPolarHBondContact O-CG 3.4Å; R231-E235 PolarHBondContact O-N 3.02Å; R231-M245 HydrophobicContact CB-CE 4.25Å; R231-E268 IonicContact CZ-OE2 3.71Å; R231-E268 VanDerWaalsContact NH1-CD 3.25Å; R231-E268 IonicContact NH1-OE1 2.66Å; R231-E268 PolarHBondContact NH1-OE1 2.99Å; R231-E268 IonicContact NH1-OE2 3.42Å; R231-E268 PolarHBondContact NH1-OE2 2.85Å
232	R	90.7	Very high	88.8	Confident	101 Å²	101	51.6 Å²	51.6	38%	0.381	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-37.9	177.9	179.9	-177.9	168	74.8	-2.5	112.5	A196 R197 L202 D228 A229	A196-R232 PolarHBondContact O-NE 3.23Å; R197-R232 PolarHBondContact O-NH2 3.43Å; L202-R232 HydrophobicContact CD2-CG 3.95Å; D228-R232 VanDerWaalsContact O-CB 3.28Å; D228-R232 WeakPolarHBondContact O-CB 3.28Å; D228-R232 PolarHBondContact O-N 3.33Å; A229-R232 PolarHBondContact O-N 2.99Å
233	W	92.8	Very high	88.7	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.027	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-39.7	175.9	176.7	91.6	0	0	0	112.2	F201 L204 H206 L209 A229 A230 R231 R241 H244 L248	F201-W233 HydrophobicContact CE1-CB 4.21Å; L204-W233 PolarHBondContact O-NE1 2.95Å; H206-W233 HydrophobicContact CB-CH2 3.78Å; H206-W233 HydrophobicContact CB-CZ2 4.13Å; L209-W233 HydrophobicContact CD2-CB 3.92Å; L209-W233 HydrophobicContact CD2-CD2 3.5Å; L209-W233 HydrophobicContact CD2-CE3 3.83Å; L209-W233 HydrophobicContact CD2-CG 3.53Å; A229-W233 PolarHBondContact O-N 2.87Å; A229-W233 VanDerWaalsContact O-N 3.09Å; A230-W233 PolarHBondContact O-N 3.3Å; R231-W233 VanDerWaalsContact C-N 3.27Å; R231-W233 PolarHBondContact O-N 3.41Å; W233-R241 HydrophobicContact CE3-CB 4.17Å; W233-R241 HydrophobicContact CE3-CG 4.43Å; W233-R241 HydrophobicContact CH2-CB 3.91Å; W233-R241 HydrophobicContact CH2-CG 3.69Å; W233-R241 HydrophobicContact CZ2-CG 4.05Å; W233-R241 HydrophobicContact CZ3-CB 3.63Å; W233-R241 HydrophobicContact CZ3-CG 3.91Å; W233-R241 WeakPolarHBondContact O-CD 3.26Å; W233-R241 PolarHBondContact O-NH1 3.27Å; W233-H244 HydrophobicContact CZ3-CB 4.46Å; W233-L248 HydrophobicContact CE3-CD1 3.8Å; W233-L248 HydrophobicContact CZ3-CD1 3.75Å
234	A	88.9	Confident	88.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.3	-40.4	177.7	0	0	0	0	0	112.6	A230 R231 H236 Q237 R241 Y242 M245	A230-A234 PolarHBondContact O-N 2.88Å; R231-A234 PolarHBondContact O-N 3.14Å; R231-A234 VanDerWaalsContact O-N 3.08Å; A234-H236 PolarHBondContact O-N 2.56Å; A234-Q237 CarbonylContact O-C 3.55Å; A234-Q237 PolarHBondContact O-N 3.35Å; A234-R241 HydrophobicContact CB-CB 4.45Å; A234-Y242 HydrophobicContact CB-CE1 4.44Å; A234-M245 HydrophobicContact CB-SD 4.29Å
235	E	89.5	Confident	88.5	Confident	97 Å²	97	58.5 Å²	58.5	45%	0.453	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-23.7	177.7	-75.8	171.6	178.6	0	0	113.4	R231 P238	R231-E235 HydrophobicContact CG-CG 4.36Å; R231-E235 WeakPolarHBondContact CG-OE1 3.32Å; R231-E235 IonicContact NE-OE1 2.8Å; R231-E235 PolarHBondContact NE-OE1 3.25Å; R231-E235 WeakPolarHBondContact O-CG 3.4Å; R231-E235 PolarHBondContact O-N 3.02Å; E235-P238 WeakPolarHBondContact O-CD 3.36Å
236	H	89.8	Confident	88.2	Confident	92 Å²	92	60 Å²	60	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-68.9	-35.9	-179.6	-173	58.5	0	0	0	113.4	L202 A234	L202-H236 HydrophobicContact CB-CB 4.4Å; L202-H236 HydrophobicContact CD1-CB 4.43Å; L202-H236 HydrophobicContact CD2-CB 4.36Å; A234-H236 PolarHBondContact O-N 2.56Å
237	Q	89.1	Confident	87.9	Confident	91 Å²	91	62.8 Å²	62.8	43%	0.425	33%	0.329	S	S	.	.	S	Bend	trans	-139.5	80.4	174.1	-65.6	176.4	-39.5	0	0	109.7	A234 L239 R241	A234-Q237 CarbonylContact O-C 3.55Å; A234-Q237 PolarHBondContact O-N 3.35Å; Q237-L239 VanDerWaalsContact C-N 3.34Å; Q237-L239 PolarHBondContact O-N 3.47Å; Q237-R241 HydrophobicContact CB-CG 4Å; Q237-R241 VanDerWaalsContact O-CB 3.22Å; Q237-R241 WeakPolarHBondContact O-CB 3.42Å; Q237-R241 WeakPolarHBondContact O-CG 3.49Å; Q237-R241 PolarHBondContact O-N 2.87Å; Q237-R241 VanDerWaalsContact OE1-CZ 3.26Å
238	P	85.9	Confident	87.6	Confident	65 Å²	65	62.8 Å²	62.8	42%	0.422	33%	0.33	S	S	.	.	H	α-helix	trans	-54.8	-44.7	-171.8	-32.5	39.5	0	0	0	114.4	E235 D240 Y242	E235-P238 WeakPolarHBondContact O-CD 3.36Å; P238-D240 PolarHBondContact O-N 3.5Å; P238-Y242 VanDerWaalsContact CA-CD2 3.47Å; P238-Y242 HydrophobicContact CB-CD2 3.67Å; P238-Y242 HydrophobicContact CB-CE2 3.66Å; P238-Y242 HydrophobicContact CG-CE2 4.23Å; P238-Y242 WeakPolarHBondContact O-CB 3.38Å; P238-Y242 VanDerWaalsContact O-CD2 3.23Å; P238-Y242 WeakPolarHBondContact O-CD2 3.25Å; P238-Y242 PolarHBondContact O-N 3.31Å
239	L	83.9	Confident	87.4	Confident	167 Å²	167	62.3 Å²	62.3	87%	0.874	33%	0.327	S	S	*	.	H	α-helix	trans	-60.3	-42.1	-169.8	-66.2	169.1	0	0	0	112.8	Q237	Q237-L239 VanDerWaalsContact C-N 3.34Å; Q237-L239 PolarHBondContact O-N 3.47Å
240	D	86.3	Confident	87.1	Confident	113 Å²	113	69.8 Å²	69.8	60%	0.604	36%	0.361	S	S	*	.	H	α-helix	trans	-95.6	-35.1	-177.2	-57.4	-33.7	0	0	0	112	P238 H244	P238-D240 PolarHBondContact O-N 3.5Å; D240-H244 PolarHBondContact O-CD2 3.16Å
241	R	88.4	Confident	86.8	Confident	21 Å²	21	72.6 Å²	72.6	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-86.1	-28	-168.2	-62.3	-176.9	-174.4	-163.7	-2.7	114.1	L202 W233 A234 Q237 A243 H244 M245	L202-R241 VanDerWaalsContact O-CZ 3.3Å; L202-R241 PolarHBondContact O-NH1 3.08Å; L202-R241 PolarHBondContact O-NH2 3.02Å; W233-R241 HydrophobicContact CE3-CB 4.17Å; W233-R241 HydrophobicContact CE3-CG 4.43Å; W233-R241 HydrophobicContact CH2-CB 3.91Å; W233-R241 HydrophobicContact CH2-CG 3.69Å; W233-R241 HydrophobicContact CZ2-CG 4.05Å; W233-R241 HydrophobicContact CZ3-CB 3.63Å; W233-R241 HydrophobicContact CZ3-CG 3.91Å; W233-R241 WeakPolarHBondContact O-CD 3.26Å; W233-R241 PolarHBondContact O-NH1 3.27Å; A234-R241 HydrophobicContact CB-CB 4.45Å; Q237-R241 HydrophobicContact CB-CG 4Å; Q237-R241 VanDerWaalsContact O-CB 3.22Å; Q237-R241 WeakPolarHBondContact O-CB 3.42Å; Q237-R241 WeakPolarHBondContact O-CG 3.49Å; Q237-R241 PolarHBondContact O-N 2.87Å; Q237-R241 VanDerWaalsContact OE1-CZ 3.26Å; R241-A243 PolarHBondContact O-N 3.28Å; R241-H244 PolarHBondContact O-N 3.22Å; R241-M245 PolarHBondContact O-N 3.5Å
242	Y	86.1	Confident	86.7	Confident	115 Å²	115	70.6 Å²	70.6	45%	0.451	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-62.3	-28.3	175.5	-87.5	-69.5	0	0	0	112.1	A234 P238 H244 M245	A234-Y242 HydrophobicContact CB-CE1 4.44Å; P238-Y242 VanDerWaalsContact CA-CD2 3.47Å; P238-Y242 HydrophobicContact CB-CD2 3.67Å; P238-Y242 HydrophobicContact CB-CE2 3.66Å; P238-Y242 HydrophobicContact CG-CE2 4.23Å; P238-Y242 WeakPolarHBondContact O-CB 3.38Å; P238-Y242 VanDerWaalsContact O-CD2 3.23Å; P238-Y242 WeakPolarHBondContact O-CD2 3.25Å; P238-Y242 PolarHBondContact O-N 3.31Å; Y242-H244 PolarHBondContact O-N 2.66Å; Y242-M245 VanDerWaalsContact O-CB 3.3Å; Y242-M245 WeakPolarHBondContact O-CB 3.4Å; Y242-M245 PolarHBondContact O-N 3.31Å; Y242-M245 VanDerWaalsContact O-N 3.14Å
243	A	86	Confident	86.5	Confident	79 Å²	79	66.8 Å²	66.8	65%	0.653	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-60.3	-29.7	173.5	0	0	0	0	0	112.8	R241	R241-A243 PolarHBondContact O-N 3.28Å
244	H	86.6	Confident	85.7	Confident	71 Å²	71	68.9 Å²	68.9	33%	0.329	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-90.9	-8.6	179.2	-60.9	-64.6	0	0	0	113.6	H206 W233 D240 R241 Y242 A247 L248	H206-H244 HydrophobicContact CB-CB 4.38Å; W233-H244 HydrophobicContact CZ3-CB 4.46Å; D240-H244 PolarHBondContact O-CD2 3.16Å; R241-H244 PolarHBondContact O-N 3.22Å; Y242-H244 PolarHBondContact O-N 2.66Å; H244-A247 PolarHBondContact O-N 2.92Å; H244-L248 PolarHBondContact O-N 3.2Å; H244-L248 VanDerWaalsContact O-N 3.16Å
245	M	83.9	Confident	85.1	Confident	14 Å²	14	69.6 Å²	69.6	7%	0.069	38%	0.375	C	S	.	.	H	α-helix	trans	-59.1	-42.7	-176.9	-170.3	63.5	163.3	0	0	113.4	Y227 A230 R231 A234 R241 Y242 A247 L248 L249	Y227-M245 HydrophobicContact CE2-CE 4.19Å; A230-M245 HydrophobicContact CB-SD 4.41Å; R231-M245 HydrophobicContact CB-CE 4.25Å; A234-M245 HydrophobicContact CB-SD 4.29Å; R241-M245 PolarHBondContact O-N 3.5Å; Y242-M245 VanDerWaalsContact O-CB 3.3Å; Y242-M245 WeakPolarHBondContact O-CB 3.4Å; Y242-M245 PolarHBondContact O-N 3.31Å; Y242-M245 VanDerWaalsContact O-N 3.14Å; M245-A247 VanDerWaalsContact C-N 3.29Å; M245-A247 PolarHBondContact O-N 2.94Å; M245-L248 PolarHBondContact O-N 2.95Å; M245-L248 VanDerWaalsContact O-N 3.15Å; M245-L249 HydrophobicContact CE-CD1 4.38Å; M245-L249 HydrophobicContact CE-CD2 4.07Å; M245-L249 HydrophobicContact CE-CG 4.29Å; M245-L249 HydrophobicContact CG-CD1 3.99Å; M245-L249 HydrophobicContact CG-CG 4.18Å; M245-L249 WeakPolarHBondContact O-CB 3.32Å; M245-L249 VanDerWaalsContact O-CG 3.31Å; M245-L249 WeakPolarHBondContact O-CG 3.28Å; M245-L249 PolarHBondContact O-N 3.21Å; M245-L249 HydrophobicContact SD-CG 4.32Å
246	P	83.6	Confident	84.7	Confident	91 Å²	91	65.1 Å²	65.1	59%	0.591	35%	0.354	S	S	*	.	H	α-helix	trans	-58.9	-39	176.5	-25	35.6	0	0	0	113.3	L249 H250	P246-L249 PolarHBondContact O-N 2.79Å; P246-H250 PolarHBondContact O-N 2.88Å; P246-H250 VanDerWaalsContact O-N 3.1Å
247	A	84.4	Confident	84.4	Confident	64 Å²	64	61 Å²	61	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-66.5	-38.7	177.4	0	0	0	0	0	111.8	H244 M245	H244-A247 PolarHBondContact O-N 2.92Å; M245-A247 VanDerWaalsContact C-N 3.29Å; M245-A247 PolarHBondContact O-N 2.94Å
248	L	84.9	Confident	83.9	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-68.3	-40.5	175.1	-64.5	176.7	0	0	0	112.1	L209 L213 W233 H244 M245 H250 H251	L209-L248 HydrophobicContact CB-CD2 4.44Å; L209-L248 HydrophobicContact CD2-CD1 3.82Å; L209-L248 HydrophobicContact CD2-CD2 4.21Å; L209-L248 HydrophobicContact CG-CD2 4.07Å; L213-L248 HydrophobicContact CD1-CB 4.38Å; L213-L248 HydrophobicContact CD1-CD2 4.26Å; W233-L248 HydrophobicContact CE3-CD1 3.8Å; W233-L248 HydrophobicContact CZ3-CD1 3.75Å; H244-L248 PolarHBondContact O-N 3.2Å; H244-L248 VanDerWaalsContact O-N 3.16Å; M245-L248 PolarHBondContact O-N 2.95Å; M245-L248 VanDerWaalsContact O-N 3.15Å; L248-H250 VanDerWaalsContact C-N 3.27Å; L248-H250 PolarHBondContact O-N 3.01Å; L248-H251 WeakPolarHBondContact O-CB 3.3Å; L248-H251 PolarHBondContact O-N 2.74Å; L248-H251 VanDerWaalsContact O-N 3.14Å
249	L	83.8	Confident	83.5	Confident	42 Å²	42	62.1 Å²	62.1	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-67.4	-26.1	179	-69.9	177.7	0	0	0	112.9	Y227 M245 P246 H251 L252 L269	Y227-L249 HydrophobicContact CD2-CD2 3.71Å; Y227-L249 HydrophobicContact CE2-CD2 4.03Å; M245-L249 HydrophobicContact CE-CD1 4.38Å; M245-L249 HydrophobicContact CE-CD2 4.07Å; M245-L249 HydrophobicContact CE-CG 4.29Å; M245-L249 HydrophobicContact CG-CD1 3.99Å; M245-L249 HydrophobicContact CG-CG 4.18Å; M245-L249 WeakPolarHBondContact O-CB 3.32Å; M245-L249 VanDerWaalsContact O-CG 3.31Å; M245-L249 WeakPolarHBondContact O-CG 3.28Å; M245-L249 PolarHBondContact O-N 3.21Å; M245-L249 HydrophobicContact SD-CG 4.32Å; P246-L249 PolarHBondContact O-N 2.79Å; L249-H251 PolarHBondContact O-N 2.87Å; L249-H251 VanDerWaalsContact O-N 3.15Å; L249-L252 WeakPolarHBondContact O-CB 3.17Å; L249-L252 PolarHBondContact O-N 3.26Å; L249-L269 HydrophobicContact CD1-CD1 4.35Å; L249-L269 HydrophobicContact CD1-CD2 3.95Å
250	H	84.8	Confident	83.4	Confident	161 Å²	161	61.6 Å²	61.6	75%	0.745	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	172.4	-170.1	76.1	0	0	0	113.1	P246 L248	P246-H250 PolarHBondContact O-N 2.88Å; P246-H250 VanDerWaalsContact O-N 3.1Å; L248-H250 VanDerWaalsContact C-N 3.27Å; L248-H250 PolarHBondContact O-N 3.01Å
251	H	85.3	Confident	83.2	Confident	62 Å²	62	58.1 Å²	58.1	29%	0.287	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.8	175.5	-59.6	-43.6	0	0	0	114	L213 L248 L249 R285	L213-H251 HydrophobicContact CB-CB 4.12Å; L248-H251 WeakPolarHBondContact O-CB 3.3Å; L248-H251 PolarHBondContact O-N 2.74Å; L248-H251 VanDerWaalsContact O-N 3.14Å; L249-H251 PolarHBondContact O-N 2.87Å; L249-H251 VanDerWaalsContact O-N 3.15Å; H251-R285 PolarHBondContact O-NH2 2.91Å; H251-R285 VanDerWaalsContact O-NH2 3.11Å
252	L	85.8	Confident	82.7	Confident	23 Å²	23	58.8 Å²	58.8	12%	0.12	32%	0.318	C	S	.	.			trans	-73.1	143.3	174.9	-167.8	70.7	0	0	0	110.1	E223 V226 L249 P254 L265	E223-L252 HydrophobicContact CB-CD1 3.91Å; E223-L252 WeakPolarHBondContact O-CD1 3.07Å; V226-L252 HydrophobicContact CB-CD1 4.15Å; V226-L252 HydrophobicContact CG1-CD1 4.1Å; L249-L252 WeakPolarHBondContact O-CB 3.17Å; L249-L252 PolarHBondContact O-N 3.26Å; L252-P254 WeakPolarHBondContact O-CD 3.41Å; L252-L265 HydrophobicContact CD2-CD2 3.78Å
253	R	86.5	Confident	82.4	Confident	20 Å²	20	61 Å²	61	8%	0.075	33%	0.326	C	S	.	.			trans	-108	79.2	179.5	-58.7	172.1	-168	-175.3	-0.8	110.7	S214 D216 E223 G255 L256 R283	S214-R253 PolarHBondContact O-NH2 2.88Å; D216-R253 IonicContact OD1-CZ 3.37Å; D216-R253 IonicContact OD1-NH1 3.61Å; D216-R253 PolarHBondContact OD1-NH1 2.85Å; D216-R253 IonicContact OD1-NH2 2.66Å; D216-R253 PolarHBondContact OD1-NH2 2.73Å; E223-R253 HydrophobicContact CG-CB 4Å; E223-R253 PolarHBondContact OE2-N 3.17Å; R253-G255 PolarHBondContact O-N 3.48Å; R253-L256 HydrophobicContact CB-CD1 4.01Å; R253-L256 HydrophobicContact CB-CG 4.38Å; R253-L256 PolarHBondContact O-N 3.35Å; R253-R283 WeakPolarHBondContact CD-O 3.18Å; R253-R283 PolarHBondContact NH1-O 2.88Å
254	P	76.9	Confident	82.2	Confident	52 Å²	52	61.3 Å²	61.3	34%	0.338	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-60	-27.1	-170.9	23.8	-34.5	0	0	0	113.5	L252 L256 L257	L252-P254 WeakPolarHBondContact O-CD 3.41Å; P254-L256 PolarHBondContact O-N 2.93Å; P254-L256 VanDerWaalsContact O-N 3.09Å; P254-L257 HydrophobicContact CB-CD1 4.28Å; P254-L257 WeakPolarHBondContact O-CB 3.42Å; P254-L257 PolarHBondContact O-N 3.17Å; P254-L257 VanDerWaalsContact O-N 3.09Å
255	G	75.3	Confident	81.8	Confident	14 Å²	14	58.4 Å²	58.4	14%	0.144	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-61.9	-14.5	175.1	0	0	0	0	0	115.2	R253	R253-G255 PolarHBondContact O-N 3.48Å
256	L	82.2	Confident	81.4	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-100.7	-3.8	177.4	-62.6	174.7	0	0	0	113.5	E223 R253 P254 L282 R283 P284 M288 I636 L640	E223-L256 HydrophobicContact CG-CB 4.04Å; R253-L256 HydrophobicContact CB-CD1 4.01Å; R253-L256 HydrophobicContact CB-CG 4.38Å; R253-L256 PolarHBondContact O-N 3.35Å; P254-L256 PolarHBondContact O-N 2.93Å; P254-L256 VanDerWaalsContact O-N 3.09Å; L256-L282 HydrophobicContact CD2-CD2 4.09Å; L256-R283 WeakPolarHBondContact CD1-O 3.21Å; L256-P284 HydrophobicContact CD2-CG 4.47Å; L256-M288 HydrophobicContact CD1-CE 4.45Å; L256-M288 HydrophobicContact CD1-SD 3.97Å; L256-I636 HydrophobicContact CD2-CG2 4.34Å; L256-L640 HydrophobicContact CD2-CD2 4.45Å
257	L	82	Confident	81.2	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.037	31%	0.307	C	S	.	.	S	Bend	trans	-73	146.2	175.9	-67.4	167.8	0	0	0	110.9	E223 A224 P254 E261 T262 L265	E223-L257 HydrophobicContact CB-CD2 3.58Å; E223-L257 HydrophobicContact CB-CG 4.06Å; A224-L257 HydrophobicContact CB-CD2 4.24Å; P254-L257 HydrophobicContact CB-CD1 4.28Å; P254-L257 WeakPolarHBondContact O-CB 3.42Å; P254-L257 PolarHBondContact O-N 3.17Å; P254-L257 VanDerWaalsContact O-N 3.09Å; L257-E261 HydrophobicContact CB-CB 4.29Å; L257-E261 HydrophobicContact CD2-CB 4.02Å; L257-T262 WeakPolarHBondContact CB-OG1 3.32Å; L257-L265 HydrophobicContact CD1-CD2 3.85Å
258	S	79.6	Confident	80.9	Confident	34 Å²	34	62.2 Å²	62.2	24%	0.238	30%	0.3	C	S	.	.			trans	-67.1	162.1	166.9	68.1	0	0	0	0	111	E260 E261 T262	S258-E260 PolarHBondContact O-N 3.05Å; S258-E261 VanDerWaalsContact CB-OE2 3.23Å; S258-E261 WeakPolarHBondContact CB-OE2 3.1Å; S258-E261 PolarHBondContact N-OE2 3.33Å; S258-E261 PolarHBondContact O-N 3.11Å; S258-E261 WeakPolarHBondContact OG-CB 3.28Å; S258-E261 WeakPolarHBondContact OG-CG 3.41Å; S258-E261 PolarHBondContact OG-N 3.47Å; S258-E261 VanDerWaalsContact OG-N 3.14Å; S258-E261 PolarHBondContact OG-OE2 3.41Å; S258-T262 WeakPolarHBondContact O-CB 3.34Å; S258-T262 PolarHBondContact O-N 2.8Å; S258-T262 PolarHBondContact O-OG1 3.01Å
259	Q	78	Confident	80.2	Confident	145 Å²	145	65.1 Å²	65.1	68%	0.678	32%	0.315	S	S	*	.	H	α-helix	trans	-60	-36.7	175.7	-82.8	170.6	-1.1	0	0	111.8	R263 R639	Q259-R263 WeakPolarHBondContact O-CB 3.37Å; Q259-R263 PolarHBondContact O-N 3.33Å; Q259-R639 VanDerWaalsContact N-NH2 3.13Å
260	E	80.6	Confident	79.3	Confident	155 Å²	155	64.2 Å²	64.2	72%	0.724	32%	0.316	S	S	*	.	H	α-helix	trans	-67.7	-46.8	177.8	-68.1	174.3	-171.6	0	0	111.6	S258 R263 R264	S258-E260 PolarHBondContact O-N 3.05Å; E260-R263 PolarHBondContact O-N 3.35Å; E260-R264 PolarHBondContact O-N 2.98Å
261	E	82.1	Confident	77.8	Confident	40 Å²	40	62.1 Å²	62.1	19%	0.187	32%	0.316	C	S	.	.	H	α-helix	trans	-63.8	-43.9	176.2	-69.5	162.8	139.6	0	0	110.9	S222 A224 L257 S258 R263 R264 L265	S222-E261 VanDerWaalsContact CB-OE1 3.25Å; S222-E261 WeakPolarHBondContact CB-OE1 3.36Å; S222-E261 PolarHBondContact OG-OE1 3.22Å; A224-E261 HydrophobicContact CB-CB 4.37Å; A224-E261 HydrophobicContact CB-CG 3.87Å; A224-E261 VanDerWaalsContact CB-OE1 3.26Å; A224-E261 WeakPolarHBondContact CB-OE1 3.46Å; L257-E261 HydrophobicContact CB-CB 4.29Å; L257-E261 HydrophobicContact CD2-CB 4.02Å; S258-E261 VanDerWaalsContact CB-OE2 3.23Å; S258-E261 WeakPolarHBondContact CB-OE2 3.1Å; S258-E261 PolarHBondContact N-OE2 3.33Å; S258-E261 PolarHBondContact O-N 3.11Å; S258-E261 WeakPolarHBondContact OG-CB 3.28Å; S258-E261 WeakPolarHBondContact OG-CG 3.41Å; S258-E261 PolarHBondContact OG-N 3.47Å; S258-E261 VanDerWaalsContact OG-N 3.14Å; S258-E261 PolarHBondContact OG-OE2 3.41Å; E261-R263 VanDerWaalsContact C-N 3.31Å; E261-R263 PolarHBondContact O-N 3.26Å; E261-R264 WeakPolarHBondContact O-CB 3.36Å; E261-R264 PolarHBondContact O-N 3.4Å; E261-L265 WeakPolarHBondContact O-CD1 3.43Å; E261-L265 PolarHBondContact O-N 3.22Å
262	T	78.1	Confident	76	Confident	35 Å²	35	63.4 Å²	63.4	22%	0.215	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-44.3	176.7	-54	0	0	0	0	110.6	L257 S258 L265 S266	L257-T262 WeakPolarHBondContact CB-OG1 3.32Å; S258-T262 WeakPolarHBondContact O-CB 3.34Å; S258-T262 PolarHBondContact O-N 2.8Å; S258-T262 PolarHBondContact O-OG1 3.01Å; T262-L265 PolarHBondContact O-N 2.92Å; T262-S266 VanDerWaalsContact O-CB 3.31Å; T262-S266 WeakPolarHBondContact O-CB 3.46Å; T262-S266 PolarHBondContact O-N 2.95Å; T262-S266 PolarHBondContact O-OG 3.22Å
263	R	79.2	Confident	74.2	Confident	163 Å²	163	65.7 Å²	65.7	62%	0.615	36%	0.36	S	S	*	.	H	α-helix	trans	-62.6	-43.2	176.9	-171	-177.9	71.2	118	1.8	111.6	Q259 E260 E261 S266 Q267	Q259-R263 WeakPolarHBondContact O-CB 3.37Å; Q259-R263 PolarHBondContact O-N 3.33Å; E260-R263 PolarHBondContact O-N 3.35Å; E261-R263 VanDerWaalsContact C-N 3.31Å; E261-R263 PolarHBondContact O-N 3.26Å; R263-S266 PolarHBondContact O-N 2.72Å; R263-Q267 VanDerWaalsContact O-CG 3.31Å; R263-Q267 WeakPolarHBondContact O-CG 3.43Å; R263-Q267 PolarHBondContact O-N 3.31Å
264	R	82.9	Confident	72.1	Confident	85 Å²	85	67 Å²	67	32%	0.321	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-51	175.2	177.7	-175.8	165.5	-149.6	-13.9	111	D228 E260 E261 S266 Q267 E268	D228-R264 IonicContact OD1-CZ 3.1Å; D228-R264 IonicContact OD1-NH1 2.73Å; D228-R264 IonicContact OD1-NH2 3.36Å; D228-R264 PolarHBondContact OD1-NH2 3.18Å; D228-R264 IonicContact OD2-NH1 2.86Å; D228-R264 PolarHBondContact OD2-NH1 2.82Å; D228-R264 IonicContact OD2-NH2 2.61Å; E260-R264 PolarHBondContact O-N 2.98Å; E261-R264 WeakPolarHBondContact O-CB 3.36Å; E261-R264 PolarHBondContact O-N 3.4Å; R264-S266 VanDerWaalsContact C-N 3.31Å; R264-S266 PolarHBondContact O-N 3.11Å; R264-Q267 WeakPolarHBondContact O-CB 3.31Å; R264-Q267 PolarHBondContact O-N 2.69Å; R264-E268 IonicContact CZ-OE1 3.87Å; R264-E268 IonicContact NE-OE1 3.68Å; R264-E268 PolarHBondContact NE-OE1 2.81Å; R264-E268 VanDerWaalsContact NE-OE1 3.07Å; R264-E268 IonicContact NH2-OE1 3.54Å; R264-E268 PolarHBondContact NH2-OE1 3.02Å; R264-E268 PolarHBondContact O-N 3.4Å; R264-E268 VanDerWaalsContact O-N 3.11Å
265	L	79	Confident	70.3	Confident	10 Å²	10	67.3 Å²	67.3	5%	0.052	39%	0.388	C	S	.	.	H	α-helix	trans	-63.9	-37.6	179.9	-86.6	78	0	0	0	111.8	Y227 L252 L257 E261 T262 Q267 E268 L269	Y227-L265 HydrophobicContact CD1-CD1 4.08Å; Y227-L265 HydrophobicContact CD1-CD2 4.11Å; Y227-L265 HydrophobicContact CD1-CG 3.93Å; Y227-L265 HydrophobicContact CD2-CD2 3.87Å; Y227-L265 HydrophobicContact CD2-CG 4.32Å; Y227-L265 HydrophobicContact CE1-CD1 4.4Å; Y227-L265 HydrophobicContact CE1-CG 4.03Å; Y227-L265 HydrophobicContact CE2-CD2 4.35Å; Y227-L265 HydrophobicContact CE2-CG 4.42Å; Y227-L265 HydrophobicContact CG-CD1 4.48Å; Y227-L265 HydrophobicContact CG-CD2 3.73Å; Y227-L265 HydrophobicContact CG-CG 4.07Å; L252-L265 HydrophobicContact CD2-CD2 3.78Å; L257-L265 HydrophobicContact CD1-CD2 3.85Å; E261-L265 WeakPolarHBondContact O-CD1 3.43Å; E261-L265 PolarHBondContact O-N 3.22Å; T262-L265 PolarHBondContact O-N 2.92Å; L265-Q267 VanDerWaalsContact C-N 3.3Å; L265-Q267 PolarHBondContact O-N 2.62Å; L265-E268 PolarHBondContact O-N 2.72Å; L265-L269 WeakPolarHBondContact O-CB 3.35Å; L265-L269 PolarHBondContact O-N 3.19Å
266	S	75.1	Confident	68.7	Low	35 Å²	35	75.7 Å²	75.7	25%	0.245	42%	0.423	C	S	.	.	H	α-helix	trans	-65	-33.9	176.6	-55.3	0	0	0	0	112.4	T262 R263 R264 G270 A274	T262-S266 VanDerWaalsContact O-CB 3.31Å; T262-S266 WeakPolarHBondContact O-CB 3.46Å; T262-S266 PolarHBondContact O-N 2.95Å; T262-S266 PolarHBondContact O-OG 3.22Å; R263-S266 PolarHBondContact O-N 2.72Å; R264-S266 VanDerWaalsContact C-N 3.31Å; R264-S266 PolarHBondContact O-N 3.11Å; S266-G270 CarbonylContact O-C 3.5Å; S266-G270 WeakPolarHBondContact O-CA 3.48Å; S266-G270 PolarHBondContact O-N 3Å; S266-G270 VanDerWaalsContact O-N 3.1Å; S266-A274 WeakPolarHBondContact OG-CB 3.2Å
267	Q	79.1	Confident	66.9	Low	135 Å²	135	77.9 Å²	77.9	63%	0.631	45%	0.446	S	S	*	.	H	α-helix	trans	-70.3	-36	173.9	-73.9	174.5	-8.3	0	0	112.1	R263 R264 L265	R263-Q267 VanDerWaalsContact O-CG 3.31Å; R263-Q267 WeakPolarHBondContact O-CG 3.43Å; R263-Q267 PolarHBondContact O-N 3.31Å; R264-Q267 WeakPolarHBondContact O-CB 3.31Å; R264-Q267 PolarHBondContact O-N 2.69Å; L265-Q267 VanDerWaalsContact C-N 3.3Å; L265-Q267 PolarHBondContact O-N 2.62Å
268	E	77.4	Confident	65.1	Low	79 Å²	79	84.4 Å²	84.4	37%	0.369	48%	0.481	S	S	.	.	H	α-helix	trans	-79.9	-37.1	-179	-68.2	-177.6	-161.1	0	0	113.1	Y227 R231 R264 L265	Y227-E268 VanDerWaalsContact CE1-OE2 3.23Å; Y227-E268 WeakPolarHBondContact CE1-OE2 3.29Å; Y227-E268 PolarHBondContact OH-OE2 3.08Å; R231-E268 IonicContact CZ-OE2 3.71Å; R231-E268 VanDerWaalsContact NH1-CD 3.25Å; R231-E268 IonicContact NH1-OE1 2.66Å; R231-E268 PolarHBondContact NH1-OE1 2.99Å; R231-E268 IonicContact NH1-OE2 3.42Å; R231-E268 PolarHBondContact NH1-OE2 2.85Å; R264-E268 IonicContact CZ-OE1 3.87Å; R264-E268 IonicContact NE-OE1 3.68Å; R264-E268 PolarHBondContact NE-OE1 2.81Å; R264-E268 VanDerWaalsContact NE-OE1 3.07Å; R264-E268 IonicContact NH2-OE1 3.54Å; R264-E268 PolarHBondContact NH2-OE1 3.02Å; R264-E268 PolarHBondContact O-N 3.4Å; R264-E268 VanDerWaalsContact O-N 3.11Å; L265-E268 PolarHBondContact O-N 2.72Å
269	L	70.4	Confident	63.8	Low	67 Å²	67	86.2 Å²	86.2	35%	0.351	51%	0.505	S	S	.	.	H	α-helix	trans	-99.9	-9.7	-174.6	-64.9	167.2	0	0	0	114.2	Y227 L249 L265 A273	Y227-L269 HydrophobicContact CE2-CD1 3.9Å; Y227-L269 HydrophobicContact CE2-CD2 4.27Å; Y227-L269 HydrophobicContact CE2-CG 4.26Å; L249-L269 HydrophobicContact CD1-CD1 4.35Å; L249-L269 HydrophobicContact CD1-CD2 3.95Å; L265-L269 WeakPolarHBondContact O-CB 3.35Å; L265-L269 PolarHBondContact O-N 3.19Å; L269-A273 HydrophobicContact CB-CB 3.86Å
270	G	64.5	Low	62.7	Low	24 Å²	24	80.2 Å²	80.2	25%	0.247	48%	0.482	C	S	.	.			trans	80.9	162.3	-174.1	0	0	0	0	0	114	S266 A272 A273	S266-G270 CarbonylContact O-C 3.5Å; S266-G270 WeakPolarHBondContact O-CA 3.48Å; S266-G270 PolarHBondContact O-N 3Å; S266-G270 VanDerWaalsContact O-N 3.1Å; G270-A272 VanDerWaalsContact C-N 3.25Å; G270-A272 PolarHBondContact O-N 3.31Å; G270-A273 PolarHBondContact O-N 3.45Å
271	P	54.1	Low	61.8	Low	116 Å²	116	76.6 Å²	76.6	75%	0.753	47%	0.472	S	S	*	.	H	α-helix	trans	-65.5	-21.7	-170.7	23.8	-32.8	0	0	0	114.5	A274 G275	P271-A274 PolarHBondContact O-N 3.3Å; P271-G275 PolarHBondContact O-N 3.47Å; P271-G275 VanDerWaalsContact O-N 3.11Å
272	A	47.4	Very low	61.4	Low	90 Å²	90	78.2 Å²	78.2	74%	0.744	48%	0.481	S	S	*	.	H	α-helix	trans	-71.9	-31.4	-179.3	0	0	0	0	0	113.3	G270	G270-A272 VanDerWaalsContact C-N 3.25Å; G270-A272 PolarHBondContact O-N 3.31Å
273	A	48.4	Very low	61.6	Low	71 Å²	71	84.6 Å²	84.6	59%	0.587	50%	0.501	S	S	*	.	H	α-helix	trans	-81.4	-19.5	177.1	0	0	0	0	0	113.1	L269 G270	L269-A273 HydrophobicContact CB-CB 3.86Å; G270-A273 PolarHBondContact O-N 3.45Å
274	A	41.8	Very low	62	Low	46 Å²	46	77.8 Å²	77.8	38%	0.38	48%	0.479	S	S	.	.	H	α-helix	trans	-93.9	-16.1	177.8	0	0	0	0	0	113.4	S266 P271	S266-A274 WeakPolarHBondContact OG-CB 3.2Å; P271-A274 PolarHBondContact O-N 3.3Å
275	G	40.1	Very low	62.3	Low	59 Å²	59	73.8 Å²	73.8	61%	0.608	46%	0.463	S	S	*	.			trans	-93.1	-16.7	-165.1	0	0	0	0	0	116.5	P271 G277	P271-G275 PolarHBondContact O-N 3.47Å; P271-G275 VanDerWaalsContact O-N 3.11Å; G275-G277 PolarHBondContact O-N 2.71Å
276	E	41.1	Very low	62.7	Low	190 Å²	190	76.2 Å²	76.2	89%	0.888	48%	0.475	S	S	*	.	S	Bend	trans	-83.7	70.1	174.6	-72.2	-167.1	165	0	0	111.1
277	G	43.4	Very low	63.2	Low	49 Å²	49	75.2 Å²	75.2	51%	0.505	47%	0.469	S	S	.	.			trans	68.6	121.4	164.7	0	0	0	0	0	115	G275 G279	G275-G277 PolarHBondContact O-N 2.71Å; G277-G279 PolarHBondContact O-N 3.35Å
278	L	45.2	Very low	63.8	Low	144 Å²	144	68.8 Å²	68.8	75%	0.754	44%	0.439	S	S	*	.	S	Bend	trans	-64	37.3	160.8	-79.8	140.4	0	0	0	112.6
279	G	52.1	Low	64.4	Low	73 Å²	73	66.5 Å²	66.5	75%	0.753	43%	0.428	S	S	*	.			trans	-118.1	41.4	-175.8	0	0	0	0	0	112.1	G277	G277-G279 PolarHBondContact O-N 3.35Å
280	G	55.8	Low	65.4	Low	19 Å²	19	65.4 Å²	65.4	20%	0.196	42%	0.421	C	S	.	.	S	Bend	trans	-74.8	159.4	164.7	0	0	0	0	0	111.3	L282	G280-L282 PolarHBondContact O-N 2.78Å; G280-L282 VanDerWaalsContact O-N 3.15Å
281	P	61.2	Low	66.7	Low	78 Å²	78	68.1 Å²	68.1	51%	0.506	43%	0.427	S	S	.	.			trans	-59.6	120.1	179.8	23	-32.1	0	0	0	111.4	R283	P281-R283 PolarHBondContact O-N 2.81Å
282	L	73.1	Confident	68.5	Low	74 Å²	74	63.2 Å²	63.2	39%	0.387	39%	0.393	S	S	.	.			trans	-78.7	57.5	176.2	-67.9	165.4	0	0	0	111.3	L256 G280 P284 L640 A643	L256-L282 HydrophobicContact CD2-CD2 4.09Å; G280-L282 PolarHBondContact O-N 2.78Å; G280-L282 VanDerWaalsContact O-N 3.15Å; L282-P284 WeakPolarHBondContact O-CD 3.32Å; L282-L640 HydrophobicContact CB-CD2 4.14Å; L282-A643 HydrophobicContact CD1-CB 3.28Å; L282-A643 HydrophobicContact CD2-CB 4.45Å; L282-A643 HydrophobicContact CG-CB 4.5Å
283	R	83.1	Confident	70.7	Confident	169 Å²	169	58.9 Å²	58.9	64%	0.638	36%	0.358	S	S	*	.			trans	-110.2	101.2	177.1	-66.5	-175.6	-177.6	-176.5	1.3	108.3	R253 L256 P281	R253-R283 WeakPolarHBondContact CD-O 3.18Å; R253-R283 PolarHBondContact NH1-O 2.88Å; L256-R283 WeakPolarHBondContact CD1-O 3.21Å; P281-R283 PolarHBondContact O-N 2.81Å
284	P	86.9	Confident	72.9	Confident	21 Å²	21	55.5 Å²	55.5	14%	0.136	33%	0.33	C	S	.	.			trans	-63.2	146.6	178.6	-18.7	30.6	0	0	0	111.8	L256 L282 M288 F289 I636 L640	L256-P284 HydrophobicContact CD2-CG 4.47Å; L282-P284 WeakPolarHBondContact O-CD 3.32Å; P284-M288 HydrophobicContact CB-CB 3.95Å; P284-M288 HydrophobicContact CB-SD 4.05Å; P284-F289 HydrophobicContact CB-CD2 4.49Å; P284-F289 HydrophobicContact CB-CE2 3.7Å; P284-F289 HydrophobicContact CB-CZ 3.82Å; P284-F289 HydrophobicContact CG-CE2 4.43Å; P284-F289 HydrophobicContact CG-CZ 4.05Å; P284-I636 HydrophobicContact CB-CG2 4.16Å; P284-I636 HydrophobicContact CG-CG2 3.97Å; P284-L640 HydrophobicContact CG-CD1 3.96Å; P284-L640 HydrophobicContact CG-CD2 4.33Å
285	R	89.7	Confident	75.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.312	C	S	.	.			trans	-78.7	162.5	175.3	-63.4	176.7	-178.8	-95.9	9.3	111.3	L213 S215 D216 L218 V220 E223 H251 G287 M288 F289	L213-R285 VanDerWaalsContact O-CZ 3.27Å; L213-R285 PolarHBondContact O-NH1 3.4Å; L213-R285 PolarHBondContact O-NH2 2.74Å; S215-R285 PolarHBondContact O-NH1 3.14Å; D216-R285 CarbonylContact O-C 3.57Å; D216-R285 WeakPolarHBondContact O-CA 3.33Å; L218-R285 WeakPolarHBondContact O-CB 3.45Å; V220-R285 HydrophobicContact CG2-CB 4.08Å; V220-R285 HydrophobicContact CG2-CG 4.33Å; E223-R285 VanDerWaalsContact OE1-CD 3.25Å; E223-R285 WeakPolarHBondContact OE1-CD 3.45Å; E223-R285 IonicContact OE1-CZ 3.95Å; E223-R285 IonicContact OE1-NE 3.29Å; E223-R285 PolarHBondContact OE1-NE 3.24Å; E223-R285 IonicContact OE1-NH2 3.02Å; E223-R285 IonicContact OE2-CZ 2.76Å; E223-R285 IonicContact OE2-NE 3.56Å; E223-R285 PolarHBondContact OE2-NE 3.37Å; E223-R285 IonicContact OE2-NH2 3.88Å; E223-R285 PolarHBondContact OE2-NH2 2.86Å; H251-R285 PolarHBondContact O-NH2 2.91Å; H251-R285 VanDerWaalsContact O-NH2 3.11Å; R285-G287 VanDerWaalsContact C-N 3.25Å; R285-G287 PolarHBondContact O-N 3.37Å; R285-G287 VanDerWaalsContact O-N 3.15Å; R285-M288 HydrophobicContact CB-CE 4.47Å; R285-M288 HydrophobicContact CB-CG 4.4Å; R285-M288 HydrophobicContact CB-SD 4.34Å; R285-M288 HydrophobicContact CG-CE 4.47Å; R285-M288 VanDerWaalsContact O-CB 3.28Å; R285-M288 WeakPolarHBondContact O-CB 3.42Å; R285-M288 PolarHBondContact O-N 2.87Å; R285-F289 VanDerWaalsContact O-CD2 3.27Å; R285-F289 WeakPolarHBondContact O-CD2 3.47Å
286	E	86.8	Confident	77.4	Confident	62 Å²	62	50.7 Å²	50.7	29%	0.29	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-56.2	-35.2	-176	-178.6	157.5	-147.8	0	0	113.9	D216 L218 M288 F289 K630	D216-E286 PolarHBondContact O-N 2.89Å; L218-E286 PolarHBondContact O-N 3.09Å; E286-M288 VanDerWaalsContact C-N 3.27Å; E286-M288 PolarHBondContact O-N 3.5Å; E286-F289 PolarHBondContact O-N 2.81Å; E286-K630 IonicContact OE1-NZ 3.1Å; E286-K630 PolarHBondContact OE1-NZ 2.78Å; E286-K630 VanDerWaalsContact OE1-NZ 3.09Å
287	G	86.7	Confident	79.2	Confident	13 Å²	13	41.7 Å²	41.7	13%	0.134	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-70.6	-18.4	176.5	0	0	0	0	0	115.1	L218 V220 R285 F289 K633	L218-G287 PolarHBondContact O-N 3.36Å; V220-G287 CarbonylContact O-C 3.58Å; V220-G287 VanDerWaalsContact O-CA 3.23Å; V220-G287 WeakPolarHBondContact O-CA 3.19Å; R285-G287 VanDerWaalsContact C-N 3.25Å; R285-G287 PolarHBondContact O-N 3.37Å; R285-G287 VanDerWaalsContact O-N 3.15Å; G287-F289 PolarHBondContact O-N 3.04Å; G287-K633 WeakPolarHBondContact O-CE 3.21Å; G287-K633 PolarHBondContact O-NZ 3.08Å
288	M	90.6	Very high	80.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-79.8	-3.1	178.1	-63.7	-179.5	180	0	0	112.9	V220 E223 L256 P284 R285 E286 K633 I636	V220-M288 HydrophobicContact CG2-CE 4.36Å; V220-M288 WeakPolarHBondContact O-CG 3.34Å; V220-M288 PolarHBondContact O-N 2.97Å; E223-M288 HydrophobicContact CG-CE 3.79Å; L256-M288 HydrophobicContact CD1-CE 4.45Å; L256-M288 HydrophobicContact CD1-SD 3.97Å; P284-M288 HydrophobicContact CB-CB 3.95Å; P284-M288 HydrophobicContact CB-SD 4.05Å; R285-M288 HydrophobicContact CB-CE 4.47Å; R285-M288 HydrophobicContact CB-CG 4.4Å; R285-M288 HydrophobicContact CB-SD 4.34Å; R285-M288 HydrophobicContact CG-CE 4.47Å; R285-M288 VanDerWaalsContact O-CB 3.28Å; R285-M288 WeakPolarHBondContact O-CB 3.42Å; R285-M288 PolarHBondContact O-N 2.87Å; E286-M288 VanDerWaalsContact C-N 3.27Å; E286-M288 PolarHBondContact O-N 3.5Å; M288-K633 WeakPolarHBondContact O-CB 3.32Å; M288-K633 WeakPolarHBondContact O-CG 3.26Å; M288-K633 PolarHBondContact O-N 3.23Å; M288-I636 HydrophobicContact CB-CG1 4.13Å; M288-I636 HydrophobicContact CG-CD1 4.46Å; M288-I636 HydrophobicContact CG-CG1 4.35Å; M288-I636 HydrophobicContact SD-CD1 4.02Å; M288-I636 HydrophobicContact SD-CG1 4.38Å
289	F	90.8	Very high	81.7	Confident	32 Å²	32	33.1 Å²	33.1	14%	0.14	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.6	174.5	-63.8	-90.4	0	0	0	111.8	P284 R285 E286 G287 D342 K630 F631 P632	P284-F289 HydrophobicContact CB-CD2 4.49Å; P284-F289 HydrophobicContact CB-CE2 3.7Å; P284-F289 HydrophobicContact CB-CZ 3.82Å; P284-F289 HydrophobicContact CG-CE2 4.43Å; P284-F289 HydrophobicContact CG-CZ 4.05Å; R285-F289 VanDerWaalsContact O-CD2 3.27Å; R285-F289 WeakPolarHBondContact O-CD2 3.47Å; E286-F289 PolarHBondContact O-N 2.81Å; G287-F289 PolarHBondContact O-N 3.04Å; F289-D342 HydrophobicContact CE1-CB 3.94Å; F289-D342 HydrophobicContact CZ-CB 4.41Å; F289-K630 HydrophobicContact CB-CB 4.07Å; F289-K630 HydrophobicContact CD1-CB 3.95Å; F289-K630 HydrophobicContact CG-CB 4.19Å; F289-F631 CarbonylContact C-O 3.03Å; F289-F631 WeakPolarHBondContact CA-O 3.35Å; F289-P632 HydrophobicContact CD1-CG 4.24Å; F289-P632 HydrophobicContact CE1-CG 3.93Å
290	E	90.4	Very high	82.4	Confident	43 Å²	43	30.7 Å²	30.7	20%	0.201	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	144.9	163.4	60	-178.6	-168.9	0	0	110.2	K292 K630 F631	E290-K292 WeakPolarHBondContact OE1-CE 3.47Å; E290-K292 IonicContact OE1-NZ 3.45Å; E290-K292 PolarHBondContact OE1-NZ 3.08Å; E290-K292 VanDerWaalsContact OE1-NZ 3.1Å; E290-K630 CarbonylContact O-C 3.53Å; E290-K630 WeakPolarHBondContact O-CA 3.36Å; E290-F631 HydrophobicContact CG-CB 4.14Å; E290-F631 PolarHBondContact N-O 2.92Å; E290-F631 PolarHBondContact O-N 2.82Å
291	K	91.6	Very high	82.9	Confident	82 Å²	82	32.1 Å²	32.1	36%	0.357	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.3	177.9	-69.7	175.7	-175.3	171.8	0	109	W578 T628 L629 K630	K291-W578 PolarHBondContact O-NE1 2.85Å; K291-T628 HydrophobicContact CB-CG2 3.97Å; K291-T628 HydrophobicContact CG-CG2 4.47Å; K291-L629 WeakPolarHBondContact CA-O 2.92Å; K291-K630 HydrophobicContact CG-CG 4.01Å
292	K	93.3	Very high	82.8	Confident	12 Å²	12	33.6 Å²	33.6	5%	0.052	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158.6	172.2	-61.3	180	-176.6	169.3	0	109.6	E290 C315 D317 E324 T628 L629 F631	E290-K292 WeakPolarHBondContact OE1-CE 3.47Å; E290-K292 IonicContact OE1-NZ 3.45Å; E290-K292 PolarHBondContact OE1-NZ 3.08Å; E290-K292 VanDerWaalsContact OE1-NZ 3.1Å; K292-C315 HydrophobicContact CB-CB 4.4Å; K292-D317 HydrophobicContact CD-CB 4.4Å; K292-D317 HydrophobicContact CG-CB 4.29Å; K292-E324 IonicContact NZ-OE2 3.27Å; K292-E324 PolarHBondContact NZ-OE2 2.63Å; K292-T628 WeakPolarHBondContact O-CA 3.22Å; K292-L629 PolarHBondContact N-O 2.58Å; K292-L629 PolarHBondContact O-N 3.42Å; K292-F631 HydrophobicContact CB-CD2 3.84Å; K292-F631 HydrophobicContact CB-CE2 3.78Å; K292-F631 HydrophobicContact CD-CD2 3.99Å; K292-F631 HydrophobicContact CD-CE2 4.25Å; K292-F631 HydrophobicContact CD-CG 4.47Å; K292-F631 HydrophobicContact CG-CD2 4.02Å; K292-F631 HydrophobicContact CG-CE2 4.38Å
293	I	93.8	Very high	82.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.1	174.4	-59.5	175	0	0	0	107.1	C315 F316 P318 A576 W578 Y583 L585 C626 T627	I293-C315 CarbonylContact O-C 3.59Å; I293-C315 WeakPolarHBondContact O-CA 3.33Å; I293-F316 HydrophobicContact CB-CB 4.48Å; I293-F316 HydrophobicContact CD1-CD1 4.43Å; I293-F316 PolarHBondContact N-O 2.83Å; I293-F316 PolarHBondContact O-N 2.81Å; I293-P318 HydrophobicContact CD1-CG 3.87Å; I293-P318 HydrophobicContact CG1-CG 4.12Å; I293-A576 HydrophobicContact CD1-CB 4.25Å; I293-A576 HydrophobicContact CG1-CB 4.23Å; I293-A576 HydrophobicContact CG2-CB 3.76Å; I293-W578 HydrophobicContact CD1-CB 4.25Å; I293-W578 HydrophobicContact CG1-CB 4.38Å; I293-Y583 HydrophobicContact CD1-CD1 4.15Å; I293-Y583 HydrophobicContact CD1-CD2 3.77Å; I293-Y583 HydrophobicContact CD1-CE2 4.5Å; I293-Y583 HydrophobicContact CD1-CG 3.58Å; I293-L585 HydrophobicContact CG2-CD1 3.79Å; I293-C626 VanDerWaalsContact CG2-SG 3.59Å; I293-T627 CarbonylContact C-O 3.56Å; I293-T627 WeakPolarHBondContact CA-O 3.36Å
294	V	92.6	Very high	81.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130	177.7	-176.6	0	0	0	0	108.5	V296 V313 C315 L326 L344 C626 T627 L629 F631	V294-V296 HydrophobicContact CG1-CG2 4.31Å; V294-V313 HydrophobicContact CG1-CG1 3.83Å; V294-C315 HydrophobicContact CG2-CB 4.11Å; V294-L326 HydrophobicContact CG1-CD1 4.13Å; V294-L326 HydrophobicContact CG2-CD1 4.4Å; V294-L344 HydrophobicContact CB-CD2 4.43Å; V294-L344 HydrophobicContact CG1-CD2 3.82Å; V294-C626 WeakPolarHBondContact O-CA 3.47Å; V294-T627 PolarHBondContact N-O 3.06Å; V294-T627 PolarHBondContact O-N 2.92Å; V294-L629 HydrophobicContact CG2-CB 3.7Å; V294-L629 HydrophobicContact CG2-CD2 4.13Å; V294-F631 HydrophobicContact CG2-CE2 3.72Å; V294-F631 HydrophobicContact CG2-CZ 3.73Å
295	C	90.1	Very high	79.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.7	173.8	-55.3	0	0	0	0	108.6	L298 V313 D314 F624 G625	C295-L298 HydrophobicContact CB-CD1 3.9Å; C295-L298 HydrophobicContact CB-CD2 3.48Å; C295-L298 VanDerWaalsContact CB-CD2 3.48Å; C295-L298 HydrophobicContact CB-CG 3.7Å; C295-V313 WeakPolarHBondContact O-CA 3.34Å; C295-D314 PolarHBondContact N-O 2.98Å; C295-D314 PolarHBondContact O-N 2.85Å; C295-D314 VanDerWaalsContact O-N 3.09Å; C295-F624 HydrophobicContact CB-CD2 3.95Å; C295-F624 HydrophobicContact CB-CE2 3.86Å; C295-G625 CarbonylContact C-O 3.56Å; C295-G625 VanDerWaalsContact CA-O 3.31Å; C295-G625 WeakPolarHBondContact CA-O 3.34Å
296	V	86.6	Confident	78.3	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126	-177.9	-179	0	0	0	0	107.8	V294 V313 V346 F624 G625	V294-V296 HydrophobicContact CG1-CG2 4.31Å; V296-V313 HydrophobicContact CG1-CG2 4.35Å; V296-V313 HydrophobicContact CG2-CG1 4.23Å; V296-V346 HydrophobicContact CG1-CG1 4.43Å; V296-V346 HydrophobicContact CG1-CG2 4.06Å; V296-V346 HydrophobicContact CG2-CG2 4.06Å; V296-F624 WeakPolarHBondContact O-CB 3.25Å; V296-G625 PolarHBondContact N-O 2.87Å; V296-G625 PolarHBondContact O-N 3.43Å
297	D	79	Confident	76.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.			trans	71.2	67.9	-170.6	-175.5	17.3	0	0	0	112.9	T299 R301 Y311 T312 F624	D297-T299 PolarHBondContact O-N 3.48Å; D297-T299 PolarHBondContact OD1-N 2.73Å; D297-T299 PolarHBondContact OD1-OG1 3.43Å; D297-R301 IonicContact OD2-CZ 2.86Å; D297-R301 IonicContact OD2-NH1 2.77Å; D297-R301 PolarHBondContact OD2-NH1 3.48Å; D297-R301 VanDerWaalsContact OD2-NH1 3.11Å; D297-R301 IonicContact OD2-NH2 3.7Å; D297-R301 PolarHBondContact OD2-NH2 2.89Å; D297-Y311 HydrophobicContact CB-CD1 4.27Å; D297-Y311 HydrophobicContact CB-CD2 4.16Å; D297-Y311 HydrophobicContact CB-CG 4.08Å; D297-Y311 WeakPolarHBondContact OD1-CD1 3.16Å; D297-Y311 WeakPolarHBondContact OD1-CE1 3.17Å; D297-T312 PolarHBondContact N-O 3.09Å; D297-F624 HydrophobicContact CB-CB 4.5Å; D297-F624 WeakPolarHBondContact O-CB 3.43Å
298	L	72.7	Confident	75.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.231	C	C	.	.			trans	-86.4	18.6	170.8	-69.3	-167.2	0	0	0	114.4	C295 P300 T312 D314 W323 L614 P615 V621 F624	C295-L298 HydrophobicContact CB-CD1 3.9Å; C295-L298 HydrophobicContact CB-CD2 3.48Å; C295-L298 VanDerWaalsContact CB-CD2 3.48Å; C295-L298 HydrophobicContact CB-CG 3.7Å; L298-P300 WeakPolarHBondContact O-CD 3.31Å; L298-T312 PolarHBondContact N-O 2.79Å; L298-T312 VanDerWaalsContact N-O 3.16Å; L298-D314 HydrophobicContact CD1-CB 3.64Å; L298-W323 HydrophobicContact CD1-CH2 4.48Å; L298-W323 HydrophobicContact CD1-CZ3 3.94Å; L298-L614 HydrophobicContact CD1-CD2 4.38Å; L298-L614 HydrophobicContact CD2-CD2 3.6Å; L298-P615 HydrophobicContact CD1-CG 3.76Å; L298-V621 HydrophobicContact CD2-CB 4.48Å; L298-V621 HydrophobicContact CD2-CG1 3.9Å; L298-V621 WeakPolarHBondContact O-CG2 3.35Å; L298-F624 HydrophobicContact CD2-CD1 4.49Å; L298-F624 HydrophobicContact CD2-CD2 3.9Å; L298-F624 HydrophobicContact CD2-CE2 4.04Å; L298-F624 HydrophobicContact CD2-CG 4.13Å; L298-F624 HydrophobicContact CD2-CZ 4.37Å
299	T	68.8	Low	74	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.08	25%	0.251	C	S	.	.			trans	-70.6	130.4	-179.7	54.1	0	0	0	0	111.6	D297 R301 Y311	D297-T299 PolarHBondContact O-N 3.48Å; D297-T299 PolarHBondContact OD1-N 2.73Å; D297-T299 PolarHBondContact OD1-OG1 3.43Å; T299-R301 PolarHBondContact O-N 2.82Å; T299-Y311 HydrophobicContact CG2-CD1 3.5Å; T299-Y311 HydrophobicContact CG2-CE1 4.02Å; T299-Y311 VanDerWaalsContact OG1-CD1 3.22Å; T299-Y311 WeakPolarHBondContact OG1-CD1 3.37Å; T299-Y311 WeakPolarHBondContact OG1-CE1 3.41Å
300	P	66.8	Low	72.6	Confident	22 Å²	22	55.1 Å²	55.1	14%	0.143	28%	0.277	C	S	.	.			trans	-58.4	131.7	175.2	-23.7	33.7	0	0	0	110.6	L298 E302 D303 L306 T618	L298-P300 WeakPolarHBondContact O-CD 3.31Å; P300-E302 PolarHBondContact O-N 3.17Å; P300-D303 PolarHBondContact O-N 3.11Å; P300-L306 WeakPolarHBondContact O-CD1 3.42Å; P300-T618 WeakPolarHBondContact CB-O 3.48Å
301	R	66.7	Low	71.6	Confident	48 Å²	48	53.4 Å²	53.4	18%	0.181	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17	-178.6	-65.2	-61.9	-175.2	-154.8	-7.3	113.6	D297 T299 D303 L306 F593 S622 Q623	D297-R301 IonicContact OD2-CZ 2.86Å; D297-R301 IonicContact OD2-NH1 2.77Å; D297-R301 PolarHBondContact OD2-NH1 3.48Å; D297-R301 VanDerWaalsContact OD2-NH1 3.11Å; D297-R301 IonicContact OD2-NH2 3.7Å; D297-R301 PolarHBondContact OD2-NH2 2.89Å; T299-R301 PolarHBondContact O-N 2.82Å; R301-D303 VanDerWaalsContact C-N 3.34Å; R301-L306 WeakPolarHBondContact O-CD1 3.09Å; R301-F593 HydrophobicContact CB-CD1 4.1Å; R301-F593 HydrophobicContact CB-CE1 3.7Å; R301-F593 HydrophobicContact CB-CE2 4.41Å; R301-F593 HydrophobicContact CB-CZ 3.87Å; R301-F593 HydrophobicContact CG-CD1 4.3Å; R301-F593 HydrophobicContact CG-CE1 3.97Å; R301-S622 PolarHBondContact NE-O 3.45Å; R301-S622 PolarHBondContact NH2-O 2.96Å; R301-Q623 PolarHBondContact NH2-O 3.12Å
302	E	59.8	Low	70.9	Confident	110 Å²	110	51.8 Å²	51.8	51%	0.514	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.9	-178.5	-62.9	172.3	178.2	0	0	113.4	P300 E304 F593 G619	P300-E302 PolarHBondContact O-N 3.17Å; E302-E304 PolarHBondContact O-N 2.95Å; E302-F593 HydrophobicContact CG-CD2 3.83Å; E302-F593 HydrophobicContact CG-CE2 4.11Å; E302-F593 WeakPolarHBondContact OE1-CD2 3.42Å; E302-G619 WeakPolarHBondContact OE2-CA 3.46Å
303	D	63.1	Low	70.6	Confident	42 Å²	42	51.3 Å²	51.3	23%	0.225	26%	0.264	C	S	.	.			trans	-80.4	111.8	-177.5	-168.8	-15.5	0	0	0	111.8	P300 R301 N305 L306 K309	P300-D303 PolarHBondContact O-N 3.11Å; R301-D303 VanDerWaalsContact C-N 3.34Å; D303-N305 PolarHBondContact O-N 3.44Å; D303-N305 VanDerWaalsContact O-N 3.13Å; D303-N305 PolarHBondContact OD1-N 3.04Å; D303-L306 HydrophobicContact CB-CD1 4.16Å; D303-L306 HydrophobicContact CB-CG 4.4Å; D303-L306 WeakPolarHBondContact O-CB 3.45Å; D303-L306 WeakPolarHBondContact O-CD1 3.39Å; D303-L306 PolarHBondContact O-N 2.96Å; D303-K309 IonicContact OD2-NZ 3.04Å; D303-K309 PolarHBondContact OD2-NZ 3.17Å
304	E	57.8	Low	70.4	Confident	191 Å²	191	51.5 Å²	51.5	89%	0.893	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.9	178.6	-63.4	-170.2	166.1	0	0	113.3	E302 L306	E302-E304 PolarHBondContact O-N 2.95Å; E304-L306 VanDerWaalsContact C-N 3.27Å; E304-L306 PolarHBondContact O-N 3.38Å
305	N	58.1	Low	70.4	Confident	97 Å²	97	51.5 Å²	51.5	52%	0.519	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	18.3	175.4	-71.3	-41.4	0	0	0	113.1	D303 A307 L308	D303-N305 PolarHBondContact O-N 3.44Å; D303-N305 VanDerWaalsContact O-N 3.13Å; D303-N305 PolarHBondContact OD1-N 3.04Å; N305-A307 PolarHBondContact O-N 3.44Å; N305-L308 PolarHBondContact O-N 2.95Å
306	L	59.1	Low	70.5	Confident	33 Å²	33	51.5 Å²	51.5	17%	0.173	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-47.5	-34.8	175.5	-115.1	135.5	0	0	0	111.5	P300 R301 D303 E304 L308 Y311 R352	P300-L306 WeakPolarHBondContact O-CD1 3.42Å; R301-L306 WeakPolarHBondContact O-CD1 3.09Å; D303-L306 HydrophobicContact CB-CD1 4.16Å; D303-L306 HydrophobicContact CB-CG 4.4Å; D303-L306 WeakPolarHBondContact O-CB 3.45Å; D303-L306 WeakPolarHBondContact O-CD1 3.39Å; D303-L306 PolarHBondContact O-N 2.96Å; E304-L306 VanDerWaalsContact C-N 3.27Å; E304-L306 PolarHBondContact O-N 3.38Å; L306-L308 VanDerWaalsContact C-N 3.26Å; L306-L308 PolarHBondContact O-N 3.31Å; L306-Y311 HydrophobicContact CD2-CE1 4.35Å; L306-R352 PolarHBondContact O-NE 2.98Å; L306-R352 PolarHBondContact O-NH1 2.69Å; L306-R352 PolarHBondContact O-NH2 3.47Å
307	A	55.1	Low	70.7	Confident	68 Å²	68	51.8 Å²	51.8	56%	0.562	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66	-18.4	-178.3	0	0	0	0	0	115.4	N305 R352	N305-A307 PolarHBondContact O-N 3.44Å; A307-R352 WeakPolarHBondContact O-CD 3.46Å; A307-R352 PolarHBondContact O-NH1 3.23Å
308	L	54.6	Low	71.2	Confident	149 Å²	149	52 Å²	52	78%	0.78	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-111.1	-12.7	-168.8	-67.3	166.9	0	0	0	115.1	N305 L306	N305-L308 PolarHBondContact O-N 2.95Å; L306-L308 VanDerWaalsContact C-N 3.26Å; L306-L308 PolarHBondContact O-N 3.31Å
309	K	62.8	Low	72	Confident	99 Å²	99	60 Å²	60	43%	0.43	30%	0.298	S	S	.	.	S	Bend	trans	-94.6	146.7	-177.6	-71.3	179.7	178.6	169.9	0	112.9	D303 R352	D303-K309 IonicContact OD2-NZ 3.04Å; D303-K309 PolarHBondContact OD2-NZ 3.17Å; K309-R352 PolarHBondContact O-NH1 3.11Å; K309-R352 PolarHBondContact O-NH2 3.18Å
310	E	62.8	Low	73	Confident	144 Å²	144	62.1 Å²	62.1	67%	0.673	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-69.9	151.5	167.9	-65	-178	162.5	0	0	110.8	T312 A328	E310-T312 PolarHBondContact O-N 2.75Å; E310-A328 HydrophobicContact CB-CB 4.09Å
311	Y	67.7	Low	74	Confident	6 Å²	6	61.6 Å²	61.6	2%	0.024	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.5	176.4	-75.1	-39.3	0	0	0	110.9	D297 T299 L306 A328 L329 S331 L332 V333	D297-Y311 HydrophobicContact CB-CD1 4.27Å; D297-Y311 HydrophobicContact CB-CD2 4.16Å; D297-Y311 HydrophobicContact CB-CG 4.08Å; D297-Y311 WeakPolarHBondContact OD1-CD1 3.16Å; D297-Y311 WeakPolarHBondContact OD1-CE1 3.17Å; T299-Y311 HydrophobicContact CG2-CD1 3.5Å; T299-Y311 HydrophobicContact CG2-CE1 4.02Å; T299-Y311 VanDerWaalsContact OG1-CD1 3.22Å; T299-Y311 WeakPolarHBondContact OG1-CD1 3.37Å; T299-Y311 WeakPolarHBondContact OG1-CE1 3.41Å; L306-Y311 HydrophobicContact CD2-CE1 4.35Å; Y311-A328 WeakPolarHBondContact O-CA 3.47Å; Y311-A328 WeakPolarHBondContact O-CB 3.42Å; Y311-L329 PolarHBondContact N-O 3.11Å; Y311-L329 PolarHBondContact O-N 2.89Å; Y311-S331 WeakPolarHBondContact CE2-OG 3.27Å; Y311-S331 PolarHBondContact OH-OG 3.37Å; Y311-L332 VanDerWaalsContact CD2-N 3.3Å; Y311-L332 VanDerWaalsContact CE2-C 3.43Å; Y311-L332 VanDerWaalsContact CE2-O 3.25Å; Y311-L332 WeakPolarHBondContact CE2-O 3.46Å; Y311-V333 WeakPolarHBondContact OH-CG2 3.49Å
312	T	78.4	Confident	75.1	Confident	49 Å²	49	66 Å²	66	30%	0.301	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	132.9	173.7	64.5	0	0	0	0	109.1	D297 L298 E310 D314	D297-T312 PolarHBondContact N-O 3.09Å; L298-T312 PolarHBondContact N-O 2.79Å; L298-T312 VanDerWaalsContact N-O 3.16Å; E310-T312 PolarHBondContact O-N 2.75Å; T312-D314 WeakPolarHBondContact CB-OD2 3.44Å; T312-D314 PolarHBondContact OG1-OD2 3.19Å
313	V	86.6	Confident	76.6	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.8	170.4	-177	0	0	0	0	105.5	V294 C295 V296 L326 L329 W370	V294-V313 HydrophobicContact CG1-CG1 3.83Å; C295-V313 WeakPolarHBondContact O-CA 3.34Å; V296-V313 HydrophobicContact CG1-CG2 4.35Å; V296-V313 HydrophobicContact CG2-CG1 4.23Å; V313-L326 HydrophobicContact CB-CB 4.28Å; V313-L326 HydrophobicContact CG1-CB 4.13Å; V313-L326 HydrophobicContact CG1-CD1 4.16Å; V313-L326 PolarHBondContact O-N 3.36Å; V313-L329 HydrophobicContact CG2-CB 4.35Å; V313-W370 HydrophobicContact CG1-CZ2 4.28Å; V313-W370 HydrophobicContact CG2-CZ2 4.02Å
314	D	89.7	Confident	77.9	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144	-176.7	-61.9	-107.6	0	0	0	109.3	C295 L298 T312 W323 K325 P615	C295-D314 PolarHBondContact N-O 2.98Å; C295-D314 PolarHBondContact O-N 2.85Å; C295-D314 VanDerWaalsContact O-N 3.09Å; L298-D314 HydrophobicContact CD1-CB 3.64Å; T312-D314 WeakPolarHBondContact CB-OD2 3.44Å; T312-D314 PolarHBondContact OG1-OD2 3.19Å; D314-W323 HydrophobicContact CB-CE3 3.87Å; D314-W323 HydrophobicContact CB-CZ3 4.14Å; D314-K325 WeakPolarHBondContact OD1-CG 3.45Å; D314-P615 HydrophobicContact CB-CG 3.97Å; D314-P615 WeakPolarHBondContact OD1-CG 3.38Å
315	C	92.3	Very high	79.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.3	171.4	73.7	0	0	0	0	111.5	K292 I293 V294 W323 E324 L326 F631	K292-C315 HydrophobicContact CB-CB 4.4Å; I293-C315 CarbonylContact O-C 3.59Å; I293-C315 WeakPolarHBondContact O-CA 3.33Å; V294-C315 HydrophobicContact CG2-CB 4.11Å; C315-W323 CarbonylContact O-C 3.54Å; C315-W323 WeakPolarHBondContact O-CA 3.23Å; C315-E324 PolarHBondContact N-O 3Å; C315-E324 PolarHBondContact O-N 3.3Å; C315-L326 HydrophobicContact CB-CD1 4Å; C315-L326 HydrophobicContact CB-CG 4.31Å; C315-F631 HydrophobicContact CB-CZ 4.34Å
316	F	91.9	Very high	81	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.8	174.9	180	-120.3	0	0	0	109.1	I293 P318 W323 Y583 V597 E612	I293-F316 HydrophobicContact CB-CB 4.48Å; I293-F316 HydrophobicContact CD1-CD1 4.43Å; I293-F316 PolarHBondContact N-O 2.83Å; I293-F316 PolarHBondContact O-N 2.81Å; F316-P318 HydrophobicContact CD1-CB 4.45Å; F316-P318 HydrophobicContact CD1-CG 3.99Å; F316-P318 HydrophobicContact CE1-CB 4.05Å; F316-P318 HydrophobicContact CE1-CG 4.09Å; F316-P318 VanDerWaalsContact O-CD 3.29Å; F316-P318 WeakPolarHBondContact O-CD 3.46Å; F316-W323 HydrophobicContact CB-CD2 3.92Å; F316-W323 HydrophobicContact CB-CE3 3.76Å; F316-W323 HydrophobicContact CB-CH2 3.81Å; F316-W323 HydrophobicContact CB-CZ2 3.95Å; F316-W323 HydrophobicContact CB-CZ3 3.72Å; F316-W323 AromaticContact CD2-CD1 3.9Å; F316-W323 AromaticContact CD2-CD2 3.81Å; F316-W323 HydrophobicContact CD2-CD2 3.81Å; F316-W323 AromaticContact CD2-CE2 3.44Å; F316-W323 VanDerWaalsContact CD2-CE2 3.44Å; F316-W323 HydrophobicContact CD2-CG 4.1Å; F316-W323 AromaticContact CD2-CZ2 3.89Å; F316-W323 HydrophobicContact CD2-CZ2 3.89Å; F316-W323 AromaticContact CD2-NE1 3.51Å; F316-W323 AromaticContact CE2-NE1 3.86Å; F316-W323 HydrophobicContact CG-CD2 4.28Å; F316-W323 AromaticContact CG-CE2 3.96Å; F316-W323 HydrophobicContact CG-CH2 4.33Å; F316-W323 AromaticContact CG-CZ2 3.99Å; F316-W323 HydrophobicContact CG-CZ2 3.99Å; F316-Y583 HydrophobicContact CE1-CD1 4.36Å; F316-Y583 HydrophobicContact CE1-CE1 4.18Å; F316-V597 HydrophobicContact CE1-CG1 4.43Å; F316-E612 HydrophobicContact CE2-CB 4.07Å; F316-E612 HydrophobicContact CE2-CG 4.43Å; F316-E612 HydrophobicContact CZ-CB 4.41Å
317	D	92	Very high	82.3	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.053	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	106.2	168.9	176.2	8.6	0	0	0	110	K292 R319 T320 G321 K322	K292-D317 HydrophobicContact CD-CB 4.4Å; K292-D317 HydrophobicContact CG-CB 4.29Å; D317-R319 PolarHBondContact O-N 3.03Å; D317-R319 VanDerWaalsContact O-N 3.12Å; D317-R319 VanDerWaalsContact OD1-CB 3.24Å; D317-R319 WeakPolarHBondContact OD1-CB 3.44Å; D317-R319 PolarHBondContact OD1-N 3.14Å; D317-R319 IonicContact OD2-NE 2.69Å; D317-R319 IonicContact OD2-NH2 3.31Å; D317-T320 WeakPolarHBondContact CB-OG1 3.36Å; D317-T320 VanDerWaalsContact CG-OG1 3.25Å; D317-T320 PolarHBondContact O-N 3.26Å; D317-T320 VanDerWaalsContact OD2-CG2 3.24Å; D317-T320 WeakPolarHBondContact OD2-CG2 3.4Å; D317-T320 PolarHBondContact OD2-OG1 2.86Å; D317-G321 WeakPolarHBondContact O-CA 3.31Å; D317-G321 PolarHBondContact O-N 3.02Å; D317-K322 PolarHBondContact N-O 3.05Å
318	P	89.6	Confident	83.8	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.039	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.3	-177.8	-17.4	33.1	0	0	0	114.4	I293 F316 W578 Y583	I293-P318 HydrophobicContact CD1-CG 3.87Å; I293-P318 HydrophobicContact CG1-CG 4.12Å; F316-P318 HydrophobicContact CD1-CB 4.45Å; F316-P318 HydrophobicContact CD1-CG 3.99Å; F316-P318 HydrophobicContact CE1-CB 4.05Å; F316-P318 HydrophobicContact CE1-CG 4.09Å; F316-P318 VanDerWaalsContact O-CD 3.29Å; F316-P318 WeakPolarHBondContact O-CD 3.46Å; P318-W578 HydrophobicContact CB-CD2 4.11Å; P318-W578 HydrophobicContact CB-CE3 4.25Å; P318-W578 HydrophobicContact CB-CG 4.47Å; P318-W578 HydrophobicContact CG-CB 4.33Å; P318-W578 HydrophobicContact CG-CD2 3.95Å; P318-W578 HydrophobicContact CG-CG 3.84Å; P318-Y583 HydrophobicContact CB-CE1 3.95Å; P318-Y583 HydrophobicContact CB-CE2 4.22Å; P318-Y583 WeakPolarHBondContact CB-OH 3.25Å; P318-Y583 HydrophobicContact CG-CE1 4.45Å; P318-Y583 HydrophobicContact CG-CE2 4.42Å
319	R	88.6	Confident	85	Confident	169 Å²	169	51.8 Å²	51.8	64%	0.638	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-42.8	175.2	-179.8	-175.2	60.8	96.5	1.1	111.2	D317 W578	D317-R319 PolarHBondContact O-N 3.03Å; D317-R319 VanDerWaalsContact O-N 3.12Å; D317-R319 VanDerWaalsContact OD1-CB 3.24Å; D317-R319 WeakPolarHBondContact OD1-CB 3.44Å; D317-R319 PolarHBondContact OD1-N 3.14Å; D317-R319 IonicContact OD2-NE 2.69Å; D317-R319 IonicContact OD2-NH2 3.31Å; R319-W578 HydrophobicContact CB-CZ2 4.5Å
320	T	89.1	Confident	85.4	Confident	57 Å²	57	51.6 Å²	51.6	35%	0.35	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-17.1	-176.4	57.9	0	0	0	0	113.1	D317 K322	D317-T320 WeakPolarHBondContact CB-OG1 3.36Å; D317-T320 VanDerWaalsContact CG-OG1 3.25Å; D317-T320 PolarHBondContact O-N 3.26Å; D317-T320 VanDerWaalsContact OD2-CG2 3.24Å; D317-T320 WeakPolarHBondContact OD2-CG2 3.4Å; D317-T320 PolarHBondContact OD2-OG1 2.86Å; T320-K322 PolarHBondContact O-N 2.91Å; T320-K322 PolarHBondContact OG1-N 3.18Å
321	G	87.8	Confident	85.3	Confident	11 Å²	11	45.6 Å²	45.6	11%	0.113	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	10.7	-172.5	0	0	0	0	0	113.1	D317 E612	D317-G321 WeakPolarHBondContact O-CA 3.31Å; D317-G321 PolarHBondContact O-N 3.02Å; G321-E612 WeakPolarHBondContact O-CG 3.27Å
322	K	90.2	Very high	85.4	Confident	139 Å²	139	45.6 Å²	45.6	60%	0.604	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	146.1	-176.8	-65.1	-173.3	177.6	-172.9	0	111.2	D317 T320	D317-K322 PolarHBondContact N-O 3.05Å; T320-K322 PolarHBondContact O-N 2.91Å; T320-K322 PolarHBondContact OG1-N 3.18Å
323	W	91.1	Very high	85.1	Confident	54 Å²	54	44.8 Å²	44.8	21%	0.205	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.3	169.6	-69.4	93.1	0	0	0	109.6	L298 D314 C315 F316 L585 V597 K613 L614 P615	L298-W323 HydrophobicContact CD1-CH2 4.48Å; L298-W323 HydrophobicContact CD1-CZ3 3.94Å; D314-W323 HydrophobicContact CB-CE3 3.87Å; D314-W323 HydrophobicContact CB-CZ3 4.14Å; C315-W323 CarbonylContact O-C 3.54Å; C315-W323 WeakPolarHBondContact O-CA 3.23Å; F316-W323 HydrophobicContact CB-CD2 3.92Å; F316-W323 HydrophobicContact CB-CE3 3.76Å; F316-W323 HydrophobicContact CB-CH2 3.81Å; F316-W323 HydrophobicContact CB-CZ2 3.95Å; F316-W323 HydrophobicContact CB-CZ3 3.72Å; F316-W323 AromaticContact CD2-CD1 3.9Å; F316-W323 AromaticContact CD2-CD2 3.81Å; F316-W323 HydrophobicContact CD2-CD2 3.81Å; F316-W323 AromaticContact CD2-CE2 3.44Å; F316-W323 VanDerWaalsContact CD2-CE2 3.44Å; F316-W323 HydrophobicContact CD2-CG 4.1Å; F316-W323 AromaticContact CD2-CZ2 3.89Å; F316-W323 HydrophobicContact CD2-CZ2 3.89Å; F316-W323 AromaticContact CD2-NE1 3.51Å; F316-W323 AromaticContact CE2-NE1 3.86Å; F316-W323 HydrophobicContact CG-CD2 4.28Å; F316-W323 AromaticContact CG-CE2 3.96Å; F316-W323 HydrophobicContact CG-CH2 4.33Å; F316-W323 AromaticContact CG-CZ2 3.99Å; F316-W323 HydrophobicContact CG-CZ2 3.99Å; W323-L585 HydrophobicContact CH2-CD2 3.87Å; W323-L585 HydrophobicContact CZ2-CD2 4.08Å; W323-V597 HydrophobicContact CZ2-CG2 4.34Å; W323-K613 PolarHBondContact NE1-O 3.09Å; W323-L614 HydrophobicContact CH2-CD2 4.45Å; W323-L614 HydrophobicContact CH2-CG 3.85Å; W323-L614 HydrophobicContact CZ2-CB 4.42Å; W323-L614 HydrophobicContact CZ2-CG 3.95Å; W323-P615 VanDerWaalsContact CD2-CD 3.49Å; W323-P615 HydrophobicContact CD2-CG 4.03Å; W323-P615 HydrophobicContact CE3-CG 3.84Å; W323-P615 HydrophobicContact CG-CG 4.34Å; W323-P615 HydrophobicContact CZ3-CG 4.29Å
324	E	90.9	Very high	84.7	Confident	71 Å²	71	45.3 Å²	45.3	33%	0.332	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.6	175.9	-60.2	174.5	162.3	0	0	108.5	K292 C315	K292-E324 IonicContact NZ-OE2 3.27Å; K292-E324 PolarHBondContact NZ-OE2 2.63Å; C315-E324 PolarHBondContact N-O 3Å; C315-E324 PolarHBondContact O-N 3.3Å
325	K	90.4	Very high	84.5	Confident	166 Å²	166	45.8 Å²	45.8	72%	0.722	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.1	174.8	-72.4	-176.5	177	-173.6	0	109.9	D314	D314-K325 WeakPolarHBondContact OD1-CG 3.45Å
326	L	90.2	Very high	84.4	Confident	26 Å²	26	45.9 Å²	45.9	14%	0.136	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	172.4	173.2	-55.8	-176.2	0	0	0	109.9	V294 V313 C315 A328 Y363 F631	V294-L326 HydrophobicContact CG1-CD1 4.13Å; V294-L326 HydrophobicContact CG2-CD1 4.4Å; V313-L326 HydrophobicContact CB-CB 4.28Å; V313-L326 HydrophobicContact CG1-CB 4.13Å; V313-L326 HydrophobicContact CG1-CD1 4.16Å; V313-L326 PolarHBondContact O-N 3.36Å; C315-L326 HydrophobicContact CB-CD1 4Å; C315-L326 HydrophobicContact CB-CG 4.31Å; L326-A328 PolarHBondContact O-N 2.79Å; L326-Y363 HydrophobicContact CB-CE2 4.4Å; L326-Y363 HydrophobicContact CD1-CE1 4.09Å; L326-F631 HydrophobicContact CD1-CE1 4.28Å; L326-F631 HydrophobicContact CD1-CZ 3.92Å; L326-F631 HydrophobicContact CD2-CE1 4.39Å
327	A	87.3	Confident	84.4	Confident	24 Å²	24	46.9 Å²	46.9	20%	0.198	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	130.8	173.7	0	0	0	0	0	112	Y363 D368 W370	A327-Y363 HydrophobicContact CB-CE2 4.2Å; A327-D368 WeakPolarHBondContact CB-O 3.35Å; A327-D368 WeakPolarHBondContact CB-OD1 3.3Å; A327-D368 PolarHBondContact N-OD1 3.35Å; A327-W370 PolarHBondContact O-NE1 3.34Å
328	A	85	Confident	84.5	Confident	42 Å²	42	47.1 Å²	47.1	35%	0.347	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	152.8	177.7	0	0	0	0	0	111.3	E310 Y311 L326 W370	E310-A328 HydrophobicContact CB-CB 4.09Å; Y311-A328 WeakPolarHBondContact O-CA 3.47Å; Y311-A328 WeakPolarHBondContact O-CB 3.42Å; L326-A328 PolarHBondContact O-N 2.79Å; A328-W370 PolarHBondContact O-NE1 3.37Å
329	L	81	Confident	84.6	Confident	10 Å²	10	48 Å²	48	5%	0.052	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.4	174.4	-175.7	63.5	0	0	0	109.7	Y311 V313 L332 V346 H361 W370	Y311-L329 PolarHBondContact N-O 3.11Å; Y311-L329 PolarHBondContact O-N 2.89Å; V313-L329 HydrophobicContact CG2-CB 4.35Å; L329-L332 HydrophobicContact CD2-CD1 4.44Å; L329-V346 HydrophobicContact CD2-CB 4.03Å; L329-V346 HydrophobicContact CD2-CG1 3.82Å; L329-V346 HydrophobicContact CD2-CG2 4.3Å; L329-H361 HydrophobicContact CD1-CB 3.95Å; L329-H361 HydrophobicContact CD2-CB 4.44Å; L329-W370 HydrophobicContact CB-CD2 4.32Å; L329-W370 HydrophobicContact CB-CZ2 4.23Å; L329-W370 HydrophobicContact CD1-CB 4.08Å; L329-W370 HydrophobicContact CD1-CD2 3.73Å; L329-W370 HydrophobicContact CD1-CE3 4.08Å; L329-W370 HydrophobicContact CD1-CG 3.72Å; L329-W370 HydrophobicContact CD2-CD2 4.38Å; L329-W370 HydrophobicContact CD2-CE3 4.32Å; L329-W370 HydrophobicContact CD2-CH2 4.18Å; L329-W370 HydrophobicContact CD2-CZ2 4.27Å; L329-W370 HydrophobicContact CD2-CZ3 4.2Å; L329-W370 HydrophobicContact CG-CD2 4.36Å
330	C	69.8	Low	84.7	Confident	95 Å²	95	41 Å²	41	64%	0.642	23%	0.229	S	C	*	.			trans	-59.8	153.5	174.8	-63.3	0	0	0	0	111.9	L332	C330-L332 PolarHBondContact O-N 2.84Å; C330-L332 VanDerWaalsContact O-N 3.11Å
331	S	61.1	Low	84.4	Confident	18 Å²	18	40.6 Å²	40.6	13%	0.126	24%	0.237	C	C	.	.			trans	-70.9	102.9	-157.5	178.2	0	0	0	0	116.1	Y311 L351 R352	Y311-S331 WeakPolarHBondContact CE2-OG 3.27Å; Y311-S331 PolarHBondContact OH-OG 3.37Å; S331-L351 WeakPolarHBondContact O-CD2 3.45Å; S331-R352 WeakPolarHBondContact OG-CD 3.47Å; S331-R352 WeakPolarHBondContact OG-CG 3.28Å; S331-R352 PolarHBondContact OG-NE 3.21Å; S331-R352 PolarHBondContact OG-NH2 3.14Å
332	L	69.3	Low	84.3	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.4	167.2	-56.8	162.9	0	0	0	114.5	Y311 L329 C330 P335 V346 G348 L351	Y311-L332 VanDerWaalsContact CD2-N 3.3Å; Y311-L332 VanDerWaalsContact CE2-C 3.43Å; Y311-L332 VanDerWaalsContact CE2-O 3.25Å; Y311-L332 WeakPolarHBondContact CE2-O 3.46Å; L329-L332 HydrophobicContact CD2-CD1 4.44Å; C330-L332 PolarHBondContact O-N 2.84Å; C330-L332 VanDerWaalsContact O-N 3.11Å; L332-P335 HydrophobicContact CB-CB 4.11Å; L332-P335 HydrophobicContact CB-CG 4.38Å; L332-V346 HydrophobicContact CD1-CG1 4.31Å; L332-G348 WeakPolarHBondContact CD1-O 3.43Å; L332-G348 WeakPolarHBondContact CD2-O 3.35Å; L332-L351 HydrophobicContact CD2-CD2 3.69Å; L332-L351 HydrophobicContact CD2-CG 4.18Å
333	V	73.8	Confident	84.3	Confident	31 Å²	31	40.6 Å²	40.6	19%	0.188	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	138.4	171.2	178.2	0	0	0	0	110.2	Y311 P335 G349 I350	Y311-V333 WeakPolarHBondContact OH-CG2 3.49Å; V333-P335 VanDerWaalsContact C-CD 3.41Å; V333-G349 CarbonylContact O-C 3.59Å; V333-G349 VanDerWaalsContact O-CA 3.31Å; V333-G349 WeakPolarHBondContact O-CA 3.37Å; V333-I350 HydrophobicContact CB-CB 4.29Å; V333-I350 PolarHBondContact N-O 3.26Å; V333-I350 PolarHBondContact O-N 3.01Å
334	S	77.4	Confident	84.4	Confident	13 Å²	13	38 Å²	38	9%	0.091	23%	0.225	C	C	.	.	S	Bend	trans	49.8	46.7	-177.9	-65.6	0	0	0	0	114.7	M382 Q623	S334-M382 PolarHBondContact O-N 2.88Å; S334-Q623 PolarHBondContact OG-OE1 3.47Å
335	P	86.4	Confident	84.5	Confident	13 Å²	13	34.6 Å²	34.6	8%	0.084	21%	0.21	C	C	.	.			trans	-73.4	157.3	175.1	34.6	-35.7	0	0	0	110.8	L332 V333 V346	L332-P335 HydrophobicContact CB-CB 4.11Å; L332-P335 HydrophobicContact CB-CG 4.38Å; V333-P335 VanDerWaalsContact C-CD 3.41Å; P335-V346 HydrophobicContact CB-CG1 3.74Å; P335-V346 HydrophobicContact CG-CG1 4.13Å
336	G	88.9	Confident	84.6	Confident	3 Å²	3	26.7 Å²	26.7	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.3	164.4	0	0	0	0	0	109.1	V346 A347 L385	G336-V346 VanDerWaalsContact O-CA 3.31Å; G336-V346 WeakPolarHBondContact O-CA 3.39Å; G336-A347 PolarHBondContact N-O 3.41Å; G336-A347 PolarHBondContact O-N 2.83Å; G336-L385 WeakPolarHBondContact O-CD2 3.4Å
337	C	91.7	Very high	84.8	Confident	21 Å²	21	25.5 Å²	25.5	14%	0.142	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	125.8	-179.3	177.3	0	0	0	0	109.8	F345	C337-F345 WeakPolarHBondContact CA-O 3.39Å
338	T	93.9	Very high	85	Confident	15 Å²	15	24.3 Å²	24.3	9%	0.092	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.5	179	-151.7	0	0	0	0	111.8	V340 F345 L385 L392	T338-V340 HydrophobicContact CG2-CG2 4.2Å; T338-F345 PolarHBondContact N-O 2.93Å; T338-F345 PolarHBondContact O-N 3.32Å; T338-L385 VanDerWaalsContact CB-O 3.26Å; T338-L385 WeakPolarHBondContact CB-O 3.43Å; T338-L385 HydrophobicContact CG2-CD2 3.9Å; T338-L385 HydrophobicContact CG2-CG 3.76Å; T338-L385 PolarHBondContact OG1-O 2.84Å; T338-L392 HydrophobicContact CG2-CD1 3.3Å
339	A	92.8	Very high	85.1	Confident	24 Å²	24	22.3 Å²	22.3	20%	0.198	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.1	176.1	0	0	0	0	0	109.4	R343 T627 T628 L629	A339-R343 CarbonylContact C-O 3.51Å; A339-R343 WeakPolarHBondContact CA-O 3.32Å; A339-T627 HydrophobicContact CB-CG2 3.95Å; A339-T627 PolarHBondContact N-OG1 3.29Å; A339-T628 WeakPolarHBondContact CB-O 3.23Å; A339-L629 HydrophobicContact CB-CD1 4.04Å
340	V	89.7	Confident	85.2	Confident	21 Å²	21	23.5 Å²	23.5	13%	0.127	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	101.5	175.4	-165.9	0	0	0	0	108.5	T338 D342 R343 F345 L392 L412	T338-V340 HydrophobicContact CG2-CG2 4.2Å; V340-D342 PolarHBondContact O-N 3.46Å; V340-R343 PolarHBondContact N-O 3.34Å; V340-R343 PolarHBondContact O-N 3.13Å; V340-F345 HydrophobicContact CG2-CD2 4.29Å; V340-F345 HydrophobicContact CG2-CE2 4.5Å; V340-L392 HydrophobicContact CG2-CD1 4.2Å; V340-L412 HydrophobicContact CB-CD1 4.03Å; V340-L412 HydrophobicContact CG1-CD1 3.62Å; V340-L412 HydrophobicContact CG2-CD1 4.23Å
341	G	84.5	Confident	85.6	Confident	49 Å²	49	21.9 Å²	21.9	51%	0.505	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	-114.7	-172.4	0	0	0	0	0	111.8
342	D	85.1	Confident	86	Confident	78 Å²	78	25 Å²	25	42%	0.417	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3.3	176	62.9	-23.5	0	0	0	113.2	F289 V340 L629 K630	F289-D342 HydrophobicContact CE1-CB 3.94Å; F289-D342 HydrophobicContact CZ-CB 4.41Å; V340-D342 PolarHBondContact O-N 3.46Å; D342-L629 WeakPolarHBondContact O-CD1 3.46Å; D342-K630 HydrophobicContact CB-CB 4.25Å
343	R	89.4	Confident	86	Confident	72 Å²	72	29.6 Å²	29.6	27%	0.272	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.5	176.9	-62.7	-177.8	-69.9	-179.3	-6	110.8	A339 V340 F345 E362 L412	A339-R343 CarbonylContact C-O 3.51Å; A339-R343 WeakPolarHBondContact CA-O 3.32Å; V340-R343 PolarHBondContact N-O 3.34Å; V340-R343 PolarHBondContact O-N 3.13Å; R343-F345 HydrophobicContact CB-CD2 4.34Å; R343-F345 HydrophobicContact CB-CE2 3.58Å; R343-F345 HydrophobicContact CB-CZ 4.09Å; R343-E362 HydrophobicContact CB-CG 4.48Å; R343-E362 VanDerWaalsContact CD-OE1 3.31Å; R343-E362 WeakPolarHBondContact CD-OE1 3.43Å; R343-L412 PolarHBondContact NH1-O 3.13Å
344	L	93	Very high	86	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.6	174.2	165.2	71.2	0	0	0	109.1	V294 E362 Y363 W370 T627 L629	V294-L344 HydrophobicContact CB-CD2 4.43Å; V294-L344 HydrophobicContact CG1-CD2 3.82Å; L344-E362 CarbonylContact O-C 3.6Å; L344-E362 VanDerWaalsContact O-CA 3.3Å; L344-E362 WeakPolarHBondContact O-CA 3.23Å; L344-Y363 HydrophobicContact CD2-CD1 4.25Å; L344-Y363 HydrophobicContact CD2-CG 4.29Å; L344-Y363 PolarHBondContact O-N 2.79Å; L344-W370 HydrophobicContact CD2-CH2 3.88Å; L344-W370 HydrophobicContact CG-CH2 4.3Å; L344-T627 HydrophobicContact CD1-CG2 3.44Å; L344-T627 VanDerWaalsContact CD1-CG2 3.44Å; L344-L629 HydrophobicContact CB-CD1 3.87Å; L344-L629 HydrophobicContact CB-CD2 3.79Å; L344-L629 HydrophobicContact CB-CG 4.41Å; L344-L629 HydrophobicContact CD2-CD2 4.27Å
345	F	93.9	Very high	86.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.1	177.7	-66.9	-86.9	0	0	0	110.8	C337 T338 V340 R343 V360 H361 E362 R373 L385 L392 L412	C337-F345 WeakPolarHBondContact CA-O 3.39Å; T338-F345 PolarHBondContact N-O 2.93Å; T338-F345 PolarHBondContact O-N 3.32Å; V340-F345 HydrophobicContact CG2-CD2 4.29Å; V340-F345 HydrophobicContact CG2-CE2 4.5Å; R343-F345 HydrophobicContact CB-CD2 4.34Å; R343-F345 HydrophobicContact CB-CE2 3.58Å; R343-F345 HydrophobicContact CB-CZ 4.09Å; F345-V360 HydrophobicContact CD1-CG1 4.47Å; F345-H361 CarbonylContact C-O 3.48Å; F345-H361 WeakPolarHBondContact CA-O 3.23Å; F345-E362 HydrophobicContact CD1-CB 3.98Å; F345-E362 HydrophobicContact CD1-CG 4.23Å; F345-E362 HydrophobicContact CE1-CB 3.73Å; F345-E362 HydrophobicContact CE1-CG 3.75Å; F345-E362 WeakPolarHBondContact CE1-OE2 3.37Å; F345-E362 HydrophobicContact CZ-CB 4.43Å; F345-E362 HydrophobicContact CZ-CG 3.95Å; F345-E362 WeakPolarHBondContact CZ-OE2 3.49Å; F345-R373 HydrophobicContact CE1-CG 4.47Å; F345-L385 HydrophobicContact CB-CD2 4.35Å; F345-L392 HydrophobicContact CB-CD1 4.5Å; F345-L392 HydrophobicContact CB-CD2 3.95Å; F345-L392 HydrophobicContact CD1-CD2 4.03Å; F345-L392 HydrophobicContact CD2-CD2 4.36Å; F345-L392 HydrophobicContact CG-CD2 3.85Å; F345-L412 HydrophobicContact CE1-CD2 4.27Å; F345-L412 HydrophobicContact CE2-CD2 3.86Å; F345-L412 HydrophobicContact CZ-CD2 3.62Å
346	V	93.6	Very high	86.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.1	171.4	179.9	0	0	0	0	107.5	V296 L329 L332 P335 G336 V360 H361 W370	V296-V346 HydrophobicContact CG1-CG1 4.43Å; V296-V346 HydrophobicContact CG1-CG2 4.06Å; V296-V346 HydrophobicContact CG2-CG2 4.06Å; L329-V346 HydrophobicContact CD2-CB 4.03Å; L329-V346 HydrophobicContact CD2-CG1 3.82Å; L329-V346 HydrophobicContact CD2-CG2 4.3Å; L332-V346 HydrophobicContact CD1-CG1 4.31Å; P335-V346 HydrophobicContact CB-CG1 3.74Å; P335-V346 HydrophobicContact CG-CG1 4.13Å; G336-V346 VanDerWaalsContact O-CA 3.31Å; G336-V346 WeakPolarHBondContact O-CA 3.39Å; V346-V360 CarbonylContact O-C 3.59Å; V346-V360 WeakPolarHBondContact O-CA 3.48Å; V346-H361 PolarHBondContact N-O 2.7Å; V346-H361 PolarHBondContact O-N 2.97Å; V346-W370 HydrophobicContact CB-CH2 4.39Å; V346-W370 HydrophobicContact CB-CZ3 4.14Å; V346-W370 HydrophobicContact CG2-CH2 3.5Å; V346-W370 VanDerWaalsContact CG2-CH2 3.5Å; V346-W370 HydrophobicContact CG2-CZ3 3.66Å
347	A	93.4	Very high	86.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.4	-176.1	0	0	0	0	0	111.9	G336 A359 V360 M376 L385	G336-A347 PolarHBondContact N-O 3.41Å; G336-A347 PolarHBondContact O-N 2.83Å; A347-A359 WeakPolarHBondContact CA-O 3.45Å; A347-V360 HydrophobicContact CB-CG1 4.35Å; A347-V360 HydrophobicContact CB-CG2 4.12Å; A347-M376 HydrophobicContact CB-CE 4.31Å; A347-M376 HydrophobicContact CB-SD 4.43Å; A347-L385 HydrophobicContact CB-CD1 4.01Å; A347-L385 HydrophobicContact CB-CD2 3.93Å
348	G	90.9	Very high	86.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.198	C	C	.	.			trans	62.4	-151.2	176	0	0	0	0	0	113.6	L332 S357 A359 R380	L332-G348 WeakPolarHBondContact CD1-O 3.43Å; L332-G348 WeakPolarHBondContact CD2-O 3.35Å; G348-S357 WeakPolarHBondContact CA-O 3.44Å; G348-A359 PolarHBondContact N-O 3.09Å; G348-R380 CarbonylContact C-O 3.54Å; G348-R380 VanDerWaalsContact CA-O 3.24Å; G348-R380 WeakPolarHBondContact CA-O 3.48Å
349	G	87.3	Confident	86.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.202	C	C	.	.			trans	102.7	179.4	-173.9	0	0	0	0	0	112.6	V333 S357 R380	V333-G349 CarbonylContact O-C 3.59Å; V333-G349 VanDerWaalsContact O-CA 3.31Å; V333-G349 WeakPolarHBondContact O-CA 3.37Å; G349-S357 PolarHBondContact O-N 3.05Å; G349-R380 PolarHBondContact N-O 3Å
350	I	82.4	Confident	86.5	Confident	34 Å²	34	31.5 Å²	31.5	17%	0.174	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116.8	-177.2	-53.5	175.2	0	0	0	108	V333 A381	V333-I350 HydrophobicContact CB-CB 4.29Å; V333-I350 PolarHBondContact N-O 3.26Å; V333-I350 PolarHBondContact O-N 3.01Å; I350-A381 HydrophobicContact CD1-CB 4.1Å; I350-A381 HydrophobicContact CG1-CB 3.49Å; I350-A381 VanDerWaalsContact CG1-CB 3.49Å
351	L	79.1	Confident	86.6	Confident	62 Å²	62	31.8 Å²	31.8	33%	0.325	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	156.2	170.7	-65.7	163.9	0	0	0	109.6	S331 L332 T353 G354 S355	S331-L351 WeakPolarHBondContact O-CD2 3.45Å; L332-L351 HydrophobicContact CD2-CD2 3.69Å; L332-L351 HydrophobicContact CD2-CG 4.18Å; L351-T353 PolarHBondContact O-N 3.1Å; L351-T353 VanDerWaalsContact O-N 3.09Å; L351-G354 WeakPolarHBondContact O-CA 3.45Å; L351-G354 PolarHBondContact O-N 3.15Å; L351-S355 WeakPolarHBondContact CB-O 3.44Å; L351-S355 PolarHBondContact N-O 3.11Å
352	R	68.4	Low	87.1	Confident	82 Å²	82	30.2 Å²	30.2	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.8	174.4	-75.8	167.6	175.5	164.3	22.8	114.8	L306 A307 K309 S331 G354	L306-R352 PolarHBondContact O-NE 2.98Å; L306-R352 PolarHBondContact O-NH1 2.69Å; L306-R352 PolarHBondContact O-NH2 3.47Å; A307-R352 WeakPolarHBondContact O-CD 3.46Å; A307-R352 PolarHBondContact O-NH1 3.23Å; K309-R352 PolarHBondContact O-NH1 3.11Å; K309-R352 PolarHBondContact O-NH2 3.18Å; S331-R352 WeakPolarHBondContact OG-CD 3.47Å; S331-R352 WeakPolarHBondContact OG-CG 3.28Å; S331-R352 PolarHBondContact OG-NE 3.21Å; S331-R352 PolarHBondContact OG-NH2 3.14Å; R352-G354 PolarHBondContact O-N 2.87Å; R352-G354 VanDerWaalsContact O-N 3.08Å
353	T	70.3	Confident	87.5	Confident	103 Å²	103	26.8 Å²	26.8	63%	0.632	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	0.2	171.2	62.3	0	0	0	0	113	L351 S355	L351-T353 PolarHBondContact O-N 3.1Å; L351-T353 VanDerWaalsContact O-N 3.09Å; T353-S355 PolarHBondContact O-N 3.43Å; T353-S355 WeakPolarHBondContact OG1-CB 3.26Å; T353-S355 PolarHBondContact OG1-N 3.2Å; T353-S355 PolarHBondContact OG1-OG 2.89Å; T353-S355 VanDerWaalsContact OG1-OG 3.07Å
354	G	74.2	Confident	87.4	Confident	39 Å²	39	24.2 Å²	24.2	40%	0.402	15%	0.145	S	C	.	.	S	Bend	trans	71.1	8.5	-170.4	0	0	0	0	0	112.9	L351 R352 R400	L351-G354 WeakPolarHBondContact O-CA 3.45Å; L351-G354 PolarHBondContact O-N 3.15Å; R352-G354 PolarHBondContact O-N 2.87Å; R352-G354 VanDerWaalsContact O-N 3.08Å; G354-R400 PolarHBondContact O-NE 2.84Å; G354-R400 PolarHBondContact O-NH2 3.11Å
355	S	83.1	Confident	87.2	Confident	38 Å²	38	24.8 Å²	24.8	27%	0.266	15%	0.15	S	C	.	.	P	Polyproline II helix	trans	-84.5	135.9	179.3	-57.3	0	0	0	0	110.2	L351 T353 R400	L351-S355 WeakPolarHBondContact CB-O 3.44Å; L351-S355 PolarHBondContact N-O 3.11Å; T353-S355 PolarHBondContact O-N 3.43Å; T353-S355 WeakPolarHBondContact OG1-CB 3.26Å; T353-S355 PolarHBondContact OG1-N 3.2Å; T353-S355 PolarHBondContact OG1-OG 2.89Å; T353-S355 VanDerWaalsContact OG1-OG 3.07Å; S355-R400 VanDerWaalsContact CA-NH2 3.29Å; S355-R400 PolarHBondContact OG-NH2 2.96Å
356	V	87.8	Confident	86.9	Confident	26 Å²	26	25.6 Å²	25.6	16%	0.158	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-79.9	129.2	174.1	-175.4	0	0	0	0	107.9	P379 A381 R400	V356-P379 HydrophobicContact CB-CB 4.24Å; V356-P379 HydrophobicContact CG1-CB 4.02Å; V356-P379 VanDerWaalsContact O-CB 3.3Å; V356-P379 WeakPolarHBondContact O-CB 3.26Å; V356-A381 HydrophobicContact CG1-CB 3.96Å; V356-R400 HydrophobicContact CG2-CG 4.19Å
357	S	90.7	Very high	86.6	Confident	14 Å²	14	27.8 Å²	27.8	10%	0.098	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-89.1	149.4	-177	-171.1	0	0	0	0	111.9	G348 G349 A359 P379 R380	G348-S357 WeakPolarHBondContact CA-O 3.44Å; G349-S357 PolarHBondContact O-N 3.05Å; S357-A359 VanDerWaalsContact OG-CB 3.31Å; S357-A359 WeakPolarHBondContact OG-CB 3.28Å; S357-A359 PolarHBondContact OG-N 3.09Å; S357-P379 WeakPolarHBondContact O-CA 3.48Å; S357-R380 PolarHBondContact O-N 3.02Å; S357-R380 VanDerWaalsContact O-N 3.09Å
358	A	93.1	Very high	86.4	Confident	23 Å²	23	30.7 Å²	30.7	19%	0.19	18%	0.182	C	C	.	.			trans	-105.8	-1.4	165.8	0	0	0	0	0	112.4	A375 M376 P379	A358-A375 HydrophobicContact CB-CB 4.41Å; A358-A375 WeakPolarHBondContact O-CA 3.49Å; A358-A375 WeakPolarHBondContact O-CB 3.12Å; A358-M376 HydrophobicContact CB-CB 4.32Å; A358-M376 WeakPolarHBondContact CB-O 3.44Å; A358-M376 PolarHBondContact O-N 3.15Å; A358-P379 HydrophobicContact CB-CB 4.08Å
359	A	92.3	Very high	86.4	Confident	20 Å²	20	36 Å²	36	17%	0.165	20%	0.202	C	C	.	.			trans	-65.3	148.7	-174.8	0	0	0	0	0	111.8	A347 G348 S357	A347-A359 WeakPolarHBondContact CA-O 3.45Å; G348-A359 PolarHBondContact N-O 3.09Å; S357-A359 VanDerWaalsContact OG-CB 3.31Å; S357-A359 WeakPolarHBondContact OG-CB 3.28Å; S357-A359 PolarHBondContact OG-N 3.09Å
360	V	93.8	Very high	86.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	127.6	-179.8	-175	0	0	0	0	107.4	F345 V346 A347 R373 M376 W417	F345-V360 HydrophobicContact CD1-CG1 4.47Å; V346-V360 CarbonylContact O-C 3.59Å; V346-V360 WeakPolarHBondContact O-CA 3.48Å; A347-V360 HydrophobicContact CB-CG1 4.35Å; A347-V360 HydrophobicContact CB-CG2 4.12Å; V360-R373 HydrophobicContact CB-CB 4.18Å; V360-R373 HydrophobicContact CG1-CB 4.06Å; V360-R373 PolarHBondContact O-N 2.94Å; V360-M376 HydrophobicContact CG2-CG 4.06Å; V360-W417 HydrophobicContact CG2-CZ2 3.77Å
361	H	93.2	Very high	87.1	Confident	28 Å²	28	38.3 Å²	38.3	13%	0.13	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.5	-179.2	-57.2	-81.6	0	0	0	109.7	L329 F345 V346 W370 I371	L329-H361 HydrophobicContact CD1-CB 3.95Å; L329-H361 HydrophobicContact CD2-CB 4.44Å; F345-H361 CarbonylContact C-O 3.48Å; F345-H361 WeakPolarHBondContact CA-O 3.23Å; V346-H361 PolarHBondContact N-O 2.7Å; V346-H361 PolarHBondContact O-N 2.97Å; H361-W370 HydrophobicContact CB-CE3 3.65Å; H361-W370 HydrophobicContact CB-CZ3 4.12Å; H361-I371 WeakPolarHBondContact CA-O 3.43Å
362	E	94.2	Very high	87.7	Confident	16 Å²	16	42.1 Å²	42.1	8%	0.075	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.1	170.3	-175.9	-178.1	145.3	0	0	109.5	R343 L344 F345 W370 I371 R373	R343-E362 HydrophobicContact CB-CG 4.48Å; R343-E362 VanDerWaalsContact CD-OE1 3.31Å; R343-E362 WeakPolarHBondContact CD-OE1 3.43Å; L344-E362 CarbonylContact O-C 3.6Å; L344-E362 VanDerWaalsContact O-CA 3.3Å; L344-E362 WeakPolarHBondContact O-CA 3.23Å; F345-E362 HydrophobicContact CD1-CB 3.98Å; F345-E362 HydrophobicContact CD1-CG 4.23Å; F345-E362 HydrophobicContact CE1-CB 3.73Å; F345-E362 HydrophobicContact CE1-CG 3.75Å; F345-E362 WeakPolarHBondContact CE1-OE2 3.37Å; F345-E362 HydrophobicContact CZ-CB 4.43Å; F345-E362 HydrophobicContact CZ-CG 3.95Å; F345-E362 WeakPolarHBondContact CZ-OE2 3.49Å; E362-W370 CarbonylContact O-C 3.59Å; E362-W370 WeakPolarHBondContact O-CA 3.28Å; E362-I371 PolarHBondContact N-O 2.83Å; E362-I371 PolarHBondContact O-N 2.78Å; E362-R373 HydrophobicContact CB-CG 3.82Å; E362-R373 IonicContact OE1-NH2 2.73Å; E362-R373 PolarHBondContact OE1-NH2 3.28Å; E362-R373 IonicContact OE2-CZ 3.2Å; E362-R373 IonicContact OE2-NE 3.88Å; E362-R373 PolarHBondContact OE2-NE 3.19Å; E362-R373 IonicContact OE2-NH2 3.68Å; E362-R373 PolarHBondContact OE2-NH2 3.29Å
363	Y	92.6	Very high	88.9	Confident	5 Å²	5	41 Å²	41	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.5	176.2	178.7	-106.8	0	0	0	111.3	L326 A327 L344 A365 D368 W370 L629 F631	L326-Y363 HydrophobicContact CB-CE2 4.4Å; L326-Y363 HydrophobicContact CD1-CE1 4.09Å; A327-Y363 HydrophobicContact CB-CE2 4.2Å; L344-Y363 HydrophobicContact CD2-CD1 4.25Å; L344-Y363 HydrophobicContact CD2-CG 4.29Å; L344-Y363 PolarHBondContact O-N 2.79Å; Y363-A365 HydrophobicContact CD1-CB 4.25Å; Y363-A365 HydrophobicContact CE1-CB 3.9Å; Y363-A365 PolarHBondContact O-N 3.07Å; Y363-D368 WeakPolarHBondContact CE2-OD1 3.42Å; Y363-D368 PolarHBondContact OH-OD1 3.22Å; Y363-W370 HydrophobicContact CD2-CD2 4.01Å; Y363-W370 AromaticContact CD2-CE2 3.73Å; Y363-W370 HydrophobicContact CD2-CG 4.4Å; Y363-W370 HydrophobicContact CD2-CZ2 4.02Å; Y363-W370 AromaticContact CD2-NE1 3.91Å; Y363-W370 HydrophobicContact CG-CH2 4.45Å; Y363-W370 HydrophobicContact CG-CZ2 4.32Å; Y363-L629 HydrophobicContact CD1-CD2 4.04Å; Y363-L629 HydrophobicContact CE1-CD2 4.4Å; Y363-F631 HydrophobicContact CE1-CE1 4.09Å
364	D	88.9	Confident	90.1	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.102	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	96.1	172.6	-176.5	-12.8	0	0	0	109.5	V366 L367 D368 R369 I371 K644	D364-V366 PolarHBondContact O-N 2.72Å; D364-V366 VanDerWaalsContact O-N 3.13Å; D364-V366 WeakPolarHBondContact OD1-CB 3.27Å; D364-V366 PolarHBondContact OD1-N 2.7Å; D364-L367 PolarHBondContact O-N 3.31Å; D364-L367 PolarHBondContact OD1-N 3.07Å; D364-D368 WeakPolarHBondContact O-CA 3.47Å; D364-D368 PolarHBondContact O-N 3.41Å; D364-R369 HydrophobicContact CB-CG 4.21Å; D364-R369 PolarHBondContact N-O 3.18Å; D364-R369 PolarHBondContact O-N 3.34Å; D364-I371 HydrophobicContact CB-CD1 3.9Å; D364-I371 HydrophobicContact CB-CG1 4.44Å; D364-K644 IonicContact OD1-NZ 2.72Å; D364-K644 PolarHBondContact OD1-NZ 3.07Å; D364-K644 IonicContact OD2-NZ 3.73Å; D364-K644 PolarHBondContact OD2-NZ 3.46Å
365	A	88.6	Confident	91	Very high	12 Å²	12	39.8 Å²	39.8	10%	0.099	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.5	179.6	0	0	0	0	0	114	Y363 F631	Y363-A365 HydrophobicContact CD1-CB 4.25Å; Y363-A365 HydrophobicContact CE1-CB 3.9Å; Y363-A365 PolarHBondContact O-N 3.07Å; A365-F631 HydrophobicContact CB-CD1 4.01Å; A365-F631 HydrophobicContact CB-CE1 4.16Å
366	V	86.9	Confident	91.6	Very high	17 Å²	17	38.3 Å²	38.3	10%	0.103	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-49.8	177.1	179.3	0	0	0	0	110.4	D364 L637 L640 R641 K644	D364-V366 PolarHBondContact O-N 2.72Å; D364-V366 VanDerWaalsContact O-N 3.13Å; D364-V366 WeakPolarHBondContact OD1-CB 3.27Å; D364-V366 PolarHBondContact OD1-N 2.7Å; V366-L637 HydrophobicContact CB-CD1 4.35Å; V366-L637 HydrophobicContact CG1-CD1 4.31Å; V366-L640 HydrophobicContact CG1-CB 3.65Å; V366-L640 HydrophobicContact CG2-CB 4.15Å; V366-L640 HydrophobicContact CG2-CD1 3.92Å; V366-R641 HydrophobicContact CG1-CG 3.87Å; V366-R641 WeakPolarHBondContact O-CG 3.12Å; V366-R641 PolarHBondContact O-NE 3.31Å; V366-R641 PolarHBondContact O-NH2 3.1Å; V366-K644 HydrophobicContact CB-CD 4.4Å; V366-K644 HydrophobicContact CG1-CD 3.96Å
367	L	87.2	Confident	91.8	Very high	46 Å²	46	40.5 Å²	40.5	24%	0.241	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-3.8	-176.6	-65	-179	0	0	0	113.6	D364 R369 K644	D364-L367 PolarHBondContact O-N 3.31Å; D364-L367 PolarHBondContact OD1-N 3.07Å; L367-R369 HydrophobicContact CB-CG 3.95Å; L367-K644 HydrophobicContact CD1-CD 3.9Å; L367-K644 HydrophobicContact CD2-CB 4.4Å; L367-K644 HydrophobicContact CD2-CD 4.03Å; L367-K644 HydrophobicContact CG-CD 3.79Å
368	D	90	Very high	91.8	Very high	61 Å²	61	42.7 Å²	42.7	33%	0.326	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	60.3	-175.5	-171.2	24.5	0	0	0	111.4	A327 Y363 D364	A327-D368 WeakPolarHBondContact CB-O 3.35Å; A327-D368 WeakPolarHBondContact CB-OD1 3.3Å; A327-D368 PolarHBondContact N-OD1 3.35Å; Y363-D368 WeakPolarHBondContact CE2-OD1 3.42Å; Y363-D368 PolarHBondContact OH-OD1 3.22Å; D364-D368 WeakPolarHBondContact O-CA 3.47Å; D364-D368 PolarHBondContact O-N 3.41Å
369	R	90.7	Very high	91.8	Very high	111 Å²	111	43.9 Å²	43.9	42%	0.419	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154.7	179.6	68.1	-177.3	-176.3	159.7	5.7	111.7	D364 L367	D364-R369 HydrophobicContact CB-CG 4.21Å; D364-R369 PolarHBondContact N-O 3.18Å; D364-R369 PolarHBondContact O-N 3.34Å; L367-R369 HydrophobicContact CB-CG 3.95Å
370	W	91.4	Very high	91.8	Very high	40 Å²	40	43 Å²	43	15%	0.152	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.6	171.6	-66.1	94.1	0	0	0	111	V313 A327 A328 L329 L344 V346 H361 E362 Y363	V313-W370 HydrophobicContact CG1-CZ2 4.28Å; V313-W370 HydrophobicContact CG2-CZ2 4.02Å; A327-W370 PolarHBondContact O-NE1 3.34Å; A328-W370 PolarHBondContact O-NE1 3.37Å; L329-W370 HydrophobicContact CB-CD2 4.32Å; L329-W370 HydrophobicContact CB-CZ2 4.23Å; L329-W370 HydrophobicContact CD1-CB 4.08Å; L329-W370 HydrophobicContact CD1-CD2 3.73Å; L329-W370 HydrophobicContact CD1-CE3 4.08Å; L329-W370 HydrophobicContact CD1-CG 3.72Å; L329-W370 HydrophobicContact CD2-CD2 4.38Å; L329-W370 HydrophobicContact CD2-CE3 4.32Å; L329-W370 HydrophobicContact CD2-CH2 4.18Å; L329-W370 HydrophobicContact CD2-CZ2 4.27Å; L329-W370 HydrophobicContact CD2-CZ3 4.2Å; L329-W370 HydrophobicContact CG-CD2 4.36Å; L344-W370 HydrophobicContact CD2-CH2 3.88Å; L344-W370 HydrophobicContact CG-CH2 4.3Å; V346-W370 HydrophobicContact CB-CH2 4.39Å; V346-W370 HydrophobicContact CB-CZ3 4.14Å; V346-W370 HydrophobicContact CG2-CH2 3.5Å; V346-W370 VanDerWaalsContact CG2-CH2 3.5Å; V346-W370 HydrophobicContact CG2-CZ3 3.66Å; H361-W370 HydrophobicContact CB-CE3 3.65Å; H361-W370 HydrophobicContact CB-CZ3 4.12Å; E362-W370 CarbonylContact O-C 3.59Å; E362-W370 WeakPolarHBondContact O-CA 3.28Å; Y363-W370 HydrophobicContact CD2-CD2 4.01Å; Y363-W370 AromaticContact CD2-CE2 3.73Å; Y363-W370 HydrophobicContact CD2-CG 4.4Å; Y363-W370 HydrophobicContact CD2-CZ2 4.02Å; Y363-W370 AromaticContact CD2-NE1 3.91Å; Y363-W370 HydrophobicContact CG-CH2 4.45Å; Y363-W370 HydrophobicContact CG-CZ2 4.32Å
371	I	91.9	Very high	91.7	Very high	43 Å²	43	43 Å²	43	22%	0.221	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.2	176.5	-58	175.2	0	0	0	106.6	H361 E362 D364	H361-I371 WeakPolarHBondContact CA-O 3.43Å; E362-I371 PolarHBondContact N-O 2.83Å; E362-I371 PolarHBondContact O-N 2.78Å; D364-I371 HydrophobicContact CB-CD1 3.9Å; D364-I371 HydrophobicContact CB-CG1 4.44Å
372	E	92.1	Very high	91.4	Very high	142 Å²	142	43.3 Å²	43.3	66%	0.664	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	134.4	173.1	-167.4	171.6	-175.2	0	0	110.1
373	R	94.4	Very high	91.4	Very high	58 Å²	58	43.3 Å²	43.3	22%	0.219	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	163.2	178.2	-66	-55.3	-168.6	-173.7	1.7	109.6	F345 V360 E362 A375	F345-R373 HydrophobicContact CE1-CG 4.47Å; V360-R373 HydrophobicContact CB-CB 4.18Å; V360-R373 HydrophobicContact CG1-CB 4.06Å; V360-R373 PolarHBondContact O-N 2.94Å; E362-R373 HydrophobicContact CB-CG 3.82Å; E362-R373 IonicContact OE1-NH2 2.73Å; E362-R373 PolarHBondContact OE1-NH2 3.28Å; E362-R373 IonicContact OE2-CZ 3.2Å; E362-R373 IonicContact OE2-NE 3.88Å; E362-R373 PolarHBondContact OE2-NE 3.19Å; E362-R373 IonicContact OE2-NH2 3.68Å; E362-R373 PolarHBondContact OE2-NH2 3.29Å; R373-A375 PolarHBondContact O-N 2.93Å
374	P	94.1	Very high	91.4	Very high	63 Å²	63	43.1 Å²	43.1	41%	0.409	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-48.9	129.2	176.7	-31.7	40.6	0	0	0	111.2	L415 W417	P374-L415 WeakPolarHBondContact CG-O 3.22Å; P374-W417 PolarHBondContact O-NE1 3.39Å
375	A	94.5	Very high	91.7	Very high	53 Å²	53	42.5 Å²	42.5	44%	0.438	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-69.6	154.5	-179	0	0	0	0	0	111	A358 R373 W417	A358-A375 HydrophobicContact CB-CB 4.41Å; A358-A375 WeakPolarHBondContact O-CA 3.49Å; A358-A375 WeakPolarHBondContact O-CB 3.12Å; R373-A375 PolarHBondContact O-N 2.93Å; A375-W417 PolarHBondContact O-NE1 3.33Å
376	M	94.9	Very high	92.1	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.039	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-63.5	151.5	169.8	-64.2	174	-64.5	0	0	110.1	A347 A358 V360 Q378 R380 L383 A394 W417	A347-M376 HydrophobicContact CB-CE 4.31Å; A347-M376 HydrophobicContact CB-SD 4.43Å; A358-M376 HydrophobicContact CB-CB 4.32Å; A358-M376 WeakPolarHBondContact CB-O 3.44Å; A358-M376 PolarHBondContact O-N 3.15Å; V360-M376 HydrophobicContact CG2-CG 4.06Å; M376-Q378 VanDerWaalsContact C-N 3.3Å; M376-R380 HydrophobicContact CE-CB 4.31Å; M376-L383 HydrophobicContact SD-CD1 4.28Å; M376-A394 HydrophobicContact SD-CB 3.65Å; M376-W417 HydrophobicContact CG-CD2 4.4Å; M376-W417 HydrophobicContact CG-CH2 3.7Å; M376-W417 HydrophobicContact CG-CZ2 3.46Å; M376-W417 VanDerWaalsContact CG-CZ2 3.46Å; M376-W417 HydrophobicContact CG-CZ3 4.27Å; M376-W417 HydrophobicContact SD-CH2 4.25Å; M376-W417 HydrophobicContact SD-CZ2 4.43Å
377	G	92.6	Very high	92.4	Very high	72 Å²	72	42.4 Å²	42.4	74%	0.742	24%	0.237	S	C	*	.	S	Bend	trans	-67.2	-31.8	172.5	0	0	0	0	0	112.5	E408	G377-E408 WeakPolarHBondContact CA-OE2 3.49Å; G377-E408 PolarHBondContact N-OE2 3.19Å
378	Q	91.4	Very high	92.6	Very high	60 Å²	60	41 Å²	41	28%	0.28	23%	0.231	S	C	.	.	S	Bend	trans	-118.7	131.1	175.4	-165.9	171.3	35.6	0	0	111.9	M376 R380 N399 L404 S406 E408	M376-Q378 VanDerWaalsContact C-N 3.3Å; Q378-R380 WeakPolarHBondContact O-CG 2.98Å; Q378-N399 PolarHBondContact NE2-ND2 3.11Å; Q378-L404 HydrophobicContact CG-CD1 4.41Å; Q378-S406 PolarHBondContact OE1-OG 2.87Å; Q378-E408 PolarHBondContact N-OE1 2.88Å
379	P	92.8	Very high	92.5	Very high	47 Å²	47	41.4 Å²	41.4	31%	0.305	25%	0.25	S	C	.	.			trans	-68.6	138.5	174.2	27.2	-33.8	0	0	0	111.4	V356 S357 A358 N399	V356-P379 HydrophobicContact CB-CB 4.24Å; V356-P379 HydrophobicContact CG1-CB 4.02Å; V356-P379 VanDerWaalsContact O-CB 3.3Å; V356-P379 WeakPolarHBondContact O-CB 3.26Å; S357-P379 WeakPolarHBondContact O-CA 3.48Å; A358-P379 HydrophobicContact CB-CB 4.08Å; P379-N399 WeakPolarHBondContact O-CB 3.47Å
380	R	92.6	Very high	92.4	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.008	26%	0.259	C	S	.	.			trans	-141.1	138.7	-171.6	-65.3	166.7	-170.8	-83.2	-1.9	111.4	G348 G349 S357 M376 Q378 L383 G396 L404 S406 E408	G348-R380 CarbonylContact C-O 3.54Å; G348-R380 VanDerWaalsContact CA-O 3.24Å; G348-R380 WeakPolarHBondContact CA-O 3.48Å; G349-R380 PolarHBondContact N-O 3Å; S357-R380 PolarHBondContact O-N 3.02Å; S357-R380 VanDerWaalsContact O-N 3.09Å; M376-R380 HydrophobicContact CE-CB 4.31Å; Q378-R380 WeakPolarHBondContact O-CG 2.98Å; R380-L383 HydrophobicContact CB-CB 4.23Å; R380-L383 HydrophobicContact CB-CD1 3.9Å; R380-G396 PolarHBondContact NH1-O 3.09Å; R380-G396 VanDerWaalsContact NH1-O 3.09Å; R380-L404 HydrophobicContact CG-CD1 3.75Å; R380-S406 PolarHBondContact NH1-O 2.84Å; R380-S406 PolarHBondContact NH1-OG 2.86Å; R380-S406 PolarHBondContact NH2-OG 2.86Å; R380-E408 IonicContact CZ-OE1 2.93Å; R380-E408 IonicContact NE-OE1 3.07Å; R380-E408 PolarHBondContact NE-OE1 3.41Å; R380-E408 IonicContact NH2-OE1 2.73Å; R380-E408 PolarHBondContact NH2-OE1 3.37Å
381	A	89.8	Confident	92.4	Very high	0 Å²	0	42 Å²	42	0%	0	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-127.4	158.7	166.7	0	0	0	0	0	110.7	I350 V356 L383 G397 C398	I350-A381 HydrophobicContact CD1-CB 4.1Å; I350-A381 HydrophobicContact CG1-CB 3.49Å; I350-A381 VanDerWaalsContact CG1-CB 3.49Å; V356-A381 HydrophobicContact CG1-CB 3.96Å; A381-L383 PolarHBondContact O-N 3.05Å; A381-L383 VanDerWaalsContact O-N 3.09Å; A381-G397 CarbonylContact O-C 3.56Å; A381-G397 VanDerWaalsContact O-CA 3.28Å; A381-G397 WeakPolarHBondContact O-CA 3.47Å; A381-C398 PolarHBondContact N-O 3.01Å; A381-C398 PolarHBondContact O-N 2.96Å
382	M	88.4	Confident	92.6	Very high	34 Å²	34	40 Å²	40	17%	0.167	25%	0.252	C	S	.	.	S	Bend	trans	51.6	32	-177.6	-57.5	-179.8	178.4	0	0	113.3	S334 R428 A429	S334-M382 PolarHBondContact O-N 2.88Å; M382-R428 HydrophobicContact CB-CB 4.43Å; M382-A429 HydrophobicContact CB-CB 4.37Å; M382-A429 PolarHBondContact O-N 3.09Å; M382-A429 HydrophobicContact SD-CB 4.29Å
383	L	93.3	Very high	92.8	Very high	16 Å²	16	34.3 Å²	34.3	8%	0.084	23%	0.225	C	C	.	.			trans	-81	159.8	179.4	76.1	174.7	0	0	0	111.7	M376 R380 A381 A394	M376-L383 HydrophobicContact SD-CD1 4.28Å; R380-L383 HydrophobicContact CB-CB 4.23Å; R380-L383 HydrophobicContact CB-CD1 3.9Å; A381-L383 PolarHBondContact O-N 3.05Å; A381-L383 VanDerWaalsContact O-N 3.09Å; L383-A394 HydrophobicContact CD1-CB 4.04Å
384	G	93.7	Very high	92.9	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.3	164.7	0	0	0	0	0	110.2	L395	G384-L395 PolarHBondContact N-O 2.84Å; G384-L395 WeakPolarHBondContact O-CB 3.45Å; G384-L395 PolarHBondContact O-N 2.93Å
385	L	95.5	Very high	93	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.1	173.4	-169.9	70.2	0	0	0	109.5	G336 T338 F345 A347 L392 Y393 A394	G336-L385 WeakPolarHBondContact O-CD2 3.4Å; T338-L385 VanDerWaalsContact CB-O 3.26Å; T338-L385 WeakPolarHBondContact CB-O 3.43Å; T338-L385 HydrophobicContact CG2-CD2 3.9Å; T338-L385 HydrophobicContact CG2-CG 3.76Å; T338-L385 PolarHBondContact OG1-O 2.84Å; F345-L385 HydrophobicContact CB-CD2 4.35Å; A347-L385 HydrophobicContact CB-CD1 4.01Å; A347-L385 HydrophobicContact CB-CD2 3.93Å; L385-L392 HydrophobicContact CD1-CD1 3.83Å; L385-L392 HydrophobicContact CD1-CD2 4.14Å; L385-L392 HydrophobicContact CD1-CG 3.89Å; L385-L392 HydrophobicContact CD2-CD1 4.41Å; L385-L392 HydrophobicContact CG-CD1 3.9Å; L385-L392 HydrophobicContact CG-CG 4.5Å; L385-Y393 WeakPolarHBondContact CA-O 3.31Å; L385-A394 HydrophobicContact CD1-CB 4.39Å
386	L	95.8	Very high	93	Very high	10 Å²	10	26 Å²	26	5%	0.052	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.1	-175.3	-68.1	179.8	0	0	0	112	Y393 L395 C432 L439	L386-Y393 PolarHBondContact N-O 2.87Å; L386-Y393 PolarHBondContact O-N 3.47Å; L386-L395 HydrophobicContact CD1-CD1 4.12Å; L386-C432 HydrophobicContact CD1-CB 3.98Å; L386-C432 HydrophobicContact CD2-CB 4.2Å; L386-C432 HydrophobicContact CG-CB 4.23Å; L386-L439 HydrophobicContact CB-CD2 4.13Å; L386-L439 HydrophobicContact CD1-CB 3.95Å; L386-L439 HydrophobicContact CD1-CD2 4.05Å; L386-L439 HydrophobicContact CD1-CG 4.46Å
387	G	93.8	Very high	92.8	Very high	17 Å²	17	25.7 Å²	25.7	18%	0.175	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.8	167.2	0	0	0	0	0	111.9	A434	G387-A434 WeakPolarHBondContact O-CB 3.31Å
388	C	91.8	Very high	92.6	Very high	17 Å²	17	22.3 Å²	22.3	12%	0.115	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	123.1	171.7	-159.5	0	0	0	0	110.7	E390 S391 Y393 G437 L439 T463	C388-E390 PolarHBondContact O-N 3.23Å; C388-S391 PolarHBondContact N-O 3.32Å; C388-S391 PolarHBondContact O-N 3.02Å; C388-Y393 HydrophobicContact CB-CD2 4.36Å; C388-Y393 HydrophobicContact CB-CE2 4.01Å; C388-G437 VanDerWaalsContact SG-CA 3.56Å; C388-L439 HydrophobicContact CB-CD2 3.59Å; C388-T463 HydrophobicContact CB-CG2 4.28Å
389	G	86.8	Confident	92.4	Very high	69 Å²	69	20.3 Å²	20.3	71%	0.711	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	-129.9	-171.8	0	0	0	0	0	111.3
390	E	88.3	Confident	91.9	Very high	134 Å²	134	25.9 Å²	25.9	63%	0.626	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	13.2	177.5	-58.7	-167.8	161.4	0	0	112.9	C388 L412 T413	C388-E390 PolarHBondContact O-N 3.23Å; E390-L412 WeakPolarHBondContact O-CB 3.34Å; E390-L412 WeakPolarHBondContact O-CG 3.48Å; E390-L412 PolarHBondContact O-N 2.81Å; E390-T413 PolarHBondContact OE2-OG1 3.37Å
391	S	93	Very high	91.4	Very high	31 Å²	31	31.2 Å²	31.2	22%	0.217	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.3	-176.9	-49.6	0	0	0	0	112.2	C388 L410	C388-S391 PolarHBondContact N-O 3.32Å; C388-S391 PolarHBondContact O-N 3.02Å; S391-L410 CarbonylContact C-O 3.56Å; S391-L410 WeakPolarHBondContact CA-O 3.31Å
392	L	95.8	Very high	91.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.8	172.1	175.6	73.9	0	0	0	109	T338 V340 F345 L385 A409 L410 L412	T338-L392 HydrophobicContact CG2-CD1 3.3Å; V340-L392 HydrophobicContact CG2-CD1 4.2Å; F345-L392 HydrophobicContact CB-CD1 4.5Å; F345-L392 HydrophobicContact CB-CD2 3.95Å; F345-L392 HydrophobicContact CD1-CD2 4.03Å; F345-L392 HydrophobicContact CD2-CD2 4.36Å; F345-L392 HydrophobicContact CG-CD2 3.85Å; L385-L392 HydrophobicContact CD1-CD1 3.83Å; L385-L392 HydrophobicContact CD1-CD2 4.14Å; L385-L392 HydrophobicContact CD1-CG 3.89Å; L385-L392 HydrophobicContact CD2-CD1 4.41Å; L385-L392 HydrophobicContact CG-CD1 3.9Å; L385-L392 HydrophobicContact CG-CG 4.5Å; L392-A409 CarbonylContact O-C 3.6Å; L392-A409 WeakPolarHBondContact O-CA 3.46Å; L392-L410 HydrophobicContact CB-CB 4.19Å; L392-L410 HydrophobicContact CD2-CD2 4.03Å; L392-L410 PolarHBondContact N-O 3.45Å; L392-L410 PolarHBondContact O-N 2.89Å; L392-L412 HydrophobicContact CB-CD2 3.94Å; L392-L412 HydrophobicContact CB-CG 4.29Å
393	Y	96.1	Very high	91.2	Very high	23 Å²	23	33.2 Å²	33.2	9%	0.09	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.2	-175.6	-64	-94.8	0	0	0	110.8	L385 L386 C388 A409 P421 L439 Y461	L385-Y393 WeakPolarHBondContact CA-O 3.31Å; L386-Y393 PolarHBondContact N-O 2.87Å; L386-Y393 PolarHBondContact O-N 3.47Å; C388-Y393 HydrophobicContact CB-CD2 4.36Å; C388-Y393 HydrophobicContact CB-CE2 4.01Å; Y393-A409 HydrophobicContact CD1-CB 3.91Å; Y393-A409 HydrophobicContact CE1-CB 3.93Å; Y393-P421 HydrophobicContact CD1-CG 4.25Å; Y393-P421 HydrophobicContact CE1-CG 4.39Å; Y393-L439 HydrophobicContact CD1-CD1 4.05Å; Y393-L439 HydrophobicContact CD2-CD1 3.89Å; Y393-L439 HydrophobicContact CE1-CD1 4.49Å; Y393-L439 HydrophobicContact CE2-CD1 4.37Å; Y393-L439 HydrophobicContact CG-CD1 3.71Å; Y393-Y461 HydrophobicContact CE1-CE1 4.24Å
394	A	96.6	Very high	91.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	100.3	169.7	0	0	0	0	0	109.1	M376 L383 L385 S407 E408 W417	M376-A394 HydrophobicContact SD-CB 3.65Å; L383-A394 HydrophobicContact CD1-CB 4.04Å; L385-A394 HydrophobicContact CD1-CB 4.39Å; A394-S407 WeakPolarHBondContact O-CA 3.26Å; A394-S407 VanDerWaalsContact O-CB 3.24Å; A394-S407 WeakPolarHBondContact O-CB 3.25Å; A394-E408 PolarHBondContact N-O 2.84Å; A394-E408 PolarHBondContact O-N 2.92Å; A394-E408 VanDerWaalsContact O-N 3.08Å; A394-W417 HydrophobicContact CB-CH2 3.94Å; A394-W417 HydrophobicContact CB-CZ3 4.01Å
395	L	96.1	Very high	91	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.8	-169.1	-56.5	174.6	0	0	0	111.7	G384 L386 P421 L423 F430 L439 L441	G384-L395 PolarHBondContact N-O 2.84Å; G384-L395 WeakPolarHBondContact O-CB 3.45Å; G384-L395 PolarHBondContact O-N 2.93Å; L386-L395 HydrophobicContact CD1-CD1 4.12Å; L395-P421 HydrophobicContact CD2-CG 4.2Å; L395-L423 HydrophobicContact CB-CD1 4.31Å; L395-L423 HydrophobicContact CD2-CD1 4.43Å; L395-F430 HydrophobicContact CB-CZ 4.21Å; L395-F430 WeakPolarHBondContact O-CZ 3.06Å; L395-L439 HydrophobicContact CD1-CB 4.49Å; L395-L439 HydrophobicContact CD1-CD1 3.95Å; L395-L439 HydrophobicContact CD2-CD1 4.47Å; L395-L441 HydrophobicContact CD1-CD1 3.98Å; L395-L441 HydrophobicContact CD1-CD2 4.39Å; L395-L441 HydrophobicContact CD1-CG 4.48Å
396	G	94.2	Very high	91	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.212	C	C	.	.			trans	56.4	-135.8	171.3	0	0	0	0	0	113.4	R380 L404 S406	R380-G396 PolarHBondContact NH1-O 3.09Å; R380-G396 VanDerWaalsContact NH1-O 3.09Å; G396-L404 WeakPolarHBondContact CA-O 3.33Å; G396-S406 PolarHBondContact N-O 3.35Å
397	G	90.8	Very high	91	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.212	C	C	.	.			trans	93	-156	-176.4	0	0	0	0	0	112.3	A381 L404 L427	A381-G397 CarbonylContact O-C 3.56Å; A381-G397 VanDerWaalsContact O-CA 3.28Å; A381-G397 WeakPolarHBondContact O-CA 3.47Å; G397-L404 PolarHBondContact O-N 2.84Å; G397-L427 PolarHBondContact N-O 2.82Å
398	C	88.3	Confident	91.1	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-138.9	154.8	173.8	58.4	0	0	0	0	111.7	A381 A402	A381-C398 PolarHBondContact N-O 3.01Å; A381-C398 PolarHBondContact O-N 2.96Å; C398-A402 WeakPolarHBondContact CA-O 3.46Å
399	N	88.1	Confident	91.3	Very high	19 Å²	19	35.5 Å²	35.5	10%	0.102	21%	0.209	C	C	.	.			trans	-117.9	-168.4	166.2	67.9	19.5	0	0	0	109.5	Q378 P379 S401 A402 L404	Q378-N399 PolarHBondContact NE2-ND2 3.11Å; P379-N399 WeakPolarHBondContact O-CB 3.47Å; N399-S401 PolarHBondContact O-N 2.92Å; N399-S401 WeakPolarHBondContact OD1-CA 3.36Å; N399-S401 PolarHBondContact OD1-N 2.82Å; N399-A402 PolarHBondContact N-O 3.37Å; N399-A402 PolarHBondContact OD1-N 2.8Å; N399-A402 PolarHBondContact OD1-O 3.02Å; N399-L404 HydrophobicContact CB-CD1 4.35Å
400	R	81.6	Confident	91.7	Very high	163 Å²	163	32.2 Å²	32.2	62%	0.615	18%	0.176	S	C	*	.	S	Bend	trans	-65.2	-24	178.5	-74	-172.5	167.2	-164	-2	113.9	G354 S355 V356	G354-R400 PolarHBondContact O-NE 2.84Å; G354-R400 PolarHBondContact O-NH2 3.11Å; S355-R400 VanDerWaalsContact CA-NH2 3.29Å; S355-R400 PolarHBondContact OG-NH2 2.96Å; V356-R400 HydrophobicContact CG2-CG 4.19Å
401	S	81.4	Confident	92	Very high	114 Å²	114	28.3 Å²	28.3	80%	0.797	16%	0.159	S	C	*	.	S	Bend	trans	-101.8	-34.6	-170.9	-56.5	0	0	0	0	113.5	N399	N399-S401 PolarHBondContact O-N 2.92Å; N399-S401 WeakPolarHBondContact OD1-CA 3.36Å; N399-S401 PolarHBondContact OD1-N 2.82Å
402	A	85.1	Confident	92	Very high	47 Å²	47	27.2 Å²	27.2	39%	0.388	15%	0.151	S	C	.	.			trans	-158.7	163.3	-170.6	0	0	0	0	0	113.6	C398 N399	C398-A402 WeakPolarHBondContact CA-O 3.46Å; N399-A402 PolarHBondContact N-O 3.37Å; N399-A402 PolarHBondContact OD1-N 2.8Å; N399-A402 PolarHBondContact OD1-O 3.02Å
403	L	88.5	Confident	91.8	Very high	29 Å²	29	32.1 Å²	32.1	15%	0.152	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-72.5	143.2	157	-83.2	72.4	0	0	0	108.9	P426 R428 T445 L447	L403-P426 HydrophobicContact CB-CB 3.86Å; L403-R428 HydrophobicContact CD2-CG 4.01Å; L403-R428 HydrophobicContact CG-CG 4.26Å; L403-T445 WeakPolarHBondContact CD2-O 3.5Å; L403-L447 HydrophobicContact CB-CD1 4.35Å; L403-L447 HydrophobicContact CD1-CD1 4.06Å; L403-L447 HydrophobicContact CD1-CG 4.26Å; L403-L447 HydrophobicContact CD2-CG 4.16Å
404	L	91.2	Very high	91.6	Very high	9 Å²	9	33.8 Å²	33.8	5%	0.047	20%	0.196	C	C	.	.			trans	-106.2	132.5	-172.4	-60	175.9	0	0	0	110.8	Q378 R380 G396 G397 N399 P426 L427	Q378-L404 HydrophobicContact CG-CD1 4.41Å; R380-L404 HydrophobicContact CG-CD1 3.75Å; G396-L404 WeakPolarHBondContact CA-O 3.33Å; G397-L404 PolarHBondContact O-N 2.84Å; N399-L404 HydrophobicContact CB-CD1 4.35Å; L404-P426 WeakPolarHBondContact O-CA 3.42Å; L404-L427 PolarHBondContact O-N 2.71Å
405	D	93.2	Very high	91.4	Very high	39 Å²	39	35.8 Å²	35.8	21%	0.209	21%	0.206	C	C	.	.			trans	-100.9	-10.2	161.9	57.4	6.7	0	0	0	111.9	R422 L423 P426	D405-R422 IonicContact OD1-CZ 2.6Å; D405-R422 VanDerWaalsContact OD1-CZ 3.29Å; D405-R422 IonicContact OD1-NH1 3.15Å; D405-R422 PolarHBondContact OD1-NH1 2.95Å; D405-R422 IonicContact OD1-NH2 2.81Å; D405-R422 PolarHBondContact OD1-NH2 2.93Å; D405-R422 IonicContact OD2-CZ 2.73Å; D405-R422 IonicContact OD2-NH1 3.68Å; D405-R422 PolarHBondContact OD2-NH1 3.18Å; D405-R422 IonicContact OD2-NH2 2.81Å; D405-L423 HydrophobicContact CB-CB 4.4Å; D405-L423 PolarHBondContact O-N 2.89Å; D405-P426 HydrophobicContact CB-CB 4.32Å; D405-P426 HydrophobicContact CB-CG 4.04Å
406	S	94.8	Very high	91.4	Very high	21 Å²	21	42.3 Å²	42.3	15%	0.147	24%	0.237	C	C	.	.			trans	-66.9	152.9	174.9	67.1	0	0	0	0	110.5	Q378 R380 G396	Q378-S406 PolarHBondContact OE1-OG 2.87Å; R380-S406 PolarHBondContact NH1-O 2.84Å; R380-S406 PolarHBondContact NH1-OG 2.86Å; R380-S406 PolarHBondContact NH2-OG 2.86Å; G396-S406 PolarHBondContact N-O 3.35Å
407	S	95.5	Very high	91.4	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.063	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	161.9	167.1	74.6	0	0	0	0	110.9	A394 G420 P421	A394-S407 WeakPolarHBondContact O-CA 3.26Å; A394-S407 VanDerWaalsContact O-CB 3.24Å; A394-S407 WeakPolarHBondContact O-CB 3.25Å; S407-G420 WeakPolarHBondContact O-CA 3.37Å; S407-G420 PolarHBondContact O-N 3.38Å; S407-G420 VanDerWaalsContact OG-CA 3.3Å; S407-G420 WeakPolarHBondContact OG-CA 3.49Å; S407-G420 PolarHBondContact OG-O 3.04Å; S407-P421 WeakPolarHBondContact CB-O 3.3Å; S407-P421 VanDerWaalsContact OG-CD 3.28Å; S407-P421 WeakPolarHBondContact OG-CD 3.39Å; S407-P421 PolarHBondContact OG-O 3.41Å
408	E	96.3	Very high	91.6	Very high	22 Å²	22	46 Å²	46	10%	0.103	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.9	179.9	-66	169	-108.1	0	0	108.5	G377 Q378 R380 A394 W417	G377-E408 WeakPolarHBondContact CA-OE2 3.49Å; G377-E408 PolarHBondContact N-OE2 3.19Å; Q378-E408 PolarHBondContact N-OE1 2.88Å; R380-E408 IonicContact CZ-OE1 2.93Å; R380-E408 IonicContact NE-OE1 3.07Å; R380-E408 PolarHBondContact NE-OE1 3.41Å; R380-E408 IonicContact NH2-OE1 2.73Å; R380-E408 PolarHBondContact NH2-OE1 3.37Å; A394-E408 PolarHBondContact N-O 2.84Å; A394-E408 PolarHBondContact O-N 2.92Å; A394-E408 VanDerWaalsContact O-N 3.08Å; E408-W417 HydrophobicContact CB-CE3 3.53Å; E408-W417 HydrophobicContact CB-CZ3 3.66Å
409	A	96	Very high	91.8	Very high	15 Å²	15	52.2 Å²	52.2	12%	0.124	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.1	177.7	0	0	0	0	0	109.5	L392 Y393 W417 G418	L392-A409 CarbonylContact O-C 3.6Å; L392-A409 WeakPolarHBondContact O-CA 3.46Å; Y393-A409 HydrophobicContact CD1-CB 3.91Å; Y393-A409 HydrophobicContact CE1-CB 3.93Å; A409-W417 VanDerWaalsContact C-CE3 3.45Å; A409-G418 PolarHBondContact N-O 2.84Å; A409-G418 PolarHBondContact O-N 2.73Å
410	L	95.7	Very high	92	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119.2	172.8	175.9	68.7	0	0	0	108.3	S391 L392 L412 L415 W417	S391-L410 CarbonylContact C-O 3.56Å; S391-L410 WeakPolarHBondContact CA-O 3.31Å; L392-L410 HydrophobicContact CB-CB 4.19Å; L392-L410 HydrophobicContact CD2-CD2 4.03Å; L392-L410 PolarHBondContact N-O 3.45Å; L392-L410 PolarHBondContact O-N 2.89Å; L410-L412 HydrophobicContact CD2-CD2 4.3Å; L410-L412 PolarHBondContact O-N 3.27Å; L410-L415 VanDerWaalsContact CD1-C 3.43Å; L410-W417 HydrophobicContact CB-CD2 3.8Å; L410-W417 HydrophobicContact CB-CE3 3.73Å; L410-W417 HydrophobicContact CB-CH2 3.79Å; L410-W417 HydrophobicContact CB-CZ2 3.81Å; L410-W417 HydrophobicContact CB-CZ3 3.75Å; L410-W417 HydrophobicContact CD1-CD2 4.17Å; L410-W417 HydrophobicContact CD1-CG 4.14Å; L410-W417 HydrophobicContact CD2-CZ2 4.19Å; L410-W417 HydrophobicContact CG-CZ2 4.45Å
411	D	94.2	Very high	92.4	Very high	52 Å²	52	45 Å²	45	28%	0.278	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	120.4	166.7	171.2	22	0	0	0	108.9	T413 S414 L415 Q416	D411-T413 PolarHBondContact O-N 3.02Å; D411-T413 WeakPolarHBondContact OD1-CB 3.43Å; D411-T413 PolarHBondContact OD1-N 3.24Å; D411-S414 WeakPolarHBondContact CB-OG 3.36Å; D411-S414 VanDerWaalsContact CG-OG 3.31Å; D411-S414 WeakPolarHBondContact OD2-CB 3.3Å; D411-S414 PolarHBondContact OD2-N 3.12Å; D411-S414 PolarHBondContact OD2-OG 3.04Å; D411-L415 WeakPolarHBondContact O-CA 3.47Å; D411-L415 PolarHBondContact O-N 3.39Å; D411-Q416 PolarHBondContact N-O 2.94Å
412	L	92	Very high	93	Very high	8 Å²	8	47 Å²	47	4%	0.042	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.8	-176.3	-64.3	173.2	0	0	0	113.5	V340 R343 F345 E390 L392 L410	V340-L412 HydrophobicContact CB-CD1 4.03Å; V340-L412 HydrophobicContact CG1-CD1 3.62Å; V340-L412 HydrophobicContact CG2-CD1 4.23Å; R343-L412 PolarHBondContact NH1-O 3.13Å; F345-L412 HydrophobicContact CE1-CD2 4.27Å; F345-L412 HydrophobicContact CE2-CD2 3.86Å; F345-L412 HydrophobicContact CZ-CD2 3.62Å; E390-L412 WeakPolarHBondContact O-CB 3.34Å; E390-L412 WeakPolarHBondContact O-CG 3.48Å; E390-L412 PolarHBondContact O-N 2.81Å; L392-L412 HydrophobicContact CB-CD2 3.94Å; L392-L412 HydrophobicContact CB-CG 4.29Å; L410-L412 HydrophobicContact CD2-CD2 4.3Å; L410-L412 PolarHBondContact O-N 3.27Å
413	T	91.3	Very high	93.4	Very high	104 Å²	104	45 Å²	45	64%	0.638	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-53.6	175.5	-60	0	0	0	0	110.5	E390 D411	E390-T413 PolarHBondContact OE2-OG1 3.37Å; D411-T413 PolarHBondContact O-N 3.02Å; D411-T413 WeakPolarHBondContact OD1-CB 3.43Å; D411-T413 PolarHBondContact OD1-N 3.24Å
414	S	92.6	Very high	93.6	Very high	58 Å²	58	46.1 Å²	46.1	41%	0.406	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-16	177.1	64.5	0	0	0	0	114.5	D411 Q416	D411-S414 WeakPolarHBondContact CB-OG 3.36Å; D411-S414 VanDerWaalsContact CG-OG 3.31Å; D411-S414 WeakPolarHBondContact OD2-CB 3.3Å; D411-S414 PolarHBondContact OD2-N 3.12Å; D411-S414 PolarHBondContact OD2-OG 3.04Å; S414-Q416 PolarHBondContact O-N 2.67Å; S414-Q416 PolarHBondContact OG-N 3.32Å
415	L	93.1	Very high	93.6	Very high	41 Å²	41	46.8 Å²	46.8	22%	0.215	26%	0.264	C	S	.	.			trans	55.7	35.4	-170.3	-62.2	175.3	0	0	0	113	P374 L410 D411	P374-L415 WeakPolarHBondContact CG-O 3.22Å; L410-L415 VanDerWaalsContact CD1-C 3.43Å; D411-L415 WeakPolarHBondContact O-CA 3.47Å; D411-L415 PolarHBondContact O-N 3.39Å
416	Q	94.7	Very high	93.5	Very high	137 Å²	137	46.8 Å²	46.8	64%	0.64	27%	0.266	S	S	*	.			trans	-110.3	136.2	176.4	-64	-172.8	-12.1	0	0	111.6	D411 S414	D411-Q416 PolarHBondContact N-O 2.94Å; S414-Q416 PolarHBondContact O-N 2.67Å; S414-Q416 PolarHBondContact OG-N 3.32Å
417	W	95.8	Very high	93.3	Very high	51 Å²	51	45.8 Å²	45.8	19%	0.193	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.8	172	-75.3	102.8	0	0	0	110.2	V360 P374 A375 M376 A394 E408 A409 L410	V360-W417 HydrophobicContact CG2-CZ2 3.77Å; P374-W417 PolarHBondContact O-NE1 3.39Å; A375-W417 PolarHBondContact O-NE1 3.33Å; M376-W417 HydrophobicContact CG-CD2 4.4Å; M376-W417 HydrophobicContact CG-CH2 3.7Å; M376-W417 HydrophobicContact CG-CZ2 3.46Å; M376-W417 VanDerWaalsContact CG-CZ2 3.46Å; M376-W417 HydrophobicContact CG-CZ3 4.27Å; M376-W417 HydrophobicContact SD-CH2 4.25Å; M376-W417 HydrophobicContact SD-CZ2 4.43Å; A394-W417 HydrophobicContact CB-CH2 3.94Å; A394-W417 HydrophobicContact CB-CZ3 4.01Å; E408-W417 HydrophobicContact CB-CE3 3.53Å; E408-W417 HydrophobicContact CB-CZ3 3.66Å; A409-W417 VanDerWaalsContact C-CE3 3.45Å; L410-W417 HydrophobicContact CB-CD2 3.8Å; L410-W417 HydrophobicContact CB-CE3 3.73Å; L410-W417 HydrophobicContact CB-CH2 3.79Å; L410-W417 HydrophobicContact CB-CZ2 3.81Å; L410-W417 HydrophobicContact CB-CZ3 3.75Å; L410-W417 HydrophobicContact CD1-CD2 4.17Å; L410-W417 HydrophobicContact CD1-CG 4.14Å; L410-W417 HydrophobicContact CD2-CZ2 4.19Å; L410-W417 HydrophobicContact CG-CZ2 4.45Å
418	G	94	Very high	93.1	Very high	28 Å²	28	47.2 Å²	47.2	29%	0.289	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	170.7	168.1	0	0	0	0	0	111.4	A409 G420	A409-G418 PolarHBondContact N-O 2.84Å; A409-G418 PolarHBondContact O-N 2.73Å; G418-G420 PolarHBondContact O-N 3.2Å
419	P	93	Very high	92.6	Very high	130 Å²	130	46.7 Å²	46.7	84%	0.844	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.4	133.1	171.4	27.5	-33.5	0	0	0	109.9
420	G	91.1	Very high	92.4	Very high	21 Å²	21	46.7 Å²	46.7	22%	0.216	26%	0.26	C	S	.	.			trans	-97.5	178.8	173.9	0	0	0	0	0	112.5	S407 G418 R422	S407-G420 WeakPolarHBondContact O-CA 3.37Å; S407-G420 PolarHBondContact O-N 3.38Å; S407-G420 VanDerWaalsContact OG-CA 3.3Å; S407-G420 WeakPolarHBondContact OG-CA 3.49Å; S407-G420 PolarHBondContact OG-O 3.04Å; G418-G420 PolarHBondContact O-N 3.2Å; G420-R422 PolarHBondContact O-N 2.86Å
421	P	91.8	Very high	92.2	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.058	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-67.3	116.7	177	30.5	-37.1	0	0	0	111.8	Y393 L395 S407 L423 Y461 W468	Y393-P421 HydrophobicContact CD1-CG 4.25Å; Y393-P421 HydrophobicContact CE1-CG 4.39Å; L395-P421 HydrophobicContact CD2-CG 4.2Å; S407-P421 WeakPolarHBondContact CB-O 3.3Å; S407-P421 VanDerWaalsContact OG-CD 3.28Å; S407-P421 WeakPolarHBondContact OG-CD 3.39Å; S407-P421 PolarHBondContact OG-O 3.41Å; P421-L423 PolarHBondContact O-N 3.41Å; P421-Y461 HydrophobicContact CB-CD1 4.34Å; P421-Y461 HydrophobicContact CB-CD2 3.64Å; P421-Y461 HydrophobicContact CB-CE1 4.02Å; P421-Y461 HydrophobicContact CB-CE2 3.28Å; P421-Y461 HydrophobicContact CB-CG 4.16Å; P421-Y461 VanDerWaalsContact CB-CZ 3.48Å; P421-Y461 HydrophobicContact CG-CD1 3.89Å; P421-Y461 HydrophobicContact CG-CD2 4.09Å; P421-Y461 HydrophobicContact CG-CE1 3.65Å; P421-Y461 HydrophobicContact CG-CE2 3.89Å; P421-Y461 HydrophobicContact CG-CG 4.09Å; P421-W468 HydrophobicContact CB-CZ2 4.22Å; P421-W468 HydrophobicContact CG-CZ2 4.34Å
422	R	94.1	Very high	92.2	Very high	157 Å²	157	45.5 Å²	45.5	59%	0.592	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-64.6	127.2	176.7	-173.3	172.6	-118.3	-83.2	-15.8	110.1	D405 G420 W468	D405-R422 IonicContact OD1-CZ 2.6Å; D405-R422 VanDerWaalsContact OD1-CZ 3.29Å; D405-R422 IonicContact OD1-NH1 3.15Å; D405-R422 PolarHBondContact OD1-NH1 2.95Å; D405-R422 IonicContact OD1-NH2 2.81Å; D405-R422 PolarHBondContact OD1-NH2 2.93Å; D405-R422 IonicContact OD2-CZ 2.73Å; D405-R422 IonicContact OD2-NH1 3.68Å; D405-R422 PolarHBondContact OD2-NH1 3.18Å; D405-R422 IonicContact OD2-NH2 2.81Å; G420-R422 PolarHBondContact O-N 2.86Å; R422-W468 PolarHBondContact O-NE1 2.91Å
423	L	93.4	Very high	92.3	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.026	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-66.8	146.4	-179.9	-77.1	69.1	0	0	0	109.8	L395 D405 P421 L425 L427 L441 W468	L395-L423 HydrophobicContact CB-CD1 4.31Å; L395-L423 HydrophobicContact CD2-CD1 4.43Å; D405-L423 HydrophobicContact CB-CB 4.4Å; D405-L423 PolarHBondContact O-N 2.89Å; P421-L423 PolarHBondContact O-N 3.41Å; L423-L425 WeakPolarHBondContact CB-O 3.36Å; L423-L425 PolarHBondContact O-N 2.73Å; L423-L425 VanDerWaalsContact O-N 3.16Å; L423-L427 HydrophobicContact CD2-CB 3.98Å; L423-L441 HydrophobicContact CD2-CD2 3.74Å; L423-L441 HydrophobicContact CG-CD2 4.29Å; L423-W468 HydrophobicContact CD1-CH2 4.43Å; L423-W468 HydrophobicContact CD1-CZ2 4.13Å; L423-W468 HydrophobicContact CG-CH2 3.98Å; L423-W468 HydrophobicContact CG-CZ2 3.95Å
424	P	92.2	Very high	92.4	Very high	53 Å²	53	42 Å²	42	34%	0.344	24%	0.239	S	C	.	.	S	Bend	trans	-61.3	-21.4	175.3	-26.6	35.2	0	0	0	114.5	L459 W468	P424-L459 HydrophobicContact CG-CD2 4.32Å; P424-W468 HydrophobicContact CG-CB 3.7Å; P424-W468 HydrophobicContact CG-CD2 4.01Å; P424-W468 HydrophobicContact CG-CE3 4.35Å; P424-W468 HydrophobicContact CG-CG 3.74Å
425	L	90.8	Very high	92.3	Very high	23 Å²	23	40.6 Å²	40.6	12%	0.12	23%	0.226	C	C	.	.	S	Bend	trans	-149.2	153	175.2	57.7	125.8	0	0	0	111	L423 L427 T446 H455 L459	L423-L425 WeakPolarHBondContact CB-O 3.36Å; L423-L425 PolarHBondContact O-N 2.73Å; L423-L425 VanDerWaalsContact O-N 3.16Å; L425-L427 HydrophobicContact CD1-CD1 3.93Å; L425-L427 PolarHBondContact O-N 2.79Å; L425-T446 HydrophobicContact CD1-CG2 3.91Å; L425-T446 VanDerWaalsContact CD1-OG1 3.25Å; L425-T446 WeakPolarHBondContact CD1-OG1 3.22Å; L425-H455 HydrophobicContact CD1-CB 4.46Å; L425-L459 HydrophobicContact CD2-CD1 4.01Å; L425-L459 HydrophobicContact CD2-CD2 4.05Å; L425-L459 HydrophobicContact CG-CD1 4.23Å
426	P	91.1	Very high	92	Very high	38 Å²	38	47 Å²	47	25%	0.247	25%	0.247	C	C	.	.			trans	-63.1	126.4	173.4	-20.7	31.4	0	0	0	111	L403 L404 D405 T446	L403-P426 HydrophobicContact CB-CB 3.86Å; L404-P426 WeakPolarHBondContact O-CA 3.42Å; D405-P426 HydrophobicContact CB-CB 4.32Å; D405-P426 HydrophobicContact CB-CG 4.04Å; P426-T446 WeakPolarHBondContact O-CA 3.45Å; P426-T446 WeakPolarHBondContact O-CB 3.42Å; P426-T446 PolarHBondContact O-OG1 3.37Å
427	L	91.4	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.23	C	C	.	.			trans	-144.2	136.7	-171.2	-163.4	71.2	0	0	0	111.5	G397 L404 L423 L425 F430 L441 H455 L459	G397-L427 PolarHBondContact N-O 2.82Å; L404-L427 PolarHBondContact O-N 2.71Å; L423-L427 HydrophobicContact CD2-CB 3.98Å; L425-L427 HydrophobicContact CD1-CD1 3.93Å; L425-L427 PolarHBondContact O-N 2.79Å; L427-F430 HydrophobicContact CB-CD1 4.12Å; L427-F430 HydrophobicContact CB-CE1 4.3Å; L427-F430 HydrophobicContact CD2-CB 3.86Å; L427-F430 HydrophobicContact CD2-CD1 3.6Å; L427-F430 HydrophobicContact CD2-CD2 4.47Å; L427-F430 HydrophobicContact CD2-CE1 4.23Å; L427-F430 HydrophobicContact CD2-CG 3.73Å; L427-F430 HydrophobicContact CG-CB 4.24Å; L427-F430 HydrophobicContact CG-CD1 3.57Å; L427-F430 HydrophobicContact CG-CE1 4.22Å; L427-F430 HydrophobicContact CG-CG 4.14Å; L427-F430 WeakPolarHBondContact O-CE1 3.31Å; L427-L441 HydrophobicContact CD2-CB 4.38Å; L427-L441 HydrophobicContact CD2-CD2 4.33Å; L427-H455 HydrophobicContact CD1-CB 3.73Å; L427-L459 HydrophobicContact CD2-CD1 4.07Å
428	R	90.1	Very high	91.5	Very high	39 Å²	39	43.3 Å²	43.3	15%	0.147	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-136.7	163.7	174.1	69.7	173.1	-177.5	152.7	0.1	112.2	M382 L403 F430 G444 T445 Y508	M382-R428 HydrophobicContact CB-CB 4.43Å; L403-R428 HydrophobicContact CD2-CG 4.01Å; L403-R428 HydrophobicContact CG-CG 4.26Å; R428-F430 PolarHBondContact O-N 3.07Å; R428-F430 VanDerWaalsContact O-N 3.11Å; R428-G444 CarbonylContact O-C 3.48Å; R428-G444 WeakPolarHBondContact O-CA 3.24Å; R428-T445 PolarHBondContact N-O 2.87Å; R428-T445 PolarHBondContact O-N 2.87Å; R428-Y508 VanDerWaalsContact NH1-CE1 3.33Å
429	A	87.3	Confident	91.5	Very high	12 Å²	12	42 Å²	42	10%	0.099	22%	0.222	C	C	.	.	S	Bend	trans	52.5	35.2	173.2	0	0	0	0	0	113.7	M382 L480	M382-A429 HydrophobicContact CB-CB 4.37Å; M382-A429 PolarHBondContact O-N 3.09Å; M382-A429 HydrophobicContact SD-CB 4.29Å; A429-L480 HydrophobicContact CB-CD2 3.78Å; A429-L480 HydrophobicContact CB-CG 4.08Å; A429-L480 PolarHBondContact O-N 3.42Å
430	F	91.1	Very high	91.6	Very high	14 Å²	14	35.9 Å²	35.9	6%	0.061	18%	0.182	C	C	.	.			trans	-91.2	151.6	177.5	50.5	-88.1	0	0	0	110.5	L395 L427 R428 C432 L441	L395-F430 HydrophobicContact CB-CZ 4.21Å; L395-F430 WeakPolarHBondContact O-CZ 3.06Å; L427-F430 HydrophobicContact CB-CD1 4.12Å; L427-F430 HydrophobicContact CB-CE1 4.3Å; L427-F430 HydrophobicContact CD2-CB 3.86Å; L427-F430 HydrophobicContact CD2-CD1 3.6Å; L427-F430 HydrophobicContact CD2-CD2 4.47Å; L427-F430 HydrophobicContact CD2-CE1 4.23Å; L427-F430 HydrophobicContact CD2-CG 3.73Å; L427-F430 HydrophobicContact CG-CB 4.24Å; L427-F430 HydrophobicContact CG-CD1 3.57Å; L427-F430 HydrophobicContact CG-CE1 4.22Å; L427-F430 HydrophobicContact CG-CG 4.14Å; L427-F430 WeakPolarHBondContact O-CE1 3.31Å; R428-F430 PolarHBondContact O-N 3.07Å; R428-F430 VanDerWaalsContact O-N 3.11Å; F430-C432 HydrophobicContact CD2-CB 3.82Å; F430-C432 HydrophobicContact CE2-CB 3.77Å; F430-L441 HydrophobicContact CD2-CB 3.8Å; F430-L441 HydrophobicContact CD2-CD2 4Å; F430-L441 HydrophobicContact CD2-CG 3.73Å; F430-L441 HydrophobicContact CE1-CD2 4.45Å; F430-L441 HydrophobicContact CE2-CB 4.1Å; F430-L441 HydrophobicContact CE2-CD2 3.52Å; F430-L441 HydrophobicContact CE2-CG 3.48Å; F430-L441 VanDerWaalsContact CE2-CG 3.48Å; F430-L441 HydrophobicContact CG-CB 4.48Å; F430-L441 HydrophobicContact CZ-CD2 3.76Å; F430-L441 HydrophobicContact CZ-CG 4.24Å
431	A	91.1	Very high	91.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.4	167.4	0	0	0	0	0	108.4	L442 A481 A492	A431-L442 HydrophobicContact CB-CB 4.27Å; A431-L442 PolarHBondContact N-O 2.84Å; A431-L442 PolarHBondContact O-N 3.04Å; A431-A481 WeakPolarHBondContact CA-O 3.48Å; A431-A481 HydrophobicContact CB-CB 4.1Å; A431-A481 WeakPolarHBondContact CB-O 3.36Å; A431-A492 HydrophobicContact CB-CB 3.69Å
432	C	93.6	Very high	91.7	Very high	27 Å²	27	34.6 Å²	34.6	18%	0.182	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.9	-179.6	67.1	0	0	0	0	112.5	L386 F430 Y440 G483	L386-C432 HydrophobicContact CD1-CB 3.98Å; L386-C432 HydrophobicContact CD2-CB 4.2Å; L386-C432 HydrophobicContact CG-CB 4.23Å; F430-C432 HydrophobicContact CD2-CB 3.82Å; F430-C432 HydrophobicContact CE2-CB 3.77Å; C432-Y440 VanDerWaalsContact CA-O 3.23Å; C432-Y440 WeakPolarHBondContact CA-O 3.46Å; C432-G483 CarbonylContact O-C 3.57Å; C432-G483 WeakPolarHBondContact O-CA 3.34Å
433	A	94.4	Very high	91.4	Very high	7 Å²	7	27.4 Å²	27.4	6%	0.058	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	148.1	171.6	0	0	0	0	0	111.4	Y440 A485 V490	A433-Y440 PolarHBondContact N-O 2.84Å; A433-Y440 PolarHBondContact O-N 2.96Å; A433-A485 HydrophobicContact CB-CB 4.06Å; A433-V490 HydrophobicContact CB-CG1 3.59Å; A433-V490 HydrophobicContact CB-CG2 4.21Å
434	A	93.2	Very high	91	Very high	32 Å²	32	27.1 Å²	27.1	26%	0.264	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	132.9	170.5	0	0	0	0	0	110.4	G387 R438 L439 A485	G387-A434 WeakPolarHBondContact O-CB 3.31Å; A434-R438 WeakPolarHBondContact CA-O 3.41Å; A434-L439 HydrophobicContact CB-CD2 3.96Å; A434-A485 WeakPolarHBondContact O-CB 3.5Å
435	L	91.1	Very high	90.7	Very high	27 Å²	27	25.2 Å²	25.2	14%	0.141	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	126.8	176.3	178.6	67.5	0	0	0	109.6	G437 R438 Y440 A485 V490	L435-G437 VanDerWaalsContact C-N 3.34Å; L435-G437 PolarHBondContact O-N 3.24Å; L435-R438 PolarHBondContact N-O 2.69Å; L435-R438 WeakPolarHBondContact O-CB 3.18Å; L435-R438 PolarHBondContact O-N 2.99Å; L435-Y440 HydrophobicContact CB-CD2 4.24Å; L435-Y440 HydrophobicContact CB-CE2 3.84Å; L435-A485 HydrophobicContact CB-CB 4.18Å; L435-A485 HydrophobicContact CD1-CB 4.31Å; L435-V490 HydrophobicContact CB-CG2 4.22Å; L435-V490 HydrophobicContact CD2-CG2 4.2Å
436	R	86.6	Confident	90.6	Very high	176 Å²	176	24.4 Å²	24.4	66%	0.664	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	42.5	171	-65.8	171.2	168.1	178.2	-9.3	115	R438 E525	R436-R438 VanDerWaalsContact C-N 3.31Å; R436-E525 VanDerWaalsContact CD-OE2 3.28Å; R436-E525 WeakPolarHBondContact CD-OE2 3.46Å; R436-E525 IonicContact CZ-OE2 3.91Å; R436-E525 IonicContact NE-OE2 3.09Å; R436-E525 IonicContact NH1-OE2 3.82Å; R436-E525 PolarHBondContact NH1-OE2 3.13Å
437	G	87.6	Confident	90.2	Very high	26 Å²	26	26.1 Å²	26.1	27%	0.268	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	14.9	180	0	0	0	0	0	113.9	C388 L435 T463	C388-G437 VanDerWaalsContact SG-CA 3.56Å; L435-G437 VanDerWaalsContact C-N 3.34Å; L435-G437 PolarHBondContact O-N 3.24Å; G437-T463 WeakPolarHBondContact O-CB 3.16Å; G437-T463 WeakPolarHBondContact O-CG2 3.29Å; G437-T463 PolarHBondContact O-N 2.92Å; G437-T463 PolarHBondContact O-OG1 3.09Å
438	R	92.4	Very high	89.5	Confident	84 Å²	84	31.5 Å²	31.5	32%	0.317	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	145.4	176.4	-63.3	169.7	-179.8	-178.8	-11.8	110.3	A434 L435 R436 Y440 I460 Y461 H462 E525	A434-R438 WeakPolarHBondContact CA-O 3.41Å; L435-R438 PolarHBondContact N-O 2.69Å; L435-R438 WeakPolarHBondContact O-CB 3.18Å; L435-R438 PolarHBondContact O-N 2.99Å; R436-R438 VanDerWaalsContact C-N 3.31Å; R438-Y440 HydrophobicContact CB-CD2 4.33Å; R438-Y440 HydrophobicContact CB-CE2 3.55Å; R438-Y440 WeakPolarHBondContact CD-OH 3.47Å; R438-I460 HydrophobicContact CB-CG2 4.18Å; R438-Y461 CarbonylContact C-O 3.6Å; R438-Y461 VanDerWaalsContact CA-O 3.25Å; R438-Y461 WeakPolarHBondContact CA-O 3.33Å; R438-H462 PolarHBondContact NE-ND1 3.04Å; R438-E525 IonicContact CZ-OE1 3.55Å; R438-E525 IonicContact NE-OE1 2.78Å; R438-E525 IonicContact NH1-OE1 3.51Å; R438-E525 PolarHBondContact NH1-OE1 2.85Å
439	L	94.9	Very high	88.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.1	174.8	-47.2	-179.7	0	0	0	108.4	L386 C388 Y393 L395 A434 L441 I460 Y461 T463	L386-L439 HydrophobicContact CB-CD2 4.13Å; L386-L439 HydrophobicContact CD1-CB 3.95Å; L386-L439 HydrophobicContact CD1-CD2 4.05Å; L386-L439 HydrophobicContact CD1-CG 4.46Å; C388-L439 HydrophobicContact CB-CD2 3.59Å; Y393-L439 HydrophobicContact CD1-CD1 4.05Å; Y393-L439 HydrophobicContact CD2-CD1 3.89Å; Y393-L439 HydrophobicContact CE1-CD1 4.49Å; Y393-L439 HydrophobicContact CE2-CD1 4.37Å; Y393-L439 HydrophobicContact CG-CD1 3.71Å; L395-L439 HydrophobicContact CD1-CB 4.49Å; L395-L439 HydrophobicContact CD1-CD1 3.95Å; L395-L439 HydrophobicContact CD2-CD1 4.47Å; A434-L439 HydrophobicContact CB-CD2 3.96Å; L439-L441 HydrophobicContact CB-CD1 4.35Å; L439-I460 CarbonylContact O-C 3.39Å; L439-I460 WeakPolarHBondContact O-CA 3.49Å; L439-Y461 HydrophobicContact CD1-CD1 3.7Å; L439-Y461 HydrophobicContact CD1-CE1 4.41Å; L439-Y461 HydrophobicContact CG-CD1 3.99Å; L439-Y461 PolarHBondContact N-O 3.33Å; L439-Y461 PolarHBondContact O-N 2.81Å; L439-T463 HydrophobicContact CD2-CG2 4.48Å; L439-T463 HydrophobicContact CG-CG2 4.18Å
440	Y	93.8	Very high	88	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.7	-179.2	-64	-98	0	0	0	109.7	C432 A433 L435 R438 V458 I460 V490 F523 E525	C432-Y440 VanDerWaalsContact CA-O 3.23Å; C432-Y440 WeakPolarHBondContact CA-O 3.46Å; A433-Y440 PolarHBondContact N-O 2.84Å; A433-Y440 PolarHBondContact O-N 2.96Å; L435-Y440 HydrophobicContact CB-CD2 4.24Å; L435-Y440 HydrophobicContact CB-CE2 3.84Å; R438-Y440 HydrophobicContact CB-CD2 4.33Å; R438-Y440 HydrophobicContact CB-CE2 3.55Å; R438-Y440 WeakPolarHBondContact CD-OH 3.47Å; Y440-V458 HydrophobicContact CD1-CG1 4.17Å; Y440-I460 HydrophobicContact CD1-CB 4.46Å; Y440-I460 HydrophobicContact CD1-CD1 4.14Å; Y440-I460 HydrophobicContact CD1-CG1 3.76Å; Y440-I460 HydrophobicContact CD1-CG2 4.14Å; Y440-I460 HydrophobicContact CE1-CB 4.43Å; Y440-I460 HydrophobicContact CE1-CD1 3.79Å; Y440-I460 HydrophobicContact CE1-CG1 3.84Å; Y440-I460 HydrophobicContact CE1-CG2 3.77Å; Y440-V490 HydrophobicContact CD1-CG2 4.27Å; Y440-V490 HydrophobicContact CD2-CG2 3.62Å; Y440-V490 HydrophobicContact CE2-CG2 4.19Å; Y440-V490 HydrophobicContact CG-CB 4.37Å; Y440-V490 HydrophobicContact CG-CG2 3.68Å; Y440-F523 HydrophobicContact CD1-CD1 4.08Å; Y440-F523 HydrophobicContact CD1-CE1 4.21Å; Y440-F523 AromaticContact CE1-CD1 3.97Å; Y440-F523 HydrophobicContact CE1-CD1 3.97Å; Y440-F523 AromaticContact CE1-CE1 3.77Å; Y440-F523 HydrophobicContact CE1-CE1 3.77Å; Y440-E525 PolarHBondContact OH-OE1 3.32Å
441	L	93.9	Very high	87.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.4	176	-64.5	65.2	0	0	0	107.3	L395 L423 L427 F430 L439 V458 L459 W468	L395-L441 HydrophobicContact CD1-CD1 3.98Å; L395-L441 HydrophobicContact CD1-CD2 4.39Å; L395-L441 HydrophobicContact CD1-CG 4.48Å; L423-L441 HydrophobicContact CD2-CD2 3.74Å; L423-L441 HydrophobicContact CG-CD2 4.29Å; L427-L441 HydrophobicContact CD2-CB 4.38Å; L427-L441 HydrophobicContact CD2-CD2 4.33Å; F430-L441 HydrophobicContact CD2-CB 3.8Å; F430-L441 HydrophobicContact CD2-CD2 4Å; F430-L441 HydrophobicContact CD2-CG 3.73Å; F430-L441 HydrophobicContact CE1-CD2 4.45Å; F430-L441 HydrophobicContact CE2-CB 4.1Å; F430-L441 HydrophobicContact CE2-CD2 3.52Å; F430-L441 HydrophobicContact CE2-CG 3.48Å; F430-L441 VanDerWaalsContact CE2-CG 3.48Å; F430-L441 HydrophobicContact CG-CB 4.48Å; F430-L441 HydrophobicContact CZ-CD2 3.76Å; F430-L441 HydrophobicContact CZ-CG 4.24Å; L439-L441 HydrophobicContact CB-CD1 4.35Å; L441-V458 CarbonylContact O-C 3.49Å; L441-V458 VanDerWaalsContact O-CA 3.31Å; L441-V458 WeakPolarHBondContact O-CA 3.36Å; L441-L459 HydrophobicContact CB-CB 4.21Å; L441-L459 PolarHBondContact N-O 2.88Å; L441-L459 PolarHBondContact O-N 3.32Å; L441-W468 HydrophobicContact CD1-CH2 3.96Å; L441-W468 HydrophobicContact CD1-CZ3 3.95Å; L441-W468 HydrophobicContact CD2-CH2 4.03Å; L441-W468 HydrophobicContact CD2-CZ3 4.34Å
442	L	90.9	Very high	86.3	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.1	-176	-62.8	91.1	0	0	0	109.8	A431 V458 V490 A492 F523	A431-L442 HydrophobicContact CB-CB 4.27Å; A431-L442 PolarHBondContact N-O 2.84Å; A431-L442 PolarHBondContact O-N 3.04Å; L442-V458 HydrophobicContact CD2-CG2 4.02Å; L442-V458 HydrophobicContact CG-CG1 4.09Å; L442-V458 HydrophobicContact CG-CG2 3.97Å; L442-V490 HydrophobicContact CD1-CB 4.28Å; L442-V490 HydrophobicContact CD1-CG1 3.55Å; L442-A492 HydrophobicContact CB-CB 4.14Å; L442-A492 HydrophobicContact CD2-CB 4.25Å; L442-F523 HydrophobicContact CD2-CB 4.06Å
443	G	87.8	Confident	85.5	Confident	6 Å²	6	52 Å²	52	6%	0.062	26%	0.258	C	S	.	.	S	Bend	trans	67	-140	176.4	0	0	0	0	0	112.8	H455 G457 T478	G443-H455 WeakPolarHBondContact CA-O 3.25Å; G443-G457 PolarHBondContact N-O 2.61Å; G443-T478 WeakPolarHBondContact CA-O 3.39Å
444	G	86.8	Confident	84.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.			trans	87	-179.2	-176.7	0	0	0	0	0	113.9	R428 V454 H455 T478	R428-G444 CarbonylContact O-C 3.48Å; R428-G444 WeakPolarHBondContact O-CA 3.24Å; G444-V454 CarbonylContact O-C 3.54Å; G444-V454 VanDerWaalsContact O-CA 3.28Å; G444-V454 WeakPolarHBondContact O-CA 3.31Å; G444-V454 VanDerWaalsContact O-CG1 3.3Å; G444-V454 WeakPolarHBondContact O-CG1 3.39Å; G444-H455 PolarHBondContact O-N 2.95Å; G444-T478 PolarHBondContact N-O 2.81Å
445	T	85.9	Confident	84.3	Confident	13 Å²	13	51.2 Å²	51.2	8%	0.08	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.1	-174.6	-55.7	0	0	0	0	110.2	L403 R428 A452 V453	L403-T445 WeakPolarHBondContact CD2-O 3.5Å; R428-T445 PolarHBondContact N-O 2.87Å; R428-T445 PolarHBondContact O-N 2.87Å; T445-A452 HydrophobicContact CG2-CB 3.96Å; T445-V453 CarbonylContact C-O 3.52Å; T445-V453 WeakPolarHBondContact CA-O 3.45Å
446	T	87.6	Confident	83.8	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-179.6	174.5	-168.2	0	0	0	0	110.8	L425 P426 A452 V453 H455	L425-T446 HydrophobicContact CD1-CG2 3.91Å; L425-T446 VanDerWaalsContact CD1-OG1 3.25Å; L425-T446 WeakPolarHBondContact CD1-OG1 3.22Å; P426-T446 WeakPolarHBondContact O-CA 3.45Å; P426-T446 WeakPolarHBondContact O-CB 3.42Å; P426-T446 PolarHBondContact O-OG1 3.37Å; T446-A452 CarbonylContact O-C 3.52Å; T446-A452 VanDerWaalsContact O-CA 3.27Å; T446-A452 WeakPolarHBondContact O-CA 3.32Å; T446-V453 HydrophobicContact CG2-CG2 3.58Å; T446-V453 PolarHBondContact N-O 2.92Å; T446-V453 PolarHBondContact O-N 2.86Å; T446-H455 HydrophobicContact CG2-CB 4.27Å
447	L	82.8	Confident	83.7	Confident	75 Å²	75	44.4 Å²	44.4	39%	0.393	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.8	176	-68.7	168.5	0	0	0	110.1	L403 R451 A452	L403-L447 HydrophobicContact CB-CD1 4.35Å; L403-L447 HydrophobicContact CD1-CD1 4.06Å; L403-L447 HydrophobicContact CD1-CG 4.26Å; L403-L447 HydrophobicContact CD2-CG 4.16Å; L447-R451 WeakPolarHBondContact CA-O 3.01Å; L447-A452 HydrophobicContact CD2-CB 4.38Å
448	E	77.1	Confident	83.8	Confident	112 Å²	112	43.1 Å²	43.1	52%	0.523	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.4	168.8	-74.9	179.7	-173	0	0	108.3	N450 R451 V453	E448-N450 VanDerWaalsContact C-N 3.26Å; E448-N450 PolarHBondContact O-N 3.4Å; E448-R451 PolarHBondContact N-O 2.78Å; E448-R451 WeakPolarHBondContact O-CA 3.17Å; E448-R451 WeakPolarHBondContact O-CB 3.32Å; E448-R451 PolarHBondContact O-N 3.46Å; E448-V453 HydrophobicContact CB-CG1 4.23Å; E448-V453 HydrophobicContact CB-CG2 3.85Å; E448-V453 HydrophobicContact CG-CG2 3.57Å
449	Q	75.2	Confident	83.8	Confident	191 Å²	191	39.1 Å²	39.1	89%	0.893	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	43	-178.5	-57.7	177.7	-16.2	0	0	113.2	R451	Q449-R451 PolarHBondContact O-N 3.35Å; Q449-R451 VanDerWaalsContact O-N 3.14Å
450	N	70.8	Confident	83.8	Confident	154 Å²	154	39.7 Å²	39.7	82%	0.824	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	8.1	-173.3	-85.1	-2.3	0	0	0	116.3	E448	E448-N450 VanDerWaalsContact C-N 3.26Å; E448-N450 PolarHBondContact O-N 3.4Å
451	R	72.1	Confident	83.8	Confident	119 Å²	119	40.1 Å²	40.1	45%	0.449	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.2	172	-60.6	-176.4	73	-177.1	1	109.4	L447 E448 Q449 V453	L447-R451 WeakPolarHBondContact CA-O 3.01Å; E448-R451 PolarHBondContact N-O 2.78Å; E448-R451 WeakPolarHBondContact O-CA 3.17Å; E448-R451 WeakPolarHBondContact O-CB 3.32Å; E448-R451 PolarHBondContact O-N 3.46Å; Q449-R451 PolarHBondContact O-N 3.35Å; Q449-R451 VanDerWaalsContact O-N 3.14Å; R451-V453 PolarHBondContact O-N 2.88Å
452	A	73.3	Confident	83.7	Confident	23 Å²	23	41.7 Å²	41.7	19%	0.19	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.9	170.4	0	0	0	0	0	108.6	T445 T446 L447 R498	T445-A452 HydrophobicContact CG2-CB 3.96Å; T446-A452 CarbonylContact O-C 3.52Å; T446-A452 VanDerWaalsContact O-CA 3.27Å; T446-A452 WeakPolarHBondContact O-CA 3.32Å; L447-A452 HydrophobicContact CD2-CB 4.38Å; A452-R498 PolarHBondContact O-NH1 3.41Å; A452-R498 PolarHBondContact O-NH2 2.93Å
453	V	76.9	Confident	83.6	Confident	38 Å²	38	43.1 Å²	43.1	23%	0.23	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	159.5	174.6	-61.1	0	0	0	0	110.4	T445 T446 E448 R451	T445-V453 CarbonylContact C-O 3.52Å; T445-V453 WeakPolarHBondContact CA-O 3.45Å; T446-V453 HydrophobicContact CG2-CG2 3.58Å; T446-V453 PolarHBondContact N-O 2.92Å; T446-V453 PolarHBondContact O-N 2.86Å; E448-V453 HydrophobicContact CB-CG1 4.23Å; E448-V453 HydrophobicContact CB-CG2 3.85Å; E448-V453 HydrophobicContact CG-CG2 3.57Å; R451-V453 PolarHBondContact O-N 2.88Å
454	V	79.9	Confident	83.7	Confident	19 Å²	19	50.7 Å²	50.7	12%	0.115	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	128.9	174	-172.1	0	0	0	0	108.5	G444 S456 R498	G444-V454 CarbonylContact O-C 3.54Å; G444-V454 VanDerWaalsContact O-CA 3.28Å; G444-V454 WeakPolarHBondContact O-CA 3.31Å; G444-V454 VanDerWaalsContact O-CG1 3.3Å; G444-V454 WeakPolarHBondContact O-CG1 3.39Å; V454-S456 PolarHBondContact O-N 2.86Å; V454-R498 HydrophobicContact CG2-CB 3.46Å; V454-R498 VanDerWaalsContact CG2-CB 3.46Å; V454-R498 VanDerWaalsContact CG2-CD 3.48Å; V454-R498 HydrophobicContact CG2-CG 4.16Å
455	H	83.6	Confident	83.7	Confident	3 Å²	3	55 Å²	55	1%	0.014	29%	0.287	C	S	.	.			trans	-70.2	125.1	178.5	176.3	-107.2	0	0	0	110.9	L425 L427 G443 G444 T446 G457 R470	L425-H455 HydrophobicContact CD1-CB 4.46Å; L427-H455 HydrophobicContact CD1-CB 3.73Å; G443-H455 WeakPolarHBondContact CA-O 3.25Å; G444-H455 PolarHBondContact O-N 2.95Å; T446-H455 HydrophobicContact CG2-CB 4.27Å; H455-G457 VanDerWaalsContact CE1-CA 3.45Å; H455-G457 WeakPolarHBondContact CE1-CA 3.43Å; H455-G457 PolarHBondContact CE1-N 2.76Å; H455-G457 PolarHBondContact CE1-O 2.95Å; H455-G457 VanDerWaalsContact CE1-O 3.29Å; H455-G457 PolarHBondContact ND1-N 2.88Å; H455-G457 PolarHBondContact ND1-O 2.97Å; H455-G457 VanDerWaalsContact ND1-O 3.13Å; H455-G457 PolarHBondContact O-N 3.02Å; H455-R470 PolarHBondContact CD2-NH2 3.17Å; H455-R470 PolarHBondContact NE2-NE 2.9Å; H455-R470 PolarHBondContact NE2-NH2 3.4Å; H455-R470 VanDerWaalsContact NE2-NH2 3.11Å
456	S	80.4	Confident	83.8	Confident	59 Å²	59	59.9 Å²	59.9	41%	0.413	31%	0.313	S	S	.	.			trans	-94.3	51.5	-179.4	54.4	0	0	0	0	113.8	V454 L473 T477	V454-S456 PolarHBondContact O-N 2.86Å; S456-L473 PolarHBondContact O-N 2.96Å; S456-T477 VanDerWaalsContact CA-CG2 3.4Å; S456-T477 VanDerWaalsContact CB-CG2 3.44Å
457	G	83.7	Confident	84	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	176	178	0	0	0	0	0	114.6	G443 H455 V471	G443-G457 PolarHBondContact N-O 2.61Å; H455-G457 VanDerWaalsContact CE1-CA 3.45Å; H455-G457 WeakPolarHBondContact CE1-CA 3.43Å; H455-G457 PolarHBondContact CE1-N 2.76Å; H455-G457 PolarHBondContact CE1-O 2.95Å; H455-G457 VanDerWaalsContact CE1-O 3.29Å; H455-G457 PolarHBondContact ND1-N 2.88Å; H455-G457 PolarHBondContact ND1-O 2.97Å; H455-G457 VanDerWaalsContact ND1-O 3.13Å; H455-G457 PolarHBondContact O-N 3.02Å; G457-V471 CarbonylContact C-O 3.51Å; G457-V471 WeakPolarHBondContact CA-O 3.48Å
458	V	89.8	Confident	84.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.9	171.9	-173.4	0	0	0	0	108.4	Y440 L441 L442 I460 R470 V471 L473 F523	Y440-V458 HydrophobicContact CD1-CG1 4.17Å; L441-V458 CarbonylContact O-C 3.49Å; L441-V458 VanDerWaalsContact O-CA 3.31Å; L441-V458 WeakPolarHBondContact O-CA 3.36Å; L442-V458 HydrophobicContact CD2-CG2 4.02Å; L442-V458 HydrophobicContact CG-CG1 4.09Å; L442-V458 HydrophobicContact CG-CG2 3.97Å; V458-I460 HydrophobicContact CG1-CD1 4.38Å; V458-I460 HydrophobicContact CG1-CG1 3.78Å; V458-R470 WeakPolarHBondContact O-CA 3.34Å; V458-V471 PolarHBondContact N-O 2.93Å; V458-V471 PolarHBondContact O-N 3.47Å; V458-L473 HydrophobicContact CG2-CD1 3.59Å; V458-L473 HydrophobicContact CG2-CG 4.12Å; V458-F523 HydrophobicContact CB-CD2 4.45Å; V458-F523 HydrophobicContact CG2-CB 4.47Å; V458-F523 HydrophobicContact CG2-CD2 3.82Å; V458-F523 HydrophobicContact CG2-CE2 4.34Å; V458-F523 HydrophobicContact CG2-CG 4.17Å
459	L	92.8	Very high	85.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.7	166.9	-53.4	173	0	0	0	107.9	P424 L425 L427 L441 W468 R470	P424-L459 HydrophobicContact CG-CD2 4.32Å; L425-L459 HydrophobicContact CD2-CD1 4.01Å; L425-L459 HydrophobicContact CD2-CD2 4.05Å; L425-L459 HydrophobicContact CG-CD1 4.23Å; L427-L459 HydrophobicContact CD2-CD1 4.07Å; L441-L459 HydrophobicContact CB-CB 4.21Å; L441-L459 PolarHBondContact N-O 2.88Å; L441-L459 PolarHBondContact O-N 3.32Å; L459-W468 HydrophobicContact CB-CE3 3.87Å; L459-W468 HydrophobicContact CB-CZ3 3.65Å; L459-R470 HydrophobicContact CD2-CB 4.07Å; L459-R470 HydrophobicContact CD2-CG 3.84Å
460	I	94	Very high	85.7	Confident	11 Å²	11	49.1 Å²	49.1	6%	0.056	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.2	-177.8	-50.4	173.5	0	0	0	107.2	R438 L439 Y440 V458 W468 T469 V471 F523	R438-I460 HydrophobicContact CB-CG2 4.18Å; L439-I460 CarbonylContact O-C 3.39Å; L439-I460 WeakPolarHBondContact O-CA 3.49Å; Y440-I460 HydrophobicContact CD1-CB 4.46Å; Y440-I460 HydrophobicContact CD1-CD1 4.14Å; Y440-I460 HydrophobicContact CD1-CG1 3.76Å; Y440-I460 HydrophobicContact CD1-CG2 4.14Å; Y440-I460 HydrophobicContact CE1-CB 4.43Å; Y440-I460 HydrophobicContact CE1-CD1 3.79Å; Y440-I460 HydrophobicContact CE1-CG1 3.84Å; Y440-I460 HydrophobicContact CE1-CG2 3.77Å; V458-I460 HydrophobicContact CG1-CD1 4.38Å; V458-I460 HydrophobicContact CG1-CG1 3.78Å; I460-W468 WeakPolarHBondContact O-CA 3.3Å; I460-T469 PolarHBondContact N-O 2.85Å; I460-T469 PolarHBondContact O-N 3.05Å; I460-V471 HydrophobicContact CD1-CG2 4.04Å; I460-F523 HydrophobicContact CD1-CE1 3.78Å; I460-F523 HydrophobicContact CD1-CZ 3.75Å
461	Y	94.4	Very high	86.5	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.047	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.4	171.3	175.5	-110.9	0	0	0	110.1	Y393 P421 R438 L439 T463 D466 C467 W468	Y393-Y461 HydrophobicContact CE1-CE1 4.24Å; P421-Y461 HydrophobicContact CB-CD1 4.34Å; P421-Y461 HydrophobicContact CB-CD2 3.64Å; P421-Y461 HydrophobicContact CB-CE1 4.02Å; P421-Y461 HydrophobicContact CB-CE2 3.28Å; P421-Y461 HydrophobicContact CB-CG 4.16Å; P421-Y461 VanDerWaalsContact CB-CZ 3.48Å; P421-Y461 HydrophobicContact CG-CD1 3.89Å; P421-Y461 HydrophobicContact CG-CD2 4.09Å; P421-Y461 HydrophobicContact CG-CE1 3.65Å; P421-Y461 HydrophobicContact CG-CE2 3.89Å; P421-Y461 HydrophobicContact CG-CG 4.09Å; R438-Y461 CarbonylContact C-O 3.6Å; R438-Y461 VanDerWaalsContact CA-O 3.25Å; R438-Y461 WeakPolarHBondContact CA-O 3.33Å; L439-Y461 HydrophobicContact CD1-CD1 3.7Å; L439-Y461 HydrophobicContact CD1-CE1 4.41Å; L439-Y461 HydrophobicContact CG-CD1 3.99Å; L439-Y461 PolarHBondContact N-O 3.33Å; L439-Y461 PolarHBondContact O-N 2.81Å; Y461-T463 HydrophobicContact CD1-CG2 3.92Å; Y461-T463 HydrophobicContact CE1-CG2 3.78Å; Y461-D466 WeakPolarHBondContact CE2-OD1 3.43Å; Y461-D466 PolarHBondContact OH-OD1 3.16Å; Y461-C467 WeakPolarHBondContact CD2-O 3.39Å; Y461-W468 HydrophobicContact CD2-CD2 4.1Å; Y461-W468 AromaticContact CD2-CE2 3.82Å; Y461-W468 HydrophobicContact CD2-CG 4.28Å; Y461-W468 HydrophobicContact CD2-CZ2 4.3Å; Y461-W468 AromaticContact CD2-NE1 3.81Å; Y461-W468 HydrophobicContact CG-CD2 4.44Å; Y461-W468 HydrophobicContact CG-CZ2 4.23Å
462	H	91.4	Very high	86.9	Confident	32 Å²	32	39.5 Å²	39.5	15%	0.148	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	103.6	178.7	-67.4	-116	0	0	0	109.3	R438 L464 T465 D466 C467 T469	R438-H462 PolarHBondContact NE-ND1 3.04Å; H462-L464 PolarHBondContact O-N 2.99Å; H462-L464 VanDerWaalsContact O-N 3.16Å; H462-T465 WeakPolarHBondContact CB-OG1 3.21Å; H462-T465 PolarHBondContact O-N 2.98Å; H462-D466 WeakPolarHBondContact O-CA 3.48Å; H462-D466 PolarHBondContact O-N 2.91Å; H462-C467 PolarHBondContact N-O 2.86Å; H462-T469 PolarHBondContact CD2-OG1 2.85Å; H462-T469 PolarHBondContact NE2-OG1 3.19Å; H462-T469 VanDerWaalsContact NE2-OG1 3.09Å
463	T	89.9	Confident	87	Confident	34 Å²	34	40.8 Å²	40.8	21%	0.209	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.2	-173	63	0	0	0	0	114.3	C388 G437 L439 Y461	C388-T463 HydrophobicContact CB-CG2 4.28Å; G437-T463 WeakPolarHBondContact O-CB 3.16Å; G437-T463 WeakPolarHBondContact O-CG2 3.29Å; G437-T463 PolarHBondContact O-N 2.92Å; G437-T463 PolarHBondContact O-OG1 3.09Å; L439-T463 HydrophobicContact CD2-CG2 4.48Å; L439-T463 HydrophobicContact CG-CG2 4.18Å; Y461-T463 HydrophobicContact CD1-CG2 3.92Å; Y461-T463 HydrophobicContact CE1-CG2 3.78Å
464	L	88.9	Confident	86.2	Confident	165 Å²	165	46.2 Å²	46.2	86%	0.864	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-32.5	-179.6	-65	175.3	0	0	0	113.2	H462	H462-L464 PolarHBondContact O-N 2.99Å; H462-L464 VanDerWaalsContact O-N 3.16Å
465	T	87.6	Confident	85.4	Confident	91 Å²	91	49.3 Å²	49.3	56%	0.558	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-4.3	-177.1	52.6	0	0	0	0	112.6	H462 C467	H462-T465 WeakPolarHBondContact CB-OG1 3.21Å; H462-T465 PolarHBondContact O-N 2.98Å; T465-C467 PolarHBondContact O-N 2.94Å; T465-C467 PolarHBondContact OG1-SG 2.88Å
466	D	88.8	Confident	84.3	Confident	114 Å²	114	49.6 Å²	49.6	61%	0.61	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	41.8	-178	-166.9	17	0	0	0	112.7	Y461 H462	Y461-D466 WeakPolarHBondContact CE2-OD1 3.43Å; Y461-D466 PolarHBondContact OH-OD1 3.16Å; H462-D466 WeakPolarHBondContact O-CA 3.48Å; H462-D466 PolarHBondContact O-N 2.91Å
467	C	91.3	Very high	83.7	Confident	26 Å²	26	48.3 Å²	48.3	18%	0.176	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153.3	-178.3	74.4	0	0	0	0	112.8	Y461 H462 T465	Y461-C467 WeakPolarHBondContact CD2-O 3.39Å; H462-C467 PolarHBondContact N-O 2.86Å; T465-C467 PolarHBondContact O-N 2.94Å; T465-C467 PolarHBondContact OG1-SG 2.88Å
468	W	92.3	Very high	83.3	Confident	18 Å²	18	48.5 Å²	48.5	7%	0.068	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.2	175.8	-75.1	97.4	0	0	0	111.4	P421 R422 L423 P424 L441 L459 I460 Y461 V535	P421-W468 HydrophobicContact CB-CZ2 4.22Å; P421-W468 HydrophobicContact CG-CZ2 4.34Å; R422-W468 PolarHBondContact O-NE1 2.91Å; L423-W468 HydrophobicContact CD1-CH2 4.43Å; L423-W468 HydrophobicContact CD1-CZ2 4.13Å; L423-W468 HydrophobicContact CG-CH2 3.98Å; L423-W468 HydrophobicContact CG-CZ2 3.95Å; P424-W468 HydrophobicContact CG-CB 3.7Å; P424-W468 HydrophobicContact CG-CD2 4.01Å; P424-W468 HydrophobicContact CG-CE3 4.35Å; P424-W468 HydrophobicContact CG-CG 3.74Å; L441-W468 HydrophobicContact CD1-CH2 3.96Å; L441-W468 HydrophobicContact CD1-CZ3 3.95Å; L441-W468 HydrophobicContact CD2-CH2 4.03Å; L441-W468 HydrophobicContact CD2-CZ3 4.34Å; L459-W468 HydrophobicContact CB-CE3 3.87Å; L459-W468 HydrophobicContact CB-CZ3 3.65Å; I460-W468 WeakPolarHBondContact O-CA 3.3Å; Y461-W468 HydrophobicContact CD2-CD2 4.1Å; Y461-W468 AromaticContact CD2-CE2 3.82Å; Y461-W468 HydrophobicContact CD2-CG 4.28Å; Y461-W468 HydrophobicContact CD2-CZ2 4.3Å; Y461-W468 AromaticContact CD2-NE1 3.81Å; Y461-W468 HydrophobicContact CG-CD2 4.44Å; Y461-W468 HydrophobicContact CG-CZ2 4.23Å; W468-V535 PolarHBondContact O-N 2.82Å
469	T	90.4	Very high	82.7	Confident	15 Å²	15	49.1 Å²	49.1	9%	0.092	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.1	170.9	-51.5	0	0	0	0	108.7	I460 H462 E532	I460-T469 PolarHBondContact N-O 2.85Å; I460-T469 PolarHBondContact O-N 3.05Å; H462-T469 PolarHBondContact CD2-OG1 2.85Å; H462-T469 PolarHBondContact NE2-OG1 3.19Å; H462-T469 VanDerWaalsContact NE2-OG1 3.09Å; T469-E532 HydrophobicContact CG2-CB 4.4Å; T469-E532 HydrophobicContact CG2-CG 4.4Å
470	R	88.4	Confident	82	Confident	98 Å²	98	50.9 Å²	50.9	37%	0.37	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.8	174.9	-176.9	174	-175.3	-163.9	-1.1	110	H455 V458 L459	H455-R470 PolarHBondContact CD2-NH2 3.17Å; H455-R470 PolarHBondContact NE2-NE 2.9Å; H455-R470 PolarHBondContact NE2-NH2 3.4Å; H455-R470 VanDerWaalsContact NE2-NH2 3.11Å; V458-R470 WeakPolarHBondContact O-CA 3.34Å; L459-R470 HydrophobicContact CD2-CB 4.07Å; L459-R470 HydrophobicContact CD2-CG 3.84Å
471	V	87.4	Confident	81.5	Confident	8 Å²	8	50.9 Å²	50.9	5%	0.048	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123	173.8	-172.2	0	0	0	0	108.7	G457 V458 I460 F523	G457-V471 CarbonylContact C-O 3.51Å; G457-V471 WeakPolarHBondContact CA-O 3.48Å; V458-V471 PolarHBondContact N-O 2.93Å; V458-V471 PolarHBondContact O-N 3.47Å; I460-V471 HydrophobicContact CD1-CG2 4.04Å; V471-F523 HydrophobicContact CB-CE2 4.16Å; V471-F523 HydrophobicContact CG1-CE2 3.98Å; V471-F523 HydrophobicContact CG2-CE2 4.33Å; V471-F523 HydrophobicContact CG2-CZ 4.22Å
472	A	80.7	Confident	81.1	Confident	63 Å²	63	50.9 Å²	50.9	52%	0.521	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	148.1	175.8	0	0	0	0	0	110.6
473	L	74.5	Confident	81	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.262	30%	0.295	S	S	.	.			trans	-116.2	122.6	172.9	-79.6	161.8	0	0	0	108.8	S456 V458 S475	S456-L473 PolarHBondContact O-N 2.96Å; V458-L473 HydrophobicContact CG2-CD1 3.59Å; V458-L473 HydrophobicContact CG2-CG 4.12Å; L473-S475 PolarHBondContact O-N 3.24Å
474	D	60.9	Low	81.1	Confident	152 Å²	152	49.1 Å²	49.1	81%	0.813	29%	0.288	S	S	*	.	S	Bend	trans	-67.4	-22.4	-175.5	-57.4	-32.8	0	0	0	113.2
475	S	62.2	Low	81.2	Confident	84 Å²	84	42.2 Å²	42.2	59%	0.587	26%	0.255	S	S	*	.	S	Bend	trans	-160.8	164	175.6	67.6	0	0	0	0	113.7	L473	L473-S475 PolarHBondContact O-N 3.24Å
476	G	60.4	Low	81.1	Confident	10 Å²	10	38.7 Å²	38.7	10%	0.103	23%	0.233	C	C	.	.			trans	91.8	25.5	165.8	0	0	0	0	0	115.7	T478 L521	G476-T478 PolarHBondContact O-N 3.11Å; G476-L521 WeakPolarHBondContact O-CD1 3.38Å
477	T	67.9	Low	80.6	Confident	32 Å²	32	43.2 Å²	43.2	20%	0.196	24%	0.241	C	C	.	.			trans	-57.6	129.7	179.1	61.5	0	0	0	0	112.8	S456	S456-T477 VanDerWaalsContact CA-CG2 3.4Å; S456-T477 VanDerWaalsContact CB-CG2 3.44Å
478	T	76.4	Confident	79.9	Confident	3 Å²	3	43 Å²	43	2%	0.018	24%	0.244	C	C	.	.			trans	-131.9	149.4	176.7	59.4	0	0	0	0	112	G443 G444 G476 A481 G494 Y496 M497	G443-T478 WeakPolarHBondContact CA-O 3.39Å; G444-T478 PolarHBondContact N-O 2.81Å; G476-T478 PolarHBondContact O-N 3.11Å; T478-A481 VanDerWaalsContact OG1-CB 3.32Å; T478-A481 WeakPolarHBondContact OG1-CB 3.23Å; T478-G494 WeakPolarHBondContact CB-O 3.37Å; T478-G494 WeakPolarHBondContact CG2-O 3.31Å; T478-G494 PolarHBondContact OG1-O 2.8Å; T478-Y496 VanDerWaalsContact CA-O 3.31Å; T478-Y496 WeakPolarHBondContact CA-O 3.44Å; T478-M497 HydrophobicContact CG2-CG 4.22Å
479	C	76.3	Confident	79.6	Confident	13 Å²	13	42.2 Å²	42.2	9%	0.088	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-117.1	158.8	164.6	64.5	0	0	0	0	109.5	A481 G495 Y496	C479-A481 PolarHBondContact O-N 2.86Å; C479-G495 CarbonylContact O-C 3.55Å; C479-G495 WeakPolarHBondContact O-CA 3.31Å; C479-Y496 PolarHBondContact N-O 2.88Å; C479-Y496 VanDerWaalsContact N-O 3.17Å; C479-Y496 PolarHBondContact O-N 3.46Å
480	L	77.3	Confident	79.6	Confident	38 Å²	38	41.5 Å²	41.5	20%	0.199	24%	0.237	C	C	.	.	S	Bend	trans	55.5	31.2	-174	-63.5	167.9	0	0	0	112.9	A429 Y496 A572	A429-L480 HydrophobicContact CB-CD2 3.78Å; A429-L480 HydrophobicContact CB-CG 4.08Å; A429-L480 PolarHBondContact O-N 3.42Å; L480-Y496 HydrophobicContact CB-CD2 4.38Å; L480-Y496 HydrophobicContact CD1-CD2 3.92Å; L480-Y496 HydrophobicContact CD1-CE2 3.98Å; L480-A572 HydrophobicContact CB-CB 4.3Å; L480-A572 PolarHBondContact O-N 2.9Å
481	A	84.6	Confident	79.6	Confident	11 Å²	11	36.8 Å²	36.8	9%	0.091	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-87.7	148.8	173.1	0	0	0	0	0	110.5	A431 T478 C479 A492 G494	A431-A481 WeakPolarHBondContact CA-O 3.48Å; A431-A481 HydrophobicContact CB-CB 4.1Å; A431-A481 WeakPolarHBondContact CB-O 3.36Å; T478-A481 VanDerWaalsContact OG1-CB 3.32Å; T478-A481 WeakPolarHBondContact OG1-CB 3.23Å; C479-A481 PolarHBondContact O-N 2.86Å; A481-A492 HydrophobicContact CB-CB 4.37Å; A481-G494 VanDerWaalsContact CB-O 3.32Å; A481-G494 WeakPolarHBondContact CB-O 3.15Å
482	G	85.3	Confident	79.7	Confident	12 Å²	12	36.4 Å²	36.4	12%	0.124	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.6	173.8	0	0	0	0	0	111.2	A492 I493	G482-A492 WeakPolarHBondContact O-CA 3.49Å; G482-I493 PolarHBondContact N-O 3.4Å; G482-I493 PolarHBondContact O-N 3.38Å
483	G	90.2	Very high	80.1	Confident	20 Å²	20	33.7 Å²	33.7	21%	0.206	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	135.5	176.1	0	0	0	0	0	112	C432 C491	C432-G483 CarbonylContact O-C 3.57Å; C432-G483 WeakPolarHBondContact O-CA 3.34Å; G483-C491 WeakPolarHBondContact CA-O 3.38Å
484	V	91.8	Very high	80.8	Confident	9 Å²	9	31.4 Å²	31.4	6%	0.055	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	131.9	175.8	67.6	0	0	0	0	112.5	V486 C491 I493 V575 R577 I582	V484-V486 HydrophobicContact CG1-CG1 4.37Å; V484-C491 HydrophobicContact CG1-CB 3.89Å; V484-C491 PolarHBondContact N-O 3.3Å; V484-C491 PolarHBondContact O-N 2.89Å; V484-I493 HydrophobicContact CG1-CD1 3.77Å; V484-V575 HydrophobicContact CB-CG1 3.93Å; V484-V575 HydrophobicContact CG1-CG1 3.94Å; V484-R577 HydrophobicContact CG2-CB 3.57Å; V484-I582 HydrophobicContact CG1-CD1 4.27Å; V484-I582 HydrophobicContact CG1-CG2 4.14Å
485	A	90.6	Very high	82	Confident	20 Å²	20	24.1 Å²	24.1	17%	0.165	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	128.6	173.5	0	0	0	0	0	110.9	A433 A434 L435 R577	A433-A485 HydrophobicContact CB-CB 4.06Å; A434-A485 WeakPolarHBondContact O-CB 3.5Å; L435-A485 HydrophobicContact CB-CB 4.18Å; L435-A485 HydrophobicContact CD1-CB 4.31Å; A485-R577 VanDerWaalsContact O-CD 3.23Å; A485-R577 WeakPolarHBondContact O-CD 2.94Å; A485-R577 PolarHBondContact O-NE 2.95Å
486	V	85.9	Confident	82.9	Confident	17 Å²	17	20.6 Å²	20.6	10%	0.103	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	175	177.2	-62.3	0	0	0	0	110.4	V484 G488 G489 F522 F563 I582	V484-V486 HydrophobicContact CG1-CG1 4.37Å; V486-G488 PolarHBondContact O-N 3.29Å; V486-G488 VanDerWaalsContact O-N 3.11Å; V486-G489 CarbonylContact C-O 3.6Å; V486-G489 WeakPolarHBondContact CG2-O 3.48Å; V486-G489 PolarHBondContact N-O 2.91Å; V486-G489 PolarHBondContact O-N 2.91Å; V486-F522 HydrophobicContact CG2-CD2 3.91Å; V486-F522 HydrophobicContact CG2-CE2 3.4Å; V486-F522 VanDerWaalsContact CG2-CE2 3.4Å; V486-F522 HydrophobicContact CG2-CZ 4.36Å; V486-F563 HydrophobicContact CG2-CZ 4.18Å; V486-I582 HydrophobicContact CG1-CD1 3.66Å; V486-I582 HydrophobicContact CG1-CG1 4.21Å
487	R	78.9	Confident	83.4	Confident	208 Å²	208	23 Å²	23	79%	0.785	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	116.9	178.9	-175.7	176.9	174.7	166.7	-3.3	109.2
488	G	75.6	Confident	83.4	Confident	22 Å²	22	24 Å²	24	23%	0.227	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	88	6.6	175.9	0	0	0	0	0	115.4	V486 E525	V486-G488 PolarHBondContact O-N 3.29Å; V486-G488 VanDerWaalsContact O-N 3.11Å; G488-E525 PolarHBondContact O-N 3.42Å
489	G	85.8	Confident	82	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-169	178.5	0	0	0	0	0	114.7	V486 F523	V486-G489 CarbonylContact C-O 3.6Å; V486-G489 WeakPolarHBondContact CG2-O 3.48Å; V486-G489 PolarHBondContact N-O 2.91Å; V486-G489 PolarHBondContact O-N 2.91Å; G489-F523 CarbonylContact C-O 3.47Å; G489-F523 WeakPolarHBondContact CA-O 3.17Å
490	V	89.6	Confident	80.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.9	-179.1	178.7	0	0	0	0	109.8	A433 L435 Y440 L442 F523	A433-V490 HydrophobicContact CB-CG1 3.59Å; A433-V490 HydrophobicContact CB-CG2 4.21Å; L435-V490 HydrophobicContact CB-CG2 4.22Å; L435-V490 HydrophobicContact CD2-CG2 4.2Å; Y440-V490 HydrophobicContact CD1-CG2 4.27Å; Y440-V490 HydrophobicContact CD2-CG2 3.62Å; Y440-V490 HydrophobicContact CE2-CG2 4.19Å; Y440-V490 HydrophobicContact CG-CB 4.37Å; Y440-V490 HydrophobicContact CG-CG2 3.68Å; L442-V490 HydrophobicContact CD1-CB 4.28Å; L442-V490 HydrophobicContact CD1-CG1 3.55Å; V490-F523 PolarHBondContact N-O 2.88Å; V490-F523 PolarHBondContact O-N 2.77Å
491	C	89.4	Confident	78.5	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	141.7	176.1	-61.1	0	0	0	0	111.6	G483 V484 I493 V520 L521 F522 F563	G483-C491 WeakPolarHBondContact CA-O 3.38Å; V484-C491 HydrophobicContact CG1-CB 3.89Å; V484-C491 PolarHBondContact N-O 3.3Å; V484-C491 PolarHBondContact O-N 2.89Å; C491-I493 HydrophobicContact CB-CD1 4.33Å; C491-I493 HydrophobicContact CB-CG1 4.24Å; C491-V520 HydrophobicContact CB-CG1 4.4Å; C491-L521 CarbonylContact C-O 3.52Å; C491-L521 WeakPolarHBondContact CA-O 3.28Å; C491-F522 WeakPolarHBondContact SG-CD2 3.31Å; C491-F563 WeakPolarHBondContact SG-CE1 3.39Å; C491-F563 WeakPolarHBondContact SG-CZ 3.35Å
492	A	89.3	Confident	76.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.1	160.9	0	0	0	0	0	108.4	A431 L442 A481 G482 V520 L521	A431-A492 HydrophobicContact CB-CB 3.69Å; L442-A492 HydrophobicContact CB-CB 4.14Å; L442-A492 HydrophobicContact CD2-CB 4.25Å; A481-A492 HydrophobicContact CB-CB 4.37Å; G482-A492 WeakPolarHBondContact O-CA 3.49Å; A492-V520 WeakPolarHBondContact O-CA 3.4Å; A492-L521 HydrophobicContact CB-CB 4.26Å; A492-L521 HydrophobicContact CB-CD1 4.34Å; A492-L521 PolarHBondContact N-O 3.06Å; A492-L521 PolarHBondContact O-N 3.37Å
493	I	90.2	Very high	74.5	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.1	-172.2	-64.9	163.3	0	0	0	109.7	G482 V484 C491 V520 L566 V575 I582 V584 W607	G482-I493 PolarHBondContact N-O 3.4Å; G482-I493 PolarHBondContact O-N 3.38Å; V484-I493 HydrophobicContact CG1-CD1 3.77Å; C491-I493 HydrophobicContact CB-CD1 4.33Å; C491-I493 HydrophobicContact CB-CG1 4.24Å; I493-V520 HydrophobicContact CG1-CB 4.43Å; I493-V520 HydrophobicContact CG1-CG1 3.76Å; I493-V520 HydrophobicContact CG1-CG2 4.16Å; I493-V520 HydrophobicContact CG2-CG2 4.28Å; I493-L566 HydrophobicContact CG2-CD1 3.57Å; I493-L566 HydrophobicContact CG2-CG 4.23Å; I493-V575 HydrophobicContact CB-CG2 4.4Å; I493-V575 HydrophobicContact CD1-CG1 3.87Å; I493-I582 HydrophobicContact CD1-CD1 4.34Å; I493-I582 HydrophobicContact CD1-CG2 3.65Å; I493-V584 HydrophobicContact CG2-CG2 3.82Å; I493-W607 HydrophobicContact CD1-CH2 4.05Å
494	G	88	Confident	72	Confident	2 Å²	2	53.1 Å²	53.1	2%	0.021	27%	0.27	C	S	.	.			trans	69.7	-145.4	179	0	0	0	0	0	112.9	T478 A481 T517 R519 I570	T478-G494 WeakPolarHBondContact CB-O 3.37Å; T478-G494 WeakPolarHBondContact CG2-O 3.31Å; T478-G494 PolarHBondContact OG1-O 2.8Å; A481-G494 VanDerWaalsContact CB-O 3.32Å; A481-G494 WeakPolarHBondContact CB-O 3.15Å; G494-T517 WeakPolarHBondContact CA-O 3.44Å; G494-T517 PolarHBondContact O-OG1 3.32Å; G494-R519 PolarHBondContact N-O 2.98Å; G494-I570 CarbonylContact C-O 3.48Å; G494-I570 VanDerWaalsContact CA-O 3.25Å; G494-I570 WeakPolarHBondContact CA-O 3.01Å
495	G	85.8	Confident	69.4	Low	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.297	C	S	.	.			trans	90.9	178.3	-175.6	0	0	0	0	0	112.7	C479 T517 I570	C479-G495 CarbonylContact O-C 3.55Å; C479-G495 WeakPolarHBondContact O-CA 3.31Å; G495-T517 WeakPolarHBondContact O-CG2 3.45Å; G495-T517 PolarHBondContact O-N 3.34Å; G495-T517 PolarHBondContact O-OG1 2.7Å; G495-T517 VanDerWaalsContact O-OG1 3.11Å; G495-I570 PolarHBondContact N-O 2.94Å
496	Y	81.4	Confident	67	Low	9 Å²	9	60.4 Å²	60.4	4%	0.035	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-90.7	130.6	176.9	-66.6	-69.1	0	0	0	110.5	T478 C479 L480 L514 A516 A571 E588	T478-Y496 VanDerWaalsContact CA-O 3.31Å; T478-Y496 WeakPolarHBondContact CA-O 3.44Å; C479-Y496 PolarHBondContact N-O 2.88Å; C479-Y496 VanDerWaalsContact N-O 3.17Å; C479-Y496 PolarHBondContact O-N 3.46Å; L480-Y496 HydrophobicContact CB-CD2 4.38Å; L480-Y496 HydrophobicContact CD1-CD2 3.92Å; L480-Y496 HydrophobicContact CD1-CE2 3.98Å; Y496-L514 HydrophobicContact CD1-CB 3.41Å; Y496-L514 VanDerWaalsContact CD1-CB 3.41Å; Y496-L514 HydrophobicContact CD1-CD1 4.46Å; Y496-L514 HydrophobicContact CD2-CD1 4.47Å; Y496-L514 HydrophobicContact CE1-CB 3.76Å; Y496-L514 WeakPolarHBondContact CE1-O 3.34Å; Y496-L514 HydrophobicContact CG-CB 3.94Å; Y496-L514 HydrophobicContact CG-CD1 4.14Å; Y496-A516 HydrophobicContact CD1-CB 4.17Å; Y496-A516 HydrophobicContact CE1-CB 3.98Å; Y496-A571 HydrophobicContact CD1-CB 4Å; Y496-A571 HydrophobicContact CD2-CB 3.52Å; Y496-A571 HydrophobicContact CE1-CB 3.8Å; Y496-A571 HydrophobicContact CE2-CB 3.3Å; Y496-A571 HydrophobicContact CG-CB 3.88Å; Y496-A571 VanDerWaalsContact CZ-CB 3.48Å; Y496-E588 WeakPolarHBondContact OH-CG 3.44Å; Y496-E588 PolarHBondContact OH-OE1 3.11Å
497	M	70.9	Confident	64.7	Low	61 Å²	61	65 Å²	65	30%	0.3	35%	0.347	S	S	.	.			trans	-84.8	144.4	164.3	-92.5	177.2	-36.4	0	0	107.9	T478 T517	T478-M497 HydrophobicContact CG2-CG 4.22Å; M497-T517 HydrophobicContact CB-CG2 3.61Å; M497-T517 HydrophobicContact CE-CG2 3.3Å; M497-T517 HydrophobicContact CG-CG2 3.42Å; M497-T517 VanDerWaalsContact CG-CG2 3.42Å; M497-T517 HydrophobicContact SD-CG2 3.77Å
498	R	67.3	Low	63.1	Low	52 Å²	52	60.7 Å²	60.7	20%	0.196	33%	0.331	C	S	.	.			trans	-114.6	126.5	-180	-160.4	175	-167.9	-178.4	-7	110.1	A452 V454	A452-R498 PolarHBondContact O-NH1 3.41Å; A452-R498 PolarHBondContact O-NH2 2.93Å; V454-R498 HydrophobicContact CG2-CB 3.46Å; V454-R498 VanDerWaalsContact CG2-CB 3.46Å; V454-R498 VanDerWaalsContact CG2-CD 3.48Å; V454-R498 HydrophobicContact CG2-CG 4.16Å
499	D	47.7	Very low	61.3	Low	144 Å²	144	65.2 Å²	65.2	77%	0.77	36%	0.355	S	S	*	.			trans	-82.9	137.5	157.1	-110.1	-23.8	0	0	0	108.5	T501	D499-T501 PolarHBondContact O-N 3.07Å
500	T	42.2	Very low	59.1	Low	123 Å²	123	71.9 Å²	71.9	76%	0.755	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	4.1	-163.6	40.1	0	0	0	0	116.5
501	T	37.5	Very low	56.9	Low	104 Å²	104	76.1 Å²	76.1	64%	0.638	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-9.7	-162.9	55.2	0	0	0	0	117.4	D499	D499-T501 PolarHBondContact O-N 3.07Å
502	K	42.6	Very low	54.9	Low	143 Å²	143	82.6 Å²	82.6	62%	0.622	44%	0.442	S	S	*	.			trans	-137.7	91.7	-176.2	-65.3	-172.1	179.1	-173.2	0	114.1
503	F	43.3	Very low	53	Low	58 Å²	58	88 Å²	88	25%	0.254	48%	0.476	S	S	.	.			trans	-166.1	111.1	152.9	-141.8	-93.1	0	0	0	109.8	L511	F503-L511 HydrophobicContact CE2-CD2 3.86Å; F503-L511 HydrophobicContact CE2-CG 4.36Å; F503-L511 HydrophobicContact CZ-CD2 4.38Å
504	L	37.3	Very low	51.7	Low	137 Å²	137	89.9 Å²	89.9	72%	0.717	49%	0.485	S	S	*	.			trans	-142.2	103.5	160.9	-80.5	156.7	0	0	0	100.3
505	D	37.1	Very low	50.6	Low	114 Å²	114	95.2 Å²	95.2	61%	0.61	51%	0.513	S	S	*	.				-160.2	162.8	65	-73.3	-42.7	0	0	0	109.7	N507	D505-N507 PolarHBondContact O-N 3.34Å
506	G	41.7	Very low	50.4	Low	68 Å²	68	95.2 Å²	95.2	70%	0.701	51%	0.513	S	S	*	.			trans	-63.7	32.1	-179.8	0	0	0	0	0	116.7
507	N	38	Very low	50.4	Low	115 Å²	115	94.8 Å²	94.8	62%	0.615	51%	0.512	S	S	*	.			trans	-95.6	125	173.3	-84.5	-16.1	0	0	0	111.4	D505 T509	D505-N507 PolarHBondContact O-N 3.34Å; N507-T509 PolarHBondContact O-N 3.07Å
508	Y	44.8	Very low	50.9	Low	117 Å²	117	92.4 Å²	92.4	46%	0.459	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	14.9	-172.6	-64.3	-93.4	0	0	0	115.1	R428	R428-Y508 VanDerWaalsContact NH1-CE1 3.33Å
509	T	37.9	Very low	51.7	Low	117 Å²	117	96.1 Å²	96.1	72%	0.718	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.7	-14.5	-164.7	50.6	0	0	0	0	115.6	N507	N507-T509 PolarHBondContact O-N 3.07Å
510	N	38.3	Very low	53.5	Low	140 Å²	140	90.3 Å²	90.3	75%	0.749	49%	0.487	S	S	*	.			trans	-119.7	88.9	177.9	-86.7	-20.5	0	0	0	110.5
511	L	44.4	Very low	55.6	Low	89 Å²	89	86.1 Å²	86.1	47%	0.466	46%	0.459	S	S	.	.			trans	-90.5	107.9	162.2	-84.8	142.2	0	0	0	107.3	F503 L514	F503-L511 HydrophobicContact CE2-CD2 3.86Å; F503-L511 HydrophobicContact CE2-CG 4.36Å; F503-L511 HydrophobicContact CZ-CD2 4.38Å; L511-L514 HydrophobicContact CD2-CD1 3.35Å; L511-L514 HydrophobicContact CD2-CG 3.9Å
512	E	46.9	Very low	57.9	Low	137 Å²	137	84.1 Å²	84.1	64%	0.64	44%	0.442	S	S	*	.			trans	-49.2	143	151	-75.2	-171	158.1	0	0	107.9	L514	E512-L514 PolarHBondContact O-N 3.48Å
513	T	50.3	Low	59.9	Low	114 Å²	114	78.5 Å²	78.5	70%	0.699	42%	0.418	S	S	*	.			trans	-58	97.8	-169.9	47.6	0	0	0	0	111.6
514	L	61.4	Low	61.8	Low	43 Å²	43	78.7 Å²	78.7	23%	0.225	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-75.6	137.1	169.5	-66.3	178.8	0	0	0	109.1	Y496 L511 E512	Y496-L514 HydrophobicContact CD1-CB 3.41Å; Y496-L514 VanDerWaalsContact CD1-CB 3.41Å; Y496-L514 HydrophobicContact CD1-CD1 4.46Å; Y496-L514 HydrophobicContact CD2-CD1 4.47Å; Y496-L514 HydrophobicContact CE1-CB 3.76Å; Y496-L514 WeakPolarHBondContact CE1-O 3.34Å; Y496-L514 HydrophobicContact CG-CB 3.94Å; Y496-L514 HydrophobicContact CG-CD1 4.14Å; L511-L514 HydrophobicContact CD2-CD1 3.35Å; L511-L514 HydrophobicContact CD2-CG 3.9Å; E512-L514 PolarHBondContact O-N 3.48Å
515	D	66.6	Low	63.3	Low	114 Å²	114	74.1 Å²	74.1	61%	0.61	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-82.1	118.9	174.7	-91.6	-23.2	0	0	0	110.3
516	A	80.6	Confident	64.3	Low	0 Å²	0	72.4 Å²	72.4	0%	0	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-66.6	164.7	172.8	0	0	0	0	0	110.7	Y496 R569 A571 N589	Y496-A516 HydrophobicContact CD1-CB 4.17Å; Y496-A516 HydrophobicContact CE1-CB 3.98Å; A516-R569 HydrophobicContact CB-CB 4Å; A516-R569 VanDerWaalsContact O-CB 3.29Å; A516-R569 WeakPolarHBondContact O-CB 3.22Å; A516-R569 VanDerWaalsContact O-CD 3.25Å; A516-R569 WeakPolarHBondContact O-CD 3.49Å; A516-R569 VanDerWaalsContact O-CG 3.26Å; A516-R569 WeakPolarHBondContact O-CG 3.32Å; A516-R569 PolarHBondContact O-NH1 3.33Å; A516-A571 HydrophobicContact CB-CB 3.89Å; A516-N589 HydrophobicContact CB-CB 4.02Å; A516-N589 VanDerWaalsContact CB-OD1 3.29Å; A516-N589 WeakPolarHBondContact CB-OD1 3.43Å; A516-N589 PolarHBondContact N-OD1 3.14Å
517	T	82.5	Confident	64.4	Low	0 Å²	0	77 Å²	77	0%	0	40%	0.397	C	S	.	.			trans	-118.3	150.8	179.6	76.1	0	0	0	0	111.6	G494 G495 M497 R519 I570	G494-T517 WeakPolarHBondContact CA-O 3.44Å; G494-T517 PolarHBondContact O-OG1 3.32Å; G495-T517 WeakPolarHBondContact O-CG2 3.45Å; G495-T517 PolarHBondContact O-N 3.34Å; G495-T517 PolarHBondContact O-OG1 2.7Å; G495-T517 VanDerWaalsContact O-OG1 3.11Å; M497-T517 HydrophobicContact CB-CG2 3.61Å; M497-T517 HydrophobicContact CE-CG2 3.3Å; M497-T517 HydrophobicContact CG-CG2 3.42Å; M497-T517 VanDerWaalsContact CG-CG2 3.42Å; M497-T517 HydrophobicContact SD-CG2 3.77Å; T517-R519 VanDerWaalsContact C-N 3.34Å; T517-I570 PolarHBondContact O-N 2.76Å; T517-I570 VanDerWaalsContact O-N 3.11Å
518	G	81.2	Confident	64.3	Low	12 Å²	12	73.7 Å²	73.7	12%	0.124	39%	0.39	C	S	.	.			trans	-96.2	11.6	166.3	0	0	0	0	0	112.2	G565 L566	G518-G565 CarbonylContact O-C 3.57Å; G518-G565 WeakPolarHBondContact O-CA 3.18Å; G518-L566 PolarHBondContact O-N 2.78Å
519	R	83.5	Confident	63.7	Low	130 Å²	130	74 Å²	74	49%	0.491	41%	0.405	S	S	.	.			trans	-75.1	148.4	-173.4	-71.5	-173.4	177.6	179.8	0.3	110.7	G494 T517	G494-R519 PolarHBondContact N-O 2.98Å; T517-R519 VanDerWaalsContact C-N 3.34Å
520	V	86.4	Confident	63.6	Low	22 Å²	22	69.9 Å²	69.9	13%	0.133	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109.4	173.4	-179.6	0	0	0	0	106.8	C491 A492 I493 F563 W607	C491-V520 HydrophobicContact CB-CG1 4.4Å; A492-V520 WeakPolarHBondContact O-CA 3.4Å; I493-V520 HydrophobicContact CG1-CB 4.43Å; I493-V520 HydrophobicContact CG1-CG1 3.76Å; I493-V520 HydrophobicContact CG1-CG2 4.16Å; I493-V520 HydrophobicContact CG2-CG2 4.28Å; V520-F563 HydrophobicContact CB-CB 3.79Å; V520-F563 HydrophobicContact CG1-CB 3.54Å; V520-F563 HydrophobicContact CG1-CD1 3.75Å; V520-F563 HydrophobicContact CG1-CG 3.73Å; V520-W607 HydrophobicContact CG2-CZ2 3.94Å
521	L	85.5	Confident	63.5	Low	34 Å²	34	68.8 Å²	68.8	18%	0.178	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.5	172.8	-53.9	173.4	0	0	0	107.9	G476 C491 A492	G476-L521 WeakPolarHBondContact O-CD1 3.38Å; C491-L521 CarbonylContact C-O 3.52Å; C491-L521 WeakPolarHBondContact CA-O 3.28Å; A492-L521 HydrophobicContact CB-CB 4.26Å; A492-L521 HydrophobicContact CB-CD1 4.34Å; A492-L521 PolarHBondContact N-O 3.06Å; A492-L521 PolarHBondContact O-N 3.37Å
522	F	86.1	Confident	63.2	Low	63 Å²	63	72 Å²	72	28%	0.276	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.1	174.2	174.2	-122.4	0	0	0	109.7	V486 C491 R524 F563	V486-F522 HydrophobicContact CG2-CD2 3.91Å; V486-F522 HydrophobicContact CG2-CE2 3.4Å; V486-F522 VanDerWaalsContact CG2-CE2 3.4Å; V486-F522 HydrophobicContact CG2-CZ 4.36Å; C491-F522 WeakPolarHBondContact SG-CD2 3.31Å; F522-R524 HydrophobicContact CD1-CB 4.42Å; F522-R524 HydrophobicContact CE1-CB 3.8Å; F522-R524 HydrophobicContact CE1-CG 4.2Å; F522-R524 HydrophobicContact CZ-CB 4.13Å; F522-R524 HydrophobicContact CZ-CG 4.37Å; F522-F563 HydrophobicContact CB-CD2 3.59Å; F522-F563 HydrophobicContact CB-CE2 3.52Å; F522-F563 HydrophobicContact CB-CZ 4.38Å; F522-F563 HydrophobicContact CD1-CD2 4.24Å; F522-F563 AromaticContact CD1-CE2 3.6Å; F522-F563 HydrophobicContact CD1-CE2 3.6Å; F522-F563 AromaticContact CD2-CE2 3.67Å; F522-F563 HydrophobicContact CD2-CE2 3.67Å; F522-F563 AromaticContact CD2-CZ 3.94Å; F522-F563 HydrophobicContact CD2-CZ 3.94Å; F522-F563 HydrophobicContact CE1-CE2 4.18Å; F522-F563 HydrophobicContact CE2-CE2 4.24Å; F522-F563 HydrophobicContact CE2-CZ 4.34Å; F522-F563 AromaticContact CG-CD2 3.9Å; F522-F563 HydrophobicContact CG-CD2 3.9Å; F522-F563 AromaticContact CG-CE2 3.29Å; F522-F563 HydrophobicContact CG-CE2 3.29Å; F522-F563 HydrophobicContact CG-CZ 4.05Å; F522-F563 HydrophobicContact CZ-CE2 4.47Å
523	F	85.1	Confident	63.1	Low	25 Å²	25	74.1 Å²	74.1	11%	0.11	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	114.2	171.6	-178.5	-96.8	0	0	0	109.2	Y440 L442 V458 I460 V471 G489 V490	Y440-F523 HydrophobicContact CD1-CD1 4.08Å; Y440-F523 HydrophobicContact CD1-CE1 4.21Å; Y440-F523 AromaticContact CE1-CD1 3.97Å; Y440-F523 HydrophobicContact CE1-CD1 3.97Å; Y440-F523 AromaticContact CE1-CE1 3.77Å; Y440-F523 HydrophobicContact CE1-CE1 3.77Å; L442-F523 HydrophobicContact CD2-CB 4.06Å; V458-F523 HydrophobicContact CB-CD2 4.45Å; V458-F523 HydrophobicContact CG2-CB 4.47Å; V458-F523 HydrophobicContact CG2-CD2 3.82Å; V458-F523 HydrophobicContact CG2-CE2 4.34Å; V458-F523 HydrophobicContact CG2-CG 4.17Å; I460-F523 HydrophobicContact CD1-CE1 3.78Å; I460-F523 HydrophobicContact CD1-CZ 3.75Å; V471-F523 HydrophobicContact CB-CE2 4.16Å; V471-F523 HydrophobicContact CG1-CE2 3.98Å; V471-F523 HydrophobicContact CG2-CE2 4.33Å; V471-F523 HydrophobicContact CG2-CZ 4.22Å; G489-F523 CarbonylContact C-O 3.47Å; G489-F523 WeakPolarHBondContact CA-O 3.17Å; V490-F523 PolarHBondContact N-O 2.88Å; V490-F523 PolarHBondContact O-N 2.77Å
524	R	81.3	Confident	62.4	Low	61 Å²	61	75.1 Å²	75.1	23%	0.23	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130	180	-174.3	176.7	172.6	156.3	2.2	110.7	F522 G526	F522-R524 HydrophobicContact CD1-CB 4.42Å; F522-R524 HydrophobicContact CE1-CB 3.8Å; F522-R524 HydrophobicContact CE1-CG 4.2Å; F522-R524 HydrophobicContact CZ-CB 4.13Å; F522-R524 HydrophobicContact CZ-CG 4.37Å; R524-G526 PolarHBondContact O-N 3.42Å
525	E	69.9	Low	61.4	Low	41 Å²	41	76.4 Å²	76.4	19%	0.192	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	120.6	174	-163.4	174.6	-150.9	0	0	109.3	R436 R438 Y440 G488	R436-E525 VanDerWaalsContact CD-OE2 3.28Å; R436-E525 WeakPolarHBondContact CD-OE2 3.46Å; R436-E525 IonicContact CZ-OE2 3.91Å; R436-E525 IonicContact NE-OE2 3.09Å; R436-E525 IonicContact NH1-OE2 3.82Å; R436-E525 PolarHBondContact NH1-OE2 3.13Å; R438-E525 IonicContact CZ-OE1 3.55Å; R438-E525 IonicContact NE-OE1 2.78Å; R438-E525 IonicContact NH1-OE1 3.51Å; R438-E525 PolarHBondContact NH1-OE1 2.85Å; Y440-E525 PolarHBondContact OH-OE1 3.32Å; G488-E525 PolarHBondContact O-N 3.42Å
526	G	57.1	Low	59.8	Low	79 Å²	79	76.4 Å²	76.4	81%	0.814	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.5	-7.1	175.7	0	0	0	0	0	117.3	R524	R524-G526 PolarHBondContact O-N 3.42Å
527	R	44.5	Very low	57.4	Low	164 Å²	164	80.7 Å²	80.7	62%	0.619	45%	0.453	S	S	*	.			trans	-119.3	76.2	165	-78.6	-165	-173.8	-172.1	0.6	109.2	T529	R527-T529 PolarHBondContact O-N 2.79Å
528	G	36.5	Very low	54.8	Low	45 Å²	45	83.9 Å²	83.9	46%	0.464	49%	0.486	S	S	.	.			trans	-82.4	94.7	162.4	0	0	0	0	0	108.8	G530	G528-G530 PolarHBondContact O-N 3.39Å
529	T	31.8	Very low	52.2	Low	125 Å²	125	87 Å²	87	77%	0.767	52%	0.518	S	S	*	.			trans	-72.4	83.9	150.8	47.8	0	0	0	0	105.8	R527	R527-T529 PolarHBondContact O-N 2.79Å
530	G	35.4	Very low	49.7	Very low	30 Å²	30	87.4 Å²	87.4	31%	0.309	53%	0.534	S	S	.	.	S	Bend	trans	162.2	112	-175.7	0	0	0	0	0	109.2	G528 E532	G528-G530 PolarHBondContact O-N 3.39Å; G530-E532 PolarHBondContact O-N 3.2Å; G530-E532 VanDerWaalsContact O-N 3.07Å
531	V	36.7	Very low	46.6	Very low	116 Å²	116	95.3 Å²	95.3	70%	0.703	57%	0.572	S	S	*	*			trans	-43.7	113.5	178.1	-178.1	0	0	0	0	109.6	R533	V531-R533 HydrophobicContact CG1-CG 4.05Å; V531-R533 PolarHBondContact O-N 3.47Å
532	E	37.1	Very low	44	Very low	156 Å²	156	99.8 Å²	99.8	73%	0.729	60%	0.601	S	S	*	*			trans	-61	105.7	169.5	-71	-175.7	162.8	0	0	107.2	T469 G530	T469-E532 HydrophobicContact CG2-CB 4.4Å; T469-E532 HydrophobicContact CG2-CG 4.4Å; G530-E532 PolarHBondContact O-N 3.2Å; G530-E532 VanDerWaalsContact O-N 3.07Å
533	R	45.1	Very low	41.2	Very low	183 Å²	183	102.2 Å²	102.2	69%	0.691	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102	106.7	169.9	-73.7	-173.7	174.5	173.4	-1	107.4	V531 V535	V531-R533 HydrophobicContact CG1-CG 4.05Å; V531-R533 PolarHBondContact O-N 3.47Å; R533-V535 PolarHBondContact O-N 3.48Å
534	E	37.2	Very low	38.3	Very low	134 Å²	134	105.5 Å²	105.5	63%	0.626	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65	124.6	167.3	-166.9	167.8	-155.9	0	0	108
535	V	39.8	Very low	35.8	Very low	71 Å²	71	112.1 Å²	112.1	43%	0.43	69%	0.691	S	S	.	*			trans	-104.3	96.4	179.3	-177.4	0	0	0	0	107.4	W468 R533	W468-V535 PolarHBondContact O-N 2.82Å; R533-V535 PolarHBondContact O-N 3.48Å
536	T	32.1	Very low	33.7	Very low	114 Å²	114	119.1 Å²	119.1	70%	0.699	72%	0.724	S	S	*	*			trans	-76.3	132.3	166.4	47.6	0	0	0	0	109	G538	T536-G538 PolarHBondContact O-N 2.91Å
537	G	30.5	Very low	32.3	Very low	89 Å²	89	127.2 Å²	127.2	92%	0.918	73%	0.73	S	S	*	*	S	Bend	trans	-67.4	103.9	-175.9	0	0	0	0	0	112
538	G	29	Very low	31.3	Very low	68 Å²	68	122.8 Å²	122.8	70%	0.701	74%	0.735	S	S	*	*	S	Bend	trans	127.6	118.6	162.2	0	0	0	0	0	114.6	T536	T536-G538 PolarHBondContact O-N 2.91Å
539	G	25.4	Very low	30.6	Very low	78 Å²	78	127 Å²	127	80%	0.804	75%	0.751	S	S	*	*			trans	68.2	119	152.7	0	0	0	0	0	118	M541	G539-M541 PolarHBondContact O-N 3.14Å
540	V	31.3	Very low	30.2	Very low	137 Å²	137	125.5 Å²	125.5	83%	0.83	75%	0.752	S	S	*	*			trans	-46.1	127.2	171.5	176.9	0	0	0	0	113.1
541	M	22.4	Very low	29.6	Very low	189 Å²	189	130 Å²	130	93%	0.931	78%	0.777	S	S	*	*			trans	-164.7	156	137.9	-111.9	-178.9	-82.9	0	0	112.3	G539	G539-M541 PolarHBondContact O-N 3.14Å
542	V	29.9	Very low	29.1	Very low	128 Å²	128	128.3 Å²	128.3	78%	0.776	78%	0.783	S	S	*	*			trans	-94.6	155.9	-161.6	178.7	0	0	0	0	112.6
543	S	26.3	Very low	28.5	Very low	113 Å²	113	123.6 Å²	123.6	79%	0.79	78%	0.776	S	S	*	*			trans	85.6	121.6	160.1	78.5	0	0	0	0	119.2
544	A	24.6	Very low	27.7	Very low	95 Å²	95	118.5 Å²	118.5	79%	0.785	77%	0.769	S	S	*	*				-169.6	125.5	127.2	0	0	0	0	0	109.7	Q546	A544-Q546 PolarHBondContact O-N 3.44Å
545	E	29.3	Very low	27.4	Very low	199 Å²	199	117.3 Å²	117.3	93%	0.93	77%	0.767	S	S	*	*			trans	-61.6	123.2	166.3	-66.6	172.4	126.2	0	0	109.8
546	Q	25	Very low	26.9	Very low	189 Å²	189	120 Å²	120	88%	0.883	77%	0.769	S	S	*	*			trans	-133.7	117	156.6	-79	-170.4	-11.6	0	0	109.7	A544 G548	A544-Q546 PolarHBondContact O-N 3.44Å; Q546-G548 PolarHBondContact O-N 2.53Å
547	R	27.9	Very low	27	Very low	249 Å²	249	115.6 Å²	115.6	94%	0.94	75%	0.745	S	S	*	*			trans	-58.3	101.8	172.7	-74.3	174.8	170.5	173.9	-4	109.6	V549	R547-V549 PolarHBondContact O-N 2.83Å
548	G	23.1	Very low	27.3	Very low	71 Å²	71	116.1 Å²	116.1	73%	0.732	73%	0.732	S	S	*	*			trans	-72.4	116.4	163.4	0	0	0	0	0	109.6	Q546 A550	Q546-G548 PolarHBondContact O-N 2.53Å; G548-A550 PolarHBondContact O-N 2.95Å
549	V	23	Very low	27.8	Very low	132 Å²	132	117.7 Å²	117.7	80%	0.8	73%	0.732	S	S	*	*			trans	-59	108.1	165.9	174.7	0	0	0	0	107.4	R547 C551	R547-V549 PolarHBondContact O-N 2.83Å; V549-C551 PolarHBondContact O-N 3.03Å
550	A	23.6	Very low	29.2	Very low	94 Å²	94	119 Å²	119	78%	0.777	73%	0.726	S	S	*	*			trans	-68.1	101.3	171.4	0	0	0	0	0	108.2	G548 G552	G548-A550 PolarHBondContact O-N 2.95Å; A550-G552 PolarHBondContact O-N 3.07Å
551	C	23.2	Very low	30.4	Very low	124 Å²	124	115.4 Å²	115.4	84%	0.838	71%	0.705	S	S	*	*			trans	-65.8	88	162.8	-67.3	0	0	0	0	107.9	V549 G553	V549-C551 PolarHBondContact O-N 3.03Å; C551-G553 PolarHBondContact O-N 3.43Å
552	G	25.2	Very low	32.6	Very low	81 Å²	81	112 Å²	112	84%	0.835	69%	0.694	S	S	*	*			trans	-66.9	77.2	170.7	0	0	0	0	0	110.5	A550	A550-G552 PolarHBondContact O-N 3.07Å
553	G	25.1	Very low	35	Very low	57 Å²	57	107.2 Å²	107.2	59%	0.588	66%	0.663	S	S	*	*			trans	-88.8	114.9	163.4	0	0	0	0	0	108.7	C551 D555	C551-G553 PolarHBondContact O-N 3.43Å; G553-D555 PolarHBondContact O-N 2.81Å
554	S	27.6	Very low	37.8	Very low	77 Å²	77	102.9 Å²	102.9	54%	0.538	63%	0.632	S	S	.	*			trans	-61.9	81	161.7	175.5	0	0	0	0	108.6	R556	S554-R556 PolarHBondContact O-N 3.31Å
555	D	31.1	Very low	40.6	Very low	108 Å²	108	100.6 Å²	100.6	58%	0.578	62%	0.618	S	S	*	*			trans	-78.1	80.7	176	-158.7	37.2	0	0	0	106.4	G553 A557	G553-D555 PolarHBondContact O-N 2.81Å; D555-A557 PolarHBondContact O-N 2.81Å
556	R	29.9	Very low	43.4	Very low	128 Å²	128	91.7 Å²	91.7	48%	0.483	58%	0.577	S	S	.	*			trans	-71	71.3	165.3	-140.2	179.7	-171.8	177.7	5.5	107.7	V9 T10 S554	V9-R556 PolarHBondContact O-NH1 3.1Å; T10-R556 VanDerWaalsContact C-NH2 3.34Å; T10-R556 PolarHBondContact O-NH2 3.28Å; S554-R556 PolarHBondContact O-N 3.31Å
557	A	33.3	Very low	46.3	Very low	22 Å²	22	86.9 Å²	86.9	18%	0.182	56%	0.561	C	S	.	*			trans	-50.1	145.6	178.2	0	0	0	0	0	110.9	D555 S559	D555-A557 PolarHBondContact O-N 2.81Å; A557-S559 PolarHBondContact O-N 2.81Å
558	P	36.9	Very low	49	Very low	99 Å²	99	80.1 Å²	80.1	64%	0.643	54%	0.536	S	S	*	.	S	Bend	trans	-51.9	138.8	163.4	23	-31.9	0	0	0	108.5
559	S	40.6	Very low	52.1	Low	101 Å²	101	82.7 Å²	82.7	71%	0.706	52%	0.523	S	S	*	.			trans	-39.5	138.5	-176.9	36.3	0	0	0	0	111.9	A557 V561	A557-S559 PolarHBondContact O-N 2.81Å; S559-V561 PolarHBondContact O-N 2.8Å
560	P	52.8	Low	55.1	Low	105 Å²	105	76.6 Å²	76.6	68%	0.682	49%	0.486	S	S	*	.			trans	-55.1	119.9	-176.3	22.2	-31.6	0	0	0	108.6	V562	P560-V562 PolarHBondContact O-N 2.93Å
561	V	57.8	Low	58.1	Low	63 Å²	63	72.1 Å²	72.1	38%	0.382	45%	0.45	S	S	.	.			trans	-66.1	101.4	174.9	178.8	0	0	0	0	106.4	S559 F563 W600	S559-V561 PolarHBondContact O-N 2.8Å; V561-F563 HydrophobicContact CB-CE2 4.1Å; V561-F563 HydrophobicContact CG1-CD2 4.24Å; V561-F563 HydrophobicContact CG1-CE1 4.5Å; V561-F563 HydrophobicContact CG1-CE2 3.73Å; V561-F563 HydrophobicContact CG1-CZ 3.88Å; V561-F563 VanDerWaalsContact O-CD2 3.26Å; V561-F563 WeakPolarHBondContact O-CD2 3.29Å; V561-F563 WeakPolarHBondContact O-CE2 3.25Å; V561-F563 PolarHBondContact O-N 2.82Å; V561-W600 HydrophobicContact CG1-CH2 3.72Å; V561-W600 HydrophobicContact CG1-CZ2 4.37Å
562	V	68.4	Low	61	Low	117 Å²	117	66.7 Å²	66.7	71%	0.709	41%	0.414	S	S	*	.			trans	-77.9	115	175.1	-178.3	0	0	0	0	107.6	P560 P564	P560-V562 PolarHBondContact O-N 2.93Å; V562-P564 WeakPolarHBondContact O-CD 3.26Å
563	F	79.8	Confident	63.9	Low	28 Å²	28	63.5 Å²	63.5	12%	0.123	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-82.6	119.7	175.2	-70.6	-95.6	0	0	0	108.9	V486 C491 V520 F522 V561 I582 W600	V486-F563 HydrophobicContact CG2-CZ 4.18Å; C491-F563 WeakPolarHBondContact SG-CE1 3.39Å; C491-F563 WeakPolarHBondContact SG-CZ 3.35Å; V520-F563 HydrophobicContact CB-CB 3.79Å; V520-F563 HydrophobicContact CG1-CB 3.54Å; V520-F563 HydrophobicContact CG1-CD1 3.75Å; V520-F563 HydrophobicContact CG1-CG 3.73Å; F522-F563 HydrophobicContact CB-CD2 3.59Å; F522-F563 HydrophobicContact CB-CE2 3.52Å; F522-F563 HydrophobicContact CB-CZ 4.38Å; F522-F563 HydrophobicContact CD1-CD2 4.24Å; F522-F563 AromaticContact CD1-CE2 3.6Å; F522-F563 HydrophobicContact CD1-CE2 3.6Å; F522-F563 AromaticContact CD2-CE2 3.67Å; F522-F563 HydrophobicContact CD2-CE2 3.67Å; F522-F563 AromaticContact CD2-CZ 3.94Å; F522-F563 HydrophobicContact CD2-CZ 3.94Å; F522-F563 HydrophobicContact CE1-CE2 4.18Å; F522-F563 HydrophobicContact CE2-CE2 4.24Å; F522-F563 HydrophobicContact CE2-CZ 4.34Å; F522-F563 AromaticContact CG-CD2 3.9Å; F522-F563 HydrophobicContact CG-CD2 3.9Å; F522-F563 AromaticContact CG-CE2 3.29Å; F522-F563 HydrophobicContact CG-CE2 3.29Å; F522-F563 HydrophobicContact CG-CZ 4.05Å; F522-F563 HydrophobicContact CZ-CE2 4.47Å; V561-F563 HydrophobicContact CB-CE2 4.1Å; V561-F563 HydrophobicContact CG1-CD2 4.24Å; V561-F563 HydrophobicContact CG1-CE1 4.5Å; V561-F563 HydrophobicContact CG1-CE2 3.73Å; V561-F563 HydrophobicContact CG1-CZ 3.88Å; V561-F563 VanDerWaalsContact O-CD2 3.26Å; V561-F563 WeakPolarHBondContact O-CD2 3.29Å; V561-F563 WeakPolarHBondContact O-CE2 3.25Å; V561-F563 PolarHBondContact O-N 2.82Å; F563-I582 HydrophobicContact CE1-CD1 4.07Å; F563-W600 HydrophobicContact CD1-CE3 4.33Å; F563-W600 AromaticContact CD1-CH2 3.57Å; F563-W600 HydrophobicContact CD1-CH2 3.57Å; F563-W600 HydrophobicContact CD1-CZ2 4.23Å; F563-W600 AromaticContact CD1-CZ3 3.66Å; F563-W600 HydrophobicContact CD1-CZ3 3.66Å; F563-W600 HydrophobicContact CE1-CE3 4.29Å; F563-W600 AromaticContact CE1-CH2 3.49Å; F563-W600 HydrophobicContact CE1-CH2 3.49Å; F563-W600 VanDerWaalsContact CE1-CH2 3.49Å; F563-W600 AromaticContact CE1-CZ3 3.36Å; F563-W600 HydrophobicContact CE1-CZ3 3.36Å; F563-W600 HydrophobicContact CG-CH2 4.32Å; F563-W600 HydrophobicContact CZ-CH2 4.15Å; F563-W600 HydrophobicContact CZ-CZ3 4.26Å
564	P	85.1	Confident	66.9	Low	21 Å²	21	60.9 Å²	60.9	14%	0.136	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-67.8	147.8	173.6	28.2	-31.9	0	0	0	110	V562 W600 R605 W607	V562-P564 WeakPolarHBondContact O-CD 3.26Å; P564-W600 VanDerWaalsContact CD-NE1 3.29Å; P564-W600 VanDerWaalsContact CG-NE1 3.27Å; P564-R605 VanDerWaalsContact CB-O 3.29Å; P564-R605 WeakPolarHBondContact CB-O 3.29Å; P564-W607 PolarHBondContact O-NE1 2.86Å
565	G	84.8	Confident	70	Confident	47 Å²	47	58 Å²	58	49%	0.485	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-63.3	148.5	168.9	0	0	0	0	0	111.4	G518	G518-G565 CarbonylContact O-C 3.57Å; G518-G565 WeakPolarHBondContact O-CA 3.18Å
566	L	87.9	Confident	73	Confident	13 Å²	13	53 Å²	53	7%	0.068	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.9	138.3	172.1	-72.5	165.7	0	0	0	110.2	I493 G518 R568 V584 W607	I493-L566 HydrophobicContact CG2-CD1 3.57Å; I493-L566 HydrophobicContact CG2-CG 4.23Å; G518-L566 PolarHBondContact O-N 2.78Å; L566-R568 WeakPolarHBondContact CB-O 3.33Å; L566-R568 PolarHBondContact O-N 2.95Å; L566-V584 HydrophobicContact CD1-CG1 4.49Å; L566-V584 HydrophobicContact CD2-CB 4.47Å; L566-V584 HydrophobicContact CD2-CG2 4.16Å; L566-W607 HydrophobicContact CD2-CD2 3.44Å; L566-W607 VanDerWaalsContact CD2-CD2 3.44Å; L566-W607 HydrophobicContact CD2-CE3 3.73Å; L566-W607 HydrophobicContact CD2-CG 3.88Å; L566-W607 HydrophobicContact CD2-CH2 4.2Å; L566-W607 HydrophobicContact CD2-CZ2 3.92Å; L566-W607 HydrophobicContact CD2-CZ3 4.11Å; L566-W607 HydrophobicContact CG-CD2 4.45Å; L566-W607 HydrophobicContact CG-CZ2 4.38Å
567	P	85.2	Confident	75.9	Confident	87 Å²	87	52.6 Å²	52.6	57%	0.565	31%	0.305	S	S	*	.	S	Bend	trans	-60.3	-26.3	175.8	-24.2	33	0	0	0	113.3	Y598 W607	P567-Y598 HydrophobicContact CB-CE1 4.38Å; P567-Y598 HydrophobicContact CG-CD1 4.44Å; P567-Y598 HydrophobicContact CG-CE1 4.11Å; P567-W607 HydrophobicContact CG-CB 4.02Å
568	R	85.4	Confident	78.7	Confident	108 Å²	108	52.7 Å²	52.7	41%	0.408	30%	0.301	S	S	.	.	S	Bend	trans	-118.3	147.3	174.3	-70.2	-170	177.2	-156.6	-1.6	110	L566 I570 Y594 Y598	L566-R568 WeakPolarHBondContact CB-O 3.33Å; L566-R568 PolarHBondContact O-N 2.95Å; R568-I570 HydrophobicContact CB-CD1 4.26Å; R568-I570 HydrophobicContact CB-CG1 4.08Å; R568-Y594 VanDerWaalsContact NH1-CE1 3.33Å; R568-Y598 VanDerWaalsContact CD-OH 3.23Å; R568-Y598 WeakPolarHBondContact CD-OH 3.29Å; R568-Y598 WeakPolarHBondContact CG-OH 3.14Å; R568-Y598 PolarHBondContact NE-OH 3.08Å
569	R	87.6	Confident	81.1	Confident	124 Å²	124	54 Å²	54	47%	0.468	30%	0.297	S	S	.	.			trans	-75.2	119.9	169.2	-71.2	171.8	-178.6	-90.4	4.1	108	A516	A516-R569 HydrophobicContact CB-CB 4Å; A516-R569 VanDerWaalsContact O-CB 3.29Å; A516-R569 WeakPolarHBondContact O-CB 3.22Å; A516-R569 VanDerWaalsContact O-CD 3.25Å; A516-R569 WeakPolarHBondContact O-CD 3.49Å; A516-R569 VanDerWaalsContact O-CG 3.26Å; A516-R569 WeakPolarHBondContact O-CG 3.32Å; A516-R569 PolarHBondContact O-NH1 3.33Å
570	I	86.5	Confident	83.2	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	29%	0.294	C	S	.	.			trans	-137.3	127.7	-173	-60.1	176.2	0	0	0	108.8	G494 G495 T517 R568 V584 G586 Y594 Y598	G494-I570 CarbonylContact C-O 3.48Å; G494-I570 VanDerWaalsContact CA-O 3.25Å; G494-I570 WeakPolarHBondContact CA-O 3.01Å; G495-I570 PolarHBondContact N-O 2.94Å; T517-I570 PolarHBondContact O-N 2.76Å; T517-I570 VanDerWaalsContact O-N 3.11Å; R568-I570 HydrophobicContact CB-CD1 4.26Å; R568-I570 HydrophobicContact CB-CG1 4.08Å; I570-V584 HydrophobicContact CD1-CG1 4.3Å; I570-G586 VanDerWaalsContact CG2-O 3.27Å; I570-G586 WeakPolarHBondContact CG2-O 3.05Å; I570-Y594 HydrophobicContact CG1-CD2 4.26Å; I570-Y594 HydrophobicContact CG1-CE2 4.46Å; I570-Y598 HydrophobicContact CD1-CD2 3.93Å; I570-Y598 HydrophobicContact CD1-CE2 3.83Å
571	A	86.1	Confident	85.1	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.008	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-119	160.2	167.8	0	0	0	0	0	110.2	Y496 A516 G573 G587 E588	Y496-A571 HydrophobicContact CD1-CB 4Å; Y496-A571 HydrophobicContact CD2-CB 3.52Å; Y496-A571 HydrophobicContact CE1-CB 3.8Å; Y496-A571 HydrophobicContact CE2-CB 3.3Å; Y496-A571 HydrophobicContact CG-CB 3.88Å; Y496-A571 VanDerWaalsContact CZ-CB 3.48Å; A516-A571 HydrophobicContact CB-CB 3.89Å; A571-G573 PolarHBondContact O-N 3.26Å; A571-G587 CarbonylContact O-C 3.54Å; A571-G587 VanDerWaalsContact O-CA 3.25Å; A571-G587 WeakPolarHBondContact O-CA 3.29Å; A571-E588 HydrophobicContact CB-CG 4.49Å; A571-E588 PolarHBondContact N-O 3.5Å; A571-E588 PolarHBondContact O-N 3.36Å
572	A	83.1	Confident	86.7	Confident	10 Å²	10	53.4 Å²	53.4	8%	0.083	26%	0.259	C	S	.	.	S	Bend	trans	49.9	29.6	177.7	0	0	0	0	0	114.9	L480 E588 Q623	L480-A572 HydrophobicContact CB-CB 4.3Å; L480-A572 PolarHBondContact O-N 2.9Å; A572-E588 HydrophobicContact CB-CG 4.13Å; A572-Q623 HydrophobicContact CB-CB 4.44Å; A572-Q623 HydrophobicContact CB-CG 3.54Å; A572-Q623 PolarHBondContact O-N 2.81Å
573	G	86.2	Confident	87.9	Confident	13 Å²	13	47.9 Å²	47.9	13%	0.134	23%	0.225	C	C	.	.			trans	-87.9	153.3	174.9	0	0	0	0	0	111.6	A571 V575 L585	A571-G573 PolarHBondContact O-N 3.26Å; G573-V575 PolarHBondContact O-N 2.97Å; G573-L585 WeakPolarHBondContact CA-O 3.45Å
574	G	89.3	Confident	88.6	Confident	3 Å²	3	46.7 Å²	46.7	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.8	175.1	0	0	0	0	0	111.2	V584 L585 F624	G574-V584 CarbonylContact O-C 3.41Å; G574-V584 WeakPolarHBondContact O-CA 3.19Å; G574-L585 PolarHBondContact N-O 2.72Å; G574-L585 PolarHBondContact O-N 3.18Å; G574-F624 VanDerWaalsContact N-CZ 3.33Å
575	V	92.2	Very high	88.9	Confident	15 Å²	15	45.7 Å²	45.7	9%	0.091	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.7	177.8	-178.2	0	0	0	0	110	V484 I493 G573 I582 Y583 V584	V484-V575 HydrophobicContact CB-CG1 3.93Å; V484-V575 HydrophobicContact CG1-CG1 3.94Å; I493-V575 HydrophobicContact CB-CG2 4.4Å; I493-V575 HydrophobicContact CD1-CG1 3.87Å; G573-V575 PolarHBondContact O-N 2.97Å; V575-I582 HydrophobicContact CG1-CG2 4Å; V575-Y583 WeakPolarHBondContact CA-O 3.46Å; V575-V584 HydrophobicContact CG2-CG1 4.35Å; V575-V584 HydrophobicContact CG2-CG2 4.13Å
576	A	93.3	Very high	89.2	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.033	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.3	-179.3	0	0	0	0	0	112.1	I293 Y583	I293-A576 HydrophobicContact CD1-CB 4.25Å; I293-A576 HydrophobicContact CG1-CB 4.23Å; I293-A576 HydrophobicContact CG2-CB 3.76Å; A576-Y583 PolarHBondContact N-O 2.91Å; A576-Y583 PolarHBondContact O-N 3.5Å
577	R	92.3	Very high	89.1	Confident	120 Å²	120	42.9 Å²	42.9	45%	0.453	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.2	172.1	-175.6	-178.3	62.9	83.4	1.5	111.1	V484 A485 K579 R581 T628	V484-R577 HydrophobicContact CG2-CB 3.57Å; A485-R577 VanDerWaalsContact O-CD 3.23Å; A485-R577 WeakPolarHBondContact O-CD 2.94Å; A485-R577 PolarHBondContact O-NE 2.95Å; R577-K579 PolarHBondContact NH1-O 2.86Å; R577-R581 WeakPolarHBondContact CA-O 3.36Å; R577-T628 PolarHBondContact O-OG1 3.27Å
578	W	91.1	Very high	89.1	Confident	23 Å²	23	39.2 Å²	39.2	9%	0.087	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.1	170.4	-173.4	90.5	0	0	0	110.9	K291 I293 P318 R319 R580 R581 Y583	K291-W578 PolarHBondContact O-NE1 2.85Å; I293-W578 HydrophobicContact CD1-CB 4.25Å; I293-W578 HydrophobicContact CG1-CB 4.38Å; P318-W578 HydrophobicContact CB-CD2 4.11Å; P318-W578 HydrophobicContact CB-CE3 4.25Å; P318-W578 HydrophobicContact CB-CG 4.47Å; P318-W578 HydrophobicContact CG-CB 4.33Å; P318-W578 HydrophobicContact CG-CD2 3.95Å; P318-W578 HydrophobicContact CG-CG 3.84Å; R319-W578 HydrophobicContact CB-CZ2 4.5Å; W578-R580 PolarHBondContact O-N 2.91Å; W578-R580 VanDerWaalsContact O-N 3.16Å; W578-R581 PolarHBondContact N-O 2.81Å; W578-R581 PolarHBondContact O-N 2.91Å; W578-Y583 HydrophobicContact CB-CD2 3.95Å; W578-Y583 HydrophobicContact CB-CE2 3.81Å; W578-Y583 HydrophobicContact CE3-CE2 4.33Å
579	K	87.2	Confident	89	Confident	128 Å²	128	35.7 Å²	35.7	56%	0.557	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	-116.8	-173	-59.2	-175.2	-179.4	-178.9	0	111.3	R577	R577-K579 PolarHBondContact NH1-O 2.86Å
580	R	85.7	Confident	88.4	Confident	174 Å²	174	30.9 Å²	30.9	66%	0.657	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	14.3	178	-65.2	-179.4	68.5	157.5	-0.5	112.8	W578 P602	W578-R580 PolarHBondContact O-N 2.91Å; W578-R580 VanDerWaalsContact O-N 3.16Å; R580-P602 WeakPolarHBondContact O-CD 3.21Å
581	R	91.3	Very high	87.7	Confident	78 Å²	78	35.3 Å²	35.3	29%	0.294	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.9	-178.1	-64.4	-178.4	-177.8	170.1	-0.6	110.7	R577 W578 Y583 W600 K601	R577-R581 WeakPolarHBondContact CA-O 3.36Å; W578-R581 PolarHBondContact N-O 2.81Å; W578-R581 PolarHBondContact O-N 2.91Å; R581-Y583 HydrophobicContact CB-CD2 4.32Å; R581-Y583 HydrophobicContact CB-CE2 3.69Å; R581-W600 CarbonylContact C-O 3.57Å; R581-W600 WeakPolarHBondContact CA-O 3.33Å; R581-W600 WeakPolarHBondContact CB-O 3.25Å; R581-K601 HydrophobicContact CG-CB 4.1Å; R581-K601 HydrophobicContact CG-CG 4.32Å
582	I	92.9	Very high	87.4	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.7	171.9	-53.7	174.4	0	0	0	107.3	V484 V486 I493 F563 V575 C599 W600 W607	V484-I582 HydrophobicContact CG1-CD1 4.27Å; V484-I582 HydrophobicContact CG1-CG2 4.14Å; V486-I582 HydrophobicContact CG1-CD1 3.66Å; V486-I582 HydrophobicContact CG1-CG1 4.21Å; I493-I582 HydrophobicContact CD1-CD1 4.34Å; I493-I582 HydrophobicContact CD1-CG2 3.65Å; F563-I582 HydrophobicContact CE1-CD1 4.07Å; V575-I582 HydrophobicContact CG1-CG2 4Å; I582-C599 CarbonylContact O-C 3.52Å; I582-C599 VanDerWaalsContact O-CA 3.31Å; I582-C599 WeakPolarHBondContact O-CA 3.46Å; I582-W600 HydrophobicContact CD1-CE3 3.89Å; I582-W600 HydrophobicContact CD1-CZ3 4Å; I582-W600 HydrophobicContact CG1-CE3 4.33Å; I582-W600 PolarHBondContact N-O 2.88Å; I582-W600 PolarHBondContact O-N 2.87Å; I582-W607 HydrophobicContact CB-CH2 4.26Å; I582-W607 HydrophobicContact CB-CZ3 4.42Å; I582-W607 HydrophobicContact CG2-CH2 4.01Å; I582-W607 HydrophobicContact CG2-CZ3 4.32Å
583	Y	93.8	Very high	87.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.3	174.9	-72.7	-101	0	0	0	109	I293 F316 P318 V575 A576 W578 R581 V597 Y598 C599	I293-Y583 HydrophobicContact CD1-CD1 4.15Å; I293-Y583 HydrophobicContact CD1-CD2 3.77Å; I293-Y583 HydrophobicContact CD1-CE2 4.5Å; I293-Y583 HydrophobicContact CD1-CG 3.58Å; F316-Y583 HydrophobicContact CE1-CD1 4.36Å; F316-Y583 HydrophobicContact CE1-CE1 4.18Å; P318-Y583 HydrophobicContact CB-CE1 3.95Å; P318-Y583 HydrophobicContact CB-CE2 4.22Å; P318-Y583 WeakPolarHBondContact CB-OH 3.25Å; P318-Y583 HydrophobicContact CG-CE1 4.45Å; P318-Y583 HydrophobicContact CG-CE2 4.42Å; V575-Y583 WeakPolarHBondContact CA-O 3.46Å; A576-Y583 PolarHBondContact N-O 2.91Å; A576-Y583 PolarHBondContact O-N 3.5Å; W578-Y583 HydrophobicContact CB-CD2 3.95Å; W578-Y583 HydrophobicContact CB-CE2 3.81Å; W578-Y583 HydrophobicContact CE3-CE2 4.33Å; R581-Y583 HydrophobicContact CB-CD2 4.32Å; R581-Y583 HydrophobicContact CB-CE2 3.69Å; Y583-V597 HydrophobicContact CD1-CG1 4.17Å; Y583-Y598 CarbonylContact C-O 3.59Å; Y583-Y598 VanDerWaalsContact CA-O 3.28Å; Y583-Y598 WeakPolarHBondContact CA-O 3.15Å; Y583-C599 HydrophobicContact CD1-CB 3.81Å; Y583-C599 HydrophobicContact CE1-CB 3.58Å; Y583-C599 HydrophobicContact CE2-CB 4.48Å; Y583-C599 HydrophobicContact CG-CB 4.37Å
584	V	93	Very high	87.5	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122	172	-178.9	0	0	0	0	106.7	I493 L566 I570 G574 V575 Y598 W607	I493-V584 HydrophobicContact CG2-CG2 3.82Å; L566-V584 HydrophobicContact CD1-CG1 4.49Å; L566-V584 HydrophobicContact CD2-CB 4.47Å; L566-V584 HydrophobicContact CD2-CG2 4.16Å; I570-V584 HydrophobicContact CD1-CG1 4.3Å; G574-V584 CarbonylContact O-C 3.41Å; G574-V584 WeakPolarHBondContact O-CA 3.19Å; V575-V584 HydrophobicContact CG2-CG1 4.35Å; V575-V584 HydrophobicContact CG2-CG2 4.13Å; V584-Y598 PolarHBondContact N-O 2.87Å; V584-Y598 PolarHBondContact O-N 2.87Å; V584-W607 HydrophobicContact CG2-CE3 4.45Å; V584-W607 HydrophobicContact CG2-CH2 3.79Å; V584-W607 HydrophobicContact CG2-CZ3 3.61Å
585	L	92.1	Very high	87.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.3	-171.4	-63.3	127.3	0	0	0	109	I293 W323 G573 G574 V597 L614 F624 C626	I293-L585 HydrophobicContact CG2-CD1 3.79Å; W323-L585 HydrophobicContact CH2-CD2 3.87Å; W323-L585 HydrophobicContact CZ2-CD2 4.08Å; G573-L585 WeakPolarHBondContact CA-O 3.45Å; G574-L585 PolarHBondContact N-O 2.72Å; G574-L585 PolarHBondContact O-N 3.18Å; L585-V597 HydrophobicContact CD2-CB 4.27Å; L585-V597 HydrophobicContact CD2-CG1 3.68Å; L585-V597 HydrophobicContact CD2-CG2 3.69Å; L585-V597 HydrophobicContact CG-CG1 4.16Å; L585-L614 HydrophobicContact CB-CD1 4.22Å; L585-L614 HydrophobicContact CD2-CD1 4.5Å; L585-F624 HydrophobicContact CB-CE2 4.47Å; L585-F624 HydrophobicContact CB-CZ 3.9Å; L585-F624 WeakPolarHBondContact O-CE1 3.41Å; L585-F624 WeakPolarHBondContact O-CZ 3.35Å; L585-C626 VanDerWaalsContact CD1-SG 3.57Å
586	G	90.1	Very high	87.3	Confident	1 Å²	1	48 Å²	48	1%	0.01	22%	0.218	C	C	.	.			trans	57.7	-139.9	175.3	0	0	0	0	0	113.8	I570 Y594 S596	I570-G586 VanDerWaalsContact CG2-O 3.27Å; I570-G586 WeakPolarHBondContact CG2-O 3.05Å; G586-Y594 WeakPolarHBondContact CA-O 3.06Å; G586-S596 PolarHBondContact N-O 3.31Å
587	G	87.2	Confident	87.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.216	C	C	.	.			trans	99.6	-172.2	-178.9	0	0	0	0	0	113.1	A571 Y594 V621	A571-G587 CarbonylContact O-C 3.54Å; A571-G587 VanDerWaalsContact O-CA 3.25Å; A571-G587 WeakPolarHBondContact O-CA 3.29Å; G587-Y594 PolarHBondContact O-N 2.97Å; G587-V621 WeakPolarHBondContact CA-O 3.41Å; G587-V621 PolarHBondContact N-O 3.34Å
588	E	85.1	Confident	87.3	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.051	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	158.3	-171.5	58.1	-171.6	-166.3	0	0	112.1	Y496 A571 A572 R592 F593 S622 Q623	Y496-E588 WeakPolarHBondContact OH-CG 3.44Å; Y496-E588 PolarHBondContact OH-OE1 3.11Å; A571-E588 HydrophobicContact CB-CG 4.49Å; A571-E588 PolarHBondContact N-O 3.5Å; A571-E588 PolarHBondContact O-N 3.36Å; A572-E588 HydrophobicContact CB-CG 4.13Å; E588-R592 CarbonylContact C-O 3.55Å; E588-R592 VanDerWaalsContact CA-O 3.31Å; E588-R592 WeakPolarHBondContact CA-O 3.33Å; E588-F593 HydrophobicContact CB-CD1 3.89Å; E588-F593 HydrophobicContact CB-CE1 4.15Å; E588-F593 VanDerWaalsContact OE2-CE1 3.29Å; E588-F593 WeakPolarHBondContact OE2-CE1 3.24Å; E588-S622 WeakPolarHBondContact OE2-CB 3.31Å; E588-S622 PolarHBondContact OE2-OG 2.92Å; E588-Q623 PolarHBondContact OE1-NE2 3.26Å
589	N	83.9	Confident	87.4	Confident	33 Å²	33	41.3 Å²	41.3	18%	0.176	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	107.2	167	-176.5	27.8	0	0	0	109.4	A516 S591 R592 Y594	A516-N589 HydrophobicContact CB-CB 4.02Å; A516-N589 VanDerWaalsContact CB-OD1 3.29Å; A516-N589 WeakPolarHBondContact CB-OD1 3.43Å; A516-N589 PolarHBondContact N-OD1 3.14Å; N589-S591 PolarHBondContact O-N 2.74Å; N589-R592 PolarHBondContact N-O 3.2Å; N589-R592 PolarHBondContact O-N 3.46Å; N589-Y594 HydrophobicContact CB-CE2 3.81Å
590	G	74.5	Confident	87.6	Confident	24 Å²	24	35.3 Å²	35.3	25%	0.247	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	-119	-169.2	0	0	0	0	0	111.2
591	S	71.3	Confident	87.8	Confident	97 Å²	97	30.9 Å²	30.9	68%	0.678	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	0.7	179.5	55.7	0	0	0	0	114.9	N589	N589-S591 PolarHBondContact O-N 2.74Å
592	R	80.9	Confident	87.3	Confident	179 Å²	179	29.9 Å²	29.9	68%	0.675	16%	0.155	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.1	-178.9	-65.1	-176.1	-177.9	-174.2	1.2	110.8	E588 N589 Y594	E588-R592 CarbonylContact C-O 3.55Å; E588-R592 VanDerWaalsContact CA-O 3.31Å; E588-R592 WeakPolarHBondContact CA-O 3.33Å; N589-R592 PolarHBondContact N-O 3.2Å; N589-R592 PolarHBondContact O-N 3.46Å; R592-Y594 HydrophobicContact CB-CE1 4.42Å
593	F	84.6	Confident	86.6	Confident	53 Å²	53	33.3 Å²	33.3	23%	0.232	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.5	172.7	-56.3	-88.1	0	0	0	110.9	R301 E302 E588 G620 S622	R301-F593 HydrophobicContact CB-CD1 4.1Å; R301-F593 HydrophobicContact CB-CE1 3.7Å; R301-F593 HydrophobicContact CB-CE2 4.41Å; R301-F593 HydrophobicContact CB-CZ 3.87Å; R301-F593 HydrophobicContact CG-CD1 4.3Å; R301-F593 HydrophobicContact CG-CE1 3.97Å; E302-F593 HydrophobicContact CG-CD2 3.83Å; E302-F593 HydrophobicContact CG-CE2 4.11Å; E302-F593 WeakPolarHBondContact OE1-CD2 3.42Å; E588-F593 HydrophobicContact CB-CD1 3.89Å; E588-F593 HydrophobicContact CB-CE1 4.15Å; E588-F593 VanDerWaalsContact OE2-CE1 3.29Å; E588-F593 WeakPolarHBondContact OE2-CE1 3.24Å; F593-G620 VanDerWaalsContact CB-CA 3.49Å; F593-S622 WeakPolarHBondContact CE1-OG 3.23Å
594	Y	86.8	Confident	86.1	Confident	25 Å²	25	37.6 Å²	37.6	10%	0.098	21%	0.208	C	C	.	.			trans	-118.2	147.7	-177.7	-57.5	-56.9	0	0	0	112.6	R568 I570 G586 G587 N589 R592 G620 V621	R568-Y594 VanDerWaalsContact NH1-CE1 3.33Å; I570-Y594 HydrophobicContact CG1-CD2 4.26Å; I570-Y594 HydrophobicContact CG1-CE2 4.46Å; G586-Y594 WeakPolarHBondContact CA-O 3.06Å; G587-Y594 PolarHBondContact O-N 2.97Å; N589-Y594 HydrophobicContact CB-CE2 3.81Å; R592-Y594 HydrophobicContact CB-CE1 4.42Å; Y594-G620 WeakPolarHBondContact O-CA 3.3Å; Y594-V621 PolarHBondContact O-N 2.69Å
595	D	87.8	Confident	85.6	Confident	49 Å²	49	48.9 Å²	48.9	26%	0.262	25%	0.25	S	C	.	.			trans	-112.3	8.1	172.5	66.8	-14.6	0	0	0	111.7	K613 L614	D595-K613 HydrophobicContact CB-CB 4.45Å; D595-K613 CarbonylContact O-C 3.6Å; D595-K613 WeakPolarHBondContact O-CA 3.39Å; D595-K613 IonicContact OD1-NZ 2.74Å; D595-K613 PolarHBondContact OD1-NZ 3.49Å; D595-K613 VanDerWaalsContact OD2-CD 3.26Å; D595-K613 WeakPolarHBondContact OD2-CD 3.24Å; D595-K613 WeakPolarHBondContact OD2-CE 3.22Å; D595-K613 IonicContact OD2-NZ 2.79Å; D595-K613 PolarHBondContact OD2-NZ 2.73Å; D595-L614 VanDerWaalsContact C-CD1 3.5Å; D595-L614 HydrophobicContact CB-CB 4.47Å; D595-L614 WeakPolarHBondContact O-CD1 3.42Å; D595-L614 PolarHBondContact O-N 2.78Å
596	S	89.2	Confident	85.5	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	145	-172.6	55.2	0	0	0	0	112.5	G586 Y598	G586-S596 PolarHBondContact N-O 3.31Å; S596-Y598 WeakPolarHBondContact OG-CE2 3.43Å
597	V	91.8	Very high	85.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122	173.6	-175.3	0	0	0	0	109.6	F316 W323 Y583 L585 R610 E612 L614	F316-V597 HydrophobicContact CE1-CG1 4.43Å; W323-V597 HydrophobicContact CZ2-CG2 4.34Å; Y583-V597 HydrophobicContact CD1-CG1 4.17Å; L585-V597 HydrophobicContact CD2-CB 4.27Å; L585-V597 HydrophobicContact CD2-CG1 3.68Å; L585-V597 HydrophobicContact CD2-CG2 3.69Å; L585-V597 HydrophobicContact CG-CG1 4.16Å; V597-R610 HydrophobicContact CB-CB 4.01Å; V597-R610 HydrophobicContact CB-CG 4.44Å; V597-R610 HydrophobicContact CG1-CB 4.24Å; V597-R610 HydrophobicContact CG1-CG 4.13Å; V597-R610 WeakPolarHBondContact O-CB 3.18Å; V597-R610 PolarHBondContact O-N 2.93Å; V597-E612 WeakPolarHBondContact CG2-O 3.45Å; V597-L614 HydrophobicContact CG2-CD1 3.7Å
598	Y	92.6	Very high	85.7	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.5	174.7	-68.9	-80.6	0	0	0	110.3	P567 R568 I570 Y583 V584 S596 W607 Q609	P567-Y598 HydrophobicContact CB-CE1 4.38Å; P567-Y598 HydrophobicContact CG-CD1 4.44Å; P567-Y598 HydrophobicContact CG-CE1 4.11Å; R568-Y598 VanDerWaalsContact CD-OH 3.23Å; R568-Y598 WeakPolarHBondContact CD-OH 3.29Å; R568-Y598 WeakPolarHBondContact CG-OH 3.14Å; R568-Y598 PolarHBondContact NE-OH 3.08Å; I570-Y598 HydrophobicContact CD1-CD2 3.93Å; I570-Y598 HydrophobicContact CD1-CE2 3.83Å; Y583-Y598 CarbonylContact C-O 3.59Å; Y583-Y598 VanDerWaalsContact CA-O 3.28Å; Y583-Y598 WeakPolarHBondContact CA-O 3.15Å; V584-Y598 PolarHBondContact N-O 2.87Å; V584-Y598 PolarHBondContact O-N 2.87Å; S596-Y598 WeakPolarHBondContact OG-CE2 3.43Å; Y598-W607 HydrophobicContact CD1-CB 4.36Å; Y598-Q609 HydrophobicContact CD1-CB 3.96Å; Y598-Q609 HydrophobicContact CD1-CG 4.31Å; Y598-Q609 HydrophobicContact CE1-CB 3.64Å; Y598-Q609 HydrophobicContact CE1-CG 3.85Å; Y598-Q609 PolarHBondContact OH-OE1 2.8Å
599	C	93.6	Very high	86	Confident	2 Å²	2	60 Å²	60	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.6	172.2	76.4	0	0	0	0	111.9	I582 Y583 V608 R610	I582-C599 CarbonylContact O-C 3.52Å; I582-C599 VanDerWaalsContact O-CA 3.31Å; I582-C599 WeakPolarHBondContact O-CA 3.46Å; Y583-C599 HydrophobicContact CD1-CB 3.81Å; Y583-C599 HydrophobicContact CE1-CB 3.58Å; Y583-C599 HydrophobicContact CE2-CB 4.48Å; Y583-C599 HydrophobicContact CG-CB 4.37Å; C599-V608 PolarHBondContact N-O 3.09Å; C599-V608 PolarHBondContact O-N 3.11Å; C599-R610 HydrophobicContact CB-CG 4.49Å
600	W	92.6	Very high	86.4	Confident	1 Å²	1	61.9 Å²	61.9	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	146.8	175.3	179.1	87.9	0	0	0	111.1	V561 F563 P564 R581 I582 P602 W604 W607	V561-W600 HydrophobicContact CG1-CH2 3.72Å; V561-W600 HydrophobicContact CG1-CZ2 4.37Å; F563-W600 HydrophobicContact CD1-CE3 4.33Å; F563-W600 AromaticContact CD1-CH2 3.57Å; F563-W600 HydrophobicContact CD1-CH2 3.57Å; F563-W600 HydrophobicContact CD1-CZ2 4.23Å; F563-W600 AromaticContact CD1-CZ3 3.66Å; F563-W600 HydrophobicContact CD1-CZ3 3.66Å; F563-W600 HydrophobicContact CE1-CE3 4.29Å; F563-W600 AromaticContact CE1-CH2 3.49Å; F563-W600 HydrophobicContact CE1-CH2 3.49Å; F563-W600 VanDerWaalsContact CE1-CH2 3.49Å; F563-W600 AromaticContact CE1-CZ3 3.36Å; F563-W600 HydrophobicContact CE1-CZ3 3.36Å; F563-W600 HydrophobicContact CG-CH2 4.32Å; F563-W600 HydrophobicContact CZ-CH2 4.15Å; F563-W600 HydrophobicContact CZ-CZ3 4.26Å; P564-W600 VanDerWaalsContact CD-NE1 3.29Å; P564-W600 VanDerWaalsContact CG-NE1 3.27Å; R581-W600 CarbonylContact C-O 3.57Å; R581-W600 WeakPolarHBondContact CA-O 3.33Å; R581-W600 WeakPolarHBondContact CB-O 3.25Å; I582-W600 HydrophobicContact CD1-CE3 3.89Å; I582-W600 HydrophobicContact CD1-CZ3 4Å; I582-W600 HydrophobicContact CG1-CE3 4.33Å; I582-W600 PolarHBondContact N-O 2.88Å; I582-W600 PolarHBondContact O-N 2.87Å; W600-P602 VanDerWaalsContact CH2-CA 3.46Å; W600-P602 HydrophobicContact CH2-CB 4.12Å; W600-P602 HydrophobicContact CH2-CG 4.11Å; W600-P602 HydrophobicContact CZ3-CB 4.32Å; W600-P602 HydrophobicContact CZ3-CG 3.8Å; W600-W604 PolarHBondContact NE1-O 3Å; W600-W607 HydrophobicContact CB-CD2 3.58Å; W600-W607 HydrophobicContact CB-CE3 3.34Å; W600-W607 HydrophobicContact CB-CG 4.25Å; W600-W607 HydrophobicContact CB-CH2 3.93Å; W600-W607 HydrophobicContact CB-CZ2 4.15Å; W600-W607 HydrophobicContact CB-CZ3 3.52Å; W600-W607 HydrophobicContact CG-CD2 4.24Å; W600-W607 HydrophobicContact CG-CE3 4.42Å
601	K	88.4	Confident	86.9	Confident	82 Å²	82	72.2 Å²	72.2	36%	0.357	35%	0.349	S	S	.	.			trans	-123.1	140.1	176.3	-174.6	-171	168.7	-170.3	0	108.2	R581 G603 W604	R581-K601 HydrophobicContact CG-CB 4.1Å; R581-K601 HydrophobicContact CG-CG 4.32Å; K601-G603 PolarHBondContact O-N 3.3Å; K601-W604 HydrophobicContact CB-CD2 3.8Å; K601-W604 HydrophobicContact CB-CE3 4.25Å; K601-W604 HydrophobicContact CB-CG 4.06Å; K601-W604 HydrophobicContact CB-CZ2 4.34Å; K601-W604 WeakPolarHBondContact O-CB 3.44Å; K601-W604 PolarHBondContact O-N 2.83Å
602	P	81.9	Confident	87.6	Confident	56 Å²	56	70 Å²	70	36%	0.364	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	127.7	169.5	-26.9	35.1	0	0	0	111.6	R580 W600	R580-P602 WeakPolarHBondContact O-CD 3.21Å; W600-P602 VanDerWaalsContact CH2-CA 3.46Å; W600-P602 HydrophobicContact CH2-CB 4.12Å; W600-P602 HydrophobicContact CH2-CG 4.11Å; W600-P602 HydrophobicContact CZ3-CB 4.32Å; W600-P602 HydrophobicContact CZ3-CG 3.8Å
603	G	77.1	Confident	87.9	Confident	77 Å²	77	67 Å²	67	79%	0.794	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	-9.3	-174.8	0	0	0	0	0	114.9	K601	K601-G603 PolarHBondContact O-N 3.3Å
604	W	82.9	Confident	87.8	Confident	90 Å²	90	65 Å²	65	34%	0.341	31%	0.312	S	S	.	.			trans	-82.9	137	172.9	-70.2	3.5	0	0	0	111.4	W600 K601 S606 V608	W600-W604 PolarHBondContact NE1-O 3Å; K601-W604 HydrophobicContact CB-CD2 3.8Å; K601-W604 HydrophobicContact CB-CE3 4.25Å; K601-W604 HydrophobicContact CB-CG 4.06Å; K601-W604 HydrophobicContact CB-CZ2 4.34Å; K601-W604 WeakPolarHBondContact O-CB 3.44Å; K601-W604 PolarHBondContact O-N 2.83Å; W604-S606 VanDerWaalsContact C-N 3.3Å; W604-S606 PolarHBondContact O-N 3.16Å; W604-V608 HydrophobicContact CE3-CG2 3.72Å; W604-V608 HydrophobicContact CH2-CG2 4.26Å; W604-V608 HydrophobicContact CZ3-CB 3.92Å; W604-V608 HydrophobicContact CZ3-CG2 3.41Å; W604-V608 VanDerWaalsContact CZ3-CG2 3.41Å
605	R	84.2	Confident	87.4	Confident	240 Å²	240	65.6 Å²	65.6	91%	0.906	32%	0.319	S	S	*	.	S	Bend	trans	-73.2	-20.2	179.4	-66.5	-176.6	-179.6	-103.4	2.1	113.6	P564	P564-R605 VanDerWaalsContact CB-O 3.29Å; P564-R605 WeakPolarHBondContact CB-O 3.29Å
606	S	88	Confident	86.3	Confident	71 Å²	71	65.7 Å²	65.7	50%	0.497	33%	0.331	S	S	.	.	S	Bend	trans	-149.5	161.3	-177.1	58.6	0	0	0	0	111.6	W604	W604-S606 VanDerWaalsContact C-N 3.3Å; W604-S606 PolarHBondContact O-N 3.16Å
607	W	91.4	Very high	84.7	Confident	11 Å²	11	74.4 Å²	74.4	4%	0.042	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-74.7	141.4	170.9	-64.9	79.5	0	0	0	110.5	I493 V520 P564 L566 P567 I582 V584 Y598 W600	I493-W607 HydrophobicContact CD1-CH2 4.05Å; V520-W607 HydrophobicContact CG2-CZ2 3.94Å; P564-W607 PolarHBondContact O-NE1 2.86Å; L566-W607 HydrophobicContact CD2-CD2 3.44Å; L566-W607 VanDerWaalsContact CD2-CD2 3.44Å; L566-W607 HydrophobicContact CD2-CE3 3.73Å; L566-W607 HydrophobicContact CD2-CG 3.88Å; L566-W607 HydrophobicContact CD2-CH2 4.2Å; L566-W607 HydrophobicContact CD2-CZ2 3.92Å; L566-W607 HydrophobicContact CD2-CZ3 4.11Å; L566-W607 HydrophobicContact CG-CD2 4.45Å; L566-W607 HydrophobicContact CG-CZ2 4.38Å; P567-W607 HydrophobicContact CG-CB 4.02Å; I582-W607 HydrophobicContact CB-CH2 4.26Å; I582-W607 HydrophobicContact CB-CZ3 4.42Å; I582-W607 HydrophobicContact CG2-CH2 4.01Å; I582-W607 HydrophobicContact CG2-CZ3 4.32Å; V584-W607 HydrophobicContact CG2-CE3 4.45Å; V584-W607 HydrophobicContact CG2-CH2 3.79Å; V584-W607 HydrophobicContact CG2-CZ3 3.61Å; Y598-W607 HydrophobicContact CD1-CB 4.36Å; W600-W607 HydrophobicContact CB-CD2 3.58Å; W600-W607 HydrophobicContact CB-CE3 3.34Å; W600-W607 HydrophobicContact CB-CG 4.25Å; W600-W607 HydrophobicContact CB-CH2 3.93Å; W600-W607 HydrophobicContact CB-CZ2 4.15Å; W600-W607 HydrophobicContact CB-CZ3 3.52Å; W600-W607 HydrophobicContact CG-CD2 4.24Å; W600-W607 HydrophobicContact CG-CE3 4.42Å
608	V	91.4	Very high	82.9	Confident	63 Å²	63	79.9 Å²	79.9	38%	0.382	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.1	176.7	177.5	0	0	0	0	108.7	C599 W604	C599-V608 PolarHBondContact N-O 3.09Å; C599-V608 PolarHBondContact O-N 3.11Å; W604-V608 HydrophobicContact CE3-CG2 3.72Å; W604-V608 HydrophobicContact CH2-CG2 4.26Å; W604-V608 HydrophobicContact CZ3-CB 3.92Å; W604-V608 HydrophobicContact CZ3-CG2 3.41Å; W604-V608 VanDerWaalsContact CZ3-CG2 3.41Å
609	Q	92	Very high	81.5	Confident	101 Å²	101	81.1 Å²	81.1	47%	0.472	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.3	170.6	-168.5	173.1	-15.5	0	0	109.5	Y598	Y598-Q609 HydrophobicContact CD1-CB 3.96Å; Y598-Q609 HydrophobicContact CD1-CG 4.31Å; Y598-Q609 HydrophobicContact CE1-CB 3.64Å; Y598-Q609 HydrophobicContact CE1-CG 3.85Å; Y598-Q609 PolarHBondContact OH-OE1 2.8Å
610	R	90.8	Very high	80.6	Confident	71 Å²	71	81.2 Å²	81.2	27%	0.268	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	150.9	173.6	-70.3	-57.7	-59.6	-165.3	-6.8	110	V597 C599 E612	V597-R610 HydrophobicContact CB-CB 4.01Å; V597-R610 HydrophobicContact CB-CG 4.44Å; V597-R610 HydrophobicContact CG1-CB 4.24Å; V597-R610 HydrophobicContact CG1-CG 4.13Å; V597-R610 WeakPolarHBondContact O-CB 3.18Å; V597-R610 PolarHBondContact O-N 2.93Å; C599-R610 HydrophobicContact CB-CG 4.49Å; R610-E612 VanDerWaalsContact C-N 3.25Å; R610-E612 VanDerWaalsContact CB-OE2 3.3Å; R610-E612 WeakPolarHBondContact CB-OE2 3.25Å; R610-E612 IonicContact CZ-OE1 3.86Å; R610-E612 IonicContact CZ-OE2 3.47Å; R610-E612 IonicContact NE-OE1 2.71Å; R610-E612 IonicContact NE-OE2 2.81Å; R610-E612 PolarHBondContact NE-OE2 3.34Å; R610-E612 IonicContact NH2-OE1 3.46Å; R610-E612 PolarHBondContact NH2-OE1 2.85Å; R610-E612 IonicContact NH2-OE2 3.37Å; R610-E612 PolarHBondContact NH2-OE2 2.83Å
611	R	85.6	Confident	80.1	Confident	242 Å²	242	81.2 Å²	81.2	91%	0.913	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	-28.2	175.9	-67.4	-176.3	179.3	-177.2	-1	110.9
612	E	86.9	Confident	79.8	Confident	49 Å²	49	77.3 Å²	77.3	23%	0.229	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131	179.1	-52.3	89.4	164.4	0	0	110.1	F316 G321 V597 R610	F316-E612 HydrophobicContact CE2-CB 4.07Å; F316-E612 HydrophobicContact CE2-CG 4.43Å; F316-E612 HydrophobicContact CZ-CB 4.41Å; G321-E612 WeakPolarHBondContact O-CG 3.27Å; V597-E612 WeakPolarHBondContact CG2-O 3.45Å; R610-E612 VanDerWaalsContact C-N 3.25Å; R610-E612 VanDerWaalsContact CB-OE2 3.3Å; R610-E612 WeakPolarHBondContact CB-OE2 3.25Å; R610-E612 IonicContact CZ-OE1 3.86Å; R610-E612 IonicContact CZ-OE2 3.47Å; R610-E612 IonicContact NE-OE1 2.71Å; R610-E612 IonicContact NE-OE2 2.81Å; R610-E612 PolarHBondContact NE-OE2 3.34Å; R610-E612 IonicContact NH2-OE1 3.46Å; R610-E612 PolarHBondContact NH2-OE1 2.85Å; R610-E612 IonicContact NH2-OE2 3.37Å; R610-E612 PolarHBondContact NH2-OE2 2.83Å
613	K	85.4	Confident	79.7	Confident	117 Å²	117	76.8 Å²	76.8	51%	0.509	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	162.2	177.1	-74.5	163.2	156.3	-117.7	0	110	W323 D595	W323-K613 PolarHBondContact NE1-O 3.09Å; D595-K613 HydrophobicContact CB-CB 4.45Å; D595-K613 CarbonylContact O-C 3.6Å; D595-K613 WeakPolarHBondContact O-CA 3.39Å; D595-K613 IonicContact OD1-NZ 2.74Å; D595-K613 PolarHBondContact OD1-NZ 3.49Å; D595-K613 VanDerWaalsContact OD2-CD 3.26Å; D595-K613 WeakPolarHBondContact OD2-CD 3.24Å; D595-K613 WeakPolarHBondContact OD2-CE 3.22Å; D595-K613 IonicContact OD2-NZ 2.79Å; D595-K613 PolarHBondContact OD2-NZ 2.73Å
614	L	83.2	Confident	80	Confident	11 Å²	11	74 Å²	74	6%	0.058	36%	0.362	C	S	.	.			trans	-62.7	144.4	171.7	-78.9	85.9	0	0	0	110.4	L298 W323 L585 D595 V597 G616 V621 F624	L298-L614 HydrophobicContact CD1-CD2 4.38Å; L298-L614 HydrophobicContact CD2-CD2 3.6Å; W323-L614 HydrophobicContact CH2-CD2 4.45Å; W323-L614 HydrophobicContact CH2-CG 3.85Å; W323-L614 HydrophobicContact CZ2-CB 4.42Å; W323-L614 HydrophobicContact CZ2-CG 3.95Å; L585-L614 HydrophobicContact CB-CD1 4.22Å; L585-L614 HydrophobicContact CD2-CD1 4.5Å; D595-L614 VanDerWaalsContact C-CD1 3.5Å; D595-L614 HydrophobicContact CB-CB 4.47Å; D595-L614 WeakPolarHBondContact O-CD1 3.42Å; D595-L614 PolarHBondContact O-N 2.78Å; V597-L614 HydrophobicContact CG2-CD1 3.7Å; L614-G616 PolarHBondContact O-N 3.11Å; L614-V621 HydrophobicContact CD2-CB 4.31Å; L614-V621 HydrophobicContact CD2-CG2 4.39Å; L614-F624 HydrophobicContact CD2-CE1 4.4Å; L614-F624 HydrophobicContact CD2-CZ 4.08Å
615	P	77.5	Confident	80.1	Confident	38 Å²	38	70 Å²	70	25%	0.247	35%	0.349	C	S	.	.	S	Bend	trans	-68	123.4	176.4	26.5	-32.1	0	0	0	110.1	L298 D314 W323	L298-P615 HydrophobicContact CD1-CG 3.76Å; D314-P615 HydrophobicContact CB-CG 3.97Å; D314-P615 WeakPolarHBondContact OD1-CG 3.38Å; W323-P615 VanDerWaalsContact CD2-CD 3.49Å; W323-P615 HydrophobicContact CD2-CG 4.03Å; W323-P615 HydrophobicContact CE3-CG 3.84Å; W323-P615 HydrophobicContact CG-CG 4.34Å; W323-P615 HydrophobicContact CZ3-CG 4.29Å
616	G	65.9	Low	80.3	Confident	51 Å²	51	59.4 Å²	59.4	53%	0.526	31%	0.312	S	S	.	.			trans	179.1	139.8	178.7	0	0	0	0	0	110.3	L614	L614-G616 PolarHBondContact O-N 3.11Å
617	E	56.4	Low	80.6	Confident	185 Å²	185	57.1 Å²	57.1	86%	0.864	30%	0.295	S	S	*	.	S	Bend	trans	-73.2	-37	-174.8	-70	177.6	170.3	0	0	111.9
618	T	52.2	Low	80.7	Confident	115 Å²	115	58 Å²	58	71%	0.706	30%	0.302	S	S	*	.	S	Bend	trans	-159	133.8	173.8	48.2	0	0	0	0	109.6	P300	P300-T618 WeakPolarHBondContact CB-O 3.48Å
619	G	63.1	Low	80.8	Confident	30 Å²	30	55 Å²	55	31%	0.309	28%	0.284	S	S	.	.	S	Bend	trans	101	149.8	173.1	0	0	0	0	0	114.7	E302	E302-G619 WeakPolarHBondContact OE2-CA 3.46Å
620	G	75	Confident	80.7	Confident	4 Å²	4	52.5 Å²	52.5	4%	0.041	27%	0.271	C	S	.	.			trans	-80.1	171	177.7	0	0	0	0	0	113.3	F593 Y594	F593-G620 VanDerWaalsContact CB-CA 3.49Å; Y594-G620 WeakPolarHBondContact O-CA 3.3Å
621	V	82.2	Confident	80.7	Confident	2 Å²	2	50 Å²	50	1%	0.012	26%	0.262	C	S	.	.			trans	-122.6	135.4	-176.7	-173	0	0	0	0	110.1	L298 G587 Y594 L614 F624	L298-V621 HydrophobicContact CD2-CB 4.48Å; L298-V621 HydrophobicContact CD2-CG1 3.9Å; L298-V621 WeakPolarHBondContact O-CG2 3.35Å; G587-V621 WeakPolarHBondContact CA-O 3.41Å; G587-V621 PolarHBondContact N-O 3.34Å; Y594-V621 PolarHBondContact O-N 2.69Å; L614-V621 HydrophobicContact CD2-CB 4.31Å; L614-V621 HydrophobicContact CD2-CG2 4.39Å; V621-F624 HydrophobicContact CB-CD1 4.31Å; V621-F624 HydrophobicContact CB-CE1 4.42Å; V621-F624 HydrophobicContact CG1-CB 4.26Å; V621-F624 HydrophobicContact CG1-CD1 3.59Å; V621-F624 HydrophobicContact CG1-CE1 4.15Å; V621-F624 HydrophobicContact CG1-CG 4.13Å
622	S	82.6	Confident	81	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.			trans	-140.9	164.6	174.7	70.2	0	0	0	0	112.5	R301 E588 F593 F624	R301-S622 PolarHBondContact NE-O 3.45Å; R301-S622 PolarHBondContact NH2-O 2.96Å; E588-S622 WeakPolarHBondContact OE2-CB 3.31Å; E588-S622 PolarHBondContact OE2-OG 2.92Å; F593-S622 WeakPolarHBondContact CE1-OG 3.23Å; S622-F624 VanDerWaalsContact C-N 3.29Å; S622-F624 PolarHBondContact O-N 2.8Å
623	Q	79.4	Confident	81.1	Confident	45 Å²	45	38.5 Å²	38.5	21%	0.21	22%	0.219	C	C	.	.	S	Bend	trans	59.8	38.4	175.8	-57.3	177.4	17.5	0	0	113.3	R301 S334 A572 E588	R301-Q623 PolarHBondContact NH2-O 3.12Å; S334-Q623 PolarHBondContact OG-OE1 3.47Å; A572-Q623 HydrophobicContact CB-CB 4.44Å; A572-Q623 HydrophobicContact CB-CG 3.54Å; A572-Q623 PolarHBondContact O-N 2.81Å; E588-Q623 PolarHBondContact OE1-NE2 3.26Å
624	F	83.8	Confident	81.2	Confident	17 Å²	17	40.4 Å²	40.4	8%	0.075	23%	0.227	C	C	.	.			trans	-108.3	153.7	-177.9	70	-92.9	0	0	0	111.3	C295 V296 D297 L298 G574 L585 L614 V621 S622 C626	C295-F624 HydrophobicContact CB-CD2 3.95Å; C295-F624 HydrophobicContact CB-CE2 3.86Å; V296-F624 WeakPolarHBondContact O-CB 3.25Å; D297-F624 HydrophobicContact CB-CB 4.5Å; D297-F624 WeakPolarHBondContact O-CB 3.43Å; L298-F624 HydrophobicContact CD2-CD1 4.49Å; L298-F624 HydrophobicContact CD2-CD2 3.9Å; L298-F624 HydrophobicContact CD2-CE2 4.04Å; L298-F624 HydrophobicContact CD2-CG 4.13Å; L298-F624 HydrophobicContact CD2-CZ 4.37Å; G574-F624 VanDerWaalsContact N-CZ 3.33Å; L585-F624 HydrophobicContact CB-CE2 4.47Å; L585-F624 HydrophobicContact CB-CZ 3.9Å; L585-F624 WeakPolarHBondContact O-CE1 3.41Å; L585-F624 WeakPolarHBondContact O-CZ 3.35Å; L614-F624 HydrophobicContact CD2-CE1 4.4Å; L614-F624 HydrophobicContact CD2-CZ 4.08Å; V621-F624 HydrophobicContact CB-CD1 4.31Å; V621-F624 HydrophobicContact CB-CE1 4.42Å; V621-F624 HydrophobicContact CG1-CB 4.26Å; V621-F624 HydrophobicContact CG1-CD1 3.59Å; V621-F624 HydrophobicContact CG1-CE1 4.15Å; V621-F624 HydrophobicContact CG1-CG 4.13Å; S622-F624 VanDerWaalsContact C-N 3.29Å; S622-F624 PolarHBondContact O-N 2.8Å; F624-C626 HydrophobicContact CD2-CB 4.27Å; F624-C626 HydrophobicContact CE2-CB 3.92Å
625	G	84.3	Confident	81.2	Confident	6 Å²	6	44 Å²	44	6%	0.062	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.7	177.1	0	0	0	0	0	110.8	C295 V296	C295-G625 CarbonylContact C-O 3.56Å; C295-G625 VanDerWaalsContact CA-O 3.31Å; C295-G625 WeakPolarHBondContact CA-O 3.34Å; V296-G625 PolarHBondContact N-O 2.87Å; V296-G625 PolarHBondContact O-N 3.43Å
626	C	89.8	Confident	81.7	Confident	19 Å²	19	42.2 Å²	42.2	13%	0.128	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	126.9	179.3	-174.5	0	0	0	0	110.9	I293 V294 L585 F624	I293-C626 VanDerWaalsContact CG2-SG 3.59Å; V294-C626 WeakPolarHBondContact O-CA 3.47Å; L585-C626 VanDerWaalsContact CD1-SG 3.57Å; F624-C626 HydrophobicContact CD2-CB 4.27Å; F624-C626 HydrophobicContact CE2-CB 3.92Å
627	T	92.7	Very high	82.7	Confident	23 Å²	23	41.2 Å²	41.2	14%	0.141	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	168.8	177.7	-170.3	0	0	0	0	111.6	I293 V294 A339 L344	I293-T627 CarbonylContact C-O 3.56Å; I293-T627 WeakPolarHBondContact CA-O 3.36Å; V294-T627 PolarHBondContact N-O 3.06Å; V294-T627 PolarHBondContact O-N 2.92Å; A339-T627 HydrophobicContact CB-CG2 3.95Å; A339-T627 PolarHBondContact N-OG1 3.29Å; L344-T627 HydrophobicContact CD1-CG2 3.44Å; L344-T627 VanDerWaalsContact CD1-CG2 3.44Å
628	T	93.5	Very high	84	Confident	30 Å²	30	35.1 Å²	35.1	18%	0.184	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.6	174.8	-59.9	0	0	0	0	110	K291 K292 A339 R577	K291-T628 HydrophobicContact CB-CG2 3.97Å; K291-T628 HydrophobicContact CG-CG2 4.47Å; K292-T628 WeakPolarHBondContact O-CA 3.22Å; A339-T628 WeakPolarHBondContact CB-O 3.23Å; R577-T628 PolarHBondContact O-OG1 3.27Å
629	L	93.7	Very high	85.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	146.6	180	-173.1	61	0	0	0	111	K291 K292 V294 A339 D342 L344 Y363 F631	K291-L629 WeakPolarHBondContact CA-O 2.92Å; K292-L629 PolarHBondContact N-O 2.58Å; K292-L629 PolarHBondContact O-N 3.42Å; V294-L629 HydrophobicContact CG2-CB 3.7Å; V294-L629 HydrophobicContact CG2-CD2 4.13Å; A339-L629 HydrophobicContact CB-CD1 4.04Å; D342-L629 WeakPolarHBondContact O-CD1 3.46Å; L344-L629 HydrophobicContact CB-CD1 3.87Å; L344-L629 HydrophobicContact CB-CD2 3.79Å; L344-L629 HydrophobicContact CB-CG 4.41Å; L344-L629 HydrophobicContact CD2-CD2 4.27Å; Y363-L629 HydrophobicContact CD1-CD2 4.04Å; Y363-L629 HydrophobicContact CE1-CD2 4.4Å; L629-F631 HydrophobicContact CB-CD2 4.36Å; L629-F631 HydrophobicContact CB-CE2 3.8Å; L629-F631 HydrophobicContact CB-CZ 4.4Å; L629-F631 HydrophobicContact CD2-CE1 4.15Å; L629-F631 HydrophobicContact CD2-CE2 3.87Å; L629-F631 HydrophobicContact CD2-CZ 3.65Å; L629-F631 HydrophobicContact CG-CD2 4.4Å; L629-F631 HydrophobicContact CG-CE2 4.02Å; L629-F631 HydrophobicContact CG-CZ 4.31Å
630	K	91.5	Very high	86.5	Confident	48 Å²	48	32 Å²	32	21%	0.209	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	169.5	-67.6	-179.9	174.5	-168.5	0	109.1	E286 F289 E290 K291 D342	E286-K630 IonicContact OE1-NZ 3.1Å; E286-K630 PolarHBondContact OE1-NZ 2.78Å; E286-K630 VanDerWaalsContact OE1-NZ 3.09Å; F289-K630 HydrophobicContact CB-CB 4.07Å; F289-K630 HydrophobicContact CD1-CB 3.95Å; F289-K630 HydrophobicContact CG-CB 4.19Å; E290-K630 CarbonylContact O-C 3.53Å; E290-K630 WeakPolarHBondContact O-CA 3.36Å; K291-K630 HydrophobicContact CG-CG 4.01Å; D342-K630 HydrophobicContact CB-CB 4.25Å
631	F	91	Very high	86.9	Confident	17 Å²	17	36.3 Å²	36.3	8%	0.075	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.1	173.7	-71.7	-92.8	0	0	0	109.8	F289 E290 K292 V294 C315 L326 Y363 A365 L629 K633	F289-F631 CarbonylContact C-O 3.03Å; F289-F631 WeakPolarHBondContact CA-O 3.35Å; E290-F631 HydrophobicContact CG-CB 4.14Å; E290-F631 PolarHBondContact N-O 2.92Å; E290-F631 PolarHBondContact O-N 2.82Å; K292-F631 HydrophobicContact CB-CD2 3.84Å; K292-F631 HydrophobicContact CB-CE2 3.78Å; K292-F631 HydrophobicContact CD-CD2 3.99Å; K292-F631 HydrophobicContact CD-CE2 4.25Å; K292-F631 HydrophobicContact CD-CG 4.47Å; K292-F631 HydrophobicContact CG-CD2 4.02Å; K292-F631 HydrophobicContact CG-CE2 4.38Å; V294-F631 HydrophobicContact CG2-CE2 3.72Å; V294-F631 HydrophobicContact CG2-CZ 3.73Å; C315-F631 HydrophobicContact CB-CZ 4.34Å; L326-F631 HydrophobicContact CD1-CE1 4.28Å; L326-F631 HydrophobicContact CD1-CZ 3.92Å; L326-F631 HydrophobicContact CD2-CE1 4.39Å; Y363-F631 HydrophobicContact CE1-CE1 4.09Å; A365-F631 HydrophobicContact CB-CD1 4.01Å; A365-F631 HydrophobicContact CB-CE1 4.16Å; L629-F631 HydrophobicContact CB-CD2 4.36Å; L629-F631 HydrophobicContact CB-CE2 3.8Å; L629-F631 HydrophobicContact CB-CZ 4.4Å; L629-F631 HydrophobicContact CD2-CE1 4.15Å; L629-F631 HydrophobicContact CD2-CE2 3.87Å; L629-F631 HydrophobicContact CD2-CZ 3.65Å; L629-F631 HydrophobicContact CG-CD2 4.4Å; L629-F631 HydrophobicContact CG-CE2 4.02Å; L629-F631 HydrophobicContact CG-CZ 4.31Å; F631-K633 PolarHBondContact O-N 2.81Å
632	P	90.7	Very high	86.8	Confident	11 Å²	11	40.1 Å²	40.1	7%	0.071	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	136.8	168.5	-21.3	32.2	0	0	0	110.4	F289 I636 L637 L640	F289-P632 HydrophobicContact CD1-CG 4.24Å; F289-P632 HydrophobicContact CE1-CG 3.93Å; P632-I636 HydrophobicContact CB-CG2 4.33Å; P632-L637 HydrophobicContact CB-CB 4.3Å; P632-L640 HydrophobicContact CB-CD1 3.99Å; P632-L640 HydrophobicContact CG-CD1 3.87Å
633	K	90.1	Very high	86.5	Confident	39 Å²	39	41.2 Å²	41.2	17%	0.17	20%	0.203	C	C	.	.			trans	-58.1	152.3	173.5	-74.7	177.2	178.2	175.9	0	110.6	D221 G287 M288 F631 H635 I636 L637	D221-K633 IonicContact OD1-NZ 3.82Å; D221-K633 PolarHBondContact OD1-NZ 2.82Å; D221-K633 IonicContact OD2-NZ 3.22Å; D221-K633 PolarHBondContact OD2-NZ 3.27Å; G287-K633 WeakPolarHBondContact O-CE 3.21Å; G287-K633 PolarHBondContact O-NZ 3.08Å; M288-K633 WeakPolarHBondContact O-CB 3.32Å; M288-K633 WeakPolarHBondContact O-CG 3.26Å; M288-K633 PolarHBondContact O-N 3.23Å; F631-K633 PolarHBondContact O-N 2.81Å; K633-H635 VanDerWaalsContact C-N 3.3Å; K633-H635 PolarHBondContact O-N 2.86Å; K633-H635 VanDerWaalsContact O-N 3.14Å; K633-I636 CarbonylContact O-C 3.58Å; K633-I636 WeakPolarHBondContact O-CA 3Å; K633-I636 PolarHBondContact O-N 2.86Å; K633-L637 WeakPolarHBondContact O-CB 3.35Å; K633-L637 PolarHBondContact O-N 3.38Å
634	K	86.8	Confident	86.4	Confident	157 Å²	157	42.7 Å²	42.7	68%	0.683	21%	0.209	S	C	*	.	H	α-helix	trans	-51.1	-42.8	-172.6	-66.5	-172.3	177.8	-172.2	0	114.4	I636 L637 S638	K634-I636 VanDerWaalsContact C-N 3.31Å; K634-I636 PolarHBondContact O-N 3.47Å; K634-L637 PolarHBondContact O-N 2.8Å; K634-S638 PolarHBondContact O-N 2.78Å; K634-S638 PolarHBondContact O-OG 2.8Å
635	H	83.3	Confident	85.9	Confident	86 Å²	86	47 Å²	47	40%	0.398	23%	0.229	S	C	.	.	H	α-helix	trans	-70.3	-26.5	180	65.7	-70.6	0	0	0	113.5	D221 K633 S638 R639	D221-H635 PolarHBondContact O-NE2 3.42Å; K633-H635 VanDerWaalsContact C-N 3.3Å; K633-H635 PolarHBondContact O-N 2.86Å; K633-H635 VanDerWaalsContact O-N 3.14Å; H635-S638 PolarHBondContact O-OG 2.73Å; H635-S638 VanDerWaalsContact O-OG 3.07Å; H635-R639 WeakPolarHBondContact O-CG 3.43Å
636	I	87.9	Confident	85.1	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-84.9	-39.5	175	-57.6	-60.9	0	0	0	110.4	L256 P284 M288 P632 K633 K634 S638 R639 L640	L256-I636 HydrophobicContact CD2-CG2 4.34Å; P284-I636 HydrophobicContact CB-CG2 4.16Å; P284-I636 HydrophobicContact CG-CG2 3.97Å; M288-I636 HydrophobicContact CB-CG1 4.13Å; M288-I636 HydrophobicContact CG-CD1 4.46Å; M288-I636 HydrophobicContact CG-CG1 4.35Å; M288-I636 HydrophobicContact SD-CD1 4.02Å; M288-I636 HydrophobicContact SD-CG1 4.38Å; P632-I636 HydrophobicContact CB-CG2 4.33Å; K633-I636 CarbonylContact O-C 3.58Å; K633-I636 WeakPolarHBondContact O-CA 3Å; K633-I636 PolarHBondContact O-N 2.86Å; K634-I636 VanDerWaalsContact C-N 3.31Å; K634-I636 PolarHBondContact O-N 3.47Å; I636-S638 VanDerWaalsContact C-N 3.33Å; I636-S638 PolarHBondContact O-N 2.66Å; I636-R639 WeakPolarHBondContact O-CB 3.48Å; I636-R639 PolarHBondContact O-N 3.06Å; I636-R639 VanDerWaalsContact O-N 3.07Å; I636-L640 HydrophobicContact CG2-CD1 4.05Å; I636-L640 HydrophobicContact CG2-CG 4.21Å; I636-L640 WeakPolarHBondContact O-CG 3.39Å; I636-L640 PolarHBondContact O-N 3.25Å
637	L	86.1	Confident	83.7	Confident	31 Å²	31	56.1 Å²	56.1	16%	0.162	28%	0.283	C	S	.	.	H	α-helix	trans	-57	-45.1	178	-178.4	65.2	0	0	0	111.9	V366 P632 K633 K634 R639 L640 R641	V366-L637 HydrophobicContact CB-CD1 4.35Å; V366-L637 HydrophobicContact CG1-CD1 4.31Å; P632-L637 HydrophobicContact CB-CB 4.3Å; K633-L637 WeakPolarHBondContact O-CB 3.35Å; K633-L637 PolarHBondContact O-N 3.38Å; K634-L637 PolarHBondContact O-N 2.8Å; L637-R639 PolarHBondContact O-N 2.92Å; L637-L640 PolarHBondContact O-N 3.49Å; L637-R641 WeakPolarHBondContact O-CG 3.42Å; L637-R641 PolarHBondContact O-N 2.89Å
638	S	84.4	Confident	82	Confident	56 Å²	56	61.7 Å²	61.7	39%	0.392	31%	0.305	S	S	.	.	H	α-helix	trans	-59.9	-36.4	176.7	58.3	0	0	0	0	112.2	K634 H635 I636 L642	K634-S638 PolarHBondContact O-N 2.78Å; K634-S638 PolarHBondContact O-OG 2.8Å; H635-S638 PolarHBondContact O-OG 2.73Å; H635-S638 VanDerWaalsContact O-OG 3.07Å; I636-S638 VanDerWaalsContact C-N 3.33Å; I636-S638 PolarHBondContact O-N 2.66Å; S638-L642 VanDerWaalsContact O-CG 3.3Å; S638-L642 WeakPolarHBondContact O-CG 3.37Å; S638-L642 PolarHBondContact O-N 3.41Å
639	R	82.3	Confident	79.7	Confident	61 Å²	61	67.5 Å²	67.5	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-70.2	-45.4	177.1	-62.7	-73.2	170.8	-177.1	-7.6	112.2	Q259 H635 I636 L637 R641 L642 A643	Q259-R639 VanDerWaalsContact N-NH2 3.13Å; H635-R639 WeakPolarHBondContact O-CG 3.43Å; I636-R639 WeakPolarHBondContact O-CB 3.48Å; I636-R639 PolarHBondContact O-N 3.06Å; I636-R639 VanDerWaalsContact O-N 3.07Å; L637-R639 PolarHBondContact O-N 2.92Å; R639-R641 VanDerWaalsContact C-N 3.25Å; R639-R641 PolarHBondContact O-N 3.25Å; R639-L642 PolarHBondContact O-N 3.36Å; R639-A643 WeakPolarHBondContact O-CB 3.38Å; R639-A643 PolarHBondContact O-N 3.45Å
640	L	84.9	Confident	77.1	Confident	18 Å²	18	72.1 Å²	72.1	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-36.3	176.8	-66.2	175.1	0	0	0	111.6	L256 L282 P284 V366 P632 I636 L637 K644	L256-L640 HydrophobicContact CD2-CD2 4.45Å; L282-L640 HydrophobicContact CB-CD2 4.14Å; P284-L640 HydrophobicContact CG-CD1 3.96Å; P284-L640 HydrophobicContact CG-CD2 4.33Å; V366-L640 HydrophobicContact CG1-CB 3.65Å; V366-L640 HydrophobicContact CG2-CB 4.15Å; V366-L640 HydrophobicContact CG2-CD1 3.92Å; P632-L640 HydrophobicContact CB-CD1 3.99Å; P632-L640 HydrophobicContact CG-CD1 3.87Å; I636-L640 HydrophobicContact CG2-CD1 4.05Å; I636-L640 HydrophobicContact CG2-CG 4.21Å; I636-L640 WeakPolarHBondContact O-CG 3.39Å; I636-L640 PolarHBondContact O-N 3.25Å; L637-L640 PolarHBondContact O-N 3.49Å; L640-K644 WeakPolarHBondContact O-CB 3.34Å; L640-K644 WeakPolarHBondContact O-CG 3.15Å; L640-K644 PolarHBondContact O-N 2.85Å
641	R	84.4	Confident	74.7	Confident	96 Å²	96	78 Å²	78	36%	0.362	39%	0.392	S	S	.	.	H	α-helix	trans	-64.6	-52.7	173.5	-74.5	177.6	179.4	178	-2.7	111.9	V366 L637 R639 A643 K644 E645	V366-R641 HydrophobicContact CG1-CG 3.87Å; V366-R641 WeakPolarHBondContact O-CG 3.12Å; V366-R641 PolarHBondContact O-NE 3.31Å; V366-R641 PolarHBondContact O-NH2 3.1Å; L637-R641 WeakPolarHBondContact O-CG 3.42Å; L637-R641 PolarHBondContact O-N 2.89Å; R639-R641 VanDerWaalsContact C-N 3.25Å; R639-R641 PolarHBondContact O-N 3.25Å; R641-A643 VanDerWaalsContact C-N 3.26Å; R641-A643 PolarHBondContact O-N 3.31Å; R641-K644 PolarHBondContact O-N 2.77Å; R641-K644 VanDerWaalsContact O-N 3.12Å; R641-E645 WeakPolarHBondContact O-CG 3.43Å; R641-E645 PolarHBondContact O-N 3.19Å
642	L	80.5	Confident	72.1	Confident	82 Å²	82	87.9 Å²	87.9	43%	0.429	45%	0.445	S	S	.	.	H	α-helix	trans	-56	-41.8	177.5	-73.3	170	0	0	0	112	S638 R639 E645 N646	S638-L642 VanDerWaalsContact O-CG 3.3Å; S638-L642 WeakPolarHBondContact O-CG 3.37Å; S638-L642 PolarHBondContact O-N 3.41Å; R639-L642 PolarHBondContact O-N 3.36Å; L642-E645 PolarHBondContact O-N 3.05Å; L642-N646 WeakPolarHBondContact O-CB 3.32Å; L642-N646 VanDerWaalsContact O-CG 3.24Å; L642-N646 PolarHBondContact O-N 2.96Å; L642-N646 PolarHBondContact O-ND2 3.46Å
643	A	76.1	Confident	71.1	Confident	22 Å²	22	91.7 Å²	91.7	18%	0.182	46%	0.464	C	S	.	.	H	α-helix	trans	-65	-45.3	176.8	0	0	0	0	0	112.7	L282 R639 R641 E645 N646 C647	L282-A643 HydrophobicContact CD1-CB 3.28Å; L282-A643 HydrophobicContact CD2-CB 4.45Å; L282-A643 HydrophobicContact CG-CB 4.5Å; R639-A643 WeakPolarHBondContact O-CB 3.38Å; R639-A643 PolarHBondContact O-N 3.45Å; R641-A643 VanDerWaalsContact C-N 3.26Å; R641-A643 PolarHBondContact O-N 3.31Å; A643-E645 VanDerWaalsContact C-N 3.27Å; A643-E645 PolarHBondContact O-N 3.38Å; A643-N646 PolarHBondContact O-N 2.93Å; A643-C647 PolarHBondContact O-N 2.95Å; A643-C647 PolarHBondContact O-SG 3Å; A643-C647 VanDerWaalsContact O-SG 3.37Å
644	K	76.3	Confident	70.1	Confident	76 Å²	76	94.5 Å²	94.5	33%	0.33	48%	0.479	S	S	.	.	H	α-helix	trans	-63.2	-32.9	175.8	-78.9	-171.9	175.7	-177.1	0	112.4	D364 V366 L367 L640 R641	D364-K644 IonicContact OD1-NZ 2.72Å; D364-K644 PolarHBondContact OD1-NZ 3.07Å; D364-K644 IonicContact OD2-NZ 3.73Å; D364-K644 PolarHBondContact OD2-NZ 3.46Å; V366-K644 HydrophobicContact CB-CD 4.4Å; V366-K644 HydrophobicContact CG1-CD 3.96Å; L367-K644 HydrophobicContact CD1-CD 3.9Å; L367-K644 HydrophobicContact CD2-CB 4.4Å; L367-K644 HydrophobicContact CD2-CD 4.03Å; L367-K644 HydrophobicContact CG-CD 3.79Å; L640-K644 WeakPolarHBondContact O-CB 3.34Å; L640-K644 WeakPolarHBondContact O-CG 3.15Å; L640-K644 PolarHBondContact O-N 2.85Å; R641-K644 PolarHBondContact O-N 2.77Å; R641-K644 VanDerWaalsContact O-N 3.12Å
645	E	74	Confident	69.2	Low	109 Å²	109	91 Å²	91	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-72.3	-41.7	175.3	-73.5	169.8	-173.8	0	0	112.1	R641 L642 A643 K648	R641-E645 WeakPolarHBondContact O-CG 3.43Å; R641-E645 PolarHBondContact O-N 3.19Å; L642-E645 PolarHBondContact O-N 3.05Å; A643-E645 VanDerWaalsContact C-N 3.27Å; A643-E645 PolarHBondContact O-N 3.38Å; E645-K648 WeakPolarHBondContact O-CB 3.43Å; E645-K648 PolarHBondContact O-N 3.13Å; E645-K648 VanDerWaalsContact O-N 3.13Å
646	N	68.1	Low	68.4	Low	103 Å²	103	91.3 Å²	91.3	55%	0.551	47%	0.472	S	S	*	.	H	α-helix	trans	-65.8	-37.3	176.7	-72.7	-18.7	0	0	0	112.3	L642 A643 K648 K649	L642-N646 WeakPolarHBondContact O-CB 3.32Å; L642-N646 VanDerWaalsContact O-CG 3.24Å; L642-N646 PolarHBondContact O-N 2.96Å; L642-N646 PolarHBondContact O-ND2 3.46Å; A643-N646 PolarHBondContact O-N 2.93Å; N646-K648 PolarHBondContact O-N 2.71Å; N646-K649 PolarHBondContact O-N 2.99Å
647	C	60.1	Low	67.2	Low	113 Å²	113	96.9 Å²	96.9	76%	0.764	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.2	173.5	-68.9	0	0	0	0	113.9	A643	A643-C647 PolarHBondContact O-N 2.95Å; A643-C647 PolarHBondContact O-SG 3Å; A643-C647 VanDerWaalsContact O-SG 3.37Å
648	K	55.5	Low	65.9	Low	140 Å²	140	101.3 Å²	101.3	61%	0.609	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.8	176.5	-80.5	-176.5	178	-178.6	0	113.6	E645 N646 P650	E645-K648 WeakPolarHBondContact O-CB 3.43Å; E645-K648 PolarHBondContact O-N 3.13Å; E645-K648 VanDerWaalsContact O-N 3.13Å; N646-K648 PolarHBondContact O-N 2.71Å; K648-P650 WeakPolarHBondContact O-CD 3.26Å
649	K	46.1	Very low	64.6	Low	151 Å²	151	104.6 Å²	104.6	66%	0.657	53%	0.533	S	S	*	.	S	Bend	trans	-77.6	111.8	170	-69.5	-175.4	177.7	-179	0	106.9	N646 N651	N646-K649 PolarHBondContact O-N 2.99Å; K649-N651 PolarHBondContact O-N 3.42Å
650	P	39.8	Very low	63.2	Low	98 Å²	98	107.9 Å²	107.9	64%	0.636	56%	0.557	S	S	*	*			trans	-55.4	141.7	164.1	25.9	-30.6	0	0	0	107.1	K648 D652	K648-P650 WeakPolarHBondContact O-CD 3.26Å; P650-D652 VanDerWaalsContact C-N 3.3Å; P650-D652 PolarHBondContact O-N 2.74Å
651	N	41.3	Very low	61.4	Low	172 Å²	172	115.4 Å²	115.4	92%	0.92	60%	0.595	S	S	*	*			trans	-57.8	101.1	167.2	-75.6	-20.9	0	0	0	106.8	K649	K649-N651 PolarHBondContact O-N 3.42Å
652	D	34.9	Very low	59.3	Low	223 Å²	223	117.2 Å²	117.2	100%	1.193	62%	0.616	S	S	*	*			trans	-68.1	0	167.6	-80.9	-23.4	0	0	0	110.3	P650	P650-D652 VanDerWaalsContact C-N 3.3Å; P650-D652 PolarHBondContact O-N 2.74Å

Retrieved 652 of 652 residues in 1033.4 ms (Link to these results)

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