A0A060VXJ0_ONCMY Loading...

FAD-dependent oxidoreductase domain-containing protein 1

Required for the assembly of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I). Involved in mid-late stages of complex I assembly.

AlphaFold DB , UniProt , Accession A0A060VXJ0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene foxred1, Length 504 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	32.8	Very low	28.2	Very low	254 Å²	254	157.5 Å²	157.5	100%	1.251	83%	0.834	S	S	*	*				0	112.5	0	-73.5	169	160.4	0	0	106
2	S	33.5	Very low	27.9	Very low	106 Å²	106	165.7 Å²	165.7	74%	0.741	85%	0.845	S	S	*	*			cis	-155.3	124.3	16	161.5	0	0	0	0	104.5
3	M	28	Very low	27.8	Very low	161 Å²	161	160 Å²	160	79%	0.793	84%	0.839	S	S	*	*				45.8	136	99.2	-93.8	-160.9	-83.8	0	0	115.1
4	W	26.8	Very low	27.7	Very low	233 Å²	233	155.4 Å²	155.4	88%	0.883	84%	0.835	S	S	*	*			cis	176.4	172.9	-6.1	-127	48.3	0	0	0	107.1
5	K	30.6	Very low	27.5	Very low	198 Å²	198	157.3 Å²	157.3	86%	0.861	84%	0.836	S	S	*	*			trans	97	123.8	166.5	-58	-179.8	178.1	-178.6	0	115.7
6	G	27.2	Very low	27.4	Very low	63 Å²	63	151.5 Å²	151.5	65%	0.649	83%	0.825	S	S	*	*			cis	122	137.4	4.9	0	0	0	0	0	112.5
7	L	27.8	Very low	27.3	Very low	151 Å²	151	150.8 Å²	150.8	79%	0.791	82%	0.819	S	S	*	*			trans	88	138.5	167	-72.5	71.9	0	0	0	116.9
8	H	26.6	Very low	27.3	Very low	168 Å²	168	151.4 Å²	151.4	78%	0.778	82%	0.815	S	S	*	*			cis	-160.9	144.1	3.3	-115.9	-42.8	0	0	0	110.2
9	M	25.8	Very low	27.2	Very low	165 Å²	165	149.7 Å²	149.7	81%	0.813	81%	0.81	S	S	*	*			trans	-77.3	148.5	155.8	-82.4	170.9	54.9	0	0	110.6
10	T	25	Very low	27.1	Very low	146 Å²	146	147.1 Å²	147.1	90%	0.896	80%	0.803	S	S	*	*			trans	-150.4	123.8	138.7	32.7	0	0	0	0	110.9
11	A	26.5	Very low	27	Very low	87 Å²	87	144.9 Å²	144.9	72%	0.719	80%	0.799	S	S	*	*			trans	-78.9	157.2	165.4	0	0	0	0	0	111.1
12	R	24	Very low	26.7	Very low	256 Å²	256	143.8 Å²	143.8	97%	0.966	78%	0.781	S	S	*	*			trans	-139.6	126.4	151.2	-97	-173.1	178	-179.9	-0.4	110.6
13	A	27	Very low	26.2	Very low	92 Å²	92	148.3 Å²	148.3	76%	0.76	79%	0.787	S	S	*	*			trans	-99.9	154.7	167.4	0	0	0	0	0	110.1
14	A	25.7	Very low	26.1	Very low	95 Å²	95	147.1 Å²	147.1	79%	0.785	78%	0.783	S	S	*	*			trans	-162.8	109.9	150.7	0	0	0	0	0	106.4
15	H	25.9	Very low	26.1	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.856	77%	0.774	S	S	*	*				62.3	121.4	70.3	-84.8	62.6	0	0	0	116.3
16	G	25.5	Very low	25.8	Very low	64 Å²	64	141.7 Å²	141.7	66%	0.66	77%	0.767	S	S	*	*			trans	133.4	86.8	155.1	0	0	0	0	0	114.8
17	I	26.3	Very low	25.7	Very low	139 Å²	139	147.6 Å²	147.6	71%	0.713	78%	0.778	S	S	*	*				75.8	125.7	80.7	-65.8	172.8	0	0	0	110.9
18	H	26.1	Very low	25.6	Very low	162 Å²	162	147.1 Å²	147.1	75%	0.75	78%	0.781	S	S	*	*			cis	-170	147.8	46.3	-120.2	-30.7	0	0	0	112.3
19	V	25.8	Very low	25.5	Very low	119 Å²	119	150 Å²	150	72%	0.721	79%	0.785	S	S	*	*				60.9	153.2	130	170	0	0	0	0	120.1
20	S	24.6	Very low	25.4	Very low	97 Å²	97	150 Å²	150	68%	0.678	79%	0.787	S	S	*	*			cis	177.1	148.6	-31	92.9	0	0	0	0	104.1
21	S	26.3	Very low	25.3	Very low	101 Å²	101	148 Å²	148	71%	0.706	78%	0.778	S	S	*	*				-179.9	116.8	128	55.4	0	0	0	0	111.3
22	R	24.9	Very low	25.3	Very low	232 Å²	232	149.8 Å²	149.8	88%	0.875	78%	0.78	S	S	*	*			trans	-76.7	146.4	156.5	-80.8	178.2	174.1	179.3	-2.1	108.9
23	F	24.2	Very low	25.3	Very low	200 Å²	200	149.5 Å²	149.5	88%	0.877	78%	0.779	S	S	*	*			trans	-125.2	124.6	156.4	-100.5	-86.4	0	0	0	109.8
24	I	26.7	Very low	25.2	Very low	137 Å²	137	152.6 Å²	152.6	70%	0.703	78%	0.783	S	S	*	*			trans	-129.7	133.1	164	-67.5	172.7	0	0	0	105.3
25	H	25.7	Very low	25.2	Very low	149 Å²	149	156.2 Å²	156.2	69%	0.69	79%	0.788	S	S	*	*			trans	170.7	149.1	150.4	-99.4	35.1	0	0	0	107.5
26	K	24.8	Very low	25.4	Very low	168 Å²	168	152.5 Å²	152.5	73%	0.73	78%	0.782	S	S	*	*			cis	-169.7	157.9	-6.7	-122.3	-179.9	-174.5	155.3	0	105.8
27	H	25.2	Very low	25.8	Very low	186 Å²	186	155.6 Å²	155.6	86%	0.861	79%	0.789	S	S	*	*			trans	-65.5	148.6	168.8	-92.7	-73.7	0	0	0	113.7
28	T	24.7	Very low	26	Very low	141 Å²	141	155.1 Å²	155.1	87%	0.865	80%	0.798	S	S	*	*			trans	-143.5	130.4	152.3	-4.9	0	0	0	0	110.4
29	R	24.5	Very low	26.4	Very low	230 Å²	230	158.1 Å²	158.1	87%	0.868	80%	0.803	S	S	*	*			trans	-91.1	146.5	168.7	-79.2	179.4	171.5	-172.6	-2.4	109.4
30	L	24.4	Very low	27.1	Very low	163 Å²	163	157.9 Å²	157.9	85%	0.853	80%	0.803	S	S	*	*				172.4	139.3	121.7	-98.6	144.5	0	0	0	114.4
31	C	23.6	Very low	28	Very low	104 Å²	104	158.5 Å²	158.5	70%	0.703	80%	0.803	S	S	*	*			trans	68.2	97.7	150.4	-81.5	0	0	0	0	123
32	T	25.5	Very low	28.7	Very low	125 Å²	125	161.2 Å²	161.2	77%	0.767	80%	0.804	S	S	*	*				6.5	123.7	124.6	52.6	0	0	0	0	119.7
33	R	24.2	Very low	29.7	Very low	250 Å²	250	156.1 Å²	156.1	94%	0.943	79%	0.794	S	S	*	*			trans	-151.3	119.7	130.4	-110.2	178.6	-179	179.5	0.3	110.3
34	N	24.2	Very low	30.9	Very low	158 Å²	158	152 Å²	152	85%	0.845	78%	0.781	S	S	*	*			trans	-67.3	136.2	174.3	-74.8	-26.5	0	0	0	111
35	I	25.9	Very low	32.1	Very low	170 Å²	170	151.8 Å²	151.8	87%	0.872	78%	0.776	S	S	*	*			trans	-128.4	111.3	146	-63.6	-179.8	0	0	0	106.2
36	S	31.3	Very low	33.1	Very low	107 Å²	107	150.6 Å²	150.6	75%	0.748	77%	0.769	S	S	*	*			trans	-80.3	132.9	179.9	102.9	0	0	0	0	109.5
37	T	33	Very low	34.6	Very low	129 Å²	129	148.8 Å²	148.8	79%	0.791	76%	0.761	S	S	*	*			trans	-163	107.5	144.9	40.7	0	0	0	0	109.2
38	S	29.9	Very low	36.3	Very low	129 Å²	129	144.5 Å²	144.5	90%	0.902	74%	0.744	S	S	*	*			trans	169.9	142	136.9	44.4	0	0	0	0	111.8
39	R	35.8	Very low	37.7	Very low	226 Å²	226	140.6 Å²	140.6	85%	0.853	72%	0.718	S	S	*	*			trans	-70.7	152.9	-173.5	-65.4	168.3	173	173.5	-4.4	112.4	V41	R39-V41 HydrophobicContact CB-CG2 4.38Å; R39-V41 PolarHBondContact O-N 3.4Å
40	P	39	Very low	39.3	Very low	113 Å²	113	136 Å²	136	73%	0.734	71%	0.706	S	S	*	*			trans	-87.5	101.4	172.6	33.7	-25.9	0	0	0	109.3
41	V	44.3	Very low	41.4	Very low	111 Å²	111	133.1 Å²	133.1	67%	0.673	69%	0.691	S	S	*	*			trans	-123.3	-17	172.4	-177.5	0	0	0	0	111.8	R39	R39-V41 HydrophobicContact CB-CG2 4.38Å; R39-V41 PolarHBondContact O-N 3.4Å
42	Q	41.6	Very low	43.3	Very low	158 Å²	158	134 Å²	134	74%	0.738	69%	0.685	S	S	*	*	H	α-helix	trans	-81.7	-30.5	179.7	-99.9	176.2	-20.9	0	0	114.5	F46	Q42-F46 VanDerWaalsContact O-CD2 3.3Å; Q42-F46 WeakPolarHBondContact O-CD2 3.41Å
43	N	44.6	Very low	44.6	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	67%	0.67	S	S	*	*	H	α-helix	trans	-76.1	-26.7	-175.2	-90.6	-0.2	0	0	0	114.3	K47	N43-K47 PolarHBondContact O-N 3.4Å
44	D	51	Low	46.6	Very low	113 Å²	113	126.8 Å²	126.8	60%	0.604	65%	0.65	S	S	*	*	H	α-helix	trans	-78.2	-32.5	179	-77.1	-19.1	0	0	0	111.7	K47 D48	D44-K47 PolarHBondContact O-N 3.39Å; D44-D48 VanDerWaalsContact O-CB 3.26Å; D44-D48 WeakPolarHBondContact O-CB 3.3Å; D44-D48 PolarHBondContact O-N 3.39Å
45	F	50.1	Low	48.7	Very low	134 Å²	134	121.8 Å²	121.8	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-62.3	-46.8	176.8	-178.5	-99.1	0	0	0	112.3	K47 D48 L49	F45-K47 PolarHBondContact O-N 2.92Å; F45-D48 PolarHBondContact O-N 3.19Å; F45-L49 HydrophobicContact CE1-CD2 4.28Å; F45-L49 WeakPolarHBondContact O-CB 3.43Å; F45-L49 PolarHBondContact O-N 2.91Å
46	F	48.1	Very low	50.3	Low	124 Å²	124	119.6 Å²	119.6	54%	0.544	62%	0.616	S	S	.	*	H	α-helix	trans	-68.7	-34.8	179.5	-74.3	-74.1	0	0	0	112.6	Q42 E50	Q42-F46 VanDerWaalsContact O-CD2 3.3Å; Q42-F46 WeakPolarHBondContact O-CD2 3.41Å; F46-E50 WeakPolarHBondContact O-CB 3.4Å; F46-E50 WeakPolarHBondContact O-CG 3.15Å; F46-E50 PolarHBondContact O-N 3.45Å
47	K	56.4	Low	51.4	Low	130 Å²	130	121.1 Å²	121.1	57%	0.565	61%	0.605	S	S	*	*	H	α-helix	trans	-68.6	-42.2	174.4	-85	-177.2	173.7	-178.4	0	112.7	N43 D44 F45 L49 E50 N51	N43-K47 PolarHBondContact O-N 3.4Å; D44-K47 PolarHBondContact O-N 3.39Å; F45-K47 PolarHBondContact O-N 2.92Å; K47-L49 VanDerWaalsContact C-N 3.31Å; K47-E50 PolarHBondContact O-N 3.43Å; K47-N51 WeakPolarHBondContact O-CB 3.3Å; K47-N51 PolarHBondContact O-N 3.5Å; K47-N51 PolarHBondContact O-ND2 2.86Å
48	D	60.3	Low	53	Low	96 Å²	96	120 Å²	120	51%	0.513	59%	0.591	S	S	.	*	H	α-helix	trans	-69.1	-36.7	-180	-149	28.2	0	0	0	110.5	D44 F45 N51 Q52	D44-D48 VanDerWaalsContact O-CB 3.26Å; D44-D48 WeakPolarHBondContact O-CB 3.3Å; D44-D48 PolarHBondContact O-N 3.39Å; F45-D48 PolarHBondContact O-N 3.19Å; D48-N51 PolarHBondContact O-N 3.39Å; D48-Q52 WeakPolarHBondContact O-CB 3.04Å; D48-Q52 VanDerWaalsContact O-CG 3.3Å; D48-Q52 WeakPolarHBondContact O-CG 3.26Å; D48-Q52 PolarHBondContact O-N 3.01Å
49	L	53.6	Low	54.7	Low	58 Å²	58	121.7 Å²	121.7	30%	0.304	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-45.6	172	-169.1	70.9	0	0	0	111.9	F45 K47 N51 Q52 F53	F45-L49 HydrophobicContact CE1-CD2 4.28Å; F45-L49 WeakPolarHBondContact O-CB 3.43Å; F45-L49 PolarHBondContact O-N 2.91Å; K47-L49 VanDerWaalsContact C-N 3.31Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 2.94Å; L49-Q52 PolarHBondContact O-N 3.18Å; L49-F53 HydrophobicContact CD1-CD2 4.23Å; L49-F53 HydrophobicContact CD1-CE2 3.65Å; L49-F53 HydrophobicContact CD1-CZ 4.32Å; L49-F53 HydrophobicContact CD2-CE2 3.92Å; L49-F53 HydrophobicContact CG-CD2 3.78Å; L49-F53 HydrophobicContact CG-CE2 3.44Å; L49-F53 VanDerWaalsContact CG-CE2 3.44Å; L49-F53 WeakPolarHBondContact O-CB 3.41Å; L49-F53 WeakPolarHBondContact O-CD2 3.4Å; L49-F53 WeakPolarHBondContact O-CG 3.45Å; L49-F53 PolarHBondContact O-N 3.44Å
50	E	59.2	Low	55.6	Low	135 Å²	135	112.8 Å²	112.8	63%	0.631	56%	0.556	S	S	*	*	H	α-helix	trans	-61.1	-40.3	174.1	-84.7	-178.1	163.3	0	0	112.5	F46 K47 F53 K54	F46-E50 WeakPolarHBondContact O-CB 3.4Å; F46-E50 WeakPolarHBondContact O-CG 3.15Å; F46-E50 PolarHBondContact O-N 3.45Å; K47-E50 PolarHBondContact O-N 3.43Å; E50-F53 PolarHBondContact O-N 2.88Å; E50-K54 WeakPolarHBondContact O-CB 3.44Å; E50-K54 PolarHBondContact O-N 2.9Å
51	N	67.3	Low	56.5	Low	101 Å²	101	110.1 Å²	110.1	54%	0.54	54%	0.544	S	S	.	.	H	α-helix	trans	-67.4	-40.9	177.4	-72.7	-27.9	0	0	0	111.8	K47 D48 L49 K54 A55	K47-N51 WeakPolarHBondContact O-CB 3.3Å; K47-N51 PolarHBondContact O-N 3.5Å; K47-N51 PolarHBondContact O-ND2 2.86Å; D48-N51 PolarHBondContact O-N 3.39Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 2.94Å; N51-K54 PolarHBondContact O-N 2.99Å; N51-A55 PolarHBondContact O-N 3.01Å
52	Q	63.4	Low	57.4	Low	122 Å²	122	111.8 Å²	111.8	57%	0.57	55%	0.549	S	S	*	.	H	α-helix	trans	-63.8	-41	173.5	-75.5	179.6	5.2	0	0	111.7	D48 L49 A55 F56	D48-Q52 WeakPolarHBondContact O-CB 3.04Å; D48-Q52 VanDerWaalsContact O-CG 3.3Å; D48-Q52 WeakPolarHBondContact O-CG 3.26Å; D48-Q52 PolarHBondContact O-N 3.01Å; L49-Q52 PolarHBondContact O-N 3.18Å; Q52-A55 PolarHBondContact O-N 3.35Å; Q52-F56 WeakPolarHBondContact O-CB 3.5Å; Q52-F56 PolarHBondContact O-N 3Å
53	F	53.2	Low	58.3	Low	100 Å²	100	107.9 Å²	107.9	44%	0.439	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-36.6	175.7	-81.5	-58.1	0	0	0	112.7	L49 E50 F56 R57	L49-F53 HydrophobicContact CD1-CD2 4.23Å; L49-F53 HydrophobicContact CD1-CE2 3.65Å; L49-F53 HydrophobicContact CD1-CZ 4.32Å; L49-F53 HydrophobicContact CD2-CE2 3.92Å; L49-F53 HydrophobicContact CG-CD2 3.78Å; L49-F53 HydrophobicContact CG-CE2 3.44Å; L49-F53 VanDerWaalsContact CG-CE2 3.44Å; L49-F53 WeakPolarHBondContact O-CB 3.41Å; L49-F53 WeakPolarHBondContact O-CD2 3.4Å; L49-F53 WeakPolarHBondContact O-CG 3.45Å; L49-F53 PolarHBondContact O-N 3.44Å; E50-F53 PolarHBondContact O-N 2.88Å; F53-F56 PolarHBondContact O-N 3.35Å; F53-R57 WeakPolarHBondContact O-CG 3.39Å; F53-R57 PolarHBondContact O-N 3.38Å
54	K	66.4	Low	58.7	Low	124 Å²	124	107.9 Å²	107.9	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-46.4	175.5	-170.2	-179	175.9	-171.2	0	111.6	E50 N51 F56 R57 E58	E50-K54 WeakPolarHBondContact O-CB 3.44Å; E50-K54 PolarHBondContact O-N 2.9Å; N51-K54 PolarHBondContact O-N 2.99Å; K54-F56 VanDerWaalsContact C-N 3.26Å; K54-F56 PolarHBondContact O-N 3.46Å; K54-R57 PolarHBondContact O-N 3.35Å; K54-E58 VanDerWaalsContact CE-OE1 3.3Å; K54-E58 WeakPolarHBondContact CE-OE1 3.3Å; K54-E58 PolarHBondContact O-N 2.91Å
55	A	68.3	Low	58.3	Low	53 Å²	53	108.2 Å²	108.2	44%	0.438	55%	0.55	S	S	.	.	H	α-helix	trans	-62.9	-33.8	176.6	0	0	0	0	0	112.4	N51 Q52 K59	N51-A55 PolarHBondContact O-N 3.01Å; Q52-A55 PolarHBondContact O-N 3.35Å; A55-K59 PolarHBondContact O-N 3.13Å; A55-K59 VanDerWaalsContact O-N 3.12Å
56	F	60.3	Low	58.4	Low	125 Å²	125	105.9 Å²	105.9	55%	0.548	56%	0.564	S	S	.	*	H	α-helix	trans	-69.3	-40.4	174.3	-171	-96.8	0	0	0	112.3	Q52 F53 K54 K59 A60	Q52-F56 WeakPolarHBondContact O-CB 3.5Å; Q52-F56 PolarHBondContact O-N 3Å; F53-F56 PolarHBondContact O-N 3.35Å; K54-F56 VanDerWaalsContact C-N 3.26Å; K54-F56 PolarHBondContact O-N 3.46Å; F56-K59 PolarHBondContact O-N 3.34Å; F56-A60 WeakPolarHBondContact O-CB 3.35Å; F56-A60 PolarHBondContact O-N 2.83Å
57	R	54.7	Low	58.5	Low	138 Å²	138	103 Å²	103	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-62.3	-43.1	174.4	-76.8	179.2	-174.4	177.7	2.8	112.4	F53 K54 A60 A61	F53-R57 WeakPolarHBondContact O-CG 3.39Å; F53-R57 PolarHBondContact O-N 3.38Å; K54-R57 PolarHBondContact O-N 3.35Å; R57-A60 PolarHBondContact O-N 3.31Å; R57-A61 WeakPolarHBondContact O-CB 3.36Å; R57-A61 PolarHBondContact O-N 2.92Å
58	E	65.1	Low	58	Low	107 Å²	107	104.7 Å²	104.7	50%	0.5	57%	0.574	S	S	.	*	H	α-helix	trans	-63.6	-43.8	177.6	-72.4	171.1	-177.7	0	0	110.8	K54 A60 A61 D62	K54-E58 VanDerWaalsContact CE-OE1 3.3Å; K54-E58 WeakPolarHBondContact CE-OE1 3.3Å; K54-E58 PolarHBondContact O-N 2.91Å; E58-A60 PolarHBondContact O-N 3.23Å; E58-A61 PolarHBondContact O-N 3.45Å; E58-D62 PolarHBondContact O-N 3.33Å; E58-D62 VanDerWaalsContact O-N 3.08Å
59	K	67	Low	57.1	Low	164 Å²	164	108.8 Å²	108.8	71%	0.713	58%	0.582	S	S	*	*	H	α-helix	trans	-63.7	-37.7	173.7	-94.2	-175.4	173.8	179.7	0	114.2	A55 F56 A63	A55-K59 PolarHBondContact O-N 3.13Å; A55-K59 VanDerWaalsContact O-N 3.12Å; F56-K59 PolarHBondContact O-N 3.34Å; K59-A63 WeakPolarHBondContact O-CB 3.33Å; K59-A63 PolarHBondContact O-N 2.92Å; K59-A63 VanDerWaalsContact O-N 3.16Å
60	A	54	Low	56.3	Low	38 Å²	38	110.1 Å²	110.1	31%	0.314	59%	0.593	S	S	.	*	H	α-helix	trans	-72.6	-37.9	179.6	0	0	0	0	0	111.9	F56 R57 E58 A63 M64	F56-A60 WeakPolarHBondContact O-CB 3.35Å; F56-A60 PolarHBondContact O-N 2.83Å; R57-A60 PolarHBondContact O-N 3.31Å; E58-A60 PolarHBondContact O-N 3.23Å; A60-A63 PolarHBondContact O-N 3.06Å; A60-M64 PolarHBondContact O-N 3.07Å
61	A	57.4	Low	55.2	Low	58 Å²	58	106 Å²	106	48%	0.479	58%	0.578	S	S	.	*	H	α-helix	trans	-66.4	-38.3	175.4	0	0	0	0	0	112.4	R57 E58 M64	R57-A61 WeakPolarHBondContact O-CB 3.36Å; R57-A61 PolarHBondContact O-N 2.92Å; E58-A61 PolarHBondContact O-N 3.45Å; A61-M64 CarbonylContact O-C 3.37Å
62	D	62.6	Low	53.7	Low	145 Å²	145	109.3 Å²	109.3	78%	0.775	59%	0.588	S	S	*	*	H	α-helix	trans	-70.6	-30.5	175.2	-82.1	-9.4	0	0	0	112.8	E58	E58-D62 PolarHBondContact O-N 3.33Å; E58-D62 VanDerWaalsContact O-N 3.08Å
63	A	62.4	Low	52.5	Low	76 Å²	76	111.2 Å²	111.2	63%	0.628	60%	0.596	S	S	*	*	H	α-helix	trans	-78	-25	179	0	0	0	0	0	113.3	K59 A60	K59-A63 WeakPolarHBondContact O-CB 3.33Å; K59-A63 PolarHBondContact O-N 2.92Å; K59-A63 VanDerWaalsContact O-N 3.16Å; A60-A63 PolarHBondContact O-N 3.06Å
64	M	52.3	Low	51.8	Low	124 Å²	124	115.8 Å²	115.8	61%	0.611	62%	0.616	S	S	*	*	S	Bend	trans	-145	78.1	-178.8	-72.1	-165.9	-90.3	0	0	111.7	A60 A61 G66 S67	A60-M64 PolarHBondContact O-N 3.07Å; A61-M64 CarbonylContact O-C 3.37Å; M64-G66 PolarHBondContact O-N 3.08Å; M64-G66 VanDerWaalsContact O-N 3.14Å; M64-S67 PolarHBondContact O-N 3.47Å; M64-S67 PolarHBondContact O-OG 3.4Å
65	P	43.2	Very low	50.5	Low	121 Å²	121	115.3 Å²	115.3	79%	0.786	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	115.3	179.8	24.3	-30.8	0	0	0	110.4
66	G	52.3	Low	49.9	Very low	85 Å²	85	118.2 Å²	118.2	88%	0.876	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.6	9.3	178.8	0	0	0	0	0	116.2	M64	M64-G66 PolarHBondContact O-N 3.08Å; M64-G66 VanDerWaalsContact O-N 3.14Å
67	S	49.5	Very low	50.2	Low	62 Å²	62	114.7 Å²	114.7	43%	0.434	63%	0.628	S	S	.	*			trans	-96.6	121	172.3	63.7	0	0	0	0	112	M64 W69	M64-S67 PolarHBondContact O-N 3.47Å; M64-S67 PolarHBondContact O-OG 3.4Å; S67-W69 PolarHBondContact O-N 3.12Å
68	D	45.6	Very low	51.7	Low	167 Å²	167	112.1 Å²	112.1	89%	0.893	62%	0.624	S	S	*	*			trans	-76.7	51.7	176.2	-78.7	-30.5	0	0	0	112	T70	D68-T70 PolarHBondContact O-N 3.33Å
69	W	40.9	Very low	53	Low	182 Å²	182	107.8 Å²	107.8	69%	0.689	61%	0.605	S	S	*	*			trans	-84.2	112.1	-179.7	-156.7	79.3	0	0	0	111.1	S67 P71	S67-W69 PolarHBondContact O-N 3.12Å; W69-P71 HydrophobicContact CE3-CG 4.44Å; W69-P71 HydrophobicContact CH2-CB 4.44Å; W69-P71 HydrophobicContact CZ3-CB 4.08Å; W69-P71 HydrophobicContact CZ3-CG 4Å
70	T	36.9	Very low	54.3	Low	85 Å²	85	101.6 Å²	101.6	52%	0.521	58%	0.581	S	S	.	*			trans	-111.5	134.1	172.3	62.3	0	0	0	0	111.5	D68 F72	D68-T70 PolarHBondContact O-N 3.33Å; T70-F72 PolarHBondContact O-N 3.18Å; T70-F72 VanDerWaalsContact O-N 3.07Å
71	P	35.9	Very low	56.4	Low	49 Å²	49	108 Å²	108	32%	0.318	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	5.4	-170.5	-12.5	28.5	0	0	0	115.6	W69	W69-P71 HydrophobicContact CE3-CG 4.44Å; W69-P71 HydrophobicContact CH2-CB 4.44Å; W69-P71 HydrophobicContact CZ3-CB 4.08Å; W69-P71 HydrophobicContact CZ3-CG 4Å
72	F	36.6	Very low	58.3	Low	171 Å²	171	111 Å²	111	75%	0.75	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	34.2	-175.9	-71.4	-74.2	0	0	0	112.7	T70 K74	T70-F72 PolarHBondContact O-N 3.18Å; T70-F72 VanDerWaalsContact O-N 3.07Å; F72-K74 PolarHBondContact O-N 3.41Å
73	E	37.8	Very low	60	Low	161 Å²	161	104.1 Å²	104.1	75%	0.752	57%	0.567	S	S	*	*			trans	-64.5	108.9	153.9	-79	-171.8	158.5	0	0	107.8	N75	E73-N75 PolarHBondContact O-N 2.94Å
74	K	39.5	Very low	61.7	Low	196 Å²	196	102.2 Å²	102.2	85%	0.852	55%	0.546	S	S	*	.			trans	-51.2	112.9	166.9	-157.9	-178.6	-168.8	-176.3	0	105.7	F72 S76	F72-K74 PolarHBondContact O-N 3.41Å; K74-S76 VanDerWaalsContact C-N 3.33Å; K74-S76 WeakPolarHBondContact O-CA 3.35Å; K74-S76 PolarHBondContact O-N 3.49Å
75	N	39.1	Very low	63.9	Low	115 Å²	115	96.5 Å²	96.5	62%	0.615	52%	0.518	S	S	*	.			trans	-48.8	96.9	-175.6	-152.9	-4.5	0	0	0	108.9	E73 S77	E73-N75 PolarHBondContact O-N 2.94Å; N75-S77 PolarHBondContact O-N 2.71Å; N75-S77 VanDerWaalsContact O-N 3.08Å; N75-S77 PolarHBondContact OD1-OG 3.46Å
76	S	53.8	Low	66.5	Low	114 Å²	114	90.8 Å²	90.8	80%	0.797	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	3.2	-164.5	59.6	0	0	0	0	112.7	K74	K74-S76 VanDerWaalsContact C-N 3.33Å; K74-S76 WeakPolarHBondContact O-CA 3.35Å; K74-S76 PolarHBondContact O-N 3.49Å
77	S	67.3	Low	68.8	Low	51 Å²	51	86.7 Å²	86.7	36%	0.357	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-25.2	-178.9	55.9	0	0	0	0	113.5	N75 M292	N75-S77 PolarHBondContact O-N 2.71Å; N75-S77 VanDerWaalsContact O-N 3.08Å; N75-S77 PolarHBondContact OD1-OG 3.46Å; S77-M292 WeakPolarHBondContact O-CE 3.42Å
78	L	86.2	Confident	71.1	Confident	83 Å²	83	84.2 Å²	84.2	44%	0.435	42%	0.421	S	S	.	.	S	Bend	trans	-80	141.6	-177.9	-65.5	177.8	0	0	0	111.4	M292 Q299	L78-M292 HydrophobicContact CD2-CE 4.29Å; L78-M292 HydrophobicContact CD2-CG 3.8Å; L78-M292 HydrophobicContact CD2-SD 4.33Å; L78-Q299 HydrophobicContact CD2-CG 4.5Å
79	P	92.7	Very high	73.6	Confident	16 Å²	16	76.7 Å²	76.7	10%	0.104	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-67.3	153.4	173.9	30.8	-34.4	0	0	0	110.3	L114 C258 V290 M292 Q299 V301	P79-L114 HydrophobicContact CB-CD2 3.91Å; P79-C258 HydrophobicContact CB-CB 4.13Å; P79-V290 HydrophobicContact CG-CB 4.2Å; P79-V290 HydrophobicContact CG-CG1 4.35Å; P79-V290 HydrophobicContact CG-CG2 4.47Å; P79-M292 VanDerWaalsContact CD-SD 3.58Å; P79-M292 HydrophobicContact CG-SD 4.4Å; P79-Q299 HydrophobicContact CG-CB 3.82Å; P79-Q299 HydrophobicContact CG-CG 4.46Å; P79-V301 HydrophobicContact CB-CG2 3.7Å; P79-V301 HydrophobicContact CG-CG2 3.93Å
80	P	95.1	Very high	76.3	Confident	34 Å²	34	68 Å²	68	22%	0.221	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-64.1	151.1	170.6	29.6	-35.4	0	0	0	110.7	R82 A83 L114 Y256	P80-R82 PolarHBondContact O-N 2.76Å; P80-R82 VanDerWaalsContact O-N 3.15Å; P80-A83 HydrophobicContact CG-CB 4.46Å; P80-L114 HydrophobicContact CG-CD2 4.49Å; P80-Y256 HydrophobicContact CG-CD2 4.25Å; P80-Y256 HydrophobicContact CG-CG 4.22Å
81	E	96.5	Very high	79.2	Confident	173 Å²	173	64.7 Å²	64.7	81%	0.808	33%	0.333	S	S	*	.	S	Bend	trans	-59.6	-26.1	174.9	-65.8	178	178.2	0	0	112.8	E302	E81-E302 PolarHBondContact O-N 3.46Å
82	R	97.4	Very high	82.2	Confident	121 Å²	121	62.4 Å²	62.4	46%	0.457	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	132	179.8	-175.8	178.3	170.2	-177.4	-3.7	112	P80 R112 E302	P80-R82 PolarHBondContact O-N 2.76Å; P80-R82 VanDerWaalsContact O-N 3.15Å; R82-R112 VanDerWaalsContact CD-NH2 3.26Å; R82-R112 PolarHBondContact O-NH1 2.76Å; R82-E302 WeakPolarHBondContact CA-O 3.28Å; R82-E302 HydrophobicContact CB-CB 4.11Å; R82-E302 WeakPolarHBondContact CD-OE2 3.5Å; R82-E302 HydrophobicContact CG-CB 3.98Å; R82-E302 HydrophobicContact CG-CG 4.36Å
83	A	98.1	Very high	85.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	139.6	169.1	0	0	0	0	0	108.9	P80 I85 V86 L114 V301 E302 C303	P80-A83 HydrophobicContact CG-CB 4.46Å; A83-I85 VanDerWaalsContact C-N 3.32Å; A83-I85 PolarHBondContact O-N 2.91Å; A83-V86 HydrophobicContact CB-CG2 4.15Å; A83-L114 HydrophobicContact CB-CB 3.7Å; A83-V301 HydrophobicContact CB-CG1 4.06Å; A83-E302 PolarHBondContact N-O 2.9Å; A83-C303 WeakPolarHBondContact O-CA 3.3Å; A83-C303 VanDerWaalsContact O-CB 3.3Å; A83-C303 WeakPolarHBondContact O-CB 3.22Å
84	D	98.3	Very high	88.1	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.193	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-36.3	-178	-53.5	-57.1	0	0	0	110.5	V111 R112 A304 I305	D84-V111 HydrophobicContact CB-CG1 4.36Å; D84-R112 PolarHBondContact N-O 2.86Å; D84-R112 IonicContact OD1-CZ 2.91Å; D84-R112 IonicContact OD1-NE 2.71Å; D84-R112 IonicContact OD1-NH2 3.1Å; D84-R112 PolarHBondContact OD1-NH2 2.76Å; D84-R112 WeakPolarHBondContact OD2-CB 3.37Å; D84-R112 IonicContact OD2-CZ 3.44Å; D84-R112 PolarHBondContact OD2-N 3.06Å; D84-R112 IonicContact OD2-NE 3.87Å; D84-R112 PolarHBondContact OD2-NE 2.65Å; D84-R112 VanDerWaalsContact OD2-NE 3.1Å; D84-R112 IonicContact OD2-NH2 3.74Å; D84-A304 WeakPolarHBondContact O-CB 3.43Å; D84-A304 PolarHBondContact O-N 2.77Å; D84-I305 PolarHBondContact O-N 3.46Å
85	I	98.8	Very high	90.9	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.7	176.1	-52.9	175.4	0	0	0	109.6	A83 I87 L101 V111 R112 V113 L114 I305 V307 I474	A83-I85 VanDerWaalsContact C-N 3.32Å; A83-I85 PolarHBondContact O-N 2.91Å; I85-I87 HydrophobicContact CG2-CG1 4.3Å; I85-L101 HydrophobicContact CD1-CD1 3.75Å; I85-L101 HydrophobicContact CD1-CD2 3.69Å; I85-L101 HydrophobicContact CD1-CG 4.3Å; I85-L101 HydrophobicContact CG2-CD1 4.04Å; I85-V111 HydrophobicContact CD1-CG1 3.66Å; I85-V111 HydrophobicContact CG1-CG1 4.04Å; I85-R112 PolarHBondContact N-O 3.11Å; I85-R112 VanDerWaalsContact N-O 3.08Å; I85-V113 WeakPolarHBondContact O-CA 3.49Å; I85-L114 PolarHBondContact O-N 3.29Å; I85-I305 WeakPolarHBondContact CA-O 3.32Å; I85-I305 HydrophobicContact CG1-CB 4.22Å; I85-I305 HydrophobicContact CG2-CB 4.41Å; I85-I305 HydrophobicContact CG2-CG2 4.23Å; I85-V307 HydrophobicContact CG2-CG2 4.09Å; I85-I474 HydrophobicContact CD1-CG2 3.83Å
86	V	98.9	Very high	93.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.8	171.4	175.9	0	0	0	0	109.3	A83 V88 L114 V116 A288 V301 C303 I305 V306 V307	A83-V86 HydrophobicContact CB-CG2 4.15Å; V86-V88 HydrophobicContact CG1-CG2 4.48Å; V86-L114 HydrophobicContact CG2-CB 4.47Å; V86-L114 HydrophobicContact CG2-CD2 4.33Å; V86-V116 HydrophobicContact CG1-CG2 4.19Å; V86-A288 HydrophobicContact CG1-CB 4.09Å; V86-V301 HydrophobicContact CG2-CG1 3.93Å; V86-C303 HydrophobicContact CB-CB 4.42Å; V86-C303 HydrophobicContact CG2-CB 3.62Å; V86-I305 PolarHBondContact N-O 3.1Å; V86-V306 CarbonylContact O-C 3.5Å; V86-V306 VanDerWaalsContact O-CA 3.28Å; V86-V306 WeakPolarHBondContact O-CA 2.87Å; V86-V307 PolarHBondContact O-N 2.9Å
87	I	98.9	Very high	95.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.8	175.7	-58.6	169.2	0	0	0	107.7	I85 I97 A98 L101 V113 L114 V115 V116 V307 A309	I85-I87 HydrophobicContact CG2-CG1 4.3Å; I87-I97 HydrophobicContact CD1-CB 4.23Å; I87-I97 HydrophobicContact CD1-CG2 3.85Å; I87-I97 HydrophobicContact CG1-CG2 4.47Å; I87-A98 HydrophobicContact CD1-CB 3.7Å; I87-L101 HydrophobicContact CD1-CD1 4.17Å; I87-V113 HydrophobicContact CD1-CG1 3.65Å; I87-V113 HydrophobicContact CG1-CG1 4.33Å; I87-L114 PolarHBondContact N-O 2.94Å; I87-V115 HydrophobicContact CB-CG2 4.22Å; I87-V115 HydrophobicContact CD1-CG2 4.08Å; I87-V116 PolarHBondContact O-N 2.87Å; I87-V307 WeakPolarHBondContact CA-O 3.46Å; I87-V307 HydrophobicContact CG1-CB 4.21Å; I87-V307 HydrophobicContact CG1-CG2 4.39Å; I87-A309 HydrophobicContact CG2-CB 4.26Å
88	V	98.9	Very high	97.4	Very high	9 Å²	9	24.8 Å²	24.8	6%	0.055	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.5	178.1	-170.2	0	0	0	0	108.4	V86 V262 F265 V306 V307 A309 A310 V317	V86-V88 HydrophobicContact CG1-CG2 4.48Å; V88-V262 HydrophobicContact CB-CG2 4.44Å; V88-V262 HydrophobicContact CG1-CB 3.86Å; V88-V262 HydrophobicContact CG1-CG2 3.84Å; V88-V262 HydrophobicContact CG2-CB 4.39Å; V88-V262 HydrophobicContact CG2-CG1 4.44Å; V88-V262 HydrophobicContact CG2-CG2 3.96Å; V88-F265 HydrophobicContact CG2-CZ 4.36Å; V88-V306 HydrophobicContact CG2-CG1 3.86Å; V88-V307 PolarHBondContact N-O 3.22Å; V88-A309 CarbonylContact O-C 3.57Å; V88-A309 WeakPolarHBondContact O-CA 3.31Å; V88-A309 PolarHBondContact O-N 3.13Å; V88-A310 HydrophobicContact CG1-CB 4.32Å; V88-A310 PolarHBondContact O-N 2.94Å; V88-V317 HydrophobicContact CG1-CG1 4.18Å; V88-V317 HydrophobicContact CG1-CG2 4.13Å
89	G	98.4	Very high	98	Very high	10 Å²	10	20.9 Å²	20.9	10%	0.103	11%	0.106	C	C	.	.			trans	105	117	-173.9	0	0	0	0	0	111.7	V116	G89-V116 WeakPolarHBondContact CA-O 3.26Å; G89-V116 PolarHBondContact N-O 2.93Å
90	G	97.7	Very high	98.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.106	C	C	.	.			trans	-101.9	30	177.5	0	0	0	0	0	113.2	W95 E117 Y122	G90-W95 PolarHBondContact O-NE1 3.12Å; G90-E117 VanDerWaalsContact CA-OE2 3.28Å; G90-E117 WeakPolarHBondContact CA-OE2 3.33Å; G90-E117 PolarHBondContact N-OE2 3.14Å; G90-Y122 WeakPolarHBondContact O-CE1 3.4Å; G90-Y122 PolarHBondContact O-OH 3.35Å
91	G	98	Very high	98.5	Very high	14 Å²	14	19.7 Å²	19.7	14%	0.144	10%	0.095	C	C	.	.	S	Bend	trans	-69	-177.6	165.2	0	0	0	0	0	112	V93 G94 W95	G91-V93 VanDerWaalsContact C-N 3.28Å; G91-V93 PolarHBondContact O-N 3.08Å; G91-G94 PolarHBondContact O-N 3.14Å; G91-G94 VanDerWaalsContact O-N 3.11Å; G91-W95 PolarHBondContact O-N 2.64Å
92	V	98.4	Very high	98.6	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.012	6%	0.058	C	C	.	.	H	α-helix	trans	-60.5	-35.8	-175.4	66.5	0	0	0	0	113.1	S96 T127 L242 L243 F246 L460 S463	V92-S96 WeakPolarHBondContact O-CB 3.41Å; V92-S96 PolarHBondContact O-N 3.35Å; V92-T127 HydrophobicContact CB-CG2 3.69Å; V92-T127 HydrophobicContact CG1-CG2 3.88Å; V92-T127 PolarHBondContact N-OG1 3.13Å; V92-L242 HydrophobicContact CG2-CD2 3.92Å; V92-L242 HydrophobicContact CG2-CG 3.94Å; V92-L243 HydrophobicContact CB-CD1 4.38Å; V92-F246 HydrophobicContact CG2-CD2 3.93Å; V92-F246 HydrophobicContact CG2-CE2 4.25Å; V92-L460 HydrophobicContact CB-CD1 4.36Å; V92-L460 HydrophobicContact CG1-CD1 3.85Å; V92-L460 HydrophobicContact CG2-CD1 4.34Å; V92-S463 WeakPolarHBondContact CG2-OG 2.95Å
93	V	98.8	Very high	98.6	Very high	17 Å²	17	10.7 Å²	10.7	10%	0.103	6%	0.058	C	C	.	.	H	α-helix	trans	-63.4	-47.8	175.4	176.4	0	0	0	0	110.7	G91 S96 I97 A309 A452 F455 V466	G91-V93 VanDerWaalsContact C-N 3.28Å; G91-V93 PolarHBondContact O-N 3.08Å; V93-S96 PolarHBondContact O-N 3.27Å; V93-I97 HydrophobicContact CG1-CD1 3.81Å; V93-I97 WeakPolarHBondContact O-CD1 3.47Å; V93-I97 VanDerWaalsContact O-CG1 3.22Å; V93-I97 WeakPolarHBondContact O-CG1 3.47Å; V93-I97 PolarHBondContact O-N 2.72Å; V93-A309 HydrophobicContact CG1-CB 4.27Å; V93-A452 HydrophobicContact CG1-CB 3.93Å; V93-F455 HydrophobicContact CG1-CE2 4.39Å; V93-F455 HydrophobicContact CG2-CE2 4.23Å; V93-V466 HydrophobicContact CG1-CG1 4.22Å
94	G	98.8	Very high	98.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.3	-46.3	179.4	0	0	0	0	0	113	G91 I97 A98	G91-G94 PolarHBondContact O-N 3.14Å; G91-G94 VanDerWaalsContact O-N 3.11Å; G94-I97 PolarHBondContact O-N 2.97Å; G94-A98 PolarHBondContact O-N 2.94Å
95	W	98.9	Very high	98.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-69.1	-34.3	176.6	-75.6	115.4	0	0	0	113.5	G90 G91 A98 Y99 V115 Y122 F246 R247 A250 I251 V255 Q257	G90-W95 PolarHBondContact O-NE1 3.12Å; G91-W95 PolarHBondContact O-N 2.64Å; W95-A98 HydrophobicContact CE3-CB 4.29Å; W95-A98 PolarHBondContact O-N 3.38Å; W95-Y99 WeakPolarHBondContact O-CB 3.49Å; W95-Y99 PolarHBondContact O-N 3.14Å; W95-V115 HydrophobicContact CD2-CG1 4.25Å; W95-V115 HydrophobicContact CD2-CG2 4.35Å; W95-V115 HydrophobicContact CE3-CB 4.4Å; W95-V115 HydrophobicContact CE3-CG2 3.89Å; W95-V115 HydrophobicContact CH2-CB 3.77Å; W95-V115 HydrophobicContact CH2-CG1 4.14Å; W95-V115 HydrophobicContact CH2-CG2 4.06Å; W95-V115 HydrophobicContact CZ2-CB 3.98Å; W95-V115 HydrophobicContact CZ2-CG1 3.81Å; W95-V115 HydrophobicContact CZ3-CB 4.01Å; W95-V115 HydrophobicContact CZ3-CG2 3.75Å; W95-Y122 PolarHBondContact NE1-OH 2.91Å; W95-F246 HydrophobicContact CB-CB 3.81Å; W95-R247 HydrophobicContact CD2-CB 3.75Å; W95-R247 HydrophobicContact CD2-CG 3.96Å; W95-R247 HydrophobicContact CE3-CB 4.26Å; W95-R247 HydrophobicContact CE3-CG 4.33Å; W95-R247 HydrophobicContact CG-CB 3.9Å; W95-R247 HydrophobicContact CH2-CG 4.11Å; W95-R247 HydrophobicContact CZ2-CB 4.43Å; W95-R247 HydrophobicContact CZ2-CG 3.71Å; W95-R247 HydrophobicContact CZ3-CG 4.39Å; W95-A250 HydrophobicContact CE3-CB 3.83Å; W95-A250 HydrophobicContact CZ3-CB 4.12Å; W95-I251 HydrophobicContact CH2-CD1 4.16Å; W95-I251 HydrophobicContact CH2-CG1 4.07Å; W95-I251 HydrophobicContact CZ3-CG1 4.06Å; W95-V255 HydrophobicContact CZ3-CB 4.42Å; W95-V255 HydrophobicContact CZ3-CG1 3.77Å; W95-Q257 HydrophobicContact CH2-CB 3.95Å; W95-Q257 HydrophobicContact CH2-CG 4.06Å; W95-Q257 HydrophobicContact CZ2-CB 4.43Å; W95-Q257 HydrophobicContact CZ2-CG 4.03Å
96	S	98.9	Very high	97.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.3	-44.5	173.1	178	0	0	0	0	111.6	V92 V93 A98 Y99 W100 S463 G467	V92-S96 WeakPolarHBondContact O-CB 3.41Å; V92-S96 PolarHBondContact O-N 3.35Å; V93-S96 PolarHBondContact O-N 3.27Å; S96-A98 VanDerWaalsContact C-N 3.35Å; S96-A98 PolarHBondContact O-N 3.15Å; S96-Y99 PolarHBondContact O-N 3.39Å; S96-W100 VanDerWaalsContact O-CD1 3.29Å; S96-W100 PolarHBondContact O-N 3.18Å; S96-S463 VanDerWaalsContact CB-O 3.29Å; S96-S463 WeakPolarHBondContact CB-O 3.35Å; S96-S463 PolarHBondContact OG-O 2.73Å; S96-G467 WeakPolarHBondContact OG-CA 3.41Å
97	I	98.9	Very high	97.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-47	174.3	-65.7	163.1	0	0	0	110.2	I87 V93 G94 Y99 W100 L101 V307 A309 A452 M470	I87-I97 HydrophobicContact CD1-CB 4.23Å; I87-I97 HydrophobicContact CD1-CG2 3.85Å; I87-I97 HydrophobicContact CG1-CG2 4.47Å; V93-I97 HydrophobicContact CG1-CD1 3.81Å; V93-I97 WeakPolarHBondContact O-CD1 3.47Å; V93-I97 VanDerWaalsContact O-CG1 3.22Å; V93-I97 WeakPolarHBondContact O-CG1 3.47Å; V93-I97 PolarHBondContact O-N 2.72Å; G94-I97 PolarHBondContact O-N 2.97Å; I97-Y99 PolarHBondContact O-N 3.38Å; I97-W100 PolarHBondContact O-N 3.36Å; I97-L101 HydrophobicContact CG2-CD1 3.82Å; I97-L101 HydrophobicContact CG2-CG 4.27Å; I97-L101 WeakPolarHBondContact O-CB 3.36Å; I97-L101 VanDerWaalsContact O-CG 3.26Å; I97-L101 WeakPolarHBondContact O-CG 3.39Å; I97-L101 PolarHBondContact O-N 2.78Å; I97-V307 HydrophobicContact CD1-CG1 3.94Å; I97-A309 HydrophobicContact CD1-CB 4.34Å; I97-A452 HydrophobicContact CD1-CB 3.63Å; I97-M470 HydrophobicContact CD1-CB 4.33Å; I97-M470 HydrophobicContact CD1-CG 4.1Å; I97-M470 HydrophobicContact CG1-CB 3.93Å; I97-M470 HydrophobicContact CG1-CG 4.15Å; I97-M470 HydrophobicContact CG2-CB 4.27Å
98	A	98.9	Very high	96.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-44.9	179.3	0	0	0	0	0	112.5	I87 G94 W95 S96 K102 V113 V115 A250 V255	I87-A98 HydrophobicContact CD1-CB 3.7Å; G94-A98 PolarHBondContact O-N 2.94Å; W95-A98 HydrophobicContact CE3-CB 4.29Å; W95-A98 PolarHBondContact O-N 3.38Å; S96-A98 VanDerWaalsContact C-N 3.35Å; S96-A98 PolarHBondContact O-N 3.15Å; A98-K102 WeakPolarHBondContact O-CG 3.15Å; A98-K102 PolarHBondContact O-N 3.36Å; A98-V113 HydrophobicContact CB-CG1 4.07Å; A98-V115 HydrophobicContact CB-CG2 3.65Å; A98-A250 HydrophobicContact CB-CB 4.36Å; A98-V255 HydrophobicContact CB-CG1 4.04Å; A98-V255 HydrophobicContact CB-CG2 4.14Å
99	Y	98.8	Very high	96.4	Very high	2 Å²	2	42 Å²	42	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-51.8	174.4	162.1	-102.3	0	0	0	111.4	W95 S96 I97 L101 K102 Q103 F153 H160 L161 F246 K249 M253	W95-Y99 WeakPolarHBondContact O-CB 3.49Å; W95-Y99 PolarHBondContact O-N 3.14Å; S96-Y99 PolarHBondContact O-N 3.39Å; I97-Y99 PolarHBondContact O-N 3.38Å; Y99-L101 PolarHBondContact O-N 2.72Å; Y99-K102 PolarHBondContact O-N 2.81Å; Y99-Q103 HydrophobicContact CE2-CB 4.42Å; Y99-Q103 WeakPolarHBondContact O-CB 3.38Å; Y99-Q103 PolarHBondContact O-N 3.33Å; Y99-F153 AromaticContact CE1-CE2 3.88Å; Y99-F153 HydrophobicContact CE1-CE2 3.88Å; Y99-F153 HydrophobicContact CE1-CZ 4Å; Y99-H160 WeakPolarHBondContact CE2-O 3.36Å; Y99-H160 WeakPolarHBondContact OH-CB 3.43Å; Y99-H160 PolarHBondContact OH-O 3.21Å; Y99-L161 HydrophobicContact CD1-CD2 4.19Å; Y99-L161 HydrophobicContact CD2-CD2 3.76Å; Y99-L161 HydrophobicContact CE1-CD2 4.14Å; Y99-L161 HydrophobicContact CE2-CD2 3.69Å; Y99-L161 HydrophobicContact CG-CD2 4.01Å; Y99-F246 HydrophobicContact CD1-CD1 4.03Å; Y99-F246 AromaticContact CD1-CE1 3.72Å; Y99-F246 HydrophobicContact CD1-CE1 3.72Å; Y99-F246 HydrophobicContact CE1-CE1 4.35Å; Y99-F246 HydrophobicContact CG-CD1 4.02Å; Y99-F246 HydrophobicContact CG-CE1 4.2Å; Y99-K249 HydrophobicContact CD2-CB 4.39Å; Y99-K249 HydrophobicContact CD2-CG 3.6Å; Y99-K249 HydrophobicContact CE2-CG 3.69Å; Y99-M253 HydrophobicContact CD2-SD 3.81Å; Y99-M253 HydrophobicContact CE2-SD 4.06Å
100	W	98.8	Very high	96.1	Very high	24 Å²	24	43.7 Å²	43.7	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-32.7	-176.5	-82.5	111.4	0	0	0	113.5	S96 I97 K102 Q103 K104 F153 P464 G467 R468 A471	S96-W100 VanDerWaalsContact O-CD1 3.29Å; S96-W100 PolarHBondContact O-N 3.18Å; I97-W100 PolarHBondContact O-N 3.36Å; W100-K102 VanDerWaalsContact C-N 3.32Å; W100-K102 PolarHBondContact O-N 3.4Å; W100-Q103 HydrophobicContact CE3-CB 4.14Å; W100-Q103 HydrophobicContact CE3-CG 4.08Å; W100-Q103 HydrophobicContact CZ3-CG 4.06Å; W100-Q103 PolarHBondContact O-N 3.31Å; W100-K104 HydrophobicContact CE3-CG 4.47Å; W100-K104 WeakPolarHBondContact O-CB 3.19Å; W100-K104 PolarHBondContact O-N 2.9Å; W100-F153 AromaticContact CZ2-CD2 3.82Å; W100-F153 HydrophobicContact CZ2-CD2 3.82Å; W100-F153 AromaticContact CZ2-CE2 3.67Å; W100-F153 HydrophobicContact CZ2-CE2 3.67Å; W100-P464 PolarHBondContact NE1-O 3.16Å; W100-G467 WeakPolarHBondContact CB-O 3.38Å; W100-G467 VanDerWaalsContact CD1-C 3.41Å; W100-R468 HydrophobicContact CD2-CB 3.71Å; W100-R468 HydrophobicContact CD2-CG 4.02Å; W100-R468 HydrophobicContact CE3-CB 4.24Å; W100-R468 HydrophobicContact CE3-CG 4.02Å; W100-R468 HydrophobicContact CG-CB 3.95Å; W100-R468 HydrophobicContact CH2-CG 4.29Å; W100-R468 HydrophobicContact CZ2-CB 4.06Å; W100-R468 HydrophobicContact CZ2-CG 4.27Å; W100-R468 HydrophobicContact CZ3-CG 4.16Å; W100-A471 HydrophobicContact CB-CB 3.64Å
101	L	98.7	Very high	96	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-43.8	171.6	-75.6	168.7	0	0	0	111.2	I85 I87 I97 Y99 E105 V113 A471 I474 L475	I85-L101 HydrophobicContact CD1-CD1 3.75Å; I85-L101 HydrophobicContact CD1-CD2 3.69Å; I85-L101 HydrophobicContact CD1-CG 4.3Å; I85-L101 HydrophobicContact CG2-CD1 4.04Å; I87-L101 HydrophobicContact CD1-CD1 4.17Å; I97-L101 HydrophobicContact CG2-CD1 3.82Å; I97-L101 HydrophobicContact CG2-CG 4.27Å; I97-L101 WeakPolarHBondContact O-CB 3.36Å; I97-L101 VanDerWaalsContact O-CG 3.26Å; I97-L101 WeakPolarHBondContact O-CG 3.39Å; I97-L101 PolarHBondContact O-N 2.78Å; Y99-L101 PolarHBondContact O-N 2.72Å; L101-E105 PolarHBondContact O-N 2.94Å; L101-V113 HydrophobicContact CB-CG2 4.15Å; L101-V113 HydrophobicContact CD1-CG1 4.24Å; L101-V113 HydrophobicContact CD1-CG2 4.17Å; L101-A471 HydrophobicContact CD2-CB 4.03Å; L101-A471 HydrophobicContact CG-CB 4.18Å; L101-I474 HydrophobicContact CD2-CB 4.18Å; L101-I474 HydrophobicContact CD2-CD1 4.33Å; L101-I474 HydrophobicContact CD2-CG2 3.96Å; L101-L475 HydrophobicContact CD2-CD1 4.05Å; L101-L475 HydrophobicContact CD2-CD2 4.29Å; L101-L475 HydrophobicContact CD2-CG 3.93Å
102	K	98.2	Very high	96	Very high	7 Å²	7	47.8 Å²	47.8	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-73.8	-35.4	176.2	-63.6	-61.5	-70.2	173.3	0	112.6	A98 Y99 W100 K104 E105 D109 V111 V113 M253 V255	A98-K102 WeakPolarHBondContact O-CG 3.15Å; A98-K102 PolarHBondContact O-N 3.36Å; Y99-K102 PolarHBondContact O-N 2.81Å; W100-K102 VanDerWaalsContact C-N 3.32Å; W100-K102 PolarHBondContact O-N 3.4Å; K102-K104 VanDerWaalsContact C-N 3.28Å; K102-K104 PolarHBondContact O-N 3.49Å; K102-E105 VanDerWaalsContact CE-OE1 3.31Å; K102-E105 WeakPolarHBondContact CE-OE1 3.32Å; K102-E105 WeakPolarHBondContact CE-OE2 3.36Å; K102-E105 IonicContact NZ-OE1 3.68Å; K102-E105 PolarHBondContact NZ-OE1 3.14Å; K102-E105 IonicContact NZ-OE2 2.74Å; K102-E105 PolarHBondContact NZ-OE2 3.28Å; K102-E105 VanDerWaalsContact O-CG 3.28Å; K102-E105 WeakPolarHBondContact O-CG 3.26Å; K102-E105 PolarHBondContact O-N 3.43Å; K102-D109 IonicContact NZ-OD1 2.75Å; K102-V111 PolarHBondContact NZ-O 2.97Å; K102-V113 HydrophobicContact CD-CG2 4.16Å; K102-M253 HydrophobicContact CB-CB 3.95Å; K102-M253 HydrophobicContact CB-CE 3.7Å; K102-M253 HydrophobicContact CB-SD 4.25Å; K102-M253 WeakPolarHBondContact CE-O 3.26Å; K102-M253 HydrophobicContact CG-CB 4.32Å; K102-V255 HydrophobicContact CD-CG2 4.22Å; K102-V255 HydrophobicContact CG-CG2 3.48Å; K102-V255 VanDerWaalsContact CG-CG2 3.48Å
103	Q	97.4	Very high	96	Very high	98 Å²	98	47.7 Å²	47.7	46%	0.458	23%	0.232	S	C	.	.	H	α-helix	trans	-66.2	-32.3	177.4	-175.3	60.8	18.4	0	0	112.3	Y99 W100 M253	Y99-Q103 HydrophobicContact CE2-CB 4.42Å; Y99-Q103 WeakPolarHBondContact O-CB 3.38Å; Y99-Q103 PolarHBondContact O-N 3.33Å; W100-Q103 HydrophobicContact CE3-CB 4.14Å; W100-Q103 HydrophobicContact CE3-CG 4.08Å; W100-Q103 HydrophobicContact CZ3-CG 4.06Å; W100-Q103 PolarHBondContact O-N 3.31Å; Q103-M253 HydrophobicContact CB-CE 4.15Å
104	K	95.8	Very high	96	Very high	54 Å²	54	46.9 Å²	46.9	24%	0.235	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	0.3	178.5	-71.1	-179.6	56.9	68.9	0	113.8	W100 K102 M106 A471 E472 L475 D476	W100-K104 HydrophobicContact CE3-CG 4.47Å; W100-K104 WeakPolarHBondContact O-CB 3.19Å; W100-K104 PolarHBondContact O-N 2.9Å; K102-K104 VanDerWaalsContact C-N 3.28Å; K102-K104 PolarHBondContact O-N 3.49Å; K104-M106 PolarHBondContact O-N 3.5Å; K104-A471 HydrophobicContact CD-CB 3.98Å; K104-E472 HydrophobicContact CD-CG 4.04Å; K104-E472 VanDerWaalsContact CE-CG 3.5Å; K104-L475 HydrophobicContact CB-CD1 3.91Å; K104-D476 WeakPolarHBondContact CE-OD2 3.47Å; K104-D476 IonicContact NZ-OD1 3.81Å; K104-D476 IonicContact NZ-OD2 2.75Å; K104-D476 PolarHBondContact NZ-OD2 2.69Å
105	E	93.5	Very high	96	Very high	34 Å²	34	46.9 Å²	46.9	16%	0.159	23%	0.227	C	C	.	.			trans	-65.7	129.2	179.4	84	-177.8	161.1	0	0	110.5	L101 K102 I107 D109 G110 V111	L101-E105 PolarHBondContact O-N 2.94Å; K102-E105 VanDerWaalsContact CE-OE1 3.31Å; K102-E105 WeakPolarHBondContact CE-OE1 3.32Å; K102-E105 WeakPolarHBondContact CE-OE2 3.36Å; K102-E105 IonicContact NZ-OE1 3.68Å; K102-E105 PolarHBondContact NZ-OE1 3.14Å; K102-E105 IonicContact NZ-OE2 2.74Å; K102-E105 PolarHBondContact NZ-OE2 3.28Å; K102-E105 VanDerWaalsContact O-CG 3.28Å; K102-E105 WeakPolarHBondContact O-CG 3.26Å; K102-E105 PolarHBondContact O-N 3.43Å; E105-I107 VanDerWaalsContact C-N 3.34Å; E105-I107 WeakPolarHBondContact CG-O 3.46Å; E105-D109 PolarHBondContact OE1-N 3.43Å; E105-D109 VanDerWaalsContact OE1-N 3.13Å; E105-D109 PolarHBondContact OE2-N 3.35Å; E105-G110 PolarHBondContact OE2-N 2.8Å; E105-V111 PolarHBondContact OE2-N 3.29Å
106	M	89.3	Confident	96	Very high	183 Å²	183	47.1 Å²	47.1	90%	0.901	23%	0.228	S	C	*	.	S	Bend	trans	-75	-28.2	-176.9	-67.6	-62.4	-63.9	0	0	112.8	K104	K104-M106 PolarHBondContact O-N 3.5Å
107	I	91.4	Very high	95.9	Very high	126 Å²	126	47.9 Å²	47.9	65%	0.646	23%	0.232	S	C	*	.	S	Bend	trans	-124.3	124.2	179.9	-58.5	174.5	0	0	0	105.9	E105 D109 G110	E105-I107 VanDerWaalsContact C-N 3.34Å; E105-I107 WeakPolarHBondContact CG-O 3.46Å; I107-D109 PolarHBondContact O-N 3.18Å; I107-G110 WeakPolarHBondContact O-CA 3.32Å; I107-G110 PolarHBondContact O-N 3.21Å
108	R	88.3	Confident	95.7	Very high	209 Å²	209	52.9 Å²	52.9	79%	0.789	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	130.2	175.3	-175.1	179.6	178.9	171.9	3.9	109.7	G110	R108-G110 PolarHBondContact O-N 2.92Å
109	D	89.3	Confident	95.5	Very high	103 Å²	103	53.8 Å²	53.8	55%	0.551	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	17.7	-176	-53.3	-46.4	0	0	0	114.2	K102 E105 I107 V111	K102-D109 IonicContact NZ-OD1 2.75Å; E105-D109 PolarHBondContact OE1-N 3.43Å; E105-D109 VanDerWaalsContact OE1-N 3.13Å; E105-D109 PolarHBondContact OE2-N 3.35Å; I107-D109 PolarHBondContact O-N 3.18Å; D109-V111 VanDerWaalsContact C-N 3.33Å
110	G	90.8	Very high	95.1	Very high	44 Å²	44	56.9 Å²	56.9	45%	0.454	28%	0.276	S	S	.	.			trans	-76.2	-20.1	178.8	0	0	0	0	0	113.7	E105 I107 R108	E105-G110 PolarHBondContact OE2-N 2.8Å; I107-G110 WeakPolarHBondContact O-CA 3.32Å; I107-G110 PolarHBondContact O-N 3.21Å; R108-G110 PolarHBondContact O-N 2.92Å
111	V	95.2	Very high	94.9	Very high	26 Å²	26	60 Å²	60	16%	0.158	30%	0.298	C	S	.	.	S	Bend	trans	-125.8	122.8	174.8	-173.9	0	0	0	0	109.7	D84 I85 K102 E105 D109 V113 L475	D84-V111 HydrophobicContact CB-CG1 4.36Å; I85-V111 HydrophobicContact CD1-CG1 3.66Å; I85-V111 HydrophobicContact CG1-CG1 4.04Å; K102-V111 PolarHBondContact NZ-O 2.97Å; E105-V111 PolarHBondContact OE2-N 3.29Å; D109-V111 VanDerWaalsContact C-N 3.33Å; V111-V113 HydrophobicContact CG1-CG2 3.94Å; V111-L475 HydrophobicContact CG2-CD2 4.29Å
112	R	97.9	Very high	94.7	Very high	75 Å²	75	60 Å²	60	28%	0.283	30%	0.298	S	S	.	.			trans	-89.3	115.2	171.8	-64.1	172	-65.1	168	-0	109.7	R82 D84 I85 Y256	R82-R112 VanDerWaalsContact CD-NH2 3.26Å; R82-R112 PolarHBondContact O-NH1 2.76Å; D84-R112 PolarHBondContact N-O 2.86Å; D84-R112 IonicContact OD1-CZ 2.91Å; D84-R112 IonicContact OD1-NE 2.71Å; D84-R112 IonicContact OD1-NH2 3.1Å; D84-R112 PolarHBondContact OD1-NH2 2.76Å; D84-R112 WeakPolarHBondContact OD2-CB 3.37Å; D84-R112 IonicContact OD2-CZ 3.44Å; D84-R112 PolarHBondContact OD2-N 3.06Å; D84-R112 IonicContact OD2-NE 3.87Å; D84-R112 PolarHBondContact OD2-NE 2.65Å; D84-R112 VanDerWaalsContact OD2-NE 3.1Å; D84-R112 IonicContact OD2-NH2 3.74Å; I85-R112 PolarHBondContact N-O 3.11Å; I85-R112 VanDerWaalsContact N-O 3.08Å; R112-Y256 HydrophobicContact CB-CE2 4.22Å; R112-Y256 HydrophobicContact CG-CE2 4.31Å
113	V	98.8	Very high	94.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130	179.7	-175.8	0	0	0	0	108.7	I85 I87 A98 L101 K102 V111 V255 Y256	I85-V113 WeakPolarHBondContact O-CA 3.49Å; I87-V113 HydrophobicContact CD1-CG1 3.65Å; I87-V113 HydrophobicContact CG1-CG1 4.33Å; A98-V113 HydrophobicContact CB-CG1 4.07Å; L101-V113 HydrophobicContact CB-CG2 4.15Å; L101-V113 HydrophobicContact CD1-CG1 4.24Å; L101-V113 HydrophobicContact CD1-CG2 4.17Å; K102-V113 HydrophobicContact CD-CG2 4.16Å; V111-V113 HydrophobicContact CG1-CG2 3.94Å; V113-V255 HydrophobicContact CB-CG1 4.31Å; V113-V255 HydrophobicContact CB-CG2 4.23Å; V113-V255 HydrophobicContact CG1-CG1 4.18Å; V113-Y256 PolarHBondContact O-N 2.9Å
114	L	98.8	Very high	94.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.9	172.8	173.5	65.2	0	0	0	109.4	P79 P80 A83 I85 V86 I87 V116 Y256 C258 V301	P79-L114 HydrophobicContact CB-CD2 3.91Å; P80-L114 HydrophobicContact CG-CD2 4.49Å; A83-L114 HydrophobicContact CB-CB 3.7Å; I85-L114 PolarHBondContact O-N 3.29Å; V86-L114 HydrophobicContact CG2-CB 4.47Å; V86-L114 HydrophobicContact CG2-CD2 4.33Å; I87-L114 PolarHBondContact N-O 2.94Å; L114-V116 HydrophobicContact CD2-CG2 3.84Å; L114-V116 HydrophobicContact CG-CG2 3.86Å; L114-Y256 WeakPolarHBondContact CA-O 3.39Å; L114-C258 HydrophobicContact CD1-CB 3.8Å; L114-V301 HydrophobicContact CD2-CB 4.45Å; L114-V301 HydrophobicContact CD2-CG1 3.91Å; L114-V301 HydrophobicContact CD2-CG2 4.02Å
115	V	98.8	Very high	94.2	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124	168.1	179.6	0	0	0	0	108.7	I87 W95 A98 V255 Y256 C258	I87-V115 HydrophobicContact CB-CG2 4.22Å; I87-V115 HydrophobicContact CD1-CG2 4.08Å; W95-V115 HydrophobicContact CD2-CG1 4.25Å; W95-V115 HydrophobicContact CD2-CG2 4.35Å; W95-V115 HydrophobicContact CE3-CB 4.4Å; W95-V115 HydrophobicContact CE3-CG2 3.89Å; W95-V115 HydrophobicContact CH2-CB 3.77Å; W95-V115 HydrophobicContact CH2-CG1 4.14Å; W95-V115 HydrophobicContact CH2-CG2 4.06Å; W95-V115 HydrophobicContact CZ2-CB 3.98Å; W95-V115 HydrophobicContact CZ2-CG1 3.81Å; W95-V115 HydrophobicContact CZ3-CB 4.01Å; W95-V115 HydrophobicContact CZ3-CG2 3.75Å; A98-V115 HydrophobicContact CB-CG2 3.65Å; V115-V255 HydrophobicContact CG2-CG1 3.87Å; V115-Y256 PolarHBondContact N-O 2.93Å; V115-C258 PolarHBondContact O-N 3.08Å
116	V	98.6	Very high	94.3	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.5	178	-175	0	0	0	0	109	V86 I87 G89 L114 C258 G260 V262 V290	V86-V116 HydrophobicContact CG1-CG2 4.19Å; I87-V116 PolarHBondContact O-N 2.87Å; G89-V116 WeakPolarHBondContact CA-O 3.26Å; G89-V116 PolarHBondContact N-O 2.93Å; L114-V116 HydrophobicContact CD2-CG2 3.84Å; L114-V116 HydrophobicContact CG-CG2 3.86Å; V116-C258 WeakPolarHBondContact CA-O 3.4Å; V116-C258 HydrophobicContact CG2-CB 4.46Å; V116-G260 WeakPolarHBondContact CG1-O 3.2Å; V116-V262 HydrophobicContact CB-CG2 4.11Å; V116-V262 HydrophobicContact CG1-CG2 3.84Å; V116-V262 HydrophobicContact CG2-CG2 4.37Å; V116-V290 HydrophobicContact CG1-CG1 3.94Å; V116-V290 HydrophobicContact CG1-CG2 4.43Å; V116-V290 HydrophobicContact CG2-CG2 4.14Å
117	E	97.7	Very high	94.6	Very high	17 Å²	17	53.3 Å²	53.3	8%	0.079	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.8	176.9	175.8	49	-115.5	0	0	110.1	G90 D119 Y122 C258 F259 G260	G90-E117 VanDerWaalsContact CA-OE2 3.28Å; G90-E117 WeakPolarHBondContact CA-OE2 3.33Å; G90-E117 PolarHBondContact N-OE2 3.14Å; E117-D119 WeakPolarHBondContact CG-O 3.25Å; E117-D119 PolarHBondContact OE1-N 3.38Å; E117-Y122 HydrophobicContact CG-CE1 3.82Å; E117-C258 PolarHBondContact N-O 3.02Å; E117-F259 HydrophobicContact CB-CD1 4.26Å; E117-F259 HydrophobicContact CG-CD1 4.47Å; E117-F259 CarbonylContact O-C 3.57Å; E117-F259 WeakPolarHBondContact O-CA 3.44Å; E117-G260 CarbonylContact C-O 3.59Å; E117-G260 VanDerWaalsContact C-O 3.23Å; E117-G260 PolarHBondContact O-N 3.5Å
118	R	95.1	Very high	94.8	Very high	104 Å²	104	49.2 Å²	49.2	39%	0.392	26%	0.261	S	S	.	.	S	Bend	trans	-80.3	-31.3	-177	68.7	-179.8	-169.4	150.4	9.5	113.1	P120 G260 E261	R118-P120 WeakPolarHBondContact O-CD 3.38Å; R118-G260 VanDerWaalsContact CA-O 3.25Å; R118-G260 WeakPolarHBondContact CA-O 3.34Å; R118-G260 PolarHBondContact N-O 3.04Å; R118-E261 HydrophobicContact CB-CB 4.14Å
119	D	93.8	Very high	95.2	Very high	20 Å²	20	40.6 Å²	40.6	11%	0.107	23%	0.231	C	C	.	.			trans	-109.4	101.9	-178.2	-179.8	6	0	0	0	110.7	E117 T121 Y122 S123 Q124	E117-D119 WeakPolarHBondContact CG-O 3.25Å; E117-D119 PolarHBondContact OE1-N 3.38Å; D119-T121 PolarHBondContact O-N 2.94Å; D119-T121 WeakPolarHBondContact OD1-CA 3.46Å; D119-T121 WeakPolarHBondContact OD1-CB 3.15Å; D119-T121 PolarHBondContact OD1-N 2.91Å; D119-T121 PolarHBondContact OD1-OG1 3.47Å; D119-T121 PolarHBondContact OD2-OG1 3.4Å; D119-Y122 PolarHBondContact O-N 3.42Å; D119-Y122 PolarHBondContact OD1-N 3.48Å; D119-Y122 PolarHBondContact OD2-N 3.41Å; D119-S123 PolarHBondContact OD2-N 2.94Å; D119-S123 PolarHBondContact OD2-OG 3.14Å; D119-Q124 PolarHBondContact OD2-N 2.94Å; D119-Q124 VanDerWaalsContact OD2-N 3.16Å
120	P	91.1	Very high	95.5	Very high	67 Å²	67	37.1 Å²	37.1	44%	0.435	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.7	179.1	27.4	-34.7	0	0	0	113.9	R118 F259	R118-P120 WeakPolarHBondContact O-CD 3.38Å; P120-F259 VanDerWaalsContact CA-CE1 3.48Å; P120-F259 HydrophobicContact CB-CB 4.35Å; P120-F259 HydrophobicContact CB-CD1 3.57Å; P120-F259 HydrophobicContact CB-CD2 4.17Å; P120-F259 HydrophobicContact CB-CE1 3.72Å; P120-F259 HydrophobicContact CB-CE2 4.29Å; P120-F259 HydrophobicContact CB-CG 3.79Å; P120-F259 HydrophobicContact CB-CZ 4.04Å
121	T	94.1	Very high	95.7	Very high	89 Å²	89	35.6 Å²	35.6	55%	0.546	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-14.9	-180	72.1	0	0	0	0	112.8	D119 S123	D119-T121 PolarHBondContact O-N 2.94Å; D119-T121 WeakPolarHBondContact OD1-CA 3.46Å; D119-T121 WeakPolarHBondContact OD1-CB 3.15Å; D119-T121 PolarHBondContact OD1-N 2.91Å; D119-T121 PolarHBondContact OD1-OG1 3.47Å; D119-T121 PolarHBondContact OD2-OG1 3.4Å; T121-S123 PolarHBondContact O-N 2.91Å; T121-S123 VanDerWaalsContact O-N 3.08Å; T121-S123 VanDerWaalsContact OG1-CB 3.26Å; T121-S123 WeakPolarHBondContact OG1-CB 3.35Å; T121-S123 PolarHBondContact OG1-N 2.9Å; T121-S123 PolarHBondContact OG1-OG 2.85Å; T121-S123 VanDerWaalsContact OG1-OG 3.08Å
122	Y	95.3	Very high	95.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.			trans	57	11.4	-170.6	-67.5	-80.6	0	0	0	115.2	G90 W95 E117 D119 Q124 A125 V128 W240 L243	G90-Y122 WeakPolarHBondContact O-CE1 3.4Å; G90-Y122 PolarHBondContact O-OH 3.35Å; W95-Y122 PolarHBondContact NE1-OH 2.91Å; E117-Y122 HydrophobicContact CG-CE1 3.82Å; D119-Y122 PolarHBondContact O-N 3.42Å; D119-Y122 PolarHBondContact OD1-N 3.48Å; D119-Y122 PolarHBondContact OD2-N 3.41Å; Y122-Q124 PolarHBondContact O-N 3.01Å; Y122-A125 HydrophobicContact CD1-CB 3.81Å; Y122-A125 WeakPolarHBondContact O-CB 3.24Å; Y122-A125 PolarHBondContact O-N 3.41Å; Y122-V128 WeakPolarHBondContact O-CG2 3.47Å; Y122-W240 HydrophobicContact CD2-CH2 4.16Å; Y122-W240 AromaticContact CD2-CZ3 3.81Å; Y122-W240 HydrophobicContact CD2-CZ3 3.81Å; Y122-W240 HydrophobicContact CG-CZ3 4.06Å; Y122-L243 HydrophobicContact CD1-CD2 3.82Å; Y122-L243 HydrophobicContact CD2-CD2 4.29Å; Y122-L243 HydrophobicContact CE1-CD1 4.48Å; Y122-L243 HydrophobicContact CE1-CD2 3.99Å; Y122-L243 HydrophobicContact CE2-CD2 4.41Å; Y122-L243 HydrophobicContact CG-CD2 3.97Å
123	S	93.5	Very high	95.6	Very high	67 Å²	67	31.4 Å²	31.4	47%	0.469	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.8	-177.4	65	0	0	0	0	114.2	D119 T121	D119-S123 PolarHBondContact OD2-N 2.94Å; D119-S123 PolarHBondContact OD2-OG 3.14Å; T121-S123 PolarHBondContact O-N 2.91Å; T121-S123 VanDerWaalsContact O-N 3.08Å; T121-S123 VanDerWaalsContact OG1-CB 3.26Å; T121-S123 WeakPolarHBondContact OG1-CB 3.35Å; T121-S123 PolarHBondContact OG1-N 2.9Å; T121-S123 PolarHBondContact OG1-OG 2.85Å; T121-S123 VanDerWaalsContact OG1-OG 3.08Å
124	Q	92.3	Very high	95.6	Very high	97 Å²	97	31.4 Å²	31.4	45%	0.453	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	2.3	179.1	-56.8	-173.4	43	0	0	113.8	D119 Y122 S126 L395	D119-Q124 PolarHBondContact OD2-N 2.94Å; D119-Q124 VanDerWaalsContact OD2-N 3.16Å; Y122-Q124 PolarHBondContact O-N 3.01Å; Q124-S126 PolarHBondContact O-N 2.99Å; Q124-L395 HydrophobicContact CB-CD1 3.97Å; Q124-L395 HydrophobicContact CG-CD1 4.06Å
125	A	94.4	Very high	95.5	Very high	17 Å²	17	31.8 Å²	31.8	14%	0.14	19%	0.185	C	C	.	.			trans	-77.8	126.3	-174.3	0	0	0	0	0	111.3	Y122 T127 V128 L129	Y122-A125 HydrophobicContact CD1-CB 3.81Å; Y122-A125 WeakPolarHBondContact O-CB 3.24Å; Y122-A125 PolarHBondContact O-N 3.41Å; A125-T127 PolarHBondContact O-N 2.88Å; A125-V128 HydrophobicContact CB-CG2 4.48Å; A125-V128 PolarHBondContact O-N 2.66Å; A125-L129 WeakPolarHBondContact O-CG 3.38Å; A125-L129 PolarHBondContact O-N 3.38Å
126	S	96.1	Very high	95.4	Very high	38 Å²	38	32 Å²	32	27%	0.266	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-31.6	174.4	-53.5	0	0	0	0	113.2	Q124 S130 F428	Q124-S126 PolarHBondContact O-N 2.99Å; S126-S130 PolarHBondContact O-N 3.08Å; S126-F428 WeakPolarHBondContact CB-O 3.47Å; S126-F428 PolarHBondContact OG-O 2.87Å
127	T	96.1	Very high	95.3	Very high	16 Å²	16	32 Å²	32	10%	0.098	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-56.4	174.9	-62.3	0	0	0	0	111.9	V92 A125 S130 P239 L243 L460	V92-T127 HydrophobicContact CB-CG2 3.69Å; V92-T127 HydrophobicContact CG1-CG2 3.88Å; V92-T127 PolarHBondContact N-OG1 3.13Å; A125-T127 PolarHBondContact O-N 2.88Å; T127-S130 WeakPolarHBondContact O-CB 3.24Å; T127-S130 PolarHBondContact O-N 3.15Å; T127-P239 HydrophobicContact CG2-CB 4.48Å; T127-P239 WeakPolarHBondContact O-CB 3.06Å; T127-L243 HydrophobicContact CG2-CB 3.94Å; T127-L243 HydrophobicContact CG2-CD1 4.42Å; T127-L243 HydrophobicContact CG2-CD2 4.07Å; T127-L243 HydrophobicContact CG2-CG 4.37Å; T127-L460 HydrophobicContact CG2-CD1 4.18Å
128	V	95	Very high	95.3	Very high	40 Å²	40	31.1 Å²	31.1	24%	0.242	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-23.4	-171.5	-49.5	0	0	0	0	112.5	Y122 A125 S130 W240 L243	Y122-V128 WeakPolarHBondContact O-CG2 3.47Å; A125-V128 HydrophobicContact CB-CG2 4.48Å; A125-V128 PolarHBondContact O-N 2.66Å; V128-S130 PolarHBondContact O-N 3.06Å; V128-W240 HydrophobicContact CG1-CE3 3.56Å; V128-W240 HydrophobicContact CG1-CZ3 4.03Å; V128-L243 HydrophobicContact CG1-CD2 3.82Å
129	L	96.4	Very high	95.4	Very high	29 Å²	29	26.9 Å²	26.9	15%	0.152	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.2	177.7	-59.4	168.5	0	0	0	112.4	A125 L395 W425 A426	A125-L129 WeakPolarHBondContact O-CG 3.38Å; A125-L129 PolarHBondContact O-N 3.38Å; L129-L395 HydrophobicContact CD1-CD1 3.83Å; L129-W425 HydrophobicContact CD2-CG 4.44Å; L129-W425 PolarHBondContact O-NE1 3.43Å; L129-A426 WeakPolarHBondContact CD1-O 3.43Å
130	S	95.9	Very high	95.6	Very high	29 Å²	29	27.2 Å²	27.2	20%	0.203	17%	0.169	C	C	.	.	S	Bend	trans	-74.4	152.8	179.9	-177.1	0	0	0	0	112.6	S126 T127 V128 G132 L460	S126-S130 PolarHBondContact O-N 3.08Å; T127-S130 WeakPolarHBondContact O-CB 3.24Å; T127-S130 PolarHBondContact O-N 3.15Å; V128-S130 PolarHBondContact O-N 3.06Å; S130-G132 PolarHBondContact O-N 2.87Å; S130-G132 PolarHBondContact OG-N 2.83Å; S130-G132 VanDerWaalsContact OG-N 3.14Å; S130-L460 WeakPolarHBondContact OG-CD2 3.35Å
131	A	94.9	Very high	95.8	Very high	12 Å²	12	26.5 Å²	26.5	10%	0.099	16%	0.164	C	C	.	.			trans	-65.9	-13.7	167.5	0	0	0	0	0	113.7	I345 F360 Y368 R370 I379	A131-I345 HydrophobicContact CB-CD1 4.17Å; A131-F360 HydrophobicContact CB-CE2 4.1Å; A131-F360 HydrophobicContact CB-CZ 3.95Å; A131-Y368 HydrophobicContact CB-CE2 4.38Å; A131-R370 VanDerWaalsContact O-CZ 3.3Å; A131-R370 PolarHBondContact O-NE 2.55Å; A131-R370 PolarHBondContact O-NH2 3.13Å; A131-I379 HydrophobicContact CB-CD1 3.5Å
132	G	95.3	Very high	95.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.152	C	C	.	.			trans	80.2	16	173.2	0	0	0	0	0	115.7	S130 W236 F237	S130-G132 PolarHBondContact O-N 2.87Å; S130-G132 PolarHBondContact OG-N 2.83Å; S130-G132 VanDerWaalsContact OG-N 3.14Å; G132-W236 CarbonylContact O-C 3.56Å; G132-W236 WeakPolarHBondContact O-CA 3.31Å; G132-W236 VanDerWaalsContact O-CB 3.28Å; G132-W236 WeakPolarHBondContact O-CB 3.37Å; G132-F237 WeakPolarHBondContact CA-O 3.36Å; G132-F237 WeakPolarHBondContact O-CD1 3.34Å; G132-F237 PolarHBondContact O-N 2.86Å
133	G	96.3	Very high	96	Very high	13 Å²	13	25.3 Å²	25.3	13%	0.134	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	145.9	-176.9	0	0	0	0	0	114.7	Y178	G133-Y178 WeakPolarHBondContact CA-OH 3.3Å
134	I	97.3	Very high	96.2	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.2	162.7	177.6	159.5	0	0	0	110.9	A151 M154 F173 Y178 E234 G235 F237 Q461	I134-A151 HydrophobicContact CD1-CB 3.68Å; I134-M154 HydrophobicContact CB-CE 4.29Å; I134-M154 HydrophobicContact CD1-CE 3.1Å; I134-M154 HydrophobicContact CG1-CE 4.25Å; I134-M154 HydrophobicContact CG2-CE 4.34Å; I134-F173 HydrophobicContact CG2-CE2 3.65Å; I134-F173 HydrophobicContact CG2-CZ 4.42Å; I134-Y178 WeakPolarHBondContact O-CD2 3.22Å; I134-Y178 WeakPolarHBondContact O-CE2 3.48Å; I134-E234 VanDerWaalsContact O-CA 3.3Å; I134-E234 WeakPolarHBondContact O-CA 3.47Å; I134-G235 PolarHBondContact N-O 3.49Å; I134-G235 PolarHBondContact O-N 3.5Å; I134-F237 HydrophobicContact CB-CE1 4.14Å; I134-F237 HydrophobicContact CG2-CD1 4.11Å; I134-F237 HydrophobicContact CG2-CE1 4.15Å; I134-Q461 HydrophobicContact CB-CB 4.08Å; I134-Q461 HydrophobicContact CD1-CB 4.34Å; I134-Q461 HydrophobicContact CG1-CB 4.1Å
135	R	97.3	Very high	96.5	Very high	8 Å²	8	21.1 Å²	21.1	3%	0.03	13%	0.126	C	C	.	.			trans	-143.9	155.5	179.8	66.1	-179.2	-176.9	-153.5	-2.4	110.7	F138 S147 Y178 H458 Q461 V504	R135-F138 HydrophobicContact CG-CE2 3.92Å; R135-F138 HydrophobicContact CG-CZ 4.25Å; R135-F138 WeakPolarHBondContact O-CE2 3.3Å; R135-S147 WeakPolarHBondContact O-CB 3.49Å; R135-S147 PolarHBondContact O-OG 3.44Å; R135-Y178 HydrophobicContact CB-CD1 4.2Å; R135-Y178 HydrophobicContact CB-CD2 3.85Å; R135-Y178 HydrophobicContact CB-CE2 4.2Å; R135-Y178 HydrophobicContact CB-CG 3.83Å; R135-H458 PolarHBondContact NH2-CE1 3.33Å; R135-H458 PolarHBondContact NH2-NE2 3.41Å; R135-Q461 PolarHBondContact O-OE1 3.22Å; R135-Q461 VanDerWaalsContact O-OE1 3.09Å; R135-V504 PolarHBondContact NH2-O 2.91Å
136	Q	96.9	Very high	96.7	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.019	12%	0.119	C	C	.	.			trans	-107.5	-4.4	170.3	-62.7	153.1	70.6	0	0	111.6	F138 M148 A202 E232 N233 E234	Q136-F138 VanDerWaalsContact C-N 3.31Å; Q136-F138 PolarHBondContact O-N 3.29Å; Q136-M148 HydrophobicContact CB-CG 4.49Å; Q136-M148 HydrophobicContact CG-CG 3.8Å; Q136-M148 VanDerWaalsContact OE1-CG 3.31Å; Q136-A202 HydrophobicContact CB-CB 3.88Å; Q136-E232 PolarHBondContact NE2-O 2.95Å; Q136-N233 PolarHBondContact NE2-O 3.28Å; Q136-E234 WeakPolarHBondContact CA-OE1 3.44Å; Q136-E234 WeakPolarHBondContact CB-OE1 3.44Å; Q136-E234 PolarHBondContact N-OE1 3.48Å
137	Q	97.5	Very high	96.8	Very high	3 Å²	3	18.5 Å²	18.5	1%	0.014	11%	0.106	C	C	.	.			trans	-73.4	78.4	-179.8	-68.8	178.2	80.2	0	0	112.1	Y178 F180 V204 S228 E234 I503	Q137-Y178 PolarHBondContact NE2-O 3.34Å; Q137-F180 HydrophobicContact CB-CD2 4.18Å; Q137-F180 HydrophobicContact CB-CE2 3.71Å; Q137-F180 HydrophobicContact CB-CZ 4.38Å; Q137-F180 HydrophobicContact CG-CE2 4.42Å; Q137-V204 HydrophobicContact CG-CG1 3.64Å; Q137-S228 PolarHBondContact OE1-O 3.4Å; Q137-S228 PolarHBondContact OE1-OG 3.32Å; Q137-E234 PolarHBondContact N-OE1 3.08Å; Q137-E234 PolarHBondContact NE2-OE2 2.93Å; Q137-I503 WeakPolarHBondContact O-CD1 3.28Å
138	F	97.8	Very high	96.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.114	C	C	.	.			trans	-119.6	171.8	173.5	-72.1	-82.9	0	0	0	110.6	R135 Q136 N143 I144 S147 Q197 H458 H462 E500 I503	R135-F138 HydrophobicContact CG-CE2 3.92Å; R135-F138 HydrophobicContact CG-CZ 4.25Å; R135-F138 WeakPolarHBondContact O-CE2 3.3Å; Q136-F138 VanDerWaalsContact C-N 3.31Å; Q136-F138 PolarHBondContact O-N 3.29Å; F138-N143 HydrophobicContact CB-CB 3.92Å; F138-N143 HydrophobicContact CD1-CB 3.85Å; F138-N143 HydrophobicContact CD2-CB 4.1Å; F138-N143 HydrophobicContact CE1-CB 4.37Å; F138-N143 HydrophobicContact CG-CB 3.69Å; F138-I144 HydrophobicContact CB-CG1 3.76Å; F138-S147 WeakPolarHBondContact CE2-OG 3.46Å; F138-Q197 VanDerWaalsContact O-CG 3.25Å; F138-Q197 WeakPolarHBondContact O-CG 3.29Å; F138-Q197 PolarHBondContact O-NE2 2.91Å; F138-H458 AromaticContact CE1-CD2 3.5Å; F138-H458 VanDerWaalsContact CE1-CD2 3.5Å; F138-H458 WeakPolarHBondContact CE1-CD2 3.2Å; F138-H458 AromaticContact CE1-NE2 3.66Å; F138-H458 HydrophobicContact CZ-CB 4.48Å; F138-H458 AromaticContact CZ-CD2 3.86Å; F138-H458 AromaticContact CZ-CG 3.98Å; F138-H462 AromaticContact CE2-NE2 3.93Å; F138-H462 AromaticContact CZ-NE2 3.97Å; F138-E500 HydrophobicContact CD1-CG 4.43Å; F138-E500 WeakPolarHBondContact CD1-OE1 3.39Å; F138-I503 HydrophobicContact CD1-CG2 3.94Å; F138-I503 HydrophobicContact CE1-CG2 3.97Å
139	S	96.9	Very high	97	Very high	14 Å²	14	20 Å²	20	10%	0.098	12%	0.117	C	C	.	.	S	Bend	trans	-102.9	-24.3	173.6	72.8	0	0	0	0	112.9	N193 T196 E500 R501	S139-N193 WeakPolarHBondContact CB-OD1 3.36Å; S139-T196 WeakPolarHBondContact O-CG2 3.31Å; S139-E500 WeakPolarHBondContact CA-OE2 3.14Å; S139-E500 VanDerWaalsContact CB-OE2 3.28Å; S139-E500 WeakPolarHBondContact CB-OE2 3.38Å; S139-E500 PolarHBondContact N-OE2 3.04Å; S139-E500 WeakPolarHBondContact OG-CA 3.27Å; S139-E500 PolarHBondContact OG-OE2 3.26Å; S139-R501 PolarHBondContact OG-N 2.99Å
140	L	96.6	Very high	97.1	Very high	28 Å²	28	18.7 Å²	18.7	15%	0.147	11%	0.109	C	C	.	.	S	Bend	trans	-89.5	126.8	174.7	-60.1	177	0	0	0	111.2	E142 N143 I144 I498 E500	L140-E142 PolarHBondContact O-N 3.49Å; L140-N143 PolarHBondContact O-N 3.35Å; L140-N143 VanDerWaalsContact O-N 3.14Å; L140-I144 WeakPolarHBondContact O-CG1 3.5Å; L140-I144 PolarHBondContact O-N 3.37Å; L140-I144 VanDerWaalsContact O-N 3.13Å; L140-I498 HydrophobicContact CD1-CB 4.18Å; L140-I498 HydrophobicContact CD1-CD1 4.38Å; L140-I498 HydrophobicContact CD1-CG1 4.34Å; L140-E500 WeakPolarHBondContact CB-OE1 3.39Å; L140-E500 HydrophobicContact CD1-CG 4.15Å; L140-E500 HydrophobicContact CG-CG 4.33Å; L140-E500 WeakPolarHBondContact CG-OE1 3.24Å; L140-E500 PolarHBondContact N-OE1 2.93Å; L140-E500 PolarHBondContact N-OE2 3.17Å
141	P	96.4	Very high	97.2	Very high	52 Å²	52	17.5 Å²	17.5	34%	0.338	10%	0.102	S	C	.	.	H	α-helix	trans	-53.2	-35.7	176.8	-27.8	35.8	0	0	0	114	N143 I144 H145 T196	P141-N143 PolarHBondContact O-N 3.28Å; P141-I144 PolarHBondContact O-N 3.32Å; P141-H145 WeakPolarHBondContact O-CB 3.34Å; P141-H145 VanDerWaalsContact O-CG 3.22Å; P141-H145 PolarHBondContact O-N 3.04Å; P141-H145 PolarHBondContact O-ND1 3.43Å; P141-H145 VanDerWaalsContact O-ND1 3.09Å; P141-T196 HydrophobicContact CG-CG2 4.12Å
142	E	95.9	Very high	97.3	Very high	60 Å²	60	21.1 Å²	21.1	28%	0.28	12%	0.119	S	C	.	.	H	α-helix	trans	-61.1	-45.4	179.4	-64.3	80.3	-178.6	0	0	111.5	L140 H145 L146 A486 F487	L140-E142 PolarHBondContact O-N 3.49Å; E142-H145 PolarHBondContact O-N 3.32Å; E142-L146 WeakPolarHBondContact O-CB 3.36Å; E142-L146 WeakPolarHBondContact O-CG 3.36Å; E142-L146 PolarHBondContact O-N 3.26Å; E142-A486 HydrophobicContact CG-CB 4.1Å; E142-F487 HydrophobicContact CB-CE1 4.49Å; E142-F487 HydrophobicContact CB-CE2 3.74Å; E142-F487 HydrophobicContact CB-CZ 3.59Å
143	N	97.8	Very high	97.5	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-71	-34.3	176.8	-76.8	-36.3	0	0	0	112.3	F138 L140 P141 S147 N437 H462 F487 E500	F138-N143 HydrophobicContact CB-CB 3.92Å; F138-N143 HydrophobicContact CD1-CB 3.85Å; F138-N143 HydrophobicContact CD2-CB 4.1Å; F138-N143 HydrophobicContact CE1-CB 4.37Å; F138-N143 HydrophobicContact CG-CB 3.69Å; L140-N143 PolarHBondContact O-N 3.35Å; L140-N143 VanDerWaalsContact O-N 3.14Å; P141-N143 PolarHBondContact O-N 3.28Å; N143-S147 WeakPolarHBondContact O-CB 3.44Å; N143-S147 PolarHBondContact O-N 2.92Å; N143-S147 PolarHBondContact O-OG 3.47Å; N143-N437 PolarHBondContact ND2-OD1 2.72Å; N143-H462 PolarHBondContact OD1-CE1 2.83Å; N143-F487 VanDerWaalsContact OD1-CZ 3.29Å; N143-F487 WeakPolarHBondContact OD1-CZ 3.37Å; N143-E500 WeakPolarHBondContact CB-OE1 3.43Å; N143-E500 PolarHBondContact ND2-OE1 2.89Å
144	I	98.2	Very high	97.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-51.4	174	-59.1	163	0	0	0	109.6	F138 L140 P141 L146 S147 M148 T196 Q197 A200 A202	F138-I144 HydrophobicContact CB-CG1 3.76Å; L140-I144 WeakPolarHBondContact O-CG1 3.5Å; L140-I144 PolarHBondContact O-N 3.37Å; L140-I144 VanDerWaalsContact O-N 3.13Å; P141-I144 PolarHBondContact O-N 3.32Å; I144-L146 PolarHBondContact O-N 2.82Å; I144-S147 PolarHBondContact O-N 3.06Å; I144-M148 HydrophobicContact CG2-CG 4.37Å; I144-M148 HydrophobicContact CG2-SD 3.88Å; I144-M148 VanDerWaalsContact O-CG 3.31Å; I144-M148 WeakPolarHBondContact O-CG 3.27Å; I144-M148 PolarHBondContact O-N 3.44Å; I144-T196 HydrophobicContact CD1-CG2 3.9Å; I144-Q197 HydrophobicContact CD1-CG 4.02Å; I144-Q197 HydrophobicContact CG1-CG 4.49Å; I144-A200 HydrophobicContact CB-CB 4.1Å; I144-A200 HydrophobicContact CD1-CB 4.04Å; I144-A200 HydrophobicContact CG2-CB 3.64Å; I144-A202 HydrophobicContact CG2-CB 4.13Å
145	H	98.1	Very high	97.5	Very high	76 Å²	76	28.3 Å²	28.3	35%	0.352	14%	0.143	S	C	.	.	H	α-helix	trans	-65.8	-38.6	-179.3	-63.8	143.1	0	0	0	112.9	P141 E142 S147 M148 A149 L482	P141-H145 WeakPolarHBondContact O-CB 3.34Å; P141-H145 VanDerWaalsContact O-CG 3.22Å; P141-H145 PolarHBondContact O-N 3.04Å; P141-H145 PolarHBondContact O-ND1 3.43Å; P141-H145 VanDerWaalsContact O-ND1 3.09Å; E142-H145 PolarHBondContact O-N 3.32Å; H145-S147 VanDerWaalsContact C-N 3.31Å; H145-S147 PolarHBondContact O-N 3.07Å; H145-M148 PolarHBondContact O-N 2.97Å; H145-A149 WeakPolarHBondContact O-CB 3.37Å; H145-A149 PolarHBondContact O-N 3.39Å; H145-L482 HydrophobicContact CB-CD2 4.01Å
146	L	97.7	Very high	97.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.3	-48.1	171.2	-85.3	178.1	0	0	0	111.1	E142 I144 A149 S150 A465 V466 L482 L484 F487	E142-L146 WeakPolarHBondContact O-CB 3.36Å; E142-L146 WeakPolarHBondContact O-CG 3.36Å; E142-L146 PolarHBondContact O-N 3.26Å; I144-L146 PolarHBondContact O-N 2.82Å; L146-A149 PolarHBondContact O-N 3.37Å; L146-S150 WeakPolarHBondContact O-CB 3.36Å; L146-S150 PolarHBondContact O-N 3.48Å; L146-S150 PolarHBondContact O-OG 2.94Å; L146-A465 HydrophobicContact CD2-CB 3.62Å; L146-V466 HydrophobicContact CD1-CG2 4.46Å; L146-V466 HydrophobicContact CD2-CG2 4.09Å; L146-L482 HydrophobicContact CD2-CD1 4.2Å; L146-L484 HydrophobicContact CD1-CD2 4.08Å; L146-L484 HydrophobicContact CD2-CD1 3.93Å; L146-L484 HydrophobicContact CD2-CD2 3.78Å; L146-L484 HydrophobicContact CD2-CG 4.49Å; L146-L484 HydrophobicContact CG-CD2 3.83Å; L146-F487 HydrophobicContact CD1-CD2 4.25Å; L146-F487 HydrophobicContact CD1-CE2 3.56Å; L146-F487 HydrophobicContact CD1-CZ 4.46Å
147	S	98.1	Very high	97.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-41.2	-178	-52.2	0	0	0	0	111.9	R135 F138 N143 I144 H145 S150 A151 H462	R135-S147 WeakPolarHBondContact O-CB 3.49Å; R135-S147 PolarHBondContact O-OG 3.44Å; F138-S147 WeakPolarHBondContact CE2-OG 3.46Å; N143-S147 WeakPolarHBondContact O-CB 3.44Å; N143-S147 PolarHBondContact O-N 2.92Å; N143-S147 PolarHBondContact O-OG 3.47Å; I144-S147 PolarHBondContact O-N 3.06Å; H145-S147 VanDerWaalsContact C-N 3.31Å; H145-S147 PolarHBondContact O-N 3.07Å; S147-S150 PolarHBondContact O-N 2.85Å; S147-A151 WeakPolarHBondContact O-CB 3.46Å; S147-A151 PolarHBondContact O-N 2.91Å; S147-H462 PolarHBondContact OG-CD2 2.83Å; S147-H462 PolarHBondContact OG-NE2 3.02Å
148	M	98.1	Very high	97.6	Very high	51 Å²	51	33.2 Å²	33.2	25%	0.251	17%	0.17	S	C	.	.	H	α-helix	trans	-61.1	-47.4	175.3	-72.2	176.1	70.4	0	0	111.9	Q136 I144 H145 S150 A151 D152	Q136-M148 HydrophobicContact CB-CG 4.49Å; Q136-M148 HydrophobicContact CG-CG 3.8Å; Q136-M148 VanDerWaalsContact OE1-CG 3.31Å; I144-M148 HydrophobicContact CG2-CG 4.37Å; I144-M148 HydrophobicContact CG2-SD 3.88Å; I144-M148 VanDerWaalsContact O-CG 3.31Å; I144-M148 WeakPolarHBondContact O-CG 3.27Å; I144-M148 PolarHBondContact O-N 3.44Å; H145-M148 PolarHBondContact O-N 2.97Å; M148-S150 PolarHBondContact O-N 2.88Å; M148-A151 PolarHBondContact O-N 2.9Å; M148-D152 PolarHBondContact O-N 3.32Å
149	A	98.4	Very high	97.6	Very high	37 Å²	37	40.4 Å²	40.4	31%	0.306	20%	0.204	S	C	.	.	H	α-helix	trans	-65.3	-38.8	179.2	0	0	0	0	0	112.2	H145 L146 F153 A465 L482	H145-A149 WeakPolarHBondContact O-CB 3.37Å; H145-A149 PolarHBondContact O-N 3.39Å; L146-A149 PolarHBondContact O-N 3.37Å; A149-F153 WeakPolarHBondContact O-CB 3.42Å; A149-F153 PolarHBondContact O-N 3.12Å; A149-A465 HydrophobicContact CB-CB 3.95Å; A149-L482 HydrophobicContact CB-CD1 3.75Å
150	S	98.4	Very high	97.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.3	-37.4	175	-68.8	0	0	0	0	113.3	L146 S147 M148 F153 M154 Q461 H462 P464 A465	L146-S150 WeakPolarHBondContact O-CB 3.36Å; L146-S150 PolarHBondContact O-N 3.48Å; L146-S150 PolarHBondContact O-OG 2.94Å; S147-S150 PolarHBondContact O-N 2.85Å; M148-S150 PolarHBondContact O-N 2.88Å; S150-F153 PolarHBondContact O-N 2.78Å; S150-M154 WeakPolarHBondContact O-CG 3.35Å; S150-M154 PolarHBondContact O-N 3.34Å; S150-Q461 WeakPolarHBondContact CB-O 3.45Å; S150-Q461 PolarHBondContact OG-O 2.94Å; S150-H462 PolarHBondContact OG-O 2.88Å; S150-P464 WeakPolarHBondContact OG-CD 3.3Å; S150-A465 WeakPolarHBondContact OG-CB 3.46Å; S150-A465 PolarHBondContact OG-N 3.01Å
151	A	97.9	Very high	97.8	Very high	5 Å²	5	40.6 Å²	40.6	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-42.2	175.5	0	0	0	0	0	111.4	I134 S147 M148 M154 R155 N233	I134-A151 HydrophobicContact CD1-CB 3.68Å; S147-A151 WeakPolarHBondContact O-CB 3.46Å; S147-A151 PolarHBondContact O-N 2.91Å; M148-A151 PolarHBondContact O-N 2.9Å; A151-M154 PolarHBondContact O-N 3.33Å; A151-R155 WeakPolarHBondContact O-CB 3.43Å; A151-R155 PolarHBondContact O-N 3.01Å; A151-N233 HydrophobicContact CB-CB 3.66Å
152	D	97.7	Very high	97.8	Very high	87 Å²	87	40.5 Å²	40.5	47%	0.465	20%	0.203	S	C	.	.	H	α-helix	trans	-62.1	-44.3	174.6	-175.7	64.7	0	0	0	111.7	M148 M154 R155 N156	M148-D152 PolarHBondContact O-N 3.32Å; D152-M154 VanDerWaalsContact C-N 3.34Å; D152-M154 PolarHBondContact O-N 2.91Å; D152-R155 WeakPolarHBondContact O-CB 3.48Å; D152-R155 PolarHBondContact O-N 2.79Å; D152-N156 PolarHBondContact O-N 2.92Å; D152-N156 VanDerWaalsContact O-N 3.08Å; D152-N156 PolarHBondContact O-ND2 2.93Å; D152-N156 PolarHBondContact OD1-ND2 2.93Å
153	F	98.5	Very high	97.9	Very high	9 Å²	9	39 Å²	39	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-46.4	173.6	-179.4	-83.8	0	0	0	112.1	Y99 W100 A149 S150 N156 I157 H160 L161 F246 P464	Y99-F153 AromaticContact CE1-CE2 3.88Å; Y99-F153 HydrophobicContact CE1-CE2 3.88Å; Y99-F153 HydrophobicContact CE1-CZ 4Å; W100-F153 AromaticContact CZ2-CD2 3.82Å; W100-F153 HydrophobicContact CZ2-CD2 3.82Å; W100-F153 AromaticContact CZ2-CE2 3.67Å; W100-F153 HydrophobicContact CZ2-CE2 3.67Å; A149-F153 WeakPolarHBondContact O-CB 3.42Å; A149-F153 PolarHBondContact O-N 3.12Å; S150-F153 PolarHBondContact O-N 2.78Å; F153-N156 CarbonylContact O-C 3.23Å; F153-N156 VanDerWaalsContact O-C 3.29Å; F153-N156 PolarHBondContact O-N 3.42Å; F153-I157 WeakPolarHBondContact O-CA 3.49Å; F153-I157 PolarHBondContact O-N 2.86Å; F153-H160 HydrophobicContact CD2-CB 4.3Å; F153-H160 AromaticContact CD2-CD2 3.3Å; F153-H160 WeakPolarHBondContact CD2-CD2 3.23Å; F153-H160 AromaticContact CD2-CG 3.77Å; F153-H160 AromaticContact CD2-NE2 3.74Å; F153-H160 HydrophobicContact CE1-CB 4.35Å; F153-H160 HydrophobicContact CE2-CB 3.51Å; F153-H160 AromaticContact CE2-CD2 3.45Å; F153-H160 VanDerWaalsContact CE2-CD2 3.45Å; F153-H160 WeakPolarHBondContact CE2-CD2 3.3Å; F153-H160 AromaticContact CE2-CG 3.42Å; F153-H160 VanDerWaalsContact CE2-CG 3.42Å; F153-H160 AromaticContact CG-CD2 3.81Å; F153-H160 HydrophobicContact CZ-CB 3.54Å; F153-H160 AromaticContact CZ-CG 3.96Å; F153-L161 HydrophobicContact CE1-CD1 3.82Å; F153-L161 HydrophobicContact CE1-CG 4.07Å; F153-L161 HydrophobicContact CZ-CD1 4.02Å; F153-L161 HydrophobicContact CZ-CD2 3.96Å; F153-L161 HydrophobicContact CZ-CG 3.83Å; F153-F246 HydrophobicContact CD1-CZ 4.27Å; F153-F246 AromaticContact CE1-CE1 3.85Å; F153-F246 HydrophobicContact CE1-CE1 3.85Å; F153-F246 HydrophobicContact CE1-CE2 4.26Å; F153-F246 AromaticContact CE1-CZ 3.43Å; F153-F246 HydrophobicContact CE1-CZ 3.43Å; F153-F246 VanDerWaalsContact CE1-CZ 3.43Å; F153-F246 AromaticContact CZ-CE1 3.59Å; F153-F246 HydrophobicContact CZ-CE1 3.59Å; F153-F246 AromaticContact CZ-CZ 3.65Å; F153-F246 HydrophobicContact CZ-CZ 3.65Å; F153-P464 HydrophobicContact CB-CB 3.96Å; F153-P464 HydrophobicContact CD1-CB 3.58Å; F153-P464 HydrophobicContact CD1-CG 3.93Å; F153-P464 HydrophobicContact CD2-CB 4.35Å; F153-P464 HydrophobicContact CE1-CB 4.16Å; F153-P464 HydrophobicContact CE1-CG 4.48Å; F153-P464 HydrophobicContact CG-CB 3.69Å; F153-P464 HydrophobicContact CG-CG 4.46Å
154	M	97.7	Very high	97.6	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.059	23%	0.233	C	C	.	.	H	α-helix	trans	-70.7	-32.5	-179.2	-74.3	-168.1	-65.7	0	0	112.8	I134 S150 A151 D152 N156 I157 L171 F237 L242 P464	I134-M154 HydrophobicContact CB-CE 4.29Å; I134-M154 HydrophobicContact CD1-CE 3.1Å; I134-M154 HydrophobicContact CG1-CE 4.25Å; I134-M154 HydrophobicContact CG2-CE 4.34Å; S150-M154 WeakPolarHBondContact O-CG 3.35Å; S150-M154 PolarHBondContact O-N 3.34Å; A151-M154 PolarHBondContact O-N 3.33Å; D152-M154 VanDerWaalsContact C-N 3.34Å; D152-M154 PolarHBondContact O-N 2.91Å; M154-N156 VanDerWaalsContact C-N 3.26Å; M154-N156 PolarHBondContact O-N 2.94Å; M154-I157 VanDerWaalsContact O-CB 3.31Å; M154-I157 WeakPolarHBondContact O-CB 3.24Å; M154-I157 WeakPolarHBondContact O-CG2 3.21Å; M154-I157 PolarHBondContact O-N 2.95Å; M154-L171 HydrophobicContact CB-CD1 3.73Å; M154-L171 HydrophobicContact CG-CD1 3.86Å; M154-L171 HydrophobicContact SD-CD1 3.94Å; M154-F237 HydrophobicContact CE-CD1 4.23Å; M154-F237 HydrophobicContact CE-CE1 3.7Å; M154-F237 HydrophobicContact CE-CZ 4.14Å; M154-F237 HydrophobicContact SD-CD1 4.09Å; M154-F237 HydrophobicContact SD-CD2 4.43Å; M154-F237 HydrophobicContact SD-CE1 3.69Å; M154-F237 HydrophobicContact SD-CE2 4.07Å; M154-F237 HydrophobicContact SD-CG 4.44Å; M154-F237 HydrophobicContact SD-CZ 3.66Å; M154-L242 HydrophobicContact CG-CD1 4.3Å; M154-L242 HydrophobicContact SD-CD1 4.3Å; M154-L242 HydrophobicContact SD-CD2 3.93Å; M154-P464 HydrophobicContact CG-CG 4.46Å
155	R	96.2	Very high	97.3	Very high	145 Å²	145	53.1 Å²	53.1	55%	0.547	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-38.2	172	-176	-175.1	-72.9	-144.1	-1.4	111.2	A151 D152 N233	A151-R155 WeakPolarHBondContact O-CB 3.43Å; A151-R155 PolarHBondContact O-N 3.01Å; D152-R155 WeakPolarHBondContact O-CB 3.48Å; D152-R155 PolarHBondContact O-N 2.79Å; R155-N233 PolarHBondContact NE-OD1 2.91Å; R155-N233 PolarHBondContact NH2-ND2 3.35Å; R155-N233 PolarHBondContact NH2-OD1 2.84Å
156	N	97.4	Very high	97.1	Very high	48 Å²	48	52.7 Å²	52.7	26%	0.257	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	26.5	180	-56.3	-58.1	0	0	0	112.5	D152 F153 M154 N158 E159 H160	D152-N156 PolarHBondContact O-N 2.92Å; D152-N156 VanDerWaalsContact O-N 3.08Å; D152-N156 PolarHBondContact O-ND2 2.93Å; D152-N156 PolarHBondContact OD1-ND2 2.93Å; F153-N156 CarbonylContact O-C 3.23Å; F153-N156 VanDerWaalsContact O-C 3.29Å; F153-N156 PolarHBondContact O-N 3.42Å; M154-N156 VanDerWaalsContact C-N 3.26Å; M154-N156 PolarHBondContact O-N 2.94Å; N156-N158 PolarHBondContact O-N 3.42Å; N156-E159 HydrophobicContact CB-CG 4.45Å; N156-E159 WeakPolarHBondContact O-CB 3.25Å; N156-E159 PolarHBondContact O-N 2.88Å; N156-H160 PolarHBondContact O-CD2 3.08Å
157	I	98	Very high	97	Very high	9 Å²	9	59.5 Å²	59.5	5%	0.046	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-33.6	-166.8	-168.7	159.3	0	0	0	114.2	F153 M154 E159 H160 L161 V169 L171 L242 A245	F153-I157 WeakPolarHBondContact O-CA 3.49Å; F153-I157 PolarHBondContact O-N 2.86Å; M154-I157 VanDerWaalsContact O-CB 3.31Å; M154-I157 WeakPolarHBondContact O-CB 3.24Å; M154-I157 WeakPolarHBondContact O-CG2 3.21Å; M154-I157 PolarHBondContact O-N 2.95Å; I157-E159 VanDerWaalsContact C-N 3.3Å; I157-E159 PolarHBondContact O-N 3.47Å; I157-H160 PolarHBondContact O-N 2.77Å; I157-H160 VanDerWaalsContact O-N 3.14Å; I157-L161 HydrophobicContact CD1-CD1 3.97Å; I157-L161 HydrophobicContact CG1-CB 4.1Å; I157-L161 HydrophobicContact CG1-CD1 3.87Å; I157-L161 HydrophobicContact CG1-CG 4.13Å; I157-L161 PolarHBondContact O-N 3.15Å; I157-V169 HydrophobicContact CD1-CG1 3.68Å; I157-V169 HydrophobicContact CG1-CB 4.39Å; I157-V169 HydrophobicContact CG1-CG1 3.99Å; I157-V169 HydrophobicContact CG2-CB 4.31Å; I157-V169 HydrophobicContact CG2-CG1 4.26Å; I157-L171 HydrophobicContact CD1-CD1 3.65Å; I157-L171 HydrophobicContact CD1-CD2 3.54Å; I157-L171 HydrophobicContact CD1-CG 3.64Å; I157-L242 HydrophobicContact CD1-CD1 3.87Å; I157-A245 HydrophobicContact CD1-CB 4.5Å
158	N	98.1	Very high	97	Very high	61 Å²	61	64.2 Å²	64.2	33%	0.326	34%	0.34	S	S	.	.	H	α-helix	trans	-72.7	-21.7	179.8	-79.1	-70.4	0	0	0	113.3	N156 H160 S162 P168 V169	N156-N158 PolarHBondContact O-N 3.42Å; N158-H160 VanDerWaalsContact C-N 3.26Å; N158-S162 WeakPolarHBondContact O-CB 3.43Å; N158-S162 PolarHBondContact O-OG 3.26Å; N158-P168 WeakPolarHBondContact OD1-CA 3.28Å; N158-P168 WeakPolarHBondContact OD1-CB 3.29Å; N158-V169 PolarHBondContact ND2-O 2.79Å; N158-V169 PolarHBondContact OD1-N 2.95Å
159	E	97.9	Very high	96.9	Very high	150 Å²	150	63 Å²	63	70%	0.701	34%	0.335	S	S	*	.	H	α-helix	trans	-72.1	-27.5	171.1	-56.4	-175.2	173.2	0	0	111.2	N156 I157	N156-E159 HydrophobicContact CB-CG 4.45Å; N156-E159 WeakPolarHBondContact O-CB 3.25Å; N156-E159 PolarHBondContact O-N 2.88Å; I157-E159 VanDerWaalsContact C-N 3.3Å; I157-E159 PolarHBondContact O-N 3.47Å
160	H	98.1	Very high	96.9	Very high	45 Å²	45	65.9 Å²	65.9	21%	0.208	35%	0.346	C	S	.	.	H	α-helix	trans	-97.1	-48.1	-175.2	-62.2	-45	0	0	0	113.3	Y99 F153 N156 I157 N158 K249	Y99-H160 WeakPolarHBondContact CE2-O 3.36Å; Y99-H160 WeakPolarHBondContact OH-CB 3.43Å; Y99-H160 PolarHBondContact OH-O 3.21Å; F153-H160 HydrophobicContact CD2-CB 4.3Å; F153-H160 AromaticContact CD2-CD2 3.3Å; F153-H160 WeakPolarHBondContact CD2-CD2 3.23Å; F153-H160 AromaticContact CD2-CG 3.77Å; F153-H160 AromaticContact CD2-NE2 3.74Å; F153-H160 HydrophobicContact CE1-CB 4.35Å; F153-H160 HydrophobicContact CE2-CB 3.51Å; F153-H160 AromaticContact CE2-CD2 3.45Å; F153-H160 VanDerWaalsContact CE2-CD2 3.45Å; F153-H160 WeakPolarHBondContact CE2-CD2 3.3Å; F153-H160 AromaticContact CE2-CG 3.42Å; F153-H160 VanDerWaalsContact CE2-CG 3.42Å; F153-H160 AromaticContact CG-CD2 3.81Å; F153-H160 HydrophobicContact CZ-CB 3.54Å; F153-H160 AromaticContact CZ-CG 3.96Å; N156-H160 PolarHBondContact O-CD2 3.08Å; I157-H160 PolarHBondContact O-N 2.77Å; I157-H160 VanDerWaalsContact O-N 3.14Å; N158-H160 VanDerWaalsContact C-N 3.26Å; H160-K249 VanDerWaalsContact O-CE 3.24Å; H160-K249 WeakPolarHBondContact O-CE 3.42Å
161	L	98.5	Very high	96.8	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-113.8	5	-164.6	-58.7	-172.9	0	0	0	114.5	Y99 F153 I157 V169 A245 F246 K249	Y99-L161 HydrophobicContact CD1-CD2 4.19Å; Y99-L161 HydrophobicContact CD2-CD2 3.76Å; Y99-L161 HydrophobicContact CE1-CD2 4.14Å; Y99-L161 HydrophobicContact CE2-CD2 3.69Å; Y99-L161 HydrophobicContact CG-CD2 4.01Å; F153-L161 HydrophobicContact CE1-CD1 3.82Å; F153-L161 HydrophobicContact CE1-CG 4.07Å; F153-L161 HydrophobicContact CZ-CD1 4.02Å; F153-L161 HydrophobicContact CZ-CD2 3.96Å; F153-L161 HydrophobicContact CZ-CG 3.83Å; I157-L161 HydrophobicContact CD1-CD1 3.97Å; I157-L161 HydrophobicContact CG1-CB 4.1Å; I157-L161 HydrophobicContact CG1-CD1 3.87Å; I157-L161 HydrophobicContact CG1-CG 4.13Å; I157-L161 PolarHBondContact O-N 3.15Å; L161-V169 HydrophobicContact CB-CG2 4.34Å; L161-A245 HydrophobicContact CB-CB 4.19Å; L161-A245 HydrophobicContact CD1-CB 3.75Å; L161-F246 HydrophobicContact CD1-CD1 3.77Å; L161-F246 HydrophobicContact CD1-CD2 4.14Å; L161-F246 HydrophobicContact CD1-CE1 3.91Å; L161-F246 HydrophobicContact CD1-CE2 4.27Å; L161-F246 HydrophobicContact CD1-CG 3.89Å; L161-F246 HydrophobicContact CD1-CZ 4.15Å; L161-F246 HydrophobicContact CD2-CD1 3.66Å; L161-F246 HydrophobicContact CD2-CE1 3.88Å; L161-F246 HydrophobicContact CD2-CG 4.44Å; L161-F246 HydrophobicContact CG-CD1 4.39Å; L161-F246 HydrophobicContact CG-CE1 4.45Å; L161-K249 HydrophobicContact CB-CB 4.35Å; L161-K249 HydrophobicContact CD2-CB 3.87Å; L161-K249 HydrophobicContact CD2-CG 3.86Å
162	S	97.3	Very high	96.7	Very high	49 Å²	49	71.7 Å²	71.7	34%	0.343	37%	0.372	S	S	.	.			trans	-63.7	140.4	171.9	54.4	0	0	0	0	111.4	N158 K249	N158-S162 WeakPolarHBondContact O-CB 3.43Å; N158-S162 PolarHBondContact O-OG 3.26Å; S162-K249 WeakPolarHBondContact O-CD 3.04Å; S162-K249 PolarHBondContact O-NZ 3.5Å
163	V	97	Very high	96.6	Very high	29 Å²	29	71.3 Å²	71.3	18%	0.176	37%	0.366	C	S	.	.			trans	-113.2	138.7	173.8	176.4	0	0	0	0	107.9	N165 D166 R248 K249	V163-N165 PolarHBondContact O-N 3.08Å; V163-D166 HydrophobicContact CB-CB 4.04Å; V163-D166 WeakPolarHBondContact CB-OD2 3.29Å; V163-D166 HydrophobicContact CG1-CB 4.48Å; V163-D166 WeakPolarHBondContact CG1-OD2 3.14Å; V163-D166 PolarHBondContact O-N 2.58Å; V163-D166 VanDerWaalsContact O-N 3.14Å; V163-R248 HydrophobicContact CG2-CB 4.49Å; V163-K249 HydrophobicContact CG2-CB 4.38Å; V163-K249 HydrophobicContact CG2-CD 4.09Å
164	L	92.4	Very high	96.4	Very high	148 Å²	148	72.6 Å²	72.6	78%	0.775	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	130.9	-177.9	-176	69.2	0	0	0	110.2	D166	L164-D166 PolarHBondContact O-N 2.92Å
165	N	91.8	Very high	96.2	Very high	153 Å²	153	79.2 Å²	79.2	82%	0.818	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	7.3	-177.2	-47.1	-47.3	0	0	0	115.8	V163	V163-N165 PolarHBondContact O-N 3.08Å
166	D	94.3	Very high	96.1	Very high	66 Å²	66	72.9 Å²	72.9	35%	0.353	38%	0.382	S	S	.	.	S	Bend	trans	-95.9	157.5	169.1	-73.2	-12.4	0	0	0	110.6	V163 L164 R248	V163-D166 HydrophobicContact CB-CB 4.04Å; V163-D166 WeakPolarHBondContact CB-OD2 3.29Å; V163-D166 HydrophobicContact CG1-CB 4.48Å; V163-D166 WeakPolarHBondContact CG1-OD2 3.14Å; V163-D166 PolarHBondContact O-N 2.58Å; V163-D166 VanDerWaalsContact O-N 3.14Å; L164-D166 PolarHBondContact O-N 2.92Å; D166-R248 IonicContact OD1-NH2 3.82Å; D166-R248 PolarHBondContact OD1-NH2 3.24Å; D166-R248 IonicContact OD2-CZ 3.85Å; D166-R248 IonicContact OD2-NE 2.94Å; D166-R248 PolarHBondContact OD2-NE 3.04Å; D166-R248 IonicContact OD2-NH2 3.66Å; D166-R248 PolarHBondContact OD2-NH2 3.34Å
167	D	95.4	Very high	96	Very high	143 Å²	143	70.7 Å²	70.7	77%	0.765	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-61	148.7	171.2	-69.1	-39.3	0	0	0	111.4
168	P	97.1	Very high	96	Very high	100 Å²	100	71 Å²	71	65%	0.649	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-53.5	144.1	172.8	-24.8	34.3	0	0	0	112	N158 D170	N158-P168 WeakPolarHBondContact OD1-CA 3.28Å; N158-P168 WeakPolarHBondContact OD1-CB 3.29Å; P168-D170 PolarHBondContact O-N 2.96Å
169	V	97.7	Very high	96	Very high	26 Å²	26	68.1 Å²	68.1	16%	0.158	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-68.7	123.1	174.5	-178.6	0	0	0	0	109.1	I157 N158 L161 L171 A245	I157-V169 HydrophobicContact CD1-CG1 3.68Å; I157-V169 HydrophobicContact CG1-CB 4.39Å; I157-V169 HydrophobicContact CG1-CG1 3.99Å; I157-V169 HydrophobicContact CG2-CB 4.31Å; I157-V169 HydrophobicContact CG2-CG1 4.26Å; N158-V169 PolarHBondContact ND2-O 2.79Å; N158-V169 PolarHBondContact OD1-N 2.95Å; L161-V169 HydrophobicContact CB-CG2 4.34Å; V169-L171 HydrophobicContact CG1-CD2 4.4Å; V169-A245 HydrophobicContact CG1-CB 3.66Å; V169-A245 HydrophobicContact CG2-CB 3.97Å
170	D	97	Very high	96	Very high	97 Å²	97	61.8 Å²	61.8	52%	0.519	33%	0.326	S	S	.	.			trans	-117.1	113.2	170.5	-175.1	-3.9	0	0	0	109.4	P168 Q172 M241	P168-D170 PolarHBondContact O-N 2.96Å; D170-Q172 PolarHBondContact O-N 3.32Å; D170-Q172 PolarHBondContact OD1-N 3.43Å; D170-Q172 PolarHBondContact OD1-NE2 2.85Å; D170-Q172 PolarHBondContact OD2-NE2 2.8Å; D170-M241 WeakPolarHBondContact O-CG 3.46Å
171	L	96.3	Very high	96	Very high	11 Å²	11	59.8 Å²	59.8	6%	0.058	32%	0.318	C	S	.	.			trans	-76.9	-7	180	-72.5	-178.5	0	0	0	113.8	M154 I157 V169 F173 F237 D238 M241 L242	M154-L171 HydrophobicContact CB-CD1 3.73Å; M154-L171 HydrophobicContact CG-CD1 3.86Å; M154-L171 HydrophobicContact SD-CD1 3.94Å; I157-L171 HydrophobicContact CD1-CD1 3.65Å; I157-L171 HydrophobicContact CD1-CD2 3.54Å; I157-L171 HydrophobicContact CD1-CG 3.64Å; V169-L171 HydrophobicContact CG1-CD2 4.4Å; L171-F173 HydrophobicContact CB-CB 4.42Å; L171-F173 PolarHBondContact O-N 2.65Å; L171-F237 HydrophobicContact CB-CB 4.13Å; L171-F237 WeakPolarHBondContact O-CB 3.5Å; L171-D238 PolarHBondContact O-N 2.87Å; L171-M241 HydrophobicContact CD2-CB 4.19Å; L171-L242 HydrophobicContact CD2-CB 3.85Å; L171-L242 HydrophobicContact CD2-CD1 4.08Å
172	Q	95.5	Very high	96	Very high	115 Å²	115	59.7 Å²	59.7	54%	0.537	32%	0.317	S	S	.	.			trans	54.5	40	-166.8	-55.1	-61.3	-57	0	0	111.4	D170 N174 D238	D170-Q172 PolarHBondContact O-N 3.32Å; D170-Q172 PolarHBondContact OD1-N 3.43Å; D170-Q172 PolarHBondContact OD1-NE2 2.85Å; D170-Q172 PolarHBondContact OD2-NE2 2.8Å; Q172-N174 PolarHBondContact O-N 3.34Å; Q172-D238 HydrophobicContact CB-CB 4.25Å; Q172-D238 HydrophobicContact CG-CB 4.47Å
173	F	95.4	Very high	96	Very high	80 Å²	80	58.4 Å²	58.4	35%	0.351	31%	0.308	S	S	.	.			trans	-68.2	123.9	-175.5	-176.5	-103.4	0	0	0	111.3	I134 L171 H175 W236 F237	I134-F173 HydrophobicContact CG2-CE2 3.65Å; I134-F173 HydrophobicContact CG2-CZ 4.42Å; L171-F173 HydrophobicContact CB-CB 4.42Å; L171-F173 PolarHBondContact O-N 2.65Å; F173-H175 HydrophobicContact CD1-CB 4.16Å; F173-H175 HydrophobicContact CE1-CB 3.67Å; F173-W236 CarbonylContact C-O 3.48Å; F173-W236 WeakPolarHBondContact CA-O 3.25Å; F173-W236 WeakPolarHBondContact CD2-O 3.39Å; F173-F237 HydrophobicContact CD2-CB 4.12Å; F173-F237 HydrophobicContact CD2-CD1 4.49Å
174	N	94.9	Very high	96	Very high	36 Å²	36	64.8 Å²	64.8	19%	0.193	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-100.8	125.7	170.2	-171	-64	0	0	0	109.7	Q172 S176 G235 W236	Q172-N174 PolarHBondContact O-N 3.34Å; N174-S176 VanDerWaalsContact OD1-CB 3.24Å; N174-S176 WeakPolarHBondContact OD1-CB 3.41Å; N174-S176 PolarHBondContact OD1-N 2.87Å; N174-S176 PolarHBondContact OD1-OG 3.3Å; N174-G235 VanDerWaalsContact O-CA 3.31Å; N174-G235 WeakPolarHBondContact O-CA 3.31Å; N174-W236 HydrophobicContact CB-CD2 3.78Å; N174-W236 HydrophobicContact CB-CE3 4.31Å; N174-W236 HydrophobicContact CB-CG 4.22Å; N174-W236 HydrophobicContact CB-CH2 4.18Å; N174-W236 HydrophobicContact CB-CZ2 3.64Å; N174-W236 HydrophobicContact CB-CZ3 4.49Å; N174-W236 VanDerWaalsContact CG-CH2 3.47Å; N174-W236 PolarHBondContact N-O 3.02Å; N174-W236 WeakPolarHBondContact ND2-CZ2 3.39Å; N174-W236 PolarHBondContact O-N 2.99Å; N174-W236 VanDerWaalsContact O-N 3.11Å; N174-W236 WeakPolarHBondContact OD1-CH2 3.45Å; N174-W236 WeakPolarHBondContact OD1-CZ2 3.34Å
175	H	94.1	Very high	96.2	Very high	150 Å²	150	66.4 Å²	66.4	69%	0.694	34%	0.337	S	S	*	.			trans	-101.6	19.8	-172.3	60.4	-87.3	0	0	0	113.5	F173 G177	F173-H175 HydrophobicContact CD1-CB 4.16Å; F173-H175 HydrophobicContact CE1-CB 3.67Å; H175-G177 PolarHBondContact O-N 3.4Å
176	S	93.3	Very high	96.4	Very high	12 Å²	12	60.4 Å²	60.4	8%	0.084	31%	0.306	C	S	.	.	S	Bend	trans	-68.3	1.8	-179.2	-65.5	0	0	0	0	114.2	N174 Y229 L356 T358 P359	N174-S176 VanDerWaalsContact OD1-CB 3.24Å; N174-S176 WeakPolarHBondContact OD1-CB 3.41Å; N174-S176 PolarHBondContact OD1-N 2.87Å; N174-S176 PolarHBondContact OD1-OG 3.3Å; S176-Y229 PolarHBondContact O-OH 3.18Å; S176-L356 PolarHBondContact OG-O 3.01Å; S176-T358 VanDerWaalsContact CB-O 3.24Å; S176-T358 WeakPolarHBondContact CB-O 3.34Å; S176-P359 WeakPolarHBondContact O-CA 3.28Å; S176-P359 WeakPolarHBondContact O-CB 3.33Å
177	G	95.4	Very high	96.5	Very high	3 Å²	3	58 Å²	58	3%	0.031	29%	0.294	C	S	.	.			trans	79.8	-178.1	175.2	0	0	0	0	0	113.7	H175 E234 P359 F360	H175-G177 PolarHBondContact O-N 3.4Å; G177-E234 WeakPolarHBondContact CA-O 3.38Å; G177-E234 PolarHBondContact N-O 3.18Å; G177-P359 WeakPolarHBondContact O-CA 3.08Å; G177-P359 WeakPolarHBondContact O-CB 3.49Å; G177-F360 PolarHBondContact O-N 3.13Å
178	Y	97.8	Very high	96.6	Very high	15 Å²	15	55.7 Å²	55.7	6%	0.059	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.4	173.7	-111.6	-93.1	0	0	0	109.7	G133 I134 R135 Q137 F180 Y229 G230 E234 G235 F360 V362	G133-Y178 WeakPolarHBondContact CA-OH 3.3Å; I134-Y178 WeakPolarHBondContact O-CD2 3.22Å; I134-Y178 WeakPolarHBondContact O-CE2 3.48Å; R135-Y178 HydrophobicContact CB-CD1 4.2Å; R135-Y178 HydrophobicContact CB-CD2 3.85Å; R135-Y178 HydrophobicContact CB-CE2 4.2Å; R135-Y178 HydrophobicContact CB-CG 3.83Å; Q137-Y178 PolarHBondContact NE2-O 3.34Å; Y178-F180 HydrophobicContact CD1-CE2 4Å; Y178-Y229 WeakPolarHBondContact O-CA 3.5Å; Y178-G230 PolarHBondContact O-N 3.42Å; Y178-E234 WeakPolarHBondContact CB-OE2 3.23Å; Y178-G235 VanDerWaalsContact CE2-O 3.23Å; Y178-G235 WeakPolarHBondContact CE2-O 3.42Å; Y178-F360 CarbonylContact C-O 3.56Å; Y178-F360 WeakPolarHBondContact CA-O 3.43Å; Y178-F360 HydrophobicContact CD1-CB 3.92Å; Y178-F360 HydrophobicContact CD1-CD1 4.15Å; Y178-F360 HydrophobicContact CD1-CG 4.15Å; Y178-F360 HydrophobicContact CD2-CB 3.69Å; Y178-F360 HydrophobicContact CD2-CG 4.21Å; Y178-F360 HydrophobicContact CE1-CB 3.82Å; Y178-F360 AromaticContact CE1-CD1 3.4Å; Y178-F360 HydrophobicContact CE1-CD1 3.4Å; Y178-F360 HydrophobicContact CE1-CD2 4.18Å; Y178-F360 AromaticContact CE1-CE1 3.96Å; Y178-F360 HydrophobicContact CE1-CE1 3.96Å; Y178-F360 AromaticContact CE1-CG 3.53Å; Y178-F360 HydrophobicContact CE1-CG 3.53Å; Y178-F360 HydrophobicContact CE2-CB 3.61Å; Y178-F360 HydrophobicContact CE2-CD1 4.34Å; Y178-F360 AromaticContact CE2-CD2 3.65Å; Y178-F360 HydrophobicContact CE2-CD2 3.65Å; Y178-F360 HydrophobicContact CE2-CE2 4.42Å; Y178-F360 AromaticContact CE2-CG 3.62Å; Y178-F360 HydrophobicContact CE2-CG 3.62Å; Y178-F360 HydrophobicContact CG-CB 3.86Å; Y178-F360 HydrophobicContact CG-CG 4.45Å; Y178-F360 AromaticContact CZ-CD1 3.52Å; Y178-F360 AromaticContact CZ-CD2 3.42Å; Y178-F360 VanDerWaalsContact CZ-CD2 3.42Å; Y178-F360 AromaticContact CZ-CE1 3.95Å; Y178-F360 AromaticContact CZ-CE2 3.88Å; Y178-F360 AromaticContact CZ-CG 3.23Å; Y178-F360 WeakPolarHBondContact OH-CD2 2.88Å; Y178-F360 WeakPolarHBondContact OH-CE1 3.5Å; Y178-F360 WeakPolarHBondContact OH-CE2 3.47Å; Y178-F360 WeakPolarHBondContact OH-CG 3.25Å; Y178-F360 VanDerWaalsContact OH-CZ 3.31Å; Y178-F360 WeakPolarHBondContact OH-CZ 3.38Å; Y178-V362 HydrophobicContact CE1-CG2 4.32Å
179	L	98.4	Very high	96.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.9	-177.3	176.9	63	0	0	0	109.9	L181 L212 I219 A227 S228 Y229 P359 F360 L361 V362	L179-L181 HydrophobicContact CD1-CD2 4.18Å; L179-L181 HydrophobicContact CD2-CD2 4.26Å; L179-L181 HydrophobicContact CG-CD2 4.02Å; L179-L212 HydrophobicContact CD1-CD1 4.12Å; L179-L212 HydrophobicContact CD2-CD1 3.84Å; L179-I219 HydrophobicContact CD2-CD1 4.37Å; L179-A227 HydrophobicContact CD1-CB 3.99Å; L179-S228 WeakPolarHBondContact CA-O 3.22Å; L179-Y229 HydrophobicContact CB-CD2 4.15Å; L179-Y229 HydrophobicContact CD1-CD2 4.19Å; L179-P359 HydrophobicContact CB-CB 3.82Å; L179-P359 HydrophobicContact CB-CG 3.5Å; L179-P359 VanDerWaalsContact CB-CG 3.5Å; L179-P359 HydrophobicContact CD2-CG 3.73Å; L179-P359 HydrophobicContact CG-CG 4.27Å; L179-F360 PolarHBondContact N-O 2.86Å; L179-L361 HydrophobicContact CD2-CD1 4.06Å; L179-L361 HydrophobicContact CD2-CG 4.46Å; L179-L361 CarbonylContact O-C 3.58Å; L179-L361 WeakPolarHBondContact O-CA 3.38Å; L179-V362 PolarHBondContact O-N 3.49Å
180	F	98.4	Very high	96.6	Very high	16 Å²	16	51.6 Å²	51.6	7%	0.07	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	139.1	171.4	-73.4	-103.1	0	0	0	110.5	Q137 Y178 M190 A227 S228 V362 V504	Q137-F180 HydrophobicContact CB-CD2 4.18Å; Q137-F180 HydrophobicContact CB-CE2 3.71Å; Q137-F180 HydrophobicContact CB-CZ 4.38Å; Q137-F180 HydrophobicContact CG-CE2 4.42Å; Y178-F180 HydrophobicContact CD1-CE2 4Å; F180-M190 HydrophobicContact CB-CE 3.75Å; F180-A227 CarbonylContact O-C 3.57Å; F180-A227 WeakPolarHBondContact O-CA 3.5Å; F180-A227 WeakPolarHBondContact O-CB 3.49Å; F180-S228 PolarHBondContact N-O 3.09Å; F180-S228 PolarHBondContact O-N 3.18Å; F180-V362 HydrophobicContact CD1-CB 3.74Å; F180-V362 HydrophobicContact CD1-CG1 3.64Å; F180-V362 HydrophobicContact CD1-CG2 4.25Å; F180-V362 HydrophobicContact CE1-CB 4.08Å; F180-V362 HydrophobicContact CE1-CG1 3.95Å; F180-V362 HydrophobicContact CE1-CG2 4.11Å; F180-V362 HydrophobicContact CG-CB 4.2Å; F180-V362 HydrophobicContact CZ-CG2 4.45Å; F180-V504 HydrophobicContact CE1-CG2 3.91Å
181	L	98.5	Very high	96.7	Very high	4 Å²	4	52 Å²	52	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.4	175.8	-52.5	-179.5	0	0	0	110	L179 L212 I219 V224 A227 L361 V362 D363 Y364 R412	L179-L181 HydrophobicContact CD1-CD2 4.18Å; L179-L181 HydrophobicContact CD2-CD2 4.26Å; L179-L181 HydrophobicContact CG-CD2 4.02Å; L181-L212 HydrophobicContact CD2-CD1 4.34Å; L181-L212 HydrophobicContact CD2-CD2 3.63Å; L181-I219 HydrophobicContact CD1-CD1 4.08Å; L181-I219 HydrophobicContact CD2-CD1 4.44Å; L181-V224 HydrophobicContact CB-CG1 4.46Å; L181-V224 HydrophobicContact CB-CG2 4.23Å; L181-V224 HydrophobicContact CD1-CG2 4.17Å; L181-V224 HydrophobicContact CD2-CG1 4.4Å; L181-A227 HydrophobicContact CD2-CB 3.67Å; L181-L361 HydrophobicContact CD1-CD1 4.27Å; L181-L361 HydrophobicContact CD1-CD2 4.27Å; L181-L361 HydrophobicContact CD1-CG 4.46Å; L181-V362 PolarHBondContact N-O 3.21Å; L181-D363 WeakPolarHBondContact CD1-OD1 3.46Å; L181-Y364 HydrophobicContact CB-CD1 4.23Å; L181-Y364 WeakPolarHBondContact O-CB 3.36Å; L181-R412 VanDerWaalsContact CD1-CD 3.45Å; L181-R412 HydrophobicContact CD1-CG 4.13Å
182	A	98	Very high	96.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.2	175.2	0	0	0	0	0	111	V186 M190 V225 L226	A182-V186 HydrophobicContact CB-CG2 3.87Å; A182-M190 HydrophobicContact CB-CB 4.26Å; A182-M190 HydrophobicContact CB-CE 3.57Å; A182-M190 HydrophobicContact CB-SD 3.67Å; A182-V225 PolarHBondContact O-N 3.09Å; A182-L226 HydrophobicContact CB-CB 4.29Å; A182-L226 PolarHBondContact N-O 3.5Å; A182-L226 PolarHBondContact O-N 3.28Å
183	S	97.7	Very high	96.8	Very high	22 Å²	22	50.6 Å²	50.6	15%	0.154	24%	0.242	C	C	.	.			trans	-79.9	169.5	162.6	67.2	0	0	0	0	110.4	K185 V186 A187 G223 Y364	S183-K185 PolarHBondContact O-N 2.96Å; S183-K185 VanDerWaalsContact O-N 3.1Å; S183-V186 PolarHBondContact O-N 3.23Å; S183-A187 PolarHBondContact O-N 3.23Å; S183-A187 VanDerWaalsContact O-N 3.07Å; S183-G223 WeakPolarHBondContact CA-O 3.17Å; S183-Y364 VanDerWaalsContact N-CD1 3.26Å
184	E	97.3	Very high	97	Very high	163 Å²	163	49.9 Å²	49.9	76%	0.762	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	-36.2	177.2	-168.9	173.3	-171.3	0	0	113	V186 V225	E184-V186 VanDerWaalsContact C-N 3.3Å; E184-V186 PolarHBondContact O-N 3.43Å; E184-V225 HydrophobicContact CB-CG1 4.04Å
185	K	96.2	Very high	97.1	Very high	181 Å²	181	51.6 Å²	51.6	79%	0.787	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.4	-178.7	-65	-177.6	-179.7	178.5	0	113.6	S183 H188	S183-K185 PolarHBondContact O-N 2.96Å; S183-K185 VanDerWaalsContact O-N 3.1Å; K185-H188 PolarHBondContact O-CE1 3.47Å; K185-H188 VanDerWaalsContact O-CE1 3.29Å; K185-H188 PolarHBondContact O-ND1 2.95Å
186	V	95.7	Very high	97.3	Very high	28 Å²	28	46.7 Å²	46.7	17%	0.17	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	2.6	-170.7	-60.5	0	0	0	0	113.6	A182 S183 E184 H188 I189 M190	A182-V186 HydrophobicContact CB-CG2 3.87Å; S183-V186 PolarHBondContact O-N 3.23Å; E184-V186 VanDerWaalsContact C-N 3.3Å; E184-V186 PolarHBondContact O-N 3.43Å; V186-H188 PolarHBondContact O-N 3.17Å; V186-I189 PolarHBondContact O-N 3Å; V186-M190 PolarHBondContact O-N 2.76Å; V186-M190 VanDerWaalsContact O-N 3.12Å
187	A	97	Very high	97.5	Very high	14 Å²	14	46.3 Å²	46.3	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-44.8	-178.6	0	0	0	0	0	113	S183 I189 M190 E191 V225 L226	S183-A187 PolarHBondContact O-N 3.23Å; S183-A187 VanDerWaalsContact O-N 3.07Å; A187-I189 VanDerWaalsContact C-N 3.28Å; A187-I189 PolarHBondContact O-N 3.48Å; A187-M190 WeakPolarHBondContact O-CA 3.31Å; A187-M190 WeakPolarHBondContact O-CB 3.32Å; A187-M190 PolarHBondContact O-N 2.97Å; A187-E191 PolarHBondContact O-N 3.01Å; A187-V225 HydrophobicContact CB-CG2 3.47Å; A187-V225 VanDerWaalsContact CB-CG2 3.47Å; A187-L226 HydrophobicContact CB-CB 4.38Å
188	H	97	Very high	97.7	Very high	96 Å²	96	51.5 Å²	51.5	44%	0.444	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-37.7	177.6	69.7	-80	0	0	0	112.3	K185 V186 M190 E191 E192	K185-H188 PolarHBondContact O-CE1 3.47Å; K185-H188 VanDerWaalsContact O-CE1 3.29Å; K185-H188 PolarHBondContact O-ND1 2.95Å; V186-H188 PolarHBondContact O-N 3.17Å; H188-M190 VanDerWaalsContact C-N 3.34Å; H188-E191 PolarHBondContact O-N 2.88Å; H188-E192 WeakPolarHBondContact O-CG 3.38Å; H188-E192 PolarHBondContact O-N 3.06Å; H188-E192 VanDerWaalsContact O-N 3.07Å
189	I	96.9	Very high	97.7	Very high	28 Å²	28	60.9 Å²	60.9	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-40.7	175.1	-52.6	-180	0	0	0	110.1	V186 A187 E191 E192 N193 R501 N502	V186-I189 PolarHBondContact O-N 3Å; A187-I189 VanDerWaalsContact C-N 3.28Å; A187-I189 PolarHBondContact O-N 3.48Å; I189-E191 VanDerWaalsContact C-N 3.33Å; I189-E191 PolarHBondContact O-N 3.31Å; I189-E192 PolarHBondContact O-N 3.21Å; I189-N193 WeakPolarHBondContact O-CB 3.49Å; I189-N193 PolarHBondContact O-N 2.59Å; I189-N193 PolarHBondContact O-OD1 3.49Å; I189-R501 HydrophobicContact CG2-CB 3.87Å; I189-N502 HydrophobicContact CB-CB 4.41Å; I189-N502 HydrophobicContact CG2-CB 3.82Å
190	M	97.9	Very high	97.6	Very high	11 Å²	11	61.5 Å²	61.5	5%	0.054	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-36	176.5	-179.9	176.2	-77.8	0	0	112.3	F180 A182 V186 A187 H188 Y194 L206 L226	F180-M190 HydrophobicContact CB-CE 3.75Å; A182-M190 HydrophobicContact CB-CB 4.26Å; A182-M190 HydrophobicContact CB-CE 3.57Å; A182-M190 HydrophobicContact CB-SD 3.67Å; V186-M190 PolarHBondContact O-N 2.76Å; V186-M190 VanDerWaalsContact O-N 3.12Å; A187-M190 WeakPolarHBondContact O-CA 3.31Å; A187-M190 WeakPolarHBondContact O-CB 3.32Å; A187-M190 PolarHBondContact O-N 2.97Å; H188-M190 VanDerWaalsContact C-N 3.34Å; M190-Y194 VanDerWaalsContact O-CB 3.25Å; M190-Y194 WeakPolarHBondContact O-CB 3.4Å; M190-Y194 PolarHBondContact O-N 2.7Å; M190-L206 HydrophobicContact CG-CD2 3.99Å; M190-L206 HydrophobicContact SD-CD2 4.29Å; M190-L226 HydrophobicContact CB-CD2 4.14Å; M190-L226 HydrophobicContact CG-CD2 3.98Å; M190-L226 HydrophobicContact SD-CB 4.23Å; M190-L226 HydrophobicContact SD-CD2 3.97Å; M190-L226 HydrophobicContact SD-CG 3.89Å
191	E	98.1	Very high	97.6	Very high	106 Å²	106	62.1 Å²	62.1	50%	0.495	30%	0.301	S	S	.	.	H	α-helix	trans	-67.5	-41.8	174.7	-67.3	177	157.2	0	0	112.6	A187 H188 I189 Y194 S195 L206 L226	A187-E191 PolarHBondContact O-N 3.01Å; H188-E191 PolarHBondContact O-N 2.88Å; I189-E191 VanDerWaalsContact C-N 3.33Å; I189-E191 PolarHBondContact O-N 3.31Å; E191-Y194 PolarHBondContact O-N 3.47Å; E191-S195 PolarHBondContact O-N 2.65Å; E191-S195 PolarHBondContact O-OG 2.83Å; E191-L206 HydrophobicContact CG-CD1 4.3Å; E191-L226 HydrophobicContact CG-CD2 3.63Å
192	E	97.9	Very high	97.6	Very high	86 Å²	86	61.9 Å²	61.9	40%	0.402	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-49.1	173	-71.5	173.2	-166.4	0	0	110.8	H188 I189 Y194 S195 T196 R501	H188-E192 WeakPolarHBondContact O-CG 3.38Å; H188-E192 PolarHBondContact O-N 3.06Å; H188-E192 VanDerWaalsContact O-N 3.07Å; I189-E192 PolarHBondContact O-N 3.21Å; E192-Y194 PolarHBondContact O-N 2.83Å; E192-S195 WeakPolarHBondContact O-CB 3.31Å; E192-S195 PolarHBondContact O-N 2.97Å; E192-S195 VanDerWaalsContact O-N 3.13Å; E192-T196 PolarHBondContact O-N 3.05Å; E192-T196 PolarHBondContact O-OG1 3.25Å; E192-R501 IonicContact OE2-CZ 3.15Å; E192-R501 IonicContact OE2-NH1 3.7Å; E192-R501 PolarHBondContact OE2-NH1 3.2Å; E192-R501 IonicContact OE2-NH2 3.99Å; E192-R501 PolarHBondContact OE2-NH2 2.83Å
193	N	97.9	Very high	97.5	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.053	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-44.6	177.5	-72.3	-5.2	0	0	0	111.5	S139 I189 S195 T196 Q197 R501	S139-N193 WeakPolarHBondContact CB-OD1 3.36Å; I189-N193 WeakPolarHBondContact O-CB 3.49Å; I189-N193 PolarHBondContact O-N 2.59Å; I189-N193 PolarHBondContact O-OD1 3.49Å; N193-S195 VanDerWaalsContact C-N 3.27Å; N193-S195 PolarHBondContact O-N 2.77Å; N193-T196 PolarHBondContact O-N 3.11Å; N193-Q197 WeakPolarHBondContact O-CB 3.43Å; N193-Q197 VanDerWaalsContact O-CD 3.27Å; N193-Q197 WeakPolarHBondContact O-CG 3.27Å; N193-Q197 PolarHBondContact O-N 3.2Å; N193-R501 PolarHBondContact ND2-O 2.96Å
194	Y	98.1	Very high	97.5	Very high	65 Å²	65	65.1 Å²	65.1	26%	0.255	31%	0.312	S	S	.	.	H	α-helix	trans	-56.3	-43.2	174.8	167.8	-101.8	0	0	0	111.6	M190 E191 E192 Q197 R198 V204 L206	M190-Y194 VanDerWaalsContact O-CB 3.25Å; M190-Y194 WeakPolarHBondContact O-CB 3.4Å; M190-Y194 PolarHBondContact O-N 2.7Å; E191-Y194 PolarHBondContact O-N 3.47Å; E192-Y194 PolarHBondContact O-N 2.83Å; Y194-Q197 PolarHBondContact O-N 3.4Å; Y194-R198 HydrophobicContact CD1-CG 4.48Å; Y194-R198 HydrophobicContact CD2-CG 4Å; Y194-R198 HydrophobicContact CE1-CG 4.14Å; Y194-R198 HydrophobicContact CE2-CG 3.61Å; Y194-R198 HydrophobicContact CG-CG 4.42Å; Y194-R198 WeakPolarHBondContact O-CB 3.17Å; Y194-R198 WeakPolarHBondContact O-CG 3.46Å; Y194-R198 PolarHBondContact O-N 2.84Å; Y194-V204 HydrophobicContact CD2-CB 4.38Å; Y194-V204 HydrophobicContact CD2-CG2 3.56Å; Y194-V204 HydrophobicContact CE2-CG2 3.8Å; Y194-L206 HydrophobicContact CD1-CD1 3.61Å; Y194-L206 HydrophobicContact CD1-CG 3.98Å; Y194-L206 HydrophobicContact CD2-CD1 4.2Å; Y194-L206 HydrophobicContact CD2-CD2 4.12Å; Y194-L206 HydrophobicContact CD2-CG 3.62Å; Y194-L206 HydrophobicContact CE1-CD1 4.16Å; Y194-L206 HydrophobicContact CE1-CG 4.38Å; Y194-L206 HydrophobicContact CE2-CG 4.06Å; Y194-L206 HydrophobicContact CG-CD1 3.63Å; Y194-L206 HydrophobicContact CG-CD2 4.09Å; Y194-L206 HydrophobicContact CG-CG 3.57Å
195	S	98.1	Very high	97.6	Very high	73 Å²	73	59.2 Å²	59.2	51%	0.51	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-46.1	177.7	-58.4	0	0	0	0	111.4	E191 E192 N193 R198 Y199	E191-S195 PolarHBondContact O-N 2.65Å; E191-S195 PolarHBondContact O-OG 2.83Å; E192-S195 WeakPolarHBondContact O-CB 3.31Å; E192-S195 PolarHBondContact O-N 2.97Å; E192-S195 VanDerWaalsContact O-N 3.13Å; N193-S195 VanDerWaalsContact C-N 3.27Å; N193-S195 PolarHBondContact O-N 2.77Å; S195-R198 PolarHBondContact O-N 2.86Å; S195-Y199 WeakPolarHBondContact O-CB 3.47Å; S195-Y199 PolarHBondContact O-N 3.37Å
196	T	98.1	Very high	97.7	Very high	46 Å²	46	52.5 Å²	52.5	28%	0.282	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-45.3	175.9	-58	0	0	0	0	112.1	S139 P141 I144 E192 N193 R198 Y199 A200	S139-T196 WeakPolarHBondContact O-CG2 3.31Å; P141-T196 HydrophobicContact CG-CG2 4.12Å; I144-T196 HydrophobicContact CD1-CG2 3.9Å; E192-T196 PolarHBondContact O-N 3.05Å; E192-T196 PolarHBondContact O-OG1 3.25Å; N193-T196 PolarHBondContact O-N 3.11Å; T196-R198 PolarHBondContact O-N 3.05Å; T196-Y199 PolarHBondContact O-N 2.89Å; T196-A200 WeakPolarHBondContact O-CB 3.22Å; T196-A200 PolarHBondContact O-N 3.38Å
197	Q	98.1	Very high	97.8	Very high	5 Å²	5	52.1 Å²	52.1	2%	0.023	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-47.6	178	-71.8	160.2	19.1	0	0	111.6	F138 I144 N193 Y194 Y199 A200 G201 A202 V204	F138-Q197 VanDerWaalsContact O-CG 3.25Å; F138-Q197 WeakPolarHBondContact O-CG 3.29Å; F138-Q197 PolarHBondContact O-NE2 2.91Å; I144-Q197 HydrophobicContact CD1-CG 4.02Å; I144-Q197 HydrophobicContact CG1-CG 4.49Å; N193-Q197 WeakPolarHBondContact O-CB 3.43Å; N193-Q197 VanDerWaalsContact O-CD 3.27Å; N193-Q197 WeakPolarHBondContact O-CG 3.27Å; N193-Q197 PolarHBondContact O-N 3.2Å; Y194-Q197 PolarHBondContact O-N 3.4Å; Q197-Y199 VanDerWaalsContact C-N 3.35Å; Q197-Y199 PolarHBondContact O-N 3.4Å; Q197-A200 PolarHBondContact O-N 3.45Å; Q197-G201 PolarHBondContact O-N 3.4Å; Q197-G201 VanDerWaalsContact O-N 3.11Å; Q197-A202 HydrophobicContact CB-CB 4.16Å; Q197-A202 WeakPolarHBondContact O-CB 3.21Å; Q197-A202 PolarHBondContact O-N 3.22Å; Q197-V204 HydrophobicContact CB-CG2 3.92Å
198	R	98.1	Very high	97.9	Very high	112 Å²	112	53.5 Å²	53.5	42%	0.423	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177.5	-69.7	-68.1	-63.1	178	-5.6	112	Y194 S195 T196 G201 V204	Y194-R198 HydrophobicContact CD1-CG 4.48Å; Y194-R198 HydrophobicContact CD2-CG 4Å; Y194-R198 HydrophobicContact CE1-CG 4.14Å; Y194-R198 HydrophobicContact CE2-CG 3.61Å; Y194-R198 HydrophobicContact CG-CG 4.42Å; Y194-R198 WeakPolarHBondContact O-CB 3.17Å; Y194-R198 WeakPolarHBondContact O-CG 3.46Å; Y194-R198 PolarHBondContact O-N 2.84Å; S195-R198 PolarHBondContact O-N 2.86Å; T196-R198 PolarHBondContact O-N 3.05Å; R198-G201 PolarHBondContact O-N 2.75Å; R198-G201 VanDerWaalsContact O-N 3.16Å; R198-V204 HydrophobicContact CG-CG2 3.92Å
199	Y	98	Very high	98	Very high	212 Å²	212	50.8 Å²	50.8	83%	0.831	26%	0.258	S	S	*	.	H	α-helix	trans	-64.5	-41.3	176.7	-177.1	-94.9	0	0	0	112.2	S195 T196 Q197 G201	S195-Y199 WeakPolarHBondContact O-CB 3.47Å; S195-Y199 PolarHBondContact O-N 3.37Å; T196-Y199 PolarHBondContact O-N 2.89Å; Q197-Y199 VanDerWaalsContact C-N 3.35Å; Q197-Y199 PolarHBondContact O-N 3.4Å; Y199-G201 PolarHBondContact O-N 3.46Å
200	A	97.4	Very high	98	Very high	14 Å²	14	54 Å²	54	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-11.5	174.1	0	0	0	0	0	113.6	I144 T196 Q197	I144-A200 HydrophobicContact CB-CB 4.1Å; I144-A200 HydrophobicContact CD1-CB 4.04Å; I144-A200 HydrophobicContact CG2-CB 3.64Å; T196-A200 WeakPolarHBondContact O-CB 3.22Å; T196-A200 PolarHBondContact O-N 3.38Å; Q197-A200 PolarHBondContact O-N 3.45Å
201	G	97.6	Very high	98.1	Very high	28 Å²	28	58 Å²	58	29%	0.289	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	-0.4	173.3	0	0	0	0	0	115.4	Q197 R198 Y199	Q197-G201 PolarHBondContact O-N 3.4Å; Q197-G201 VanDerWaalsContact O-N 3.11Å; R198-G201 PolarHBondContact O-N 2.75Å; R198-G201 VanDerWaalsContact O-N 3.16Å; Y199-G201 PolarHBondContact O-N 3.46Å
202	A	97.7	Very high	98.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.			trans	-62.8	142.2	178.4	0	0	0	0	0	111.8	Q136 I144 Q197 V204	Q136-A202 HydrophobicContact CB-CB 3.88Å; I144-A202 HydrophobicContact CG2-CB 4.13Å; Q197-A202 HydrophobicContact CB-CB 4.16Å; Q197-A202 WeakPolarHBondContact O-CB 3.21Å; Q197-A202 PolarHBondContact O-N 3.22Å; A202-V204 HydrophobicContact CB-CG1 4.41Å; A202-V204 PolarHBondContact O-N 3.15Å
203	K	97.6	Very high	98.1	Very high	88 Å²	88	53 Å²	53	38%	0.383	27%	0.273	S	S	.	.			trans	-94.1	86.5	179.4	-55.4	-55	-175.2	-165.6	0	109.7	L231 E232	K203-L231 HydrophobicContact CB-CB 4.17Å; K203-L231 WeakPolarHBondContact O-CB 3.45Å; K203-L231 PolarHBondContact O-N 2.9Å; K203-E232 HydrophobicContact CB-CB 3.99Å; K203-E232 HydrophobicContact CB-CG 4.06Å; K203-E232 HydrophobicContact CG-CB 4.18Å; K203-E232 HydrophobicContact CG-CG 4.15Å
204	V	97.3	Very high	98	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.1	179.4	-65.9	0	0	0	0	111	Q137 Y194 Q197 R198 A202 Y229	Q137-V204 HydrophobicContact CG-CG1 3.64Å; Y194-V204 HydrophobicContact CD2-CB 4.38Å; Y194-V204 HydrophobicContact CD2-CG2 3.56Å; Y194-V204 HydrophobicContact CE2-CG2 3.8Å; Q197-V204 HydrophobicContact CB-CG2 3.92Å; R198-V204 HydrophobicContact CG-CG2 3.92Å; A202-V204 HydrophobicContact CB-CG1 4.41Å; A202-V204 PolarHBondContact O-N 3.15Å; V204-Y229 CarbonylContact C-O 3.55Å; V204-Y229 WeakPolarHBondContact CA-O 3.47Å
205	S	97.8	Very high	97.9	Very high	38 Å²	38	60.8 Å²	60.8	27%	0.266	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.4	173.8	-171.2	0	0	0	0	110.2	S228 Y229	S205-S228 WeakPolarHBondContact O-CA 3.36Å; S205-Y229 PolarHBondContact N-O 3.18Å; S205-Y229 PolarHBondContact O-N 2.8Å
206	L	98.5	Very high	97.9	Very high	41 Å²	41	57.4 Å²	57.4	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	142.8	163.4	-67.5	180	0	0	0	110.2	M190 E191 Y194 L226 A227	M190-L206 HydrophobicContact CG-CD2 3.99Å; M190-L206 HydrophobicContact SD-CD2 4.29Å; E191-L206 HydrophobicContact CG-CD1 4.3Å; Y194-L206 HydrophobicContact CD1-CD1 3.61Å; Y194-L206 HydrophobicContact CD1-CG 3.98Å; Y194-L206 HydrophobicContact CD2-CD1 4.2Å; Y194-L206 HydrophobicContact CD2-CD2 4.12Å; Y194-L206 HydrophobicContact CD2-CG 3.62Å; Y194-L206 HydrophobicContact CE1-CD1 4.16Å; Y194-L206 HydrophobicContact CE1-CG 4.38Å; Y194-L206 HydrophobicContact CE2-CG 4.06Å; Y194-L206 HydrophobicContact CG-CD1 3.63Å; Y194-L206 HydrophobicContact CG-CD2 4.09Å; Y194-L206 HydrophobicContact CG-CG 3.57Å; L206-L226 HydrophobicContact CB-CD1 4.19Å; L206-L226 HydrophobicContact CD1-CD1 4.43Å; L206-L226 HydrophobicContact CD1-CD2 4.22Å; L206-L226 HydrophobicContact CD2-CD1 4.44Å; L206-L226 HydrophobicContact CD2-CD2 4.11Å; L206-L226 HydrophobicContact CD2-CG 4.19Å; L206-A227 CarbonylContact C-O 3.54Å; L206-A227 VanDerWaalsContact CA-O 3.29Å; L206-A227 WeakPolarHBondContact CA-O 3.43Å
207	L	98.7	Very high	97.8	Very high	19 Å²	19	59.5 Å²	59.5	10%	0.099	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.1	179.5	-56.4	175.8	0	0	0	109	Q211 L212 K215 A227	L207-Q211 HydrophobicContact CB-CB 4.14Å; L207-Q211 HydrophobicContact CD2-CB 4.19Å; L207-L212 HydrophobicContact CB-CB 4.47Å; L207-K215 HydrophobicContact CD1-CD 3.93Å; L207-A227 HydrophobicContact CB-CB 4.39Å; L207-A227 PolarHBondContact N-O 3.02Å; L207-A227 PolarHBondContact O-N 2.88Å
208	S	98.6	Very high	97.7	Very high	43 Å²	43	62.1 Å²	62.1	30%	0.301	31%	0.31	S	S	.	.			trans	-68	164.2	165	76.2	0	0	0	0	110.6	T210 Q211 L212	S208-T210 PolarHBondContact O-N 2.96Å; S208-Q211 PolarHBondContact O-N 2.78Å; S208-Q211 VanDerWaalsContact O-N 3.13Å; S208-Q211 WeakPolarHBondContact OG-CG 3.4Å; S208-Q211 PolarHBondContact OG-N 3.46Å; S208-Q211 PolarHBondContact OG-OE1 3.29Å; S208-L212 WeakPolarHBondContact O-CB 3.38Å; S208-L212 PolarHBondContact O-N 2.89Å
209	P	98.5	Very high	97.7	Very high	40 Å²	40	56.8 Å²	56.8	26%	0.26	29%	0.29	S	S	.	.	H	α-helix	trans	-56.2	-36.8	175.7	-27.7	37.7	0	0	0	112.8	L212 K213 V224 V225	P209-L212 PolarHBondContact O-N 2.89Å; P209-K213 WeakPolarHBondContact O-CB 3.35Å; P209-K213 PolarHBondContact O-N 3.02Å; P209-V224 WeakPolarHBondContact CG-O 3.37Å; P209-V225 WeakPolarHBondContact CD-O 3.33Å
210	T	98.5	Very high	97.7	Very high	95 Å²	95	48 Å²	48	58%	0.583	26%	0.257	S	S	*	.	H	α-helix	trans	-64.5	-49.1	175.4	-51.7	0	0	0	0	111.6	S208 L212 K213 E214	S208-T210 PolarHBondContact O-N 2.96Å; T210-L212 VanDerWaalsContact C-N 3.3Å; T210-L212 PolarHBondContact O-N 3.03Å; T210-K213 PolarHBondContact O-N 2.82Å; T210-E214 WeakPolarHBondContact O-CG 3.45Å; T210-E214 PolarHBondContact O-N 2.88Å
211	Q	98.5	Very high	97.8	Very high	94 Å²	94	48.9 Å²	48.9	44%	0.439	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-36.5	178.4	-68.7	171.6	-49.6	0	0	112	L207 S208 E214 K215	L207-Q211 HydrophobicContact CB-CB 4.14Å; L207-Q211 HydrophobicContact CD2-CB 4.19Å; S208-Q211 PolarHBondContact O-N 2.78Å; S208-Q211 VanDerWaalsContact O-N 3.13Å; S208-Q211 WeakPolarHBondContact OG-CG 3.4Å; S208-Q211 PolarHBondContact OG-N 3.46Å; S208-Q211 PolarHBondContact OG-OE1 3.29Å; Q211-E214 PolarHBondContact O-N 2.88Å; Q211-K215 WeakPolarHBondContact O-CB 3.41Å; Q211-K215 PolarHBondContact O-N 3.14Å
212	L	98.3	Very high	97.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-45.8	173.5	172.7	61.4	0	0	0	111.1	L179 L181 L207 S208 P209 T210 E214 K215 C216 I219 T221 V224 A227	L179-L212 HydrophobicContact CD1-CD1 4.12Å; L179-L212 HydrophobicContact CD2-CD1 3.84Å; L181-L212 HydrophobicContact CD2-CD1 4.34Å; L181-L212 HydrophobicContact CD2-CD2 3.63Å; L207-L212 HydrophobicContact CB-CB 4.47Å; S208-L212 WeakPolarHBondContact O-CB 3.38Å; S208-L212 PolarHBondContact O-N 2.89Å; P209-L212 PolarHBondContact O-N 2.89Å; T210-L212 VanDerWaalsContact C-N 3.3Å; T210-L212 PolarHBondContact O-N 3.03Å; L212-E214 VanDerWaalsContact C-N 3.33Å; L212-E214 PolarHBondContact O-N 3Å; L212-K215 PolarHBondContact O-N 3.29Å; L212-C216 HydrophobicContact CD1-CB 4.5Å; L212-C216 PolarHBondContact O-N 3.17Å; L212-I219 HydrophobicContact CD1-CD1 4.1Å; L212-I219 HydrophobicContact CD1-CG2 4.48Å; L212-I219 HydrophobicContact CD2-CD1 4.22Å; L212-I219 HydrophobicContact CG-CD1 4.35Å; L212-I219 HydrophobicContact CG-CG2 4.06Å; L212-T221 HydrophobicContact CD2-CG2 3.97Å; L212-T221 HydrophobicContact CG-CG2 4.17Å; L212-V224 HydrophobicContact CD2-CG1 3.95Å; L212-A227 HydrophobicContact CD1-CB 4.38Å; L212-A227 HydrophobicContact CD2-CB 4.01Å
213	K	98	Very high	97.8	Very high	89 Å²	89	54.6 Å²	54.6	39%	0.387	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-36.5	178	-171	60.2	166.2	174.4	0	112.1	P209 T210 C216 P217 I219 T221	P209-K213 WeakPolarHBondContact O-CB 3.35Å; P209-K213 PolarHBondContact O-N 3.02Å; T210-K213 PolarHBondContact O-N 2.82Å; K213-C216 CarbonylContact O-C 3.58Å; K213-P217 WeakPolarHBondContact CE-O 3.28Å; K213-P217 PolarHBondContact NZ-O 3.39Å; K213-P217 WeakPolarHBondContact O-CA 3.04Å; K213-I219 HydrophobicContact CD-CG2 4.39Å; K213-I219 WeakPolarHBondContact CD-O 3.43Å; K213-I219 PolarHBondContact NZ-O 2.72Å; K213-T221 HydrophobicContact CB-CG2 4.08Å; K213-T221 HydrophobicContact CD-CG2 4.37Å
214	E	97.6	Very high	97.9	Very high	142 Å²	142	50.8 Å²	50.8	66%	0.664	28%	0.28	S	S	*	.	H	α-helix	trans	-64.1	-44.5	173.3	-72.4	170.8	-179.7	0	0	111.7	T210 Q211 L212	T210-E214 WeakPolarHBondContact O-CG 3.45Å; T210-E214 PolarHBondContact O-N 2.88Å; Q211-E214 PolarHBondContact O-N 2.88Å; L212-E214 VanDerWaalsContact C-N 3.33Å; L212-E214 PolarHBondContact O-N 3Å
215	K	95.9	Very high	97.9	Very high	95 Å²	95	53.6 Å²	53.6	41%	0.413	30%	0.298	S	S	.	.	H	α-helix	trans	-71.6	-39.9	179.9	-176.9	173	170.9	62.3	0	113	L207 Q211 L212 Y229	L207-K215 HydrophobicContact CD1-CD 3.93Å; Q211-K215 WeakPolarHBondContact O-CB 3.41Å; Q211-K215 PolarHBondContact O-N 3.14Å; L212-K215 PolarHBondContact O-N 3.29Å; K215-Y229 HydrophobicContact CD-CD1 4.47Å; K215-Y229 VanDerWaalsContact NZ-CZ 3.32Å; K215-Y229 PolarHBondContact NZ-OH 2.83Å
216	C	96.8	Very high	97.9	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.02	29%	0.29	C	S	.	.			trans	-124.3	75.8	-178.2	-64.4	0	0	0	0	110	L212 K213 W218 I219	L212-C216 HydrophobicContact CD1-CB 4.5Å; L212-C216 PolarHBondContact O-N 3.17Å; K213-C216 CarbonylContact O-C 3.58Å; C216-W218 HydrophobicContact CB-CD2 4.37Å; C216-W218 HydrophobicContact CB-CH2 4.32Å; C216-W218 HydrophobicContact CB-CZ2 3.76Å; C216-W218 PolarHBondContact O-N 3.3Å; C216-I219 HydrophobicContact CB-CB 4.07Å; C216-I219 HydrophobicContact CB-CG2 3.99Å; C216-I219 WeakPolarHBondContact O-CB 3.38Å; C216-I219 WeakPolarHBondContact O-CG2 3.38Å; C216-I219 PolarHBondContact O-N 2.72Å
217	P	96.5	Very high	97.9	Very high	89 Å²	89	50.8 Å²	50.8	58%	0.578	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-27	-173.7	-28.5	36.5	0	0	0	115.2	K213 I219	K213-P217 WeakPolarHBondContact CE-O 3.28Å; K213-P217 PolarHBondContact NZ-O 3.39Å; K213-P217 WeakPolarHBondContact O-CA 3.04Å; P217-I219 VanDerWaalsContact C-N 3.28Å; P217-I219 PolarHBondContact O-N 2.8Å
218	W	96.4	Very high	97.9	Very high	60 Å²	60	50 Å²	50	23%	0.227	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-16.2	178	50.1	-100.5	0	0	0	114	C216 P354 T358 L361 F369 V413	C216-W218 HydrophobicContact CB-CD2 4.37Å; C216-W218 HydrophobicContact CB-CH2 4.32Å; C216-W218 HydrophobicContact CB-CZ2 3.76Å; C216-W218 PolarHBondContact O-N 3.3Å; W218-P354 HydrophobicContact CD2-CB 3.75Å; W218-P354 HydrophobicContact CD2-CG 3.6Å; W218-P354 HydrophobicContact CE3-CB 4.18Å; W218-P354 HydrophobicContact CE3-CG 3.57Å; W218-P354 HydrophobicContact CG-CB 4.07Å; W218-P354 HydrophobicContact CG-CG 4.05Å; W218-P354 HydrophobicContact CH2-CB 4.5Å; W218-P354 HydrophobicContact CH2-CG 4.39Å; W218-P354 HydrophobicContact CZ2-CB 4.09Å; W218-P354 HydrophobicContact CZ2-CG 4.41Å; W218-P354 HydrophobicContact CZ3-CG 4Å; W218-T358 HydrophobicContact CH2-CG2 4.09Å; W218-T358 HydrophobicContact CZ2-CG2 3.85Å; W218-L361 HydrophobicContact CH2-CD1 3.9Å; W218-L361 HydrophobicContact CZ3-CD1 4.15Å; W218-F369 HydrophobicContact CH2-CZ 4.03Å; W218-F369 AromaticContact CZ3-CZ 3.96Å; W218-F369 HydrophobicContact CZ3-CZ 3.96Å; W218-V413 HydrophobicContact CE3-CG1 4.23Å; W218-V413 HydrophobicContact CE3-CG2 3.88Å; W218-V413 HydrophobicContact CZ3-CG2 3.65Å
219	I	97.9	Very high	97.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.			trans	-79.8	137.5	-173.4	-152.8	172.5	0	0	0	110.9	L179 L181 L212 K213 C216 P217 T221 L361 R412	L179-I219 HydrophobicContact CD2-CD1 4.37Å; L181-I219 HydrophobicContact CD1-CD1 4.08Å; L181-I219 HydrophobicContact CD2-CD1 4.44Å; L212-I219 HydrophobicContact CD1-CD1 4.1Å; L212-I219 HydrophobicContact CD1-CG2 4.48Å; L212-I219 HydrophobicContact CD2-CD1 4.22Å; L212-I219 HydrophobicContact CG-CD1 4.35Å; L212-I219 HydrophobicContact CG-CG2 4.06Å; K213-I219 HydrophobicContact CD-CG2 4.39Å; K213-I219 WeakPolarHBondContact CD-O 3.43Å; K213-I219 PolarHBondContact NZ-O 2.72Å; C216-I219 HydrophobicContact CB-CB 4.07Å; C216-I219 HydrophobicContact CB-CG2 3.99Å; C216-I219 WeakPolarHBondContact O-CB 3.38Å; C216-I219 WeakPolarHBondContact O-CG2 3.38Å; C216-I219 PolarHBondContact O-N 2.72Å; P217-I219 VanDerWaalsContact C-N 3.28Å; P217-I219 PolarHBondContact O-N 2.8Å; I219-T221 HydrophobicContact CG2-CG2 3.8Å; I219-L361 HydrophobicContact CD1-CD1 3.72Å; I219-R412 HydrophobicContact CD1-CG 4.45Å; I219-R412 HydrophobicContact CG1-CG 4.1Å
220	N	98.5	Very high	97.9	Very high	29 Å²	29	47.3 Å²	47.3	16%	0.155	25%	0.254	C	S	.	.			trans	-76.4	134.7	160.9	-172.9	1.5	0	0	0	108.1	D222 H411 R412 P414	N220-D222 WeakPolarHBondContact OD1-CB 3.17Å; N220-D222 PolarHBondContact OD1-N 2.94Å; N220-D222 PolarHBondContact OD1-OD2 3.33Å; N220-H411 WeakPolarHBondContact CB-O 3.32Å; N220-H411 PolarHBondContact ND2-O 2.88Å; N220-H411 VanDerWaalsContact ND2-O 3.1Å; N220-R412 PolarHBondContact N-O 3.14Å; N220-R412 WeakPolarHBondContact O-CD 3.4Å; N220-R412 PolarHBondContact O-NH1 2.96Å; N220-P414 HydrophobicContact CB-CG 4.23Å
221	T	98.5	Very high	97.7	Very high	31 Å²	31	47.4 Å²	47.4	19%	0.19	25%	0.25	C	S	.	.			trans	-106.7	2.8	178.7	54.2	0	0	0	0	113.1	L212 K213 I219 G223 V224	L212-T221 HydrophobicContact CD2-CG2 3.97Å; L212-T221 HydrophobicContact CG-CG2 4.17Å; K213-T221 HydrophobicContact CB-CG2 4.08Å; K213-T221 HydrophobicContact CD-CG2 4.37Å; I219-T221 HydrophobicContact CG2-CG2 3.8Å; T221-G223 PolarHBondContact O-N 3.31Å; T221-V224 WeakPolarHBondContact O-CB 3.25Å; T221-V224 PolarHBondContact O-N 2.91Å
222	D	98.3	Very high	97.6	Very high	100 Å²	100	47.4 Å²	47.4	54%	0.535	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	135.6	175.4	-66.2	-13.3	0	0	0	110.3	N220 V224 R412	N220-D222 WeakPolarHBondContact OD1-CB 3.17Å; N220-D222 PolarHBondContact OD1-N 2.94Å; N220-D222 PolarHBondContact OD1-OD2 3.33Å; D222-V224 PolarHBondContact O-N 3.11Å; D222-V224 VanDerWaalsContact O-N 3.13Å; D222-R412 PolarHBondContact O-NH1 3.25Å
223	G	97.4	Very high	97.3	Very high	48 Å²	48	49.2 Å²	49.2	50%	0.495	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	-7.9	-176.4	0	0	0	0	0	115.8	S183 T221	S183-G223 WeakPolarHBondContact CA-O 3.17Å; T221-G223 PolarHBondContact O-N 3.31Å
224	V	98.5	Very high	97.3	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	24%	0.243	C	C	.	.			trans	-88.3	126.5	174.7	-177.6	0	0	0	0	108.9	L181 P209 L212 T221 D222 L226 Y364 R412	L181-V224 HydrophobicContact CB-CG1 4.46Å; L181-V224 HydrophobicContact CB-CG2 4.23Å; L181-V224 HydrophobicContact CD1-CG2 4.17Å; L181-V224 HydrophobicContact CD2-CG1 4.4Å; P209-V224 WeakPolarHBondContact CG-O 3.37Å; L212-V224 HydrophobicContact CD2-CG1 3.95Å; T221-V224 WeakPolarHBondContact O-CB 3.25Å; T221-V224 PolarHBondContact O-N 2.91Å; D222-V224 PolarHBondContact O-N 3.11Å; D222-V224 VanDerWaalsContact O-N 3.13Å; V224-L226 WeakPolarHBondContact CG1-O 3.49Å; V224-Y364 HydrophobicContact CG2-CE1 3.91Å; V224-R412 VanDerWaalsContact CG2-NH2 3.29Å
225	V	98.4	Very high	97.2	Very high	62 Å²	62	38.4 Å²	38.4	38%	0.376	21%	0.211	S	C	.	.	S	Bend	trans	-109.2	-21.4	173.5	-54.9	0	0	0	0	112.4	A182 E184 A187 P209	A182-V225 PolarHBondContact O-N 3.09Å; E184-V225 HydrophobicContact CB-CG1 4.04Å; A187-V225 HydrophobicContact CB-CG2 3.47Å; A187-V225 VanDerWaalsContact CB-CG2 3.47Å; P209-V225 WeakPolarHBondContact CD-O 3.33Å
226	L	98.4	Very high	97.3	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.099	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	148.1	-178.9	-168.4	66.4	0	0	0	109.7	A182 A187 M190 E191 L206 V224	A182-L226 HydrophobicContact CB-CB 4.29Å; A182-L226 PolarHBondContact N-O 3.5Å; A182-L226 PolarHBondContact O-N 3.28Å; A187-L226 HydrophobicContact CB-CB 4.38Å; M190-L226 HydrophobicContact CB-CD2 4.14Å; M190-L226 HydrophobicContact CG-CD2 3.98Å; M190-L226 HydrophobicContact SD-CB 4.23Å; M190-L226 HydrophobicContact SD-CD2 3.97Å; M190-L226 HydrophobicContact SD-CG 3.89Å; E191-L226 HydrophobicContact CG-CD2 3.63Å; L206-L226 HydrophobicContact CB-CD1 4.19Å; L206-L226 HydrophobicContact CD1-CD1 4.43Å; L206-L226 HydrophobicContact CD1-CD2 4.22Å; L206-L226 HydrophobicContact CD2-CD1 4.44Å; L206-L226 HydrophobicContact CD2-CD2 4.11Å; L206-L226 HydrophobicContact CD2-CG 4.19Å; V224-L226 WeakPolarHBondContact CG1-O 3.49Å
227	A	98.5	Very high	97.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.4	170.4	0	0	0	0	0	111	L179 F180 L181 L206 L207 L212	L179-A227 HydrophobicContact CD1-CB 3.99Å; F180-A227 CarbonylContact O-C 3.57Å; F180-A227 WeakPolarHBondContact O-CA 3.5Å; F180-A227 WeakPolarHBondContact O-CB 3.49Å; L181-A227 HydrophobicContact CD2-CB 3.67Å; L206-A227 CarbonylContact C-O 3.54Å; L206-A227 VanDerWaalsContact CA-O 3.29Å; L206-A227 WeakPolarHBondContact CA-O 3.43Å; L207-A227 HydrophobicContact CB-CB 4.39Å; L207-A227 PolarHBondContact N-O 3.02Å; L207-A227 PolarHBondContact O-N 2.88Å; L212-A227 HydrophobicContact CD1-CB 4.38Å; L212-A227 HydrophobicContact CD2-CB 4.01Å
228	S	98.4	Very high	97.3	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.8	174.4	-179.2	0	0	0	0	109.7	Q137 L179 F180 S205	Q137-S228 PolarHBondContact OE1-O 3.4Å; Q137-S228 PolarHBondContact OE1-OG 3.32Å; L179-S228 WeakPolarHBondContact CA-O 3.22Å; F180-S228 PolarHBondContact N-O 3.09Å; F180-S228 PolarHBondContact O-N 3.18Å; S205-S228 WeakPolarHBondContact O-CA 3.36Å
229	Y	98.3	Very high	97.4	Very high	26 Å²	26	30.8 Å²	30.8	10%	0.102	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.8	-176.4	-177.7	-104	0	0	0	111.4	S176 Y178 L179 V204 S205 K215 L231 P359	S176-Y229 PolarHBondContact O-OH 3.18Å; Y178-Y229 WeakPolarHBondContact O-CA 3.5Å; L179-Y229 HydrophobicContact CB-CD2 4.15Å; L179-Y229 HydrophobicContact CD1-CD2 4.19Å; V204-Y229 CarbonylContact C-O 3.55Å; V204-Y229 WeakPolarHBondContact CA-O 3.47Å; S205-Y229 PolarHBondContact N-O 3.18Å; S205-Y229 PolarHBondContact O-N 2.8Å; K215-Y229 HydrophobicContact CD-CD1 4.47Å; K215-Y229 VanDerWaalsContact NZ-CZ 3.32Å; K215-Y229 PolarHBondContact NZ-OH 2.83Å; Y229-L231 HydrophobicContact CD1-CD2 3.78Å; Y229-L231 HydrophobicContact CE1-CD2 4.07Å; Y229-P359 HydrophobicContact CE2-CB 3.95Å; Y229-P359 HydrophobicContact CE2-CG 4.31Å
230	G	97.6	Very high	97.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.3	172.5	0	0	0	0	0	112.7	Y178 E234	Y178-G230 PolarHBondContact O-N 3.42Å; G230-E234 WeakPolarHBondContact CA-OE2 3.24Å
231	L	95.6	Very high	97.3	Very high	97 Å²	97	37.3 Å²	37.3	51%	0.508	20%	0.2	S	C	.	.			trans	-92.7	-30.8	-175.4	-59.7	170.9	0	0	0	113.1	K203 Y229	K203-L231 HydrophobicContact CB-CB 4.17Å; K203-L231 WeakPolarHBondContact O-CB 3.45Å; K203-L231 PolarHBondContact O-N 2.9Å; Y229-L231 HydrophobicContact CD1-CD2 3.78Å; Y229-L231 HydrophobicContact CE1-CD2 4.07Å
232	E	94.9	Very high	97.3	Very high	94 Å²	94	35.8 Å²	35.8	44%	0.439	19%	0.19	S	C	.	.	S	Bend	trans	-142	149.4	-177	-62.3	179.6	-156	0	0	110.2	Q136 K203 E234	Q136-E232 PolarHBondContact NE2-O 2.95Å; K203-E232 HydrophobicContact CB-CB 3.99Å; K203-E232 HydrophobicContact CB-CG 4.06Å; K203-E232 HydrophobicContact CG-CB 4.18Å; K203-E232 HydrophobicContact CG-CG 4.15Å; E232-E234 PolarHBondContact O-N 3.47Å
233	N	93.4	Very high	97.3	Very high	39 Å²	39	31 Å²	31	21%	0.209	17%	0.165	C	C	.	.	S	Bend	trans	59.7	28.9	171.5	-77.4	-27.1	0	0	0	114	Q136 A151 R155	Q136-N233 PolarHBondContact NE2-O 3.28Å; A151-N233 HydrophobicContact CB-CB 3.66Å; R155-N233 PolarHBondContact NE-OD1 2.91Å; R155-N233 PolarHBondContact NH2-ND2 3.35Å; R155-N233 PolarHBondContact NH2-OD1 2.84Å
234	E	96.9	Very high	97.3	Very high	3 Å²	3	30.1 Å²	30.1	1%	0.014	15%	0.149	C	C	.	.			trans	-132.2	152	175.1	-56.7	-162.9	166.4	0	0	110.7	I134 Q136 Q137 G177 Y178 G230 E232	I134-E234 VanDerWaalsContact O-CA 3.3Å; I134-E234 WeakPolarHBondContact O-CA 3.47Å; Q136-E234 WeakPolarHBondContact CA-OE1 3.44Å; Q136-E234 WeakPolarHBondContact CB-OE1 3.44Å; Q136-E234 PolarHBondContact N-OE1 3.48Å; Q137-E234 PolarHBondContact N-OE1 3.08Å; Q137-E234 PolarHBondContact NE2-OE2 2.93Å; G177-E234 WeakPolarHBondContact CA-O 3.38Å; G177-E234 PolarHBondContact N-O 3.18Å; Y178-E234 WeakPolarHBondContact CB-OE2 3.23Å; G230-E234 WeakPolarHBondContact CA-OE2 3.24Å; E232-E234 PolarHBondContact O-N 3.47Å
235	G	96.8	Very high	97.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146	-140	-177.9	0	0	0	0	0	110.6	I134 N174 Y178	I134-G235 PolarHBondContact N-O 3.49Å; I134-G235 PolarHBondContact O-N 3.5Å; N174-G235 VanDerWaalsContact O-CA 3.31Å; N174-G235 WeakPolarHBondContact O-CA 3.31Å; Y178-G235 VanDerWaalsContact CE2-O 3.23Å; Y178-G235 WeakPolarHBondContact CE2-O 3.42Å
236	W	97.1	Very high	97.3	Very high	18 Å²	18	27.1 Å²	27.1	7%	0.068	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	162.3	178.4	62.9	94.2	0	0	0	112.1	G132 F173 N174 T358 F360 R370 R371	G132-W236 CarbonylContact O-C 3.56Å; G132-W236 WeakPolarHBondContact O-CA 3.31Å; G132-W236 VanDerWaalsContact O-CB 3.28Å; G132-W236 WeakPolarHBondContact O-CB 3.37Å; F173-W236 CarbonylContact C-O 3.48Å; F173-W236 WeakPolarHBondContact CA-O 3.25Å; F173-W236 WeakPolarHBondContact CD2-O 3.39Å; N174-W236 HydrophobicContact CB-CD2 3.78Å; N174-W236 HydrophobicContact CB-CE3 4.31Å; N174-W236 HydrophobicContact CB-CG 4.22Å; N174-W236 HydrophobicContact CB-CH2 4.18Å; N174-W236 HydrophobicContact CB-CZ2 3.64Å; N174-W236 HydrophobicContact CB-CZ3 4.49Å; N174-W236 VanDerWaalsContact CG-CH2 3.47Å; N174-W236 PolarHBondContact N-O 3.02Å; N174-W236 WeakPolarHBondContact ND2-CZ2 3.39Å; N174-W236 PolarHBondContact O-N 2.99Å; N174-W236 VanDerWaalsContact O-N 3.11Å; N174-W236 WeakPolarHBondContact OD1-CH2 3.45Å; N174-W236 WeakPolarHBondContact OD1-CZ2 3.34Å; W236-T358 WeakPolarHBondContact CH2-O 3.25Å; W236-F360 HydrophobicContact CB-CD2 4.27Å; W236-F360 HydrophobicContact CE3-CB 4.06Å; W236-F360 HydrophobicContact CE3-CD2 4.28Å; W236-F360 HydrophobicContact CZ3-CB 4.32Å; W236-R370 VanDerWaalsContact CD1-CD 3.46Å; W236-R370 HydrophobicContact CD2-CB 4.33Å; W236-R370 HydrophobicContact CD2-CG 4.44Å; W236-R370 HydrophobicContact CE3-CB 4.19Å; W236-R370 HydrophobicContact CH2-CB 4.46Å; W236-R370 HydrophobicContact CZ3-CB 4.26Å; W236-R371 HydrophobicContact CH2-CB 4.34Å; W236-R371 HydrophobicContact CZ2-CB 3.97Å
237	F	96.9	Very high	97.3	Very high	3 Å²	3	28.7 Å²	28.7	1%	0.013	14%	0.136	C	C	.	.			trans	-144.1	173.2	178.4	57.9	-83.3	0	0	0	110.4	G132 I134 M154 L171 F173 P239 L242 L460	G132-F237 WeakPolarHBondContact CA-O 3.36Å; G132-F237 WeakPolarHBondContact O-CD1 3.34Å; G132-F237 PolarHBondContact O-N 2.86Å; I134-F237 HydrophobicContact CB-CE1 4.14Å; I134-F237 HydrophobicContact CG2-CD1 4.11Å; I134-F237 HydrophobicContact CG2-CE1 4.15Å; M154-F237 HydrophobicContact CE-CD1 4.23Å; M154-F237 HydrophobicContact CE-CE1 3.7Å; M154-F237 HydrophobicContact CE-CZ 4.14Å; M154-F237 HydrophobicContact SD-CD1 4.09Å; M154-F237 HydrophobicContact SD-CD2 4.43Å; M154-F237 HydrophobicContact SD-CE1 3.69Å; M154-F237 HydrophobicContact SD-CE2 4.07Å; M154-F237 HydrophobicContact SD-CG 4.44Å; M154-F237 HydrophobicContact SD-CZ 3.66Å; L171-F237 HydrophobicContact CB-CB 4.13Å; L171-F237 WeakPolarHBondContact O-CB 3.5Å; F173-F237 HydrophobicContact CD2-CB 4.12Å; F173-F237 HydrophobicContact CD2-CD1 4.49Å; F237-P239 VanDerWaalsContact O-CD 3.3Å; F237-P239 WeakPolarHBondContact O-CD 3.5Å; F237-L242 HydrophobicContact CD2-CB 4.22Å; F237-L242 HydrophobicContact CE2-CB 3.76Å; F237-L242 HydrophobicContact CE2-CD2 3.48Å; F237-L242 VanDerWaalsContact CE2-CD2 3.48Å; F237-L242 HydrophobicContact CE2-CG 4.23Å; F237-L242 HydrophobicContact CZ-CD2 3.74Å; F237-L460 HydrophobicContact CE2-CD1 4.07Å; F237-L460 HydrophobicContact CE2-CD2 4.17Å; F237-L460 HydrophobicContact CE2-CG 4.14Å; F237-L460 HydrophobicContact CZ-CD1 4.13Å; F237-L460 HydrophobicContact CZ-CD2 3.99Å; F237-L460 HydrophobicContact CZ-CG 3.78Å
238	D	97.1	Very high	97.3	Very high	56 Å²	56	34.7 Å²	34.7	30%	0.299	16%	0.158	S	C	.	.			trans	-79	113.9	173.9	-173.9	-30.2	0	0	0	110.6	L171 Q172 W240 M241 L242	L171-D238 PolarHBondContact O-N 2.87Å; Q172-D238 HydrophobicContact CB-CB 4.25Å; Q172-D238 HydrophobicContact CG-CB 4.47Å; D238-W240 VanDerWaalsContact C-N 3.27Å; D238-W240 PolarHBondContact O-N 2.88Å; D238-W240 WeakPolarHBondContact OD1-CA 3.33Å; D238-W240 WeakPolarHBondContact OD1-CB 3.33Å; D238-W240 PolarHBondContact OD1-N 3.1Å; D238-M241 HydrophobicContact CB-CB 4.14Å; D238-M241 HydrophobicContact CB-CG 3.71Å; D238-M241 PolarHBondContact O-N 3.17Å; D238-M241 PolarHBondContact OD1-N 3.49Å; D238-L242 PolarHBondContact O-N 3.33Å
239	P	97.3	Very high	97.3	Very high	11 Å²	11	36.4 Å²	36.4	7%	0.071	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-31	179.4	-19.1	31.3	0	0	0	114.1	T127 F237 M241 L242 L243 L460	T127-P239 HydrophobicContact CG2-CB 4.48Å; T127-P239 WeakPolarHBondContact O-CB 3.06Å; F237-P239 VanDerWaalsContact O-CD 3.3Å; F237-P239 WeakPolarHBondContact O-CD 3.5Å; P239-M241 VanDerWaalsContact C-N 3.34Å; P239-L242 PolarHBondContact O-N 3Å; P239-L243 WeakPolarHBondContact O-CB 3.49Å; P239-L243 PolarHBondContact O-N 3.44Å; P239-L460 HydrophobicContact CB-CD1 4.03Å; P239-L460 HydrophobicContact CB-CD2 3.69Å; P239-L460 HydrophobicContact CG-CD2 3.67Å
240	W	97.1	Very high	97.3	Very high	98 Å²	98	35.1 Å²	35.1	37%	0.371	16%	0.161	S	C	.	.	H	α-helix	trans	-66.9	-37.7	178.5	-180	-116.6	0	0	0	111	Y122 V128 D238 L243 N244	Y122-W240 HydrophobicContact CD2-CH2 4.16Å; Y122-W240 AromaticContact CD2-CZ3 3.81Å; Y122-W240 HydrophobicContact CD2-CZ3 3.81Å; Y122-W240 HydrophobicContact CG-CZ3 4.06Å; V128-W240 HydrophobicContact CG1-CE3 3.56Å; V128-W240 HydrophobicContact CG1-CZ3 4.03Å; D238-W240 VanDerWaalsContact C-N 3.27Å; D238-W240 PolarHBondContact O-N 2.88Å; D238-W240 WeakPolarHBondContact OD1-CA 3.33Å; D238-W240 WeakPolarHBondContact OD1-CB 3.33Å; D238-W240 PolarHBondContact OD1-N 3.1Å; W240-L243 HydrophobicContact CE3-CD2 4.09Å; W240-L243 HydrophobicContact CZ3-CD2 4.16Å; W240-N244 VanDerWaalsContact CZ2-ND2 3.32Å; W240-N244 WeakPolarHBondContact CZ2-ND2 3.43Å; W240-N244 PolarHBondContact NE1-ND2 3.32Å; W240-N244 VanDerWaalsContact NE1-ND2 3.14Å; W240-N244 WeakPolarHBondContact O-CB 3.41Å; W240-N244 PolarHBondContact O-N 3.22Å; W240-N244 PolarHBondContact O-ND2 3.45Å; W240-N244 VanDerWaalsContact O-ND2 3.15Å
241	M	97.8	Very high	97.3	Very high	67 Å²	67	38.4 Å²	38.4	33%	0.33	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-47.2	175.4	-65.5	-60.9	121.8	0	0	111.3	D170 L171 D238 P239 N244 A245	D170-M241 WeakPolarHBondContact O-CG 3.46Å; L171-M241 HydrophobicContact CD2-CB 4.19Å; D238-M241 HydrophobicContact CB-CB 4.14Å; D238-M241 HydrophobicContact CB-CG 3.71Å; D238-M241 PolarHBondContact O-N 3.17Å; D238-M241 PolarHBondContact OD1-N 3.49Å; P239-M241 VanDerWaalsContact C-N 3.34Å; M241-N244 PolarHBondContact O-N 3.12Å; M241-A245 VanDerWaalsContact O-CB 3.29Å; M241-A245 WeakPolarHBondContact O-CB 3.3Å; M241-A245 PolarHBondContact O-N 3.2Å
242	L	98.4	Very high	97.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.1	-46	179.1	-176.2	63.7	0	0	0	112	V92 M154 I157 L171 F237 D238 P239 N244 A245 F246 L460	V92-L242 HydrophobicContact CG2-CD2 3.92Å; V92-L242 HydrophobicContact CG2-CG 3.94Å; M154-L242 HydrophobicContact CG-CD1 4.3Å; M154-L242 HydrophobicContact SD-CD1 4.3Å; M154-L242 HydrophobicContact SD-CD2 3.93Å; I157-L242 HydrophobicContact CD1-CD1 3.87Å; L171-L242 HydrophobicContact CD2-CB 3.85Å; L171-L242 HydrophobicContact CD2-CD1 4.08Å; F237-L242 HydrophobicContact CD2-CB 4.22Å; F237-L242 HydrophobicContact CE2-CB 3.76Å; F237-L242 HydrophobicContact CE2-CD2 3.48Å; F237-L242 VanDerWaalsContact CE2-CD2 3.48Å; F237-L242 HydrophobicContact CE2-CG 4.23Å; F237-L242 HydrophobicContact CZ-CD2 3.74Å; D238-L242 PolarHBondContact O-N 3.33Å; P239-L242 PolarHBondContact O-N 3Å; L242-N244 PolarHBondContact O-N 3.09Å; L242-A245 PolarHBondContact O-N 3.09Å; L242-F246 HydrophobicContact CD1-CD2 3.91Å; L242-F246 HydrophobicContact CD1-CE2 3.6Å; L242-F246 HydrophobicContact CD2-CE2 4.38Å; L242-F246 HydrophobicContact CG-CD2 3.99Å; L242-F246 HydrophobicContact CG-CE2 3.91Å; L242-F246 WeakPolarHBondContact O-CD2 3.46Å; L242-F246 PolarHBondContact O-N 3.45Å; L242-F246 VanDerWaalsContact O-N 3.08Å; L242-L460 HydrophobicContact CD2-CD1 4.14Å
243	L	98.4	Very high	97.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-55.2	-51.4	176.8	173.5	61.1	0	0	0	111.5	V92 Y122 T127 V128 P239 W240 F246 R247	V92-L243 HydrophobicContact CB-CD1 4.38Å; Y122-L243 HydrophobicContact CD1-CD2 3.82Å; Y122-L243 HydrophobicContact CD2-CD2 4.29Å; Y122-L243 HydrophobicContact CE1-CD1 4.48Å; Y122-L243 HydrophobicContact CE1-CD2 3.99Å; Y122-L243 HydrophobicContact CE2-CD2 4.41Å; Y122-L243 HydrophobicContact CG-CD2 3.97Å; T127-L243 HydrophobicContact CG2-CB 3.94Å; T127-L243 HydrophobicContact CG2-CD1 4.42Å; T127-L243 HydrophobicContact CG2-CD2 4.07Å; T127-L243 HydrophobicContact CG2-CG 4.37Å; V128-L243 HydrophobicContact CG1-CD2 3.82Å; P239-L243 WeakPolarHBondContact O-CB 3.49Å; P239-L243 PolarHBondContact O-N 3.44Å; W240-L243 HydrophobicContact CE3-CD2 4.09Å; W240-L243 HydrophobicContact CZ3-CD2 4.16Å; L243-F246 PolarHBondContact O-N 2.66Å; L243-R247 WeakPolarHBondContact O-CB 3.39Å; L243-R247 PolarHBondContact O-N 3.32Å
244	N	97.8	Very high	97.6	Very high	29 Å²	29	33.9 Å²	33.9	16%	0.155	17%	0.169	C	C	.	.	H	α-helix	trans	-70.3	-33.8	-177.7	-78.5	-44.9	0	0	0	112.7	W240 M241 L242 R247 R248	W240-N244 VanDerWaalsContact CZ2-ND2 3.32Å; W240-N244 WeakPolarHBondContact CZ2-ND2 3.43Å; W240-N244 PolarHBondContact NE1-ND2 3.32Å; W240-N244 VanDerWaalsContact NE1-ND2 3.14Å; W240-N244 WeakPolarHBondContact O-CB 3.41Å; W240-N244 PolarHBondContact O-N 3.22Å; W240-N244 PolarHBondContact O-ND2 3.45Å; W240-N244 VanDerWaalsContact O-ND2 3.15Å; M241-N244 PolarHBondContact O-N 3.12Å; L242-N244 PolarHBondContact O-N 3.09Å; N244-R247 PolarHBondContact O-N 2.77Å; N244-R248 VanDerWaalsContact O-CB 3.27Å; N244-R248 WeakPolarHBondContact O-CB 3.46Å; N244-R248 VanDerWaalsContact O-CG 3.23Å; N244-R248 WeakPolarHBondContact O-CG 3.32Å; N244-R248 PolarHBondContact O-N 3.35Å
245	A	98.5	Very high	97.7	Very high	7 Å²	7	34.1 Å²	34.1	6%	0.058	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-49.3	173.7	0	0	0	0	0	110.9	I157 L161 V169 M241 L242 K249	I157-A245 HydrophobicContact CD1-CB 4.5Å; L161-A245 HydrophobicContact CB-CB 4.19Å; L161-A245 HydrophobicContact CD1-CB 3.75Å; V169-A245 HydrophobicContact CG1-CB 3.66Å; V169-A245 HydrophobicContact CG2-CB 3.97Å; M241-A245 VanDerWaalsContact O-CB 3.29Å; M241-A245 WeakPolarHBondContact O-CB 3.3Å; M241-A245 PolarHBondContact O-N 3.2Å; L242-A245 PolarHBondContact O-N 3.09Å; A245-K249 VanDerWaalsContact O-CB 3.24Å; A245-K249 WeakPolarHBondContact O-CB 3.48Å; A245-K249 PolarHBondContact O-N 3.39Å
246	F	98.8	Very high	97.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-48.6	175.5	-85	-63.1	0	0	0	112	V92 W95 Y99 F153 L161 L242 L243 K249 A250 P464	V92-F246 HydrophobicContact CG2-CD2 3.93Å; V92-F246 HydrophobicContact CG2-CE2 4.25Å; W95-F246 HydrophobicContact CB-CB 3.81Å; Y99-F246 HydrophobicContact CD1-CD1 4.03Å; Y99-F246 AromaticContact CD1-CE1 3.72Å; Y99-F246 HydrophobicContact CD1-CE1 3.72Å; Y99-F246 HydrophobicContact CE1-CE1 4.35Å; Y99-F246 HydrophobicContact CG-CD1 4.02Å; Y99-F246 HydrophobicContact CG-CE1 4.2Å; F153-F246 HydrophobicContact CD1-CZ 4.27Å; F153-F246 AromaticContact CE1-CE1 3.85Å; F153-F246 HydrophobicContact CE1-CE1 3.85Å; F153-F246 HydrophobicContact CE1-CE2 4.26Å; F153-F246 AromaticContact CE1-CZ 3.43Å; F153-F246 HydrophobicContact CE1-CZ 3.43Å; F153-F246 VanDerWaalsContact CE1-CZ 3.43Å; F153-F246 AromaticContact CZ-CE1 3.59Å; F153-F246 HydrophobicContact CZ-CE1 3.59Å; F153-F246 AromaticContact CZ-CZ 3.65Å; F153-F246 HydrophobicContact CZ-CZ 3.65Å; L161-F246 HydrophobicContact CD1-CD1 3.77Å; L161-F246 HydrophobicContact CD1-CD2 4.14Å; L161-F246 HydrophobicContact CD1-CE1 3.91Å; L161-F246 HydrophobicContact CD1-CE2 4.27Å; L161-F246 HydrophobicContact CD1-CG 3.89Å; L161-F246 HydrophobicContact CD1-CZ 4.15Å; L161-F246 HydrophobicContact CD2-CD1 3.66Å; L161-F246 HydrophobicContact CD2-CE1 3.88Å; L161-F246 HydrophobicContact CD2-CG 4.44Å; L161-F246 HydrophobicContact CG-CD1 4.39Å; L161-F246 HydrophobicContact CG-CE1 4.45Å; L242-F246 HydrophobicContact CD1-CD2 3.91Å; L242-F246 HydrophobicContact CD1-CE2 3.6Å; L242-F246 HydrophobicContact CD2-CE2 4.38Å; L242-F246 HydrophobicContact CG-CD2 3.99Å; L242-F246 HydrophobicContact CG-CE2 3.91Å; L242-F246 WeakPolarHBondContact O-CD2 3.46Å; L242-F246 PolarHBondContact O-N 3.45Å; L242-F246 VanDerWaalsContact O-N 3.08Å; L243-F246 PolarHBondContact O-N 2.66Å; F246-K249 PolarHBondContact O-N 3.4Å; F246-A250 WeakPolarHBondContact O-CB 2.98Å; F246-A250 PolarHBondContact O-N 3.2Å; F246-P464 HydrophobicContact CE2-CG 4.15Å; F246-P464 HydrophobicContact CZ-CB 4.01Å; F246-P464 HydrophobicContact CZ-CG 4.05Å
247	R	98.4	Very high	97.7	Very high	52 Å²	52	40.4 Å²	40.4	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-58	-53	-179.5	174.4	177.3	169.2	-150.3	-1.1	111.9	W95 L243 N244 K249 A250 I251 Q257	W95-R247 HydrophobicContact CD2-CB 3.75Å; W95-R247 HydrophobicContact CD2-CG 3.96Å; W95-R247 HydrophobicContact CE3-CB 4.26Å; W95-R247 HydrophobicContact CE3-CG 4.33Å; W95-R247 HydrophobicContact CG-CB 3.9Å; W95-R247 HydrophobicContact CH2-CG 4.11Å; W95-R247 HydrophobicContact CZ2-CB 4.43Å; W95-R247 HydrophobicContact CZ2-CG 3.71Å; W95-R247 HydrophobicContact CZ3-CG 4.39Å; L243-R247 WeakPolarHBondContact O-CB 3.39Å; L243-R247 PolarHBondContact O-N 3.32Å; N244-R247 PolarHBondContact O-N 2.77Å; R247-K249 PolarHBondContact O-N 2.66Å; R247-A250 PolarHBondContact O-N 2.92Å; R247-I251 HydrophobicContact CG-CD1 3.71Å; R247-I251 WeakPolarHBondContact O-CB 3.44Å; R247-I251 VanDerWaalsContact O-CG1 3.25Å; R247-I251 WeakPolarHBondContact O-CG1 3.42Å; R247-I251 PolarHBondContact O-N 3.45Å; R247-Q257 VanDerWaalsContact CZ-NE2 3.32Å
248	R	98.1	Very high	97.7	Very high	125 Å²	125	40.3 Å²	40.3	47%	0.472	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-45.9	-179.7	-72.2	171.6	69.9	172.5	10.1	110.9	V163 D166 N244 I251 S252	V163-R248 HydrophobicContact CG2-CB 4.49Å; D166-R248 IonicContact OD1-NH2 3.82Å; D166-R248 PolarHBondContact OD1-NH2 3.24Å; D166-R248 IonicContact OD2-CZ 3.85Å; D166-R248 IonicContact OD2-NE 2.94Å; D166-R248 PolarHBondContact OD2-NE 3.04Å; D166-R248 IonicContact OD2-NH2 3.66Å; D166-R248 PolarHBondContact OD2-NH2 3.34Å; N244-R248 VanDerWaalsContact O-CB 3.27Å; N244-R248 WeakPolarHBondContact O-CB 3.46Å; N244-R248 VanDerWaalsContact O-CG 3.23Å; N244-R248 WeakPolarHBondContact O-CG 3.32Å; N244-R248 PolarHBondContact O-N 3.35Å; R248-I251 PolarHBondContact O-N 2.92Å; R248-S252 WeakPolarHBondContact O-CB 3.18Å; R248-S252 PolarHBondContact O-N 2.76Å
249	K	98.6	Very high	97.7	Very high	39 Å²	39	40.3 Å²	40.3	17%	0.17	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-50.3	178.1	-177.1	63.6	173.3	-173.2	0	111.6	Y99 H160 L161 S162 V163 A245 F246 R247 I251 S252 M253	Y99-K249 HydrophobicContact CD2-CB 4.39Å; Y99-K249 HydrophobicContact CD2-CG 3.6Å; Y99-K249 HydrophobicContact CE2-CG 3.69Å; H160-K249 VanDerWaalsContact O-CE 3.24Å; H160-K249 WeakPolarHBondContact O-CE 3.42Å; L161-K249 HydrophobicContact CB-CB 4.35Å; L161-K249 HydrophobicContact CD2-CB 3.87Å; L161-K249 HydrophobicContact CD2-CG 3.86Å; S162-K249 WeakPolarHBondContact O-CD 3.04Å; S162-K249 PolarHBondContact O-NZ 3.5Å; V163-K249 HydrophobicContact CG2-CB 4.38Å; V163-K249 HydrophobicContact CG2-CD 4.09Å; A245-K249 VanDerWaalsContact O-CB 3.24Å; A245-K249 WeakPolarHBondContact O-CB 3.48Å; A245-K249 PolarHBondContact O-N 3.39Å; F246-K249 PolarHBondContact O-N 3.4Å; R247-K249 PolarHBondContact O-N 2.66Å; K249-I251 VanDerWaalsContact C-N 3.35Å; K249-I251 PolarHBondContact O-N 2.9Å; K249-S252 WeakPolarHBondContact O-CB 3.38Å; K249-S252 PolarHBondContact O-N 3Å; K249-S252 VanDerWaalsContact O-N 3.14Å; K249-S252 PolarHBondContact O-OG 3.36Å; K249-M253 HydrophobicContact CD-SD 4.31Å; K249-M253 HydrophobicContact CG-SD 4.01Å; K249-M253 VanDerWaalsContact O-CG 3.32Å; K249-M253 WeakPolarHBondContact O-CG 3.42Å; K249-M253 PolarHBondContact O-N 3.13Å; K249-M253 VanDerWaalsContact O-N 3.13Å
250	A	98.4	Very high	97.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-44.2	179.1	0	0	0	0	0	111.9	W95 A98 F246 R247 S252 M253 G254 V255	W95-A250 HydrophobicContact CE3-CB 3.83Å; W95-A250 HydrophobicContact CZ3-CB 4.12Å; A98-A250 HydrophobicContact CB-CB 4.36Å; F246-A250 WeakPolarHBondContact O-CB 2.98Å; F246-A250 PolarHBondContact O-N 3.2Å; R247-A250 PolarHBondContact O-N 2.92Å; A250-S252 VanDerWaalsContact C-N 3.35Å; A250-S252 PolarHBondContact O-N 3.15Å; A250-M253 CarbonylContact O-C 3.59Å; A250-M253 WeakPolarHBondContact O-CA 3.4Å; A250-M253 WeakPolarHBondContact O-CB 3.02Å; A250-M253 PolarHBondContact O-N 2.92Å; A250-M253 VanDerWaalsContact O-N 3.08Å; A250-G254 PolarHBondContact O-N 3.31Å; A250-V255 HydrophobicContact CB-CB 4.2Å; A250-V255 HydrophobicContact CB-CG2 3.9Å; A250-V255 WeakPolarHBondContact O-CB 3.49Å; A250-V255 VanDerWaalsContact O-CG2 3.3Å; A250-V255 WeakPolarHBondContact O-CG2 3.4Å; A250-V255 PolarHBondContact O-N 3.08Å; A250-V255 VanDerWaalsContact O-N 3.12Å
251	I	97.4	Very high	97.6	Very high	68 Å²	68	39.5 Å²	39.5	35%	0.349	19%	0.194	S	C	.	.	H	α-helix	trans	-61.8	-42.5	175.3	-69.2	169	0	0	0	111	W95 R247 R248 K249 M253 G254 Q257	W95-I251 HydrophobicContact CH2-CD1 4.16Å; W95-I251 HydrophobicContact CH2-CG1 4.07Å; W95-I251 HydrophobicContact CZ3-CG1 4.06Å; R247-I251 HydrophobicContact CG-CD1 3.71Å; R247-I251 WeakPolarHBondContact O-CB 3.44Å; R247-I251 VanDerWaalsContact O-CG1 3.25Å; R247-I251 WeakPolarHBondContact O-CG1 3.42Å; R247-I251 PolarHBondContact O-N 3.45Å; R248-I251 PolarHBondContact O-N 2.92Å; K249-I251 VanDerWaalsContact C-N 3.35Å; K249-I251 PolarHBondContact O-N 2.9Å; I251-M253 PolarHBondContact O-N 2.8Å; I251-M253 VanDerWaalsContact O-N 3.14Å; I251-G254 PolarHBondContact O-N 3.22Å; I251-Q257 HydrophobicContact CD1-CB 4.42Å
252	S	96.8	Very high	97.6	Very high	64 Å²	64	36.7 Å²	36.7	45%	0.448	18%	0.181	S	C	.	.	H	α-helix	trans	-61.6	-22	176.1	81.3	0	0	0	0	113.3	R248 K249 A250	R248-S252 WeakPolarHBondContact O-CB 3.18Å; R248-S252 PolarHBondContact O-N 2.76Å; K249-S252 WeakPolarHBondContact O-CB 3.38Å; K249-S252 PolarHBondContact O-N 3Å; K249-S252 VanDerWaalsContact O-N 3.14Å; K249-S252 PolarHBondContact O-OG 3.36Å; A250-S252 VanDerWaalsContact C-N 3.35Å; A250-S252 PolarHBondContact O-N 3.15Å
253	M	96.9	Very high	97.6	Very high	38 Å²	38	39.6 Å²	39.6	19%	0.187	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2	175.9	-61.7	169.7	80.5	0	0	112.8	Y99 K102 Q103 K249 A250 I251	Y99-M253 HydrophobicContact CD2-SD 3.81Å; Y99-M253 HydrophobicContact CE2-SD 4.06Å; K102-M253 HydrophobicContact CB-CB 3.95Å; K102-M253 HydrophobicContact CB-CE 3.7Å; K102-M253 HydrophobicContact CB-SD 4.25Å; K102-M253 WeakPolarHBondContact CE-O 3.26Å; K102-M253 HydrophobicContact CG-CB 4.32Å; Q103-M253 HydrophobicContact CB-CE 4.15Å; K249-M253 HydrophobicContact CD-SD 4.31Å; K249-M253 HydrophobicContact CG-SD 4.01Å; K249-M253 VanDerWaalsContact O-CG 3.32Å; K249-M253 WeakPolarHBondContact O-CG 3.42Å; K249-M253 PolarHBondContact O-N 3.13Å; K249-M253 VanDerWaalsContact O-N 3.13Å; A250-M253 CarbonylContact O-C 3.59Å; A250-M253 WeakPolarHBondContact O-CA 3.4Å; A250-M253 WeakPolarHBondContact O-CB 3.02Å; A250-M253 PolarHBondContact O-N 2.92Å; A250-M253 VanDerWaalsContact O-N 3.08Å; I251-M253 PolarHBondContact O-N 2.8Å; I251-M253 VanDerWaalsContact O-N 3.14Å
254	G	96	Very high	97.5	Very high	34 Å²	34	40.1 Å²	40.1	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	16.8	176.1	0	0	0	0	0	115.3	A250 I251	A250-G254 PolarHBondContact O-N 3.31Å; I251-G254 PolarHBondContact O-N 3.22Å
255	V	98.3	Very high	97.6	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.042	20%	0.2	C	C	.	.			trans	-69.2	132.8	169.8	177.5	0	0	0	0	110.1	W95 A98 K102 V113 V115 A250	W95-V255 HydrophobicContact CZ3-CB 4.42Å; W95-V255 HydrophobicContact CZ3-CG1 3.77Å; A98-V255 HydrophobicContact CB-CG1 4.04Å; A98-V255 HydrophobicContact CB-CG2 4.14Å; K102-V255 HydrophobicContact CD-CG2 4.22Å; K102-V255 HydrophobicContact CG-CG2 3.48Å; K102-V255 VanDerWaalsContact CG-CG2 3.48Å; V113-V255 HydrophobicContact CB-CG1 4.31Å; V113-V255 HydrophobicContact CB-CG2 4.23Å; V113-V255 HydrophobicContact CG1-CG1 4.18Å; V115-V255 HydrophobicContact CG2-CG1 3.87Å; A250-V255 HydrophobicContact CB-CB 4.2Å; A250-V255 HydrophobicContact CB-CG2 3.9Å; A250-V255 WeakPolarHBondContact O-CB 3.49Å; A250-V255 VanDerWaalsContact O-CG2 3.3Å; A250-V255 WeakPolarHBondContact O-CG2 3.4Å; A250-V255 PolarHBondContact O-N 3.08Å; A250-V255 VanDerWaalsContact O-N 3.12Å
256	Y	97.9	Very high	97.5	Very high	110 Å²	110	41.4 Å²	41.4	43%	0.431	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	134.4	173.3	-61.1	-77.8	0	0	0	110.5	P80 R112 V113 L114 V115	P80-Y256 HydrophobicContact CG-CD2 4.25Å; P80-Y256 HydrophobicContact CG-CG 4.22Å; R112-Y256 HydrophobicContact CB-CE2 4.22Å; R112-Y256 HydrophobicContact CG-CE2 4.31Å; V113-Y256 PolarHBondContact O-N 2.9Å; L114-Y256 WeakPolarHBondContact CA-O 3.39Å; V115-Y256 PolarHBondContact N-O 2.93Å
257	Q	97.3	Very high	97.5	Very high	40 Å²	40	45.9 Å²	45.9	19%	0.187	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.3	170.1	-177	167.3	33.9	0	0	109.5	W95 R247 I251 F259	W95-Q257 HydrophobicContact CH2-CB 3.95Å; W95-Q257 HydrophobicContact CH2-CG 4.06Å; W95-Q257 HydrophobicContact CZ2-CB 4.43Å; W95-Q257 HydrophobicContact CZ2-CG 4.03Å; R247-Q257 VanDerWaalsContact CZ-NE2 3.32Å; I251-Q257 HydrophobicContact CD1-CB 4.42Å; Q257-F259 VanDerWaalsContact CD-CZ 3.47Å; Q257-F259 HydrophobicContact CG-CE1 4.47Å; Q257-F259 HydrophobicContact CG-CE2 4.37Å; Q257-F259 HydrophobicContact CG-CZ 4.28Å
258	C	96.7	Very high	97.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.3	168	178.1	0	0	0	0	110	P79 L114 V115 V116 E117	P79-C258 HydrophobicContact CB-CB 4.13Å; L114-C258 HydrophobicContact CD1-CB 3.8Å; V115-C258 PolarHBondContact O-N 3.08Å; V116-C258 WeakPolarHBondContact CA-O 3.4Å; V116-C258 HydrophobicContact CG2-CB 4.46Å; E117-C258 PolarHBondContact N-O 3.02Å
259	F	95.8	Very high	97.3	Very high	56 Å²	56	44.1 Å²	44.1	25%	0.246	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	97.7	170.4	-65	-62.5	0	0	0	109.6	E117 P120 Q257 M292 P293	E117-F259 HydrophobicContact CB-CD1 4.26Å; E117-F259 HydrophobicContact CG-CD1 4.47Å; E117-F259 CarbonylContact O-C 3.57Å; E117-F259 WeakPolarHBondContact O-CA 3.44Å; P120-F259 VanDerWaalsContact CA-CE1 3.48Å; P120-F259 HydrophobicContact CB-CB 4.35Å; P120-F259 HydrophobicContact CB-CD1 3.57Å; P120-F259 HydrophobicContact CB-CD2 4.17Å; P120-F259 HydrophobicContact CB-CE1 3.72Å; P120-F259 HydrophobicContact CB-CE2 4.29Å; P120-F259 HydrophobicContact CB-CG 3.79Å; P120-F259 HydrophobicContact CB-CZ 4.04Å; Q257-F259 VanDerWaalsContact CD-CZ 3.47Å; Q257-F259 HydrophobicContact CG-CE1 4.47Å; Q257-F259 HydrophobicContact CG-CE2 4.37Å; Q257-F259 HydrophobicContact CG-CZ 4.28Å; F259-M292 VanDerWaalsContact O-CE 3.29Å; F259-M292 WeakPolarHBondContact O-CE 3.47Å; F259-P293 WeakPolarHBondContact O-CD 3.43Å
260	G	95.7	Very high	97.1	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.031	26%	0.258	C	S	.	.	S	Bend	trans	-170	170.6	-174.6	0	0	0	0	0	111.2	V116 E117 R118 Q291	V116-G260 WeakPolarHBondContact CG1-O 3.2Å; E117-G260 CarbonylContact C-O 3.59Å; E117-G260 VanDerWaalsContact C-O 3.23Å; E117-G260 PolarHBondContact O-N 3.5Å; R118-G260 VanDerWaalsContact CA-O 3.25Å; R118-G260 WeakPolarHBondContact CA-O 3.34Å; R118-G260 PolarHBondContact N-O 3.04Å; G260-Q291 CarbonylContact C-O 3.54Å; G260-Q291 WeakPolarHBondContact CA-O 3.41Å
261	E	97.3	Very high	96.9	Very high	90 Å²	90	50.6 Å²	50.6	42%	0.421	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.9	-179	-178	168.3	-156.1	0	0	110.3	R118 T263 V290 Q291	R118-E261 HydrophobicContact CB-CB 4.14Å; E261-T263 HydrophobicContact CB-CG2 4.38Å; E261-T263 HydrophobicContact CG-CG2 4.03Å; E261-T263 PolarHBondContact O-N 3.49Å; E261-V290 CarbonylContact O-C 3.54Å; E261-V290 WeakPolarHBondContact O-CA 3.4Å; E261-Q291 PolarHBondContact N-O 3.18Å; E261-Q291 WeakPolarHBondContact O-CB 3.35Å; E261-Q291 PolarHBondContact O-N 3.17Å
262	V	98.4	Very high	96.5	Very high	8 Å²	8	52.4 Å²	52.4	5%	0.048	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	114.2	168.6	179	0	0	0	0	108.1	V88 V116 F265 N289 V290 M320	V88-V262 HydrophobicContact CB-CG2 4.44Å; V88-V262 HydrophobicContact CG1-CB 3.86Å; V88-V262 HydrophobicContact CG1-CG2 3.84Å; V88-V262 HydrophobicContact CG2-CB 4.39Å; V88-V262 HydrophobicContact CG2-CG1 4.44Å; V88-V262 HydrophobicContact CG2-CG2 3.96Å; V116-V262 HydrophobicContact CB-CG2 4.11Å; V116-V262 HydrophobicContact CG1-CG2 3.84Å; V116-V262 HydrophobicContact CG2-CG2 4.37Å; V262-F265 HydrophobicContact CG1-CE1 3.86Å; V262-F265 HydrophobicContact CG1-CE2 4.26Å; V262-F265 HydrophobicContact CG1-CZ 3.67Å; V262-N289 WeakPolarHBondContact CA-O 3.48Å; V262-V290 HydrophobicContact CG2-CG2 4.36Å; V262-M320 WeakPolarHBondContact O-CE 3.45Å
263	T	97.4	Very high	96.2	Very high	60 Å²	60	53.8 Å²	53.8	37%	0.368	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-7.1	-175.6	54	0	0	0	0	113.3	E261 N289 Q291	E261-T263 HydrophobicContact CB-CG2 4.38Å; E261-T263 HydrophobicContact CG-CG2 4.03Å; E261-T263 PolarHBondContact O-N 3.49Å; T263-N289 PolarHBondContact N-O 3.47Å; T263-Q291 HydrophobicContact CG2-CB 3.56Å; T263-Q291 HydrophobicContact CG2-CG 4.32Å
264	G	97.8	Very high	95.7	Very high	11 Å²	11	54.2 Å²	54.2	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.9	-177.8	176.3	0	0	0	0	0	113.4	N289	G264-N289 WeakPolarHBondContact O-CB 3.39Å; G264-N289 PolarHBondContact O-N 2.94Å
265	F	98.3	Very high	95.3	Very high	16 Å²	16	57.6 Å²	57.6	7%	0.07	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	143.8	-178.8	-59.5	-81.1	0	0	0	110.8	V88 V262 I285 Y287 A288 V306 V317 M320 M321	V88-F265 HydrophobicContact CG2-CZ 4.36Å; V262-F265 HydrophobicContact CG1-CE1 3.86Å; V262-F265 HydrophobicContact CG1-CE2 4.26Å; V262-F265 HydrophobicContact CG1-CZ 3.67Å; F265-I285 HydrophobicContact CB-CG2 4.26Å; F265-I285 HydrophobicContact CD1-CD1 4.07Å; F265-I285 HydrophobicContact CD1-CG2 3.83Å; F265-I285 HydrophobicContact CE1-CD1 4.38Å; F265-I285 HydrophobicContact CG-CD1 4.31Å; F265-I285 HydrophobicContact CG-CG2 4.41Å; F265-Y287 VanDerWaalsContact CA-O 3.3Å; F265-Y287 WeakPolarHBondContact CA-O 3.5Å; F265-A288 HydrophobicContact CD1-CB 4.02Å; F265-A288 HydrophobicContact CE1-CB 3.93Å; F265-V306 HydrophobicContact CD1-CG2 4.42Å; F265-V306 HydrophobicContact CE1-CG1 3.83Å; F265-V306 HydrophobicContact CE1-CG2 4.03Å; F265-V306 HydrophobicContact CZ-CG1 4.09Å; F265-V317 HydrophobicContact CE2-CG1 4.12Å; F265-V317 HydrophobicContact CZ-CG1 4.08Å; F265-M320 HydrophobicContact CD2-CB 4.1Å; F265-M320 HydrophobicContact CE2-CB 4.19Å; F265-M321 HydrophobicContact CB-CG 4.37Å; F265-M321 HydrophobicContact CB-SD 3.37Å; F265-M321 WeakPolarHBondContact CB-SD 3.37Å; F265-M321 HydrophobicContact CD2-CG 3.53Å; F265-M321 HydrophobicContact CD2-SD 3.71Å; F265-M321 HydrophobicContact CE2-CG 4.04Å; F265-M321 HydrophobicContact CG-CG 4.09Å; F265-M321 HydrophobicContact CG-SD 3.7Å
266	S	97.9	Very high	94.7	Very high	48 Å²	48	64.3 Å²	64.3	34%	0.336	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.3	165.9	-57.9	0	0	0	0	109.1	K286 Y287	S266-K286 PolarHBondContact O-N 2.91Å; S266-Y287 PolarHBondContact N-O 2.73Å; S266-Y287 PolarHBondContact O-N 3.36Å; S266-Y287 VanDerWaalsContact O-N 3.12Å
267	Y	97.3	Very high	94.2	Very high	94 Å²	94	61.4 Å²	61.4	37%	0.369	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	162	-173.7	58.8	-94.6	0	0	0	112.7	R283 R284 M321	Y267-R283 HydrophobicContact CD2-CB 4Å; Y267-R283 HydrophobicContact CD2-CG 3.84Å; Y267-R283 HydrophobicContact CE2-CB 4.5Å; Y267-R283 HydrophobicContact CE2-CG 3.87Å; Y267-R283 HydrophobicContact CG-CB 4.48Å; Y267-R284 CarbonylContact C-O 3.46Å; Y267-R284 WeakPolarHBondContact CA-O 3.44Å; Y267-R284 VanDerWaalsContact CB-O 3.24Å; Y267-R284 WeakPolarHBondContact CB-O 3.37Å; Y267-M321 HydrophobicContact CD1-CE 3.51Å; Y267-M321 HydrophobicContact CD1-SD 3.69Å; Y267-M321 HydrophobicContact CD2-CE 4.4Å; Y267-M321 HydrophobicContact CE1-CE 4.03Å; Y267-M321 HydrophobicContact CE1-SD 4.22Å; Y267-M321 HydrophobicContact CG-CE 3.72Å; Y267-M321 HydrophobicContact CG-SD 4.4Å
268	T	97.3	Very high	93.6	Very high	68 Å²	68	64.4 Å²	64.4	42%	0.417	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	143.1	168.2	53.6	0	0	0	0	109.9	R283 R284 K286	T268-R283 CarbonylContact O-C 3.52Å; T268-R283 WeakPolarHBondContact O-CA 3.32Å; T268-R284 PolarHBondContact N-O 3.45Å; T268-R284 PolarHBondContact O-N 3.16Å; T268-K286 HydrophobicContact CG2-CG 4.13Å; T268-K286 WeakPolarHBondContact OG1-CE 3.29Å
269	T	96.1	Very high	93.2	Very high	71 Å²	71	72.6 Å²	72.6	44%	0.436	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	135.3	174.8	-56	0	0	0	0	110.1	D281 F282	T269-D281 HydrophobicContact CG2-CB 3.76Å; T269-F282 CarbonylContact C-O 3.25Å; T269-F282 WeakPolarHBondContact CA-O 3.38Å
270	N	94.4	Very high	92.9	Very high	106 Å²	106	71.6 Å²	71.6	57%	0.567	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.1	170.1	-169.8	14.4	0	0	0	109.4	F282	N270-F282 PolarHBondContact N-O 3.38Å; N270-F282 PolarHBondContact O-N 3.24Å
271	T	93.4	Very high	92.7	Very high	69 Å²	69	74.8 Å²	74.8	42%	0.423	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.3	-179.8	-51.7	0	0	0	0	109.7	K279 V280 D281	T271-K279 HydrophobicContact CG2-CB 3.87Å; T271-K279 HydrophobicContact CG2-CD 4.21Å; T271-K279 HydrophobicContact CG2-CG 4.16Å; T271-V280 WeakPolarHBondContact CA-O 3.34Å; T271-D281 VanDerWaalsContact CB-OD1 3.31Å; T271-D281 WeakPolarHBondContact CB-OD1 3.19Å; T271-D281 WeakPolarHBondContact CG2-OD1 3.46Å; T271-D281 PolarHBondContact OG1-OD1 3.49Å
272	M	90.1	Very high	92.5	Very high	106 Å²	106	73 Å²	73	52%	0.522	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	153.9	171.5	-60	-170.6	74.2	0	0	110.1	K279 V280 F282	M272-K279 CarbonylContact O-C 3.56Å; M272-K279 WeakPolarHBondContact O-CA 3.42Å; M272-V280 PolarHBondContact N-O 2.98Å; M272-V280 PolarHBondContact O-N 3.18Å; M272-F282 HydrophobicContact CB-CD2 4.35Å; M272-F282 HydrophobicContact CB-CE2 4.03Å; M272-F282 HydrophobicContact CG-CD2 3.94Å; M272-F282 HydrophobicContact CG-CE2 3.97Å; M272-F282 HydrophobicContact SD-CD2 3.99Å; M272-F282 HydrophobicContact SD-CE2 3.78Å
273	T	90.5	Very high	92.4	Very high	94 Å²	94	75.4 Å²	75.4	58%	0.577	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	128.5	173.9	-51.3	0	0	0	0	108.8	D278	T273-D278 CarbonylContact C-O 3.56Å; T273-D278 VanDerWaalsContact CA-O 3.25Å; T273-D278 WeakPolarHBondContact CA-O 3.32Å
274	T	85.3	Confident	92.4	Very high	47 Å²	47	77 Å²	77	29%	0.288	42%	0.423	S	S	.	.			trans	-70	171.2	174.2	72.5	0	0	0	0	111	E276 G277 D278 V280	T274-E276 VanDerWaalsContact CB-OE2 3.24Å; T274-E276 WeakPolarHBondContact CB-OE2 3.46Å; T274-E276 PolarHBondContact O-N 3.34Å; T274-E276 PolarHBondContact OG1-N 3.08Å; T274-E276 PolarHBondContact OG1-OE2 2.9Å; T274-G277 PolarHBondContact O-N 2.6Å; T274-G277 VanDerWaalsContact O-N 3.08Å; T274-D278 HydrophobicContact CG2-CB 4.19Å; T274-D278 PolarHBondContact N-O 2.86Å; T274-D278 PolarHBondContact OG1-N 2.89Å; T274-V280 HydrophobicContact CG2-CG2 3.62Å
275	A	87.3	Confident	92.4	Very high	104 Å²	104	76.5 Å²	76.5	86%	0.86	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-28	175.6	0	0	0	0	0	112	G277	A275-G277 VanDerWaalsContact C-N 3.29Å
276	E	86.7	Confident	92.4	Very high	149 Å²	149	79.5 Å²	79.5	70%	0.696	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-4.9	178.4	-56.4	74.1	-155.4	0	0	113.2	T274	T274-E276 VanDerWaalsContact CB-OE2 3.24Å; T274-E276 WeakPolarHBondContact CB-OE2 3.46Å; T274-E276 PolarHBondContact O-N 3.34Å; T274-E276 PolarHBondContact OG1-N 3.08Å; T274-E276 PolarHBondContact OG1-OE2 2.9Å
277	G	87	Confident	92.5	Very high	49 Å²	49	81.7 Å²	81.7	51%	0.505	43%	0.432	S	S	.	.	S	Bend	trans	92.5	1	-180	0	0	0	0	0	114.9	T274 A275	T274-G277 PolarHBondContact O-N 2.6Å; T274-G277 VanDerWaalsContact O-N 3.08Å; A275-G277 VanDerWaalsContact C-N 3.29Å
278	D	85.3	Confident	92.5	Very high	103 Å²	103	77.2 Å²	77.2	55%	0.551	41%	0.414	S	S	*	.			trans	-75.3	141.9	179.9	-66.1	-40.7	0	0	0	111.4	T273 T274	T273-D278 CarbonylContact C-O 3.56Å; T273-D278 VanDerWaalsContact CA-O 3.25Å; T273-D278 WeakPolarHBondContact CA-O 3.32Å; T274-D278 HydrophobicContact CG2-CB 4.19Å; T274-D278 PolarHBondContact N-O 2.86Å; T274-D278 PolarHBondContact OG1-N 2.89Å
279	K	88.1	Confident	92.6	Very high	172 Å²	172	74.8 Å²	74.8	75%	0.748	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.1	175.8	-69.3	-176.7	179.9	-178.9	0	110.5	T271 M272	T271-K279 HydrophobicContact CG2-CB 3.87Å; T271-K279 HydrophobicContact CG2-CD 4.21Å; T271-K279 HydrophobicContact CG2-CG 4.16Å; M272-K279 CarbonylContact O-C 3.56Å; M272-K279 WeakPolarHBondContact O-CA 3.42Å
280	V	88.9	Confident	92.7	Very high	35 Å²	35	71.4 Å²	71.4	21%	0.212	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.6	177.7	-178.4	0	0	0	0	109.5	T271 M272 T274 F282 L445	T271-V280 WeakPolarHBondContact CA-O 3.34Å; M272-V280 PolarHBondContact N-O 2.98Å; M272-V280 PolarHBondContact O-N 3.18Å; T274-V280 HydrophobicContact CG2-CG2 3.62Å; V280-F282 HydrophobicContact CB-CE2 4.28Å; V280-F282 HydrophobicContact CG1-CD2 4.43Å; V280-F282 HydrophobicContact CG1-CE2 3.88Å; V280-F282 HydrophobicContact CG1-CZ 3.94Å; V280-L445 HydrophobicContact CG1-CD2 3.46Å; V280-L445 VanDerWaalsContact CG1-CD2 3.46Å
281	D	91.8	Very high	92.8	Very high	70 Å²	70	68.7 Å²	68.7	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.7	178	-74.2	-17.6	0	0	0	110.9	T269 T271	T269-D281 HydrophobicContact CG2-CB 3.76Å; T271-D281 VanDerWaalsContact CB-OD1 3.31Å; T271-D281 WeakPolarHBondContact CB-OD1 3.19Å; T271-D281 WeakPolarHBondContact CG2-OD1 3.46Å; T271-D281 PolarHBondContact OG1-OD1 3.49Å
282	F	93.9	Very high	92.8	Very high	53 Å²	53	66.1 Å²	66.1	23%	0.232	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.8	170.1	-65.3	-83.5	0	0	0	110	T269 N270 M272 V280 L445 N447	T269-F282 CarbonylContact C-O 3.25Å; T269-F282 WeakPolarHBondContact CA-O 3.38Å; N270-F282 PolarHBondContact N-O 3.38Å; N270-F282 PolarHBondContact O-N 3.24Å; M272-F282 HydrophobicContact CB-CD2 4.35Å; M272-F282 HydrophobicContact CB-CE2 4.03Å; M272-F282 HydrophobicContact CG-CD2 3.94Å; M272-F282 HydrophobicContact CG-CE2 3.97Å; M272-F282 HydrophobicContact SD-CD2 3.99Å; M272-F282 HydrophobicContact SD-CE2 3.78Å; V280-F282 HydrophobicContact CB-CE2 4.28Å; V280-F282 HydrophobicContact CG1-CD2 4.43Å; V280-F282 HydrophobicContact CG1-CE2 3.88Å; V280-F282 HydrophobicContact CG1-CZ 3.94Å; F282-L445 WeakPolarHBondContact CA-O 3.37Å; F282-L445 HydrophobicContact CD1-CD2 4.37Å; F282-L445 HydrophobicContact CE1-CD2 4.09Å; F282-N447 VanDerWaalsContact CD1-OD1 3.31Å; F282-N447 WeakPolarHBondContact CD1-OD1 3.43Å
283	R	95.9	Very high	92.7	Very high	59 Å²	59	64.8 Å²	64.8	22%	0.223	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.5	177.9	-62.4	175.4	-176.2	158.6	5.5	110.2	Y267 T268 M321 L445 V446 N447	Y267-R283 HydrophobicContact CD2-CB 4Å; Y267-R283 HydrophobicContact CD2-CG 3.84Å; Y267-R283 HydrophobicContact CE2-CB 4.5Å; Y267-R283 HydrophobicContact CE2-CG 3.87Å; Y267-R283 HydrophobicContact CG-CB 4.48Å; T268-R283 CarbonylContact O-C 3.52Å; T268-R283 WeakPolarHBondContact O-CA 3.32Å; R283-M321 HydrophobicContact CB-CE 3.97Å; R283-M321 PolarHBondContact NH1-O 3.42Å; R283-L445 PolarHBondContact N-O 2.87Å; R283-V446 HydrophobicContact CB-CG2 4.31Å; R283-V446 WeakPolarHBondContact O-CA 3.44Å; R283-N447 PolarHBondContact O-N 3.36Å
284	R	97.3	Very high	92.5	Very high	94 Å²	94	68.8 Å²	68.8	36%	0.355	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.1	170.8	-179.7	174	-179.6	71.6	9.9	109.8	Y267 T268 A304 N448	Y267-R284 CarbonylContact C-O 3.46Å; Y267-R284 WeakPolarHBondContact CA-O 3.44Å; Y267-R284 VanDerWaalsContact CB-O 3.24Å; Y267-R284 WeakPolarHBondContact CB-O 3.37Å; T268-R284 PolarHBondContact N-O 3.45Å; T268-R284 PolarHBondContact O-N 3.16Å; R284-A304 PolarHBondContact NH2-O 3.36Å; R284-A304 VanDerWaalsContact NH2-O 3.11Å; R284-N448 WeakPolarHBondContact CA-OD1 3.26Å
285	I	98.5	Very high	92.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.6	176.1	-58.8	169.5	0	0	0	109.1	F265 V306 M321 V446 N448 M449	F265-I285 HydrophobicContact CB-CG2 4.26Å; F265-I285 HydrophobicContact CD1-CD1 4.07Å; F265-I285 HydrophobicContact CD1-CG2 3.83Å; F265-I285 HydrophobicContact CE1-CD1 4.38Å; F265-I285 HydrophobicContact CG-CD1 4.31Å; F265-I285 HydrophobicContact CG-CG2 4.41Å; I285-V306 HydrophobicContact CB-CG2 4.32Å; I285-V306 HydrophobicContact CD1-CB 3.92Å; I285-V306 HydrophobicContact CD1-CG2 3.74Å; I285-V306 HydrophobicContact CG2-CG2 3.87Å; I285-M321 HydrophobicContact CD1-CE 4.43Å; I285-M321 HydrophobicContact CD1-CG 4.09Å; I285-M321 HydrophobicContact CD1-SD 3.9Å; I285-M321 HydrophobicContact CG1-CE 3.85Å; I285-M321 HydrophobicContact CG1-CG 4.46Å; I285-M321 HydrophobicContact CG1-SD 3.64Å; I285-V446 HydrophobicContact CD1-CG1 4.14Å; I285-V446 HydrophobicContact CG1-CG1 4.17Å; I285-N448 PolarHBondContact N-OD1 2.78Å; I285-N448 PolarHBondContact O-ND2 2.91Å; I285-M449 HydrophobicContact CD1-CB 4.13Å; I285-M449 HydrophobicContact CD1-CG 4.49Å; I285-M449 HydrophobicContact CD1-SD 4.42Å
286	K	98.4	Very high	92.7	Very high	79 Å²	79	72.1 Å²	72.1	34%	0.343	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-39.3	174.1	-61.3	-60.7	-175.5	170.9	0	111.3	S266 T268 E302 C303	S266-K286 PolarHBondContact O-N 2.91Å; T268-K286 HydrophobicContact CG2-CG 4.13Å; T268-K286 WeakPolarHBondContact OG1-CE 3.29Å; K286-E302 WeakPolarHBondContact O-CA 3.45Å; K286-C303 PolarHBondContact O-N 2.65Å
287	Y	98.6	Very high	92.8	Very high	93 Å²	93	71.8 Å²	71.8	37%	0.365	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.8	179.5	-57.1	-93.2	0	0	0	111.2	F265 S266 P300 V301 E302	F265-Y287 VanDerWaalsContact CA-O 3.3Å; F265-Y287 WeakPolarHBondContact CA-O 3.5Å; S266-Y287 PolarHBondContact N-O 2.73Å; S266-Y287 PolarHBondContact O-N 3.36Å; S266-Y287 VanDerWaalsContact O-N 3.12Å; Y287-P300 HydrophobicContact CD1-CB 3.95Å; Y287-P300 HydrophobicContact CG-CB 4.35Å; Y287-V301 VanDerWaalsContact CA-O 3.24Å; Y287-V301 WeakPolarHBondContact CA-O 3.16Å; Y287-E302 HydrophobicContact CD1-CB 3.9Å; Y287-E302 HydrophobicContact CE1-CB 3.62Å; Y287-E302 HydrophobicContact CE1-CG 4.05Å
288	A	98.6	Very high	93.1	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.2	161.5	0	0	0	0	0	108.6	V86 F265 V301	V86-A288 HydrophobicContact CG1-CB 4.09Å; F265-A288 HydrophobicContact CD1-CB 4.02Å; F265-A288 HydrophobicContact CE1-CB 3.93Å; A288-V301 PolarHBondContact N-O 3.38Å; A288-V301 PolarHBondContact O-N 3.32Å
289	N	97.9	Very high	93.6	Very high	18 Å²	18	73 Å²	73	10%	0.096	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	109.2	-177.8	-62.1	-10.6	0	0	0	108.8	V262 T263 G264 Y298	V262-N289 WeakPolarHBondContact CA-O 3.48Å; T263-N289 PolarHBondContact N-O 3.47Å; G264-N289 WeakPolarHBondContact O-CB 3.39Å; G264-N289 PolarHBondContact O-N 2.94Å; N289-Y298 HydrophobicContact CB-CD2 3.57Å; N289-Y298 HydrophobicContact CB-CE2 4.06Å; N289-Y298 HydrophobicContact CB-CG 3.94Å
290	V	98	Very high	94.1	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.6	-177.1	-175.5	0	0	0	0	110.1	P79 V116 E261 V262 M292 Y298 Q299 V301	P79-V290 HydrophobicContact CG-CB 4.2Å; P79-V290 HydrophobicContact CG-CG1 4.35Å; P79-V290 HydrophobicContact CG-CG2 4.47Å; V116-V290 HydrophobicContact CG1-CG1 3.94Å; V116-V290 HydrophobicContact CG1-CG2 4.43Å; V116-V290 HydrophobicContact CG2-CG2 4.14Å; E261-V290 CarbonylContact O-C 3.54Å; E261-V290 WeakPolarHBondContact O-CA 3.4Å; V262-V290 HydrophobicContact CG2-CG2 4.36Å; V290-M292 HydrophobicContact CG1-SD 4.03Å; V290-M292 PolarHBondContact O-N 2.82Å; V290-Y298 CarbonylContact O-C 3.5Å; V290-Y298 WeakPolarHBondContact O-CA 3.26Å; V290-Q299 PolarHBondContact N-O 2.79Å; V290-Q299 PolarHBondContact O-N 3.4Å; V290-V301 HydrophobicContact CG2-CG2 3.87Å
291	Q	96.6	Very high	94.5	Very high	48 Å²	48	66 Å²	66	22%	0.224	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.5	171.8	-174	58	64.2	0	0	110	G260 E261 T263 S295 E297	G260-Q291 CarbonylContact C-O 3.54Å; G260-Q291 WeakPolarHBondContact CA-O 3.41Å; E261-Q291 PolarHBondContact N-O 3.18Å; E261-Q291 WeakPolarHBondContact O-CB 3.35Å; E261-Q291 PolarHBondContact O-N 3.17Å; T263-Q291 HydrophobicContact CG2-CB 3.56Å; T263-Q291 HydrophobicContact CG2-CG 4.32Å; Q291-S295 PolarHBondContact NE2-O 3.13Å; Q291-E297 PolarHBondContact NE2-O 3.14Å
292	M	94.3	Very high	94.8	Very high	15 Å²	15	66.5 Å²	66.5	7%	0.074	32%	0.323	C	S	.	.			trans	-78.5	147	175	-60.2	-52.8	-59	0	0	110.7	S77 L78 P79 F259 V290 N294 S295 Q299	S77-M292 WeakPolarHBondContact O-CE 3.42Å; L78-M292 HydrophobicContact CD2-CE 4.29Å; L78-M292 HydrophobicContact CD2-CG 3.8Å; L78-M292 HydrophobicContact CD2-SD 4.33Å; P79-M292 VanDerWaalsContact CD-SD 3.58Å; P79-M292 HydrophobicContact CG-SD 4.4Å; F259-M292 VanDerWaalsContact O-CE 3.29Å; F259-M292 WeakPolarHBondContact O-CE 3.47Å; V290-M292 HydrophobicContact CG1-SD 4.03Å; V290-M292 PolarHBondContact O-N 2.82Å; M292-N294 PolarHBondContact O-N 3.16Å; M292-S295 WeakPolarHBondContact O-CB 3.5Å; M292-S295 PolarHBondContact O-N 3.36Å; M292-S295 VanDerWaalsContact O-N 3.17Å; M292-Q299 HydrophobicContact CG-CG 4.01Å
293	P	88.7	Confident	95.1	Very high	78 Å²	78	64.5 Å²	64.5	51%	0.506	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	134.8	171.5	-23.9	33.9	0	0	0	110.7	F259 S295	F259-P293 WeakPolarHBondContact O-CD 3.43Å; P293-S295 PolarHBondContact O-N 2.89Å; P293-S295 VanDerWaalsContact O-N 3.14Å
294	N	85.5	Confident	95.1	Very high	179 Å²	179	63.5 Å²	63.5	96%	0.957	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	15.8	179.5	-48	-47.7	0	0	0	115.6	M292	M292-N294 PolarHBondContact O-N 3.16Å
295	S	89.1	Confident	95.2	Very high	42 Å²	42	60.6 Å²	60.6	29%	0.294	31%	0.311	S	S	.	.			trans	-98.3	146.1	170	-178.6	0	0	0	0	110.5	Q291 M292 P293 E297	Q291-S295 PolarHBondContact NE2-O 3.13Å; M292-S295 WeakPolarHBondContact O-CB 3.5Å; M292-S295 PolarHBondContact O-N 3.36Å; M292-S295 VanDerWaalsContact O-N 3.17Å; P293-S295 PolarHBondContact O-N 2.89Å; P293-S295 VanDerWaalsContact O-N 3.14Å; S295-E297 PolarHBondContact OG-N 3.04Å; S295-E297 VanDerWaalsContact OG-N 3.15Å; S295-E297 PolarHBondContact OG-O 3.29Å
296	L	87.6	Confident	95.2	Very high	179 Å²	179	60.6 Å²	60.6	94%	0.937	31%	0.311	S	S	*	.	S	Bend	trans	-88.6	-17.1	169.8	-66.5	175.4	0	0	0	112.5
297	E	89.6	Confident	95.3	Very high	141 Å²	141	56.9 Å²	56.9	66%	0.659	30%	0.295	S	S	*	.	S	Bend	trans	-110.1	143	-179.7	-64.1	-177.6	177.2	0	0	110.4	Q291 S295	Q291-E297 PolarHBondContact NE2-O 3.14Å; S295-E297 PolarHBondContact OG-N 3.04Å; S295-E297 VanDerWaalsContact OG-N 3.15Å; S295-E297 PolarHBondContact OG-O 3.29Å
298	Y	92.9	Very high	95.3	Very high	113 Å²	113	52.4 Å²	52.4	44%	0.443	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	152.7	168.8	65.4	-96.9	0	0	0	110.4	N289 V290 P300	N289-Y298 HydrophobicContact CB-CD2 3.57Å; N289-Y298 HydrophobicContact CB-CE2 4.06Å; N289-Y298 HydrophobicContact CB-CG 3.94Å; V290-Y298 CarbonylContact O-C 3.5Å; V290-Y298 WeakPolarHBondContact O-CA 3.26Å; Y298-P300 HydrophobicContact CE2-CB 4.32Å
299	Q	95.6	Very high	95.3	Very high	66 Å²	66	52.8 Å²	52.8	31%	0.308	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	113.8	173.1	-59.8	-55.6	-37.2	0	0	109.2	L78 P79 V290 M292	L78-Q299 HydrophobicContact CD2-CG 4.5Å; P79-Q299 HydrophobicContact CG-CB 3.82Å; P79-Q299 HydrophobicContact CG-CG 4.46Å; V290-Q299 PolarHBondContact N-O 2.79Å; V290-Q299 PolarHBondContact O-N 3.4Å; M292-Q299 HydrophobicContact CG-CG 4.01Å
300	P	97.4	Very high	95.3	Very high	59 Å²	59	53 Å²	53	38%	0.383	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.3	176	30	-32.4	0	0	0	110.2	Y287 Y298	Y287-P300 HydrophobicContact CD1-CB 3.95Å; Y287-P300 HydrophobicContact CG-CB 4.35Å; Y298-P300 HydrophobicContact CE2-CB 4.32Å
301	V	98.5	Very high	95.3	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	110.8	174.3	-177.6	0	0	0	0	108.8	P79 A83 V86 L114 Y287 A288 V290 C303	P79-V301 HydrophobicContact CB-CG2 3.7Å; P79-V301 HydrophobicContact CG-CG2 3.93Å; A83-V301 HydrophobicContact CB-CG1 4.06Å; V86-V301 HydrophobicContact CG2-CG1 3.93Å; L114-V301 HydrophobicContact CD2-CB 4.45Å; L114-V301 HydrophobicContact CD2-CG1 3.91Å; L114-V301 HydrophobicContact CD2-CG2 4.02Å; Y287-V301 VanDerWaalsContact CA-O 3.24Å; Y287-V301 WeakPolarHBondContact CA-O 3.16Å; A288-V301 PolarHBondContact N-O 3.38Å; A288-V301 PolarHBondContact O-N 3.32Å; V290-V301 HydrophobicContact CG2-CG2 3.87Å; V301-C303 PolarHBondContact O-N 3.02Å
302	E	98.7	Very high	95.3	Very high	79 Å²	79	52 Å²	52	37%	0.369	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	129.1	174.3	-171.7	-169.7	172.9	0	0	109.3	E81 R82 A83 K286 Y287	E81-E302 PolarHBondContact O-N 3.46Å; R82-E302 WeakPolarHBondContact CA-O 3.28Å; R82-E302 HydrophobicContact CB-CB 4.11Å; R82-E302 WeakPolarHBondContact CD-OE2 3.5Å; R82-E302 HydrophobicContact CG-CB 3.98Å; R82-E302 HydrophobicContact CG-CG 4.36Å; A83-E302 PolarHBondContact N-O 2.9Å; K286-E302 WeakPolarHBondContact O-CA 3.45Å; Y287-E302 HydrophobicContact CD1-CB 3.9Å; Y287-E302 HydrophobicContact CE1-CB 3.62Å; Y287-E302 HydrophobicContact CE1-CG 4.05Å
303	C	98.4	Very high	95.4	Very high	11 Å²	11	53.2 Å²	53.2	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	153	-178.4	58.8	0	0	0	0	115.3	A83 V86 K286 V301	A83-C303 WeakPolarHBondContact O-CA 3.3Å; A83-C303 VanDerWaalsContact O-CB 3.3Å; A83-C303 WeakPolarHBondContact O-CB 3.22Å; V86-C303 HydrophobicContact CB-CB 4.42Å; V86-C303 HydrophobicContact CG2-CB 3.62Å; K286-C303 PolarHBondContact O-N 2.65Å; V301-C303 PolarHBondContact O-N 3.02Å
304	A	97.9	Very high	95.9	Very high	38 Å²	38	49.5 Å²	49.5	31%	0.314	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-32.1	176.3	0	0	0	0	0	112	D84 R284 N448	D84-A304 WeakPolarHBondContact O-CB 3.43Å; D84-A304 PolarHBondContact O-N 2.77Å; R284-A304 PolarHBondContact NH2-O 3.36Å; R284-A304 VanDerWaalsContact NH2-O 3.11Å; A304-N448 VanDerWaalsContact O-CB 3.25Å; A304-N448 WeakPolarHBondContact O-CB 3.26Å; A304-N448 PolarHBondContact O-ND2 2.72Å
305	I	98.6	Very high	96.5	Very high	34 Å²	34	41.7 Å²	41.7	17%	0.174	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	142	-178.1	-63	178.2	0	0	0	110	D84 I85 V86 V307 F450 I474	D84-I305 PolarHBondContact O-N 3.46Å; I85-I305 WeakPolarHBondContact CA-O 3.32Å; I85-I305 HydrophobicContact CG1-CB 4.22Å; I85-I305 HydrophobicContact CG2-CB 4.41Å; I85-I305 HydrophobicContact CG2-CG2 4.23Å; V86-I305 PolarHBondContact N-O 3.1Å; I305-V307 HydrophobicContact CG2-CG2 4.3Å; I305-F450 HydrophobicContact CD1-CE2 4.47Å; I305-F450 HydrophobicContact CG2-CD2 3.66Å; I305-F450 HydrophobicContact CG2-CE2 3.78Å; I305-I474 HydrophobicContact CD1-CG2 3.64Å
306	V	98.9	Very high	96.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.4	168.4	177.9	0	0	0	0	109.5	V86 V88 F265 I285 N448 M449 F450	V86-V306 CarbonylContact O-C 3.5Å; V86-V306 VanDerWaalsContact O-CA 3.28Å; V86-V306 WeakPolarHBondContact O-CA 2.87Å; V88-V306 HydrophobicContact CG2-CG1 3.86Å; F265-V306 HydrophobicContact CD1-CG2 4.42Å; F265-V306 HydrophobicContact CE1-CG1 3.83Å; F265-V306 HydrophobicContact CE1-CG2 4.03Å; F265-V306 HydrophobicContact CZ-CG1 4.09Å; I285-V306 HydrophobicContact CB-CG2 4.32Å; I285-V306 HydrophobicContact CD1-CB 3.92Å; I285-V306 HydrophobicContact CD1-CG2 3.74Å; I285-V306 HydrophobicContact CG2-CG2 3.87Å; V306-N448 PolarHBondContact N-O 3.36Å; V306-M449 CarbonylContact O-C 3.57Å; V306-M449 WeakPolarHBondContact O-CA 3.24Å; V306-F450 PolarHBondContact O-N 2.92Å
307	V	98.9	Very high	97.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.9	170.8	-171.5	0	0	0	0	108.7	I85 V86 I87 V88 I97 I305 A309 F450 M470 I474	I85-V307 HydrophobicContact CG2-CG2 4.09Å; V86-V307 PolarHBondContact O-N 2.9Å; I87-V307 WeakPolarHBondContact CA-O 3.46Å; I87-V307 HydrophobicContact CG1-CB 4.21Å; I87-V307 HydrophobicContact CG1-CG2 4.39Å; V88-V307 PolarHBondContact N-O 3.22Å; I97-V307 HydrophobicContact CD1-CG1 3.94Å; I305-V307 HydrophobicContact CG2-CG2 4.3Å; V307-A309 PolarHBondContact O-N 3.25Å; V307-F450 CarbonylContact C-O 3.51Å; V307-F450 WeakPolarHBondContact CA-O 3.29Å; V307-F450 HydrophobicContact CG1-CB 4.44Å; V307-F450 HydrophobicContact CG2-CB 4.39Å; V307-M470 HydrophobicContact CG1-CE 3.86Å; V307-I474 HydrophobicContact CG2-CD1 3.68Å
308	N	98.9	Very high	97.8	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	101.5	173.8	-178.3	11.2	0	0	0	109.4	A310 S314 V317 M449 F450 F451 A452	N308-A310 WeakPolarHBondContact OD1-CB 3.24Å; N308-A310 PolarHBondContact OD1-N 3.17Å; N308-S314 PolarHBondContact ND2-O 2.9Å; N308-S314 PolarHBondContact OD1-OG 3.09Å; N308-V317 HydrophobicContact CB-CG1 4.34Å; N308-M449 HydrophobicContact CB-CE 3.72Å; N308-F450 PolarHBondContact N-O 2.92Å; N308-F451 HydrophobicContact CB-CD1 3.91Å; N308-F451 HydrophobicContact CB-CE1 4.3Å; N308-A452 PolarHBondContact O-N 2.72Å; N308-A452 VanDerWaalsContact O-N 3.09Å
309	A	98.8	Very high	98	Very high	8 Å²	8	30.5 Å²	30.5	7%	0.066	17%	0.171	C	C	.	.			trans	-121.7	32.3	175.6	0	0	0	0	0	110.1	I87 V88 V93 I97 V307 G311	I87-A309 HydrophobicContact CG2-CB 4.26Å; V88-A309 CarbonylContact O-C 3.57Å; V88-A309 WeakPolarHBondContact O-CA 3.31Å; V88-A309 PolarHBondContact O-N 3.13Å; V93-A309 HydrophobicContact CG1-CB 4.27Å; I97-A309 HydrophobicContact CD1-CB 4.34Å; V307-A309 PolarHBondContact O-N 3.25Å; A309-G311 PolarHBondContact O-N 3.34Å
310	A	98.3	Very high	98.1	Very high	21 Å²	21	30.6 Å²	30.6	17%	0.174	17%	0.173	C	C	.	.			trans	-79.7	19.6	-171.7	0	0	0	0	0	113.6	V88 N308 A312 L313 S314 V317	V88-A310 HydrophobicContact CG1-CB 4.32Å; V88-A310 PolarHBondContact O-N 2.94Å; N308-A310 WeakPolarHBondContact OD1-CB 3.24Å; N308-A310 PolarHBondContact OD1-N 3.17Å; A310-A312 PolarHBondContact O-N 3.18Å; A310-L313 HydrophobicContact CB-CB 4.46Å; A310-L313 PolarHBondContact O-N 3.06Å; A310-S314 PolarHBondContact N-OG 2.7Å; A310-V317 HydrophobicContact CB-CG2 3.8Å
311	G	97.2	Very high	98	Very high	20 Å²	20	27.8 Å²	27.8	21%	0.206	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	47.6	-126.8	-177.5	0	0	0	0	0	111.6	A309 L313 S314 T453	A309-G311 PolarHBondContact O-N 3.34Å; G311-L313 PolarHBondContact O-N 3.29Å; G311-S314 PolarHBondContact N-OG 3.21Å; G311-S314 VanDerWaalsContact O-CB 3.24Å; G311-S314 WeakPolarHBondContact O-CB 3.31Å; G311-S314 PolarHBondContact O-N 2.94Å; G311-S314 PolarHBondContact O-OG 3.19Å; G311-T453 PolarHBondContact O-OG1 3.06Å
312	A	97	Very high	97.8	Very high	9 Å²	9	28.5 Å²	28.5	7%	0.074	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.7	-13.7	-175.3	0	0	0	0	0	114.7	A310 P340 F428 D430	A310-A312 PolarHBondContact O-N 3.18Å; A312-P340 HydrophobicContact CB-CB 3.92Å; A312-P340 WeakPolarHBondContact O-CD 3.23Å; A312-F428 HydrophobicContact CB-CB 3.87Å; A312-D430 HydrophobicContact CB-CB 4.31Å; A312-D430 VanDerWaalsContact N-CB 3.33Å
313	L	97.5	Very high	97.6	Very high	39 Å²	39	25.2 Å²	25.2	20%	0.204	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-99.4	4.6	178.1	-57.9	178.3	0	0	0	113.3	A310 G311 G315 K316 V317	A310-L313 HydrophobicContact CB-CB 4.46Å; A310-L313 PolarHBondContact O-N 3.06Å; G311-L313 PolarHBondContact O-N 3.29Å; L313-G315 PolarHBondContact O-N 2.96Å; L313-K316 HydrophobicContact CD2-CD 4.22Å; L313-K316 WeakPolarHBondContact O-CB 3.41Å; L313-K316 PolarHBondContact O-N 3.37Å; L313-V317 PolarHBondContact O-N 2.76Å
314	S	98.4	Very high	97.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-34.7	-176.2	-59.2	0	0	0	0	112.3	N308 A310 G311 V317 A318 L336 T453	N308-S314 PolarHBondContact ND2-O 2.9Å; N308-S314 PolarHBondContact OD1-OG 3.09Å; A310-S314 PolarHBondContact N-OG 2.7Å; G311-S314 PolarHBondContact N-OG 3.21Å; G311-S314 VanDerWaalsContact O-CB 3.24Å; G311-S314 WeakPolarHBondContact O-CB 3.31Å; G311-S314 PolarHBondContact O-N 2.94Å; G311-S314 PolarHBondContact O-OG 3.19Å; S314-V317 PolarHBondContact O-N 2.73Å; S314-A318 WeakPolarHBondContact O-CB 3.2Å; S314-A318 PolarHBondContact O-N 3.39Å; S314-L336 WeakPolarHBondContact O-CD2 3.47Å; S314-T453 WeakPolarHBondContact CB-OG1 3.33Å; S314-T453 WeakPolarHBondContact OG-CB 3.34Å; S314-T453 PolarHBondContact OG-OG1 3.31Å
315	G	98.1	Very high	97.3	Very high	15 Å²	15	29.4 Å²	29.4	16%	0.155	17%	0.168	C	C	.	.	H	α-helix	trans	-57	-48.5	171.9	0	0	0	0	0	112.2	L313 V317 A318 E319	L313-G315 PolarHBondContact O-N 2.96Å; G315-V317 PolarHBondContact O-N 2.75Å; G315-A318 WeakPolarHBondContact O-CB 3.17Å; G315-A318 PolarHBondContact O-N 3.32Å; G315-E319 PolarHBondContact O-N 3.31Å
316	K	97.8	Very high	96.9	Very high	129 Å²	129	29 Å²	29	56%	0.561	17%	0.172	S	C	*	.	H	α-helix	trans	-62.9	-40.3	176.8	-64.9	-173	179.5	178.9	0	112.4	L313 A318 E319 M320	L313-K316 HydrophobicContact CD2-CD 4.22Å; L313-K316 WeakPolarHBondContact O-CB 3.41Å; L313-K316 PolarHBondContact O-N 3.37Å; K316-A318 VanDerWaalsContact C-N 3.33Å; K316-A318 PolarHBondContact O-N 3.4Å; K316-E319 WeakPolarHBondContact O-CB 3.21Å; K316-E319 PolarHBondContact O-N 3.09Å; K316-M320 WeakPolarHBondContact O-CG 3.34Å; K316-M320 PolarHBondContact O-N 3.1Å; K316-M320 VanDerWaalsContact O-N 3.13Å
317	V	98.3	Very high	96.5	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.055	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-38	176.1	174.9	0	0	0	0	111.4	V88 F265 N308 A310 L313 S314 G315 M320 M449	V88-V317 HydrophobicContact CG1-CG1 4.18Å; V88-V317 HydrophobicContact CG1-CG2 4.13Å; F265-V317 HydrophobicContact CE2-CG1 4.12Å; F265-V317 HydrophobicContact CZ-CG1 4.08Å; N308-V317 HydrophobicContact CB-CG1 4.34Å; A310-V317 HydrophobicContact CB-CG2 3.8Å; L313-V317 PolarHBondContact O-N 2.76Å; S314-V317 PolarHBondContact O-N 2.73Å; G315-V317 PolarHBondContact O-N 2.75Å; V317-M320 WeakPolarHBondContact O-CB 3.15Å; V317-M320 PolarHBondContact O-N 2.72Å; V317-M449 HydrophobicContact CG1-CE 4.01Å
318	A	97.9	Very high	95.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67	-39.4	174.3	0	0	0	0	0	111.8	S314 G315 K316 M320 M321 I323 L336 F451	S314-A318 WeakPolarHBondContact O-CB 3.2Å; S314-A318 PolarHBondContact O-N 3.39Å; G315-A318 WeakPolarHBondContact O-CB 3.17Å; G315-A318 PolarHBondContact O-N 3.32Å; K316-A318 VanDerWaalsContact C-N 3.33Å; K316-A318 PolarHBondContact O-N 3.4Å; A318-M320 VanDerWaalsContact C-N 3.28Å; A318-M320 PolarHBondContact O-N 2.69Å; A318-M321 WeakPolarHBondContact O-CA 3.48Å; A318-M321 WeakPolarHBondContact O-CB 3.47Å; A318-M321 PolarHBondContact O-N 3.16Å; A318-I323 HydrophobicContact CB-CB 4.16Å; A318-I323 HydrophobicContact CB-CD1 4.1Å; A318-I323 HydrophobicContact CB-CG2 4.41Å; A318-I323 WeakPolarHBondContact O-CB 3.47Å; A318-I323 PolarHBondContact O-N 3.11Å; A318-L336 HydrophobicContact CB-CB 3.76Å; A318-L336 HydrophobicContact CB-CD2 3.87Å; A318-L336 HydrophobicContact CB-CG 4.48Å; A318-F451 HydrophobicContact CB-CE1 4.24Å
319	E	97.4	Very high	95.2	Very high	102 Å²	102	49.5 Å²	49.5	48%	0.477	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-33.5	176.3	-169.8	-177.2	163.8	0	0	112.6	G315 K316 M321 G322 L325	G315-E319 PolarHBondContact O-N 3.31Å; K316-E319 WeakPolarHBondContact O-CB 3.21Å; K316-E319 PolarHBondContact O-N 3.09Å; E319-M321 PolarHBondContact O-N 2.98Å; E319-M321 VanDerWaalsContact O-N 3.15Å; E319-G322 VanDerWaalsContact O-CA 3.3Å; E319-G322 WeakPolarHBondContact O-CA 3.45Å; E319-G322 PolarHBondContact O-N 2.97Å; E319-L325 HydrophobicContact CG-CD1 3.81Å; E319-L325 HydrophobicContact CG-CD2 4Å; E319-L325 HydrophobicContact CG-CG 3.98Å
320	M	97.2	Very high	94.8	Very high	68 Å²	68	51.9 Å²	51.9	34%	0.335	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.9	172.6	-65.3	168.7	-174.8	0	0	113	V262 F265 K316 V317 A318 G322	V262-M320 WeakPolarHBondContact O-CE 3.45Å; F265-M320 HydrophobicContact CD2-CB 4.1Å; F265-M320 HydrophobicContact CE2-CB 4.19Å; K316-M320 WeakPolarHBondContact O-CG 3.34Å; K316-M320 PolarHBondContact O-N 3.1Å; K316-M320 VanDerWaalsContact O-N 3.13Å; V317-M320 WeakPolarHBondContact O-CB 3.15Å; V317-M320 PolarHBondContact O-N 2.72Å; A318-M320 VanDerWaalsContact C-N 3.28Å; A318-M320 PolarHBondContact O-N 2.69Å; M320-G322 VanDerWaalsContact C-N 3.31Å
321	M	95.6	Very high	94.2	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	7.1	172.2	-81.1	-57.5	-53.4	0	0	113.3	F265 Y267 R283 I285 A318 E319 I323 V446 M449	F265-M321 HydrophobicContact CB-CG 4.37Å; F265-M321 HydrophobicContact CB-SD 3.37Å; F265-M321 WeakPolarHBondContact CB-SD 3.37Å; F265-M321 HydrophobicContact CD2-CG 3.53Å; F265-M321 HydrophobicContact CD2-SD 3.71Å; F265-M321 HydrophobicContact CE2-CG 4.04Å; F265-M321 HydrophobicContact CG-CG 4.09Å; F265-M321 HydrophobicContact CG-SD 3.7Å; Y267-M321 HydrophobicContact CD1-CE 3.51Å; Y267-M321 HydrophobicContact CD1-SD 3.69Å; Y267-M321 HydrophobicContact CD2-CE 4.4Å; Y267-M321 HydrophobicContact CE1-CE 4.03Å; Y267-M321 HydrophobicContact CE1-SD 4.22Å; Y267-M321 HydrophobicContact CG-CE 3.72Å; Y267-M321 HydrophobicContact CG-SD 4.4Å; R283-M321 HydrophobicContact CB-CE 3.97Å; R283-M321 PolarHBondContact NH1-O 3.42Å; I285-M321 HydrophobicContact CD1-CE 4.43Å; I285-M321 HydrophobicContact CD1-CG 4.09Å; I285-M321 HydrophobicContact CD1-SD 3.9Å; I285-M321 HydrophobicContact CG1-CE 3.85Å; I285-M321 HydrophobicContact CG1-CG 4.46Å; I285-M321 HydrophobicContact CG1-SD 3.64Å; A318-M321 WeakPolarHBondContact O-CA 3.48Å; A318-M321 WeakPolarHBondContact O-CB 3.47Å; A318-M321 PolarHBondContact O-N 3.16Å; E319-M321 PolarHBondContact O-N 2.98Å; E319-M321 VanDerWaalsContact O-N 3.15Å; M321-I323 VanDerWaalsContact C-N 3.27Å; M321-I323 HydrophobicContact CB-CD1 4.18Å; M321-I323 HydrophobicContact CB-CG1 4.13Å; M321-I323 PolarHBondContact O-N 3Å; M321-V446 HydrophobicContact CE-CG1 3.89Å; M321-V446 HydrophobicContact CE-CG2 4.28Å; M321-M449 HydrophobicContact CB-SD 4.3Å; M321-M449 HydrophobicContact CG-SD 3.91Å
322	G	94.1	Very high	93.8	Very high	17 Å²	17	54.5 Å²	54.5	18%	0.175	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	19.4	-176	0	0	0	0	0	114.4	E319 M320 L325	E319-G322 VanDerWaalsContact O-CA 3.3Å; E319-G322 WeakPolarHBondContact O-CA 3.45Å; E319-G322 PolarHBondContact O-N 2.97Å; M320-G322 VanDerWaalsContact C-N 3.31Å; G322-L325 PolarHBondContact O-N 2.87Å
323	I	95.1	Very high	93.6	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.046	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	125.4	176	-60.9	172.7	0	0	0	108.1	A318 M321 L325 H443 V446 M449 F451	A318-I323 HydrophobicContact CB-CB 4.16Å; A318-I323 HydrophobicContact CB-CD1 4.1Å; A318-I323 HydrophobicContact CB-CG2 4.41Å; A318-I323 WeakPolarHBondContact O-CB 3.47Å; A318-I323 PolarHBondContact O-N 3.11Å; M321-I323 VanDerWaalsContact C-N 3.27Å; M321-I323 HydrophobicContact CB-CD1 4.18Å; M321-I323 HydrophobicContact CB-CG1 4.13Å; M321-I323 PolarHBondContact O-N 3Å; I323-L325 VanDerWaalsContact C-N 3.31Å; I323-H443 WeakPolarHBondContact CG2-NE2 3.24Å; I323-V446 HydrophobicContact CD1-CG2 4.01Å; I323-V446 HydrophobicContact CG1-CG2 4.15Å; I323-M449 HydrophobicContact CD1-SD 3.9Å; I323-F451 HydrophobicContact CD1-CZ 3.96Å
324	G	94.6	Very high	93.5	Very high	21 Å²	21	54.5 Å²	54.5	22%	0.216	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-6.1	-175.3	0	0	0	0	0	115.1	A332 I334	G324-A332 PolarHBondContact N-O 2.82Å; G324-A332 VanDerWaalsContact N-O 3.1Å; G324-I334 PolarHBondContact N-O 3.26Å
325	L	94.1	Very high	93.4	Very high	116 Å²	116	58 Å²	58	61%	0.607	33%	0.327	S	S	*	.			trans	-96.9	-0.3	178.7	-58.3	-173.6	0	0	0	113.4	E319 G322 I323	E319-L325 HydrophobicContact CG-CD1 3.81Å; E319-L325 HydrophobicContact CG-CD2 4Å; E319-L325 HydrophobicContact CG-CG 3.98Å; G322-L325 PolarHBondContact O-N 2.87Å; I323-L325 VanDerWaalsContact C-N 3.31Å
326	G	90.9	Very high	93.4	Very high	26 Å²	26	57.7 Å²	57.7	27%	0.268	32%	0.321	S	S	.	.	S	Bend	trans	-74.8	179.5	175.2	0	0	0	0	0	113.8	A332 G333	G326-A332 PolarHBondContact N-O 3.25Å; G326-A332 VanDerWaalsContact N-O 3.09Å; G326-G333 WeakPolarHBondContact O-CA 3.3Å
327	P	89.9	Confident	93.4	Very high	92 Å²	92	52.4 Å²	52.4	60%	0.597	30%	0.301	S	S	*	.			trans	-56.6	142.2	176.1	-22.4	33	0	0	0	112	T330 G333	P327-T330 HydrophobicContact CB-CG2 3.96Å; P327-T330 PolarHBondContact O-N 2.96Å; P327-T330 PolarHBondContact O-OG1 3.48Å; P327-G333 WeakPolarHBondContact O-CA 3.47Å
328	K	87.4	Confident	93.4	Very high	188 Å²	188	52.4 Å²	52.4	82%	0.817	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	147.9	174.8	-66.3	-172.4	177.6	-174.7	0	110.6	T330	K328-T330 PolarHBondContact O-N 2.93Å
329	D	84.7	Confident	93.3	Very high	151 Å²	151	55.9 Å²	55.9	81%	0.807	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	14.9	-178.9	-54.2	-57.3	0	0	0	115.5
330	T	88.5	Confident	93.3	Very high	57 Å²	57	52.2 Å²	52.2	35%	0.35	30%	0.302	S	S	.	.	S	Bend	trans	-110.7	158	169.2	72.8	0	0	0	0	110.8	P327 K328 A332 G333 I334	P327-T330 HydrophobicContact CB-CG2 3.96Å; P327-T330 PolarHBondContact O-N 2.96Å; P327-T330 PolarHBondContact O-OG1 3.48Å; K328-T330 PolarHBondContact O-N 2.93Å; T330-A332 PolarHBondContact O-N 3Å; T330-G333 PolarHBondContact O-N 3.13Å; T330-G333 PolarHBondContact OG1-N 2.65Å; T330-I334 WeakPolarHBondContact O-CG1 3.21Å; T330-I334 PolarHBondContact O-N 3.43Å
331	I	87.1	Confident	93.3	Very high	66 Å²	66	50.1 Å²	50.1	34%	0.338	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-55.6	-36.8	176.5	-55.8	173.8	0	0	0	111.2	G333 I334 P444 L445 M493	I331-G333 VanDerWaalsContact C-N 3.28Å; I331-G333 PolarHBondContact O-N 3.3Å; I331-I334 PolarHBondContact O-N 3.36Å; I331-P444 HydrophobicContact CG2-CB 4.37Å; I331-P444 HydrophobicContact CG2-CG 3.64Å; I331-L445 HydrophobicContact CB-CD1 3.88Å; I331-L445 HydrophobicContact CB-CG 4.33Å; I331-L445 HydrophobicContact CG2-CD1 3.64Å; I331-L445 HydrophobicContact CG2-CD2 4.24Å; I331-L445 HydrophobicContact CG2-CG 3.67Å; I331-M493 HydrophobicContact CB-CE 4.39Å; I331-M493 HydrophobicContact CD1-CE 3.54Å; I331-M493 HydrophobicContact CG1-CE 3.74Å; I331-M493 HydrophobicContact CG2-CE 3.77Å; I331-M493 HydrophobicContact CG2-SD 4.39Å
332	A	87.8	Confident	93.4	Very high	31 Å²	31	50.8 Å²	50.8	26%	0.256	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-68.8	-25.1	178.5	0	0	0	0	0	113.5	G324 G326 T330 L445	G324-A332 PolarHBondContact N-O 2.82Å; G324-A332 VanDerWaalsContact N-O 3.1Å; G326-A332 PolarHBondContact N-O 3.25Å; G326-A332 VanDerWaalsContact N-O 3.09Å; T330-A332 PolarHBondContact O-N 3Å; A332-L445 HydrophobicContact CB-CD1 3.88Å
333	G	92.8	Very high	93.6	Very high	16 Å²	16	50.9 Å²	50.9	17%	0.165	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-88.8	-2.1	176.9	0	0	0	0	0	114.5	G326 P327 T330 I331 P335	G326-G333 WeakPolarHBondContact O-CA 3.3Å; P327-G333 WeakPolarHBondContact O-CA 3.47Å; T330-G333 PolarHBondContact O-N 3.13Å; T330-G333 PolarHBondContact OG1-N 2.65Å; I331-G333 VanDerWaalsContact C-N 3.28Å; I331-G333 PolarHBondContact O-N 3.3Å; G333-P335 WeakPolarHBondContact O-CD 3.12Å
334	I	95.6	Very high	93.7	Very high	32 Å²	32	50.7 Å²	50.7	16%	0.164	29%	0.287	C	S	.	.			trans	-84.3	114.7	176.5	-60.3	179	0	0	0	108.6	G324 T330 I331 F489 I492 M493	G324-I334 PolarHBondContact N-O 3.26Å; T330-I334 WeakPolarHBondContact O-CG1 3.21Å; T330-I334 PolarHBondContact O-N 3.43Å; I331-I334 PolarHBondContact O-N 3.36Å; I334-F489 HydrophobicContact CG2-CE1 4.15Å; I334-F489 HydrophobicContact CG2-CZ 3.93Å; I334-I492 HydrophobicContact CG2-CG2 3.72Å; I334-M493 HydrophobicContact CD1-CB 4.22Å; I334-M493 HydrophobicContact CD1-CG 4.22Å
335	P	96.8	Very high	93.9	Very high	72 Å²	72	50.1 Å²	50.1	47%	0.468	28%	0.279	S	S	.	.			trans	-72.2	161.5	177.6	31.9	-35.3	0	0	0	111	G333 P337	G333-P335 WeakPolarHBondContact O-CD 3.12Å; P335-P337 VanDerWaalsContact O-CD 3.26Å; P335-P337 WeakPolarHBondContact O-CD 3.28Å
336	L	97.8	Very high	94.1	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.047	25%	0.25	C	S	.	.			trans	-73.6	112	159.4	-179.3	69.9	0	0	0	107.5	S314 A318 V338 I439 F451 T453 F489	S314-L336 WeakPolarHBondContact O-CD2 3.47Å; A318-L336 HydrophobicContact CB-CB 3.76Å; A318-L336 HydrophobicContact CB-CD2 3.87Å; A318-L336 HydrophobicContact CB-CG 4.48Å; L336-V338 HydrophobicContact CD1-CG2 4.38Å; L336-V338 HydrophobicContact CG-CB 4.38Å; L336-V338 HydrophobicContact CG-CG2 4.07Å; L336-V338 PolarHBondContact O-N 3.14Å; L336-I439 HydrophobicContact CD1-CB 4.46Å; L336-I439 HydrophobicContact CD1-CD1 3.56Å; L336-I439 HydrophobicContact CD1-CG2 4.01Å; L336-F451 HydrophobicContact CD1-CD1 4.27Å; L336-F451 HydrophobicContact CD1-CD2 4.22Å; L336-F451 HydrophobicContact CD1-CE1 4.39Å; L336-F451 HydrophobicContact CD1-CE2 4.28Å; L336-F451 HydrophobicContact CD1-CG 4.21Å; L336-F451 HydrophobicContact CD1-CZ 4.38Å; L336-F451 HydrophobicContact CD2-CD1 3.87Å; L336-F451 HydrophobicContact CD2-CE1 3.84Å; L336-F451 HydrophobicContact CD2-CZ 4.46Å; L336-T453 HydrophobicContact CD2-CG2 4.12Å; L336-F489 HydrophobicContact CB-CE2 4.47Å; L336-F489 HydrophobicContact CD1-CD2 4.12Å; L336-F489 HydrophobicContact CD1-CE2 4Å
337	P	97.6	Very high	94.4	Very high	19 Å²	19	44.2 Å²	44.2	12%	0.123	24%	0.242	C	C	.	.			trans	-80.9	47.9	-168.7	35.6	-37.7	0	0	0	112	P335 N432 T433 F434 I439 I492	P335-P337 VanDerWaalsContact O-CD 3.26Å; P335-P337 WeakPolarHBondContact O-CD 3.28Å; P337-N432 WeakPolarHBondContact CG-OD1 3.13Å; P337-N432 CarbonylContact O-C 3.53Å; P337-N432 VanDerWaalsContact O-CA 3.27Å; P337-N432 WeakPolarHBondContact O-CA 3.21Å; P337-N432 PolarHBondContact O-OD1 2.97Å; P337-T433 WeakPolarHBondContact CB-OG1 3.33Å; P337-T433 PolarHBondContact O-N 2.87Å; P337-T433 PolarHBondContact O-OG1 3.27Å; P337-F434 HydrophobicContact CB-CB 4.25Å; P337-F434 HydrophobicContact CG-CB 3.89Å; P337-I439 HydrophobicContact CG-CD1 4.04Å; P337-I492 HydrophobicContact CG-CD1 3.79Å; P337-I492 HydrophobicContact CG-CG1 4.43Å; P337-I492 HydrophobicContact CG-CG2 4.38Å
338	V	98.4	Very high	94.8	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.3	-178.2	179.3	0	0	0	0	110	L336 D430 Y431 I439 T453	L336-V338 HydrophobicContact CD1-CG2 4.38Å; L336-V338 HydrophobicContact CG-CB 4.38Å; L336-V338 HydrophobicContact CG-CG2 4.07Å; L336-V338 PolarHBondContact O-N 3.14Å; V338-D430 HydrophobicContact CG1-CB 4.04Å; V338-Y431 WeakPolarHBondContact CA-O 3.46Å; V338-I439 HydrophobicContact CG2-CD1 3.74Å; V338-T453 HydrophobicContact CG2-CG2 4.26Å
339	E	97.1	Very high	95.3	Very high	73 Å²	73	33.6 Å²	33.6	34%	0.341	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.2	-179.1	72.1	-176.9	-166.3	0	0	111.9	R341 Y431 T433	E339-R341 PolarHBondContact O-N 2.79Å; E339-R341 IonicContact OE1-CZ 2.7Å; E339-R341 IonicContact OE1-NE 2.73Å; E339-R341 PolarHBondContact OE1-NE 2.99Å; E339-R341 IonicContact OE1-NH2 3.33Å; E339-R341 PolarHBondContact OE1-NH2 2.94Å; E339-Y431 PolarHBondContact N-O 3Å; E339-Y431 PolarHBondContact O-N 2.8Å; E339-T433 VanDerWaalsContact CD-CG2 3.41Å; E339-T433 HydrophobicContact CG-CG2 3.73Å; E339-T433 VanDerWaalsContact OE1-CG2 3.29Å; E339-T433 WeakPolarHBondContact OE1-CG2 3.28Å
340	P	97.6	Very high	95.9	Very high	26 Å²	26	26.4 Å²	26.4	17%	0.169	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.7	171.2	27.2	-32.4	0	0	0	110.4	A312 T392 F428 Y429	A312-P340 HydrophobicContact CB-CB 3.92Å; A312-P340 WeakPolarHBondContact O-CD 3.23Å; P340-T392 HydrophobicContact CB-CG2 4.01Å; P340-T392 HydrophobicContact CG-CG2 4.05Å; P340-T392 VanDerWaalsContact O-CG2 3.26Å; P340-T392 WeakPolarHBondContact O-CG2 3.24Å; P340-F428 HydrophobicContact CB-CB 4.29Å; P340-F428 HydrophobicContact CB-CD1 3.79Å; P340-F428 HydrophobicContact CB-CE1 4.27Å; P340-F428 HydrophobicContact CB-CG 4Å; P340-Y429 WeakPolarHBondContact CA-O 3.44Å
341	R	96.9	Very high	96.1	Very high	24 Å²	24	28 Å²	28	9%	0.091	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121	163	-68.4	-65.4	-175.9	113.5	-7.8	109.7	E339 E386 E389 F428 Y429 Y431	E339-R341 PolarHBondContact O-N 2.79Å; E339-R341 IonicContact OE1-CZ 2.7Å; E339-R341 IonicContact OE1-NE 2.73Å; E339-R341 PolarHBondContact OE1-NE 2.99Å; E339-R341 IonicContact OE1-NH2 3.33Å; E339-R341 PolarHBondContact OE1-NH2 2.94Å; R341-E386 IonicContact CZ-OE1 3.46Å; R341-E386 VanDerWaalsContact CZ-OE1 3.27Å; R341-E386 IonicContact NH1-OE1 3.99Å; R341-E386 PolarHBondContact NH1-OE1 2.89Å; R341-E386 IonicContact NH1-OE2 2.84Å; R341-E386 PolarHBondContact NH1-OE2 2.91Å; R341-E386 VanDerWaalsContact NH1-OE2 3.15Å; R341-E386 IonicContact NH2-OE1 3.62Å; R341-E386 PolarHBondContact NH2-OE1 2.97Å; R341-E389 WeakPolarHBondContact CD-OE1 3.45Å; R341-E389 IonicContact CZ-OE1 2.9Å; R341-E389 IonicContact NE-OE1 3.79Å; R341-E389 IonicContact NH1-OE1 3.15Å; R341-E389 PolarHBondContact NH1-OE1 3.27Å; R341-F428 CarbonylContact O-C 3.55Å; R341-F428 WeakPolarHBondContact O-CA 3.48Å; R341-Y429 PolarHBondContact N-O 3.48Å; R341-Y429 PolarHBondContact O-N 2.87Å; R341-Y431 HydrophobicContact CB-CG 4.35Å; R341-Y431 HydrophobicContact CG-CD1 3.75Å; R341-Y431 HydrophobicContact CG-CD2 4.26Å; R341-Y431 HydrophobicContact CG-CG 3.55Å
342	K	97.6	Very high	96.5	Very high	14 Å²	14	31 Å²	31	6%	0.061	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.1	-173.8	176.8	170.7	63.1	-178.7	0	110.2	F344 P390 E391 T392 N394 A426 G427 F428	K342-F344 HydrophobicContact CD-CE1 4Å; K342-F344 HydrophobicContact CD-CZ 4.43Å; K342-F344 HydrophobicContact CG-CE1 4.02Å; K342-F344 HydrophobicContact CG-CZ 4.39Å; K342-P390 HydrophobicContact CB-CG 4.03Å; K342-P390 HydrophobicContact CG-CG 4.39Å; K342-E391 WeakPolarHBondContact CE-O 3.42Å; K342-E391 PolarHBondContact NZ-O 2.92Å; K342-T392 HydrophobicContact CB-CG2 4.41Å; K342-N394 PolarHBondContact NZ-OD1 3.08Å; K342-A426 HydrophobicContact CD-CB 4.18Å; K342-A426 HydrophobicContact CG-CB 4.11Å; K342-G427 WeakPolarHBondContact CA-O 3.34Å; K342-F428 HydrophobicContact CB-CD1 3.98Å; K342-F428 HydrophobicContact CB-CE1 3.92Å; K342-F428 HydrophobicContact CG-CE1 4.43Å
343	R	97.3	Very high	96.8	Very high	19 Å²	19	30.5 Å²	30.5	7%	0.072	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.3	-179.6	-61.3	-65.2	174.4	-99.3	7.3	109.2	S383 E389 A426 G427 Y429	R343-S383 PolarHBondContact NE-OG 2.84Å; R343-E389 IonicContact CZ-OE1 2.67Å; R343-E389 IonicContact CZ-OE2 3.47Å; R343-E389 IonicContact NH1-OE1 3.27Å; R343-E389 PolarHBondContact NH1-OE1 3.06Å; R343-E389 IonicContact NH1-OE2 3.18Å; R343-E389 PolarHBondContact NH1-OE2 3.26Å; R343-E389 IonicContact NH2-OE1 2.84Å; R343-E389 PolarHBondContact NH2-OE1 3.32Å; R343-E389 IonicContact NH2-OE2 2.67Å; R343-A426 CarbonylContact O-C 3.43Å; R343-A426 VanDerWaalsContact O-CA 3.23Å; R343-A426 WeakPolarHBondContact O-CA 3.42Å; R343-G427 PolarHBondContact N-O 2.97Å; R343-G427 PolarHBondContact O-N 3.42Å; R343-Y429 HydrophobicContact CG-CD1 3.99Å; R343-Y429 HydrophobicContact CG-CD2 4.26Å; R343-Y429 HydrophobicContact CG-CE1 4.17Å; R343-Y429 HydrophobicContact CG-CE2 4.42Å; R343-Y429 HydrophobicContact CG-CG 4.06Å
344	F	97.9	Very high	96.9	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.018	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.7	-179.9	-51.2	-63.2	0	0	0	110.4	K342 Y346 P390 V397 D398 F401 A426	K342-F344 HydrophobicContact CD-CE1 4Å; K342-F344 HydrophobicContact CD-CZ 4.43Å; K342-F344 HydrophobicContact CG-CE1 4.02Å; K342-F344 HydrophobicContact CG-CZ 4.39Å; F344-Y346 HydrophobicContact CB-CE2 3.65Å; F344-P390 HydrophobicContact CE2-CB 4.48Å; F344-P390 HydrophobicContact CE2-CG 4.03Å; F344-P390 HydrophobicContact CZ-CB 4.07Å; F344-P390 HydrophobicContact CZ-CG 3.89Å; F344-V397 HydrophobicContact CD1-CB 4.49Å; F344-V397 HydrophobicContact CD1-CG1 4.2Å; F344-D398 HydrophobicContact CE1-CB 4.19Å; F344-D398 HydrophobicContact CE2-CB 3.9Å; F344-D398 HydrophobicContact CZ-CB 3.68Å; F344-F401 HydrophobicContact CD2-CB 4.28Å; F344-F401 AromaticContact CD2-CD1 3.67Å; F344-F401 HydrophobicContact CD2-CD1 3.67Å; F344-F401 HydrophobicContact CD2-CE1 4.23Å; F344-F401 HydrophobicContact CD2-CG 4.05Å; F344-F401 HydrophobicContact CE2-CB 4.41Å; F344-F401 HydrophobicContact CE2-CD1 4.36Å; F344-F401 HydrophobicContact CE2-CG 4.32Å; F344-A426 HydrophobicContact CD1-CB 3.85Å; F344-A426 HydrophobicContact CE1-CB 4.16Å
345	I	98.2	Very high	96.8	Very high	9 Å²	9	30.3 Å²	30.3	5%	0.046	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.1	171.7	-57.8	-176.5	0	0	0	108.3	A131 I379 A424 W425	A131-I345 HydrophobicContact CB-CD1 4.17Å; I345-I379 HydrophobicContact CG2-CB 3.86Å; I345-I379 HydrophobicContact CG2-CD1 4.35Å; I345-I379 HydrophobicContact CG2-CG2 4.28Å; I345-A424 CarbonylContact O-C 3.21Å; I345-A424 WeakPolarHBondContact O-CA 3.45Å; I345-A424 WeakPolarHBondContact O-CB 3.29Å; I345-W425 HydrophobicContact CB-CD2 3.95Å; I345-W425 HydrophobicContact CB-CE3 4.26Å; I345-W425 HydrophobicContact CB-CH2 4.03Å; I345-W425 HydrophobicContact CB-CZ2 3.66Å; I345-W425 HydrophobicContact CB-CZ3 4.3Å; I345-W425 HydrophobicContact CD1-CZ2 3.57Å; I345-W425 HydrophobicContact CG1-CZ2 4.16Å; I345-W425 HydrophobicContact CG2-CD2 4.32Å; I345-W425 HydrophobicContact CG2-CE3 4.23Å; I345-W425 HydrophobicContact CG2-CH2 3.35Å; I345-W425 HydrophobicContact CG2-CZ2 3.42Å; I345-W425 VanDerWaalsContact CG2-CZ2 3.42Å; I345-W425 HydrophobicContact CG2-CZ3 3.77Å; I345-W425 PolarHBondContact N-O 3.02Å; I345-W425 PolarHBondContact O-N 3.04Å
346	Y	98.6	Very high	96.5	Very high	1 Å²	1	31.8 Å²	31.8	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.5	178.6	-55.8	-92.7	0	0	0	109.5	F344 I379 A380 V397 D398 F401 F402 I405 V421 A424	F344-Y346 HydrophobicContact CB-CE2 3.65Å; Y346-I379 CarbonylContact O-C 3.51Å; Y346-I379 WeakPolarHBondContact O-CA 3.46Å; Y346-A380 PolarHBondContact N-O 2.92Å; Y346-A380 PolarHBondContact O-N 2.92Å; Y346-V397 HydrophobicContact CE1-CG1 3.97Å; Y346-D398 PolarHBondContact OH-O 3.09Å; Y346-F401 HydrophobicContact CE2-CD1 4.43Å; Y346-F402 HydrophobicContact CD1-CB 4.08Å; Y346-F402 AromaticContact CD1-CD2 3.94Å; Y346-F402 HydrophobicContact CD1-CD2 3.94Å; Y346-F402 HydrophobicContact CD1-CG 4.24Å; Y346-F402 AromaticContact CD2-CD2 3.72Å; Y346-F402 HydrophobicContact CD2-CD2 3.72Å; Y346-F402 HydrophobicContact CD2-CE2 4.47Å; Y346-F402 HydrophobicContact CE1-CB 3.8Å; Y346-F402 HydrophobicContact CE1-CD2 4.41Å; Y346-F402 HydrophobicContact CE1-CG 4.45Å; Y346-F402 HydrophobicContact CE2-CB 4.34Å; Y346-F402 HydrophobicContact CE2-CD2 4.2Å; Y346-F402 HydrophobicContact CG-CB 4.48Å; Y346-F402 AromaticContact CG-CD2 3.57Å; Y346-F402 HydrophobicContact CG-CD2 3.57Å; Y346-F402 HydrophobicContact CG-CE2 4.23Å; Y346-F402 HydrophobicContact CG-CG 4.32Å; Y346-I405 HydrophobicContact CD2-CD1 3.78Å; Y346-I405 HydrophobicContact CE2-CD1 3.5Å; Y346-V421 HydrophobicContact CD1-CG1 4.28Å; Y346-A424 HydrophobicContact CD1-CB 3.57Å; Y346-A424 HydrophobicContact CE1-CB 4.03Å; Y346-A424 HydrophobicContact CG-CB 4.25Å
347	V	98.3	Very high	96.1	Very high	17 Å²	17	38 Å²	38	10%	0.103	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	118.1	166.5	-172.6	0	0	0	0	107.8	N377 Y378 I379 K422 S423 W425	V347-N377 HydrophobicContact CG1-CB 4.31Å; V347-Y378 CarbonylContact C-O 3.06Å; V347-Y378 WeakPolarHBondContact CA-O 3.41Å; V347-I379 HydrophobicContact CG2-CG2 4.24Å; V347-K422 HydrophobicContact CG1-CB 4.47Å; V347-K422 PolarHBondContact O-N 2.92Å; V347-S423 WeakPolarHBondContact CB-OG 3.45Å; V347-S423 WeakPolarHBondContact CG2-OG 3.49Å; V347-S423 PolarHBondContact N-O 3.29Å; V347-W425 HydrophobicContact CG2-CE3 4.33Å; V347-W425 HydrophobicContact CG2-CZ3 3.58Å
348	V	98.1	Very high	96	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.4	176.3	-58.8	0	0	0	0	110	N377 Y378 F402 L419 K420 V421	V348-N377 CarbonylContact O-C 3.54Å; V348-N377 VanDerWaalsContact O-CA 3.32Å; V348-N377 WeakPolarHBondContact O-CA 3.48Å; V348-Y378 HydrophobicContact CG2-CD2 4.28Å; V348-Y378 PolarHBondContact N-O 3.32Å; V348-Y378 PolarHBondContact O-N 3.31Å; V348-F402 HydrophobicContact CG1-CE2 3.81Å; V348-F402 HydrophobicContact CG1-CZ 3.66Å; V348-L419 HydrophobicContact CB-CB 4.44Å; V348-L419 HydrophobicContact CB-CD1 4.26Å; V348-L419 HydrophobicContact CB-CD2 4.17Å; V348-L419 HydrophobicContact CG1-CD1 4.04Å; V348-L419 HydrophobicContact CG1-CD2 4.24Å; V348-L419 HydrophobicContact CG2-CD2 4.17Å; V348-K420 CarbonylContact C-O 3.37Å; V348-K420 WeakPolarHBondContact CA-O 3.44Å; V348-V421 HydrophobicContact CG1-CG2 4.22Å
349	H	98	Very high	95.9	Very high	57 Å²	57	36.8 Å²	36.8	26%	0.264	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.2	174.8	-178.4	72.6	0	0	0	109.7	G375 G376 N377 L419 K420 K422	H349-G375 PolarHBondContact CE1-O 2.72Å; H349-G375 PolarHBondContact ND1-O 2.97Å; H349-G376 PolarHBondContact ND1-O 3.15Å; H349-N377 PolarHBondContact ND1-OD1 3.18Å; H349-L419 WeakPolarHBondContact O-CA 3.48Å; H349-K420 PolarHBondContact N-O 3.45Å; H349-K420 PolarHBondContact O-N 3.12Å; H349-K422 HydrophobicContact CB-CD 3.91Å; H349-K422 HydrophobicContact CB-CG 3.51Å
350	C	97.4	Very high	96	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.194	C	C	.	.			trans	-142.3	103.2	171.3	-179	0	0	0	0	108.9	N352 G353 G376 Y378 A415 F416 L419	C350-N352 PolarHBondContact O-N 3.33Å; C350-G353 PolarHBondContact O-N 3.48Å; C350-G353 PolarHBondContact SG-N 3.28Å; C350-G376 CarbonylContact C-O 3.23Å; C350-G376 PolarHBondContact N-O 2.88Å; C350-Y378 HydrophobicContact CB-CE2 4.19Å; C350-A415 PolarHBondContact SG-O 3.47Å; C350-F416 HydrophobicContact CB-CD1 3.76Å; C350-F416 HydrophobicContact CB-CE1 3.9Å; C350-L419 HydrophobicContact CB-CB 4.13Å
351	P	92.6	Very high	96	Very high	91 Å²	91	32.4 Å²	32.4	59%	0.591	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.8	-174.7	26.5	-34.2	0	0	0	113	G353	P351-G353 VanDerWaalsContact C-N 3.33Å
352	N	93.7	Very high	96.1	Very high	130 Å²	130	31.6 Å²	31.6	70%	0.695	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	11.1	176.8	-59.8	-25.9	0	0	0	112.4	C350 A415	C350-N352 PolarHBondContact O-N 3.33Å; N352-A415 WeakPolarHBondContact O-CB 3.39Å
353	G	95.1	Very high	96.1	Very high	19 Å²	19	31.2 Å²	31.2	20%	0.196	18%	0.183	C	C	.	.	S	Bend	trans	-76	-176.1	-179.1	0	0	0	0	0	113.7	C350 P351 Y378	C350-G353 PolarHBondContact O-N 3.48Å; C350-G353 PolarHBondContact SG-N 3.28Å; P351-G353 VanDerWaalsContact C-N 3.33Å; G353-Y378 VanDerWaalsContact CA-OH 3.29Å; G353-Y378 WeakPolarHBondContact CA-OH 3.38Å
354	P	95.4	Very high	96	Very high	3 Å²	3	34 Å²	34	2%	0.019	19%	0.194	C	C	.	.			trans	-55.2	136.4	-179.3	-29.1	39.1	0	0	0	115.6	W218 T358 F369 Y378 V413 F416	W218-P354 HydrophobicContact CD2-CB 3.75Å; W218-P354 HydrophobicContact CD2-CG 3.6Å; W218-P354 HydrophobicContact CE3-CB 4.18Å; W218-P354 HydrophobicContact CE3-CG 3.57Å; W218-P354 HydrophobicContact CG-CB 4.07Å; W218-P354 HydrophobicContact CG-CG 4.05Å; W218-P354 HydrophobicContact CH2-CB 4.5Å; W218-P354 HydrophobicContact CH2-CG 4.39Å; W218-P354 HydrophobicContact CZ2-CB 4.09Å; W218-P354 HydrophobicContact CZ2-CG 4.41Å; W218-P354 HydrophobicContact CZ3-CG 4Å; P354-T358 VanDerWaalsContact C-OG1 3.24Å; P354-T358 HydrophobicContact CB-CG2 3.7Å; P354-T358 WeakPolarHBondContact CB-OG1 3.42Å; P354-T358 HydrophobicContact CG-CG2 4.49Å; P354-T358 PolarHBondContact O-OG1 2.92Å; P354-F369 HydrophobicContact CG-CE2 4.33Å; P354-F369 HydrophobicContact CG-CZ 4.42Å; P354-Y378 HydrophobicContact CB-CE1 4.3Å; P354-Y378 VanDerWaalsContact N-OH 3.09Å; P354-Y378 PolarHBondContact O-OH 3.24Å; P354-V413 HydrophobicContact CG-CG1 3.62Å; P354-V413 HydrophobicContact CG-CG2 4.42Å; P354-F416 HydrophobicContact CG-CZ 4.37Å
355	G	92.1	Very high	95.9	Very high	42 Å²	42	35.4 Å²	35.4	43%	0.433	21%	0.205	S	C	.	.			trans	-75.9	-166.4	-175.1	0	0	0	0	0	115.6	D357 T358 R371	G355-D357 VanDerWaalsContact C-N 3.27Å; G355-D357 PolarHBondContact O-N 3.02Å; G355-T358 PolarHBondContact N-OG1 3.04Å; G355-T358 WeakPolarHBondContact O-CB 3.25Å; G355-T358 PolarHBondContact O-N 3.49Å; G355-T358 VanDerWaalsContact O-N 3.13Å; G355-T358 PolarHBondContact O-OG1 3.05Å; G355-R371 WeakPolarHBondContact O-CD 3.39Å
356	L	91	Very high	95.7	Very high	102 Å²	102	36.3 Å²	36.3	53%	0.534	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-35.5	-171.8	-71.2	168	0	0	0	114.6	S176 T358 R371 L374	S176-L356 PolarHBondContact OG-O 3.01Å; L356-T358 PolarHBondContact O-N 3.16Å; L356-R371 VanDerWaalsContact CD2-CZ 3.46Å; L356-L374 HydrophobicContact CD2-CD2 3.56Å
357	D	90	Very high	95.7	Very high	140 Å²	140	36.3 Å²	36.3	75%	0.749	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	10.7	-177.1	-54.9	-40.7	0	0	0	113.8	G355 P359	G355-D357 VanDerWaalsContact C-N 3.27Å; G355-D357 PolarHBondContact O-N 3.02Å; D357-P359 WeakPolarHBondContact O-CD 3.1Å
358	T	95.2	Very high	95.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.215	C	C	.	.			trans	-67.8	121.4	178.7	-54.6	0	0	0	0	110.1	S176 W218 W236 P354 G355 L356 F369	S176-T358 VanDerWaalsContact CB-O 3.24Å; S176-T358 WeakPolarHBondContact CB-O 3.34Å; W218-T358 HydrophobicContact CH2-CG2 4.09Å; W218-T358 HydrophobicContact CZ2-CG2 3.85Å; W236-T358 WeakPolarHBondContact CH2-O 3.25Å; P354-T358 VanDerWaalsContact C-OG1 3.24Å; P354-T358 HydrophobicContact CB-CG2 3.7Å; P354-T358 WeakPolarHBondContact CB-OG1 3.42Å; P354-T358 HydrophobicContact CG-CG2 4.49Å; P354-T358 PolarHBondContact O-OG1 2.92Å; G355-T358 PolarHBondContact N-OG1 3.04Å; G355-T358 WeakPolarHBondContact O-CB 3.25Å; G355-T358 PolarHBondContact O-N 3.49Å; G355-T358 VanDerWaalsContact O-N 3.13Å; G355-T358 PolarHBondContact O-OG1 3.05Å; L356-T358 PolarHBondContact O-N 3.16Å; T358-F369 HydrophobicContact CG2-CE2 3.69Å; T358-F369 HydrophobicContact CG2-CZ 4.22Å
359	P	96.7	Very high	95.7	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	22%	0.215	C	C	.	.			trans	-70.2	169.8	175.3	27.4	-31.6	0	0	0	112	S176 G177 L179 Y229 D357 L361	S176-P359 WeakPolarHBondContact O-CA 3.28Å; S176-P359 WeakPolarHBondContact O-CB 3.33Å; G177-P359 WeakPolarHBondContact O-CA 3.08Å; G177-P359 WeakPolarHBondContact O-CB 3.49Å; L179-P359 HydrophobicContact CB-CB 3.82Å; L179-P359 HydrophobicContact CB-CG 3.5Å; L179-P359 VanDerWaalsContact CB-CG 3.5Å; L179-P359 HydrophobicContact CD2-CG 3.73Å; L179-P359 HydrophobicContact CG-CG 4.27Å; Y229-P359 HydrophobicContact CE2-CB 3.95Å; Y229-P359 HydrophobicContact CE2-CG 4.31Å; D357-P359 WeakPolarHBondContact O-CD 3.1Å; P359-L361 PolarHBondContact O-N 3.36Å; P359-L361 VanDerWaalsContact O-N 3.08Å
360	F	98	Very high	95.7	Very high	6 Å²	6	34.5 Å²	34.5	3%	0.026	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	105.1	157.7	-157.7	-51	0	0	0	107.7	A131 G177 Y178 L179 W236 Y368 R370	A131-F360 HydrophobicContact CB-CE2 4.1Å; A131-F360 HydrophobicContact CB-CZ 3.95Å; G177-F360 PolarHBondContact O-N 3.13Å; Y178-F360 CarbonylContact C-O 3.56Å; Y178-F360 WeakPolarHBondContact CA-O 3.43Å; Y178-F360 HydrophobicContact CD1-CB 3.92Å; Y178-F360 HydrophobicContact CD1-CD1 4.15Å; Y178-F360 HydrophobicContact CD1-CG 4.15Å; Y178-F360 HydrophobicContact CD2-CB 3.69Å; Y178-F360 HydrophobicContact CD2-CG 4.21Å; Y178-F360 HydrophobicContact CE1-CB 3.82Å; Y178-F360 AromaticContact CE1-CD1 3.4Å; Y178-F360 HydrophobicContact CE1-CD1 3.4Å; Y178-F360 HydrophobicContact CE1-CD2 4.18Å; Y178-F360 AromaticContact CE1-CE1 3.96Å; Y178-F360 HydrophobicContact CE1-CE1 3.96Å; Y178-F360 AromaticContact CE1-CG 3.53Å; Y178-F360 HydrophobicContact CE1-CG 3.53Å; Y178-F360 HydrophobicContact CE2-CB 3.61Å; Y178-F360 HydrophobicContact CE2-CD1 4.34Å; Y178-F360 AromaticContact CE2-CD2 3.65Å; Y178-F360 HydrophobicContact CE2-CD2 3.65Å; Y178-F360 HydrophobicContact CE2-CE2 4.42Å; Y178-F360 AromaticContact CE2-CG 3.62Å; Y178-F360 HydrophobicContact CE2-CG 3.62Å; Y178-F360 HydrophobicContact CG-CB 3.86Å; Y178-F360 HydrophobicContact CG-CG 4.45Å; Y178-F360 AromaticContact CZ-CD1 3.52Å; Y178-F360 AromaticContact CZ-CD2 3.42Å; Y178-F360 VanDerWaalsContact CZ-CD2 3.42Å; Y178-F360 AromaticContact CZ-CE1 3.95Å; Y178-F360 AromaticContact CZ-CE2 3.88Å; Y178-F360 AromaticContact CZ-CG 3.23Å; Y178-F360 WeakPolarHBondContact OH-CD2 2.88Å; Y178-F360 WeakPolarHBondContact OH-CE1 3.5Å; Y178-F360 WeakPolarHBondContact OH-CE2 3.47Å; Y178-F360 WeakPolarHBondContact OH-CG 3.25Å; Y178-F360 VanDerWaalsContact OH-CZ 3.31Å; Y178-F360 WeakPolarHBondContact OH-CZ 3.38Å; L179-F360 PolarHBondContact N-O 2.86Å; W236-F360 HydrophobicContact CB-CD2 4.27Å; W236-F360 HydrophobicContact CE3-CB 4.06Å; W236-F360 HydrophobicContact CE3-CD2 4.28Å; W236-F360 HydrophobicContact CZ3-CB 4.32Å; F360-Y368 AromaticContact CE1-CD2 3.54Å; F360-Y368 HydrophobicContact CE1-CD2 3.54Å; F360-Y368 HydrophobicContact CE1-CE2 4.37Å; F360-Y368 HydrophobicContact CE1-CG 4.03Å; F360-Y368 AromaticContact CZ-CD2 3.78Å; F360-Y368 HydrophobicContact CZ-CD2 3.78Å; F360-Y368 HydrophobicContact CZ-CE2 4.16Å; F360-R370 HydrophobicContact CB-CB 4.17Å; F360-R370 HydrophobicContact CD1-CB 4.35Å; F360-R370 HydrophobicContact CD2-CB 3.71Å; F360-R370 HydrophobicContact CD2-CG 3.78Å; F360-R370 HydrophobicContact CE2-CB 4.14Å; F360-R370 HydrophobicContact CE2-CG 3.74Å; F360-R370 HydrophobicContact CG-CB 3.82Å; F360-R370 HydrophobicContact CG-CG 4.35Å; F360-R370 HydrophobicContact CZ-CG 4.29Å
361	L	98.3	Very high	95.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	137	-175.6	-175	152.6	0	0	0	110.4	L179 L181 W218 I219 P359 D363 Y368 F369 R412	L179-L361 HydrophobicContact CD2-CD1 4.06Å; L179-L361 HydrophobicContact CD2-CG 4.46Å; L179-L361 CarbonylContact O-C 3.58Å; L179-L361 WeakPolarHBondContact O-CA 3.38Å; L181-L361 HydrophobicContact CD1-CD1 4.27Å; L181-L361 HydrophobicContact CD1-CD2 4.27Å; L181-L361 HydrophobicContact CD1-CG 4.46Å; W218-L361 HydrophobicContact CH2-CD1 3.9Å; W218-L361 HydrophobicContact CZ3-CD1 4.15Å; I219-L361 HydrophobicContact CD1-CD1 3.72Å; P359-L361 PolarHBondContact O-N 3.36Å; P359-L361 VanDerWaalsContact O-N 3.08Å; L361-D363 HydrophobicContact CD2-CB 4.25Å; L361-Y368 CarbonylContact O-C 3.59Å; L361-Y368 WeakPolarHBondContact O-CA 3.42Å; L361-Y368 VanDerWaalsContact O-CB 3.28Å; L361-Y368 WeakPolarHBondContact O-CB 3.48Å; L361-F369 HydrophobicContact CB-CD1 4.07Å; L361-F369 HydrophobicContact CB-CE1 3.74Å; L361-F369 HydrophobicContact CB-CZ 4.13Å; L361-F369 HydrophobicContact CD1-CE1 3.8Å; L361-F369 HydrophobicContact CD1-CZ 4.14Å; L361-F369 HydrophobicContact CD2-CD1 4.09Å; L361-F369 HydrophobicContact CD2-CE1 3.78Å; L361-F369 HydrophobicContact CG-CE1 3.98Å; L361-F369 PolarHBondContact N-O 3.31Å; L361-F369 PolarHBondContact O-N 3.02Å; L361-R412 HydrophobicContact CD1-CG 4.33Å; L361-R412 HydrophobicContact CD2-CG 4.3Å
362	V	98.3	Very high	95.7	Very high	7 Å²	7	34.6 Å²	34.6	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	121.8	167.6	170	0	0	0	0	108.2	Y178 L179 F180 L181 V504	Y178-V362 HydrophobicContact CE1-CG2 4.32Å; L179-V362 PolarHBondContact O-N 3.49Å; F180-V362 HydrophobicContact CD1-CB 3.74Å; F180-V362 HydrophobicContact CD1-CG1 3.64Å; F180-V362 HydrophobicContact CD1-CG2 4.25Å; F180-V362 HydrophobicContact CE1-CB 4.08Å; F180-V362 HydrophobicContact CE1-CG1 3.95Å; F180-V362 HydrophobicContact CE1-CG2 4.11Å; F180-V362 HydrophobicContact CG-CB 4.2Å; F180-V362 HydrophobicContact CZ-CG2 4.45Å; L181-V362 PolarHBondContact N-O 3.21Å; V362-V504 HydrophobicContact CB-CG2 4Å; V362-V504 HydrophobicContact CG1-CG2 3.06Å; V362-V504 HydrophobicContact CG2-CG2 3.75Å
363	D	97.9	Very high	95.4	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.037	19%	0.187	C	C	.	.			trans	-88.7	152.6	171.3	-167.8	72.8	0	0	0	111.3	L181 L361 S365 G366 V367 R412	L181-D363 WeakPolarHBondContact CD1-OD1 3.46Å; L361-D363 HydrophobicContact CD2-CB 4.25Å; D363-S365 PolarHBondContact O-N 3.45Å; D363-S365 VanDerWaalsContact O-N 3.13Å; D363-S365 VanDerWaalsContact OD2-CB 3.23Å; D363-S365 WeakPolarHBondContact OD2-CB 3.37Å; D363-S365 PolarHBondContact OD2-N 3.09Å; D363-S365 PolarHBondContact OD2-OG 2.9Å; D363-G366 PolarHBondContact O-N 2.84Å; D363-V367 HydrophobicContact CB-CG2 3.79Å; D363-V367 PolarHBondContact N-O 2.9Å; D363-R412 IonicContact OD1-CZ 2.73Å; D363-R412 IonicContact OD1-NE 2.85Å; D363-R412 PolarHBondContact OD1-NE 3.25Å; D363-R412 IonicContact OD1-NH2 3.15Å; D363-R412 PolarHBondContact OD1-NH2 3.31Å; D363-R412 IonicContact OD2-NH2 2.76Å
364	Y	95.7	Very high	95	Very high	76 Å²	76	36.7 Å²	36.7	30%	0.298	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.7	174.5	55.8	-105.1	0	0	0	113.3	L181 S183 V224 G366 R412	L181-Y364 HydrophobicContact CB-CD1 4.23Å; L181-Y364 WeakPolarHBondContact O-CB 3.36Å; S183-Y364 VanDerWaalsContact N-CD1 3.26Å; V224-Y364 HydrophobicContact CG2-CE1 3.91Å; Y364-G366 PolarHBondContact O-N 2.52Å; Y364-R412 VanDerWaalsContact CZ-NH2 3.34Å; Y364-R412 PolarHBondContact OH-NH2 3.48Å; Y364-R412 VanDerWaalsContact OH-NH2 3.12Å
365	S	95.4	Very high	94.5	Very high	35 Å²	35	38.9 Å²	38.9	25%	0.245	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.1	170.4	86.9	0	0	0	0	113.5	D363 H408	D363-S365 PolarHBondContact O-N 3.45Å; D363-S365 VanDerWaalsContact O-N 3.13Å; D363-S365 VanDerWaalsContact OD2-CB 3.23Å; D363-S365 WeakPolarHBondContact OD2-CB 3.37Å; D363-S365 PolarHBondContact OD2-N 3.09Å; D363-S365 PolarHBondContact OD2-OG 2.9Å; S365-H408 WeakPolarHBondContact OG-CB 3.42Å
366	G	95.1	Very high	94.6	Very high	27 Å²	27	37.4 Å²	37.4	28%	0.278	22%	0.222	S	C	.	.	S	Bend	trans	89.9	-9.8	-177.7	0	0	0	0	0	114.7	D363 Y364	D363-G366 PolarHBondContact O-N 2.84Å; Y364-G366 PolarHBondContact O-N 2.52Å
367	V	97.6	Very high	94.9	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	21%	0.208	C	C	.	.			trans	-72.7	142.3	172.1	-59.9	0	0	0	0	110.7	D363 G381 M382 I405 H408 L409	D363-V367 HydrophobicContact CB-CG2 3.79Å; D363-V367 PolarHBondContact N-O 2.9Å; V367-G381 WeakPolarHBondContact CA-O 3.44Å; V367-M382 HydrophobicContact CG1-CB 4.22Å; V367-M382 HydrophobicContact CG1-CG 4.27Å; V367-M382 HydrophobicContact CG1-SD 3.6Å; V367-M382 VanDerWaalsContact CG1-SD 3.6Å; V367-I405 HydrophobicContact CG1-CG2 3.96Å; V367-H408 HydrophobicContact CB-CB 4.27Å; V367-H408 HydrophobicContact CG1-CB 3.58Å; V367-H408 HydrophobicContact CG2-CB 3.67Å; V367-L409 HydrophobicContact CB-CD2 4.37Å; V367-L409 HydrophobicContact CG2-CD2 4.23Å
368	Y	98.2	Very high	95.2	Very high	21 Å²	21	28.3 Å²	28.3	8%	0.082	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	156	171.1	68.6	-95.2	0	0	0	110.8	A131 F360 L361 A380 G381	A131-Y368 HydrophobicContact CB-CE2 4.38Å; F360-Y368 AromaticContact CE1-CD2 3.54Å; F360-Y368 HydrophobicContact CE1-CD2 3.54Å; F360-Y368 HydrophobicContact CE1-CE2 4.37Å; F360-Y368 HydrophobicContact CE1-CG 4.03Å; F360-Y368 AromaticContact CZ-CD2 3.78Å; F360-Y368 HydrophobicContact CZ-CD2 3.78Å; F360-Y368 HydrophobicContact CZ-CE2 4.16Å; L361-Y368 CarbonylContact O-C 3.59Å; L361-Y368 WeakPolarHBondContact O-CA 3.42Å; L361-Y368 VanDerWaalsContact O-CB 3.28Å; L361-Y368 WeakPolarHBondContact O-CB 3.48Å; Y368-A380 VanDerWaalsContact O-CA 3.22Å; Y368-A380 WeakPolarHBondContact O-CA 3.43Å; Y368-A380 WeakPolarHBondContact O-CB 3.4Å; Y368-G381 VanDerWaalsContact CD1-O 3.24Å; Y368-G381 WeakPolarHBondContact CD1-O 3.5Å; Y368-G381 WeakPolarHBondContact CE1-O 3.12Å; Y368-G381 PolarHBondContact N-O 2.96Å; Y368-G381 PolarHBondContact O-N 2.96Å; Y368-G381 VanDerWaalsContact O-N 3.14Å
369	F	98.3	Very high	95.4	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.009	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	156.7	166.1	75.5	-84	0	0	0	111.9	W218 P354 T358 L361 Y378 I379 A380 L409 V413 F416	W218-F369 HydrophobicContact CH2-CZ 4.03Å; W218-F369 AromaticContact CZ3-CZ 3.96Å; W218-F369 HydrophobicContact CZ3-CZ 3.96Å; P354-F369 HydrophobicContact CG-CE2 4.33Å; P354-F369 HydrophobicContact CG-CZ 4.42Å; T358-F369 HydrophobicContact CG2-CE2 3.69Å; T358-F369 HydrophobicContact CG2-CZ 4.22Å; L361-F369 HydrophobicContact CB-CD1 4.07Å; L361-F369 HydrophobicContact CB-CE1 3.74Å; L361-F369 HydrophobicContact CB-CZ 4.13Å; L361-F369 HydrophobicContact CD1-CE1 3.8Å; L361-F369 HydrophobicContact CD1-CZ 4.14Å; L361-F369 HydrophobicContact CD2-CD1 4.09Å; L361-F369 HydrophobicContact CD2-CE1 3.78Å; L361-F369 HydrophobicContact CG-CE1 3.98Å; L361-F369 PolarHBondContact N-O 3.31Å; L361-F369 PolarHBondContact O-N 3.02Å; F369-Y378 AromaticContact CD2-CD1 3.97Å; F369-Y378 HydrophobicContact CD2-CD1 3.97Å; F369-Y378 HydrophobicContact CE2-CD1 4.2Å; F369-I379 CarbonylContact C-O 3.57Å; F369-I379 WeakPolarHBondContact CA-O 3.22Å; F369-I379 WeakPolarHBondContact CB-O 3.27Å; F369-A380 HydrophobicContact CB-CB 3.9Å; F369-L409 HydrophobicContact CB-CD2 4.18Å; F369-L409 HydrophobicContact CD1-CD2 3.92Å; F369-L409 HydrophobicContact CG-CD2 4.36Å; F369-V413 HydrophobicContact CE1-CG2 3.72Å; F369-V413 HydrophobicContact CZ-CG2 3.61Å; F369-F416 HydrophobicContact CD1-CE2 4.19Å; F369-F416 AromaticContact CD2-CE2 3.85Å; F369-F416 HydrophobicContact CD2-CE2 3.85Å; F369-F416 AromaticContact CD2-CZ 3.99Å; F369-F416 HydrophobicContact CD2-CZ 3.99Å; F369-F416 HydrophobicContact CE1-CE2 4.14Å; F369-F416 AromaticContact CE2-CE2 3.81Å; F369-F416 HydrophobicContact CE2-CE2 3.81Å; F369-F416 AromaticContact CE2-CZ 3.87Å; F369-F416 HydrophobicContact CE2-CZ 3.87Å; F369-F416 HydrophobicContact CG-CE2 4.05Å; F369-F416 AromaticContact CZ-CE2 3.98Å; F369-F416 HydrophobicContact CZ-CE2 3.98Å; F369-F416 HydrophobicContact CZ-CZ 4.39Å
370	R	97.3	Very high	95.4	Very high	14 Å²	14	28.2 Å²	28.2	5%	0.053	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	162.6	165.9	63.6	147.8	-179.7	82.8	-1.8	109.9	A131 W236 F360 E372 Y378 I379	A131-R370 VanDerWaalsContact O-CZ 3.3Å; A131-R370 PolarHBondContact O-NE 2.55Å; A131-R370 PolarHBondContact O-NH2 3.13Å; W236-R370 VanDerWaalsContact CD1-CD 3.46Å; W236-R370 HydrophobicContact CD2-CB 4.33Å; W236-R370 HydrophobicContact CD2-CG 4.44Å; W236-R370 HydrophobicContact CE3-CB 4.19Å; W236-R370 HydrophobicContact CH2-CB 4.46Å; W236-R370 HydrophobicContact CZ3-CB 4.26Å; F360-R370 HydrophobicContact CB-CB 4.17Å; F360-R370 HydrophobicContact CD1-CB 4.35Å; F360-R370 HydrophobicContact CD2-CB 3.71Å; F360-R370 HydrophobicContact CD2-CG 3.78Å; F360-R370 HydrophobicContact CE2-CB 4.14Å; F360-R370 HydrophobicContact CE2-CG 3.74Å; F360-R370 HydrophobicContact CG-CB 3.82Å; F360-R370 HydrophobicContact CG-CG 4.35Å; F360-R370 HydrophobicContact CZ-CG 4.29Å; R370-E372 IonicContact CZ-OE2 2.72Å; R370-E372 IonicContact NH1-OE2 3.24Å; R370-E372 PolarHBondContact NH1-OE2 2.65Å; R370-E372 IonicContact NH2-OE2 3.52Å; R370-E372 PolarHBondContact NH2-OE2 2.85Å; R370-Y378 CarbonylContact O-C 3.49Å; R370-Y378 WeakPolarHBondContact O-CA 3.35Å; R370-Y378 WeakPolarHBondContact O-CB 3.25Å; R370-I379 HydrophobicContact CG-CD1 3.78Å; R370-I379 HydrophobicContact CG-CG1 3.38Å; R370-I379 PolarHBondContact N-O 3.34Å; R370-I379 VanDerWaalsContact NE-CD1 3.34Å; R370-I379 VanDerWaalsContact NH2-CD1 3.34Å; R370-I379 PolarHBondContact O-N 2.86Å
371	R	95.5	Very high	95.4	Very high	13 Å²	13	28 Å²	28	5%	0.049	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	149.4	173.1	-85	172.1	29.5	84.5	19.2	112.1	W236 G355 L356 G373 Y378	W236-R371 HydrophobicContact CH2-CB 4.34Å; W236-R371 HydrophobicContact CZ2-CB 3.97Å; G355-R371 WeakPolarHBondContact O-CD 3.39Å; L356-R371 VanDerWaalsContact CD2-CZ 3.46Å; R371-G373 PolarHBondContact NH2-O 3.27Å; R371-Y378 HydrophobicContact CB-CD1 4.47Å; R371-Y378 HydrophobicContact CG-CD1 3.78Å; R371-Y378 HydrophobicContact CG-CE1 3.55Å
372	E	94.2	Very high	95.3	Very high	80 Å²	80	29 Å²	29	37%	0.374	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	114.9	172.3	-178.6	55.5	-138.4	0	0	109.2	R370 N377 I379	R370-E372 IonicContact CZ-OE2 2.72Å; R370-E372 IonicContact NH1-OE2 3.24Å; R370-E372 PolarHBondContact NH1-OE2 2.65Å; R370-E372 IonicContact NH2-OE2 3.52Å; R370-E372 PolarHBondContact NH2-OE2 2.85Å; E372-N377 HydrophobicContact CB-CB 4.15Å; E372-N377 PolarHBondContact N-O 2.98Å; E372-N377 WeakPolarHBondContact O-CB 3.36Å; E372-I379 HydrophobicContact CB-CG2 4.16Å; E372-I379 HydrophobicContact CG-CG2 4.32Å
373	G	88.6	Confident	95.2	Very high	46 Å²	46	30.5 Å²	30.5	47%	0.474	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	-159.9	-173.3	0	0	0	0	0	114.3	R371	R371-G373 PolarHBondContact NH2-O 3.27Å
374	L	86.7	Confident	95	Very high	146 Å²	146	30.7 Å²	30.7	76%	0.764	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-18	-176.7	-58.8	179.3	0	0	0	113.9	L356 G376	L356-L374 HydrophobicContact CD2-CD2 3.56Å; L374-G376 PolarHBondContact O-N 3.2Å
375	G	85.1	Confident	94.8	Very high	49 Å²	49	33.2 Å²	33.2	51%	0.505	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	38.4	-166.1	0	0	0	0	0	116.2	H349 N377	H349-G375 PolarHBondContact CE1-O 2.72Å; H349-G375 PolarHBondContact ND1-O 2.97Å; G375-N377 VanDerWaalsContact C-N 3.27Å; G375-N377 PolarHBondContact O-N 2.72Å
376	G	93.1	Very high	94.6	Very high	11 Å²	11	36.1 Å²	36.1	11%	0.113	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	27.9	178.3	0	0	0	0	0	114.4	H349 C350 L374 Y378	H349-G376 PolarHBondContact ND1-O 3.15Å; C350-G376 CarbonylContact C-O 3.23Å; C350-G376 PolarHBondContact N-O 2.88Å; L374-G376 PolarHBondContact O-N 3.2Å; G376-Y378 WeakPolarHBondContact O-CE2 3.47Å
377	N	96.9	Very high	94.5	Very high	48 Å²	48	42.9 Å²	42.9	26%	0.257	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	151.4	168.6	-53.3	-50.9	0	0	0	109.9	V347 V348 H349 E372 G375	V347-N377 HydrophobicContact CG1-CB 4.31Å; V348-N377 CarbonylContact O-C 3.54Å; V348-N377 VanDerWaalsContact O-CA 3.32Å; V348-N377 WeakPolarHBondContact O-CA 3.48Å; H349-N377 PolarHBondContact ND1-OD1 3.18Å; E372-N377 HydrophobicContact CB-CB 4.15Å; E372-N377 PolarHBondContact N-O 2.98Å; E372-N377 WeakPolarHBondContact O-CB 3.36Å; G375-N377 VanDerWaalsContact C-N 3.27Å; G375-N377 PolarHBondContact O-N 2.72Å
378	Y	98	Very high	94.2	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.3	177.7	-48.7	-95.7	0	0	0	108.1	V347 V348 C350 G353 P354 F369 R370 R371 G376 F416	V347-Y378 CarbonylContact C-O 3.06Å; V347-Y378 WeakPolarHBondContact CA-O 3.41Å; V348-Y378 HydrophobicContact CG2-CD2 4.28Å; V348-Y378 PolarHBondContact N-O 3.32Å; V348-Y378 PolarHBondContact O-N 3.31Å; C350-Y378 HydrophobicContact CB-CE2 4.19Å; G353-Y378 VanDerWaalsContact CA-OH 3.29Å; G353-Y378 WeakPolarHBondContact CA-OH 3.38Å; P354-Y378 HydrophobicContact CB-CE1 4.3Å; P354-Y378 VanDerWaalsContact N-OH 3.09Å; P354-Y378 PolarHBondContact O-OH 3.24Å; F369-Y378 AromaticContact CD2-CD1 3.97Å; F369-Y378 HydrophobicContact CD2-CD1 3.97Å; F369-Y378 HydrophobicContact CE2-CD1 4.2Å; R370-Y378 CarbonylContact O-C 3.49Å; R370-Y378 WeakPolarHBondContact O-CA 3.35Å; R370-Y378 WeakPolarHBondContact O-CB 3.25Å; R371-Y378 HydrophobicContact CB-CD1 4.47Å; R371-Y378 HydrophobicContact CG-CD1 3.78Å; R371-Y378 HydrophobicContact CG-CE1 3.55Å; G376-Y378 WeakPolarHBondContact O-CE2 3.47Å; Y378-F416 AromaticContact CD1-CZ 3.92Å; Y378-F416 HydrophobicContact CD1-CZ 3.92Å; Y378-F416 AromaticContact CD2-CE1 3.78Å; Y378-F416 HydrophobicContact CD2-CE1 3.78Å; Y378-F416 AromaticContact CD2-CZ 3.84Å; Y378-F416 HydrophobicContact CD2-CZ 3.84Å; Y378-F416 HydrophobicContact CE1-CE1 4.39Å; Y378-F416 HydrophobicContact CE1-CZ 4.08Å; Y378-F416 AromaticContact CE2-CE1 3.66Å; Y378-F416 HydrophobicContact CE2-CE1 3.66Å; Y378-F416 HydrophobicContact CE2-CZ 4.03Å; Y378-F416 HydrophobicContact CG-CE1 4.24Å; Y378-F416 AromaticContact CG-CZ 3.81Å; Y378-F416 HydrophobicContact CG-CZ 3.81Å
379	I	97.7	Very high	94.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	141.2	161.5	61.7	155.6	0	0	0	108.3	A131 I345 Y346 V347 F369 R370 E372 W425	A131-I379 HydrophobicContact CB-CD1 3.5Å; I345-I379 HydrophobicContact CG2-CB 3.86Å; I345-I379 HydrophobicContact CG2-CD1 4.35Å; I345-I379 HydrophobicContact CG2-CG2 4.28Å; Y346-I379 CarbonylContact O-C 3.51Å; Y346-I379 WeakPolarHBondContact O-CA 3.46Å; V347-I379 HydrophobicContact CG2-CG2 4.24Å; F369-I379 CarbonylContact C-O 3.57Å; F369-I379 WeakPolarHBondContact CA-O 3.22Å; F369-I379 WeakPolarHBondContact CB-O 3.27Å; R370-I379 HydrophobicContact CG-CD1 3.78Å; R370-I379 HydrophobicContact CG-CG1 3.38Å; R370-I379 PolarHBondContact N-O 3.34Å; R370-I379 VanDerWaalsContact NE-CD1 3.34Å; R370-I379 VanDerWaalsContact NH2-CD1 3.34Å; R370-I379 PolarHBondContact O-N 2.86Å; E372-I379 HydrophobicContact CB-CG2 4.16Å; E372-I379 HydrophobicContact CG-CG2 4.32Å; I379-W425 HydrophobicContact CG2-CH2 3.75Å; I379-W425 HydrophobicContact CG2-CZ3 4.23Å
380	A	98.3	Very high	94	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.7	177.8	0	0	0	0	0	111	Y346 Y368 F369 L409	Y346-A380 PolarHBondContact N-O 2.92Å; Y346-A380 PolarHBondContact O-N 2.92Å; Y368-A380 VanDerWaalsContact O-CA 3.22Å; Y368-A380 WeakPolarHBondContact O-CA 3.43Å; Y368-A380 WeakPolarHBondContact O-CB 3.4Å; F369-A380 HydrophobicContact CB-CB 3.9Å; A380-L409 HydrophobicContact CB-CD1 3.73Å; A380-L409 HydrophobicContact CB-CD2 4.32Å
381	G	97.6	Very high	93.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	173.9	179.3	0	0	0	0	0	111.7	V367 Y368	V367-G381 WeakPolarHBondContact CA-O 3.44Å; Y368-G381 VanDerWaalsContact CD1-O 3.24Å; Y368-G381 WeakPolarHBondContact CD1-O 3.5Å; Y368-G381 WeakPolarHBondContact CE1-O 3.12Å; Y368-G381 PolarHBondContact N-O 2.96Å; Y368-G381 PolarHBondContact O-N 2.96Å; Y368-G381 VanDerWaalsContact O-N 3.14Å
382	M	96.4	Very high	93.9	Very high	24 Å²	24	59 Å²	59	12%	0.118	32%	0.322	C	S	.	.			trans	-153.7	145.8	172.9	-171.5	166.8	71.9	0	0	106.8	V367 F401 N404 I405	V367-M382 HydrophobicContact CG1-CB 4.22Å; V367-M382 HydrophobicContact CG1-CG 4.27Å; V367-M382 HydrophobicContact CG1-SD 3.6Å; V367-M382 VanDerWaalsContact CG1-SD 3.6Å; M382-F401 HydrophobicContact CB-CE1 4.41Å; M382-F401 HydrophobicContact CE-CZ 4.13Å; M382-F401 WeakPolarHBondContact O-CE1 3.38Å; M382-N404 HydrophobicContact CE-CB 3.82Å; M382-I405 HydrophobicContact CB-CD1 4.14Å; M382-I405 HydrophobicContact CB-CG1 3.85Å; M382-I405 HydrophobicContact CE-CG1 4.27Å
383	S	94.8	Very high	93.8	Very high	38 Å²	38	60.6 Å²	60.6	27%	0.266	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-74.2	136.4	170.1	-67.3	0	0	0	0	109.2	R343	R343-S383 PolarHBondContact NE-OG 2.84Å
384	P	94.3	Very high	94.1	Very high	10 Å²	10	60.9 Å²	60.9	7%	0.065	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-57.6	152.7	164.4	-21.7	33.8	0	0	0	111	P390 F401	P384-P390 HydrophobicContact CG-CG 4.34Å; P384-F401 HydrophobicContact CB-CE2 4.21Å; P384-F401 HydrophobicContact CB-CZ 4.25Å; P384-F401 HydrophobicContact CG-CE1 4.49Å; P384-F401 HydrophobicContact CG-CE2 4.18Å; P384-F401 HydrophobicContact CG-CZ 3.93Å
385	E	92	Very high	94.5	Very high	129 Å²	129	56 Å²	56	60%	0.603	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-65.8	155.4	169.5	-62.9	-63.8	160.7	0	0	110.3	E387 E388 E389	E385-E387 PolarHBondContact O-N 3.25Å; E385-E388 HydrophobicContact CB-CG 4.48Å; E385-E388 CarbonylContact O-C 3.55Å; E385-E388 PolarHBondContact O-N 3.32Å; E385-E389 PolarHBondContact O-N 2.97Å
386	E	90.4	Very high	95.1	Very high	97 Å²	97	60 Å²	60	45%	0.453	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-58.2	-36.3	-174.6	-172.9	67.6	-149.4	0	0	112.2	R341 E388	R341-E386 IonicContact CZ-OE1 3.46Å; R341-E386 VanDerWaalsContact CZ-OE1 3.27Å; R341-E386 IonicContact NH1-OE1 3.99Å; R341-E386 PolarHBondContact NH1-OE1 2.89Å; R341-E386 IonicContact NH1-OE2 2.84Å; R341-E386 PolarHBondContact NH1-OE2 2.91Å; R341-E386 VanDerWaalsContact NH1-OE2 3.15Å; R341-E386 IonicContact NH2-OE1 3.62Å; R341-E386 PolarHBondContact NH2-OE1 2.97Å; E386-E388 VanDerWaalsContact C-N 3.28Å; E386-E388 PolarHBondContact O-N 3.04Å
387	E	92.7	Very high	95.3	Very high	168 Å²	168	60.9 Å²	60.9	79%	0.785	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-75.5	-15	177.9	-60.4	78	-167.4	0	0	113.9	E385	E385-E387 PolarHBondContact O-N 3.25Å
388	E	92.9	Very high	95.3	Very high	121 Å²	121	62 Å²	62	57%	0.565	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-112	17.7	-174.9	-59.4	-169.6	152.1	0	0	112.5	E385 E386 P390	E385-E388 HydrophobicContact CB-CG 4.48Å; E385-E388 CarbonylContact O-C 3.55Å; E385-E388 PolarHBondContact O-N 3.32Å; E386-E388 VanDerWaalsContact C-N 3.28Å; E386-E388 PolarHBondContact O-N 3.04Å; E388-P390 WeakPolarHBondContact O-CD 3.5Å
389	E	95.1	Very high	95.3	Very high	42 Å²	42	67.9 Å²	67.9	20%	0.196	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.6	123.4	-175.9	-78.6	-90.7	-151.1	0	0	112.2	R341 R343 E385	R341-E389 WeakPolarHBondContact CD-OE1 3.45Å; R341-E389 IonicContact CZ-OE1 2.9Å; R341-E389 IonicContact NE-OE1 3.79Å; R341-E389 IonicContact NH1-OE1 3.15Å; R341-E389 PolarHBondContact NH1-OE1 3.27Å; R343-E389 IonicContact CZ-OE1 2.67Å; R343-E389 IonicContact CZ-OE2 3.47Å; R343-E389 IonicContact NH1-OE1 3.27Å; R343-E389 PolarHBondContact NH1-OE1 3.06Å; R343-E389 IonicContact NH1-OE2 3.18Å; R343-E389 PolarHBondContact NH1-OE2 3.26Å; R343-E389 IonicContact NH2-OE1 2.84Å; R343-E389 PolarHBondContact NH2-OE1 3.32Å; R343-E389 IonicContact NH2-OE2 2.67Å; E385-E389 PolarHBondContact O-N 2.97Å
390	P	95.9	Very high	95.2	Very high	30 Å²	30	75.4 Å²	75.4	20%	0.195	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-75.5	154.5	-172.6	28.7	-34.9	0	0	0	112.5	K342 F344 P384 E388	K342-P390 HydrophobicContact CB-CG 4.03Å; K342-P390 HydrophobicContact CG-CG 4.39Å; F344-P390 HydrophobicContact CE2-CB 4.48Å; F344-P390 HydrophobicContact CE2-CG 4.03Å; F344-P390 HydrophobicContact CZ-CB 4.07Å; F344-P390 HydrophobicContact CZ-CG 3.89Å; P384-P390 HydrophobicContact CG-CG 4.34Å; E388-P390 WeakPolarHBondContact O-CD 3.5Å
391	E	94.9	Very high	95.2	Very high	139 Å²	139	76.1 Å²	76.1	65%	0.65	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-57.3	142.6	178.4	-64.4	-172.6	178.7	0	0	113	K342 N393	K342-E391 WeakPolarHBondContact CE-O 3.42Å; K342-E391 PolarHBondContact NZ-O 2.92Å; E391-N393 PolarHBondContact OE2-ND2 3.44Å
392	T	95.8	Very high	95.2	Very high	59 Å²	59	76.7 Å²	76.7	36%	0.362	38%	0.38	S	S	.	.			trans	-107.2	17.6	-172.4	54.5	0	0	0	0	113.8	P340 K342 N394 F428	P340-T392 HydrophobicContact CB-CG2 4.01Å; P340-T392 HydrophobicContact CG-CG2 4.05Å; P340-T392 VanDerWaalsContact O-CG2 3.26Å; P340-T392 WeakPolarHBondContact O-CG2 3.24Å; K342-T392 HydrophobicContact CB-CG2 4.41Å; T392-N394 VanDerWaalsContact C-N 3.33Å; T392-F428 HydrophobicContact CG2-CD1 4.44Å; T392-F428 HydrophobicContact CG2-CE1 4.11Å
393	N	93.4	Very high	95.2	Very high	113 Å²	113	80.9 Å²	80.9	60%	0.604	40%	0.4	S	S	*	.	S	Bend	trans	-75.2	-18.4	178.6	56.1	8.6	0	0	0	113.8	E391	E391-N393 PolarHBondContact OE2-ND2 3.44Å
394	N	94.2	Very high	95.3	Very high	51 Å²	51	82.7 Å²	82.7	27%	0.273	41%	0.407	S	S	.	.			trans	-149	177.8	179.1	70.6	34.5	0	0	0	111.6	K342 T392 E396	K342-N394 PolarHBondContact NZ-OD1 3.08Å; T392-N394 VanDerWaalsContact C-N 3.33Å; N394-E396 HydrophobicContact CB-CG 4.36Å; N394-E396 VanDerWaalsContact ND2-CD 3.29Å; N394-E396 PolarHBondContact ND2-OE2 2.94Å; N394-E396 WeakPolarHBondContact OD1-CB 3.5Å; N394-E396 PolarHBondContact OD1-N 3.02Å
395	L	95.8	Very high	95.4	Very high	43 Å²	43	82.2 Å²	82.2	23%	0.225	40%	0.403	C	S	.	.			trans	-110.9	32.5	172.8	-71	176.7	0	0	0	112.1	Q124 L129 A426 F428	Q124-L395 HydrophobicContact CB-CD1 3.97Å; Q124-L395 HydrophobicContact CG-CD1 4.06Å; L129-L395 HydrophobicContact CD1-CD1 3.83Å; L395-A426 HydrophobicContact CB-CB 4.42Å; L395-A426 HydrophobicContact CD2-CB 4.31Å; L395-A426 WeakPolarHBondContact O-CB 3.39Å; L395-F428 HydrophobicContact CD1-CE2 4.33Å; L395-F428 HydrophobicContact CD2-CD1 4.09Å; L395-F428 HydrophobicContact CD2-CD2 3.77Å; L395-F428 HydrophobicContact CD2-CE1 3.8Å; L395-F428 HydrophobicContact CD2-CE2 3.47Å; L395-F428 VanDerWaalsContact CD2-CE2 3.47Å; L395-F428 HydrophobicContact CD2-CG 4.07Å; L395-F428 HydrophobicContact CD2-CZ 3.48Å; L395-F428 VanDerWaalsContact CD2-CZ 3.48Å; L395-F428 HydrophobicContact CG-CD2 4.43Å; L395-F428 HydrophobicContact CG-CE2 3.8Å; L395-F428 HydrophobicContact CG-CZ 3.97Å
396	E	96.8	Very high	95.7	Very high	135 Å²	135	80.5 Å²	80.5	63%	0.631	39%	0.391	S	S	*	.			trans	-71.3	140	172.7	-65.7	179.3	164.8	0	0	110.2	N394	N394-E396 HydrophobicContact CB-CG 4.36Å; N394-E396 VanDerWaalsContact ND2-CD 3.29Å; N394-E396 PolarHBondContact ND2-OE2 2.94Å; N394-E396 WeakPolarHBondContact OD1-CB 3.5Å; N394-E396 PolarHBondContact OD1-N 3.02Å
397	V	97.4	Very high	96.1	Very high	29 Å²	29	79.3 Å²	79.3	18%	0.176	39%	0.392	C	S	.	.			trans	-85.4	131.2	180	178	0	0	0	0	109.8	F344 Y346 H399 A424 W425 A426	F344-V397 HydrophobicContact CD1-CB 4.49Å; F344-V397 HydrophobicContact CD1-CG1 4.2Å; Y346-V397 HydrophobicContact CE1-CG1 3.97Å; V397-H399 PolarHBondContact O-N 3.04Å; V397-A424 HydrophobicContact CG1-CB 3.79Å; V397-A424 HydrophobicContact CG2-CB 4.26Å; V397-W425 VanDerWaalsContact CG2-CA 3.46Å; V397-A426 HydrophobicContact CG2-CB 4.17Å
398	D	97.1	Very high	96.4	Very high	71 Å²	71	75 Å²	75	38%	0.38	37%	0.372	S	S	.	.			trans	-79	106.2	162.3	-176.4	-11.8	0	0	0	109.4	F344 Y346 Q400 F401	F344-D398 HydrophobicContact CE1-CB 4.19Å; F344-D398 HydrophobicContact CE2-CB 3.9Å; F344-D398 HydrophobicContact CZ-CB 3.68Å; Y346-D398 PolarHBondContact OH-O 3.09Å; D398-Q400 VanDerWaalsContact C-N 3.31Å; D398-Q400 PolarHBondContact O-N 3.41Å; D398-Q400 WeakPolarHBondContact OD1-CA 3.4Å; D398-Q400 WeakPolarHBondContact OD1-CB 3.31Å; D398-Q400 PolarHBondContact OD1-N 3.42Å; D398-F401 HydrophobicContact CB-CB 4.1Å; D398-F401 PolarHBondContact OD1-N 3.19Å
399	H	96.9	Very high	96.7	Very high	127 Å²	127	69.3 Å²	69.3	59%	0.588	35%	0.345	S	S	*	.	S	Bend	trans	-74.8	-20	178.4	-67.8	-68.6	0	0	0	113.7	V397	V397-H399 PolarHBondContact O-N 3.04Å
400	Q	96.8	Very high	96.8	Very high	157 Å²	157	68 Å²	68	73%	0.734	34%	0.342	S	S	*	.	S	Bend	trans	-77.6	-29.9	178.5	-64.1	-173.1	-7.9	0	0	111.7	D398 F402 Q403	D398-Q400 VanDerWaalsContact C-N 3.31Å; D398-Q400 PolarHBondContact O-N 3.41Å; D398-Q400 WeakPolarHBondContact OD1-CA 3.4Å; D398-Q400 WeakPolarHBondContact OD1-CB 3.31Å; D398-Q400 PolarHBondContact OD1-N 3.42Å; Q400-F402 PolarHBondContact O-N 2.92Å; Q400-Q403 VanDerWaalsContact O-CB 3.28Å; Q400-Q403 WeakPolarHBondContact O-CB 3.17Å; Q400-Q403 VanDerWaalsContact O-CG 3.3Å; Q400-Q403 WeakPolarHBondContact O-CG 3.13Å; Q400-Q403 PolarHBondContact O-N 2.91Å
401	F	97.3	Very high	96.9	Very high	16 Å²	16	70.6 Å²	70.6	7%	0.07	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.9	176.1	-174.6	-103	0	0	0	113.3	F344 Y346 M382 P384 D398 Q403 N404 I405	F344-F401 HydrophobicContact CD2-CB 4.28Å; F344-F401 AromaticContact CD2-CD1 3.67Å; F344-F401 HydrophobicContact CD2-CD1 3.67Å; F344-F401 HydrophobicContact CD2-CE1 4.23Å; F344-F401 HydrophobicContact CD2-CG 4.05Å; F344-F401 HydrophobicContact CE2-CB 4.41Å; F344-F401 HydrophobicContact CE2-CD1 4.36Å; F344-F401 HydrophobicContact CE2-CG 4.32Å; Y346-F401 HydrophobicContact CE2-CD1 4.43Å; M382-F401 HydrophobicContact CB-CE1 4.41Å; M382-F401 HydrophobicContact CE-CZ 4.13Å; M382-F401 WeakPolarHBondContact O-CE1 3.38Å; P384-F401 HydrophobicContact CB-CE2 4.21Å; P384-F401 HydrophobicContact CB-CZ 4.25Å; P384-F401 HydrophobicContact CG-CE1 4.49Å; P384-F401 HydrophobicContact CG-CE2 4.18Å; P384-F401 HydrophobicContact CG-CZ 3.93Å; D398-F401 HydrophobicContact CB-CB 4.1Å; D398-F401 PolarHBondContact OD1-N 3.19Å; F401-Q403 PolarHBondContact O-N 2.83Å; F401-Q403 VanDerWaalsContact O-N 3.13Å; F401-N404 WeakPolarHBondContact O-CB 3.44Å; F401-N404 PolarHBondContact O-N 3.31Å; F401-I405 HydrophobicContact CD1-CD1 3.95Å; F401-I405 HydrophobicContact CD1-CG1 4.37Å; F401-I405 HydrophobicContact CE1-CD1 3.91Å; F401-I405 HydrophobicContact CE1-CG1 4.19Å
402	F	97.8	Very high	97.1	Very high	11 Å²	11	64.1 Å²	64.1	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-24.2	173.5	-171.2	-106.2	0	0	0	113.9	Y346 V348 Q400 N404 I405 W406 L409 L419 V421	Y346-F402 HydrophobicContact CD1-CB 4.08Å; Y346-F402 AromaticContact CD1-CD2 3.94Å; Y346-F402 HydrophobicContact CD1-CD2 3.94Å; Y346-F402 HydrophobicContact CD1-CG 4.24Å; Y346-F402 AromaticContact CD2-CD2 3.72Å; Y346-F402 HydrophobicContact CD2-CD2 3.72Å; Y346-F402 HydrophobicContact CD2-CE2 4.47Å; Y346-F402 HydrophobicContact CE1-CB 3.8Å; Y346-F402 HydrophobicContact CE1-CD2 4.41Å; Y346-F402 HydrophobicContact CE1-CG 4.45Å; Y346-F402 HydrophobicContact CE2-CB 4.34Å; Y346-F402 HydrophobicContact CE2-CD2 4.2Å; Y346-F402 HydrophobicContact CG-CB 4.48Å; Y346-F402 AromaticContact CG-CD2 3.57Å; Y346-F402 HydrophobicContact CG-CD2 3.57Å; Y346-F402 HydrophobicContact CG-CE2 4.23Å; Y346-F402 HydrophobicContact CG-CG 4.32Å; V348-F402 HydrophobicContact CG1-CE2 3.81Å; V348-F402 HydrophobicContact CG1-CZ 3.66Å; Q400-F402 PolarHBondContact O-N 2.92Å; F402-N404 PolarHBondContact O-N 3.17Å; F402-I405 HydrophobicContact CD2-CB 4.13Å; F402-I405 HydrophobicContact CD2-CD1 4.32Å; F402-I405 HydrophobicContact CD2-CG2 4.44Å; F402-I405 HydrophobicContact CE2-CB 4.37Å; F402-I405 HydrophobicContact CE2-CG2 4.27Å; F402-I405 PolarHBondContact O-N 3.13Å; F402-W406 HydrophobicContact CD1-CB 4.17Å; F402-W406 HydrophobicContact CE1-CB 3.68Å; F402-W406 HydrophobicContact CE1-CG 4.09Å; F402-W406 HydrophobicContact CZ-CB 4.03Å; F402-W406 PolarHBondContact O-N 3.18Å; F402-L409 HydrophobicContact CE2-CD1 4.31Å; F402-L409 HydrophobicContact CZ-CD1 4.47Å; F402-L419 HydrophobicContact CE1-CD1 3.75Å; F402-L419 HydrophobicContact CZ-CD1 3.61Å; F402-L419 HydrophobicContact CZ-CD2 4.31Å; F402-V421 HydrophobicContact CD1-CG2 3.48Å; F402-V421 VanDerWaalsContact CD1-CG2 3.48Å; F402-V421 HydrophobicContact CD2-CG2 4.26Å; F402-V421 HydrophobicContact CE1-CG2 3.34Å; F402-V421 HydrophobicContact CE2-CG2 4.15Å; F402-V421 HydrophobicContact CG-CG2 3.95Å; F402-V421 HydrophobicContact CZ-CG2 3.71Å
403	Q	96.8	Very high	97.2	Very high	113 Å²	113	61.3 Å²	61.3	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-24	174.8	-60.4	-57.7	-41.5	0	0	112.6	Q400 F401 P407	Q400-Q403 VanDerWaalsContact O-CB 3.28Å; Q400-Q403 WeakPolarHBondContact O-CB 3.17Å; Q400-Q403 VanDerWaalsContact O-CG 3.3Å; Q400-Q403 WeakPolarHBondContact O-CG 3.13Å; Q400-Q403 PolarHBondContact O-N 2.91Å; F401-Q403 PolarHBondContact O-N 2.83Å; F401-Q403 VanDerWaalsContact O-N 3.13Å; Q403-P407 WeakPolarHBondContact O-CD 3.39Å; Q403-P407 WeakPolarHBondContact O-CG 3.27Å
404	N	96.4	Very high	97.5	Very high	76 Å²	76	58.8 Å²	58.8	41%	0.406	29%	0.293	S	S	.	.	H	α-helix	trans	-80.6	-24.3	173.9	-60	-11.9	0	0	0	111.5	M382 F401 F402 H408	M382-N404 HydrophobicContact CE-CB 3.82Å; F401-N404 WeakPolarHBondContact O-CB 3.44Å; F401-N404 PolarHBondContact O-N 3.31Å; F402-N404 PolarHBondContact O-N 3.17Å; N404-H408 PolarHBondContact O-CD2 2.61Å; N404-H408 VanDerWaalsContact O-CD2 3.24Å
405	I	97.9	Very high	97.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-88.5	-45.1	-175.9	-56.9	178	0	0	0	111.2	Y346 V367 M382 F401 F402 H408 L409	Y346-I405 HydrophobicContact CD2-CD1 3.78Å; Y346-I405 HydrophobicContact CE2-CD1 3.5Å; V367-I405 HydrophobicContact CG1-CG2 3.96Å; M382-I405 HydrophobicContact CB-CD1 4.14Å; M382-I405 HydrophobicContact CB-CG1 3.85Å; M382-I405 HydrophobicContact CE-CG1 4.27Å; F401-I405 HydrophobicContact CD1-CD1 3.95Å; F401-I405 HydrophobicContact CD1-CG1 4.37Å; F401-I405 HydrophobicContact CE1-CD1 3.91Å; F401-I405 HydrophobicContact CE1-CG1 4.19Å; F402-I405 HydrophobicContact CD2-CB 4.13Å; F402-I405 HydrophobicContact CD2-CD1 4.32Å; F402-I405 HydrophobicContact CD2-CG2 4.44Å; F402-I405 HydrophobicContact CE2-CB 4.37Å; F402-I405 HydrophobicContact CE2-CG2 4.27Å; F402-I405 PolarHBondContact O-N 3.13Å; I405-H408 PolarHBondContact O-N 2.61Å; I405-L409 HydrophobicContact CG2-CD1 3.65Å; I405-L409 HydrophobicContact CG2-CG 3.92Å; I405-L409 PolarHBondContact O-N 3Å; I405-L409 VanDerWaalsContact O-N 3.15Å
406	W	98.5	Very high	97.8	Very high	92 Å²	92	55.8 Å²	55.8	35%	0.348	28%	0.282	S	S	.	.	H	α-helix	trans	-57.5	-43.3	-170.3	178.6	36.7	0	0	0	114.6	F402 H408 L409 A410 F416 E417	F402-W406 HydrophobicContact CD1-CB 4.17Å; F402-W406 HydrophobicContact CE1-CB 3.68Å; F402-W406 HydrophobicContact CE1-CG 4.09Å; F402-W406 HydrophobicContact CZ-CB 4.03Å; F402-W406 PolarHBondContact O-N 3.18Å; W406-H408 VanDerWaalsContact C-N 3.31Å; W406-H408 PolarHBondContact O-N 2.8Å; W406-L409 PolarHBondContact O-N 3.5Å; W406-A410 WeakPolarHBondContact O-CB 2.91Å; W406-A410 PolarHBondContact O-N 2.73Å; W406-F416 PolarHBondContact NE1-O 3.42Å; W406-E417 WeakPolarHBondContact CZ2-O 3.36Å
407	P	98.4	Very high	97.8	Very high	73 Å²	73	56 Å²	56	47%	0.474	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-40.6	179.1	-26	36	0	0	0	113.1	Q403 H411	Q403-P407 WeakPolarHBondContact O-CD 3.39Å; Q403-P407 WeakPolarHBondContact O-CG 3.27Å; P407-H411 VanDerWaalsContact O-CB 3.26Å; P407-H411 WeakPolarHBondContact O-CB 3.36Å; P407-H411 PolarHBondContact O-N 2.84Å
408	H	98.4	Very high	97.7	Very high	77 Å²	77	58.2 Å²	58.2	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-69.9	-40.7	178	-63.4	-61.2	0	0	0	112	S365 V367 N404 I405 W406 H411 R412	S365-H408 WeakPolarHBondContact OG-CB 3.42Å; V367-H408 HydrophobicContact CB-CB 4.27Å; V367-H408 HydrophobicContact CG1-CB 3.58Å; V367-H408 HydrophobicContact CG2-CB 3.67Å; N404-H408 PolarHBondContact O-CD2 2.61Å; N404-H408 VanDerWaalsContact O-CD2 3.24Å; I405-H408 PolarHBondContact O-N 2.61Å; W406-H408 VanDerWaalsContact C-N 3.31Å; W406-H408 PolarHBondContact O-N 2.8Å; H408-H411 PolarHBondContact O-N 2.67Å; H408-R412 WeakPolarHBondContact O-CB 3.4Å; H408-R412 PolarHBondContact O-N 2.83Å
409	L	98.5	Very high	97.8	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-48.5	174	-72.2	179.4	0	0	0	111.9	V367 F369 A380 F402 I405 W406 H411 R412 V413 F416 L419	V367-L409 HydrophobicContact CB-CD2 4.37Å; V367-L409 HydrophobicContact CG2-CD2 4.23Å; F369-L409 HydrophobicContact CB-CD2 4.18Å; F369-L409 HydrophobicContact CD1-CD2 3.92Å; F369-L409 HydrophobicContact CG-CD2 4.36Å; A380-L409 HydrophobicContact CB-CD1 3.73Å; A380-L409 HydrophobicContact CB-CD2 4.32Å; F402-L409 HydrophobicContact CE2-CD1 4.31Å; F402-L409 HydrophobicContact CZ-CD1 4.47Å; I405-L409 HydrophobicContact CG2-CD1 3.65Å; I405-L409 HydrophobicContact CG2-CG 3.92Å; I405-L409 PolarHBondContact O-N 3Å; I405-L409 VanDerWaalsContact O-N 3.15Å; W406-L409 PolarHBondContact O-N 3.5Å; L409-H411 VanDerWaalsContact C-N 3.35Å; L409-R412 PolarHBondContact O-N 2.83Å; L409-V413 PolarHBondContact O-N 3.07Å; L409-F416 HydrophobicContact CB-CD2 4.03Å; L409-F416 HydrophobicContact CD2-CD2 4.49Å; L409-L419 HydrophobicContact CD1-CD2 4.26Å
410	A	98.4	Very high	97.8	Very high	14 Å²	14	56.5 Å²	56.5	12%	0.116	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-38.5	178.9	0	0	0	0	0	111.9	W406 V413 P414 E417	W406-A410 WeakPolarHBondContact O-CB 2.91Å; W406-A410 PolarHBondContact O-N 2.73Å; A410-V413 CarbonylContact O-C 3.53Å; A410-V413 VanDerWaalsContact O-O 3.11Å; A410-P414 WeakPolarHBondContact O-CA 3.33Å; A410-E417 HydrophobicContact CB-CG 4.01Å
411	H	98.5	Very high	97.9	Very high	85 Å²	85	52 Å²	52	39%	0.394	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-46.7	175	178.8	70.2	0	0	0	112	N220 P407 H408 L409	N220-H411 WeakPolarHBondContact CB-O 3.32Å; N220-H411 PolarHBondContact ND2-O 2.88Å; N220-H411 VanDerWaalsContact ND2-O 3.1Å; P407-H411 VanDerWaalsContact O-CB 3.26Å; P407-H411 WeakPolarHBondContact O-CB 3.36Å; P407-H411 PolarHBondContact O-N 2.84Å; H408-H411 PolarHBondContact O-N 2.67Å; L409-H411 VanDerWaalsContact C-N 3.35Å
412	R	98.5	Very high	97.9	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-74.7	-33.1	-178	-175.1	54.5	66.1	-148.5	-0.8	112.8	L181 I219 N220 D222 V224 L361 D363 Y364 H408 L409	L181-R412 VanDerWaalsContact CD1-CD 3.45Å; L181-R412 HydrophobicContact CD1-CG 4.13Å; I219-R412 HydrophobicContact CD1-CG 4.45Å; I219-R412 HydrophobicContact CG1-CG 4.1Å; N220-R412 PolarHBondContact N-O 3.14Å; N220-R412 WeakPolarHBondContact O-CD 3.4Å; N220-R412 PolarHBondContact O-NH1 2.96Å; D222-R412 PolarHBondContact O-NH1 3.25Å; V224-R412 VanDerWaalsContact CG2-NH2 3.29Å; L361-R412 HydrophobicContact CD1-CG 4.33Å; L361-R412 HydrophobicContact CD2-CG 4.3Å; D363-R412 IonicContact OD1-CZ 2.73Å; D363-R412 IonicContact OD1-NE 2.85Å; D363-R412 PolarHBondContact OD1-NE 3.25Å; D363-R412 IonicContact OD1-NH2 3.15Å; D363-R412 PolarHBondContact OD1-NH2 3.31Å; D363-R412 IonicContact OD2-NH2 2.76Å; Y364-R412 VanDerWaalsContact CZ-NH2 3.34Å; Y364-R412 PolarHBondContact OH-NH2 3.48Å; Y364-R412 VanDerWaalsContact OH-NH2 3.12Å; H408-R412 WeakPolarHBondContact O-CB 3.4Å; H408-R412 PolarHBondContact O-N 2.83Å; L409-R412 PolarHBondContact O-N 2.83Å
413	V	98.4	Very high	97.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	-128.3	95.6	178.9	-175.7	0	0	0	0	108	W218 P354 F369 L409 A410 A415 F416	W218-V413 HydrophobicContact CE3-CG1 4.23Å; W218-V413 HydrophobicContact CE3-CG2 3.88Å; W218-V413 HydrophobicContact CZ3-CG2 3.65Å; P354-V413 HydrophobicContact CG-CG1 3.62Å; P354-V413 HydrophobicContact CG-CG2 4.42Å; F369-V413 HydrophobicContact CE1-CG2 3.72Å; F369-V413 HydrophobicContact CZ-CG2 3.61Å; L409-V413 PolarHBondContact O-N 3.07Å; A410-V413 CarbonylContact O-C 3.53Å; A410-V413 VanDerWaalsContact O-O 3.11Å; V413-A415 HydrophobicContact CG1-CB 4.37Å; V413-A415 PolarHBondContact O-N 2.84Å; V413-F416 HydrophobicContact CB-CB 4.25Å; V413-F416 HydrophobicContact CB-CD2 3.53Å; V413-F416 HydrophobicContact CB-CE2 3.95Å; V413-F416 HydrophobicContact CB-CG 3.85Å; V413-F416 HydrophobicContact CG1-CB 4.48Å; V413-F416 HydrophobicContact CG1-CD1 4.02Å; V413-F416 HydrophobicContact CG1-CD2 3.9Å; V413-F416 HydrophobicContact CG1-CE1 4.21Å; V413-F416 HydrophobicContact CG1-CE2 4.1Å; V413-F416 HydrophobicContact CG1-CG 3.87Å; V413-F416 HydrophobicContact CG1-CZ 4.26Å; V413-F416 HydrophobicContact CG2-CD2 3.95Å; V413-F416 HydrophobicContact CG2-CE2 3.94Å; V413-F416 WeakPolarHBondContact O-CA 3.13Å; V413-F416 VanDerWaalsContact O-CB 3.24Å; V413-F416 WeakPolarHBondContact O-CB 3.43Å; V413-F416 PolarHBondContact O-N 3.36Å
414	P	98.2	Very high	97.9	Very high	60 Å²	60	56.5 Å²	56.5	39%	0.39	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-54.3	-31.8	-175.2	-30.6	37.1	0	0	0	114.4	N220 A410 F416 E417	N220-P414 HydrophobicContact CB-CG 4.23Å; A410-P414 WeakPolarHBondContact O-CA 3.33Å; P414-F416 PolarHBondContact O-N 3.46Å; P414-E417 WeakPolarHBondContact O-CB 3.14Å; P414-E417 WeakPolarHBondContact O-CG 3.47Å; P414-E417 PolarHBondContact O-N 2.67Å; P414-E417 VanDerWaalsContact O-N 3.08Å
415	A	97.6	Very high	98	Very high	31 Å²	31	56 Å²	56	26%	0.256	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-61.3	-23.2	174.4	0	0	0	0	0	113.8	C350 N352 V413 E417 C418	C350-A415 PolarHBondContact SG-O 3.47Å; N352-A415 WeakPolarHBondContact O-CB 3.39Å; V413-A415 HydrophobicContact CG1-CB 4.37Å; V413-A415 PolarHBondContact O-N 2.84Å; A415-E417 PolarHBondContact O-N 3.39Å; A415-C418 PolarHBondContact O-N 2.81Å; A415-C418 PolarHBondContact O-SG 3Å
416	F	98.4	Very high	98	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-74.5	-2.8	175.7	-72.3	-8.6	0	0	0	113.6	C350 P354 F369 Y378 W406 L409 V413 P414 C418 L419	C350-F416 HydrophobicContact CB-CD1 3.76Å; C350-F416 HydrophobicContact CB-CE1 3.9Å; P354-F416 HydrophobicContact CG-CZ 4.37Å; F369-F416 HydrophobicContact CD1-CE2 4.19Å; F369-F416 AromaticContact CD2-CE2 3.85Å; F369-F416 HydrophobicContact CD2-CE2 3.85Å; F369-F416 AromaticContact CD2-CZ 3.99Å; F369-F416 HydrophobicContact CD2-CZ 3.99Å; F369-F416 HydrophobicContact CE1-CE2 4.14Å; F369-F416 AromaticContact CE2-CE2 3.81Å; F369-F416 HydrophobicContact CE2-CE2 3.81Å; F369-F416 AromaticContact CE2-CZ 3.87Å; F369-F416 HydrophobicContact CE2-CZ 3.87Å; F369-F416 HydrophobicContact CG-CE2 4.05Å; F369-F416 AromaticContact CZ-CE2 3.98Å; F369-F416 HydrophobicContact CZ-CE2 3.98Å; F369-F416 HydrophobicContact CZ-CZ 4.39Å; Y378-F416 AromaticContact CD1-CZ 3.92Å; Y378-F416 HydrophobicContact CD1-CZ 3.92Å; Y378-F416 AromaticContact CD2-CE1 3.78Å; Y378-F416 HydrophobicContact CD2-CE1 3.78Å; Y378-F416 AromaticContact CD2-CZ 3.84Å; Y378-F416 HydrophobicContact CD2-CZ 3.84Å; Y378-F416 HydrophobicContact CE1-CE1 4.39Å; Y378-F416 HydrophobicContact CE1-CZ 4.08Å; Y378-F416 AromaticContact CE2-CE1 3.66Å; Y378-F416 HydrophobicContact CE2-CE1 3.66Å; Y378-F416 HydrophobicContact CE2-CZ 4.03Å; Y378-F416 HydrophobicContact CG-CE1 4.24Å; Y378-F416 AromaticContact CG-CZ 3.81Å; Y378-F416 HydrophobicContact CG-CZ 3.81Å; W406-F416 PolarHBondContact NE1-O 3.42Å; L409-F416 HydrophobicContact CB-CD2 4.03Å; L409-F416 HydrophobicContact CD2-CD2 4.49Å; V413-F416 HydrophobicContact CB-CB 4.25Å; V413-F416 HydrophobicContact CB-CD2 3.53Å; V413-F416 HydrophobicContact CB-CE2 3.95Å; V413-F416 HydrophobicContact CB-CG 3.85Å; V413-F416 HydrophobicContact CG1-CB 4.48Å; V413-F416 HydrophobicContact CG1-CD1 4.02Å; V413-F416 HydrophobicContact CG1-CD2 3.9Å; V413-F416 HydrophobicContact CG1-CE1 4.21Å; V413-F416 HydrophobicContact CG1-CE2 4.1Å; V413-F416 HydrophobicContact CG1-CG 3.87Å; V413-F416 HydrophobicContact CG1-CZ 4.26Å; V413-F416 HydrophobicContact CG2-CD2 3.95Å; V413-F416 HydrophobicContact CG2-CE2 3.94Å; V413-F416 WeakPolarHBondContact O-CA 3.13Å; V413-F416 VanDerWaalsContact O-CB 3.24Å; V413-F416 WeakPolarHBondContact O-CB 3.43Å; V413-F416 PolarHBondContact O-N 3.36Å; P414-F416 PolarHBondContact O-N 3.46Å; F416-C418 PolarHBondContact O-N 2.86Å; F416-L419 HydrophobicContact CB-CD2 3.75Å; F416-L419 HydrophobicContact CB-CG 4.42Å; F416-L419 HydrophobicContact CD1-CD2 4.46Å; F416-L419 HydrophobicContact CD2-CD2 4.43Å; F416-L419 HydrophobicContact CG-CD2 3.98Å; F416-L419 WeakPolarHBondContact O-CG 3.4Å; F416-L419 PolarHBondContact O-N 2.82Å
417	E	97.6	Very high	98	Very high	141 Å²	141	52.2 Å²	52.2	66%	0.659	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-57.2	-28.3	166.2	-74.6	-177.1	178.3	0	0	112.9	W406 A410 P414 A415	W406-E417 WeakPolarHBondContact CZ2-O 3.36Å; A410-E417 HydrophobicContact CB-CG 4.01Å; P414-E417 WeakPolarHBondContact O-CB 3.14Å; P414-E417 WeakPolarHBondContact O-CG 3.47Å; P414-E417 PolarHBondContact O-N 2.67Å; P414-E417 VanDerWaalsContact O-N 3.08Å; A415-E417 PolarHBondContact O-N 3.39Å
418	C	96.3	Very high	97.9	Very high	75 Å²	75	49.9 Å²	49.9	51%	0.507	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-107.7	13.5	-179.6	70.5	0	0	0	0	114.3	A415 F416	A415-C418 PolarHBondContact O-N 2.81Å; A415-C418 PolarHBondContact O-SG 3Å; F416-C418 PolarHBondContact O-N 2.86Å
419	L	97.4	Very high	97.8	Very high	16 Å²	16	49 Å²	49	8%	0.084	26%	0.258	C	S	.	.			trans	-61.3	158	-179.6	69.4	70.2	0	0	0	112	V348 H349 C350 F402 L409 F416	V348-L419 HydrophobicContact CB-CB 4.44Å; V348-L419 HydrophobicContact CB-CD1 4.26Å; V348-L419 HydrophobicContact CB-CD2 4.17Å; V348-L419 HydrophobicContact CG1-CD1 4.04Å; V348-L419 HydrophobicContact CG1-CD2 4.24Å; V348-L419 HydrophobicContact CG2-CD2 4.17Å; H349-L419 WeakPolarHBondContact O-CA 3.48Å; C350-L419 HydrophobicContact CB-CB 4.13Å; F402-L419 HydrophobicContact CE1-CD1 3.75Å; F402-L419 HydrophobicContact CZ-CD1 3.61Å; F402-L419 HydrophobicContact CZ-CD2 4.31Å; L409-L419 HydrophobicContact CD1-CD2 4.26Å; F416-L419 HydrophobicContact CB-CD2 3.75Å; F416-L419 HydrophobicContact CB-CG 4.42Å; F416-L419 HydrophobicContact CD1-CD2 4.46Å; F416-L419 HydrophobicContact CD2-CD2 4.43Å; F416-L419 HydrophobicContact CG-CD2 3.98Å; F416-L419 WeakPolarHBondContact O-CG 3.4Å; F416-L419 PolarHBondContact O-N 2.82Å
420	K	97.8	Very high	97.8	Very high	146 Å²	146	49.6 Å²	49.6	64%	0.635	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	128.9	172.8	-63.4	-176.8	-179.6	179.6	0	110.1	V348 H349 K422	V348-K420 CarbonylContact C-O 3.37Å; V348-K420 WeakPolarHBondContact CA-O 3.44Å; H349-K420 PolarHBondContact N-O 3.45Å; H349-K420 PolarHBondContact O-N 3.12Å; K420-K422 PolarHBondContact O-N 3.03Å
421	V	98.1	Very high	97.7	Very high	61 Å²	61	50.2 Å²	50.2	37%	0.37	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.9	169.1	-175.7	0	0	0	0	108.6	Y346 V348 F402	Y346-V421 HydrophobicContact CD1-CG1 4.28Å; V348-V421 HydrophobicContact CG1-CG2 4.22Å; F402-V421 HydrophobicContact CD1-CG2 3.48Å; F402-V421 VanDerWaalsContact CD1-CG2 3.48Å; F402-V421 HydrophobicContact CD2-CG2 4.26Å; F402-V421 HydrophobicContact CE1-CG2 3.34Å; F402-V421 HydrophobicContact CE2-CG2 4.15Å; F402-V421 HydrophobicContact CG-CG2 3.95Å; F402-V421 HydrophobicContact CZ-CG2 3.71Å
422	K	97.6	Very high	97.7	Very high	145 Å²	145	46.1 Å²	46.1	63%	0.63	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	-39.6	-179.2	-66.8	-61.6	-64.2	178.5	0	112.2	V347 H349 K420	V347-K422 HydrophobicContact CG1-CB 4.47Å; V347-K422 PolarHBondContact O-N 2.92Å; H349-K422 HydrophobicContact CB-CD 3.91Å; H349-K422 HydrophobicContact CB-CG 3.51Å; K420-K422 PolarHBondContact O-N 3.03Å
423	S	97.6	Very high	97.6	Very high	63 Å²	63	49.2 Å²	49.2	44%	0.441	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	171.6	177.6	56.8	0	0	0	0	109	V347	V347-S423 WeakPolarHBondContact CB-OG 3.45Å; V347-S423 WeakPolarHBondContact CG2-OG 3.49Å; V347-S423 PolarHBondContact N-O 3.29Å
424	A	98.2	Very high	97.5	Very high	27 Å²	27	51.9 Å²	51.9	22%	0.223	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	159.4	174.3	0	0	0	0	0	109.6	I345 Y346 V397	I345-A424 CarbonylContact O-C 3.21Å; I345-A424 WeakPolarHBondContact O-CA 3.45Å; I345-A424 WeakPolarHBondContact O-CB 3.29Å; Y346-A424 HydrophobicContact CD1-CB 3.57Å; Y346-A424 HydrophobicContact CE1-CB 4.03Å; Y346-A424 HydrophobicContact CG-CB 4.25Å; V397-A424 HydrophobicContact CG1-CB 3.79Å; V397-A424 HydrophobicContact CG2-CB 4.26Å
425	W	98.2	Very high	97.4	Very high	67 Å²	67	49.1 Å²	49.1	25%	0.254	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164.6	169.6	71	93.8	0	0	0	110.2	L129 I345 V347 I379 V397	L129-W425 HydrophobicContact CD2-CG 4.44Å; L129-W425 PolarHBondContact O-NE1 3.43Å; I345-W425 HydrophobicContact CB-CD2 3.95Å; I345-W425 HydrophobicContact CB-CE3 4.26Å; I345-W425 HydrophobicContact CB-CH2 4.03Å; I345-W425 HydrophobicContact CB-CZ2 3.66Å; I345-W425 HydrophobicContact CB-CZ3 4.3Å; I345-W425 HydrophobicContact CD1-CZ2 3.57Å; I345-W425 HydrophobicContact CG1-CZ2 4.16Å; I345-W425 HydrophobicContact CG2-CD2 4.32Å; I345-W425 HydrophobicContact CG2-CE3 4.23Å; I345-W425 HydrophobicContact CG2-CH2 3.35Å; I345-W425 HydrophobicContact CG2-CZ2 3.42Å; I345-W425 VanDerWaalsContact CG2-CZ2 3.42Å; I345-W425 HydrophobicContact CG2-CZ3 3.77Å; I345-W425 PolarHBondContact N-O 3.02Å; I345-W425 PolarHBondContact O-N 3.04Å; V347-W425 HydrophobicContact CG2-CE3 4.33Å; V347-W425 HydrophobicContact CG2-CZ3 3.58Å; I379-W425 HydrophobicContact CG2-CH2 3.75Å; I379-W425 HydrophobicContact CG2-CZ3 4.23Å; V397-W425 VanDerWaalsContact CG2-CA 3.46Å
426	A	97.9	Very high	97.4	Very high	4 Å²	4	52.1 Å²	52.1	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.8	172.2	0	0	0	0	0	110	L129 K342 R343 F344 L395 V397	L129-A426 WeakPolarHBondContact CD1-O 3.43Å; K342-A426 HydrophobicContact CD-CB 4.18Å; K342-A426 HydrophobicContact CG-CB 4.11Å; R343-A426 CarbonylContact O-C 3.43Å; R343-A426 VanDerWaalsContact O-CA 3.23Å; R343-A426 WeakPolarHBondContact O-CA 3.42Å; F344-A426 HydrophobicContact CD1-CB 3.85Å; F344-A426 HydrophobicContact CE1-CB 4.16Å; L395-A426 HydrophobicContact CB-CB 4.42Å; L395-A426 HydrophobicContact CD2-CB 4.31Å; L395-A426 WeakPolarHBondContact O-CB 3.39Å; V397-A426 HydrophobicContact CG2-CB 4.17Å
427	G	97.2	Very high	97.3	Very high	8 Å²	8	52.3 Å²	52.3	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	165.1	171.9	0	0	0	0	0	110.8	K342 R343	K342-G427 WeakPolarHBondContact CA-O 3.34Å; R343-G427 PolarHBondContact N-O 2.97Å; R343-G427 PolarHBondContact O-N 3.42Å
428	F	97.3	Very high	97.3	Very high	23 Å²	23	45.8 Å²	45.8	10%	0.101	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.1	174.5	-60.7	-57.9	0	0	0	111.1	S126 A312 P340 R341 K342 T392 L395	S126-F428 WeakPolarHBondContact CB-O 3.47Å; S126-F428 PolarHBondContact OG-O 2.87Å; A312-F428 HydrophobicContact CB-CB 3.87Å; P340-F428 HydrophobicContact CB-CB 4.29Å; P340-F428 HydrophobicContact CB-CD1 3.79Å; P340-F428 HydrophobicContact CB-CE1 4.27Å; P340-F428 HydrophobicContact CB-CG 4Å; R341-F428 CarbonylContact O-C 3.55Å; R341-F428 WeakPolarHBondContact O-CA 3.48Å; K342-F428 HydrophobicContact CB-CD1 3.98Å; K342-F428 HydrophobicContact CB-CE1 3.92Å; K342-F428 HydrophobicContact CG-CE1 4.43Å; T392-F428 HydrophobicContact CG2-CD1 4.44Å; T392-F428 HydrophobicContact CG2-CE1 4.11Å; L395-F428 HydrophobicContact CD1-CE2 4.33Å; L395-F428 HydrophobicContact CD2-CD1 4.09Å; L395-F428 HydrophobicContact CD2-CD2 3.77Å; L395-F428 HydrophobicContact CD2-CE1 3.8Å; L395-F428 HydrophobicContact CD2-CE2 3.47Å; L395-F428 VanDerWaalsContact CD2-CE2 3.47Å; L395-F428 HydrophobicContact CD2-CG 4.07Å; L395-F428 HydrophobicContact CD2-CZ 3.48Å; L395-F428 VanDerWaalsContact CD2-CZ 3.48Å; L395-F428 HydrophobicContact CG-CD2 4.43Å; L395-F428 HydrophobicContact CG-CE2 3.8Å; L395-F428 HydrophobicContact CG-CZ 3.97Å
429	Y	97.1	Very high	97.4	Very high	59 Å²	59	42.2 Å²	42.2	23%	0.231	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	142	152.5	-79.1	12.4	0	0	0	109	P340 R341 R343 Y431 S456 G457	P340-Y429 WeakPolarHBondContact CA-O 3.44Å; R341-Y429 PolarHBondContact N-O 3.48Å; R341-Y429 PolarHBondContact O-N 2.87Å; R343-Y429 HydrophobicContact CG-CD1 3.99Å; R343-Y429 HydrophobicContact CG-CD2 4.26Å; R343-Y429 HydrophobicContact CG-CE1 4.17Å; R343-Y429 HydrophobicContact CG-CE2 4.42Å; R343-Y429 HydrophobicContact CG-CG 4.06Å; Y429-Y431 PolarHBondContact O-N 3.28Å; Y429-S456 WeakPolarHBondContact CD2-O 3.32Å; Y429-S456 WeakPolarHBondContact CE2-O 3.41Å; Y429-G457 VanDerWaalsContact CZ-CA 3.41Å
430	D	96.6	Very high	97.4	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.08	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	77.1	162.8	62.3	-38.9	0	0	0	108.5	A312 V338 N432 G454 F455 S456	A312-D430 HydrophobicContact CB-CB 4.31Å; A312-D430 VanDerWaalsContact N-CB 3.33Å; V338-D430 HydrophobicContact CG1-CB 4.04Å; D430-N432 PolarHBondContact O-N 3.37Å; D430-G454 CarbonylContact O-C 3.51Å; D430-G454 VanDerWaalsContact O-C 3.23Å; D430-G454 WeakPolarHBondContact O-CA 3.23Å; D430-G454 PolarHBondContact OD2-N 3.24Å; D430-F455 PolarHBondContact O-N 3.49Å; D430-F455 PolarHBondContact OD2-N 3.44Å; D430-F455 VanDerWaalsContact OD2-N 3.13Å; D430-S456 PolarHBondContact O-N 3.13Å; D430-S456 VanDerWaalsContact O-N 3.09Å
431	Y	97.4	Very high	97.4	Very high	26 Å²	26	34.7 Å²	34.7	10%	0.102	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	120.2	-168.5	-172.1	-104.6	0	0	0	110.3	V338 E339 R341 Y429 T433 Q436	V338-Y431 WeakPolarHBondContact CA-O 3.46Å; E339-Y431 PolarHBondContact N-O 3Å; E339-Y431 PolarHBondContact O-N 2.8Å; R341-Y431 HydrophobicContact CB-CG 4.35Å; R341-Y431 HydrophobicContact CG-CD1 3.75Å; R341-Y431 HydrophobicContact CG-CD2 4.26Å; R341-Y431 HydrophobicContact CG-CG 3.55Å; Y429-Y431 PolarHBondContact O-N 3.28Å; Y431-T433 HydrophobicContact CD1-CG2 3.8Å; Y431-T433 HydrophobicContact CE1-CG2 4.12Å; Y431-T433 PolarHBondContact O-N 2.8Å; Y431-Q436 HydrophobicContact CE2-CG 3.74Å; Y431-Q436 PolarHBondContact OH-NE2 2.8Å
432	N	97.7	Very high	97.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	107.7	169.8	175.3	4	0	0	0	109.5	P337 D430 F434 D435 Q436 N437 G454 S456 R491	P337-N432 WeakPolarHBondContact CG-OD1 3.13Å; P337-N432 CarbonylContact O-C 3.53Å; P337-N432 VanDerWaalsContact O-CA 3.27Å; P337-N432 WeakPolarHBondContact O-CA 3.21Å; P337-N432 PolarHBondContact O-OD1 2.97Å; D430-N432 PolarHBondContact O-N 3.37Å; N432-F434 PolarHBondContact O-N 2.9Å; N432-F434 VanDerWaalsContact OD1-CB 3.25Å; N432-F434 WeakPolarHBondContact OD1-CB 3.29Å; N432-F434 PolarHBondContact OD1-N 3.48Å; N432-D435 PolarHBondContact ND2-OD1 2.75Å; N432-Q436 VanDerWaalsContact O-CA 3.22Å; N432-Q436 WeakPolarHBondContact O-CA 2.92Å; N432-Q436 PolarHBondContact O-N 3.46Å; N432-N437 PolarHBondContact ND2-O 3Å; N432-G454 WeakPolarHBondContact CB-O 3.4Å; N432-S456 PolarHBondContact N-OG 2.95Å; N432-R491 PolarHBondContact ND2-NH2 3.17Å
433	T	96.5	Very high	97.2	Very high	66 Å²	66	29.3 Å²	29.3	41%	0.405	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.4	-177.8	56.2	0	0	0	0	113.9	P337 E339 Y431	P337-T433 WeakPolarHBondContact CB-OG1 3.33Å; P337-T433 PolarHBondContact O-N 2.87Å; P337-T433 PolarHBondContact O-OG1 3.27Å; E339-T433 VanDerWaalsContact CD-CG2 3.41Å; E339-T433 HydrophobicContact CG-CG2 3.73Å; E339-T433 VanDerWaalsContact OE1-CG2 3.29Å; E339-T433 WeakPolarHBondContact OE1-CG2 3.28Å; Y431-T433 HydrophobicContact CD1-CG2 3.8Å; Y431-T433 HydrophobicContact CE1-CG2 4.12Å; Y431-T433 PolarHBondContact O-N 2.8Å
434	F	97.1	Very high	96.9	Very high	57 Å²	57	28.3 Å²	28.3	25%	0.25	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-49.3	-179.5	-177.7	-111.7	0	0	0	112.3	P337 N432 R491 I492 P497	P337-F434 HydrophobicContact CB-CB 4.25Å; P337-F434 HydrophobicContact CG-CB 3.89Å; N432-F434 PolarHBondContact O-N 2.9Å; N432-F434 VanDerWaalsContact OD1-CB 3.25Å; N432-F434 WeakPolarHBondContact OD1-CB 3.29Å; N432-F434 PolarHBondContact OD1-N 3.48Å; F434-R491 HydrophobicContact CE1-CG 4.08Å; F434-I492 HydrophobicContact CD1-CG1 3.83Å; F434-I492 HydrophobicContact CE1-CG1 4.2Å; F434-I492 HydrophobicContact CG-CG1 4.21Å; F434-P497 HydrophobicContact CD1-CB 4.36Å; F434-P497 VanDerWaalsContact CE1-CA 3.49Å; F434-P497 HydrophobicContact CE1-CB 3.83Å; F434-P497 HydrophobicContact CZ-CB 3.97Å; F434-P497 HydrophobicContact CZ-CG 4.46Å
435	D	96.4	Very high	96.7	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.011	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-156	12.9	-174.5	68	-0.1	0	0	0	114.4	N432 N437 R491 P497 I498 L499	N432-D435 PolarHBondContact ND2-OD1 2.75Å; D435-N437 PolarHBondContact O-N 2.76Å; D435-N437 PolarHBondContact O-ND2 3.14Å; D435-N437 PolarHBondContact OD1-N 2.74Å; D435-N437 VanDerWaalsContact OD1-N 3.15Å; D435-R491 IonicContact OD1-CZ 3.36Å; D435-R491 IonicContact OD1-NE 3.13Å; D435-R491 IonicContact OD1-NH2 3.38Å; D435-R491 PolarHBondContact OD1-NH2 3.3Å; D435-R491 IonicContact OD2-CZ 3.84Å; D435-R491 IonicContact OD2-NE 3.43Å; D435-R491 PolarHBondContact OD2-NE 3.24Å; D435-R491 IonicContact OD2-NH2 2.66Å; D435-R491 PolarHBondContact OD2-NH2 3.46Å; D435-P497 HydrophobicContact CB-CB 3.73Å; D435-I498 WeakPolarHBondContact CB-O 3.47Å; D435-I498 WeakPolarHBondContact OD2-CG1 3.26Å; D435-I498 PolarHBondContact OD2-N 3.13Å; D435-I498 VanDerWaalsContact OD2-N 3.09Å; D435-L499 HydrophobicContact CB-CD2 3.9Å
436	Q	96.2	Very high	96.6	Very high	93 Å²	93	24.7 Å²	24.7	44%	0.435	13%	0.127	S	C	.	.	S	Bend	trans	60.8	7.8	178.5	-52.3	172.3	10	0	0	114.9	Y431 N432 S456	Y431-Q436 HydrophobicContact CE2-CG 3.74Å; Y431-Q436 PolarHBondContact OH-NE2 2.8Å; N432-Q436 VanDerWaalsContact O-CA 3.22Å; N432-Q436 WeakPolarHBondContact O-CA 2.92Å; N432-Q436 PolarHBondContact O-N 3.46Å; Q436-S456 VanDerWaalsContact C-OG 3.28Å; Q436-S456 VanDerWaalsContact CA-OG 3.27Å; Q436-S456 WeakPolarHBondContact CA-OG 3.32Å; Q436-S456 WeakPolarHBondContact O-CB 3.13Å; Q436-S456 PolarHBondContact O-OG 3.47Å
437	N	96.6	Very high	96.2	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.027	14%	0.144	C	C	.	.	S	Bend	trans	-99.8	157.4	179.5	-87.1	-76.7	0	0	0	112.8	N143 N432 D435 G454 F487 R491 I498	N143-N437 PolarHBondContact ND2-OD1 2.72Å; N432-N437 PolarHBondContact ND2-O 3Å; D435-N437 PolarHBondContact O-N 2.76Å; D435-N437 PolarHBondContact O-ND2 3.14Å; D435-N437 PolarHBondContact OD1-N 2.74Å; D435-N437 VanDerWaalsContact OD1-N 3.15Å; N437-G454 CarbonylContact C-O 3.51Å; N437-G454 VanDerWaalsContact C-O 3.25Å; N437-F487 HydrophobicContact CB-CD1 4.1Å; N437-F487 HydrophobicContact CB-CE1 3.89Å; N437-R491 PolarHBondContact O-NH2 3.34Å; N437-R491 VanDerWaalsContact O-NH2 3.13Å; N437-I498 HydrophobicContact CB-CG1 4.31Å; N437-I498 PolarHBondContact ND2-O 2.75Å
438	G	97.4	Very high	96.2	Very high	3 Å²	3	27.8 Å²	27.8	3%	0.031	14%	0.141	C	C	.	.			trans	-53.3	151.2	176.9	0	0	0	0	0	113.5	F487 R491	G438-F487 WeakPolarHBondContact O-CB 3.46Å; G438-R491 PolarHBondContact O-NH1 3.36Å; G438-R491 PolarHBondContact O-NH2 3.08Å
439	I	98.5	Very high	96.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	107.4	171.4	-55.2	173.9	0	0	0	107.2	L336 P337 V338 F451 A452 T453 F487 F489 I492	L336-I439 HydrophobicContact CD1-CB 4.46Å; L336-I439 HydrophobicContact CD1-CD1 3.56Å; L336-I439 HydrophobicContact CD1-CG2 4.01Å; P337-I439 HydrophobicContact CG-CD1 4.04Å; V338-I439 HydrophobicContact CG2-CD1 3.74Å; I439-F451 HydrophobicContact CG2-CB 4.03Å; I439-F451 HydrophobicContact CG2-CD2 4.2Å; I439-F451 HydrophobicContact CG2-CG 4.41Å; I439-F451 CarbonylContact O-C 3.57Å; I439-A452 WeakPolarHBondContact O-CA 3.44Å; I439-A452 PolarHBondContact O-N 3.04Å; I439-T453 PolarHBondContact N-O 3.24Å; I439-T453 PolarHBondContact O-N 3.28Å; I439-F487 CarbonylContact C-O 3.47Å; I439-F487 WeakPolarHBondContact CA-O 3.48Å; I439-F489 HydrophobicContact CG2-CD2 4.31Å; I439-I492 HydrophobicContact CD1-CD1 3.67Å; I439-I492 HydrophobicContact CG1-CD1 4.16Å
440	V	98.4	Very high	96.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	123.4	-174.1	-175	0	0	0	0	109.5	F451 F455 M470 F479 L484 F487 S488	V440-F451 VanDerWaalsContact CA-O 3.31Å; V440-F451 WeakPolarHBondContact CA-O 3.21Å; V440-F455 HydrophobicContact CG2-CE1 4.16Å; V440-F455 HydrophobicContact CG2-CZ 4.01Å; V440-M470 HydrophobicContact CG1-CG 4.27Å; V440-M470 HydrophobicContact CG1-SD 3.56Å; V440-M470 VanDerWaalsContact CG1-SD 3.56Å; V440-F479 HydrophobicContact CG1-CE1 4.28Å; V440-F479 HydrophobicContact CG1-CZ 4.21Å; V440-L484 HydrophobicContact CG1-CD1 4.17Å; V440-F487 HydrophobicContact CB-CB 4.1Å; V440-F487 HydrophobicContact CG2-CB 4.17Å; V440-F487 PolarHBondContact N-O 2.79Å; V440-S488 WeakPolarHBondContact O-CA 3.22Å
441	G	97.4	Very high	96.5	Very high	4 Å²	4	24 Å²	24	4%	0.041	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	126.8	-168.3	174	0	0	0	0	0	114.3	F450 F451	G441-F450 CarbonylContact O-C 3.29Å; G441-F450 VanDerWaalsContact O-CA 3.32Å; G441-F450 WeakPolarHBondContact O-CA 3.49Å; G441-F451 PolarHBondContact N-O 3.48Å; G441-F451 PolarHBondContact O-N 2.83Å
442	M	96	Very high	96.5	Very high	91 Å²	91	22.9 Å²	22.9	45%	0.448	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	145.1	-171.1	-165.4	172.7	62	0	0	112.4	F450	M442-F450 HydrophobicContact CB-CD1 3.95Å; M442-F450 HydrophobicContact CB-CE1 3.82Å; M442-F450 HydrophobicContact CB-CZ 4.29Å; M442-F450 HydrophobicContact CG-CD1 4.47Å; M442-F450 HydrophobicContact CG-CE1 4.22Å; M442-F450 HydrophobicContact CG-CE2 4.42Å; M442-F450 HydrophobicContact CG-CZ 4.2Å; M442-F450 HydrophobicContact SD-CE1 4.42Å; M442-F450 HydrophobicContact SD-CE2 4.38Å; M442-F450 HydrophobicContact SD-CZ 3.98Å
443	H	94.7	Very high	96.5	Very high	3 Å²	3	23 Å²	23	1%	0.014	12%	0.121	C	C	.	.			trans	-71.8	135.5	167.9	-171.8	-93.6	0	0	0	110.7	I323 L445 V446 M449 F451	I323-H443 WeakPolarHBondContact CG2-NE2 3.24Å; H443-L445 VanDerWaalsContact C-N 3.34Å; H443-L445 PolarHBondContact ND1-N 2.9Å; H443-L445 VanDerWaalsContact ND1-N 3.12Å; H443-L445 PolarHBondContact O-N 2.87Å; H443-V446 HydrophobicContact CB-CB 4.2Å; H443-V446 PolarHBondContact ND1-N 3.14Å; H443-V446 PolarHBondContact O-N 2.81Å; H443-M449 PolarHBondContact N-O 2.81Å; H443-F451 HydrophobicContact CB-CE2 3.61Å; H443-F451 HydrophobicContact CB-CZ 3.89Å; H443-F451 AromaticContact CD2-CE2 3.74Å; H443-F451 AromaticContact CD2-CZ 3.9Å
444	P	92.6	Very high	96.6	Very high	41 Å²	41	19.8 Å²	19.8	27%	0.266	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.5	-175.9	28	-41.6	0	0	0	114.8	I331 F489 M493	I331-P444 HydrophobicContact CG2-CB 4.37Å; I331-P444 HydrophobicContact CG2-CG 3.64Å; P444-F489 HydrophobicContact CG-CD1 4.23Å; P444-M493 HydrophobicContact CB-CE 4.18Å; P444-M493 HydrophobicContact CB-SD 4.02Å; P444-M493 HydrophobicContact CG-CE 4.07Å; P444-M493 HydrophobicContact CG-SD 3.56Å; P444-M493 VanDerWaalsContact CG-SD 3.56Å
445	L	93.6	Very high	96.6	Very high	17 Å²	17	17.3 Å²	17.3	9%	0.089	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-4.5	-176.7	-55	-179.5	0	0	0	114	V280 F282 R283 I331 A332 H443	V280-L445 HydrophobicContact CG1-CD2 3.46Å; V280-L445 VanDerWaalsContact CG1-CD2 3.46Å; F282-L445 WeakPolarHBondContact CA-O 3.37Å; F282-L445 HydrophobicContact CD1-CD2 4.37Å; F282-L445 HydrophobicContact CE1-CD2 4.09Å; R283-L445 PolarHBondContact N-O 2.87Å; I331-L445 HydrophobicContact CB-CD1 3.88Å; I331-L445 HydrophobicContact CB-CG 4.33Å; I331-L445 HydrophobicContact CG2-CD1 3.64Å; I331-L445 HydrophobicContact CG2-CD2 4.24Å; I331-L445 HydrophobicContact CG2-CG 3.67Å; A332-L445 HydrophobicContact CB-CD1 3.88Å; H443-L445 VanDerWaalsContact C-N 3.34Å; H443-L445 PolarHBondContact ND1-N 2.9Å; H443-L445 VanDerWaalsContact ND1-N 3.12Å; H443-L445 PolarHBondContact O-N 2.87Å
446	V	95.9	Very high	96.6	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.012	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-122.6	89.5	177.4	-172.9	0	0	0	0	107.2	R283 I285 M321 I323 H443 N448 M449	R283-V446 HydrophobicContact CB-CG2 4.31Å; R283-V446 WeakPolarHBondContact O-CA 3.44Å; I285-V446 HydrophobicContact CD1-CG1 4.14Å; I285-V446 HydrophobicContact CG1-CG1 4.17Å; M321-V446 HydrophobicContact CE-CG1 3.89Å; M321-V446 HydrophobicContact CE-CG2 4.28Å; I323-V446 HydrophobicContact CD1-CG2 4.01Å; I323-V446 HydrophobicContact CG1-CG2 4.15Å; H443-V446 HydrophobicContact CB-CB 4.2Å; H443-V446 PolarHBondContact ND1-N 3.14Å; H443-V446 PolarHBondContact O-N 2.81Å; V446-N448 PolarHBondContact O-N 2.83Å; V446-M449 HydrophobicContact CB-CB 3.97Å; V446-M449 HydrophobicContact CG1-CB 3.52Å; V446-M449 PolarHBondContact O-N 3.3Å
447	N	90.5	Very high	96.4	Very high	75 Å²	75	14.2 Å²	14.2	40%	0.401	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	2.9	-159.3	-58.2	10.2	0	0	0	114.5	F282 R283	F282-N447 VanDerWaalsContact CD1-OD1 3.31Å; F282-N447 WeakPolarHBondContact CD1-OD1 3.43Å; R283-N447 PolarHBondContact O-N 3.36Å
448	N	97.3	Very high	96.3	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.011	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.5	21.3	176.4	67.8	-33	0	0	0	113.3	R284 I285 A304 V306 V446	R284-N448 WeakPolarHBondContact CA-OD1 3.26Å; I285-N448 PolarHBondContact N-OD1 2.78Å; I285-N448 PolarHBondContact O-ND2 2.91Å; A304-N448 VanDerWaalsContact O-CB 3.25Å; A304-N448 WeakPolarHBondContact O-CB 3.26Å; A304-N448 PolarHBondContact O-ND2 2.72Å; V306-N448 PolarHBondContact N-O 3.36Å; V446-N448 PolarHBondContact O-N 2.83Å
449	M	98.1	Very high	96.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.9	169.8	-171.5	171.4	-168.8	0	0	109.5	I285 V306 N308 V317 M321 I323 H443 V446 F451	I285-M449 HydrophobicContact CD1-CB 4.13Å; I285-M449 HydrophobicContact CD1-CG 4.49Å; I285-M449 HydrophobicContact CD1-SD 4.42Å; V306-M449 CarbonylContact O-C 3.57Å; V306-M449 WeakPolarHBondContact O-CA 3.24Å; N308-M449 HydrophobicContact CB-CE 3.72Å; V317-M449 HydrophobicContact CG1-CE 4.01Å; M321-M449 HydrophobicContact CB-SD 4.3Å; M321-M449 HydrophobicContact CG-SD 3.91Å; I323-M449 HydrophobicContact CD1-SD 3.9Å; H443-M449 PolarHBondContact N-O 2.81Å; V446-M449 HydrophobicContact CB-CB 3.97Å; V446-M449 HydrophobicContact CG1-CB 3.52Å; V446-M449 PolarHBondContact O-N 3.3Å; M449-F451 HydrophobicContact CE-CE1 4.01Å; M449-F451 HydrophobicContact CG-CE1 4.31Å; M449-F451 HydrophobicContact SD-CE1 4.29Å
450	F	98.7	Very high	96.1	Very high	18 Å²	18	16.3 Å²	16.3	8%	0.079	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	150.4	175.9	-65.5	-103.9	0	0	0	110.5	I305 V306 V307 N308 G441 M442 M470 L473 I474	I305-F450 HydrophobicContact CD1-CE2 4.47Å; I305-F450 HydrophobicContact CG2-CD2 3.66Å; I305-F450 HydrophobicContact CG2-CE2 3.78Å; V306-F450 PolarHBondContact O-N 2.92Å; V307-F450 CarbonylContact C-O 3.51Å; V307-F450 WeakPolarHBondContact CA-O 3.29Å; V307-F450 HydrophobicContact CG1-CB 4.44Å; V307-F450 HydrophobicContact CG2-CB 4.39Å; N308-F450 PolarHBondContact N-O 2.92Å; G441-F450 CarbonylContact O-C 3.29Å; G441-F450 VanDerWaalsContact O-CA 3.32Å; G441-F450 WeakPolarHBondContact O-CA 3.49Å; M442-F450 HydrophobicContact CB-CD1 3.95Å; M442-F450 HydrophobicContact CB-CE1 3.82Å; M442-F450 HydrophobicContact CB-CZ 4.29Å; M442-F450 HydrophobicContact CG-CD1 4.47Å; M442-F450 HydrophobicContact CG-CE1 4.22Å; M442-F450 HydrophobicContact CG-CE2 4.42Å; M442-F450 HydrophobicContact CG-CZ 4.2Å; M442-F450 HydrophobicContact SD-CE1 4.42Å; M442-F450 HydrophobicContact SD-CE2 4.38Å; M442-F450 HydrophobicContact SD-CZ 3.98Å; F450-M470 HydrophobicContact CB-CE 3.49Å; F450-M470 VanDerWaalsContact CB-CE 3.49Å; F450-M470 HydrophobicContact CD1-CE 4.11Å; F450-M470 HydrophobicContact CG-CE 4.12Å; F450-L473 HydrophobicContact CD1-CD2 3.85Å; F450-L473 HydrophobicContact CD1-CG 4.35Å; F450-L473 HydrophobicContact CE1-CD2 3.85Å; F450-L473 HydrophobicContact CE1-CG 3.91Å; F450-I474 HydrophobicContact CD1-CG1 4.24Å; F450-I474 HydrophobicContact CD2-CG1 4.38Å; F450-I474 HydrophobicContact CE1-CG1 4.16Å; F450-I474 HydrophobicContact CE2-CG1 4.31Å; F450-I474 HydrophobicContact CG-CG1 4.36Å; F450-I474 HydrophobicContact CZ-CG1 4.2Å
451	F	98.7	Very high	96.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.3	174.4	-57	-57.3	0	0	0	110.1	N308 A318 I323 L336 I439 V440 G441 H443 M449 T453 F489	N308-F451 HydrophobicContact CB-CD1 3.91Å; N308-F451 HydrophobicContact CB-CE1 4.3Å; A318-F451 HydrophobicContact CB-CE1 4.24Å; I323-F451 HydrophobicContact CD1-CZ 3.96Å; L336-F451 HydrophobicContact CD1-CD1 4.27Å; L336-F451 HydrophobicContact CD1-CD2 4.22Å; L336-F451 HydrophobicContact CD1-CE1 4.39Å; L336-F451 HydrophobicContact CD1-CE2 4.28Å; L336-F451 HydrophobicContact CD1-CG 4.21Å; L336-F451 HydrophobicContact CD1-CZ 4.38Å; L336-F451 HydrophobicContact CD2-CD1 3.87Å; L336-F451 HydrophobicContact CD2-CE1 3.84Å; L336-F451 HydrophobicContact CD2-CZ 4.46Å; I439-F451 HydrophobicContact CG2-CB 4.03Å; I439-F451 HydrophobicContact CG2-CD2 4.2Å; I439-F451 HydrophobicContact CG2-CG 4.41Å; I439-F451 CarbonylContact O-C 3.57Å; V440-F451 VanDerWaalsContact CA-O 3.31Å; V440-F451 WeakPolarHBondContact CA-O 3.21Å; G441-F451 PolarHBondContact N-O 3.48Å; G441-F451 PolarHBondContact O-N 2.83Å; H443-F451 HydrophobicContact CB-CE2 3.61Å; H443-F451 HydrophobicContact CB-CZ 3.89Å; H443-F451 AromaticContact CD2-CE2 3.74Å; H443-F451 AromaticContact CD2-CZ 3.9Å; M449-F451 HydrophobicContact CE-CE1 4.01Å; M449-F451 HydrophobicContact CG-CE1 4.31Å; M449-F451 HydrophobicContact SD-CE1 4.29Å; F451-T453 HydrophobicContact CB-CG2 4.26Å; F451-F489 HydrophobicContact CD2-CD2 4.15Å; F451-F489 AromaticContact CE2-CD2 3.84Å; F451-F489 HydrophobicContact CE2-CD2 3.84Å; F451-F489 HydrophobicContact CE2-CE2 4.27Å; F451-F489 HydrophobicContact CE2-CG 4.45Å
452	A	98.6	Very high	96.1	Very high	2 Å²	2	16.6 Å²	16.6	2%	0.017	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	80.3	164.1	0	0	0	0	0	107.1	V93 I97 N308 I439 V466 M470	V93-A452 HydrophobicContact CG1-CB 3.93Å; I97-A452 HydrophobicContact CD1-CB 3.63Å; N308-A452 PolarHBondContact O-N 2.72Å; N308-A452 VanDerWaalsContact O-N 3.09Å; I439-A452 WeakPolarHBondContact O-CA 3.44Å; I439-A452 PolarHBondContact O-N 3.04Å; A452-V466 HydrophobicContact CB-CG1 4.11Å; A452-M470 HydrophobicContact CB-CE 4.43Å; A452-M470 HydrophobicContact CB-CG 3.95Å; A452-M470 HydrophobicContact CB-SD 4.23Å
453	T	98.6	Very high	96.2	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.006	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	174.8	-166.3	-171.1	0	0	0	0	111.3	G311 S314 L336 V338 I439 F451	G311-T453 PolarHBondContact O-OG1 3.06Å; S314-T453 WeakPolarHBondContact CB-OG1 3.33Å; S314-T453 WeakPolarHBondContact OG-CB 3.34Å; S314-T453 PolarHBondContact OG-OG1 3.31Å; L336-T453 HydrophobicContact CD2-CG2 4.12Å; V338-T453 HydrophobicContact CG2-CG2 4.26Å; I439-T453 PolarHBondContact N-O 3.24Å; I439-T453 PolarHBondContact O-N 3.28Å; F451-T453 HydrophobicContact CB-CG2 4.26Å
454	G	97.6	Very high	96.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.073	C	C	.	.			trans	79.7	28.6	174.1	0	0	0	0	0	112.7	D430 N432 N437 S456	D430-G454 CarbonylContact O-C 3.51Å; D430-G454 VanDerWaalsContact O-C 3.23Å; D430-G454 WeakPolarHBondContact O-CA 3.23Å; D430-G454 PolarHBondContact OD2-N 3.24Å; N432-G454 WeakPolarHBondContact CB-O 3.4Å; N437-G454 CarbonylContact C-O 3.51Å; N437-G454 VanDerWaalsContact C-O 3.25Å; G454-S456 PolarHBondContact O-N 3.32Å; G454-S456 PolarHBondContact O-OG 3.21Å
455	F	97.3	Very high	96.7	Very high	5 Å²	5	10.6 Å²	10.6	2%	0.022	6%	0.063	C	C	.	.			trans	-80.3	2.4	-173.8	-63.4	-81.6	0	0	0	113.7	V93 D430 V440 G457 H458 G459 V466	V93-F455 HydrophobicContact CG1-CE2 4.39Å; V93-F455 HydrophobicContact CG2-CE2 4.23Å; D430-F455 PolarHBondContact O-N 3.49Å; D430-F455 PolarHBondContact OD2-N 3.44Å; D430-F455 VanDerWaalsContact OD2-N 3.13Å; V440-F455 HydrophobicContact CG2-CE1 4.16Å; V440-F455 HydrophobicContact CG2-CZ 4.01Å; F455-G457 PolarHBondContact O-N 3.07Å; F455-H458 PolarHBondContact O-N 3.18Å; F455-G459 VanDerWaalsContact CB-N 3.26Å; F455-V466 HydrophobicContact CE1-CG1 4.48Å; F455-V466 HydrophobicContact CE1-CG2 3.66Å; F455-V466 HydrophobicContact CE2-CG1 4.49Å; F455-V466 HydrophobicContact CZ-CB 4.32Å; F455-V466 HydrophobicContact CZ-CG1 3.73Å; F455-V466 HydrophobicContact CZ-CG2 3.75Å
456	S	96.1	Very high	96.9	Very high	10 Å²	10	9.8 Å²	9.8	7%	0.07	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	39.6	171.4	-50	0	0	0	0	114.6	Y429 D430 N432 Q436 G454	Y429-S456 WeakPolarHBondContact CD2-O 3.32Å; Y429-S456 WeakPolarHBondContact CE2-O 3.41Å; D430-S456 PolarHBondContact O-N 3.13Å; D430-S456 VanDerWaalsContact O-N 3.09Å; N432-S456 PolarHBondContact N-OG 2.95Å; Q436-S456 VanDerWaalsContact C-OG 3.28Å; Q436-S456 VanDerWaalsContact CA-OG 3.27Å; Q436-S456 WeakPolarHBondContact CA-OG 3.32Å; Q436-S456 WeakPolarHBondContact O-CB 3.13Å; Q436-S456 PolarHBondContact O-OG 3.47Å; G454-S456 PolarHBondContact O-N 3.32Å; G454-S456 PolarHBondContact O-OG 3.21Å
457	G	92.4	Very high	97.1	Very high	19 Å²	19	9.7 Å²	9.7	20%	0.196	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.7	-4.7	178.6	0	0	0	0	0	116	Y429 F455	Y429-G457 VanDerWaalsContact CZ-CA 3.41Å; F455-G457 PolarHBondContact O-N 3.07Å
458	H	93.4	Very high	97.5	Very high	28 Å²	28	10.5 Å²	10.5	13%	0.13	6%	0.056	C	C	.	.			trans	-110.1	1.3	-179.2	-54.5	-30.6	0	0	0	114	R135 F138 F455 L460 Q461 H462 V504	R135-H458 PolarHBondContact NH2-CE1 3.33Å; R135-H458 PolarHBondContact NH2-NE2 3.41Å; F138-H458 AromaticContact CE1-CD2 3.5Å; F138-H458 VanDerWaalsContact CE1-CD2 3.5Å; F138-H458 WeakPolarHBondContact CE1-CD2 3.2Å; F138-H458 AromaticContact CE1-NE2 3.66Å; F138-H458 HydrophobicContact CZ-CB 4.48Å; F138-H458 AromaticContact CZ-CD2 3.86Å; F138-H458 AromaticContact CZ-CG 3.98Å; F455-H458 PolarHBondContact O-N 3.18Å; H458-L460 VanDerWaalsContact C-N 3.26Å; H458-L460 PolarHBondContact O-N 3.48Å; H458-Q461 HydrophobicContact CB-CG 4.33Å; H458-Q461 WeakPolarHBondContact O-CG 3.34Å; H458-Q461 PolarHBondContact O-N 2.83Å; H458-H462 PolarHBondContact O-N 2.94Å; H458-H462 VanDerWaalsContact O-N 3.09Å; H458-V504 PolarHBondContact CE1-O 3.39Å
459	G	95.1	Very high	97.5	Very high	10 Å²	10	10.5 Å²	10.5	10%	0.103	6%	0.056	C	C	.	.	H	α-helix	trans	-61.2	-31.1	-175.8	0	0	0	0	0	114	F455 S463	F455-G459 VanDerWaalsContact CB-N 3.26Å; G459-S463 VanDerWaalsContact O-CB 3.27Å; G459-S463 WeakPolarHBondContact O-CB 3.49Å; G459-S463 PolarHBondContact O-N 3.48Å
460	L	97.5	Very high	97.6	Very high	14 Å²	14	10.5 Å²	10.5	7%	0.073	6%	0.056	C	C	.	.	H	α-helix	trans	-61.9	-57	176.9	175.8	64	0	0	0	111.4	V92 T127 S130 F237 P239 L242 H458 H462 S463	V92-L460 HydrophobicContact CB-CD1 4.36Å; V92-L460 HydrophobicContact CG1-CD1 3.85Å; V92-L460 HydrophobicContact CG2-CD1 4.34Å; T127-L460 HydrophobicContact CG2-CD1 4.18Å; S130-L460 WeakPolarHBondContact OG-CD2 3.35Å; F237-L460 HydrophobicContact CE2-CD1 4.07Å; F237-L460 HydrophobicContact CE2-CD2 4.17Å; F237-L460 HydrophobicContact CE2-CG 4.14Å; F237-L460 HydrophobicContact CZ-CD1 4.13Å; F237-L460 HydrophobicContact CZ-CD2 3.99Å; F237-L460 HydrophobicContact CZ-CG 3.78Å; P239-L460 HydrophobicContact CB-CD1 4.03Å; P239-L460 HydrophobicContact CB-CD2 3.69Å; P239-L460 HydrophobicContact CG-CD2 3.67Å; L242-L460 HydrophobicContact CD2-CD1 4.14Å; H458-L460 VanDerWaalsContact C-N 3.26Å; H458-L460 PolarHBondContact O-N 3.48Å; L460-H462 VanDerWaalsContact C-N 3.33Å; L460-H462 PolarHBondContact O-N 3Å; L460-S463 PolarHBondContact O-N 3.49Å; L460-S463 PolarHBondContact O-OG 3.13Å
461	Q	97.6	Very high	97.6	Very high	7 Å²	7	9.7 Å²	9.7	3%	0.033	5%	0.053	C	C	.	.	H	α-helix	trans	-66.7	-33	-179.4	59.4	174	-25.5	0	0	112.6	I134 R135 S150 H458 S463	I134-Q461 HydrophobicContact CB-CB 4.08Å; I134-Q461 HydrophobicContact CD1-CB 4.34Å; I134-Q461 HydrophobicContact CG1-CB 4.1Å; R135-Q461 PolarHBondContact O-OE1 3.22Å; R135-Q461 VanDerWaalsContact O-OE1 3.09Å; S150-Q461 WeakPolarHBondContact CB-O 3.45Å; S150-Q461 PolarHBondContact OG-O 2.94Å; H458-Q461 HydrophobicContact CB-CG 4.33Å; H458-Q461 WeakPolarHBondContact O-CG 3.34Å; H458-Q461 PolarHBondContact O-N 2.83Å; Q461-S463 VanDerWaalsContact C-N 3.33Å
462	H	98.3	Very high	97.5	Very high	3 Å²	3	9.8 Å²	9.8	1%	0.014	5%	0.053	C	C	.	.	H	α-helix	trans	-81.1	-13.9	-179.7	-65.8	165	0	0	0	113.3	F138 N143 S147 S150 H458 L460 A465 V466	F138-H462 AromaticContact CE2-NE2 3.93Å; F138-H462 AromaticContact CZ-NE2 3.97Å; N143-H462 PolarHBondContact OD1-CE1 2.83Å; S147-H462 PolarHBondContact OG-CD2 2.83Å; S147-H462 PolarHBondContact OG-NE2 3.02Å; S150-H462 PolarHBondContact OG-O 2.88Å; H458-H462 PolarHBondContact O-N 2.94Å; H458-H462 VanDerWaalsContact O-N 3.09Å; L460-H462 VanDerWaalsContact C-N 3.33Å; L460-H462 PolarHBondContact O-N 3Å; H462-A465 PolarHBondContact O-N 2.81Å; H462-V466 HydrophobicContact CB-CG2 4.01Å; H462-V466 WeakPolarHBondContact O-CB 3.39Å; H462-V466 WeakPolarHBondContact O-CG2 3.14Å; H462-V466 PolarHBondContact O-N 2.94Å
463	S	98.4	Very high	97.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-55.5	-40.3	-171.7	61.2	0	0	0	0	115.6	V92 S96 G459 L460 Q461 G467	V92-S463 WeakPolarHBondContact CG2-OG 2.95Å; S96-S463 VanDerWaalsContact CB-O 3.29Å; S96-S463 WeakPolarHBondContact CB-O 3.35Å; S96-S463 PolarHBondContact OG-O 2.73Å; G459-S463 VanDerWaalsContact O-CB 3.27Å; G459-S463 WeakPolarHBondContact O-CB 3.49Å; G459-S463 PolarHBondContact O-N 3.48Å; L460-S463 PolarHBondContact O-N 3.49Å; L460-S463 PolarHBondContact O-OG 3.13Å; Q461-S463 VanDerWaalsContact C-N 3.33Å; S463-G467 PolarHBondContact O-N 2.73Å
464	P	98.6	Very high	97.5	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.006	7%	0.065	C	C	.	.	H	α-helix	trans	-61	-48.9	177	-23	33.7	0	0	0	113.4	W100 S150 F153 M154 F246 G467 R468	W100-P464 PolarHBondContact NE1-O 3.16Å; S150-P464 WeakPolarHBondContact OG-CD 3.3Å; F153-P464 HydrophobicContact CB-CB 3.96Å; F153-P464 HydrophobicContact CD1-CB 3.58Å; F153-P464 HydrophobicContact CD1-CG 3.93Å; F153-P464 HydrophobicContact CD2-CB 4.35Å; F153-P464 HydrophobicContact CE1-CB 4.16Å; F153-P464 HydrophobicContact CE1-CG 4.48Å; F153-P464 HydrophobicContact CG-CB 3.69Å; F153-P464 HydrophobicContact CG-CG 4.46Å; M154-P464 HydrophobicContact CG-CG 4.46Å; F246-P464 HydrophobicContact CE2-CG 4.15Å; F246-P464 HydrophobicContact CZ-CB 4.01Å; F246-P464 HydrophobicContact CZ-CG 4.05Å; P464-G467 PolarHBondContact O-N 2.97Å; P464-R468 PolarHBondContact O-N 2.85Å
465	A	98.6	Very high	97.4	Very high	8 Å²	8	15.1 Å²	15.1	7%	0.066	8%	0.081	C	C	.	.	H	α-helix	trans	-70.9	-39.8	-178.4	0	0	0	0	0	112.4	L146 A149 S150 H462 G467 R468 A469 L482	L146-A465 HydrophobicContact CD2-CB 3.62Å; A149-A465 HydrophobicContact CB-CB 3.95Å; S150-A465 WeakPolarHBondContact OG-CB 3.46Å; S150-A465 PolarHBondContact OG-N 3.01Å; H462-A465 PolarHBondContact O-N 2.81Å; A465-G467 VanDerWaalsContact C-N 3.34Å; A465-G467 PolarHBondContact O-N 3.44Å; A465-R468 PolarHBondContact O-N 2.84Å; A465-A469 PolarHBondContact O-N 3.35Å; A465-L482 HydrophobicContact CB-CD1 4.2Å
466	V	98.7	Very high	97.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61	-43.2	174.8	168	0	0	0	0	111.1	V93 L146 A452 F455 H462 R468 A469 M470	V93-V466 HydrophobicContact CG1-CG1 4.22Å; L146-V466 HydrophobicContact CD1-CG2 4.46Å; L146-V466 HydrophobicContact CD2-CG2 4.09Å; A452-V466 HydrophobicContact CB-CG1 4.11Å; F455-V466 HydrophobicContact CE1-CG1 4.48Å; F455-V466 HydrophobicContact CE1-CG2 3.66Å; F455-V466 HydrophobicContact CE2-CG1 4.49Å; F455-V466 HydrophobicContact CZ-CB 4.32Å; F455-V466 HydrophobicContact CZ-CG1 3.73Å; F455-V466 HydrophobicContact CZ-CG2 3.75Å; H462-V466 HydrophobicContact CB-CG2 4.01Å; H462-V466 WeakPolarHBondContact O-CB 3.39Å; H462-V466 WeakPolarHBondContact O-CG2 3.14Å; H462-V466 PolarHBondContact O-N 2.94Å; V466-R468 VanDerWaalsContact C-N 3.29Å; V466-R468 PolarHBondContact O-N 2.96Å; V466-A469 PolarHBondContact O-N 2.55Å; V466-M470 HydrophobicContact CG1-CG 4.31Å; V466-M470 WeakPolarHBondContact O-CB 3.38Å; V466-M470 WeakPolarHBondContact O-CG 3.38Å; V466-M470 PolarHBondContact O-N 3.5Å
467	G	98.8	Very high	97.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-42.3	177.7	0	0	0	0	0	112.5	S96 W100 S463 P464 A465 M470 A471	S96-G467 WeakPolarHBondContact OG-CA 3.41Å; W100-G467 WeakPolarHBondContact CB-O 3.38Å; W100-G467 VanDerWaalsContact CD1-C 3.41Å; S463-G467 PolarHBondContact O-N 2.73Å; P464-G467 PolarHBondContact O-N 2.97Å; A465-G467 VanDerWaalsContact C-N 3.34Å; A465-G467 PolarHBondContact O-N 3.44Å; G467-M470 PolarHBondContact O-N 2.89Å; G467-A471 PolarHBondContact O-N 3.15Å
468	R	98.8	Very high	97.6	Very high	93 Å²	93	20.8 Å²	20.8	35%	0.351	13%	0.126	S	C	.	.	H	α-helix	trans	-63.3	-50	175.2	-174.9	176.3	173.4	165.3	-1.2	111.8	W100 P464 A465 V466 M470 A471 E472 T481	W100-R468 HydrophobicContact CD2-CB 3.71Å; W100-R468 HydrophobicContact CD2-CG 4.02Å; W100-R468 HydrophobicContact CE3-CB 4.24Å; W100-R468 HydrophobicContact CE3-CG 4.02Å; W100-R468 HydrophobicContact CG-CB 3.95Å; W100-R468 HydrophobicContact CH2-CG 4.29Å; W100-R468 HydrophobicContact CZ2-CB 4.06Å; W100-R468 HydrophobicContact CZ2-CG 4.27Å; W100-R468 HydrophobicContact CZ3-CG 4.16Å; P464-R468 PolarHBondContact O-N 2.85Å; A465-R468 PolarHBondContact O-N 2.84Å; V466-R468 VanDerWaalsContact C-N 3.29Å; V466-R468 PolarHBondContact O-N 2.96Å; R468-M470 VanDerWaalsContact C-N 3.26Å; R468-M470 PolarHBondContact O-N 3.49Å; R468-A471 PolarHBondContact O-N 3.12Å; R468-E472 IonicContact NE-OE1 2.72Å; R468-E472 PolarHBondContact NE-OE1 2.8Å; R468-E472 VanDerWaalsContact NE-OE1 3.13Å; R468-E472 WeakPolarHBondContact O-CG 3.46Å; R468-E472 PolarHBondContact O-N 2.97Å; R468-T481 PolarHBondContact NE-OG1 3.47Å; R468-T481 PolarHBondContact NH2-OG1 3.41Å
469	A	98.6	Very high	97.8	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-39.3	-179.5	0	0	0	0	0	111.7	A465 V466 E472 L473 F479 L484	A465-A469 PolarHBondContact O-N 3.35Å; V466-A469 PolarHBondContact O-N 2.55Å; A469-E472 PolarHBondContact O-N 3.31Å; A469-L473 WeakPolarHBondContact O-CB 3.48Å; A469-L473 PolarHBondContact O-N 3.1Å; A469-F479 HydrophobicContact CB-CD1 3.95Å; A469-F479 HydrophobicContact CB-CE1 4.04Å; A469-L484 HydrophobicContact CB-CD1 3.42Å; A469-L484 VanDerWaalsContact CB-CD1 3.42Å; A469-L484 HydrophobicContact CB-CG 4.12Å
470	M	98.7	Very high	97.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-43.2	174.8	-76.6	-56.8	-66.4	0	0	112.9	I97 V307 V440 F450 A452 V466 G467 R468 E472 L473 I474	I97-M470 HydrophobicContact CD1-CB 4.33Å; I97-M470 HydrophobicContact CD1-CG 4.1Å; I97-M470 HydrophobicContact CG1-CB 3.93Å; I97-M470 HydrophobicContact CG1-CG 4.15Å; I97-M470 HydrophobicContact CG2-CB 4.27Å; V307-M470 HydrophobicContact CG1-CE 3.86Å; V440-M470 HydrophobicContact CG1-CG 4.27Å; V440-M470 HydrophobicContact CG1-SD 3.56Å; V440-M470 VanDerWaalsContact CG1-SD 3.56Å; F450-M470 HydrophobicContact CB-CE 3.49Å; F450-M470 VanDerWaalsContact CB-CE 3.49Å; F450-M470 HydrophobicContact CD1-CE 4.11Å; F450-M470 HydrophobicContact CG-CE 4.12Å; A452-M470 HydrophobicContact CB-CE 4.43Å; A452-M470 HydrophobicContact CB-CG 3.95Å; A452-M470 HydrophobicContact CB-SD 4.23Å; V466-M470 HydrophobicContact CG1-CG 4.31Å; V466-M470 WeakPolarHBondContact O-CB 3.38Å; V466-M470 WeakPolarHBondContact O-CG 3.38Å; V466-M470 PolarHBondContact O-N 3.5Å; G467-M470 PolarHBondContact O-N 2.89Å; R468-M470 VanDerWaalsContact C-N 3.26Å; R468-M470 PolarHBondContact O-N 3.49Å; M470-E472 VanDerWaalsContact C-N 3.35Å; M470-L473 PolarHBondContact O-N 2.97Å; M470-I474 HydrophobicContact CE-CD1 4.16Å; M470-I474 WeakPolarHBondContact O-CB 3.19Å; M470-I474 VanDerWaalsContact O-CG1 3.27Å; M470-I474 WeakPolarHBondContact O-CG1 3.06Å; M470-I474 PolarHBondContact O-N 3.13Å
471	A	98.6	Very high	97.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-39.1	176.4	0	0	0	0	0	112.2	W100 L101 K104 G467 R468 I474 L475	W100-A471 HydrophobicContact CB-CB 3.64Å; L101-A471 HydrophobicContact CD2-CB 4.03Å; L101-A471 HydrophobicContact CG-CB 4.18Å; K104-A471 HydrophobicContact CD-CB 3.98Å; G467-A471 PolarHBondContact O-N 3.15Å; R468-A471 PolarHBondContact O-N 3.12Å; A471-I474 PolarHBondContact O-N 2.88Å; A471-L475 VanDerWaalsContact O-CB 3.32Å; A471-L475 WeakPolarHBondContact O-CB 3.39Å; A471-L475 WeakPolarHBondContact O-CG 3.46Å; A471-L475 PolarHBondContact O-N 3.01Å
472	E	98.3	Very high	97.8	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-46.9	172	-71.1	172.1	-179.1	0	0	111.7	K104 R468 A469 M470 I474 D476 G477 G478 K480 T481	K104-E472 HydrophobicContact CD-CG 4.04Å; K104-E472 VanDerWaalsContact CE-CG 3.5Å; R468-E472 IonicContact NE-OE1 2.72Å; R468-E472 PolarHBondContact NE-OE1 2.8Å; R468-E472 VanDerWaalsContact NE-OE1 3.13Å; R468-E472 WeakPolarHBondContact O-CG 3.46Å; R468-E472 PolarHBondContact O-N 2.97Å; A469-E472 PolarHBondContact O-N 3.31Å; M470-E472 VanDerWaalsContact C-N 3.35Å; E472-I474 VanDerWaalsContact C-N 3.32Å; E472-I474 PolarHBondContact O-N 3.29Å; E472-D476 CarbonylContact O-C 3.59Å; E472-D476 VanDerWaalsContact O-CA 3.26Å; E472-D476 WeakPolarHBondContact O-CA 3.5Å; E472-D476 WeakPolarHBondContact O-CB 3.35Å; E472-D476 PolarHBondContact O-N 3.12Å; E472-G477 PolarHBondContact O-N 3.06Å; E472-G478 CarbonylContact C-O 3.57Å; E472-K480 HydrophobicContact CB-CG 4.27Å; E472-K480 HydrophobicContact CG-CB 4.22Å; E472-K480 HydrophobicContact CG-CG 4.24Å; E472-K480 WeakPolarHBondContact OE2-CA 3.38Å; E472-K480 PolarHBondContact OE2-N 3.38Å; E472-T481 WeakPolarHBondContact OE1-CB 3.41Å; E472-T481 PolarHBondContact OE1-OG1 2.7Å; E472-T481 PolarHBondContact OE2-N 2.87Å
473	L	97.9	Very high	97.7	Very high	31 Å²	31	36.3 Å²	36.3	16%	0.162	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-42.3	178.2	-177.5	62.6	0	0	0	112.1	F450 A469 M470 G477 F479	F450-L473 HydrophobicContact CD1-CD2 3.85Å; F450-L473 HydrophobicContact CD1-CG 4.35Å; F450-L473 HydrophobicContact CE1-CD2 3.85Å; F450-L473 HydrophobicContact CE1-CG 3.91Å; A469-L473 WeakPolarHBondContact O-CB 3.48Å; A469-L473 PolarHBondContact O-N 3.1Å; M470-L473 PolarHBondContact O-N 2.97Å; L473-G477 VanDerWaalsContact O-CA 3.32Å; L473-G477 WeakPolarHBondContact O-CA 3.36Å; L473-G477 PolarHBondContact O-N 3.03Å; L473-F479 HydrophobicContact CB-CD1 4.29Å; L473-F479 HydrophobicContact CB-CE1 4.03Å; L473-F479 HydrophobicContact CD2-CE1 4.1Å; L473-F479 HydrophobicContact CD2-CZ 4.04Å; L473-F479 HydrophobicContact CG-CE1 4.49Å
474	I	97.7	Very high	97.6	Very high	23 Å²	23	36.4 Å²	36.4	12%	0.118	20%	0.203	C	C	.	.	H	α-helix	trans	-74.2	-46.6	-177.3	-71.1	166.4	0	0	0	112.2	I85 L101 I305 V307 F450 M470 A471 E472	I85-I474 HydrophobicContact CD1-CG2 3.83Å; L101-I474 HydrophobicContact CD2-CB 4.18Å; L101-I474 HydrophobicContact CD2-CD1 4.33Å; L101-I474 HydrophobicContact CD2-CG2 3.96Å; I305-I474 HydrophobicContact CD1-CG2 3.64Å; V307-I474 HydrophobicContact CG2-CD1 3.68Å; F450-I474 HydrophobicContact CD1-CG1 4.24Å; F450-I474 HydrophobicContact CD2-CG1 4.38Å; F450-I474 HydrophobicContact CE1-CG1 4.16Å; F450-I474 HydrophobicContact CE2-CG1 4.31Å; F450-I474 HydrophobicContact CG-CG1 4.36Å; F450-I474 HydrophobicContact CZ-CG1 4.2Å; M470-I474 HydrophobicContact CE-CD1 4.16Å; M470-I474 WeakPolarHBondContact O-CB 3.19Å; M470-I474 VanDerWaalsContact O-CG1 3.27Å; M470-I474 WeakPolarHBondContact O-CG1 3.06Å; M470-I474 PolarHBondContact O-N 3.13Å; A471-I474 PolarHBondContact O-N 2.88Å; E472-I474 VanDerWaalsContact C-N 3.32Å; E472-I474 PolarHBondContact O-N 3.29Å
475	L	96.9	Very high	97.5	Very high	61 Å²	61	39.2 Å²	39.2	32%	0.319	22%	0.222	S	C	.	.	H	α-helix	trans	-91.3	-36	-172.9	-60.8	177.9	0	0	0	112.9	L101 K104 V111 A471	L101-L475 HydrophobicContact CD2-CD1 4.05Å; L101-L475 HydrophobicContact CD2-CD2 4.29Å; L101-L475 HydrophobicContact CD2-CG 3.93Å; K104-L475 HydrophobicContact CB-CD1 3.91Å; V111-L475 HydrophobicContact CG2-CD2 4.29Å; A471-L475 VanDerWaalsContact O-CB 3.32Å; A471-L475 WeakPolarHBondContact O-CB 3.39Å; A471-L475 WeakPolarHBondContact O-CG 3.46Å; A471-L475 PolarHBondContact O-N 3.01Å
476	D	96.4	Very high	97.4	Very high	68 Å²	68	40.5 Å²	40.5	36%	0.364	23%	0.233	S	C	.	.	H	α-helix	trans	-101.4	-2	-175.6	-48.7	-37	0	0	0	112.8	K104 E472 G478 K480	K104-D476 WeakPolarHBondContact CE-OD2 3.47Å; K104-D476 IonicContact NZ-OD1 3.81Å; K104-D476 IonicContact NZ-OD2 2.75Å; K104-D476 PolarHBondContact NZ-OD2 2.69Å; E472-D476 CarbonylContact O-C 3.59Å; E472-D476 VanDerWaalsContact O-CA 3.26Å; E472-D476 WeakPolarHBondContact O-CA 3.5Å; E472-D476 WeakPolarHBondContact O-CB 3.35Å; E472-D476 PolarHBondContact O-N 3.12Å; D476-G478 VanDerWaalsContact C-N 3.27Å; D476-G478 PolarHBondContact O-N 3.05Å; D476-K480 VanDerWaalsContact CB-CE 3.42Å; D476-K480 HydrophobicContact CB-CG 4.23Å
477	G	96.1	Very high	97.3	Very high	67 Å²	67	40.6 Å²	40.6	69%	0.691	23%	0.233	S	C	*	.	S	Bend	trans	73.9	10.2	178.2	0	0	0	0	0	115	E472 L473	E472-G477 PolarHBondContact O-N 3.06Å; L473-G477 VanDerWaalsContact O-CA 3.32Å; L473-G477 WeakPolarHBondContact O-CA 3.36Å; L473-G477 PolarHBondContact O-N 3.03Å
478	G	96.9	Very high	97.3	Very high	18 Å²	18	42 Å²	42	19%	0.186	24%	0.244	C	C	.	.	S	Bend	trans	177.1	157.7	179.6	0	0	0	0	0	112.4	E472 D476	E472-G478 CarbonylContact C-O 3.57Å; D476-G478 VanDerWaalsContact C-N 3.27Å; D476-G478 PolarHBondContact O-N 3.05Å
479	F	97.8	Very high	97.1	Very high	39 Å²	39	37.7 Å²	37.7	17%	0.171	23%	0.227	C	C	.	.			trans	-58	137.8	175	-58.2	-54.4	0	0	0	111.3	V440 A469 L473 L482 L484	V440-F479 HydrophobicContact CG1-CE1 4.28Å; V440-F479 HydrophobicContact CG1-CZ 4.21Å; A469-F479 HydrophobicContact CB-CD1 3.95Å; A469-F479 HydrophobicContact CB-CE1 4.04Å; L473-F479 HydrophobicContact CB-CD1 4.29Å; L473-F479 HydrophobicContact CB-CE1 4.03Å; L473-F479 HydrophobicContact CD2-CE1 4.1Å; L473-F479 HydrophobicContact CD2-CZ 4.04Å; L473-F479 HydrophobicContact CG-CE1 4.49Å; F479-L482 WeakPolarHBondContact CB-O 3.18Å; F479-L484 HydrophobicContact CD1-CB 4.49Å; F479-L484 HydrophobicContact CD2-CB 4.46Å; F479-L484 HydrophobicContact CE1-CB 4.03Å; F479-L484 VanDerWaalsContact CE2-C 3.46Å; F479-L484 HydrophobicContact CE2-CB 4Å; F479-L484 HydrophobicContact CZ-CB 3.77Å
480	K	97.4	Very high	96.9	Very high	134 Å²	134	44.2 Å²	44.2	58%	0.583	26%	0.255	S	S	*	.	S	Bend	trans	-119.2	-42.6	-179.4	-56.9	-59.3	178.8	-170.3	0	112.6	E472 D476	E472-K480 HydrophobicContact CB-CG 4.27Å; E472-K480 HydrophobicContact CG-CB 4.22Å; E472-K480 HydrophobicContact CG-CG 4.24Å; E472-K480 WeakPolarHBondContact OE2-CA 3.38Å; E472-K480 PolarHBondContact OE2-N 3.38Å; D476-K480 VanDerWaalsContact CB-CE 3.42Å; D476-K480 HydrophobicContact CB-CG 4.23Å
481	T	96.4	Very high	96.8	Very high	67 Å²	67	44.9 Å²	44.9	41%	0.411	26%	0.258	S	S	.	.	S	Bend	trans	-95.3	-45.3	-172.9	-54.2	0	0	0	0	112.1	R468 E472	R468-T481 PolarHBondContact NE-OG1 3.47Å; R468-T481 PolarHBondContact NH2-OG1 3.41Å; E472-T481 WeakPolarHBondContact OE1-CB 3.41Å; E472-T481 PolarHBondContact OE1-OG1 2.7Å; E472-T481 PolarHBondContact OE2-N 2.87Å
482	L	95.8	Very high	96.7	Very high	37 Å²	37	45.4 Å²	45.4	19%	0.194	26%	0.26	C	S	.	.	S	Bend	trans	-131.4	124.5	176.4	-69	178.2	0	0	0	108.6	H145 L146 A149 A465 F479 L484	H145-L482 HydrophobicContact CB-CD2 4.01Å; L146-L482 HydrophobicContact CD2-CD1 4.2Å; A149-L482 HydrophobicContact CB-CD1 3.75Å; A465-L482 HydrophobicContact CB-CD1 4.2Å; F479-L482 WeakPolarHBondContact CB-O 3.18Å; L482-L484 HydrophobicContact CB-CD2 4.38Å; L482-L484 PolarHBondContact O-N 3.38Å
483	D	96.1	Very high	96.5	Very high	111 Å²	111	47.8 Å²	47.8	59%	0.594	27%	0.272	S	S	*	.			trans	-77.8	110.2	175.5	-173.6	5.3	0	0	0	110.1	S485	D483-S485 WeakPolarHBondContact OD1-CB 3.48Å; D483-S485 PolarHBondContact OD1-N 2.84Å; D483-S485 PolarHBondContact OD1-OG 3.21Å
484	L	97.1	Very high	96.3	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	28%	0.282	C	S	.	.			trans	-105.4	21.3	176.5	-54.7	-175.5	0	0	0	111.9	L146 V440 A469 F479 L482 A486 F487	L146-L484 HydrophobicContact CD1-CD2 4.08Å; L146-L484 HydrophobicContact CD2-CD1 3.93Å; L146-L484 HydrophobicContact CD2-CD2 3.78Å; L146-L484 HydrophobicContact CD2-CG 4.49Å; L146-L484 HydrophobicContact CG-CD2 3.83Å; V440-L484 HydrophobicContact CG1-CD1 4.17Å; A469-L484 HydrophobicContact CB-CD1 3.42Å; A469-L484 VanDerWaalsContact CB-CD1 3.42Å; A469-L484 HydrophobicContact CB-CG 4.12Å; F479-L484 HydrophobicContact CD1-CB 4.49Å; F479-L484 HydrophobicContact CD2-CB 4.46Å; F479-L484 HydrophobicContact CE1-CB 4.03Å; F479-L484 VanDerWaalsContact CE2-C 3.46Å; F479-L484 HydrophobicContact CE2-CB 4Å; F479-L484 HydrophobicContact CZ-CB 3.77Å; L482-L484 HydrophobicContact CB-CD2 4.38Å; L482-L484 PolarHBondContact O-N 3.38Å; L484-A486 PolarHBondContact O-N 3.45Å; L484-F487 HydrophobicContact CB-CD2 4.15Å; L484-F487 HydrophobicContact CD2-CD2 4.06Å; L484-F487 HydrophobicContact CD2-CE2 4.15Å; L484-F487 WeakPolarHBondContact O-CA 3.09Å; L484-F487 WeakPolarHBondContact O-CB 3.23Å; L484-F487 PolarHBondContact O-N 3.02Å
485	S	96.3	Very high	96.2	Very high	60 Å²	60	55.2 Å²	55.2	42%	0.42	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-59.2	-29.2	-179.9	-61.2	0	0	0	0	112.7	D483 F487 S488	D483-S485 WeakPolarHBondContact OD1-CB 3.48Å; D483-S485 PolarHBondContact OD1-N 2.84Å; D483-S485 PolarHBondContact OD1-OG 3.21Å; S485-F487 PolarHBondContact O-N 2.97Å; S485-S488 VanDerWaalsContact O-CB 3.23Å; S485-S488 WeakPolarHBondContact O-CB 3.32Å; S485-S488 PolarHBondContact O-N 3.1Å; S485-S488 VanDerWaalsContact O-N 3.09Å; S485-S488 PolarHBondContact O-OG 3.27Å
486	A	96.2	Very high	96.2	Very high	35 Å²	35	58 Å²	58	29%	0.289	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.9	-29.7	172.2	0	0	0	0	0	112.5	E142 L484 S488 R491 I498	E142-A486 HydrophobicContact CG-CB 4.1Å; L484-A486 PolarHBondContact O-N 3.45Å; A486-S488 VanDerWaalsContact C-N 3.32Å; A486-S488 PolarHBondContact O-N 2.91Å; A486-R491 VanDerWaalsContact O-CD 3.26Å; A486-R491 WeakPolarHBondContact O-CD 3.2Å; A486-I498 HydrophobicContact CB-CD1 4.11Å; A486-I498 WeakPolarHBondContact O-CD1 3.45Å
487	F	97.7	Very high	96.2	Very high	1 Å²	1	58 Å²	58	0%	0.004	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-88.2	7.4	176.8	-62	-39.7	0	0	0	113.9	E142 N143 L146 N437 G438 I439 V440 L484 S485 R491 I498	E142-F487 HydrophobicContact CB-CE1 4.49Å; E142-F487 HydrophobicContact CB-CE2 3.74Å; E142-F487 HydrophobicContact CB-CZ 3.59Å; N143-F487 VanDerWaalsContact OD1-CZ 3.29Å; N143-F487 WeakPolarHBondContact OD1-CZ 3.37Å; L146-F487 HydrophobicContact CD1-CD2 4.25Å; L146-F487 HydrophobicContact CD1-CE2 3.56Å; L146-F487 HydrophobicContact CD1-CZ 4.46Å; N437-F487 HydrophobicContact CB-CD1 4.1Å; N437-F487 HydrophobicContact CB-CE1 3.89Å; G438-F487 WeakPolarHBondContact O-CB 3.46Å; I439-F487 CarbonylContact C-O 3.47Å; I439-F487 WeakPolarHBondContact CA-O 3.48Å; V440-F487 HydrophobicContact CB-CB 4.1Å; V440-F487 HydrophobicContact CG2-CB 4.17Å; V440-F487 PolarHBondContact N-O 2.79Å; L484-F487 HydrophobicContact CB-CD2 4.15Å; L484-F487 HydrophobicContact CD2-CD2 4.06Å; L484-F487 HydrophobicContact CD2-CE2 4.15Å; L484-F487 WeakPolarHBondContact O-CA 3.09Å; L484-F487 WeakPolarHBondContact O-CB 3.23Å; L484-F487 PolarHBondContact O-N 3.02Å; S485-F487 PolarHBondContact O-N 2.97Å; F487-R491 PolarHBondContact O-NH1 2.85Å; F487-I498 HydrophobicContact CD1-CD1 3.7Å; F487-I498 HydrophobicContact CE1-CD1 3.63Å
488	S	96.9	Very high	96.1	Very high	31 Å²	31	56.9 Å²	56.9	22%	0.217	30%	0.3	C	S	.	.	S	Bend	trans	-68	155.1	178.6	69.3	0	0	0	0	112.8	V440 S485 A486 K490 R491	V440-S488 WeakPolarHBondContact O-CA 3.22Å; S485-S488 VanDerWaalsContact O-CB 3.23Å; S485-S488 WeakPolarHBondContact O-CB 3.32Å; S485-S488 PolarHBondContact O-N 3.1Å; S485-S488 VanDerWaalsContact O-N 3.09Å; S485-S488 PolarHBondContact O-OG 3.27Å; A486-S488 VanDerWaalsContact C-N 3.32Å; A486-S488 PolarHBondContact O-N 2.91Å; S488-K490 PolarHBondContact O-N 3.42Å; S488-K490 VanDerWaalsContact O-N 3.1Å; S488-K490 WeakPolarHBondContact OG-CB 3.24Å; S488-R491 WeakPolarHBondContact O-CG 3.4Å; S488-R491 PolarHBondContact O-N 3.15Å; S488-R491 PolarHBondContact O-NH1 2.92Å; S488-R491 VanDerWaalsContact O-NH1 3.17Å
489	F	95.7	Very high	95.9	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.009	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.2	174.3	-166.1	-89.7	0	0	0	112.7	I334 L336 I439 P444 F451 R491 I492 M493	I334-F489 HydrophobicContact CG2-CE1 4.15Å; I334-F489 HydrophobicContact CG2-CZ 3.93Å; L336-F489 HydrophobicContact CB-CE2 4.47Å; L336-F489 HydrophobicContact CD1-CD2 4.12Å; L336-F489 HydrophobicContact CD1-CE2 4Å; I439-F489 HydrophobicContact CG2-CD2 4.31Å; P444-F489 HydrophobicContact CG-CD1 4.23Å; F451-F489 HydrophobicContact CD2-CD2 4.15Å; F451-F489 AromaticContact CE2-CD2 3.84Å; F451-F489 HydrophobicContact CE2-CD2 3.84Å; F451-F489 HydrophobicContact CE2-CE2 4.27Å; F451-F489 HydrophobicContact CE2-CG 4.45Å; F489-R491 PolarHBondContact O-N 3.33Å; F489-I492 HydrophobicContact CD2-CD1 3.93Å; F489-I492 HydrophobicContact CE2-CD1 4.18Å; F489-I492 HydrophobicContact CG-CD1 4.45Å; F489-I492 WeakPolarHBondContact O-CB 3.3Å; F489-I492 PolarHBondContact O-N 3.2Å; F489-M493 HydrophobicContact CD1-CG 3.73Å; F489-M493 HydrophobicContact CD1-SD 3.94Å; F489-M493 HydrophobicContact CE1-CG 3.82Å; F489-M493 HydrophobicContact CE1-SD 4.42Å; F489-M493 PolarHBondContact O-N 3.25Å
490	K	94.9	Very high	95.7	Very high	139 Å²	139	60.8 Å²	60.8	60%	0.604	32%	0.317	S	S	*	.	H	α-helix	trans	-52.5	-41	178.6	-176.1	-177.9	175	-173.4	0	112.1	S488 I492 M493 T494	S488-K490 PolarHBondContact O-N 3.42Å; S488-K490 VanDerWaalsContact O-N 3.1Å; S488-K490 WeakPolarHBondContact OG-CB 3.24Å; K490-I492 PolarHBondContact O-N 2.87Å; K490-M493 WeakPolarHBondContact O-CA 3.48Å; K490-M493 VanDerWaalsContact O-CB 3.32Å; K490-M493 WeakPolarHBondContact O-CB 3.42Å; K490-M493 PolarHBondContact O-N 3.21Å; K490-T494 HydrophobicContact CG-CG2 4.27Å; K490-T494 PolarHBondContact O-N 3.03Å; K490-T494 PolarHBondContact O-OG1 2.93Å
491	R	96.1	Very high	95.4	Very high	13 Å²	13	59.6 Å²	59.6	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-31.7	-177.9	83.6	-176.9	-176.1	-87.8	11.7	113	N432 F434 D435 N437 G438 A486 F487 S488 F489 T494 K495 E496	N432-R491 PolarHBondContact ND2-NH2 3.17Å; F434-R491 HydrophobicContact CE1-CG 4.08Å; D435-R491 IonicContact OD1-CZ 3.36Å; D435-R491 IonicContact OD1-NE 3.13Å; D435-R491 IonicContact OD1-NH2 3.38Å; D435-R491 PolarHBondContact OD1-NH2 3.3Å; D435-R491 IonicContact OD2-CZ 3.84Å; D435-R491 IonicContact OD2-NE 3.43Å; D435-R491 PolarHBondContact OD2-NE 3.24Å; D435-R491 IonicContact OD2-NH2 2.66Å; D435-R491 PolarHBondContact OD2-NH2 3.46Å; N437-R491 PolarHBondContact O-NH2 3.34Å; N437-R491 VanDerWaalsContact O-NH2 3.13Å; G438-R491 PolarHBondContact O-NH1 3.36Å; G438-R491 PolarHBondContact O-NH2 3.08Å; A486-R491 VanDerWaalsContact O-CD 3.26Å; A486-R491 WeakPolarHBondContact O-CD 3.2Å; F487-R491 PolarHBondContact O-NH1 2.85Å; S488-R491 WeakPolarHBondContact O-CG 3.4Å; S488-R491 PolarHBondContact O-N 3.15Å; S488-R491 PolarHBondContact O-NH1 2.92Å; S488-R491 VanDerWaalsContact O-NH1 3.17Å; F489-R491 PolarHBondContact O-N 3.33Å; R491-T494 WeakPolarHBondContact CA-OG1 3.39Å; R491-T494 PolarHBondContact O-OG1 3.02Å; R491-K495 WeakPolarHBondContact O-CA 3.34Å; R491-K495 PolarHBondContact O-N 3.23Å; R491-E496 WeakPolarHBondContact CB-O 3.48Å; R491-E496 PolarHBondContact O-N 2.99Å
492	I	96.3	Very high	94.7	Very high	12 Å²	12	59.6 Å²	59.6	6%	0.062	31%	0.306	C	S	.	.	H	α-helix	trans	-71.1	-40.2	176.6	-56.9	164.2	0	0	0	108.8	I334 P337 F434 I439 F489 K490 K495	I334-I492 HydrophobicContact CG2-CG2 3.72Å; P337-I492 HydrophobicContact CG-CD1 3.79Å; P337-I492 HydrophobicContact CG-CG1 4.43Å; P337-I492 HydrophobicContact CG-CG2 4.38Å; F434-I492 HydrophobicContact CD1-CG1 3.83Å; F434-I492 HydrophobicContact CE1-CG1 4.2Å; F434-I492 HydrophobicContact CG-CG1 4.21Å; I439-I492 HydrophobicContact CD1-CD1 3.67Å; I439-I492 HydrophobicContact CG1-CD1 4.16Å; F489-I492 HydrophobicContact CD2-CD1 3.93Å; F489-I492 HydrophobicContact CE2-CD1 4.18Å; F489-I492 HydrophobicContact CG-CD1 4.45Å; F489-I492 WeakPolarHBondContact O-CB 3.3Å; F489-I492 PolarHBondContact O-N 3.2Å; K490-I492 PolarHBondContact O-N 2.87Å; I492-K495 PolarHBondContact O-N 3.28Å
493	M	93.8	Very high	93.6	Very high	52 Å²	52	59.2 Å²	59.2	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-40.9	175.3	-56.4	164.7	59.7	0	0	112.6	I331 I334 P444 F489 K490 K495	I331-M493 HydrophobicContact CB-CE 4.39Å; I331-M493 HydrophobicContact CD1-CE 3.54Å; I331-M493 HydrophobicContact CG1-CE 3.74Å; I331-M493 HydrophobicContact CG2-CE 3.77Å; I331-M493 HydrophobicContact CG2-SD 4.39Å; I334-M493 HydrophobicContact CD1-CB 4.22Å; I334-M493 HydrophobicContact CD1-CG 4.22Å; P444-M493 HydrophobicContact CB-CE 4.18Å; P444-M493 HydrophobicContact CB-SD 4.02Å; P444-M493 HydrophobicContact CG-CE 4.07Å; P444-M493 HydrophobicContact CG-SD 3.56Å; P444-M493 VanDerWaalsContact CG-SD 3.56Å; F489-M493 HydrophobicContact CD1-CG 3.73Å; F489-M493 HydrophobicContact CD1-SD 3.94Å; F489-M493 HydrophobicContact CE1-CG 3.82Å; F489-M493 HydrophobicContact CE1-SD 4.42Å; F489-M493 PolarHBondContact O-N 3.25Å; K490-M493 WeakPolarHBondContact O-CA 3.48Å; K490-M493 VanDerWaalsContact O-CB 3.32Å; K490-M493 WeakPolarHBondContact O-CB 3.42Å; K490-M493 PolarHBondContact O-N 3.21Å; M493-K495 VanDerWaalsContact C-N 3.28Å
494	T	94.4	Very high	92	Very high	61 Å²	61	56.8 Å²	56.8	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-82.9	-5.4	179.7	56.4	0	0	0	0	113.2	K490 R491 E496	K490-T494 HydrophobicContact CG-CG2 4.27Å; K490-T494 PolarHBondContact O-N 3.03Å; K490-T494 PolarHBondContact O-OG1 2.93Å; R491-T494 WeakPolarHBondContact CA-OG1 3.39Å; R491-T494 PolarHBondContact O-OG1 3.02Å; T494-E496 VanDerWaalsContact C-N 3.31Å; T494-E496 WeakPolarHBondContact CB-OE2 3.39Å; T494-E496 PolarHBondContact OG1-OE2 2.89Å
495	K	95.3	Very high	91.8	Very high	149 Å²	149	59.5 Å²	59.5	65%	0.648	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	41.3	-176.8	-55.9	179.6	-179.4	178.2	0	112.4	R491 I492 M493 P497	R491-K495 WeakPolarHBondContact O-CA 3.34Å; R491-K495 PolarHBondContact O-N 3.23Å; I492-K495 PolarHBondContact O-N 3.28Å; M493-K495 VanDerWaalsContact C-N 3.28Å; K495-P497 VanDerWaalsContact O-CD 3.25Å; K495-P497 WeakPolarHBondContact O-CD 3.43Å
496	E	96.1	Very high	91.5	Very high	121 Å²	121	59.5 Å²	59.5	57%	0.565	30%	0.301	S	S	*	.			trans	-111.9	83.3	180	-68.8	169.7	155.5	0	0	109.9	R491 T494	R491-E496 WeakPolarHBondContact CB-O 3.48Å; R491-E496 PolarHBondContact O-N 2.99Å; T494-E496 VanDerWaalsContact C-N 3.31Å; T494-E496 WeakPolarHBondContact CB-OE2 3.39Å; T494-E496 PolarHBondContact OG1-OE2 2.89Å
497	P	96.3	Very high	91.3	Very high	67 Å²	67	60.8 Å²	60.8	44%	0.435	30%	0.302	S	S	.	.			trans	-69.8	144.5	179.8	30.2	-35.3	0	0	0	111.6	F434 D435 K495	F434-P497 HydrophobicContact CD1-CB 4.36Å; F434-P497 VanDerWaalsContact CE1-CA 3.49Å; F434-P497 HydrophobicContact CE1-CB 3.83Å; F434-P497 HydrophobicContact CZ-CB 3.97Å; F434-P497 HydrophobicContact CZ-CG 4.46Å; D435-P497 HydrophobicContact CB-CB 3.73Å; K495-P497 VanDerWaalsContact O-CD 3.25Å; K495-P497 WeakPolarHBondContact O-CD 3.43Å
498	I	94.3	Very high	90.9	Very high	43 Å²	43	64.4 Å²	64.4	22%	0.221	32%	0.319	C	S	.	.			trans	-111.5	112.6	168.2	53.7	176.4	0	0	0	108.2	L140 D435 N437 A486 F487	L140-I498 HydrophobicContact CD1-CB 4.18Å; L140-I498 HydrophobicContact CD1-CD1 4.38Å; L140-I498 HydrophobicContact CD1-CG1 4.34Å; D435-I498 WeakPolarHBondContact CB-O 3.47Å; D435-I498 WeakPolarHBondContact OD2-CG1 3.26Å; D435-I498 PolarHBondContact OD2-N 3.13Å; D435-I498 VanDerWaalsContact OD2-N 3.09Å; N437-I498 HydrophobicContact CB-CG1 4.31Å; N437-I498 PolarHBondContact ND2-O 2.75Å; A486-I498 HydrophobicContact CB-CD1 4.11Å; A486-I498 WeakPolarHBondContact O-CD1 3.45Å; F487-I498 HydrophobicContact CD1-CD1 3.7Å; F487-I498 HydrophobicContact CE1-CD1 3.63Å
499	L	93.8	Very high	90.5	Very high	102 Å²	102	66.4 Å²	66.4	53%	0.534	33%	0.326	S	S	.	.			trans	-104.6	135.3	-174	-65.5	173	0	0	0	110.8	D435	D435-L499 HydrophobicContact CB-CD2 3.9Å
500	E	93.6	Very high	90.2	Very high	37 Å²	37	70.7 Å²	70.7	17%	0.173	35%	0.347	C	S	.	.			trans	-71.9	140.1	163	-75.9	-69.7	177.1	0	0	110.1	F138 S139 L140 N143 I503	F138-E500 HydrophobicContact CD1-CG 4.43Å; F138-E500 WeakPolarHBondContact CD1-OE1 3.39Å; S139-E500 WeakPolarHBondContact CA-OE2 3.14Å; S139-E500 VanDerWaalsContact CB-OE2 3.28Å; S139-E500 WeakPolarHBondContact CB-OE2 3.38Å; S139-E500 PolarHBondContact N-OE2 3.04Å; S139-E500 WeakPolarHBondContact OG-CA 3.27Å; S139-E500 PolarHBondContact OG-OE2 3.26Å; L140-E500 WeakPolarHBondContact CB-OE1 3.39Å; L140-E500 HydrophobicContact CD1-CG 4.15Å; L140-E500 HydrophobicContact CG-CG 4.33Å; L140-E500 WeakPolarHBondContact CG-OE1 3.24Å; L140-E500 PolarHBondContact N-OE1 2.93Å; L140-E500 PolarHBondContact N-OE2 3.17Å; N143-E500 WeakPolarHBondContact CB-OE1 3.43Å; N143-E500 PolarHBondContact ND2-OE1 2.89Å; E500-I503 HydrophobicContact CB-CB 3.92Å; E500-I503 HydrophobicContact CB-CG1 3.84Å; E500-I503 HydrophobicContact CG-CG1 4.34Å; E500-I503 WeakPolarHBondContact OE2-CG1 3.08Å
501	R	90.1	Very high	89.8	Confident	109 Å²	109	65.9 Å²	65.9	41%	0.411	33%	0.328	S	S	.	.	S	Bend	trans	-106.7	116.1	-178.5	-66.8	177.5	64.6	-152.5	-4.8	110.6	S139 I189 E192 N193 I503	S139-R501 PolarHBondContact OG-N 2.99Å; I189-R501 HydrophobicContact CG2-CB 3.87Å; E192-R501 IonicContact OE2-CZ 3.15Å; E192-R501 IonicContact OE2-NH1 3.7Å; E192-R501 PolarHBondContact OE2-NH1 3.2Å; E192-R501 IonicContact OE2-NH2 3.99Å; E192-R501 PolarHBondContact OE2-NH2 2.83Å; N193-R501 PolarHBondContact ND2-O 2.96Å; R501-I503 VanDerWaalsContact C-N 3.35Å; R501-I503 PolarHBondContact O-N 2.79Å
502	N	81.3	Confident	89.4	Confident	67 Å²	67	69.9 Å²	69.9	36%	0.358	35%	0.35	S	S	.	.	S	Bend	trans	56.7	45.4	178.2	-164.4	44.7	0	0	0	113.3	I189	I189-N502 HydrophobicContact CB-CB 4.41Å; I189-N502 HydrophobicContact CG2-CB 3.82Å
503	I	74.6	Confident	88.8	Confident	29 Å²	29	74.8 Å²	74.8	15%	0.149	37%	0.374	C	S	.	.			trans	-112.5	138.5	174.8	-59.2	-53.7	0	0	0	107.6	Q137 F138 E500 R501	Q137-I503 WeakPolarHBondContact O-CD1 3.28Å; F138-I503 HydrophobicContact CD1-CG2 3.94Å; F138-I503 HydrophobicContact CE1-CG2 3.97Å; E500-I503 HydrophobicContact CB-CB 3.92Å; E500-I503 HydrophobicContact CB-CG1 3.84Å; E500-I503 HydrophobicContact CG-CG1 4.34Å; E500-I503 WeakPolarHBondContact OE2-CG1 3.08Å; R501-I503 VanDerWaalsContact C-N 3.35Å; R501-I503 PolarHBondContact O-N 2.79Å
504	V	62.1	Low	88.3	Confident	60 Å²	60	76.8 Å²	76.8	36%	0.364	39%	0.385	S	S	.	.			trans	-66.8	0	179.3	-173.6	0	0	0	0	111.9	R135 F180 V362 H458	R135-V504 PolarHBondContact NH2-O 2.91Å; F180-V504 HydrophobicContact CE1-CG2 3.91Å; V362-V504 HydrophobicContact CB-CG2 4Å; V362-V504 HydrophobicContact CG1-CG2 3.06Å; V362-V504 HydrophobicContact CG2-CG2 3.75Å; H458-V504 PolarHBondContact CE1-O 3.39Å

Retrieved 504 of 504 residues in 1353.7 ms (Link to these results)

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