A0A077ZH86_TRITR Loading...

Iron-sulfur clusters transporter ABCB7, mitochondrial

AlphaFold DB , UniProt , Accession A0A077ZH86, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 587 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	36.2	Very low	34.8	Very low	233 Å²	233	149.7 Å²	149.7	100%	1.148	81%	0.813	S	S	*	*				0	104.4	0	-150.8	168.9	176.4	0	0	106.9	V3	M1-V3 PolarHBondContact O-N 2.9Å; M1-V3 VanDerWaalsContact O-N 3.16Å
2	K	26.5	Very low	35.2	Very low	214 Å²	214	140.9 Å²	140.9	93%	0.93	78%	0.783	S	S	*	*			trans	-71.3	103.5	179	-89.3	179.1	173.3	177.9	0	107.9
3	V	32.3	Very low	35.9	Very low	130 Å²	130	136.5 Å²	136.5	79%	0.788	76%	0.762	S	S	*	*			trans	-92.5	106	173.4	-177.4	0	0	0	0	107.2	M1	M1-V3 PolarHBondContact O-N 2.9Å; M1-V3 VanDerWaalsContact O-N 3.16Å
4	L	30.6	Very low	36.1	Very low	158 Å²	158	135.5 Å²	135.5	83%	0.827	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.3	133.6	177.9	-74.7	155.6	0	0	0	110.3
5	A	32.3	Very low	36.4	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-64	137.9	174.6	0	0	0	0	0	110.9	Q7	A5-Q7 PolarHBondContact O-N 3.05Å
6	P	33.1	Very low	36.6	Very low	121 Å²	121	138.4 Å²	138.4	79%	0.786	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-71.8	124.4	178.7	27.7	-30.5	0	0	0	110.3	I8	P6-I8 PolarHBondContact O-N 2.56Å
7	Q	34.6	Very low	36.7	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-60.2	118.2	168.2	-77.9	-179	-37.5	0	0	109.4	A5 T9	A5-Q7 PolarHBondContact O-N 3.05Å; Q7-T9 PolarHBondContact O-N 3Å
8	I	36.6	Very low	36.9	Very low	159 Å²	159	134.5 Å²	134.5	82%	0.815	73%	0.73	S	S	*	*			trans	-69.7	111.7	173.2	-63.1	168.9	0	0	0	107.4	P6	P6-I8 PolarHBondContact O-N 2.56Å
9	T	39.4	Very low	36.9	Very low	98 Å²	98	134.4 Å²	134.4	60%	0.601	73%	0.728	S	S	*	*			trans	-75.4	144	178.4	48.3	0	0	0	0	111.1	Q7 E11 G12	Q7-T9 PolarHBondContact O-N 3Å; T9-E11 PolarHBondContact O-N 3.12Å; T9-G12 PolarHBondContact O-N 3.42Å
10	S	41.2	Very low	36.9	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-12.7	-175.2	49.6	0	0	0	0	115
11	E	40.1	Very low	36.9	Very low	157 Å²	157	136.4 Å²	136.4	73%	0.734	73%	0.732	S	S	*	*	H	α-helix	trans	-72.7	-27	177.4	-71.3	-175.3	151.2	0	0	113.1	T9 V13	T9-E11 PolarHBondContact O-N 3.12Å; E11-V13 PolarHBondContact O-N 3.48Å
12	G	39.7	Very low	36.8	Very low	44 Å²	44	135.4 Å²	135.4	45%	0.454	72%	0.715	S	S	.	*	H	α-helix	trans	-70.9	-28.5	178	0	0	0	0	0	114	T9	T9-G12 PolarHBondContact O-N 3.42Å
13	V	43.8	Very low	37.3	Very low	84 Å²	84	135 Å²	135	51%	0.509	71%	0.709	S	S	.	*	H	α-helix	trans	-77.4	-30.6	-179.6	-178.3	0	0	0	0	111.3	E11 F16 L17	E11-V13 PolarHBondContact O-N 3.48Å; V13-F16 PolarHBondContact O-N 3.33Å; V13-L17 HydrophobicContact CG1-CD1 4.2Å; V13-L17 PolarHBondContact O-N 3.07Å
14	L	39.7	Very low	37.3	Very low	122 Å²	122	134 Å²	134	64%	0.639	71%	0.705	S	S	*	*	H	α-helix	trans	-74.2	-30.6	-179.5	-130.8	88.7	0	0	0	112.9	F16 T18	L14-F16 VanDerWaalsContact C-N 3.34Å; L14-T18 PolarHBondContact O-N 2.79Å; L14-T18 PolarHBondContact O-OG1 3.09Å
15	Q	39.6	Very low	37.4	Very low	146 Å²	146	131.7 Å²	131.7	68%	0.682	70%	0.702	S	S	*	*	H	α-helix	trans	-70.4	-29.7	173.6	-89.8	-176.7	-14.6	0	0	112.8	T18	Q15-T18 WeakPolarHBondContact CA-OG1 3.31Å; Q15-T18 PolarHBondContact O-OG1 2.97Å
16	F	40.5	Very low	37.3	Very low	172 Å²	172	132.4 Å²	132.4	75%	0.754	71%	0.708	S	S	*	*	H	α-helix	trans	-76.3	-36.1	177	-132.8	-90	0	0	0	112.4	V13 L14	V13-F16 PolarHBondContact O-N 3.33Å; L14-F16 VanDerWaalsContact C-N 3.34Å
17	L	38.3	Very low	37.2	Very low	113 Å²	113	132.3 Å²	132.3	59%	0.592	71%	0.706	S	S	*	*	H	α-helix	trans	-76.3	-25.1	179.1	-72.2	171	0	0	0	113.7	V13	V13-L17 HydrophobicContact CG1-CD1 4.2Å; V13-L17 PolarHBondContact O-N 3.07Å
18	T	40.5	Very low	36.9	Very low	93 Å²	93	128.7 Å²	128.7	57%	0.571	70%	0.696	S	S	*	*	H	α-helix	trans	-76.9	-29.1	176.1	39.4	0	0	0	0	113	L14 Q15	L14-T18 PolarHBondContact O-N 2.79Å; L14-T18 PolarHBondContact O-OG1 3.09Å; Q15-T18 WeakPolarHBondContact CA-OG1 3.31Å; Q15-T18 PolarHBondContact O-OG1 2.97Å
19	L	35.8	Very low	36.5	Very low	132 Å²	132	133.4 Å²	133.4	69%	0.691	70%	0.704	S	S	*	*	H	α-helix	trans	-71.3	-32.4	172.7	-102.9	142.2	0	0	0	112.7	R21 R22	L19-R21 VanDerWaalsContact C-N 3.3Å; L19-R21 PolarHBondContact O-N 2.84Å; L19-R22 PolarHBondContact O-N 2.7Å
20	A	37.4	Very low	35.9	Very low	78 Å²	78	139.1 Å²	139.1	65%	0.645	71%	0.714	S	S	*	*	H	α-helix	trans	-71.5	-19.3	179.2	0	0	0	0	0	114.2
21	R	35.7	Very low	35.3	Very low	233 Å²	233	142.4 Å²	142.4	88%	0.879	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-7.8	178.9	-89.8	-173	-179	-166.1	1.1	115	L19	L19-R21 VanDerWaalsContact C-N 3.3Å; L19-R21 PolarHBondContact O-N 2.84Å
22	R	34.8	Very low	34.8	Very low	212 Å²	212	140.4 Å²	140.4	80%	0.8	72%	0.72	S	S	*	*	S	Bend	trans	-93.7	0.4	-172.2	-131.3	174.5	-172.9	175.9	1.5	115.7	L19	L19-R22 PolarHBondContact O-N 2.7Å
23	Y	37.8	Very low	34.3	Very low	206 Å²	206	148.9 Å²	148.9	81%	0.808	74%	0.738	S	S	*	*			trans	-134.6	87	174.4	-69.9	-78.3	0	0	0	111.4
24	P	32	Very low	33.6	Very low	108 Å²	108	154.7 Å²	154.7	70%	0.701	75%	0.751	S	S	*	*			trans	-75.7	153.4	166.6	32.9	-30	0	0	0	109.7
25	S	33.3	Very low	33.3	Very low	110 Å²	110	154.7 Å²	154.7	77%	0.769	76%	0.759	S	S	*	*			trans	73.5	89	173.9	65.9	0	0	0	0	116.9	T27	S25-T27 PolarHBondContact O-N 3.3Å
26	A	29.9	Very low	32.9	Very low	104 Å²	104	152.3 Å²	152.3	86%	0.86	76%	0.757	S	S	*	*			trans	-58.6	113.5	148.8	0	0	0	0	0	109.7
27	T	30	Very low	32.5	Very low	120 Å²	120	152.3 Å²	152.3	74%	0.736	76%	0.757	S	S	*	*			trans	-152.8	120.1	155.6	-20.6	0	0	0	0	111.2	S25	S25-T27 PolarHBondContact O-N 3.3Å
28	V	29.7	Very low	32.1	Very low	110 Å²	110	153.5 Å²	153.5	67%	0.667	76%	0.759	S	S	*	*			trans	74.6	96.2	160.7	-158	0	0	0	0	118	R30	V28-R30 HydrophobicContact CG1-CG 4.1Å; V28-R30 PolarHBondContact O-N 3.41Å; V28-R30 VanDerWaalsContact O-N 3.1Å
29	W	26.4	Very low	32.1	Very low	258 Å²	258	153.2 Å²	153.2	98%	0.977	76%	0.759	S	S	*	*			trans	-48.8	106.6	149.8	-79.1	57.9	0	0	0	111
30	R	26.7	Very low	31.9	Very low	218 Å²	218	150.7 Å²	150.7	82%	0.823	76%	0.764	S	S	*	*			trans	-134.2	99.9	156.2	-85.1	-170.5	-179.8	-154.6	1	110.4	V28	V28-R30 HydrophobicContact CG1-CG 4.1Å; V28-R30 PolarHBondContact O-N 3.41Å; V28-R30 VanDerWaalsContact O-N 3.1Å
31	H	29.6	Very low	31.6	Very low	171 Å²	171	149.7 Å²	149.7	79%	0.792	76%	0.756	S	S	*	*			trans	55	77.3	144.5	-68.7	54.1	0	0	0	116.3
32	C	29.3	Very low	31.5	Very low	114 Å²	114	143.4 Å²	143.4	77%	0.77	75%	0.748	S	S	*	*			trans	-112.1	76.5	151.8	-161.7	0	0	0	0	107.9	R34	C32-R34 PolarHBondContact O-N 3.3Å; C32-R34 VanDerWaalsContact O-N 3.07Å
33	W	28.9	Very low	31.5	Very low	222 Å²	222	138.6 Å²	138.6	84%	0.841	74%	0.742	S	S	*	*			trans	-67	100.7	163.3	-96.2	61.7	0	0	0	107.2
34	R	30.5	Very low	31.3	Very low	207 Å²	207	133.3 Å²	133.3	78%	0.781	74%	0.742	S	S	*	*			trans	-71.3	123	161.4	-75.2	-171.5	173.8	-141.1	0.3	107.5	C32 C36	C32-R34 PolarHBondContact O-N 3.3Å; C32-R34 VanDerWaalsContact O-N 3.07Å; R34-C36 PolarHBondContact O-N 3.37Å
35	P	32.5	Very low	31.4	Very low	122 Å²	122	132 Å²	132	79%	0.792	74%	0.74	S	S	*	*			trans	-79.6	83.3	172.1	33.1	-28.8	0	0	0	107.3	F37	P35-F37 PolarHBondContact O-N 3.15Å; P35-F37 VanDerWaalsContact O-N 3.08Å
36	C	32	Very low	31.3	Very low	96 Å²	96	132.2 Å²	132.2	65%	0.649	74%	0.739	S	S	*	*			trans	-66.8	104.7	158.5	-67.3	0	0	0	0	106.3	R34 H38	R34-C36 PolarHBondContact O-N 3.37Å; C36-H38 PolarHBondContact O-N 3.01Å
37	F	32.3	Very low	31.7	Very low	171 Å²	171	132.1 Å²	132.1	75%	0.75	72%	0.723	S	S	*	*			trans	-66.3	95.5	-179.4	-173.4	-95.5	0	0	0	109.5	P35 P39	P35-F37 PolarHBondContact O-N 3.15Å; P35-F37 VanDerWaalsContact O-N 3.08Å; F37-P39 HydrophobicContact CD1-CG 4.4Å; F37-P39 HydrophobicContact CE1-CB 3.99Å; F37-P39 HydrophobicContact CE1-CG 4.09Å; F37-P39 HydrophobicContact CZ-CB 4.47Å
38	H	29.7	Very low	32.1	Very low	139 Å²	139	130.4 Å²	130.4	64%	0.644	71%	0.714	S	S	*	*			trans	-97.5	109.6	163.7	-73.8	-68.3	0	0	0	108.3	C36 G40 A41	C36-H38 PolarHBondContact O-N 3.01Å; H38-G40 PolarHBondContact O-N 2.81Å; H38-A41 PolarHBondContact O-N 2.73Å
39	P	40.4	Very low	32.6	Very low	87 Å²	87	134 Å²	134	57%	0.565	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	10.7	179.4	23	-23.7	0	0	0	114.3	F37 I458	F37-P39 HydrophobicContact CD1-CG 4.4Å; F37-P39 HydrophobicContact CE1-CB 3.99Å; F37-P39 HydrophobicContact CE1-CG 4.09Å; F37-P39 HydrophobicContact CZ-CB 4.47Å; P39-I458 HydrophobicContact CG-CG2 4.18Å
40	G	30.6	Very low	33.6	Very low	78 Å²	78	124 Å²	124	80%	0.804	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-9.5	170.1	0	0	0	0	0	115.1	H38	H38-G40 PolarHBondContact O-N 2.81Å
41	A	30.4	Very low	34.5	Very low	57 Å²	57	120.7 Å²	120.7	47%	0.471	68%	0.68	S	S	.	*			trans	-116.2	73.9	-175.4	0	0	0	0	0	111.1	H38 T43	H38-A41 PolarHBondContact O-N 2.73Å; A41-T43 PolarHBondContact O-N 3.09Å; A41-T43 PolarHBondContact O-OG1 2.86Å
42	S	34.2	Very low	35.6	Very low	101 Å²	101	120.9 Å²	120.9	71%	0.706	68%	0.681	S	S	*	*			trans	-68.4	72.7	159.6	-63.5	0	0	0	0	109.5
43	T	34.5	Very low	36.9	Very low	111 Å²	111	119.3 Å²	119.3	68%	0.681	66%	0.662	S	S	*	*			trans	-101.9	0.5	177.2	41.6	0	0	0	0	113.8	A41	A41-T43 PolarHBondContact O-N 3.09Å; A41-T43 PolarHBondContact O-OG1 2.86Å
44	A	33.4	Very low	38.5	Very low	96 Å²	96	113.5 Å²	113.5	79%	0.793	65%	0.647	S	S	*	*	S	Bend	trans	-99.8	-5.3	-169.8	0	0	0	0	0	116.7
45	A	34.1	Very low	40.7	Very low	80 Å²	80	104.2 Å²	104.2	66%	0.661	61%	0.613	S	S	*	*	S	Bend	trans	-105.2	109.3	170	0	0	0	0	0	108.5	L47	A45-L47 PolarHBondContact O-N 3.4Å
46	P	31.4	Very low	43.2	Very low	115 Å²	115	102.2 Å²	102.2	75%	0.747	60%	0.602	S	S	*	*			trans	-51.1	131.8	160.9	-15.8	27.9	0	0	0	106.5	P48	P46-P48 VanDerWaalsContact O-CD 3.27Å; P46-P48 WeakPolarHBondContact O-CD 3.42Å
47	L	38.7	Very low	45.8	Very low	101 Å²	101	102 Å²	102	53%	0.529	59%	0.594	S	S	.	*			trans	-45.3	119.5	164.3	-71.7	161.5	0	0	0	105.4	A45 K49	A45-L47 PolarHBondContact O-N 3.4Å; L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 2.58Å
48	P	38.5	Very low	48.4	Very low	85 Å²	85	102.7 Å²	102.7	55%	0.552	59%	0.592	S	S	*	*			trans	-52.7	116.7	162.5	21	-28.7	0	0	0	103.4	P46 L50	P46-P48 VanDerWaalsContact O-CD 3.27Å; P46-P48 WeakPolarHBondContact O-CD 3.42Å; P48-L50 PolarHBondContact O-N 2.61Å
49	K	40.9	Very low	51.2	Low	185 Å²	185	98.2 Å²	98.2	80%	0.804	58%	0.579	S	S	*	*			trans	-41.6	117.1	175.8	-75.7	178.2	177.1	178.7	0	103.5	L47 E51	L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 2.58Å; K49-E51 PolarHBondContact O-N 3.1Å
50	L	47.5	Very low	53.5	Low	49 Å²	49	94.1 Å²	94.1	26%	0.257	55%	0.552	S	S	.	*			trans	-40.3	111.1	174.7	-155.8	90	0	0	0	104.6	P48 E52 T383 T386	P48-L50 PolarHBondContact O-N 2.61Å; L50-E52 WeakPolarHBondContact O-CA 3.5Å; L50-E52 PolarHBondContact O-N 3.13Å; L50-T383 HydrophobicContact CD2-CG2 4.3Å; L50-T386 HydrophobicContact CD2-CG2 3.62Å; L50-T386 HydrophobicContact CG-CG2 4.01Å
51	E	45.7	Very low	56.3	Low	148 Å²	148	93.4 Å²	93.4	69%	0.692	53%	0.529	S	S	*	.			trans	-45	119.7	-172.4	-75.9	177	158.8	0	0	106.6	K49 H53 L54	K49-E51 PolarHBondContact O-N 3.1Å; E51-H53 PolarHBondContact O-N 3.35Å; E51-L54 HydrophobicContact CB-CD2 4.34Å
52	E	51.1	Low	59.2	Low	175 Å²	175	95.2 Å²	95.2	82%	0.818	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.7	103.9	-157.3	-75.3	179	155.2	0	0	110.8	L50 L54	L50-E52 WeakPolarHBondContact O-CA 3.5Å; L50-E52 PolarHBondContact O-N 3.13Å; E52-L54 PolarHBondContact O-N 2.91Å
53	H	57.8	Low	61.9	Low	81 Å²	81	92.7 Å²	92.7	38%	0.375	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	27	79.3	175.4	-60.4	-67.4	0	0	0	115.6	E51 I55 Q382	E51-H53 PolarHBondContact O-N 3.35Å; H53-I55 PolarHBondContact O-N 3.11Å; H53-Q382 VanDerWaalsContact CB-CD 3.41Å; H53-Q382 HydrophobicContact CB-CG 3.82Å; H53-Q382 VanDerWaalsContact ND1-CD 3.32Å; H53-Q382 WeakPolarHBondContact ND1-CG 3.17Å; H53-Q382 PolarHBondContact ND1-OE1 3.4Å
54	L	63.3	Low	64.6	Low	99 Å²	99	87.5 Å²	87.5	52%	0.518	47%	0.474	S	S	.	.	S	Bend	trans	-50.3	-19.1	177.2	-64	172.8	0	0	0	114.4	E51 E52 T386	E51-L54 HydrophobicContact CB-CD2 4.34Å; E52-L54 PolarHBondContact O-N 2.91Å; L54-T386 HydrophobicContact CB-CG2 4.34Å; L54-T386 HydrophobicContact CD1-CG2 4.1Å; L54-T386 HydrophobicContact CG-CG2 4.3Å
55	I	75.4	Confident	67.4	Low	13 Å²	13	86.4 Å²	86.4	7%	0.067	46%	0.455	C	S	.	.	S	Bend	trans	-109.2	124.6	-174.9	-52	179	0	0	0	110.7	H53 A59 V60 Q382 F385 T389	H53-I55 PolarHBondContact O-N 3.11Å; I55-A59 HydrophobicContact CG2-CB 3.49Å; I55-A59 VanDerWaalsContact CG2-CB 3.49Å; I55-V60 HydrophobicContact CB-CG2 4.34Å; I55-V60 HydrophobicContact CG2-CG2 3.73Å; I55-Q382 PolarHBondContact O-NE2 3.49Å; I55-F385 HydrophobicContact CD1-CB 3.54Å; I55-F385 VanDerWaalsContact CD1-O 3.27Å; I55-F385 WeakPolarHBondContact CD1-O 3.22Å; I55-T389 HydrophobicContact CD1-CG2 3.6Å; I55-T389 HydrophobicContact CG1-CG2 3.92Å
56	S	85.1	Confident	70.1	Confident	79 Å²	79	87.4 Å²	87.4	55%	0.552	45%	0.449	S	S	*	.			trans	-63	148	170.6	177.3	0	0	0	0	112.3	R58 A59 V60	S56-R58 PolarHBondContact O-N 3.11Å; S56-R58 VanDerWaalsContact O-N 3.08Å; S56-A59 WeakPolarHBondContact O-CA 3.34Å; S56-A59 WeakPolarHBondContact O-CB 3.47Å; S56-A59 PolarHBondContact O-N 3.36Å; S56-V60 PolarHBondContact O-N 3.09Å
57	N	86	Confident	73	Confident	91 Å²	91	84 Å²	84	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-50.7	-35.9	174.1	-70.3	-19.5	0	0	0	113.1	V60 L61 M378	N57-V60 PolarHBondContact O-N 3.07Å; N57-L61 PolarHBondContact O-N 3.28Å; N57-M378 HydrophobicContact CB-CE 3.9Å; N57-M378 WeakPolarHBondContact O-CE 3.32Å
58	R	88.5	Confident	75.5	Confident	187 Å²	187	79.8 Å²	79.8	71%	0.706	40%	0.4	S	S	*	.	H	α-helix	trans	-66.1	-40	176.6	-175.7	-179.8	177.5	-175.3	-0.1	111.7	S56 L61 M62	S56-R58 PolarHBondContact O-N 3.11Å; S56-R58 VanDerWaalsContact O-N 3.08Å; R58-L61 PolarHBondContact O-N 3.23Å; R58-M62 WeakPolarHBondContact O-CB 3.23Å; R58-M62 WeakPolarHBondContact O-CG 3.41Å; R58-M62 PolarHBondContact O-N 3.08Å
59	A	87.9	Confident	78.2	Confident	45 Å²	45	81.2 Å²	81.2	37%	0.372	40%	0.395	S	S	.	.	H	α-helix	trans	-68.9	-40.1	178.4	0	0	0	0	0	111.2	I55 S56 L61 M62 Q63	I55-A59 HydrophobicContact CG2-CB 3.49Å; I55-A59 VanDerWaalsContact CG2-CB 3.49Å; S56-A59 WeakPolarHBondContact O-CA 3.34Å; S56-A59 WeakPolarHBondContact O-CB 3.47Å; S56-A59 PolarHBondContact O-N 3.36Å; A59-L61 VanDerWaalsContact C-N 3.34Å; A59-L61 PolarHBondContact O-N 3.07Å; A59-M62 PolarHBondContact O-N 3.21Å; A59-Q63 WeakPolarHBondContact O-CB 3.27Å; A59-Q63 PolarHBondContact O-N 3.42Å
60	V	89.3	Confident	80.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-56	-48.1	171	170.3	0	0	0	0	111.1	I55 S56 N57 Q63 M64 M378 M381 Q382 F385	I55-V60 HydrophobicContact CB-CG2 4.34Å; I55-V60 HydrophobicContact CG2-CG2 3.73Å; S56-V60 PolarHBondContact O-N 3.09Å; N57-V60 PolarHBondContact O-N 3.07Å; V60-Q63 PolarHBondContact O-N 3.26Å; V60-M64 WeakPolarHBondContact O-CB 2.81Å; V60-M64 PolarHBondContact O-N 3.43Å; V60-M378 HydrophobicContact CB-CE 4.05Å; V60-M378 HydrophobicContact CG1-CE 3.86Å; V60-M378 HydrophobicContact CG1-SD 4.16Å; V60-M381 HydrophobicContact CG1-CB 3.78Å; V60-M381 HydrophobicContact CG1-CE 4Å; V60-M381 HydrophobicContact CG1-SD 4.33Å; V60-Q382 HydrophobicContact CG2-CB 4.05Å; V60-Q382 HydrophobicContact CG2-CG 4.09Å; V60-F385 HydrophobicContact CB-CD2 4.32Å; V60-F385 HydrophobicContact CG1-CD2 3.83Å; V60-F385 HydrophobicContact CG1-CE2 3.97Å; V60-F385 HydrophobicContact CG2-CD2 4.24Å
61	L	89.8	Confident	82.4	Confident	63 Å²	63	79.4 Å²	79.4	33%	0.33	39%	0.387	S	S	.	.	H	α-helix	trans	-63.2	-44.8	179.3	-166.4	82.5	0	0	0	111.7	N57 R58 A59 Q63 M64 L65 L207	N57-L61 PolarHBondContact O-N 3.28Å; R58-L61 PolarHBondContact O-N 3.23Å; A59-L61 VanDerWaalsContact C-N 3.34Å; A59-L61 PolarHBondContact O-N 3.07Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 2.88Å; L61-M64 HydrophobicContact CD1-CE 3.67Å; L61-M64 HydrophobicContact CG-CE 4.35Å; L61-M64 PolarHBondContact O-N 3.46Å; L61-L65 HydrophobicContact CG-CD1 4.38Å; L61-L65 WeakPolarHBondContact O-CB 3.43Å; L61-L65 VanDerWaalsContact O-CG 3.28Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.42Å; L61-L207 HydrophobicContact CD1-CD1 4.45Å
62	M	90.8	Very high	84.5	Confident	95 Å²	95	80.1 Å²	80.1	47%	0.468	40%	0.396	S	S	.	.	H	α-helix	trans	-63.5	-39.8	177.4	-75.7	-63.7	-177.4	0	0	112	R58 A59 L65 N66	R58-M62 WeakPolarHBondContact O-CB 3.23Å; R58-M62 WeakPolarHBondContact O-CG 3.41Å; R58-M62 PolarHBondContact O-N 3.08Å; A59-M62 PolarHBondContact O-N 3.21Å; M62-L65 PolarHBondContact O-N 2.96Å; M62-L65 HydrophobicContact SD-CD1 4.36Å; M62-N66 VanDerWaalsContact O-CG 3.27Å; M62-N66 PolarHBondContact O-N 2.58Å; M62-N66 PolarHBondContact O-ND2 2.92Å
63	Q	89.7	Confident	86.4	Confident	49 Å²	49	75.1 Å²	75.1	23%	0.229	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-45.7	177.4	-166	169	13.2	0	0	110.9	A59 V60 L61 L65 N66 Y67 F385	A59-Q63 WeakPolarHBondContact O-CB 3.27Å; A59-Q63 PolarHBondContact O-N 3.42Å; V60-Q63 PolarHBondContact O-N 3.26Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 2.88Å; Q63-L65 VanDerWaalsContact C-N 3.34Å; Q63-L65 PolarHBondContact O-N 3.37Å; Q63-N66 WeakPolarHBondContact O-CB 3.25Å; Q63-N66 PolarHBondContact O-N 3.07Å; Q63-Y67 HydrophobicContact CG-CE2 4.02Å; Q63-Y67 WeakPolarHBondContact O-CD2 3.46Å; Q63-Y67 PolarHBondContact O-N 3.22Å; Q63-F385 HydrophobicContact CB-CE1 4.23Å; Q63-F385 HydrophobicContact CB-CE2 4.45Å; Q63-F385 HydrophobicContact CB-CZ 4.16Å; Q63-F385 HydrophobicContact CG-CD1 3.88Å; Q63-F385 HydrophobicContact CG-CE1 3.54Å; Q63-F385 HydrophobicContact CG-CZ 3.93Å; Q63-F385 VanDerWaalsContact OE1-CG 3.24Å
64	M	92.4	Very high	88.1	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-54.4	-48.8	170.8	169.6	-172.2	89.4	0	0	111.7	V60 L61 N66 Y67 V68 L200 V203 L204 L207 M381	V60-M64 WeakPolarHBondContact O-CB 2.81Å; V60-M64 PolarHBondContact O-N 3.43Å; L61-M64 HydrophobicContact CD1-CE 3.67Å; L61-M64 HydrophobicContact CG-CE 4.35Å; L61-M64 PolarHBondContact O-N 3.46Å; M64-N66 VanDerWaalsContact C-N 3.25Å; M64-N66 PolarHBondContact O-N 2.83Å; M64-Y67 PolarHBondContact O-N 3.42Å; M64-V68 PolarHBondContact O-N 2.68Å; M64-V68 VanDerWaalsContact O-N 3.11Å; M64-L200 HydrophobicContact CB-CD1 3.84Å; M64-L200 HydrophobicContact CG-CD1 3.48Å; M64-L200 VanDerWaalsContact CG-CD1 3.48Å; M64-L200 HydrophobicContact SD-CD1 4.23Å; M64-V203 HydrophobicContact CE-CG1 4.19Å; M64-V203 HydrophobicContact SD-CB 4.28Å; M64-V203 HydrophobicContact SD-CG1 3.77Å; M64-L204 HydrophobicContact CE-CD2 3.72Å; M64-L204 HydrophobicContact CG-CD2 3.7Å; M64-L204 HydrophobicContact CG-CG 4.16Å; M64-L204 HydrophobicContact SD-CD2 3.48Å; M64-L204 WeakPolarHBondContact SD-CD2 3.44Å; M64-L204 HydrophobicContact SD-CG 3.85Å; M64-L207 HydrophobicContact CE-CD1 3.7Å; M64-M381 HydrophobicContact SD-CE 4.36Å; M64-M381 HydrophobicContact SD-SD 4.33Å
65	L	91.2	Very high	89.5	Confident	73 Å²	73	81.8 Å²	81.8	38%	0.382	39%	0.392	S	S	.	.	H	α-helix	trans	-60.7	-34.1	-179.8	-74	171.4	0	0	0	112.3	L61 M62 Q63 Y67 V68 W69	L61-L65 HydrophobicContact CG-CD1 4.38Å; L61-L65 WeakPolarHBondContact O-CB 3.43Å; L61-L65 VanDerWaalsContact O-CG 3.28Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.42Å; M62-L65 PolarHBondContact O-N 2.96Å; M62-L65 HydrophobicContact SD-CD1 4.36Å; Q63-L65 VanDerWaalsContact C-N 3.34Å; Q63-L65 PolarHBondContact O-N 3.37Å; L65-Y67 VanDerWaalsContact C-N 3.26Å; L65-Y67 PolarHBondContact O-N 3.22Å; L65-V68 PolarHBondContact O-N 3.19Å; L65-W69 WeakPolarHBondContact O-CB 3.47Å; L65-W69 PolarHBondContact O-N 3.29Å
66	N	91.7	Very high	90.3	Very high	102 Å²	102	81.8 Å²	81.8	55%	0.545	39%	0.392	S	S	.	.	H	α-helix	trans	-63.5	-30.4	174.4	-70.6	-29.7	0	0	0	113	M62 Q63 M64 W69 P70	M62-N66 VanDerWaalsContact O-CG 3.27Å; M62-N66 PolarHBondContact O-N 2.58Å; M62-N66 PolarHBondContact O-ND2 2.92Å; Q63-N66 WeakPolarHBondContact O-CB 3.25Å; Q63-N66 PolarHBondContact O-N 3.07Å; M64-N66 VanDerWaalsContact C-N 3.25Å; M64-N66 PolarHBondContact O-N 2.83Å; N66-W69 CarbonylContact O-C 3.54Å; N66-W69 VanDerWaalsContact O-C 3.3Å; N66-P70 WeakPolarHBondContact O-CA 3.19Å
67	Y	91.7	Very high	90.7	Very high	43 Å²	43	81.9 Å²	81.9	17%	0.169	38%	0.38	C	S	.	.	H	α-helix	trans	-81.1	-31.2	175.5	-71.6	-79	0	0	0	113	Q63 M64 L65 S161 E164 I165 F385	Q63-Y67 HydrophobicContact CG-CE2 4.02Å; Q63-Y67 WeakPolarHBondContact O-CD2 3.46Å; Q63-Y67 PolarHBondContact O-N 3.22Å; M64-Y67 PolarHBondContact O-N 3.42Å; L65-Y67 VanDerWaalsContact C-N 3.26Å; L65-Y67 PolarHBondContact O-N 3.22Å; Y67-S161 PolarHBondContact O-OG 3.49Å; Y67-E164 HydrophobicContact CD1-CB 4.33Å; Y67-E164 HydrophobicContact CD1-CG 4.27Å; Y67-E164 HydrophobicContact CE1-CG 4.32Å; Y67-I165 HydrophobicContact CD1-CD1 4.12Å; Y67-I165 HydrophobicContact CD1-CG1 3.37Å; Y67-I165 HydrophobicContact CD2-CD1 3.25Å; Y67-I165 HydrophobicContact CD2-CG1 3.36Å; Y67-I165 HydrophobicContact CE1-CG1 3.56Å; Y67-I165 HydrophobicContact CE2-CD1 3.78Å; Y67-I165 HydrophobicContact CE2-CG1 3.57Å; Y67-I165 HydrophobicContact CG-CD1 3.45Å; Y67-I165 VanDerWaalsContact CG-CD1 3.45Å; Y67-I165 HydrophobicContact CG-CG1 3.26Å; Y67-F385 HydrophobicContact CE2-CE1 4.11Å
68	V	92.4	Very high	91.2	Very high	13 Å²	13	81.7 Å²	81.7	8%	0.079	38%	0.378	C	S	.	.	H	α-helix	trans	-70.9	-37.2	171.8	179.9	0	0	0	0	111.2	M64 L65 P70 V80 V157 L204	M64-V68 PolarHBondContact O-N 2.68Å; M64-V68 VanDerWaalsContact O-N 3.11Å; L65-V68 PolarHBondContact O-N 3.19Å; V68-P70 WeakPolarHBondContact O-CD 3.29Å; V68-V80 HydrophobicContact CG1-CG2 3.96Å; V68-V157 HydrophobicContact CG1-CG1 4.08Å; V68-L204 HydrophobicContact CG2-CD1 3.84Å; V68-L204 HydrophobicContact CG2-CD2 3.29Å; V68-L204 HydrophobicContact CG2-CG 4.22Å
69	W	94.2	Very high	91.6	Very high	114 Å²	114	75.7 Å²	75.7	43%	0.432	36%	0.355	S	S	.	.	S	Bend	trans	-115.4	67.6	179.6	-165.7	-90	0	0	0	111.8	L65 N66 K71 R77 V80 V81	L65-W69 WeakPolarHBondContact O-CB 3.47Å; L65-W69 PolarHBondContact O-N 3.29Å; N66-W69 CarbonylContact O-C 3.54Å; N66-W69 VanDerWaalsContact O-C 3.3Å; W69-K71 PolarHBondContact O-N 3.49Å; W69-R77 HydrophobicContact CD2-CB 4.22Å; W69-R77 HydrophobicContact CD2-CG 3.7Å; W69-R77 HydrophobicContact CE3-CB 4.21Å; W69-R77 HydrophobicContact CE3-CG 4.12Å; W69-R77 HydrophobicContact CG-CG 4.07Å; W69-R77 HydrophobicContact CH2-CB 3.99Å; W69-R77 HydrophobicContact CH2-CG 4.46Å; W69-R77 HydrophobicContact CZ2-CB 3.98Å; W69-R77 HydrophobicContact CZ2-CG 4.07Å; W69-R77 HydrophobicContact CZ3-CB 4.1Å; W69-R77 HydrophobicContact CZ3-CG 4.48Å; W69-R77 VanDerWaalsContact NE1-CD 3.29Å; W69-V80 HydrophobicContact CE3-CB 4.08Å; W69-V80 HydrophobicContact CE3-CG1 3.98Å; W69-V80 HydrophobicContact CE3-CG2 4.5Å; W69-V80 HydrophobicContact CZ3-CB 4Å; W69-V80 HydrophobicContact CZ3-CG1 3.94Å; W69-V81 HydrophobicContact CH2-CG2 3.67Å; W69-V81 HydrophobicContact CZ3-CG2 3.85Å
70	P	90	Very high	91.9	Very high	23 Å²	23	74.3 Å²	74.3	15%	0.149	34%	0.342	C	S	.	.			trans	-69.8	131.6	-178.3	28.6	-35.1	0	0	0	111.4	N66 V68 N72 K73 L76 R77	N66-P70 WeakPolarHBondContact O-CA 3.19Å; V68-P70 WeakPolarHBondContact O-CD 3.29Å; P70-N72 VanDerWaalsContact C-N 3.3Å; P70-N72 PolarHBondContact O-N 3.11Å; P70-K73 HydrophobicContact CB-CB 4.4Å; P70-K73 HydrophobicContact CG-CB 3.89Å; P70-K73 HydrophobicContact CG-CD 4.43Å; P70-K73 PolarHBondContact O-N 2.92Å; P70-L76 HydrophobicContact CG-CB 3.98Å; P70-L76 HydrophobicContact CG-CD1 3.78Å; P70-R77 PolarHBondContact O-NE 3.47Å
71	K	86.3	Confident	92.2	Very high	174 Å²	174	78.2 Å²	78.2	76%	0.757	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-40.2	178.4	-65.1	-176.1	-179.9	-179.7	0	112.2	W69 R77	W69-K71 PolarHBondContact O-N 3.49Å; K71-R77 PolarHBondContact O-NH2 3.47Å
72	N	89.5	Confident	92.6	Very high	163 Å²	163	78 Å²	78	87%	0.872	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-19.3	-172.5	-64.1	-3.7	0	0	0	114.5	P70	P70-N72 VanDerWaalsContact C-N 3.3Å; P70-N72 PolarHBondContact O-N 3.11Å
73	K	91	Very high	92.8	Very high	69 Å²	69	73.7 Å²	73.7	30%	0.3	35%	0.347	S	S	.	.			trans	-112.3	88.2	-173.4	-62.7	176.6	-176.1	164.7	0	111.2	P70 Q75 L76 R77 N160 E164	P70-K73 HydrophobicContact CB-CB 4.4Å; P70-K73 HydrophobicContact CG-CB 3.89Å; P70-K73 HydrophobicContact CG-CD 4.43Å; P70-K73 PolarHBondContact O-N 2.92Å; K73-Q75 VanDerWaalsContact C-N 3.29Å; K73-Q75 PolarHBondContact O-N 3.36Å; K73-L76 HydrophobicContact CB-CB 4.37Å; K73-L76 HydrophobicContact CB-CD1 3.75Å; K73-L76 HydrophobicContact CB-CG 4.39Å; K73-L76 HydrophobicContact CD-CD1 3.38Å; K73-L76 HydrophobicContact CG-CD1 4.21Å; K73-L76 PolarHBondContact O-N 3.39Å; K73-R77 PolarHBondContact O-N 3.23Å; K73-N160 PolarHBondContact NZ-OD1 3.27Å; K73-E164 IonicContact NZ-OE2 3.91Å; K73-E164 PolarHBondContact NZ-OE2 3.44Å
74	R	93.3	Very high	93.1	Very high	189 Å²	189	75 Å²	75	71%	0.713	36%	0.355	S	S	*	.	H	α-helix	trans	-56.2	-39.6	-179.8	-174.1	179.4	177.8	-180	-0.4	113	L76 R77 I78	R74-L76 VanDerWaalsContact C-N 3.29Å; R74-L76 PolarHBondContact O-N 2.96Å; R74-R77 PolarHBondContact O-N 3.06Å; R74-I78 HydrophobicContact CG-CD1 3.97Å; R74-I78 HydrophobicContact CG-CG1 4.41Å; R74-I78 WeakPolarHBondContact O-CG1 3.18Å; R74-I78 PolarHBondContact O-N 3.28Å
75	Q	93.5	Very high	93.3	Very high	131 Å²	131	76.8 Å²	76.8	61%	0.612	37%	0.374	S	S	*	.	H	α-helix	trans	-60.4	-36.4	-179.3	-165.5	-173.1	18.3	0	0	112.8	K73 R79	K73-Q75 VanDerWaalsContact C-N 3.29Å; K73-Q75 PolarHBondContact O-N 3.36Å; Q75-R79 VanDerWaalsContact NE2-NH2 3.16Å; Q75-R79 VanDerWaalsContact O-CG 3.28Å; Q75-R79 WeakPolarHBondContact O-CG 3.47Å; Q75-R79 PolarHBondContact O-N 3.12Å
76	L	92.8	Very high	93.6	Very high	13 Å²	13	75.7 Å²	75.7	7%	0.068	37%	0.366	C	S	.	.	H	α-helix	trans	-69.7	-42.1	177.5	-77.9	160.6	0	0	0	111.5	P70 K73 R74 I78 R79 V80 V157 N160	P70-L76 HydrophobicContact CG-CB 3.98Å; P70-L76 HydrophobicContact CG-CD1 3.78Å; K73-L76 HydrophobicContact CB-CB 4.37Å; K73-L76 HydrophobicContact CB-CD1 3.75Å; K73-L76 HydrophobicContact CB-CG 4.39Å; K73-L76 HydrophobicContact CD-CD1 3.38Å; K73-L76 HydrophobicContact CG-CD1 4.21Å; K73-L76 PolarHBondContact O-N 3.39Å; R74-L76 VanDerWaalsContact C-N 3.29Å; R74-L76 PolarHBondContact O-N 2.96Å; L76-I78 VanDerWaalsContact C-N 3.33Å; L76-I78 PolarHBondContact O-N 3.16Å; L76-R79 WeakPolarHBondContact O-CB 3.5Å; L76-R79 PolarHBondContact O-N 2.87Å; L76-R79 VanDerWaalsContact O-N 3.14Å; L76-V80 WeakPolarHBondContact O-CG2 3.12Å; L76-V80 PolarHBondContact O-N 2.93Å; L76-V157 HydrophobicContact CD2-CB 4.29Å; L76-V157 HydrophobicContact CD2-CG1 4.3Å; L76-V157 HydrophobicContact CD2-CG2 4.1Å; L76-N160 HydrophobicContact CD1-CB 4.23Å; L76-N160 WeakPolarHBondContact CD1-OD1 3.22Å; L76-N160 HydrophobicContact CD2-CB 3.86Å
77	R	94	Very high	93.8	Very high	81 Å²	81	71 Å²	71	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-44.1	175.3	-65.1	-171.1	-84.5	155.7	-7.9	111.6	W69 P70 K71 K73 R74 R79 V80 V81	W69-R77 HydrophobicContact CD2-CB 4.22Å; W69-R77 HydrophobicContact CD2-CG 3.7Å; W69-R77 HydrophobicContact CE3-CB 4.21Å; W69-R77 HydrophobicContact CE3-CG 4.12Å; W69-R77 HydrophobicContact CG-CG 4.07Å; W69-R77 HydrophobicContact CH2-CB 3.99Å; W69-R77 HydrophobicContact CH2-CG 4.46Å; W69-R77 HydrophobicContact CZ2-CB 3.98Å; W69-R77 HydrophobicContact CZ2-CG 4.07Å; W69-R77 HydrophobicContact CZ3-CB 4.1Å; W69-R77 HydrophobicContact CZ3-CG 4.48Å; W69-R77 VanDerWaalsContact NE1-CD 3.29Å; P70-R77 PolarHBondContact O-NE 3.47Å; K71-R77 PolarHBondContact O-NH2 3.47Å; K73-R77 PolarHBondContact O-N 3.23Å; R74-R77 PolarHBondContact O-N 3.06Å; R77-R79 VanDerWaalsContact C-N 3.35Å; R77-R79 PolarHBondContact O-N 2.88Å; R77-V80 PolarHBondContact O-N 3.49Å; R77-V81 WeakPolarHBondContact O-CG2 3.47Å; R77-V81 PolarHBondContact O-N 3.41Å
78	I	95.8	Very high	94.1	Very high	87 Å²	87	72.3 Å²	72.3	45%	0.446	35%	0.353	S	S	.	.	H	α-helix	trans	-59.5	-45.7	174.5	-66.4	169.1	0	0	0	110.6	R74 L76 V80 V81 V82	R74-I78 HydrophobicContact CG-CD1 3.97Å; R74-I78 HydrophobicContact CG-CG1 4.41Å; R74-I78 WeakPolarHBondContact O-CG1 3.18Å; R74-I78 PolarHBondContact O-N 3.28Å; L76-I78 VanDerWaalsContact C-N 3.33Å; L76-I78 PolarHBondContact O-N 3.16Å; I78-V80 VanDerWaalsContact C-N 3.31Å; I78-V80 PolarHBondContact O-N 3.19Å; I78-V81 PolarHBondContact O-N 3.36Å; I78-V82 HydrophobicContact CG2-CG2 4.11Å; I78-V82 WeakPolarHBondContact O-CB 3.42Å; I78-V82 VanDerWaalsContact O-CG2 3.28Å; I78-V82 WeakPolarHBondContact O-CG2 3.44Å; I78-V82 PolarHBondContact O-N 3.4Å
79	R	95.7	Very high	94.3	Very high	61 Å²	61	73 Å²	73	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-39.6	177.6	-71.8	169.1	-174.1	-84.1	-2	112.5	Q75 L76 R77 V82 A83 V153 V157	Q75-R79 VanDerWaalsContact NE2-NH2 3.16Å; Q75-R79 VanDerWaalsContact O-CG 3.28Å; Q75-R79 WeakPolarHBondContact O-CG 3.47Å; Q75-R79 PolarHBondContact O-N 3.12Å; L76-R79 WeakPolarHBondContact O-CB 3.5Å; L76-R79 PolarHBondContact O-N 2.87Å; L76-R79 VanDerWaalsContact O-N 3.14Å; R77-R79 VanDerWaalsContact C-N 3.35Å; R77-R79 PolarHBondContact O-N 2.88Å; R79-V82 PolarHBondContact O-N 3.46Å; R79-A83 WeakPolarHBondContact O-CB 3.47Å; R79-A83 PolarHBondContact O-N 2.93Å; R79-V153 HydrophobicContact CB-CG1 3.88Å; R79-V153 HydrophobicContact CG-CG1 4.23Å; R79-V153 VanDerWaalsContact O-CG1 3.29Å; R79-V153 WeakPolarHBondContact O-CG1 3.27Å; R79-V157 HydrophobicContact CB-CG2 3.52Å
80	V	95	Very high	94.5	Very high	16 Å²	16	67.8 Å²	67.8	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-48.2	175.6	174.2	0	0	0	0	110.7	V68 W69 L76 R77 I78 V82 A83 L84 V157	V68-V80 HydrophobicContact CG1-CG2 3.96Å; W69-V80 HydrophobicContact CE3-CB 4.08Å; W69-V80 HydrophobicContact CE3-CG1 3.98Å; W69-V80 HydrophobicContact CE3-CG2 4.5Å; W69-V80 HydrophobicContact CZ3-CB 4Å; W69-V80 HydrophobicContact CZ3-CG1 3.94Å; L76-V80 WeakPolarHBondContact O-CG2 3.12Å; L76-V80 PolarHBondContact O-N 2.93Å; R77-V80 PolarHBondContact O-N 3.49Å; I78-V80 VanDerWaalsContact C-N 3.31Å; I78-V80 PolarHBondContact O-N 3.19Å; V80-V82 PolarHBondContact O-N 3.42Å; V80-A83 PolarHBondContact O-N 3.24Å; V80-L84 HydrophobicContact CG1-CD1 4.13Å; V80-L84 WeakPolarHBondContact O-CG 3.49Å; V80-L84 PolarHBondContact O-N 3.33Å; V80-V157 HydrophobicContact CG2-CB 4.45Å; V80-V157 HydrophobicContact CG2-CG1 3.66Å; V80-V157 HydrophobicContact CG2-CG2 4.1Å
81	V	96	Very high	94.7	Very high	82 Å²	82	68.3 Å²	68.3	50%	0.497	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-44.2	177.9	175.8	0	0	0	0	111.2	W69 R77 I78 A83 L84 G85	W69-V81 HydrophobicContact CH2-CG2 3.67Å; W69-V81 HydrophobicContact CZ3-CG2 3.85Å; R77-V81 WeakPolarHBondContact O-CG2 3.47Å; R77-V81 PolarHBondContact O-N 3.41Å; I78-V81 PolarHBondContact O-N 3.36Å; V81-A83 PolarHBondContact O-N 3.29Å; V81-L84 PolarHBondContact O-N 3.38Å; V81-G85 PolarHBondContact O-N 2.91Å
82	V	97.3	Very high	95.1	Very high	59 Å²	59	64.7 Å²	64.7	36%	0.358	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-42.8	176.8	170.3	0	0	0	0	111.3	I78 R79 V80 G85 F86 V153	I78-V82 HydrophobicContact CG2-CG2 4.11Å; I78-V82 WeakPolarHBondContact O-CB 3.42Å; I78-V82 VanDerWaalsContact O-CG2 3.28Å; I78-V82 WeakPolarHBondContact O-CG2 3.44Å; I78-V82 PolarHBondContact O-N 3.4Å; R79-V82 PolarHBondContact O-N 3.46Å; V80-V82 PolarHBondContact O-N 3.42Å; V82-G85 PolarHBondContact O-N 3.33Å; V82-F86 HydrophobicContact CG1-CD2 3.9Å; V82-F86 HydrophobicContact CG1-CE2 3.51Å; V82-F86 HydrophobicContact CG1-CZ 3.99Å; V82-F86 WeakPolarHBondContact O-CG 3.38Å; V82-F86 PolarHBondContact O-N 2.68Å; V82-V153 HydrophobicContact CB-CG1 4.48Å; V82-V153 HydrophobicContact CG1-CG1 4.29Å; V82-V153 HydrophobicContact CG1-CG2 4.44Å
83	A	96.3	Very high	95.4	Very high	4 Å²	4	59.1 Å²	59.1	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-41.3	176.8	0	0	0	0	0	112.2	R79 V80 V81 G85 F86 L87 R150 V153 F154	R79-A83 WeakPolarHBondContact O-CB 3.47Å; R79-A83 PolarHBondContact O-N 2.93Å; V80-A83 PolarHBondContact O-N 3.24Å; V81-A83 PolarHBondContact O-N 3.29Å; A83-G85 VanDerWaalsContact C-N 3.34Å; A83-F86 PolarHBondContact O-N 3.02Å; A83-L87 PolarHBondContact O-N 3.42Å; A83-R150 HydrophobicContact CB-CG 4.45Å; A83-R150 WeakPolarHBondContact O-CG 3.46Å; A83-V153 HydrophobicContact CB-CB 4.5Å; A83-V153 HydrophobicContact CB-CG1 4.19Å; A83-F154 HydrophobicContact CB-CB 4.16Å
84	L	95.2	Very high	95.6	Very high	77 Å²	77	56.1 Å²	56.1	40%	0.403	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-38.1	173.5	-69.9	173.5	0	0	0	111.7	V80 V81 L87 V88	V80-L84 HydrophobicContact CG1-CD1 4.13Å; V80-L84 WeakPolarHBondContact O-CG 3.49Å; V80-L84 PolarHBondContact O-N 3.33Å; V81-L84 PolarHBondContact O-N 3.38Å; L84-L87 WeakPolarHBondContact O-CB 3.42Å; L84-L87 PolarHBondContact O-N 3.4Å; L84-V88 WeakPolarHBondContact O-CG2 3.32Å; L84-V88 PolarHBondContact O-N 3.14Å
85	G	96.7	Very high	95.5	Very high	39 Å²	39	47.6 Å²	47.6	40%	0.402	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-46.9	173	0	0	0	0	0	112.1	V81 V82 A83 L87 V88 A89	V81-G85 PolarHBondContact O-N 2.91Å; V82-G85 PolarHBondContact O-N 3.33Å; A83-G85 VanDerWaalsContact C-N 3.34Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 2.91Å; G85-V88 PolarHBondContact O-N 3.31Å; G85-A89 WeakPolarHBondContact O-CB 3.49Å; G85-A89 PolarHBondContact O-N 3.2Å
86	F	97.8	Very high	95.5	Very high	49 Å²	49	43.4 Å²	43.4	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-33.3	174.6	-70.3	-31.6	0	0	0	113.3	V82 A83 S90 F146 L149 R150 V153	V82-F86 HydrophobicContact CG1-CD2 3.9Å; V82-F86 HydrophobicContact CG1-CE2 3.51Å; V82-F86 HydrophobicContact CG1-CZ 3.99Å; V82-F86 WeakPolarHBondContact O-CG 3.38Å; V82-F86 PolarHBondContact O-N 2.68Å; A83-F86 PolarHBondContact O-N 3.02Å; F86-S90 WeakPolarHBondContact O-CB 3.41Å; F86-S90 PolarHBondContact O-N 3.01Å; F86-F146 AromaticContact CD1-CD1 3.4Å; F86-F146 HydrophobicContact CD1-CD1 3.4Å; F86-F146 AromaticContact CD1-CE1 3.77Å; F86-F146 HydrophobicContact CD1-CE1 3.77Å; F86-F146 AromaticContact CE1-CD1 3.82Å; F86-F146 HydrophobicContact CE1-CD1 3.82Å; F86-F146 AromaticContact CE1-CE1 3.8Å; F86-F146 HydrophobicContact CE1-CE1 3.8Å; F86-F146 HydrophobicContact CG-CD1 4.24Å; F86-L149 HydrophobicContact CD2-CB 3.85Å; F86-L149 HydrophobicContact CE1-CD1 4.43Å; F86-L149 HydrophobicContact CE2-CB 3.82Å; F86-L149 HydrophobicContact CG-CB 4.34Å; F86-L149 HydrophobicContact CZ-CB 4.28Å; F86-L149 HydrophobicContact CZ-CD1 4.23Å; F86-R150 HydrophobicContact CB-CB 3.77Å; F86-V153 HydrophobicContact CD2-CG2 4.37Å; F86-V153 HydrophobicContact CE2-CG2 3.97Å
87	L	96.3	Very high	95.6	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-54	172.3	-170.7	160.3	0	0	0	110.9	A83 L84 G85 A89 S90 K91 R150 L212 P213 L216	A83-L87 PolarHBondContact O-N 3.42Å; L84-L87 WeakPolarHBondContact O-CB 3.42Å; L84-L87 PolarHBondContact O-N 3.4Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 2.91Å; L87-A89 PolarHBondContact O-N 3.46Å; L87-S90 PolarHBondContact O-N 2.82Å; L87-K91 HydrophobicContact CD2-CG 4.37Å; L87-K91 WeakPolarHBondContact O-CG 3.16Å; L87-K91 PolarHBondContact O-N 3.47Å; L87-R150 VanDerWaalsContact CB-CD 3.45Å; L87-R150 HydrophobicContact CB-CG 4.45Å; L87-L212 HydrophobicContact CD1-CB 4.3Å; L87-P213 HydrophobicContact CD1-CG 3.77Å; L87-P213 HydrophobicContact CG-CG 4.22Å; L87-L216 HydrophobicContact CD2-CD1 3.26Å
88	V	96.6	Very high	95.6	Very high	70 Å²	70	40.1 Å²	40.1	42%	0.424	23%	0.232	S	C	.	.	H	α-helix	trans	-62.4	-45.1	-178.7	174.5	0	0	0	0	110.5	L84 G85 S90 K91 L92	L84-V88 WeakPolarHBondContact O-CG2 3.32Å; L84-V88 PolarHBondContact O-N 3.14Å; G85-V88 PolarHBondContact O-N 3.31Å; V88-S90 PolarHBondContact O-N 3.33Å; V88-K91 PolarHBondContact O-N 2.95Å; V88-L92 HydrophobicContact CG1-CD1 3.76Å; V88-L92 HydrophobicContact CG1-CG 4.22Å; V88-L92 WeakPolarHBondContact O-CB 3.3Å; V88-L92 WeakPolarHBondContact O-CG 3.21Å; V88-L92 PolarHBondContact O-N 3.3Å
89	A	97.3	Very high	95.5	Very high	28 Å²	28	37.8 Å²	37.8	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-47.4	176.7	0	0	0	0	0	112.1	G85 L87 K91 L92 I93 F146	G85-A89 WeakPolarHBondContact O-CB 3.49Å; G85-A89 PolarHBondContact O-N 3.2Å; L87-A89 PolarHBondContact O-N 3.46Å; A89-K91 VanDerWaalsContact C-N 3.32Å; A89-K91 PolarHBondContact O-N 2.89Å; A89-L92 PolarHBondContact O-N 3.41Å; A89-I93 WeakPolarHBondContact O-CB 3.47Å; A89-I93 WeakPolarHBondContact O-CD1 3.37Å; A89-I93 WeakPolarHBondContact O-CG1 3.24Å; A89-I93 PolarHBondContact O-N 3.35Å; A89-F146 HydrophobicContact CB-CD1 4.3Å; A89-F146 HydrophobicContact CB-CD2 4.43Å; A89-F146 HydrophobicContact CB-CG 4.23Å
90	S	97.3	Very high	95.5	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.028	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-43.8	177.7	176.3	0	0	0	0	112	F86 L87 V88 G94 S143	F86-S90 WeakPolarHBondContact O-CB 3.41Å; F86-S90 PolarHBondContact O-N 3.01Å; L87-S90 PolarHBondContact O-N 2.82Å; V88-S90 PolarHBondContact O-N 3.33Å; S90-G94 PolarHBondContact O-N 3.41Å; S90-S143 WeakPolarHBondContact CB-O 3.22Å; S90-S143 PolarHBondContact O-OG 3.32Å; S90-S143 PolarHBondContact OG-O 3.39Å
91	K	95.1	Very high	95.5	Very high	35 Å²	35	40.2 Å²	40.2	15%	0.152	23%	0.231	C	C	.	.	H	α-helix	trans	-73.1	-42.6	-179.4	-65.8	-54.8	-177.1	-178.4	0	113.4	L87 V88 A89 I93 G94 V95 E217 L220	L87-K91 HydrophobicContact CD2-CG 4.37Å; L87-K91 WeakPolarHBondContact O-CG 3.16Å; L87-K91 PolarHBondContact O-N 3.47Å; V88-K91 PolarHBondContact O-N 2.95Å; A89-K91 VanDerWaalsContact C-N 3.32Å; A89-K91 PolarHBondContact O-N 2.89Å; K91-I93 PolarHBondContact O-N 2.9Å; K91-G94 PolarHBondContact O-N 2.98Å; K91-V95 WeakPolarHBondContact O-CB 3.36Å; K91-V95 VanDerWaalsContact O-CG2 3.22Å; K91-V95 WeakPolarHBondContact O-CG2 3.36Å; K91-V95 PolarHBondContact O-N 3.45Å; K91-E217 HydrophobicContact CD-CB 4.23Å; K91-E217 IonicContact NZ-OE2 3.03Å; K91-E217 PolarHBondContact NZ-OE2 3.27Å; K91-L220 HydrophobicContact CB-CD1 4.14Å
92	L	94.8	Very high	95.4	Very high	98 Å²	98	36.6 Å²	36.6	51%	0.513	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-43.8	175.5	-70.8	175.7	0	0	0	111.7	V88 A89 S96 L220	V88-L92 HydrophobicContact CG1-CD1 3.76Å; V88-L92 HydrophobicContact CG1-CG 4.22Å; V88-L92 WeakPolarHBondContact O-CB 3.3Å; V88-L92 WeakPolarHBondContact O-CG 3.21Å; V88-L92 PolarHBondContact O-N 3.3Å; A89-L92 PolarHBondContact O-N 3.41Å; L92-S96 PolarHBondContact O-N 3.43Å; L92-L220 HydrophobicContact CD2-CD1 4.26Å; L92-L220 HydrophobicContact CD2-CD2 4.14Å
93	I	95.7	Very high	95.2	Very high	45 Å²	45	38.7 Å²	38.7	23%	0.231	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-43.8	176.3	-63.5	166.1	0	0	0	110.4	A89 K91 V95 S96 V97 A139 F146	A89-I93 WeakPolarHBondContact O-CB 3.47Å; A89-I93 WeakPolarHBondContact O-CD1 3.37Å; A89-I93 WeakPolarHBondContact O-CG1 3.24Å; A89-I93 PolarHBondContact O-N 3.35Å; K91-I93 PolarHBondContact O-N 2.9Å; I93-V95 VanDerWaalsContact C-N 3.32Å; I93-V95 PolarHBondContact O-N 3.34Å; I93-S96 WeakPolarHBondContact O-CB 3.41Å; I93-S96 PolarHBondContact O-N 3.18Å; I93-S96 PolarHBondContact O-OG 2.9Å; I93-V97 PolarHBondContact O-N 3.06Å; I93-A139 HydrophobicContact CG2-CB 4.17Å; I93-A139 WeakPolarHBondContact CG2-O 3.07Å; I93-F146 HydrophobicContact CD1-CD2 3.51Å; I93-F146 HydrophobicContact CD1-CE2 3.49Å; I93-F146 VanDerWaalsContact CD1-CE2 3.49Å
94	G	94.2	Very high	95	Very high	7 Å²	7	38.6 Å²	38.6	7%	0.072	21%	0.211	C	C	.	.	H	α-helix	trans	-58.8	-44.7	179.1	0	0	0	0	0	112.1	S90 K91 S96 V97 P98 S143 Q359	S90-G94 PolarHBondContact O-N 3.41Å; K91-G94 PolarHBondContact O-N 2.98Å; G94-S96 PolarHBondContact O-N 2.95Å; G94-V97 VanDerWaalsContact O-CB 3.28Å; G94-V97 WeakPolarHBondContact O-CB 3.48Å; G94-V97 WeakPolarHBondContact O-CG2 3.14Å; G94-V97 PolarHBondContact O-N 3.21Å; G94-V97 VanDerWaalsContact O-N 3.09Å; G94-P98 WeakPolarHBondContact O-CD 3.45Å; G94-S143 WeakPolarHBondContact CA-OG 3.35Å; G94-S143 PolarHBondContact N-OG 3.43Å; G94-Q359 PolarHBondContact O-OE1 2.94Å
95	V	93.2	Very high	94.8	Very high	9 Å²	9	36.2 Å²	36.2	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-23.7	176.8	171.5	0	0	0	0	112.7	K91 I93 V97 P98 F99 L220 L224 L356	K91-V95 WeakPolarHBondContact O-CB 3.36Å; K91-V95 VanDerWaalsContact O-CG2 3.22Å; K91-V95 WeakPolarHBondContact O-CG2 3.36Å; K91-V95 PolarHBondContact O-N 3.45Å; I93-V95 VanDerWaalsContact C-N 3.32Å; I93-V95 PolarHBondContact O-N 3.34Å; V95-V97 VanDerWaalsContact C-N 3.32Å; V95-P98 WeakPolarHBondContact O-CD 3.18Å; V95-F99 VanDerWaalsContact O-CD2 3.26Å; V95-F99 WeakPolarHBondContact O-CD2 3.41Å; V95-L220 HydrophobicContact CG2-CB 4.35Å; V95-L220 HydrophobicContact CG2-CD1 4.4Å; V95-L224 HydrophobicContact CG1-CD1 3.07Å; V95-L356 HydrophobicContact CG1-CD2 4.14Å
96	S	91.9	Very high	94.5	Very high	44 Å²	44	36 Å²	36	31%	0.308	19%	0.188	S	C	.	.	H	α-helix	trans	-74.6	-18.7	173.8	78.1	0	0	0	0	114	L92 I93 G94 F99 L100	L92-S96 PolarHBondContact O-N 3.43Å; I93-S96 WeakPolarHBondContact O-CB 3.41Å; I93-S96 PolarHBondContact O-N 3.18Å; I93-S96 PolarHBondContact O-OG 2.9Å; G94-S96 PolarHBondContact O-N 2.95Å; S96-F99 WeakPolarHBondContact O-CB 3.26Å; S96-F99 PolarHBondContact O-N 2.85Å; S96-F99 VanDerWaalsContact O-N 3.12Å; S96-L100 PolarHBondContact O-N 3.11Å; S96-L100 VanDerWaalsContact O-N 3.12Å
97	V	95.4	Very high	94	Very high	16 Å²	16	36 Å²	36	10%	0.097	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-48.8	-176.1	173.3	0	0	0	0	112.3	I93 G94 V95 F99 L100 F101 Y136 A139 R140	I93-V97 PolarHBondContact O-N 3.06Å; G94-V97 VanDerWaalsContact O-CB 3.28Å; G94-V97 WeakPolarHBondContact O-CB 3.48Å; G94-V97 WeakPolarHBondContact O-CG2 3.14Å; G94-V97 PolarHBondContact O-N 3.21Å; G94-V97 VanDerWaalsContact O-N 3.09Å; V95-V97 VanDerWaalsContact C-N 3.32Å; V97-F99 PolarHBondContact O-N 3.3Å; V97-L100 PolarHBondContact O-N 3.47Å; V97-F101 PolarHBondContact O-N 3.1Å; V97-F101 VanDerWaalsContact O-N 3.14Å; V97-Y136 HydrophobicContact CG1-CD2 3.42Å; V97-Y136 VanDerWaalsContact CG1-CD2 3.42Å; V97-Y136 HydrophobicContact CG1-CE2 3.19Å; V97-Y136 HydrophobicContact CG1-CG 4.47Å; V97-A139 HydrophobicContact CG2-CB 3.83Å; V97-R140 HydrophobicContact CG1-CB 4.46Å; V97-R140 HydrophobicContact CG2-CB 4.26Å
98	P	94.7	Very high	93.4	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-29.1	173.7	-23.8	32.4	0	0	0	114.5	G94 V95 F101 K102 M352 L356	G94-P98 WeakPolarHBondContact O-CD 3.45Å; V95-P98 WeakPolarHBondContact O-CD 3.18Å; P98-F101 PolarHBondContact O-N 2.82Å; P98-K102 WeakPolarHBondContact O-CB 3.26Å; P98-K102 PolarHBondContact O-N 2.82Å; P98-M352 HydrophobicContact CB-CG 4.05Å; P98-L356 HydrophobicContact CB-CD2 4.42Å; P98-L356 HydrophobicContact CB-CG 4.25Å; P98-L356 HydrophobicContact CG-CD2 3.99Å; P98-L356 HydrophobicContact CG-CG 4.2Å
99	F	94	Very high	92.7	Very high	37 Å²	37	40.6 Å²	40.6	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-69.6	-43.8	177.3	-74.3	-99.5	0	0	0	111.2	V95 S96 V97 F101 K102 Y103 L224 M352 L356	V95-F99 VanDerWaalsContact O-CD2 3.26Å; V95-F99 WeakPolarHBondContact O-CD2 3.41Å; S96-F99 WeakPolarHBondContact O-CB 3.26Å; S96-F99 PolarHBondContact O-N 2.85Å; S96-F99 VanDerWaalsContact O-N 3.12Å; V97-F99 PolarHBondContact O-N 3.3Å; F99-F101 VanDerWaalsContact C-N 3.26Å; F99-F101 PolarHBondContact O-N 3.46Å; F99-K102 WeakPolarHBondContact O-CB 3.48Å; F99-K102 PolarHBondContact O-N 3.06Å; F99-Y103 HydrophobicContact CB-CE2 4.23Å; F99-Y103 WeakPolarHBondContact O-CD2 3.39Å; F99-Y103 PolarHBondContact O-N 2.61Å; F99-L224 HydrophobicContact CE2-CD1 4.22Å; F99-L224 HydrophobicContact CZ-CD1 4.44Å; F99-L224 HydrophobicContact CZ-CD2 4.24Å; F99-M352 HydrophobicContact CD1-SD 3.67Å; F99-M352 HydrophobicContact CD2-CG 4.43Å; F99-M352 HydrophobicContact CD2-SD 4.24Å; F99-M352 HydrophobicContact CE1-SD 3.41Å; F99-M352 WeakPolarHBondContact CE1-SD 3.39Å; F99-M352 HydrophobicContact CE2-CG 4.48Å; F99-M352 HydrophobicContact CE2-SD 4.02Å; F99-M352 HydrophobicContact CG-SD 4.08Å; F99-M352 HydrophobicContact CZ-SD 3.6Å; F99-L356 HydrophobicContact CE2-CD1 4.39Å
100	L	94.3	Very high	91.5	Very high	43 Å²	43	43.6 Å²	43.6	23%	0.225	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-39.8	174.9	-68.7	170.6	0	0	0	111.3	S96 V97 Y103 A104 L132 A139	S96-L100 PolarHBondContact O-N 3.11Å; S96-L100 VanDerWaalsContact O-N 3.12Å; V97-L100 PolarHBondContact O-N 3.47Å; L100-Y103 PolarHBondContact O-N 3.36Å; L100-A104 PolarHBondContact O-N 2.6Å; L100-L132 HydrophobicContact CD2-CD2 4.37Å; L100-A139 HydrophobicContact CD1-CB 3.66Å
101	F	95.3	Very high	89.6	Confident	85 Å²	85	45.4 Å²	45.4	37%	0.373	23%	0.23	S	C	.	.	H	α-helix	trans	-67.8	-40.7	176.4	-170.2	-135.1	0	0	0	112.3	V97 P98 F99 Y103 A104 V105 Y136 V351	V97-F101 PolarHBondContact O-N 3.1Å; V97-F101 VanDerWaalsContact O-N 3.14Å; P98-F101 PolarHBondContact O-N 2.82Å; F99-F101 VanDerWaalsContact C-N 3.26Å; F99-F101 PolarHBondContact O-N 3.46Å; F101-Y103 PolarHBondContact O-N 2.79Å; F101-A104 PolarHBondContact O-N 3.12Å; F101-V105 HydrophobicContact CD2-CG2 4.34Å; F101-V105 HydrophobicContact CE1-CG2 4.46Å; F101-V105 HydrophobicContact CE2-CG2 4.04Å; F101-V105 HydrophobicContact CZ-CG2 4.1Å; F101-V105 WeakPolarHBondContact O-CG2 3.47Å; F101-V105 PolarHBondContact O-N 3.12Å; F101-Y136 HydrophobicContact CB-CD2 3.98Å; F101-Y136 HydrophobicContact CB-CE2 4.22Å; F101-V351 HydrophobicContact CD1-CG1 3.28Å; F101-V351 HydrophobicContact CE1-CG1 3.23Å; F101-V351 HydrophobicContact CG-CG1 4.39Å; F101-V351 HydrophobicContact CZ-CG1 4.31Å
102	K	94.4	Very high	87.7	Confident	7 Å²	7	51.7 Å²	51.7	3%	0.03	26%	0.258	C	S	.	.	H	α-helix	trans	-53.4	-52.7	170.8	161.7	179.3	-179.3	-168.5	0	111.9	P98 F99 A104 V105 E106 G348 D349 M352	P98-K102 WeakPolarHBondContact O-CB 3.26Å; P98-K102 PolarHBondContact O-N 2.82Å; F99-K102 WeakPolarHBondContact O-CB 3.48Å; F99-K102 PolarHBondContact O-N 3.06Å; K102-A104 VanDerWaalsContact C-N 3.27Å; K102-A104 PolarHBondContact O-N 3.29Å; K102-V105 PolarHBondContact O-N 3.46Å; K102-V105 VanDerWaalsContact O-N 3.11Å; K102-E106 WeakPolarHBondContact CE-OE1 3.44Å; K102-E106 VanDerWaalsContact CE-OE2 3.27Å; K102-E106 WeakPolarHBondContact CE-OE2 3.42Å; K102-E106 HydrophobicContact CG-CG 4.42Å; K102-E106 IonicContact NZ-OE1 3.84Å; K102-E106 PolarHBondContact NZ-OE1 2.92Å; K102-E106 WeakPolarHBondContact O-CG 3.41Å; K102-E106 PolarHBondContact O-N 3.11Å; K102-G348 WeakPolarHBondContact CB-O 3.38Å; K102-G348 WeakPolarHBondContact CG-O 3.3Å; K102-D349 WeakPolarHBondContact CE-OD1 3.48Å; K102-D349 VanDerWaalsContact NZ-CG 3.34Å; K102-D349 IonicContact NZ-OD1 3.57Å; K102-D349 PolarHBondContact NZ-OD1 3.33Å; K102-D349 IonicContact NZ-OD2 3.4Å; K102-M352 HydrophobicContact CB-CB 3.96Å; K102-M352 HydrophobicContact CD-CB 4.16Å; K102-M352 HydrophobicContact CD-SD 3.96Å
103	Y	93.2	Very high	85.5	Confident	103 Å²	103	52.8 Å²	52.8	40%	0.404	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-35.2	-177.4	-64.6	-48.1	0	0	0	111.9	F99 L100 F101 E106 Y107	F99-Y103 HydrophobicContact CB-CE2 4.23Å; F99-Y103 WeakPolarHBondContact O-CD2 3.39Å; F99-Y103 PolarHBondContact O-N 2.61Å; L100-Y103 PolarHBondContact O-N 3.36Å; F101-Y103 PolarHBondContact O-N 2.79Å; Y103-E106 WeakPolarHBondContact CD1-OE2 3.45Å; Y103-E106 PolarHBondContact O-N 2.98Å; Y103-Y107 VanDerWaalsContact O-CB 3.24Å; Y103-Y107 WeakPolarHBondContact O-CB 3.36Å; Y103-Y107 PolarHBondContact O-N 3.49Å
104	A	91.7	Very high	83.3	Confident	2 Å²	2	54.9 Å²	54.9	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-45.4	172.5	0	0	0	0	0	111.6	L100 F101 K102 Y107 Y108 L132 L133	L100-A104 PolarHBondContact O-N 2.6Å; F101-A104 PolarHBondContact O-N 3.12Å; K102-A104 VanDerWaalsContact C-N 3.27Å; K102-A104 PolarHBondContact O-N 3.29Å; A104-Y107 PolarHBondContact O-N 3.09Å; A104-Y108 WeakPolarHBondContact O-CD2 3.24Å; A104-Y108 PolarHBondContact O-N 3.28Å; A104-Y108 VanDerWaalsContact O-N 3.16Å; A104-L132 HydrophobicContact CB-CB 4.12Å; A104-L133 HydrophobicContact CB-CD2 3.83Å; A104-L133 HydrophobicContact CB-CG 4.22Å
105	V	91.7	Very high	81.2	Confident	26 Å²	26	58 Å²	58	16%	0.158	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-40.2	177.9	171.7	0	0	0	0	111.9	F101 K102 N109 V347	F101-V105 HydrophobicContact CD2-CG2 4.34Å; F101-V105 HydrophobicContact CE1-CG2 4.46Å; F101-V105 HydrophobicContact CE2-CG2 4.04Å; F101-V105 HydrophobicContact CZ-CG2 4.1Å; F101-V105 WeakPolarHBondContact O-CG2 3.47Å; F101-V105 PolarHBondContact O-N 3.12Å; K102-V105 PolarHBondContact O-N 3.46Å; K102-V105 VanDerWaalsContact O-N 3.11Å; V105-N109 WeakPolarHBondContact CG1-ND2 3.27Å; V105-N109 WeakPolarHBondContact O-CB 3.28Å; V105-N109 PolarHBondContact O-N 3.14Å; V105-N109 PolarHBondContact O-ND2 2.96Å; V105-V347 HydrophobicContact CG1-CG1 4.32Å
106	E	90.3	Very high	78.8	Confident	36 Å²	36	65 Å²	65	17%	0.168	33%	0.328	C	S	.	.	H	α-helix	trans	-66.6	-41.5	176.1	-73	176.9	153.7	0	0	111.9	K102 Y103 Y108 N109 S110 T346	K102-E106 WeakPolarHBondContact CE-OE1 3.44Å; K102-E106 VanDerWaalsContact CE-OE2 3.27Å; K102-E106 WeakPolarHBondContact CE-OE2 3.42Å; K102-E106 HydrophobicContact CG-CG 4.42Å; K102-E106 IonicContact NZ-OE1 3.84Å; K102-E106 PolarHBondContact NZ-OE1 2.92Å; K102-E106 WeakPolarHBondContact O-CG 3.41Å; K102-E106 PolarHBondContact O-N 3.11Å; Y103-E106 WeakPolarHBondContact CD1-OE2 3.45Å; Y103-E106 PolarHBondContact O-N 2.98Å; E106-Y108 PolarHBondContact O-N 2.93Å; E106-N109 PolarHBondContact O-N 3.29Å; E106-N109 VanDerWaalsContact O-N 3.12Å; E106-S110 WeakPolarHBondContact O-CB 3.35Å; E106-S110 PolarHBondContact O-N 2.87Å; E106-S110 PolarHBondContact O-OG 3.33Å; E106-T346 HydrophobicContact CG-CG2 4.48Å; E106-T346 WeakPolarHBondContact OE1-CB 3.33Å; E106-T346 WeakPolarHBondContact OE1-CG2 3.34Å; E106-T346 PolarHBondContact OE1-OG1 3.2Å
107	Y	86.7	Confident	76.8	Confident	48 Å²	48	66.4 Å²	66.4	19%	0.188	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-48.9	178.2	-179.3	-99.6	0	0	0	111.6	Y103 A104 N109 T125 I128	Y103-Y107 VanDerWaalsContact O-CB 3.24Å; Y103-Y107 WeakPolarHBondContact O-CB 3.36Å; Y103-Y107 PolarHBondContact O-N 3.49Å; A104-Y107 PolarHBondContact O-N 3.09Å; Y107-N109 VanDerWaalsContact C-N 3.26Å; Y107-N109 PolarHBondContact O-N 3.29Å; Y107-T125 HydrophobicContact CE1-CG2 4.37Å; Y107-T125 WeakPolarHBondContact CE1-O 3.41Å; Y107-T125 WeakPolarHBondContact OH-CA 3.29Å; Y107-T125 WeakPolarHBondContact OH-CG2 3.45Å; Y107-T125 PolarHBondContact OH-O 2.95Å; Y107-I128 HydrophobicContact CD2-CG2 4.31Å; Y107-I128 HydrophobicContact CE2-CB 4Å; Y107-I128 HydrophobicContact CE2-CG2 4.02Å
108	Y	84.3	Confident	74.7	Confident	106 Å²	106	74.1 Å²	74.1	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-73.5	-12.9	177.9	-71.8	-67.5	0	0	0	114.3	A104 E106 L133	A104-Y108 WeakPolarHBondContact O-CD2 3.24Å; A104-Y108 PolarHBondContact O-N 3.28Å; A104-Y108 VanDerWaalsContact O-N 3.16Å; E106-Y108 PolarHBondContact O-N 2.93Å; Y108-L133 HydrophobicContact CE2-CD1 4.24Å
109	N	82.1	Confident	72.7	Confident	64 Å²	64	80.2 Å²	80.2	34%	0.342	39%	0.394	S	S	.	.	H	α-helix	trans	-98	-23.7	176.4	-83.9	-53.4	0	0	0	114.3	V105 E106 Y107	V105-N109 WeakPolarHBondContact CG1-ND2 3.27Å; V105-N109 WeakPolarHBondContact O-CB 3.28Å; V105-N109 PolarHBondContact O-N 3.14Å; V105-N109 PolarHBondContact O-ND2 2.96Å; E106-N109 PolarHBondContact O-N 3.29Å; E106-N109 VanDerWaalsContact O-N 3.12Å; Y107-N109 VanDerWaalsContact C-N 3.26Å; Y107-N109 PolarHBondContact O-N 3.29Å
110	S	70.4	Confident	70.8	Confident	92 Å²	92	80.8 Å²	80.8	64%	0.643	40%	0.401	S	S	*	.	H	α-helix	trans	-74.1	-28.9	-174.8	-59.7	0	0	0	0	112.8	E106 K112	E106-S110 WeakPolarHBondContact O-CB 3.35Å; E106-S110 PolarHBondContact O-N 2.87Å; E106-S110 PolarHBondContact O-OG 3.33Å; S110-K112 PolarHBondContact O-N 2.88Å; S110-K112 VanDerWaalsContact O-N 3.09Å
111	D	57.9	Low	68.9	Low	42 Å²	42	82.5 Å²	82.5	23%	0.225	41%	0.414	C	S	.	.			trans	-87.3	46.7	177.9	-85.8	-24.5	0	0	0	112.7	F117	D111-F117 HydrophobicContact CB-CD2 3.78Å; D111-F117 HydrophobicContact CB-CE2 3.65Å
112	K	54.4	Low	67.2	Low	167 Å²	167	86.1 Å²	86.1	73%	0.726	43%	0.43	S	S	*	.			trans	-74.6	-9.5	166.1	-81.5	-175.3	-178.6	-178.6	0	113.5	S110 S114	S110-K112 PolarHBondContact O-N 2.88Å; S110-K112 VanDerWaalsContact O-N 3.09Å; K112-S114 PolarHBondContact O-N 3.39Å
113	D	48.8	Very low	65.5	Low	120 Å²	120	89.4 Å²	89.4	64%	0.642	45%	0.454	S	S	*	.	S	Bend	trans	-74.5	85.1	155.9	-84.4	-18.2	0	0	0	107.9	S115 R116	D113-S115 PolarHBondContact O-N 2.86Å; D113-R116 PolarHBondContact O-N 3.37Å; D113-R116 VanDerWaalsContact O-N 3.15Å
114	S	50.4	Low	63.9	Low	90 Å²	90	88 Å²	88	63%	0.629	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-0.3	179.4	39.9	0	0	0	0	115.1	K112 F118	K112-S114 PolarHBondContact O-N 3.39Å; S114-F118 VanDerWaalsContact O-CD2 3.23Å; S114-F118 WeakPolarHBondContact O-CD2 3.16Å
115	S	49.3	Very low	62.2	Low	71 Å²	71	88.3 Å²	88.3	50%	0.497	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-32.5	172.4	52.9	0	0	0	0	113.8	D113 F118 D119	D113-S115 PolarHBondContact O-N 2.86Å; S115-F118 PolarHBondContact O-N 3.14Å; S115-D119 PolarHBondContact O-N 3.41Å
116	R	44.2	Very low	60.9	Low	156 Å²	156	89.6 Å²	89.6	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-77.4	-24.9	-175.5	-85.6	-169.2	-177.7	143.5	3.4	115.4	D113 F118 D119 T120	D113-R116 PolarHBondContact O-N 3.37Å; D113-R116 VanDerWaalsContact O-N 3.15Å; R116-F118 PolarHBondContact O-N 3.44Å; R116-D119 PolarHBondContact O-N 2.97Å; R116-T120 PolarHBondContact O-N 3Å; R116-T120 PolarHBondContact O-OG1 2.87Å
117	F	49.1	Very low	60.3	Low	74 Å²	74	91.7 Å²	91.7	33%	0.325	48%	0.481	S	S	.	.	H	α-helix	trans	-66	-21.1	173.9	-104.9	-82.3	0	0	0	112.7	D111 T125	D111-F117 HydrophobicContact CB-CD2 3.78Å; D111-F117 HydrophobicContact CB-CE2 3.65Å; F117-T125 HydrophobicContact CD1-CG2 3.93Å; F117-T125 HydrophobicContact CD2-CG2 4.48Å; F117-T125 HydrophobicContact CE1-CG2 3.35Å; F117-T125 HydrophobicContact CE2-CG2 3.97Å; F117-T125 HydrophobicContact CG-CG2 4.47Å; F117-T125 HydrophobicContact CZ-CG2 3.37Å
118	F	52	Low	60.2	Low	179 Å²	179	94 Å²	94	79%	0.785	50%	0.496	S	S	*	.	H	α-helix	trans	-91.5	-27.9	174.6	-65.7	-73.9	0	0	0	113	S114 S115 R116	S114-F118 VanDerWaalsContact O-CD2 3.23Å; S114-F118 WeakPolarHBondContact O-CD2 3.16Å; S115-F118 PolarHBondContact O-N 3.14Å; R116-F118 PolarHBondContact O-N 3.44Å
119	D	52	Low	60.2	Low	137 Å²	137	89 Å²	89	73%	0.733	48%	0.476	S	S	*	.	H	α-helix	trans	-89.5	-26.7	-178.5	-70.9	-23.6	0	0	0	114.2	S115 R116	S115-D119 PolarHBondContact O-N 3.41Å; R116-D119 PolarHBondContact O-N 2.97Å
120	T	54.6	Low	60.3	Low	49 Å²	49	88.5 Å²	88.5	30%	0.301	48%	0.475	S	S	.	.	S	Bend	trans	-87	137.4	172.9	53.4	0	0	0	0	109.4	R116 F122 T125	R116-T120 PolarHBondContact O-N 3Å; R116-T120 PolarHBondContact O-OG1 2.87Å; T120-F122 PolarHBondContact O-N 2.96Å; T120-F122 VanDerWaalsContact O-N 3.09Å; T120-T125 PolarHBondContact OG1-OG1 3.32Å
121	P	55.1	Low	61.3	Low	79 Å²	79	86.6 Å²	86.6	51%	0.513	47%	0.466	S	S	.	.			trans	-51.2	126.6	176.9	-23.8	29.9	0	0	0	109.4	S123 T124 T125	P121-S123 WeakPolarHBondContact CB-OG 3.1Å; P121-S123 CarbonylContact O-C 3.4Å; P121-S123 PolarHBondContact O-N 2.97Å; P121-T124 WeakPolarHBondContact CB-OG1 3.24Å; P121-T124 WeakPolarHBondContact CD-OG1 3.41Å; P121-T124 PolarHBondContact O-N 3.32Å; P121-T124 PolarHBondContact O-OG1 3.37Å; P121-T125 PolarHBondContact O-N 3.47Å
122	F	59.4	Low	62.9	Low	161 Å²	161	86.5 Å²	86.5	71%	0.706	47%	0.465	S	S	*	.	H	α-helix	trans	-46.2	-32.1	175.5	179	-100.1	0	0	0	111.5	T120 V126	T120-F122 PolarHBondContact O-N 2.96Å; T120-F122 VanDerWaalsContact O-N 3.09Å; F122-V126 HydrophobicContact CD1-CG2 4.34Å; F122-V126 HydrophobicContact CD2-CG2 4.31Å; F122-V126 HydrophobicContact CE1-CG2 4.08Å; F122-V126 HydrophobicContact CE2-CG2 4.04Å; F122-V126 HydrophobicContact CG-CG2 4.45Å; F122-V126 HydrophobicContact CZ-CG2 3.92Å; F122-V126 VanDerWaalsContact O-CB 3.3Å; F122-V126 WeakPolarHBondContact O-CB 3.29Å; F122-V126 WeakPolarHBondContact O-CG2 3.37Å; F122-V126 PolarHBondContact O-N 2.8Å
123	S	58.6	Low	64.7	Low	76 Å²	76	82 Å²	82	53%	0.531	45%	0.448	S	S	.	.	H	α-helix	trans	-60.1	-48.4	173.3	58.7	0	0	0	0	113.9	P121 T127	P121-S123 WeakPolarHBondContact CB-OG 3.1Å; P121-S123 CarbonylContact O-C 3.4Å; P121-S123 PolarHBondContact O-N 2.97Å; S123-T127 WeakPolarHBondContact O-CB 3.41Å; S123-T127 PolarHBondContact O-N 2.97Å; S123-T127 VanDerWaalsContact O-N 3.07Å; S123-T127 PolarHBondContact O-OG1 3.48Å
124	T	59.3	Low	66.8	Low	73 Å²	73	81.9 Å²	81.9	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-69.2	-41.5	-175.8	24.3	0	0	0	0	112.9	P121 T127 I128	P121-T124 WeakPolarHBondContact CB-OG1 3.24Å; P121-T124 WeakPolarHBondContact CD-OG1 3.41Å; P121-T124 PolarHBondContact O-N 3.32Å; P121-T124 PolarHBondContact O-OG1 3.37Å; T124-T127 WeakPolarHBondContact O-CB 3.47Å; T124-T127 PolarHBondContact O-N 2.99Å; T124-T127 VanDerWaalsContact O-N 3.11Å; T124-I128 PolarHBondContact O-N 3.44Å
125	T	55.7	Low	68.8	Low	9 Å²	9	78.6 Å²	78.6	6%	0.055	43%	0.428	C	S	.	.	H	α-helix	trans	-74.6	-33.8	-177	-49.1	0	0	0	0	111.6	Y107 F117 T120 P121 T127	Y107-T125 HydrophobicContact CE1-CG2 4.37Å; Y107-T125 WeakPolarHBondContact CE1-O 3.41Å; Y107-T125 WeakPolarHBondContact OH-CA 3.29Å; Y107-T125 WeakPolarHBondContact OH-CG2 3.45Å; Y107-T125 PolarHBondContact OH-O 2.95Å; F117-T125 HydrophobicContact CD1-CG2 3.93Å; F117-T125 HydrophobicContact CD2-CG2 4.48Å; F117-T125 HydrophobicContact CE1-CG2 3.35Å; F117-T125 HydrophobicContact CE2-CG2 3.97Å; F117-T125 HydrophobicContact CG-CG2 4.47Å; F117-T125 HydrophobicContact CZ-CG2 3.37Å; T120-T125 PolarHBondContact OG1-OG1 3.32Å; P121-T125 PolarHBondContact O-N 3.47Å; T125-T127 VanDerWaalsContact C-N 3.28Å; T125-T127 PolarHBondContact O-N 3.37Å
126	V	63.6	Low	71	Confident	53 Å²	53	78.7 Å²	78.7	32%	0.321	42%	0.418	S	S	.	.	H	α-helix	trans	-67	-30.6	168.6	173.2	0	0	0	0	111	F122 T130	F122-V126 HydrophobicContact CD1-CG2 4.34Å; F122-V126 HydrophobicContact CD2-CG2 4.31Å; F122-V126 HydrophobicContact CE1-CG2 4.08Å; F122-V126 HydrophobicContact CE2-CG2 4.04Å; F122-V126 HydrophobicContact CG-CG2 4.45Å; F122-V126 HydrophobicContact CZ-CG2 3.92Å; F122-V126 VanDerWaalsContact O-CB 3.3Å; F122-V126 WeakPolarHBondContact O-CB 3.29Å; F122-V126 WeakPolarHBondContact O-CG2 3.37Å; F122-V126 PolarHBondContact O-N 2.8Å; V126-T130 HydrophobicContact CG1-CG2 3.81Å; V126-T130 VanDerWaalsContact O-CB 3.24Å; V126-T130 WeakPolarHBondContact O-CB 3.5Å; V126-T130 WeakPolarHBondContact O-CG2 3.49Å; V126-T130 PolarHBondContact O-N 3.3Å; V126-T130 VanDerWaalsContact O-N 3.11Å; V126-T130 PolarHBondContact O-OG1 3.43Å
127	T	79	Confident	73.4	Confident	80 Å²	80	72.5 Å²	72.5	49%	0.491	40%	0.402	S	S	.	.	H	α-helix	trans	-67.5	-47.3	-174.6	-61.5	0	0	0	0	113.8	S123 T124 T125 T130 A131	S123-T127 WeakPolarHBondContact O-CB 3.41Å; S123-T127 PolarHBondContact O-N 2.97Å; S123-T127 VanDerWaalsContact O-N 3.07Å; S123-T127 PolarHBondContact O-OG1 3.48Å; T124-T127 WeakPolarHBondContact O-CB 3.47Å; T124-T127 PolarHBondContact O-N 2.99Å; T124-T127 VanDerWaalsContact O-N 3.11Å; T125-T127 VanDerWaalsContact C-N 3.28Å; T125-T127 PolarHBondContact O-N 3.37Å; T127-T130 PolarHBondContact O-OG1 3.5Å; T127-T130 VanDerWaalsContact O-OG1 3.06Å; T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 2.88Å
128	I	83.8	Confident	75.7	Confident	96 Å²	96	74 Å²	74	49%	0.492	41%	0.413	S	S	.	.	H	α-helix	trans	-72.3	-46.4	-174.7	-60.3	174.5	0	0	0	111.3	Y107 T124 T130 A131 L132	Y107-I128 HydrophobicContact CD2-CG2 4.31Å; Y107-I128 HydrophobicContact CE2-CB 4Å; Y107-I128 HydrophobicContact CE2-CG2 4.02Å; T124-I128 PolarHBondContact O-N 3.44Å; I128-T130 PolarHBondContact O-N 3.25Å; I128-A131 PolarHBondContact O-N 2.94Å; I128-L132 HydrophobicContact CG2-CD1 4.36Å; I128-L132 WeakPolarHBondContact O-CG 3.24Å; I128-L132 PolarHBondContact O-N 2.87Å
129	G	83.6	Confident	77.8	Confident	0 Å²	0	66 Å²	66	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-44	177.6	0	0	0	0	0	112.2	L132 L133	G129-L132 PolarHBondContact O-N 3.37Å; G129-L133 WeakPolarHBondContact O-CG 3.38Å; G129-L133 PolarHBondContact O-N 2.73Å; G129-L133 VanDerWaalsContact O-N 3.1Å
130	T	86.1	Confident	79.9	Confident	54 Å²	54	67.4 Å²	67.4	33%	0.331	37%	0.374	S	S	.	.	H	α-helix	trans	-66.4	-38.2	174.4	57.5	0	0	0	0	112.2	V126 T127 I128 L132 L133 L134	V126-T130 HydrophobicContact CG1-CG2 3.81Å; V126-T130 VanDerWaalsContact O-CB 3.24Å; V126-T130 WeakPolarHBondContact O-CB 3.5Å; V126-T130 WeakPolarHBondContact O-CG2 3.49Å; V126-T130 PolarHBondContact O-N 3.3Å; V126-T130 VanDerWaalsContact O-N 3.11Å; V126-T130 PolarHBondContact O-OG1 3.43Å; T127-T130 PolarHBondContact O-OG1 3.5Å; T127-T130 VanDerWaalsContact O-OG1 3.06Å; I128-T130 PolarHBondContact O-N 3.25Å; T130-L132 VanDerWaalsContact C-N 3.35Å; T130-L132 PolarHBondContact O-N 2.92Å; T130-L133 PolarHBondContact O-N 3.27Å; T130-L134 WeakPolarHBondContact O-CB 3.43Å; T130-L134 VanDerWaalsContact O-CG 3.29Å; T130-L134 WeakPolarHBondContact O-CG 3.36Å; T130-L134 PolarHBondContact O-N 3.42Å
131	A	89.4	Confident	81.9	Confident	53 Å²	53	70.7 Å²	70.7	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-39	174.9	0	0	0	0	0	112.5	T127 I128 G135	T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 2.88Å; I128-A131 PolarHBondContact O-N 2.94Å; A131-G135 PolarHBondContact O-N 2.86Å
132	L	91.9	Very high	84	Confident	40 Å²	40	68.5 Å²	68.5	21%	0.209	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-42.3	174.8	-72.9	171	0	0	0	112	L100 A104 I128 G129 T130 G135 Y136	L100-L132 HydrophobicContact CD2-CD2 4.37Å; A104-L132 HydrophobicContact CB-CB 4.12Å; I128-L132 HydrophobicContact CG2-CD1 4.36Å; I128-L132 WeakPolarHBondContact O-CG 3.24Å; I128-L132 PolarHBondContact O-N 2.87Å; G129-L132 PolarHBondContact O-N 3.37Å; T130-L132 VanDerWaalsContact C-N 3.35Å; T130-L132 PolarHBondContact O-N 2.92Å; L132-G135 PolarHBondContact O-N 2.89Å; L132-Y136 PolarHBondContact O-N 3.43Å
133	L	92.4	Very high	85.8	Confident	72 Å²	72	61.8 Å²	61.8	38%	0.377	35%	0.348	S	S	.	.	H	α-helix	trans	-68.1	-39.2	176.7	-68.6	174.2	0	0	0	112.4	A104 Y108 G129 T130 Y136 G137	A104-L133 HydrophobicContact CB-CD2 3.83Å; A104-L133 HydrophobicContact CB-CG 4.22Å; Y108-L133 HydrophobicContact CE2-CD1 4.24Å; G129-L133 WeakPolarHBondContact O-CG 3.38Å; G129-L133 PolarHBondContact O-N 2.73Å; G129-L133 VanDerWaalsContact O-N 3.1Å; T130-L133 PolarHBondContact O-N 3.27Å; L133-Y136 WeakPolarHBondContact O-CB 3.38Å; L133-Y136 PolarHBondContact O-N 3.48Å; L133-G137 PolarHBondContact O-N 2.81Å; L133-G137 VanDerWaalsContact O-N 3.09Å
134	L	92.9	Very high	87.5	Confident	117 Å²	117	61.4 Å²	61.4	61%	0.613	35%	0.346	S	S	*	.	H	α-helix	trans	-63.6	-43.6	170.8	-73.9	173.4	0	0	0	110.8	T130 Y136 G137 I138	T130-L134 WeakPolarHBondContact O-CB 3.43Å; T130-L134 VanDerWaalsContact O-CG 3.29Å; T130-L134 WeakPolarHBondContact O-CG 3.36Å; T130-L134 PolarHBondContact O-N 3.42Å; L134-Y136 VanDerWaalsContact C-N 3.33Å; L134-Y136 PolarHBondContact O-N 3.45Å; L134-G137 WeakPolarHBondContact O-CA 3.42Å; L134-G137 PolarHBondContact O-N 2.81Å; L134-G137 VanDerWaalsContact O-N 3.12Å; L134-I138 WeakPolarHBondContact O-CG1 3.34Å; L134-I138 PolarHBondContact O-N 3.46Å
135	G	93.5	Very high	89.4	Confident	22 Å²	22	62.4 Å²	62.4	23%	0.227	35%	0.348	C	S	.	.	H	α-helix	trans	-58.1	-43.3	174.3	0	0	0	0	0	112.2	A131 L132 G137 I138 A139	A131-G135 PolarHBondContact O-N 2.86Å; L132-G135 PolarHBondContact O-N 2.89Å; G135-G137 VanDerWaalsContact C-N 3.34Å; G135-G137 PolarHBondContact O-N 3.42Å; G135-I138 PolarHBondContact O-N 3.12Å; G135-A139 VanDerWaalsContact O-CB 3.28Å; G135-A139 WeakPolarHBondContact O-CB 3.31Å; G135-A139 PolarHBondContact O-N 3.39Å
136	Y	94.8	Very high	91.4	Very high	73 Å²	73	64.7 Å²	64.7	29%	0.286	36%	0.357	S	S	.	.	H	α-helix	trans	-56.2	-47.4	172.3	162.7	-89.4	0	0	0	111.3	V97 F101 L132 L133 L134 A139 R140	V97-Y136 HydrophobicContact CG1-CD2 3.42Å; V97-Y136 VanDerWaalsContact CG1-CD2 3.42Å; V97-Y136 HydrophobicContact CG1-CE2 3.19Å; V97-Y136 HydrophobicContact CG1-CG 4.47Å; F101-Y136 HydrophobicContact CB-CD2 3.98Å; F101-Y136 HydrophobicContact CB-CE2 4.22Å; L132-Y136 PolarHBondContact O-N 3.43Å; L133-Y136 WeakPolarHBondContact O-CB 3.38Å; L133-Y136 PolarHBondContact O-N 3.48Å; L134-Y136 VanDerWaalsContact C-N 3.33Å; L134-Y136 PolarHBondContact O-N 3.45Å; Y136-A139 PolarHBondContact O-N 3.47Å; Y136-R140 WeakPolarHBondContact O-CB 3.34Å; Y136-R140 PolarHBondContact O-N 3.48Å
137	G	95	Very high	92.9	Very high	25 Å²	25	64.1 Å²	64.1	26%	0.258	35%	0.352	S	S	.	.	H	α-helix	trans	-59.9	-49.7	176.2	0	0	0	0	0	112.4	L133 L134 G135 A139 R140 I141	L133-G137 PolarHBondContact O-N 2.81Å; L133-G137 VanDerWaalsContact O-N 3.09Å; L134-G137 WeakPolarHBondContact O-CA 3.42Å; L134-G137 PolarHBondContact O-N 2.81Å; L134-G137 VanDerWaalsContact O-N 3.12Å; G135-G137 VanDerWaalsContact C-N 3.34Å; G135-G137 PolarHBondContact O-N 3.42Å; G137-A139 PolarHBondContact O-N 2.86Å; G137-R140 PolarHBondContact O-N 3.32Å; G137-I141 VanDerWaalsContact O-CG1 3.25Å; G137-I141 WeakPolarHBondContact O-CG1 3.44Å; G137-I141 PolarHBondContact O-N 2.86Å
138	I	96.4	Very high	93.8	Very high	107 Å²	107	65.3 Å²	65.3	55%	0.549	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-43.6	178.8	-67.9	166.7	0	0	0	111.2	L134 G135 I141 S142	L134-I138 WeakPolarHBondContact O-CG1 3.34Å; L134-I138 PolarHBondContact O-N 3.46Å; G135-I138 PolarHBondContact O-N 3.12Å; I138-I141 PolarHBondContact O-N 3.09Å; I138-S142 VanDerWaalsContact O-CB 3.23Å; I138-S142 WeakPolarHBondContact O-CB 3.28Å; I138-S142 PolarHBondContact O-N 3.45Å; I138-S142 PolarHBondContact O-OG 2.84Å
139	A	96.3	Very high	94.5	Very high	10 Å²	10	63.9 Å²	63.9	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-44.2	178.7	0	0	0	0	0	111.2	I93 V97 L100 G135 Y136 G137 S142 S143	I93-A139 HydrophobicContact CG2-CB 4.17Å; I93-A139 WeakPolarHBondContact CG2-O 3.07Å; V97-A139 HydrophobicContact CG2-CB 3.83Å; L100-A139 HydrophobicContact CD1-CB 3.66Å; G135-A139 VanDerWaalsContact O-CB 3.28Å; G135-A139 WeakPolarHBondContact O-CB 3.31Å; G135-A139 PolarHBondContact O-N 3.39Å; Y136-A139 PolarHBondContact O-N 3.47Å; G137-A139 PolarHBondContact O-N 2.86Å; A139-S142 PolarHBondContact O-N 3.31Å; A139-S143 WeakPolarHBondContact O-CB 3.32Å; A139-S143 PolarHBondContact O-N 3.46Å
140	R	96.1	Very high	95.1	Very high	166 Å²	166	64.2 Å²	64.2	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-46.1	176.3	-170	-177.8	-178.7	-164.8	1.9	111.8	V97 Y136 G137 S143 S144	V97-R140 HydrophobicContact CG1-CB 4.46Å; V97-R140 HydrophobicContact CG2-CB 4.26Å; Y136-R140 WeakPolarHBondContact O-CB 3.34Å; Y136-R140 PolarHBondContact O-N 3.48Å; G137-R140 PolarHBondContact O-N 3.32Å; R140-S143 PolarHBondContact O-N 2.9Å; R140-S144 PolarHBondContact O-N 2.92Å; R140-S144 VanDerWaalsContact O-N 3.14Å
141	I	98	Very high	95.6	Very high	118 Å²	118	63 Å²	63	61%	0.605	34%	0.34	S	S	*	.	H	α-helix	trans	-61.4	-45.2	176.1	-68.2	165.4	0	0	0	110.4	G137 I138 S144 L145	G137-I141 VanDerWaalsContact O-CG1 3.25Å; G137-I141 WeakPolarHBondContact O-CG1 3.44Å; G137-I141 PolarHBondContact O-N 2.86Å; I138-I141 PolarHBondContact O-N 3.09Å; I141-S144 PolarHBondContact O-N 2.9Å; I141-L145 WeakPolarHBondContact O-CB 3.25Å; I141-L145 PolarHBondContact O-N 3.48Å
142	S	97.5	Very high	95.9	Very high	33 Å²	33	63.3 Å²	63.3	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-43.9	-179.2	-61	0	0	0	0	112	I138 A139 S144 L145 F146	I138-S142 VanDerWaalsContact O-CB 3.23Å; I138-S142 WeakPolarHBondContact O-CB 3.28Å; I138-S142 PolarHBondContact O-N 3.45Å; I138-S142 PolarHBondContact O-OG 2.84Å; A139-S142 PolarHBondContact O-N 3.31Å; S142-S144 VanDerWaalsContact C-N 3.29Å; S142-S144 PolarHBondContact O-N 3.34Å; S142-L145 PolarHBondContact O-N 3.49Å; S142-F146 WeakPolarHBondContact O-CD2 3.35Å; S142-F146 PolarHBondContact O-N 2.99Å
143	S	96.9	Very high	96.1	Very high	21 Å²	21	62.8 Å²	62.8	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-58.2	-43.6	175.4	178	0	0	0	0	111.3	S90 G94 A139 R140 N147	S90-S143 WeakPolarHBondContact CB-O 3.22Å; S90-S143 PolarHBondContact O-OG 3.32Å; S90-S143 PolarHBondContact OG-O 3.39Å; G94-S143 WeakPolarHBondContact CA-OG 3.35Å; G94-S143 PolarHBondContact N-OG 3.43Å; A139-S143 WeakPolarHBondContact O-CB 3.32Å; A139-S143 PolarHBondContact O-N 3.46Å; R140-S143 PolarHBondContact O-N 2.9Å; S143-N147 WeakPolarHBondContact O-CB 3.44Å; S143-N147 PolarHBondContact O-N 3.43Å
144	S	96.3	Very high	96.2	Very high	67 Å²	67	59.6 Å²	59.6	47%	0.469	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-43.4	175.2	-179.2	0	0	0	0	112.3	R140 I141 S142 F146 N147 E148	R140-S144 PolarHBondContact O-N 2.92Å; R140-S144 VanDerWaalsContact O-N 3.14Å; I141-S144 PolarHBondContact O-N 2.9Å; S142-S144 VanDerWaalsContact C-N 3.29Å; S142-S144 PolarHBondContact O-N 3.34Å; S144-F146 PolarHBondContact O-N 2.85Å; S144-N147 WeakPolarHBondContact O-CA 3.27Å; S144-N147 VanDerWaalsContact O-CB 3.3Å; S144-N147 WeakPolarHBondContact O-CB 3.35Å; S144-N147 PolarHBondContact O-N 3.05Å; S144-N147 VanDerWaalsContact O-N 3.1Å; S144-E148 PolarHBondContact O-N 3.24Å
145	L	98.1	Very high	96.3	Very high	95 Å²	95	56.3 Å²	56.3	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-57.8	-48.8	176.6	176.7	63.8	0	0	0	111.6	I141 S142 N147 E148 L149	I141-L145 WeakPolarHBondContact O-CB 3.25Å; I141-L145 PolarHBondContact O-N 3.48Å; S142-L145 PolarHBondContact O-N 3.49Å; L145-N147 VanDerWaalsContact C-N 3.27Å; L145-N147 PolarHBondContact O-N 3.39Å; L145-E148 PolarHBondContact O-N 3.37Å; L145-L149 HydrophobicContact CD1-CD1 4.25Å; L145-L149 HydrophobicContact CD1-CG 4.25Å; L145-L149 HydrophobicContact CG-CD1 4.05Å; L145-L149 HydrophobicContact CG-CG 4.44Å; L145-L149 WeakPolarHBondContact O-CB 3.49Å; L145-L149 VanDerWaalsContact O-CG 3.32Å; L145-L149 WeakPolarHBondContact O-CG 3.28Å; L145-L149 PolarHBondContact O-N 3.46Å
146	F	98	Very high	96.3	Very high	56 Å²	56	61.5 Å²	61.5	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-33.5	176.6	-76.9	-64.7	0	0	0	112.3	F86 A89 I93 S142 S144 L149 R150	F86-F146 AromaticContact CD1-CD1 3.4Å; F86-F146 HydrophobicContact CD1-CD1 3.4Å; F86-F146 AromaticContact CD1-CE1 3.77Å; F86-F146 HydrophobicContact CD1-CE1 3.77Å; F86-F146 AromaticContact CE1-CD1 3.82Å; F86-F146 HydrophobicContact CE1-CD1 3.82Å; F86-F146 AromaticContact CE1-CE1 3.8Å; F86-F146 HydrophobicContact CE1-CE1 3.8Å; F86-F146 HydrophobicContact CG-CD1 4.24Å; A89-F146 HydrophobicContact CB-CD1 4.3Å; A89-F146 HydrophobicContact CB-CD2 4.43Å; A89-F146 HydrophobicContact CB-CG 4.23Å; I93-F146 HydrophobicContact CD1-CD2 3.51Å; I93-F146 HydrophobicContact CD1-CE2 3.49Å; I93-F146 VanDerWaalsContact CD1-CE2 3.49Å; S142-F146 WeakPolarHBondContact O-CD2 3.35Å; S142-F146 PolarHBondContact O-N 2.99Å; S144-F146 PolarHBondContact O-N 2.85Å; F146-L149 HydrophobicContact CD1-CD1 4.44Å; F146-R150 WeakPolarHBondContact O-CB 3.36Å; F146-R150 PolarHBondContact O-N 3.44Å
147	N	96	Very high	96.3	Very high	42 Å²	42	58.1 Å²	58.1	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-43.8	173.7	-173	62.6	0	0	0	111.9	S143 S144 L145 R150 S151	S143-N147 WeakPolarHBondContact O-CB 3.44Å; S143-N147 PolarHBondContact O-N 3.43Å; S144-N147 WeakPolarHBondContact O-CA 3.27Å; S144-N147 VanDerWaalsContact O-CB 3.3Å; S144-N147 WeakPolarHBondContact O-CB 3.35Å; S144-N147 PolarHBondContact O-N 3.05Å; S144-N147 VanDerWaalsContact O-N 3.1Å; L145-N147 VanDerWaalsContact C-N 3.27Å; L145-N147 PolarHBondContact O-N 3.39Å; N147-R150 WeakPolarHBondContact O-CB 3.41Å; N147-R150 PolarHBondContact OD1-NE 3.33Å; N147-R150 PolarHBondContact OD1-NH2 3.04Å; N147-S151 PolarHBondContact O-N 3.39Å; N147-S151 PolarHBondContact O-OG 2.87Å; N147-S151 VanDerWaalsContact O-OG 3.11Å
148	E	96.9	Very high	96.3	Very high	105 Å²	105	57.2 Å²	57.2	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-73.1	-38.3	178.7	-64.4	-44.9	124.1	0	0	112.7	S144 L145 R150 S151 A152	S144-E148 PolarHBondContact O-N 3.24Å; L145-E148 PolarHBondContact O-N 3.37Å; E148-R150 VanDerWaalsContact C-N 3.32Å; E148-R150 PolarHBondContact O-N 2.75Å; E148-S151 WeakPolarHBondContact O-CB 3.23Å; E148-S151 PolarHBondContact O-N 3.07Å; E148-S151 VanDerWaalsContact O-N 3.12Å; E148-A152 PolarHBondContact O-N 2.66Å
149	L	97.5	Very high	96.2	Very high	65 Å²	65	57.9 Å²	57.9	34%	0.34	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-41.5	173.9	-73	175	0	0	0	111.7	F86 L145 F146 S151 A152 V153	F86-L149 HydrophobicContact CD2-CB 3.85Å; F86-L149 HydrophobicContact CE1-CD1 4.43Å; F86-L149 HydrophobicContact CE2-CB 3.82Å; F86-L149 HydrophobicContact CG-CB 4.34Å; F86-L149 HydrophobicContact CZ-CB 4.28Å; F86-L149 HydrophobicContact CZ-CD1 4.23Å; L145-L149 HydrophobicContact CD1-CD1 4.25Å; L145-L149 HydrophobicContact CD1-CG 4.25Å; L145-L149 HydrophobicContact CG-CD1 4.05Å; L145-L149 HydrophobicContact CG-CG 4.44Å; L145-L149 WeakPolarHBondContact O-CB 3.49Å; L145-L149 VanDerWaalsContact O-CG 3.32Å; L145-L149 WeakPolarHBondContact O-CG 3.28Å; L145-L149 PolarHBondContact O-N 3.46Å; F146-L149 HydrophobicContact CD1-CD1 4.44Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 2.94Å; L149-A152 PolarHBondContact O-N 3.42Å; L149-V153 WeakPolarHBondContact O-CB 3.21Å; L149-V153 WeakPolarHBondContact O-CG2 3.13Å; L149-V153 PolarHBondContact O-N 2.98Å
150	R	97.3	Very high	96.1	Very high	8 Å²	8	58.9 Å²	58.9	3%	0.03	31%	0.312	C	S	.	.	H	α-helix	trans	-55.7	-48.9	171.1	173.2	-173.9	69	76.3	7.3	111	A83 F86 L87 F146 N147 E148 V153 F154 V208	A83-R150 HydrophobicContact CB-CG 4.45Å; A83-R150 WeakPolarHBondContact O-CG 3.46Å; F86-R150 HydrophobicContact CB-CB 3.77Å; L87-R150 VanDerWaalsContact CB-CD 3.45Å; L87-R150 HydrophobicContact CB-CG 4.45Å; F146-R150 WeakPolarHBondContact O-CB 3.36Å; F146-R150 PolarHBondContact O-N 3.44Å; N147-R150 WeakPolarHBondContact O-CB 3.41Å; N147-R150 PolarHBondContact OD1-NE 3.33Å; N147-R150 PolarHBondContact OD1-NH2 3.04Å; E148-R150 VanDerWaalsContact C-N 3.32Å; E148-R150 PolarHBondContact O-N 2.75Å; R150-V153 PolarHBondContact O-N 3.23Å; R150-F154 VanDerWaalsContact O-CB 3.27Å; R150-F154 WeakPolarHBondContact O-CB 3.45Å; R150-F154 PolarHBondContact O-N 3.01Å; R150-V208 PolarHBondContact NH1-O 2.86Å
151	S	95.6	Very high	96	Very high	28 Å²	28	51 Å²	51	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-47.3	177.9	-58.6	0	0	0	0	112.3	N147 E148 L149 F154 A155 F209	N147-S151 PolarHBondContact O-N 3.39Å; N147-S151 PolarHBondContact O-OG 2.87Å; N147-S151 VanDerWaalsContact O-OG 3.11Å; E148-S151 WeakPolarHBondContact O-CB 3.23Å; E148-S151 PolarHBondContact O-N 3.07Å; E148-S151 VanDerWaalsContact O-N 3.12Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 2.94Å; S151-F154 PolarHBondContact O-N 3.47Å; S151-A155 WeakPolarHBondContact O-CB 3.39Å; S151-A155 PolarHBondContact O-N 3.47Å; S151-F209 WeakPolarHBondContact OG-CE1 3.31Å
152	A	95.7	Very high	95.8	Very high	60 Å²	60	46.6 Å²	46.6	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-64.5	-42.6	179.7	0	0	0	0	0	113.1	E148 L149	E148-A152 PolarHBondContact O-N 2.66Å; L149-A152 PolarHBondContact O-N 3.42Å
153	V	96.1	Very high	95.7	Very high	28 Å²	28	52.7 Å²	52.7	17%	0.17	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-43.8	178.7	173.6	0	0	0	0	110.9	R79 V82 A83 F86 L149 R150	R79-V153 HydrophobicContact CB-CG1 3.88Å; R79-V153 HydrophobicContact CG-CG1 4.23Å; R79-V153 VanDerWaalsContact O-CG1 3.29Å; R79-V153 WeakPolarHBondContact O-CG1 3.27Å; V82-V153 HydrophobicContact CB-CG1 4.48Å; V82-V153 HydrophobicContact CG1-CG1 4.29Å; V82-V153 HydrophobicContact CG1-CG2 4.44Å; A83-V153 HydrophobicContact CB-CB 4.5Å; A83-V153 HydrophobicContact CB-CG1 4.19Å; F86-V153 HydrophobicContact CD2-CG2 4.37Å; F86-V153 HydrophobicContact CE2-CG2 3.97Å; L149-V153 WeakPolarHBondContact O-CB 3.21Å; L149-V153 WeakPolarHBondContact O-CG2 3.13Å; L149-V153 PolarHBondContact O-N 2.98Å; R150-V153 PolarHBondContact O-N 3.23Å
154	F	96.1	Very high	95.6	Very high	6 Å²	6	54 Å²	54	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-70.1	-35.2	-178.2	-174.1	-103.1	0	0	0	112.8	A83 R150 S151 K156 V157 A158 L204 V208 F209	A83-F154 HydrophobicContact CB-CB 4.16Å; R150-F154 VanDerWaalsContact O-CB 3.27Å; R150-F154 WeakPolarHBondContact O-CB 3.45Å; R150-F154 PolarHBondContact O-N 3.01Å; S151-F154 PolarHBondContact O-N 3.47Å; F154-K156 PolarHBondContact O-N 3.44Å; F154-K156 VanDerWaalsContact O-N 3.15Å; F154-V157 HydrophobicContact CD2-CB 4.35Å; F154-V157 HydrophobicContact CE2-CG1 4.49Å; F154-V157 WeakPolarHBondContact O-CA 3.38Å; F154-V157 WeakPolarHBondContact O-CB 3.44Å; F154-V157 PolarHBondContact O-N 2.92Å; F154-A158 HydrophobicContact CD1-CB 4.32Å; F154-A158 HydrophobicContact CE1-CB 3.94Å; F154-A158 HydrophobicContact CZ-CB 4.43Å; F154-A158 PolarHBondContact O-N 3Å; F154-L204 HydrophobicContact CZ-CB 4.29Å; F154-V208 HydrophobicContact CB-CG1 4.35Å; F154-V208 HydrophobicContact CD1-CB 4.1Å; F154-V208 HydrophobicContact CD1-CG1 3.79Å; F154-V208 HydrophobicContact CD1-CG2 4.39Å; F154-V208 HydrophobicContact CD2-CG1 4Å; F154-V208 HydrophobicContact CD2-CG2 4.13Å; F154-V208 HydrophobicContact CE1-CB 3.84Å; F154-V208 HydrophobicContact CE1-CG1 4.06Å; F154-V208 HydrophobicContact CE1-CG2 3.84Å; F154-V208 HydrophobicContact CE2-CB 4.3Å; F154-V208 HydrophobicContact CE2-CG1 4.28Å; F154-V208 HydrophobicContact CE2-CG2 3.58Å; F154-V208 HydrophobicContact CG-CB 4.43Å; F154-V208 HydrophobicContact CG-CG1 3.76Å; F154-V208 HydrophobicContact CZ-CB 3.96Å; F154-V208 HydrophobicContact CZ-CG1 4.3Å; F154-V208 HydrophobicContact CZ-CG2 3.4Å; F154-V208 VanDerWaalsContact CZ-CG2 3.4Å; F154-F209 HydrophobicContact CB-CZ 4.39Å; F154-F209 AromaticContact CD1-CE2 3.9Å; F154-F209 HydrophobicContact CD1-CE2 3.9Å; F154-F209 AromaticContact CD1-CZ 3.7Å; F154-F209 HydrophobicContact CD1-CZ 3.7Å; F154-F209 HydrophobicContact CE1-CE2 4.32Å; F154-F209 HydrophobicContact CG-CZ 4.46Å
155	A	94.2	Very high	95.5	Very high	47 Å²	47	50.9 Å²	50.9	39%	0.388	26%	0.259	S	S	.	.	H	α-helix	trans	-52.5	-40.1	178.3	0	0	0	0	0	112.5	S151 V157 A158 Q159	S151-A155 WeakPolarHBondContact O-CB 3.39Å; S151-A155 PolarHBondContact O-N 3.47Å; A155-V157 VanDerWaalsContact C-N 3.34Å; A155-V157 PolarHBondContact O-N 3.42Å; A155-A158 PolarHBondContact O-N 3.18Å; A155-Q159 WeakPolarHBondContact O-CB 3.15Å; A155-Q159 WeakPolarHBondContact O-CG 3.21Å; A155-Q159 PolarHBondContact O-N 3.48Å
156	K	93.7	Very high	95.3	Very high	132 Å²	132	47.9 Å²	47.9	57%	0.574	25%	0.248	S	C	*	.	H	α-helix	trans	-65.5	-35	176.1	-71.3	178.2	176	176.5	0	112.9	F154 N160	F154-K156 PolarHBondContact O-N 3.44Å; F154-K156 VanDerWaalsContact O-N 3.15Å; K156-N160 WeakPolarHBondContact O-CB 3.43Å; K156-N160 PolarHBondContact O-N 2.88Å
157	V	94.7	Very high	95.2	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-70.3	-47.5	175.9	-178.8	0	0	0	0	110.4	V68 L76 R79 V80 F154 A155 Q159 N160 S161	V68-V157 HydrophobicContact CG1-CG1 4.08Å; L76-V157 HydrophobicContact CD2-CB 4.29Å; L76-V157 HydrophobicContact CD2-CG1 4.3Å; L76-V157 HydrophobicContact CD2-CG2 4.1Å; R79-V157 HydrophobicContact CB-CG2 3.52Å; V80-V157 HydrophobicContact CG2-CB 4.45Å; V80-V157 HydrophobicContact CG2-CG1 3.66Å; V80-V157 HydrophobicContact CG2-CG2 4.1Å; F154-V157 HydrophobicContact CD2-CB 4.35Å; F154-V157 HydrophobicContact CE2-CG1 4.49Å; F154-V157 WeakPolarHBondContact O-CA 3.38Å; F154-V157 WeakPolarHBondContact O-CB 3.44Å; F154-V157 PolarHBondContact O-N 2.92Å; A155-V157 VanDerWaalsContact C-N 3.34Å; A155-V157 PolarHBondContact O-N 3.42Å; V157-Q159 PolarHBondContact O-N 2.88Å; V157-N160 PolarHBondContact O-N 2.88Å; V157-S161 PolarHBondContact O-N 2.71Å; V157-S161 PolarHBondContact O-OG 3.3Å
158	A	94.2	Very high	95.1	Very high	7 Å²	7	52.1 Å²	52.1	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-50.4	179	0	0	0	0	0	111.3	F154 A155 N160 S161 I162	F154-A158 HydrophobicContact CD1-CB 4.32Å; F154-A158 HydrophobicContact CE1-CB 3.94Å; F154-A158 HydrophobicContact CZ-CB 4.43Å; F154-A158 PolarHBondContact O-N 3Å; A155-A158 PolarHBondContact O-N 3.18Å; A158-N160 VanDerWaalsContact C-N 3.34Å; A158-N160 PolarHBondContact O-N 3.42Å; A158-S161 WeakPolarHBondContact O-CB 3.4Å; A158-S161 PolarHBondContact O-N 2.87Å; A158-S161 VanDerWaalsContact O-N 3.15Å; A158-I162 WeakPolarHBondContact O-CG1 3.49Å; A158-I162 PolarHBondContact O-N 3.38Å
159	Q	94.8	Very high	95	Very high	120 Å²	120	47.1 Å²	47.1	56%	0.561	24%	0.241	S	C	*	.	H	α-helix	trans	-64.5	-35.4	179.4	-68.2	-59.5	-25.3	0	0	113.1	A155 V157 R163	A155-Q159 WeakPolarHBondContact O-CB 3.15Å; A155-Q159 WeakPolarHBondContact O-CG 3.21Å; A155-Q159 PolarHBondContact O-N 3.48Å; V157-Q159 PolarHBondContact O-N 2.88Å; Q159-R163 WeakPolarHBondContact O-CB 3.33Å; Q159-R163 PolarHBondContact O-N 3.41Å
160	N	94.1	Very high	94.7	Very high	31 Å²	31	49.7 Å²	49.7	17%	0.166	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-42.1	173.8	-161.2	-96	0	0	0	112	K73 L76 K156 V157 A158 R163 E164	K73-N160 PolarHBondContact NZ-OD1 3.27Å; L76-N160 HydrophobicContact CD1-CB 4.23Å; L76-N160 WeakPolarHBondContact CD1-OD1 3.22Å; L76-N160 HydrophobicContact CD2-CB 3.86Å; K156-N160 WeakPolarHBondContact O-CB 3.43Å; K156-N160 PolarHBondContact O-N 2.88Å; V157-N160 PolarHBondContact O-N 2.88Å; A158-N160 VanDerWaalsContact C-N 3.34Å; A158-N160 PolarHBondContact O-N 3.42Å; N160-R163 PolarHBondContact O-N 3.5Å; N160-E164 WeakPolarHBondContact O-CB 3.48Å; N160-E164 PolarHBondContact O-N 2.83Å
161	S	94.7	Very high	94.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-47.4	179.5	-52.9	0	0	0	0	110.6	Y67 V157 A158 R163 E164 I165	Y67-S161 PolarHBondContact O-OG 3.49Å; V157-S161 PolarHBondContact O-N 2.71Å; V157-S161 PolarHBondContact O-OG 3.3Å; A158-S161 WeakPolarHBondContact O-CB 3.4Å; A158-S161 PolarHBondContact O-N 2.87Å; A158-S161 VanDerWaalsContact O-N 3.15Å; S161-R163 PolarHBondContact O-N 2.84Å; S161-E164 PolarHBondContact O-N 3.45Å; S161-I165 WeakPolarHBondContact O-CG1 3.36Å; S161-I165 PolarHBondContact O-N 2.73Å
162	I	94.3	Very high	94.5	Very high	26 Å²	26	53.1 Å²	53.1	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-58.3	-49.3	176.7	-66.2	162	0	0	0	110.7	A158 E164 I165 A166 L200	A158-I162 WeakPolarHBondContact O-CG1 3.49Å; A158-I162 PolarHBondContact O-N 3.38Å; I162-E164 PolarHBondContact O-N 2.93Å; I162-I165 PolarHBondContact O-N 3.05Å; I162-A166 WeakPolarHBondContact O-CB 3.22Å; I162-A166 PolarHBondContact O-N 2.91Å; I162-L200 HydrophobicContact CB-CD2 4.43Å; I162-L200 HydrophobicContact CG1-CD2 3.78Å
163	R	95.1	Very high	94.2	Very high	161 Å²	161	51.3 Å²	51.3	61%	0.608	25%	0.247	S	C	*	.	H	α-helix	trans	-60.5	-44.9	-179.9	-172.7	-177.8	74.3	171.4	7.6	112.6	Q159 N160 S161 R167	Q159-R163 WeakPolarHBondContact O-CB 3.33Å; Q159-R163 PolarHBondContact O-N 3.41Å; N160-R163 PolarHBondContact O-N 3.5Å; S161-R163 PolarHBondContact O-N 2.84Å; R163-R167 WeakPolarHBondContact O-CB 3.41Å; R163-R167 PolarHBondContact O-N 3.31Å
164	E	93.9	Very high	93.8	Very high	49 Å²	49	55.9 Å²	55.9	23%	0.229	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-41.7	-177.7	-163.7	69.9	-129.2	0	0	111.7	Y67 K73 N160 S161 I162 R167 T168	Y67-E164 HydrophobicContact CD1-CB 4.33Å; Y67-E164 HydrophobicContact CD1-CG 4.27Å; Y67-E164 HydrophobicContact CE1-CG 4.32Å; K73-E164 IonicContact NZ-OE2 3.91Å; K73-E164 PolarHBondContact NZ-OE2 3.44Å; N160-E164 WeakPolarHBondContact O-CB 3.48Å; N160-E164 PolarHBondContact O-N 2.83Å; S161-E164 PolarHBondContact O-N 3.45Å; I162-E164 PolarHBondContact O-N 2.93Å; E164-R167 PolarHBondContact O-N 2.95Å; E164-R167 IonicContact OE1-NH1 2.9Å; E164-T168 WeakPolarHBondContact O-CB 3.42Å; E164-T168 PolarHBondContact O-N 3.31Å; E164-T168 PolarHBondContact O-OG1 3.21Å
165	I	94.2	Very high	93.5	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-49	176	-67.1	-176.4	0	0	0	110.6	Y67 S161 I162 R167 T168 V169 L200 M384 F385	Y67-I165 HydrophobicContact CD1-CD1 4.12Å; Y67-I165 HydrophobicContact CD1-CG1 3.37Å; Y67-I165 HydrophobicContact CD2-CD1 3.25Å; Y67-I165 HydrophobicContact CD2-CG1 3.36Å; Y67-I165 HydrophobicContact CE1-CG1 3.56Å; Y67-I165 HydrophobicContact CE2-CD1 3.78Å; Y67-I165 HydrophobicContact CE2-CG1 3.57Å; Y67-I165 HydrophobicContact CG-CD1 3.45Å; Y67-I165 VanDerWaalsContact CG-CD1 3.45Å; Y67-I165 HydrophobicContact CG-CG1 3.26Å; S161-I165 WeakPolarHBondContact O-CG1 3.36Å; S161-I165 PolarHBondContact O-N 2.73Å; I162-I165 PolarHBondContact O-N 3.05Å; I165-R167 VanDerWaalsContact C-N 3.28Å; I165-R167 PolarHBondContact O-N 3.34Å; I165-T168 PolarHBondContact O-N 3.01Å; I165-V169 HydrophobicContact CG2-CG2 4.12Å; I165-V169 WeakPolarHBondContact O-CG2 3.34Å; I165-V169 PolarHBondContact O-N 3.21Å; I165-L200 HydrophobicContact CD1-CD1 3.58Å; I165-L200 HydrophobicContact CD1-CD2 3.53Å; I165-L200 HydrophobicContact CD1-CG 4.18Å; I165-L200 HydrophobicContact CG1-CD2 4.45Å; I165-M384 HydrophobicContact CG2-CE 3.56Å; I165-M384 HydrophobicContact CG2-SD 3.8Å; I165-F385 HydrophobicContact CD1-CE1 4.38Å; I165-F385 HydrophobicContact CD1-CZ 4.08Å; I165-F385 HydrophobicContact CG2-CE1 4.48Å
166	A	94.3	Very high	93.2	Very high	32 Å²	32	61.4 Å²	61.4	26%	0.264	28%	0.282	S	S	.	.	H	α-helix	trans	-55.4	-46.1	179.1	0	0	0	0	0	111.4	I162 F170 T197	I162-A166 WeakPolarHBondContact O-CB 3.22Å; I162-A166 PolarHBondContact O-N 2.91Å; A166-F170 VanDerWaalsContact O-CB 3.26Å; A166-F170 WeakPolarHBondContact O-CB 3.28Å; A166-F170 PolarHBondContact O-N 2.94Å; A166-T197 HydrophobicContact CB-CG2 3.88Å
167	R	95.1	Very high	92.7	Very high	145 Å²	145	56 Å²	56	55%	0.547	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.8	-179.1	177.1	174	-89	-4.3	112.4	R163 E164 I165 F170 L171	R163-R167 WeakPolarHBondContact O-CB 3.41Å; R163-R167 PolarHBondContact O-N 3.31Å; E164-R167 PolarHBondContact O-N 2.95Å; E164-R167 IonicContact OE1-NH1 2.9Å; I165-R167 VanDerWaalsContact C-N 3.28Å; I165-R167 PolarHBondContact O-N 3.34Å; R167-F170 PolarHBondContact O-N 2.88Å; R167-L171 HydrophobicContact CG-CD1 4.1Å; R167-L171 HydrophobicContact CG-CG 4.48Å; R167-L171 WeakPolarHBondContact O-CB 3.42Å; R167-L171 WeakPolarHBondContact O-CG 3.27Å; R167-L171 PolarHBondContact O-N 3.29Å
168	T	94.8	Very high	92	Very high	42 Å²	42	60.3 Å²	60.3	26%	0.258	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-45.5	-179.4	-59.1	0	0	0	0	111	E164 I165 L171 H172 L388	E164-T168 WeakPolarHBondContact O-CB 3.42Å; E164-T168 PolarHBondContact O-N 3.31Å; E164-T168 PolarHBondContact O-OG1 3.21Å; I165-T168 PolarHBondContact O-N 3.01Å; T168-L171 PolarHBondContact O-N 3.14Å; T168-H172 VanDerWaalsContact O-CB 3.28Å; T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.43Å; T168-L388 HydrophobicContact CG2-CD2 4.42Å
169	V	93.8	Very high	91.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-42.6	176.2	-179.1	0	0	0	0	110.9	I165 L171 H172 L173 V193 M384 L387 L388	I165-V169 HydrophobicContact CG2-CG2 4.12Å; I165-V169 WeakPolarHBondContact O-CG2 3.34Å; I165-V169 PolarHBondContact O-N 3.21Å; V169-L171 PolarHBondContact O-N 3.05Å; V169-H172 PolarHBondContact O-N 3.06Å; V169-L173 HydrophobicContact CG1-CD1 4.14Å; V169-L173 HydrophobicContact CG1-CG 4.32Å; V169-L173 WeakPolarHBondContact O-CG 3.21Å; V169-L173 PolarHBondContact O-N 3.48Å; V169-V193 HydrophobicContact CG1-CG1 4.32Å; V169-V193 HydrophobicContact CG1-CG2 3.59Å; V169-M384 HydrophobicContact CG2-CG 3.97Å; V169-M384 HydrophobicContact CG2-SD 4.27Å; V169-L387 HydrophobicContact CG1-CD1 4.47Å; V169-L388 HydrophobicContact CB-CD2 4.2Å; V169-L388 HydrophobicContact CG2-CD1 3.97Å; V169-L388 HydrophobicContact CG2-CD2 3.75Å; V169-L388 HydrophobicContact CG2-CG 3.88Å
170	F	92.7	Very high	90.3	Very high	119 Å²	119	57.9 Å²	57.9	52%	0.522	27%	0.27	S	S	.	.	H	α-helix	trans	-57.8	-50.2	175.5	178.3	-97.8	0	0	0	112.3	A166 R167 H172 L173 H174	A166-F170 VanDerWaalsContact O-CB 3.26Å; A166-F170 WeakPolarHBondContact O-CB 3.28Å; A166-F170 PolarHBondContact O-N 2.94Å; R167-F170 PolarHBondContact O-N 2.88Å; F170-H172 VanDerWaalsContact C-N 3.29Å; F170-H172 PolarHBondContact O-N 3.24Å; F170-L173 PolarHBondContact O-N 3.27Å; F170-H174 AromaticContact CD1-CD2 3.92Å; F170-H174 AromaticContact CE1-CD2 3.5Å; F170-H174 AromaticContact CE1-NE2 3.63Å; F170-H174 AromaticContact CE2-CD2 3.76Å; F170-H174 AromaticContact CE2-NE2 3.41Å; F170-H174 WeakPolarHBondContact CE2-NE2 3.42Å; F170-H174 AromaticContact CZ-CD2 3.42Å; F170-H174 VanDerWaalsContact CZ-CD2 3.42Å; F170-H174 WeakPolarHBondContact CZ-CD2 3.49Å; F170-H174 AromaticContact CZ-NE2 3.05Å; F170-H174 WeakPolarHBondContact CZ-NE2 3.17Å; F170-H174 PolarHBondContact O-CD2 3.46Å; F170-H174 PolarHBondContact O-N 3.24Å; F170-H174 VanDerWaalsContact O-N 3.09Å
171	L	94.2	Very high	89.6	Confident	72 Å²	72	59.4 Å²	59.4	38%	0.377	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-34.5	177.7	-72.1	173.7	0	0	0	112.5	R167 T168 V169 H174 K175	R167-L171 HydrophobicContact CG-CD1 4.1Å; R167-L171 HydrophobicContact CG-CG 4.48Å; R167-L171 WeakPolarHBondContact O-CB 3.42Å; R167-L171 WeakPolarHBondContact O-CG 3.27Å; R167-L171 PolarHBondContact O-N 3.29Å; T168-L171 PolarHBondContact O-N 3.14Å; V169-L171 PolarHBondContact O-N 3.05Å; L171-H174 PolarHBondContact O-N 2.99Å; L171-K175 WeakPolarHBondContact O-CG 3.47Å; L171-K175 PolarHBondContact O-N 3.39Å
172	H	92.8	Very high	88.6	Confident	37 Å²	37	64.2 Å²	64.2	17%	0.171	30%	0.301	C	S	.	.	H	α-helix	trans	-68	-43.8	176.5	-176.9	80.2	0	0	0	111.6	T168 V169 F170 H174 K175 M176 L387 L388 L390	T168-H172 VanDerWaalsContact O-CB 3.28Å; T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.43Å; V169-H172 PolarHBondContact O-N 3.06Å; F170-H172 VanDerWaalsContact C-N 3.29Å; F170-H172 PolarHBondContact O-N 3.24Å; H172-H174 VanDerWaalsContact C-N 3.28Å; H172-H174 PolarHBondContact O-N 3.44Å; H172-K175 WeakPolarHBondContact O-CB 3.43Å; H172-K175 PolarHBondContact O-N 3.1Å; H172-M176 WeakPolarHBondContact NE2-CE 3.29Å; H172-L387 PolarHBondContact CD2-O 2.97Å; H172-L387 PolarHBondContact NE2-O 2.88Å; H172-L388 HydrophobicContact CB-CD2 3.66Å; H172-L390 PolarHBondContact CE1-O 2.95Å; H172-L390 PolarHBondContact NE2-O 2.79Å
173	L	89.5	Confident	87.5	Confident	22 Å²	22	65.5 Å²	65.5	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-60.2	-37.7	174.8	-72.2	174.7	0	0	0	112	V169 F170 K175 M176 Y180 H181 V193	V169-L173 HydrophobicContact CG1-CD1 4.14Å; V169-L173 HydrophobicContact CG1-CG 4.32Å; V169-L173 WeakPolarHBondContact O-CG 3.21Å; V169-L173 PolarHBondContact O-N 3.48Å; F170-L173 PolarHBondContact O-N 3.27Å; L173-K175 PolarHBondContact O-N 3.06Å; L173-M176 WeakPolarHBondContact O-CB 3.27Å; L173-M176 WeakPolarHBondContact O-CG 3.43Å; L173-M176 PolarHBondContact O-N 2.88Å; L173-Y180 HydrophobicContact CD2-CE1 4.02Å; L173-H181 PolarHBondContact O-CE1 3.37Å; L173-H181 PolarHBondContact O-NE2 3.22Å; L173-V193 HydrophobicContact CD1-CG2 3.9Å
174	H	88.7	Confident	86.2	Confident	124 Å²	124	60.2 Å²	60.2	57%	0.574	29%	0.292	S	S	*	.	H	α-helix	trans	-68.2	-19.9	175.5	-89.9	-74	0	0	0	114.7	F170 L171 H172 M176	F170-H174 AromaticContact CD1-CD2 3.92Å; F170-H174 AromaticContact CE1-CD2 3.5Å; F170-H174 AromaticContact CE1-NE2 3.63Å; F170-H174 AromaticContact CE2-CD2 3.76Å; F170-H174 AromaticContact CE2-NE2 3.41Å; F170-H174 WeakPolarHBondContact CE2-NE2 3.42Å; F170-H174 AromaticContact CZ-CD2 3.42Å; F170-H174 VanDerWaalsContact CZ-CD2 3.42Å; F170-H174 WeakPolarHBondContact CZ-CD2 3.49Å; F170-H174 AromaticContact CZ-NE2 3.05Å; F170-H174 WeakPolarHBondContact CZ-NE2 3.17Å; F170-H174 PolarHBondContact O-CD2 3.46Å; F170-H174 PolarHBondContact O-N 3.24Å; F170-H174 VanDerWaalsContact O-N 3.09Å; L171-H174 PolarHBondContact O-N 2.99Å; H172-H174 VanDerWaalsContact C-N 3.28Å; H172-H174 PolarHBondContact O-N 3.44Å; H174-M176 VanDerWaalsContact C-N 3.32Å
175	K	89.6	Confident	84.9	Confident	155 Å²	155	63.2 Å²	63.2	67%	0.674	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.5	175.4	-70.9	177.3	178.7	-168.4	0	112.7	L171 H172 L173 P392	L171-K175 WeakPolarHBondContact O-CG 3.47Å; L171-K175 PolarHBondContact O-N 3.39Å; H172-K175 WeakPolarHBondContact O-CB 3.43Å; H172-K175 PolarHBondContact O-N 3.1Å; L173-K175 PolarHBondContact O-N 3.06Å; K175-P392 VanDerWaalsContact O-CG 3.31Å; K175-P392 WeakPolarHBondContact O-CG 3.41Å
176	M	87.7	Confident	83.8	Confident	14 Å²	14	68.4 Å²	68.4	7%	0.069	34%	0.338	C	S	.	.	S	Bend	trans	-69.1	153.6	178.6	-63.6	-66.1	104.2	0	0	111	H172 L173 H174 Y180 L390 P392	H172-M176 WeakPolarHBondContact NE2-CE 3.29Å; L173-M176 WeakPolarHBondContact O-CB 3.27Å; L173-M176 WeakPolarHBondContact O-CG 3.43Å; L173-M176 PolarHBondContact O-N 2.88Å; H174-M176 VanDerWaalsContact C-N 3.32Å; M176-Y180 HydrophobicContact CB-CD1 3.54Å; M176-Y180 HydrophobicContact CB-CE1 4.25Å; M176-Y180 HydrophobicContact CB-CG 3.93Å; M176-Y180 HydrophobicContact CG-CD1 3.72Å; M176-Y180 HydrophobicContact CG-CE1 3.94Å; M176-Y180 HydrophobicContact CG-CG 4.18Å; M176-L390 HydrophobicContact SD-CB 4.26Å; M176-P392 HydrophobicContact CE-CG 3.77Å
177	D	82.9	Confident	82.7	Confident	18 Å²	18	68.9 Å²	68.9	10%	0.096	35%	0.346	C	S	.	.			trans	-73.6	163.2	179.2	62.5	-99.7	0	0	0	112.7	N179 Y180 H181 T393 I394	D177-N179 PolarHBondContact O-N 3.22Å; D177-N179 WeakPolarHBondContact OD2-CA 3.17Å; D177-N179 VanDerWaalsContact OD2-CB 3.25Å; D177-N179 WeakPolarHBondContact OD2-CB 3.26Å; D177-N179 PolarHBondContact OD2-N 2.81Å; D177-N179 VanDerWaalsContact OD2-N 3.08Å; D177-Y180 WeakPolarHBondContact O-CB 3.25Å; D177-Y180 PolarHBondContact O-N 2.93Å; D177-Y180 VanDerWaalsContact O-N 3.16Å; D177-Y180 PolarHBondContact OD2-N 3.39Å; D177-H181 PolarHBondContact O-CD2 3.23Å; D177-H181 PolarHBondContact O-N 3.44Å; D177-T393 WeakPolarHBondContact OD1-CB 3.37Å; D177-T393 PolarHBondContact OD1-N 3.2Å; D177-T393 PolarHBondContact OD1-OG1 3.13Å; D177-I394 HydrophobicContact CB-CD1 4.34Å; D177-I394 HydrophobicContact CB-CG1 4.42Å
178	L	79.8	Confident	81.9	Confident	91 Å²	91	63.8 Å²	63.8	48%	0.476	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-32.5	-177.9	-177.4	60.3	0	0	0	112.5	Y180 H181 L182 Y421	L178-Y180 VanDerWaalsContact C-N 3.34Å; L178-Y180 PolarHBondContact O-N 3.49Å; L178-H181 PolarHBondContact O-N 3.28Å; L178-L182 HydrophobicContact CD1-CD1 4.29Å; L178-L182 HydrophobicContact CD1-CD2 4.5Å; L178-L182 HydrophobicContact CD1-CG 4.06Å; L178-L182 HydrophobicContact CD2-CD1 4.32Å; L178-L182 HydrophobicContact CG-CD1 3.86Å; L178-L182 HydrophobicContact CG-CG 4.1Å; L178-L182 WeakPolarHBondContact O-CG 3.28Å; L178-L182 PolarHBondContact O-N 3.14Å; L178-Y421 HydrophobicContact CB-CE1 4.33Å; L178-Y421 HydrophobicContact CD2-CE1 4.09Å; L178-Y421 HydrophobicContact CD2-CE2 4.34Å; L178-Y421 HydrophobicContact CG-CE1 4.37Å
179	N	75.5	Confident	81.3	Confident	53 Å²	53	62.8 Å²	62.8	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-39	178.1	-178.1	51.8	0	0	0	111.3	D177 H181 L182 S183 Y421	D177-N179 PolarHBondContact O-N 3.22Å; D177-N179 WeakPolarHBondContact OD2-CA 3.17Å; D177-N179 VanDerWaalsContact OD2-CB 3.25Å; D177-N179 WeakPolarHBondContact OD2-CB 3.26Å; D177-N179 PolarHBondContact OD2-N 2.81Å; D177-N179 VanDerWaalsContact OD2-N 3.08Å; N179-H181 VanDerWaalsContact C-N 3.29Å; N179-H181 PolarHBondContact O-N 3.45Å; N179-L182 PolarHBondContact O-N 3.37Å; N179-S183 VanDerWaalsContact O-CB 3.26Å; N179-S183 WeakPolarHBondContact O-CB 3.45Å; N179-S183 PolarHBondContact O-N 2.94Å; N179-S183 PolarHBondContact O-OG 2.76Å; N179-Y421 HydrophobicContact CB-CD1 4.15Å; N179-Y421 PolarHBondContact OD1-O 3.1Å; N179-Y421 VanDerWaalsContact OD1-O 3.06Å
180	Y	78.7	Confident	80.8	Confident	23 Å²	23	65.6 Å²	65.6	9%	0.09	36%	0.355	C	S	.	.	H	α-helix	trans	-56.6	-43.3	172	-178	-96.8	0	0	0	112.1	L173 M176 D177 L178 S183 R184 L189 L390	L173-Y180 HydrophobicContact CD2-CE1 4.02Å; M176-Y180 HydrophobicContact CB-CD1 3.54Å; M176-Y180 HydrophobicContact CB-CE1 4.25Å; M176-Y180 HydrophobicContact CB-CG 3.93Å; M176-Y180 HydrophobicContact CG-CD1 3.72Å; M176-Y180 HydrophobicContact CG-CE1 3.94Å; M176-Y180 HydrophobicContact CG-CG 4.18Å; D177-Y180 WeakPolarHBondContact O-CB 3.25Å; D177-Y180 PolarHBondContact O-N 2.93Å; D177-Y180 VanDerWaalsContact O-N 3.16Å; D177-Y180 PolarHBondContact OD2-N 3.39Å; L178-Y180 VanDerWaalsContact C-N 3.34Å; L178-Y180 PolarHBondContact O-N 3.49Å; Y180-S183 PolarHBondContact O-OG 3.33Å; Y180-R184 HydrophobicContact CD2-CG 4.49Å; Y180-R184 HydrophobicContact CE2-CG 4.28Å; Y180-R184 WeakPolarHBondContact O-CB 3.34Å; Y180-R184 WeakPolarHBondContact O-CG 3.43Å; Y180-R184 PolarHBondContact O-N 3.47Å; Y180-L189 HydrophobicContact CE1-CD1 3.84Å; Y180-L189 HydrophobicContact CE1-CD2 4.42Å; Y180-L189 WeakPolarHBondContact OH-CD2 3.25Å; Y180-L390 HydrophobicContact CE2-CD1 3.65Å
181	H	79.7	Confident	80.6	Confident	63 Å²	63	66.2 Å²	66.2	29%	0.292	36%	0.357	S	S	.	.	H	α-helix	trans	-72.6	-36.8	179.1	-68.8	-58.1	0	0	0	113.7	L173 D177 L178 N179 R184	L173-H181 PolarHBondContact O-CE1 3.37Å; L173-H181 PolarHBondContact O-NE2 3.22Å; D177-H181 PolarHBondContact O-CD2 3.23Å; D177-H181 PolarHBondContact O-N 3.44Å; L178-H181 PolarHBondContact O-N 3.28Å; N179-H181 VanDerWaalsContact C-N 3.29Å; N179-H181 PolarHBondContact O-N 3.45Å; H181-R184 VanDerWaalsContact O-O 3.11Å
182	L	72.5	Confident	80.3	Confident	103 Å²	103	63.6 Å²	63.6	54%	0.539	35%	0.346	S	S	.	.	H	α-helix	trans	-74.4	-30.5	178.6	-68.6	177.2	0	0	0	112.9	L178 N179 Y421	L178-L182 HydrophobicContact CD1-CD1 4.29Å; L178-L182 HydrophobicContact CD1-CD2 4.5Å; L178-L182 HydrophobicContact CD1-CG 4.06Å; L178-L182 HydrophobicContact CD2-CD1 4.32Å; L178-L182 HydrophobicContact CG-CD1 3.86Å; L178-L182 HydrophobicContact CG-CG 4.1Å; L178-L182 WeakPolarHBondContact O-CG 3.28Å; L178-L182 PolarHBondContact O-N 3.14Å; N179-L182 PolarHBondContact O-N 3.37Å; L182-Y421 HydrophobicContact CD1-CD2 4.1Å; L182-Y421 HydrophobicContact CD1-CE2 4.49Å; L182-Y421 HydrophobicContact CD1-CG 4.23Å
183	S	71.2	Confident	80.2	Confident	52 Å²	52	63 Å²	63	36%	0.364	35%	0.345	S	S	.	.	H	α-helix	trans	-83.4	-9.8	179.3	61.9	0	0	0	0	114	N179 Y180	N179-S183 VanDerWaalsContact O-CB 3.26Å; N179-S183 WeakPolarHBondContact O-CB 3.45Å; N179-S183 PolarHBondContact O-N 2.94Å; N179-S183 PolarHBondContact O-OG 2.76Å; Y180-S183 PolarHBondContact O-OG 3.33Å
184	R	67.9	Low	80.3	Confident	50 Å²	50	65.4 Å²	65.4	19%	0.189	36%	0.358	C	S	.	.	S	Bend	trans	-118.8	139.5	-175.7	-63.7	-70.1	-175.5	168.4	-1.7	111.3	Y180 H181 T186 L189	Y180-R184 HydrophobicContact CD2-CG 4.49Å; Y180-R184 HydrophobicContact CE2-CG 4.28Å; Y180-R184 WeakPolarHBondContact O-CB 3.34Å; Y180-R184 WeakPolarHBondContact O-CG 3.43Å; Y180-R184 PolarHBondContact O-N 3.47Å; H181-R184 VanDerWaalsContact O-O 3.11Å; R184-T186 PolarHBondContact O-N 2.76Å; R184-L189 HydrophobicContact CB-CD1 4Å; R184-L189 HydrophobicContact CB-CG 4.36Å
185	Q	66.6	Low	80.5	Confident	113 Å²	113	65.9 Å²	65.9	53%	0.528	36%	0.355	S	S	.	.			trans	-69.6	114.8	169	-65.6	176.4	-9.2	0	0	109	G187 G188 L189	Q185-G187 PolarHBondContact O-N 2.82Å; Q185-G187 VanDerWaalsContact O-N 3.15Å; Q185-G188 PolarHBondContact O-N 3Å; Q185-L189 PolarHBondContact O-N 3.2Å
186	T	70.7	Confident	80.7	Confident	108 Å²	108	58.5 Å²	58.5	66%	0.663	32%	0.322	S	S	*	.	H	α-helix	trans	-52.6	-36.2	178.2	49.4	0	0	0	0	112.3	R184 G188 L189 A190	R184-T186 PolarHBondContact O-N 2.76Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.36Å; T186-L189 PolarHBondContact O-N 3.28Å; T186-A190 PolarHBondContact O-N 2.9Å
187	G	72	Confident	81	Confident	43 Å²	43	58.6 Å²	58.6	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-31.6	175.1	0	0	0	0	0	114.5	Q185 K191	Q185-G187 PolarHBondContact O-N 2.82Å; Q185-G187 VanDerWaalsContact O-N 3.15Å; G187-K191 WeakPolarHBondContact O-CG 3.42Å; G187-K191 PolarHBondContact O-N 3.31Å
188	G	78.8	Confident	81.5	Confident	37 Å²	37	63 Å²	63	38%	0.381	34%	0.339	S	S	.	.	H	α-helix	trans	-70.9	-43.7	176.2	0	0	0	0	0	112.2	Q185 T186 K191 A192	Q185-G188 PolarHBondContact O-N 3Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.36Å; G188-K191 PolarHBondContact O-N 3.47Å; G188-A192 PolarHBondContact O-N 2.91Å
189	L	82	Confident	82.2	Confident	21 Å²	21	58.6 Å²	58.6	11%	0.11	32%	0.316	C	S	.	.	H	α-helix	trans	-63.4	-46.1	176.5	-64.4	175.1	0	0	0	111.3	Y180 R184 Q185 T186 K191 A192 V193 L387	Y180-L189 HydrophobicContact CE1-CD1 3.84Å; Y180-L189 HydrophobicContact CE1-CD2 4.42Å; Y180-L189 WeakPolarHBondContact OH-CD2 3.25Å; R184-L189 HydrophobicContact CB-CD1 4Å; R184-L189 HydrophobicContact CB-CG 4.36Å; Q185-L189 PolarHBondContact O-N 3.2Å; T186-L189 PolarHBondContact O-N 3.28Å; L189-K191 VanDerWaalsContact C-N 3.33Å; L189-K191 PolarHBondContact O-N 3.3Å; L189-A192 WeakPolarHBondContact O-CB 3.45Å; L189-A192 PolarHBondContact O-N 3.32Å; L189-A192 VanDerWaalsContact O-N 3.11Å; L189-V193 WeakPolarHBondContact O-CG2 3.28Å; L189-V193 PolarHBondContact O-N 3.33Å; L189-L387 HydrophobicContact CD2-CD2 4.05Å
190	A	82.8	Confident	83.1	Confident	60 Å²	60	56.1 Å²	56.1	50%	0.496	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-45.7	176.8	0	0	0	0	0	111.8	T186 A192 V193 D194	T186-A190 PolarHBondContact O-N 2.9Å; A190-A192 VanDerWaalsContact C-N 3.34Å; A190-A192 PolarHBondContact O-N 3.38Å; A190-V193 PolarHBondContact O-N 2.94Å; A190-D194 WeakPolarHBondContact O-CB 3.28Å; A190-D194 PolarHBondContact O-N 2.62Å
191	K	88	Confident	83.8	Confident	131 Å²	131	56.5 Å²	56.5	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-63.3	-36.8	175.4	-76.2	-179.3	-178.7	179.3	0	112.7	G187 G188 L189 R195	G187-K191 WeakPolarHBondContact O-CG 3.42Å; G187-K191 PolarHBondContact O-N 3.31Å; G188-K191 PolarHBondContact O-N 3.47Å; L189-K191 VanDerWaalsContact C-N 3.33Å; L189-K191 PolarHBondContact O-N 3.3Å; K191-R195 VanDerWaalsContact O-CB 3.28Å; K191-R195 WeakPolarHBondContact O-CB 3.46Å; K191-R195 VanDerWaalsContact O-CG 3.27Å; K191-R195 WeakPolarHBondContact O-CG 3.45Å; K191-R195 PolarHBondContact O-N 3.49Å
192	A	88.5	Confident	84.5	Confident	17 Å²	17	58.5 Å²	58.5	14%	0.14	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-43	177.7	0	0	0	0	0	112	G188 L189 A190 G196 T383 L387	G188-A192 PolarHBondContact O-N 2.91Å; L189-A192 WeakPolarHBondContact O-CB 3.45Å; L189-A192 PolarHBondContact O-N 3.32Å; L189-A192 VanDerWaalsContact O-N 3.11Å; A190-A192 VanDerWaalsContact C-N 3.34Å; A190-A192 PolarHBondContact O-N 3.38Å; A192-G196 PolarHBondContact O-N 3.3Å; A192-T383 HydrophobicContact CB-CG2 4.14Å; A192-L387 HydrophobicContact CB-CD1 4.22Å
193	V	91.2	Very high	85.6	Confident	25 Å²	25	53.7 Å²	53.7	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-46.9	176.2	-179.5	0	0	0	0	111.3	V169 L173 L189 A190 G196 T197 L387	V169-V193 HydrophobicContact CG1-CG1 4.32Å; V169-V193 HydrophobicContact CG1-CG2 3.59Å; L173-V193 HydrophobicContact CD1-CG2 3.9Å; L189-V193 WeakPolarHBondContact O-CG2 3.28Å; L189-V193 PolarHBondContact O-N 3.33Å; A190-V193 PolarHBondContact O-N 2.94Å; V193-G196 PolarHBondContact O-N 2.81Å; V193-T197 HydrophobicContact CG1-CG2 4.47Å; V193-T197 VanDerWaalsContact O-CG2 3.32Å; V193-T197 WeakPolarHBondContact O-CG2 3.29Å; V193-T197 PolarHBondContact O-N 3.15Å; V193-T197 PolarHBondContact O-OG1 3.06Å; V193-L387 HydrophobicContact CG2-CD1 4.25Å
194	D	91.1	Very high	86.7	Confident	72 Å²	72	51.4 Å²	51.4	39%	0.385	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-43.3	-179.9	177.1	49.1	0	0	0	112.3	A190 T197 R198	A190-D194 WeakPolarHBondContact O-CB 3.28Å; A190-D194 PolarHBondContact O-N 2.62Å; D194-T197 PolarHBondContact O-OG1 2.66Å; D194-R198 PolarHBondContact O-N 2.95Å; D194-R198 VanDerWaalsContact O-N 3.11Å; D194-R198 IonicContact OD1-CZ 2.79Å; D194-R198 IonicContact OD1-NH1 3.13Å; D194-R198 PolarHBondContact OD1-NH1 3.46Å; D194-R198 IonicContact OD1-NH2 3.2Å; D194-R198 IonicContact OD2-CZ 2.65Å; D194-R198 IonicContact OD2-NH1 2.95Å; D194-R198 PolarHBondContact OD2-NH1 3.49Å; D194-R198 IonicContact OD2-NH2 2.51Å; D194-R198 PolarHBondContact OD2-NH2 3.46Å
195	R	92.6	Very high	87.8	Confident	134 Å²	134	50.7 Å²	50.7	51%	0.506	28%	0.279	S	S	.	.	H	α-helix	trans	-65.6	-42.6	172.6	-72.4	179.4	-178	175.3	-0.8	112.2	K191 T197 R198 G199 D380	K191-R195 VanDerWaalsContact O-CB 3.28Å; K191-R195 WeakPolarHBondContact O-CB 3.46Å; K191-R195 VanDerWaalsContact O-CG 3.27Å; K191-R195 WeakPolarHBondContact O-CG 3.45Å; K191-R195 PolarHBondContact O-N 3.49Å; R195-T197 PolarHBondContact O-N 3.28Å; R195-R198 PolarHBondContact O-N 3.29Å; R195-G199 PolarHBondContact O-N 3.4Å; R195-D380 HydrophobicContact CB-CB 4.22Å
196	G	93.7	Very high	89.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-40.9	179.4	0	0	0	0	0	113.2	A192 V193 G199 L200	A192-G196 PolarHBondContact O-N 3.3Å; V193-G196 PolarHBondContact O-N 2.81Å; G196-G199 PolarHBondContact O-N 3.16Å; G196-L200 PolarHBondContact O-N 2.68Å
197	T	95.2	Very high	90.2	Very high	17 Å²	17	42.8 Å²	42.8	10%	0.104	24%	0.236	C	C	.	.	H	α-helix	trans	-67.9	-38.3	175.7	52.8	0	0	0	0	112.5	A166 V193 D194 R195 L200 S201 M384	A166-T197 HydrophobicContact CB-CG2 3.88Å; V193-T197 HydrophobicContact CG1-CG2 4.47Å; V193-T197 VanDerWaalsContact O-CG2 3.32Å; V193-T197 WeakPolarHBondContact O-CG2 3.29Å; V193-T197 PolarHBondContact O-N 3.15Å; V193-T197 PolarHBondContact O-OG1 3.06Å; D194-T197 PolarHBondContact O-OG1 2.66Å; R195-T197 PolarHBondContact O-N 3.28Å; T197-L200 WeakPolarHBondContact O-CB 3.48Å; T197-L200 PolarHBondContact O-N 2.84Å; T197-S201 PolarHBondContact O-N 3.47Å; T197-M384 HydrophobicContact CG2-SD 4.13Å
198	R	93.9	Very high	91.1	Very high	109 Å²	109	41.6 Å²	41.6	41%	0.411	22%	0.221	S	C	.	.	H	α-helix	trans	-64	-44.2	168.9	-76.7	-164.9	-67.4	-96	-8.7	112.2	D194 R195 L200 S201 F202	D194-R198 PolarHBondContact O-N 2.95Å; D194-R198 VanDerWaalsContact O-N 3.11Å; D194-R198 IonicContact OD1-CZ 2.79Å; D194-R198 IonicContact OD1-NH1 3.13Å; D194-R198 PolarHBondContact OD1-NH1 3.46Å; D194-R198 IonicContact OD1-NH2 3.2Å; D194-R198 IonicContact OD2-CZ 2.65Å; D194-R198 IonicContact OD2-NH1 2.95Å; D194-R198 PolarHBondContact OD2-NH1 3.49Å; D194-R198 IonicContact OD2-NH2 2.51Å; D194-R198 PolarHBondContact OD2-NH2 3.46Å; R195-R198 PolarHBondContact O-N 3.29Å; R198-L200 VanDerWaalsContact C-N 3.29Å; R198-L200 PolarHBondContact O-N 3.29Å; R198-S201 WeakPolarHBondContact O-CB 3.48Å; R198-S201 PolarHBondContact O-N 2.87Å; R198-S201 VanDerWaalsContact O-N 3.1Å; R198-F202 HydrophobicContact CB-CD2 4.34Å; R198-F202 HydrophobicContact CB-CE2 4.05Å; R198-F202 WeakPolarHBondContact O-CD2 3.46Å; R198-F202 WeakPolarHBondContact O-CG 3.32Å; R198-F202 PolarHBondContact O-N 3.08Å
199	G	94.3	Very high	91.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-43.3	176.2	0	0	0	0	0	112	R195 G196 F202 V203	R195-G199 PolarHBondContact O-N 3.4Å; G196-G199 PolarHBondContact O-N 3.16Å; G199-F202 PolarHBondContact O-N 2.98Å; G199-V203 WeakPolarHBondContact O-CG2 3.47Å; G199-V203 PolarHBondContact O-N 3.23Å
200	L	94.3	Very high	92.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-50.8	171.6	-175.4	90.8	0	0	0	111.9	M64 I162 I165 G196 T197 R198 F202 V203 L204 M381	M64-L200 HydrophobicContact CB-CD1 3.84Å; M64-L200 HydrophobicContact CG-CD1 3.48Å; M64-L200 VanDerWaalsContact CG-CD1 3.48Å; M64-L200 HydrophobicContact SD-CD1 4.23Å; I162-L200 HydrophobicContact CB-CD2 4.43Å; I162-L200 HydrophobicContact CG1-CD2 3.78Å; I165-L200 HydrophobicContact CD1-CD1 3.58Å; I165-L200 HydrophobicContact CD1-CD2 3.53Å; I165-L200 HydrophobicContact CD1-CG 4.18Å; I165-L200 HydrophobicContact CG1-CD2 4.45Å; G196-L200 PolarHBondContact O-N 2.68Å; T197-L200 WeakPolarHBondContact O-CB 3.48Å; T197-L200 PolarHBondContact O-N 2.84Å; R198-L200 VanDerWaalsContact C-N 3.29Å; R198-L200 PolarHBondContact O-N 3.29Å; L200-F202 VanDerWaalsContact C-N 3.27Å; L200-F202 PolarHBondContact O-N 3.48Å; L200-V203 PolarHBondContact O-N 3.47Å; L200-L204 HydrophobicContact CD1-CD1 4.45Å; L200-L204 HydrophobicContact CD2-CD1 4.25Å; L200-L204 HydrophobicContact CG-CD1 3.94Å; L200-L204 HydrophobicContact CG-CG 4.39Å; L200-L204 WeakPolarHBondContact O-CB 3.45Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.42Å; L200-L204 PolarHBondContact O-N 3.5Å; L200-M381 WeakPolarHBondContact CA-SD 3.32Å; L200-M381 HydrophobicContact CB-CG 4.14Å; L200-M381 HydrophobicContact CB-SD 3.81Å; L200-M381 HydrophobicContact CD1-SD 3.61Å; L200-M381 HydrophobicContact CG-SD 4.28Å
201	S	94	Very high	92.8	Very high	31 Å²	31	43.7 Å²	43.7	22%	0.217	21%	0.214	C	C	.	.	H	α-helix	trans	-55.1	-45.6	178.1	-171.2	0	0	0	0	111.5	T197 R198 S205	T197-S201 PolarHBondContact O-N 3.47Å; R198-S201 WeakPolarHBondContact O-CB 3.48Å; R198-S201 PolarHBondContact O-N 2.87Å; R198-S201 VanDerWaalsContact O-N 3.1Å; S201-S205 WeakPolarHBondContact O-CB 3.44Å; S201-S205 PolarHBondContact O-N 3.41Å; S201-S205 PolarHBondContact O-OG 2.89Å
202	F	93.6	Very high	93	Very high	105 Å²	105	41 Å²	41	46%	0.461	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-48	179.3	-70.6	-55.8	0	0	0	112.6	R198 G199 L200 L204 S205 A206	R198-F202 HydrophobicContact CB-CD2 4.34Å; R198-F202 HydrophobicContact CB-CE2 4.05Å; R198-F202 WeakPolarHBondContact O-CD2 3.46Å; R198-F202 WeakPolarHBondContact O-CG 3.32Å; R198-F202 PolarHBondContact O-N 3.08Å; G199-F202 PolarHBondContact O-N 2.98Å; L200-F202 VanDerWaalsContact C-N 3.27Å; L200-F202 PolarHBondContact O-N 3.48Å; F202-L204 PolarHBondContact O-N 3.19Å; F202-S205 PolarHBondContact O-N 3.06Å; F202-A206 WeakPolarHBondContact O-CB 3.31Å; F202-A206 PolarHBondContact O-N 3.01Å
203	V	95.1	Very high	93.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-42.5	-179.9	173.4	0	0	0	0	111	M64 G199 L200 A206 L207 V374 M378 M381	M64-V203 HydrophobicContact CE-CG1 4.19Å; M64-V203 HydrophobicContact SD-CB 4.28Å; M64-V203 HydrophobicContact SD-CG1 3.77Å; G199-V203 WeakPolarHBondContact O-CG2 3.47Å; G199-V203 PolarHBondContact O-N 3.23Å; L200-V203 PolarHBondContact O-N 3.47Å; V203-A206 PolarHBondContact O-N 2.76Å; V203-L207 HydrophobicContact CG1-CD1 4.02Å; V203-L207 HydrophobicContact CG1-CG 4.46Å; V203-L207 WeakPolarHBondContact O-CB 3.47Å; V203-L207 VanDerWaalsContact O-CG 3.31Å; V203-L207 WeakPolarHBondContact O-CG 3.31Å; V203-L207 PolarHBondContact O-N 2.86Å; V203-V374 HydrophobicContact CG2-CG1 4.45Å; V203-M378 HydrophobicContact CG1-SD 4.43Å; V203-M378 HydrophobicContact CG2-CG 4.29Å; V203-M378 HydrophobicContact CG2-SD 4.41Å; V203-M381 HydrophobicContact CB-CE 3.77Å; V203-M381 HydrophobicContact CG1-CE 4.05Å; V203-M381 HydrophobicContact CG2-CE 3.54Å
204	L	93.9	Very high	93.4	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-46.3	175	-72	-179.6	0	0	0	112.2	M64 V68 F154 L200 F202 L207 V208	M64-L204 HydrophobicContact CE-CD2 3.72Å; M64-L204 HydrophobicContact CG-CD2 3.7Å; M64-L204 HydrophobicContact CG-CG 4.16Å; M64-L204 HydrophobicContact SD-CD2 3.48Å; M64-L204 WeakPolarHBondContact SD-CD2 3.44Å; M64-L204 HydrophobicContact SD-CG 3.85Å; V68-L204 HydrophobicContact CG2-CD1 3.84Å; V68-L204 HydrophobicContact CG2-CD2 3.29Å; V68-L204 HydrophobicContact CG2-CG 4.22Å; F154-L204 HydrophobicContact CZ-CB 4.29Å; L200-L204 HydrophobicContact CD1-CD1 4.45Å; L200-L204 HydrophobicContact CD2-CD1 4.25Å; L200-L204 HydrophobicContact CG-CD1 3.94Å; L200-L204 HydrophobicContact CG-CG 4.39Å; L200-L204 WeakPolarHBondContact O-CB 3.45Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.42Å; L200-L204 PolarHBondContact O-N 3.5Å; F202-L204 PolarHBondContact O-N 3.19Å; L204-L207 PolarHBondContact O-N 3.45Å; L204-V208 PolarHBondContact O-N 3.44Å
205	S	92.7	Very high	93.5	Very high	35 Å²	35	40.9 Å²	40.9	25%	0.245	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-45.2	178.6	-62.6	0	0	0	0	111.2	S201 F202 L207 V208 F209	S201-S205 WeakPolarHBondContact O-CB 3.44Å; S201-S205 PolarHBondContact O-N 3.41Å; S201-S205 PolarHBondContact O-OG 2.89Å; F202-S205 PolarHBondContact O-N 3.06Å; S205-L207 PolarHBondContact O-N 3.34Å; S205-V208 PolarHBondContact O-N 3.47Å; S205-F209 WeakPolarHBondContact O-CA 3.42Å; S205-F209 WeakPolarHBondContact O-CB 3.23Å; S205-F209 VanDerWaalsContact O-CD2 3.22Å; S205-F209 WeakPolarHBondContact O-CD2 3.12Å; S205-F209 PolarHBondContact O-N 2.93Å
206	A	93.9	Very high	93.6	Very high	6 Å²	6	38.1 Å²	38.1	5%	0.05	20%	0.2	C	C	.	.	I	π-helix	trans	-59.2	-46.2	176.5	0	0	0	0	0	111.8	F202 V203 N210 V211 V370 V374	F202-A206 WeakPolarHBondContact O-CB 3.31Å; F202-A206 PolarHBondContact O-N 3.01Å; V203-A206 PolarHBondContact O-N 2.76Å; A206-N210 CarbonylContact O-C 3.42Å; A206-N210 WeakPolarHBondContact O-CA 3.15Å; A206-N210 WeakPolarHBondContact O-CB 3.28Å; A206-N210 PolarHBondContact O-N 3.35Å; A206-V211 PolarHBondContact O-N 3.46Å; A206-V370 HydrophobicContact CB-CG1 4.1Å; A206-V374 HydrophobicContact CB-CG2 3.41Å; A206-V374 VanDerWaalsContact CB-CG2 3.41Å
207	L	92.9	Very high	93.5	Very high	49 Å²	49	38.6 Å²	38.6	26%	0.257	20%	0.203	S	C	.	.	I	π-helix	trans	-61.6	-47.5	178.7	-76	171.8	0	0	0	112	L61 M64 V203 L204 S205 V211 L212	L61-L207 HydrophobicContact CD1-CD1 4.45Å; M64-L207 HydrophobicContact CE-CD1 3.7Å; V203-L207 HydrophobicContact CG1-CD1 4.02Å; V203-L207 HydrophobicContact CG1-CG 4.46Å; V203-L207 WeakPolarHBondContact O-CB 3.47Å; V203-L207 VanDerWaalsContact O-CG 3.31Å; V203-L207 WeakPolarHBondContact O-CG 3.31Å; V203-L207 PolarHBondContact O-N 2.86Å; L204-L207 PolarHBondContact O-N 3.45Å; S205-L207 PolarHBondContact O-N 3.34Å; L207-V211 HydrophobicContact CD2-CB 4.36Å; L207-V211 HydrophobicContact CD2-CG1 4.43Å; L207-L212 VanDerWaalsContact O-CB 3.23Å; L207-L212 WeakPolarHBondContact O-CB 2.97Å; L207-L212 VanDerWaalsContact O-CG 3.26Å; L207-L212 WeakPolarHBondContact O-CG 3.34Å; L207-L212 PolarHBondContact O-N 2.93Å
208	V	91.7	Very high	93.5	Very high	18 Å²	18	40.5 Å²	40.5	11%	0.109	21%	0.209	C	C	.	.	I	π-helix	trans	-83.3	-34.6	-172.2	173.2	0	0	0	0	113.4	R150 F154 L204 S205 P213	R150-V208 PolarHBondContact NH1-O 2.86Å; F154-V208 HydrophobicContact CB-CG1 4.35Å; F154-V208 HydrophobicContact CD1-CB 4.1Å; F154-V208 HydrophobicContact CD1-CG1 3.79Å; F154-V208 HydrophobicContact CD1-CG2 4.39Å; F154-V208 HydrophobicContact CD2-CG1 4Å; F154-V208 HydrophobicContact CD2-CG2 4.13Å; F154-V208 HydrophobicContact CE1-CB 3.84Å; F154-V208 HydrophobicContact CE1-CG1 4.06Å; F154-V208 HydrophobicContact CE1-CG2 3.84Å; F154-V208 HydrophobicContact CE2-CB 4.3Å; F154-V208 HydrophobicContact CE2-CG1 4.28Å; F154-V208 HydrophobicContact CE2-CG2 3.58Å; F154-V208 HydrophobicContact CG-CB 4.43Å; F154-V208 HydrophobicContact CG-CG1 3.76Å; F154-V208 HydrophobicContact CZ-CB 3.96Å; F154-V208 HydrophobicContact CZ-CG1 4.3Å; F154-V208 HydrophobicContact CZ-CG2 3.4Å; F154-V208 VanDerWaalsContact CZ-CG2 3.4Å; L204-V208 PolarHBondContact O-N 3.44Å; S205-V208 PolarHBondContact O-N 3.47Å; V208-P213 VanDerWaalsContact O-CD 3.31Å; V208-P213 WeakPolarHBondContact O-CD 3.42Å; V208-P213 WeakPolarHBondContact O-CG 3.26Å
209	F	92	Very high	93.5	Very high	59 Å²	59	36.7 Å²	36.7	26%	0.259	21%	0.205	S	C	.	.	I	π-helix	trans	-95.1	-26.8	-175.8	-61.2	-61.9	0	0	0	113.9	S151 F154 S205	S151-F209 WeakPolarHBondContact OG-CE1 3.31Å; F154-F209 HydrophobicContact CB-CZ 4.39Å; F154-F209 AromaticContact CD1-CE2 3.9Å; F154-F209 HydrophobicContact CD1-CE2 3.9Å; F154-F209 AromaticContact CD1-CZ 3.7Å; F154-F209 HydrophobicContact CD1-CZ 3.7Å; F154-F209 HydrophobicContact CE1-CE2 4.32Å; F154-F209 HydrophobicContact CG-CZ 4.46Å; S205-F209 WeakPolarHBondContact O-CA 3.42Å; S205-F209 WeakPolarHBondContact O-CB 3.23Å; S205-F209 VanDerWaalsContact O-CD2 3.22Å; S205-F209 WeakPolarHBondContact O-CD2 3.12Å; S205-F209 PolarHBondContact O-N 2.93Å
210	N	92.8	Very high	93.5	Very high	51 Å²	51	39.1 Å²	39.1	27%	0.273	22%	0.217	S	C	.	.	I	π-helix	trans	-120.6	-62.9	-174.1	-59.4	-53.9	0	0	0	111.8	A206 T214 V370	A206-N210 CarbonylContact O-C 3.42Å; A206-N210 WeakPolarHBondContact O-CA 3.15Å; A206-N210 WeakPolarHBondContact O-CB 3.28Å; A206-N210 PolarHBondContact O-N 3.35Å; N210-T214 WeakPolarHBondContact O-CB 3.08Å; N210-T214 PolarHBondContact O-N 2.88Å; N210-T214 PolarHBondContact O-OG1 3.47Å; N210-V370 HydrophobicContact CB-CG1 4.33Å; N210-V370 HydrophobicContact CB-CG2 3.72Å
211	V	92.8	Very high	93.5	Very high	52 Å²	52	39.1 Å²	39.1	32%	0.315	22%	0.217	S	C	.	.	I	π-helix	trans	-64.2	-58.4	-169.3	-179.3	0	0	0	0	111.6	A206 L207 T214 T215 V370	A206-V211 PolarHBondContact O-N 3.46Å; L207-V211 HydrophobicContact CD2-CB 4.36Å; L207-V211 HydrophobicContact CD2-CG1 4.43Å; V211-T214 PolarHBondContact O-N 3.48Å; V211-T215 WeakPolarHBondContact O-CB 3.35Å; V211-T215 PolarHBondContact O-N 3.12Å; V211-T215 PolarHBondContact O-OG1 3.45Å; V211-V370 HydrophobicContact CG2-CG1 3.79Å
212	L	93.4	Very high	93.5	Very high	74 Å²	74	38.5 Å²	38.5	39%	0.387	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-48.6	-178.1	-69.8	170.5	0	0	0	112.5	L87 L207 T214 T215 L216	L87-L212 HydrophobicContact CD1-CB 4.3Å; L207-L212 VanDerWaalsContact O-CB 3.23Å; L207-L212 WeakPolarHBondContact O-CB 2.97Å; L207-L212 VanDerWaalsContact O-CG 3.26Å; L207-L212 WeakPolarHBondContact O-CG 3.34Å; L207-L212 PolarHBondContact O-N 2.93Å; L212-T214 VanDerWaalsContact C-N 3.34Å; L212-T214 PolarHBondContact O-N 2.94Å; L212-T215 PolarHBondContact O-N 2.96Å; L212-L216 WeakPolarHBondContact O-CB 3.5Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 2.91Å
213	P	94	Very high	93.6	Very high	4 Å²	4	37 Å²	37	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-42.2	176	-24.8	34.6	0	0	0	113.3	L87 V208 L216 E217	L87-P213 HydrophobicContact CD1-CG 3.77Å; L87-P213 HydrophobicContact CG-CG 4.22Å; V208-P213 VanDerWaalsContact O-CD 3.31Å; V208-P213 WeakPolarHBondContact O-CD 3.42Å; V208-P213 WeakPolarHBondContact O-CG 3.26Å; P213-L216 PolarHBondContact O-N 3.44Å; P213-E217 WeakPolarHBondContact O-CB 3.38Å; P213-E217 PolarHBondContact O-N 3.35Å
214	T	92.6	Very high	93.5	Very high	22 Å²	22	39.4 Å²	39.4	14%	0.135	22%	0.224	C	C	.	.	H	α-helix	trans	-67.5	-44.3	-179.3	-56	0	0	0	0	111.1	N210 V211 L212 L216 E217 F218 P363 L364	N210-T214 WeakPolarHBondContact O-CB 3.08Å; N210-T214 PolarHBondContact O-N 2.88Å; N210-T214 PolarHBondContact O-OG1 3.47Å; V211-T214 PolarHBondContact O-N 3.48Å; L212-T214 VanDerWaalsContact C-N 3.34Å; L212-T214 PolarHBondContact O-N 2.94Å; T214-L216 VanDerWaalsContact C-N 3.34Å; T214-L216 PolarHBondContact O-N 2.94Å; T214-E217 PolarHBondContact O-N 2.88Å; T214-F218 WeakPolarHBondContact O-CB 3.3Å; T214-F218 PolarHBondContact O-N 3.41Å; T214-P363 HydrophobicContact CG2-CB 4.05Å; T214-P363 VanDerWaalsContact OG1-CB 3.31Å; T214-P363 WeakPolarHBondContact OG1-CB 3.11Å; T214-L364 HydrophobicContact CG2-CD1 4.49Å; T214-L364 HydrophobicContact CG2-CG 4.39Å
215	T	93.2	Very high	93.5	Very high	85 Å²	85	39.2 Å²	39.2	52%	0.521	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-41.8	177.2	-57.1	0	0	0	0	111.6	V211 L212 G219	V211-T215 WeakPolarHBondContact O-CB 3.35Å; V211-T215 PolarHBondContact O-N 3.12Å; V211-T215 PolarHBondContact O-OG1 3.45Å; L212-T215 PolarHBondContact O-N 2.96Å; T215-G219 PolarHBondContact O-N 2.87Å
216	L	94.8	Very high	93.6	Very high	76 Å²	76	44 Å²	44	40%	0.398	24%	0.237	S	C	.	.	H	α-helix	trans	-66.9	-45.5	177.1	-76.5	169.5	0	0	0	112.1	L87 L212 P213 T214 G219 L220	L87-L216 HydrophobicContact CD2-CD1 3.26Å; L212-L216 WeakPolarHBondContact O-CB 3.5Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 2.91Å; P213-L216 PolarHBondContact O-N 3.44Å; T214-L216 VanDerWaalsContact C-N 3.34Å; T214-L216 PolarHBondContact O-N 2.94Å; L216-G219 PolarHBondContact O-N 3.11Å; L216-L220 WeakPolarHBondContact O-CB 3.41Å; L216-L220 VanDerWaalsContact O-CG 3.24Å; L216-L220 WeakPolarHBondContact O-CG 3.23Å; L216-L220 PolarHBondContact O-N 3.18Å
217	E	93.4	Very high	93.5	Very high	11 Å²	11	52.5 Å²	52.5	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-46.6	178	-174.4	169.6	-175.2	0	0	111.8	K91 P213 T214 G219 L220 V221 L360	K91-E217 HydrophobicContact CD-CB 4.23Å; K91-E217 IonicContact NZ-OE2 3.03Å; K91-E217 PolarHBondContact NZ-OE2 3.27Å; P213-E217 WeakPolarHBondContact O-CB 3.38Å; P213-E217 PolarHBondContact O-N 3.35Å; T214-E217 PolarHBondContact O-N 2.88Å; E217-G219 PolarHBondContact O-N 2.81Å; E217-L220 PolarHBondContact O-N 3.39Å; E217-V221 WeakPolarHBondContact O-CB 3.2Å; E217-V221 VanDerWaalsContact O-CG2 3.31Å; E217-V221 WeakPolarHBondContact O-CG2 3.42Å; E217-V221 PolarHBondContact O-N 3.3Å; E217-L360 HydrophobicContact CG-CD2 4.06Å
218	F	93.4	Very high	93.2	Very high	56 Å²	56	55.2 Å²	55.2	25%	0.246	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-47.1	173.5	164.5	-112.7	0	0	0	112.5	T214 T222 L238 V241 L360	T214-F218 WeakPolarHBondContact O-CB 3.3Å; T214-F218 PolarHBondContact O-N 3.41Å; F218-T222 WeakPolarHBondContact CE2-OG1 3.49Å; F218-T222 WeakPolarHBondContact O-CB 3.21Å; F218-T222 PolarHBondContact O-N 3Å; F218-T222 PolarHBondContact O-OG1 3.11Å; F218-L238 HydrophobicContact CE1-CD2 4.46Å; F218-L238 HydrophobicContact CE2-CD2 3.81Å; F218-L238 HydrophobicContact CZ-CD2 3.4Å; F218-V241 HydrophobicContact CD2-CB 4.24Å; F218-V241 HydrophobicContact CD2-CG1 3.95Å; F218-V241 HydrophobicContact CD2-CG2 3.87Å; F218-V241 HydrophobicContact CE2-CB 3.84Å; F218-V241 HydrophobicContact CE2-CG1 3.73Å; F218-V241 HydrophobicContact CE2-CG2 3.88Å; F218-V241 HydrophobicContact CZ-CG1 4.25Å; F218-L360 HydrophobicContact CB-CD2 4.44Å
219	G	94.3	Very high	92.9	Very high	30 Å²	30	55.5 Å²	55.5	31%	0.309	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-44.5	177.8	0	0	0	0	0	112.2	T215 L216 E217 T223	T215-G219 PolarHBondContact O-N 2.87Å; L216-G219 PolarHBondContact O-N 3.11Å; E217-G219 PolarHBondContact O-N 2.81Å; G219-T223 VanDerWaalsContact O-CB 3.24Å; G219-T223 WeakPolarHBondContact O-CB 3.2Å; G219-T223 PolarHBondContact O-N 2.92Å; G219-T223 PolarHBondContact O-OG1 2.91Å
220	L	94.8	Very high	92.9	Very high	50 Å²	50	54 Å²	54	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-62.8	-50.2	177.2	-73.6	170.5	0	0	0	111.7	K91 L92 V95 L216 E217 T223 L224	K91-L220 HydrophobicContact CB-CD1 4.14Å; L92-L220 HydrophobicContact CD2-CD1 4.26Å; L92-L220 HydrophobicContact CD2-CD2 4.14Å; V95-L220 HydrophobicContact CG2-CB 4.35Å; V95-L220 HydrophobicContact CG2-CD1 4.4Å; L216-L220 WeakPolarHBondContact O-CB 3.41Å; L216-L220 VanDerWaalsContact O-CG 3.24Å; L216-L220 WeakPolarHBondContact O-CG 3.23Å; L216-L220 PolarHBondContact O-N 3.18Å; E217-L220 PolarHBondContact O-N 3.39Å; L220-T223 PolarHBondContact O-N 3.04Å; L220-L224 WeakPolarHBondContact O-CB 3.34Å; L220-L224 VanDerWaalsContact O-CG 3.26Å; L220-L224 WeakPolarHBondContact O-CG 3.48Å; L220-L224 PolarHBondContact O-N 3.45Å
221	V	94.6	Very high	92.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-48	-179.6	170	0	0	0	0	111	E217 T223 L224 M225 T237 L356 L360	E217-V221 WeakPolarHBondContact O-CB 3.2Å; E217-V221 VanDerWaalsContact O-CG2 3.31Å; E217-V221 WeakPolarHBondContact O-CG2 3.42Å; E217-V221 PolarHBondContact O-N 3.3Å; V221-T223 VanDerWaalsContact C-N 3.34Å; V221-T223 PolarHBondContact O-N 3.41Å; V221-L224 PolarHBondContact O-N 3.43Å; V221-M225 HydrophobicContact CG1-CG 4.38Å; V221-M225 HydrophobicContact CG1-SD 3.84Å; V221-M225 VanDerWaalsContact O-CG 3.28Å; V221-M225 WeakPolarHBondContact O-CG 3.28Å; V221-M225 PolarHBondContact O-N 2.93Å; V221-T237 HydrophobicContact CG1-CG2 4.4Å; V221-L356 HydrophobicContact CG1-CB 4.07Å; V221-L356 HydrophobicContact CG2-CD2 4.27Å; V221-L360 HydrophobicContact CB-CD1 4.28Å; V221-L360 HydrophobicContact CB-CD2 4.17Å; V221-L360 HydrophobicContact CB-CG 4.45Å; V221-L360 HydrophobicContact CG1-CD1 3.83Å; V221-L360 HydrophobicContact CG1-CG 4.25Å; V221-L360 HydrophobicContact CG2-CD2 4Å; V221-L360 HydrophobicContact CG2-CG 4.4Å
222	T	94.3	Very high	92.9	Very high	18 Å²	18	57 Å²	57	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-44.4	179.6	-55	0	0	0	0	111.5	F218 M225 Y226 A234 L238	F218-T222 WeakPolarHBondContact CE2-OG1 3.49Å; F218-T222 WeakPolarHBondContact O-CB 3.21Å; F218-T222 PolarHBondContact O-N 3Å; F218-T222 PolarHBondContact O-OG1 3.11Å; T222-M225 PolarHBondContact O-N 3.47Å; T222-Y226 PolarHBondContact O-N 3.46Å; T222-A234 HydrophobicContact CG2-CB 4.21Å; T222-L238 HydrophobicContact CG2-CD1 4.08Å; T222-L238 HydrophobicContact CG2-CD2 3.82Å; T222-L238 HydrophobicContact CG2-CG 3.73Å
223	T	94.5	Very high	92.9	Very high	73 Å²	73	53.6 Å²	53.6	45%	0.448	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-42.5	178.9	-57.2	0	0	0	0	111.5	G219 L220 V221 Y226 Y227	G219-T223 VanDerWaalsContact O-CB 3.24Å; G219-T223 WeakPolarHBondContact O-CB 3.2Å; G219-T223 PolarHBondContact O-N 2.92Å; G219-T223 PolarHBondContact O-OG1 2.91Å; L220-T223 PolarHBondContact O-N 3.04Å; V221-T223 VanDerWaalsContact C-N 3.34Å; V221-T223 PolarHBondContact O-N 3.41Å; T223-Y226 WeakPolarHBondContact O-CB 3.27Å; T223-Y226 PolarHBondContact O-N 3.02Å; T223-Y227 HydrophobicContact CG2-CD2 3.68Å; T223-Y227 HydrophobicContact CG2-CE2 3.5Å; T223-Y227 VanDerWaalsContact CG2-CE2 3.5Å; T223-Y227 WeakPolarHBondContact O-CD2 3.32Å; T223-Y227 PolarHBondContact O-N 3.44Å; T223-Y227 VanDerWaalsContact O-N 3.11Å
224	L	94.3	Very high	93	Very high	54 Å²	54	53.7 Å²	53.7	28%	0.283	29%	0.285	S	S	.	.	H	α-helix	trans	-66.9	-41.3	178.6	-75.2	168.3	0	0	0	112.7	V95 F99 L220 V221 Y226 Y227 K228	V95-L224 HydrophobicContact CG1-CD1 3.07Å; F99-L224 HydrophobicContact CE2-CD1 4.22Å; F99-L224 HydrophobicContact CZ-CD1 4.44Å; F99-L224 HydrophobicContact CZ-CD2 4.24Å; L220-L224 WeakPolarHBondContact O-CB 3.34Å; L220-L224 VanDerWaalsContact O-CG 3.26Å; L220-L224 WeakPolarHBondContact O-CG 3.48Å; L220-L224 PolarHBondContact O-N 3.45Å; V221-L224 PolarHBondContact O-N 3.43Å; L224-Y226 VanDerWaalsContact C-N 3.29Å; L224-Y226 PolarHBondContact O-N 2.85Å; L224-Y227 PolarHBondContact O-N 3.33Å; L224-K228 VanDerWaalsContact O-CB 3.25Å; L224-K228 WeakPolarHBondContact O-CB 3.17Å; L224-K228 PolarHBondContact O-N 3.41Å
225	M	92.7	Very high	93.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-39.6	175.9	-68.7	178.5	90.7	0	0	111.2	V221 T222 S229 G230 T237 L332 L353	V221-M225 HydrophobicContact CG1-CG 4.38Å; V221-M225 HydrophobicContact CG1-SD 3.84Å; V221-M225 VanDerWaalsContact O-CG 3.28Å; V221-M225 WeakPolarHBondContact O-CG 3.28Å; V221-M225 PolarHBondContact O-N 2.93Å; T222-M225 PolarHBondContact O-N 3.47Å; M225-S229 PolarHBondContact O-N 3.36Å; M225-S229 VanDerWaalsContact O-N 3.07Å; M225-G230 PolarHBondContact O-N 3.03Å; M225-G230 VanDerWaalsContact O-N 3.09Å; M225-T237 VanDerWaalsContact CE-OG1 3.28Å; M225-T237 WeakPolarHBondContact CE-OG1 3.47Å; M225-T237 HydrophobicContact SD-CG2 4.11Å; M225-T237 PolarHBondContact SD-OG1 2.93Å; M225-L332 HydrophobicContact CE-CD1 3.5Å; M225-L332 VanDerWaalsContact CE-CD1 3.5Å; M225-L353 HydrophobicContact CE-CD2 3.73Å; M225-L353 HydrophobicContact CG-CD2 3.91Å
226	Y	94.4	Very high	93.3	Very high	136 Å²	136	56.4 Å²	56.4	53%	0.533	30%	0.295	S	S	.	.	H	α-helix	trans	-59.1	-52	175.3	-179.6	-94.9	0	0	0	112	T222 T223 L224 G230 A234	T222-Y226 PolarHBondContact O-N 3.46Å; T223-Y226 WeakPolarHBondContact O-CB 3.27Å; T223-Y226 PolarHBondContact O-N 3.02Å; L224-Y226 VanDerWaalsContact C-N 3.29Å; L224-Y226 PolarHBondContact O-N 2.85Å; Y226-G230 CarbonylContact O-C 3.56Å; Y226-G230 VanDerWaalsContact O-CA 3.29Å; Y226-G230 WeakPolarHBondContact O-CA 3.26Å; Y226-G230 PolarHBondContact O-N 2.77Å; Y226-A234 HydrophobicContact CD2-CB 4.31Å
227	Y	91.9	Very high	93.3	Very high	185 Å²	185	52.8 Å²	52.8	73%	0.725	28%	0.276	S	S	*	.	H	α-helix	trans	-74.9	-34.6	-175.8	-75.9	-65.4	0	0	0	114	T223 L224	T223-Y227 HydrophobicContact CG2-CD2 3.68Å; T223-Y227 HydrophobicContact CG2-CE2 3.5Å; T223-Y227 VanDerWaalsContact CG2-CE2 3.5Å; T223-Y227 WeakPolarHBondContact O-CD2 3.32Å; T223-Y227 PolarHBondContact O-N 3.44Å; T223-Y227 VanDerWaalsContact O-N 3.11Å; L224-Y227 PolarHBondContact O-N 3.33Å
228	K	87.6	Confident	93.4	Very high	105 Å²	105	55.8 Å²	55.8	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-90.9	-35.1	-172.1	-171	59.3	179.1	178.6	0	113.7	L224 M352	L224-K228 VanDerWaalsContact O-CB 3.25Å; L224-K228 WeakPolarHBondContact O-CB 3.17Å; L224-K228 PolarHBondContact O-N 3.41Å; K228-M352 HydrophobicContact CG-CE 3.99Å
229	S	86	Confident	93.5	Very high	25 Å²	25	54.8 Å²	54.8	18%	0.175	30%	0.297	C	S	.	.	H	α-helix	trans	-124.2	-13.7	-172.1	-54.8	0	0	0	0	113.2	M225 Y233 L353	M225-S229 PolarHBondContact O-N 3.36Å; M225-S229 VanDerWaalsContact O-N 3.07Å; S229-Y233 VanDerWaalsContact CB-CD2 3.48Å; S229-Y233 WeakPolarHBondContact O-CD2 3.34Å; S229-Y233 WeakPolarHBondContact O-CE2 3.49Å; S229-L353 WeakPolarHBondContact OG-CD2 3.4Å
230	G	90.4	Very high	93.6	Very high	28 Å²	28	53.7 Å²	53.7	29%	0.289	29%	0.285	S	S	.	.			trans	111.3	170.2	173.5	0	0	0	0	0	114.2	M225 Y226 Q232 Y233	M225-G230 PolarHBondContact O-N 3.03Å; M225-G230 VanDerWaalsContact O-N 3.09Å; Y226-G230 CarbonylContact O-C 3.56Å; Y226-G230 VanDerWaalsContact O-CA 3.29Å; Y226-G230 WeakPolarHBondContact O-CA 3.26Å; Y226-G230 PolarHBondContact O-N 2.77Å; G230-Q232 VanDerWaalsContact C-N 3.28Å; G230-Q232 PolarHBondContact O-N 2.86Å; G230-Y233 PolarHBondContact O-N 3.47Å
231	G	91.9	Very high	93.5	Very high	39 Å²	39	52 Å²	52	40%	0.402	28%	0.277	S	S	.	.	H	α-helix	trans	-64.6	-26.6	-172.6	0	0	0	0	0	115.1	A234 L235	G231-A234 PolarHBondContact O-N 3.43Å; G231-L235 WeakPolarHBondContact O-CB 3.3Å; G231-L235 PolarHBondContact O-N 3.05Å
232	Q	94.1	Very high	93.6	Very high	125 Å²	125	54.6 Å²	54.6	58%	0.584	30%	0.298	S	S	*	.	H	α-helix	trans	-66.3	-40.3	-179.7	-60.6	-179	-6.1	0	0	112	G230 L235 L236 M335	G230-Q232 VanDerWaalsContact C-N 3.28Å; G230-Q232 PolarHBondContact O-N 2.86Å; Q232-L235 PolarHBondContact O-N 3.26Å; Q232-L236 PolarHBondContact O-N 3.43Å; Q232-M335 HydrophobicContact CB-CE 3.65Å
233	Y	94.7	Very high	93.7	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-41.4	176.8	-67.6	-82.5	0	0	0	112.1	S229 G230 L235 L236 T237 L332 M335 S336 E339 M345 L353	S229-Y233 VanDerWaalsContact CB-CD2 3.48Å; S229-Y233 WeakPolarHBondContact O-CD2 3.34Å; S229-Y233 WeakPolarHBondContact O-CE2 3.49Å; G230-Y233 PolarHBondContact O-N 3.47Å; Y233-L235 VanDerWaalsContact C-N 3.34Å; Y233-L236 PolarHBondContact O-N 3.47Å; Y233-T237 PolarHBondContact O-N 2.92Å; Y233-T237 PolarHBondContact O-OG1 3.39Å; Y233-L332 HydrophobicContact CD1-CG 4.35Å; Y233-M335 HydrophobicContact CE1-CB 4.12Å; Y233-S336 WeakPolarHBondContact OH-CA 3.45Å; Y233-S336 PolarHBondContact OH-N 3.49Å; Y233-E339 WeakPolarHBondContact OH-CG 3.45Å; Y233-M345 HydrophobicContact CE2-SD 4.11Å; Y233-M345 PolarHBondContact OH-SD 3.07Å; Y233-L353 HydrophobicContact CD1-CD1 3.87Å; Y233-L353 HydrophobicContact CE1-CD1 3.75Å
234	A	95	Very high	93.7	Very high	5 Å²	5	54.1 Å²	54.1	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-41.5	174	0	0	0	0	0	111.7	T222 Y226 G231 T237 L238	T222-A234 HydrophobicContact CG2-CB 4.21Å; Y226-A234 HydrophobicContact CD2-CB 4.31Å; G231-A234 PolarHBondContact O-N 3.43Å; A234-T237 PolarHBondContact O-N 2.92Å; A234-L238 WeakPolarHBondContact O-CB 3.49Å; A234-L238 VanDerWaalsContact O-CG 3.29Å; A234-L238 WeakPolarHBondContact O-CG 3.34Å; A234-L238 PolarHBondContact O-N 2.9Å
235	L	96.1	Very high	93.7	Very high	124 Å²	124	52.9 Å²	52.9	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-64.3	-42.7	177.3	-175.4	66.5	0	0	0	112	G231 Q232 Y233 T237 L238 G239	G231-L235 WeakPolarHBondContact O-CB 3.3Å; G231-L235 PolarHBondContact O-N 3.05Å; Q232-L235 PolarHBondContact O-N 3.26Å; Y233-L235 VanDerWaalsContact C-N 3.34Å; L235-T237 VanDerWaalsContact C-N 3.33Å; L235-T237 PolarHBondContact O-N 2.89Å; L235-L238 PolarHBondContact O-N 3.09Å; L235-G239 PolarHBondContact O-N 3.25Å
236	L	95.9	Very high	93.8	Very high	40 Å²	40	57 Å²	57	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-59.4	-45	175	-179.5	146.9	0	0	0	111.2	Q232 Y233 G239 C240 A328 L332 M335 L357	Q232-L236 PolarHBondContact O-N 3.43Å; Y233-L236 PolarHBondContact O-N 3.47Å; L236-G239 PolarHBondContact O-N 2.77Å; L236-C240 WeakPolarHBondContact O-CB 3.14Å; L236-C240 PolarHBondContact O-N 3.02Å; L236-A328 HydrophobicContact CD2-CB 4.28Å; L236-L332 HydrophobicContact CD1-CB 4.47Å; L236-L332 HydrophobicContact CD2-CB 4.12Å; L236-L332 HydrophobicContact CD2-CD1 4.46Å; L236-M335 HydrophobicContact CD1-SD 3.59Å; L236-M335 VanDerWaalsContact CD1-SD 3.59Å; L236-L357 HydrophobicContact CD2-CD2 4.35Å
237	T	94.3	Very high	93.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-43.7	177.8	-63.5	0	0	0	0	112.2	V221 M225 Y233 A234 L235 G239 C240 V241 L357 L360	V221-T237 HydrophobicContact CG1-CG2 4.4Å; M225-T237 VanDerWaalsContact CE-OG1 3.28Å; M225-T237 WeakPolarHBondContact CE-OG1 3.47Å; M225-T237 HydrophobicContact SD-CG2 4.11Å; M225-T237 PolarHBondContact SD-OG1 2.93Å; Y233-T237 PolarHBondContact O-N 2.92Å; Y233-T237 PolarHBondContact O-OG1 3.39Å; A234-T237 PolarHBondContact O-N 2.92Å; L235-T237 VanDerWaalsContact C-N 3.33Å; L235-T237 PolarHBondContact O-N 2.89Å; T237-G239 PolarHBondContact O-N 3.11Å; T237-C240 PolarHBondContact O-N 3.15Å; T237-V241 WeakPolarHBondContact O-CG2 3.42Å; T237-V241 PolarHBondContact O-N 2.8Å; T237-L357 HydrophobicContact CG2-CD1 4.29Å; T237-L360 HydrophobicContact CG2-CD1 3.65Å
238	L	95.5	Very high	94	Very high	74 Å²	74	44 Å²	44	39%	0.387	27%	0.266	S	S	.	.	H	α-helix	trans	-59.4	-46	173.8	-74.8	172.8	0	0	0	111.6	F218 T222 A234 L235 V241 A242	F218-L238 HydrophobicContact CE1-CD2 4.46Å; F218-L238 HydrophobicContact CE2-CD2 3.81Å; F218-L238 HydrophobicContact CZ-CD2 3.4Å; T222-L238 HydrophobicContact CG2-CD1 4.08Å; T222-L238 HydrophobicContact CG2-CD2 3.82Å; T222-L238 HydrophobicContact CG2-CG 3.73Å; A234-L238 WeakPolarHBondContact O-CB 3.49Å; A234-L238 VanDerWaalsContact O-CG 3.29Å; A234-L238 WeakPolarHBondContact O-CG 3.34Å; A234-L238 PolarHBondContact O-N 2.9Å; L235-L238 PolarHBondContact O-N 3.09Å; L238-V241 PolarHBondContact O-N 2.99Å; L238-A242 VanDerWaalsContact O-CB 3.25Å; L238-A242 WeakPolarHBondContact O-CB 3.37Å; L238-A242 PolarHBondContact O-N 3.03Å
239	G	96	Very high	94.3	Very high	35 Å²	35	41.2 Å²	41.2	36%	0.361	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-43.2	177.3	0	0	0	0	0	112.7	L235 L236 T237 T243	L235-G239 PolarHBondContact O-N 3.25Å; L236-G239 PolarHBondContact O-N 2.77Å; T237-G239 PolarHBondContact O-N 3.11Å; G239-T243 VanDerWaalsContact O-CB 3.26Å; G239-T243 WeakPolarHBondContact O-CB 3.27Å; G239-T243 PolarHBondContact O-N 2.93Å; G239-T243 PolarHBondContact O-OG1 2.82Å
240	C	95.9	Very high	94.7	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.054	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-53	174.8	179.3	0	0	0	0	111.2	L236 T237 A242 T243 Y244 A328	L236-C240 WeakPolarHBondContact O-CB 3.14Å; L236-C240 PolarHBondContact O-N 3.02Å; T237-C240 PolarHBondContact O-N 3.15Å; C240-A242 PolarHBondContact O-N 3Å; C240-T243 PolarHBondContact O-N 3.37Å; C240-Y244 WeakPolarHBondContact O-CB 3.34Å; C240-Y244 PolarHBondContact O-N 3.33Å; C240-A328 HydrophobicContact CB-CB 3.74Å; C240-A328 WeakPolarHBondContact SG-CB 3.43Å
241	V	94.4	Very high	94.9	Very high	14 Å²	14	44.5 Å²	44.5	9%	0.085	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-40.5	-178.5	171.4	0	0	0	0	111.6	F218 T237 L238 S245 L360 L364	F218-V241 HydrophobicContact CD2-CB 4.24Å; F218-V241 HydrophobicContact CD2-CG1 3.95Å; F218-V241 HydrophobicContact CD2-CG2 3.87Å; F218-V241 HydrophobicContact CE2-CB 3.84Å; F218-V241 HydrophobicContact CE2-CG1 3.73Å; F218-V241 HydrophobicContact CE2-CG2 3.88Å; F218-V241 HydrophobicContact CZ-CG1 4.25Å; T237-V241 WeakPolarHBondContact O-CG2 3.42Å; T237-V241 PolarHBondContact O-N 2.8Å; L238-V241 PolarHBondContact O-N 2.99Å; V241-S245 VanDerWaalsContact O-CB 3.25Å; V241-S245 WeakPolarHBondContact O-CB 3.48Å; V241-S245 PolarHBondContact O-N 2.94Å; V241-S245 PolarHBondContact O-OG 3.1Å; V241-L360 HydrophobicContact CG2-CD1 4.12Å; V241-L364 HydrophobicContact CG1-CD2 4.16Å; V241-L364 HydrophobicContact CG2-CD1 4.36Å
242	A	94.9	Very high	95	Very high	55 Å²	55	43.1 Å²	43.1	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-49.8	176.7	0	0	0	0	0	111.4	L238 C240 Y244 S245 V246	L238-A242 VanDerWaalsContact O-CB 3.25Å; L238-A242 WeakPolarHBondContact O-CB 3.37Å; L238-A242 PolarHBondContact O-N 3.03Å; C240-A242 PolarHBondContact O-N 3Å; A242-Y244 VanDerWaalsContact C-N 3.34Å; A242-Y244 PolarHBondContact O-N 2.93Å; A242-S245 PolarHBondContact O-N 3.01Å; A242-V246 WeakPolarHBondContact O-CG2 3.46Å; A242-V246 PolarHBondContact O-N 3.16Å
243	T	96.7	Very high	94.9	Very high	80 Å²	80	43.8 Å²	43.8	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-46.5	177.8	-56.5	0	0	0	0	110.9	G239 C240 S245 V246 F247 I324	G239-T243 VanDerWaalsContact O-CB 3.26Å; G239-T243 WeakPolarHBondContact O-CB 3.27Å; G239-T243 PolarHBondContact O-N 2.93Å; G239-T243 PolarHBondContact O-OG1 2.82Å; C240-T243 PolarHBondContact O-N 3.37Å; T243-S245 PolarHBondContact O-N 3.49Å; T243-V246 PolarHBondContact O-N 3.15Å; T243-F247 VanDerWaalsContact O-CB 3.26Å; T243-F247 WeakPolarHBondContact O-CB 3.42Å; T243-F247 PolarHBondContact O-N 3.39Å; T243-I324 HydrophobicContact CG2-CD1 4.33Å; T243-I324 HydrophobicContact CG2-CG1 4.46Å; T243-I324 HydrophobicContact CG2-CG2 4.4Å
244	Y	95.5	Very high	94.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-47.6	175.9	-176.8	-77.8	0	0	0	112.1	C240 A242 F247 T248 Q321 F325 L364 N365	C240-Y244 WeakPolarHBondContact O-CB 3.34Å; C240-Y244 PolarHBondContact O-N 3.33Å; A242-Y244 VanDerWaalsContact C-N 3.34Å; A242-Y244 PolarHBondContact O-N 2.93Å; Y244-F247 PolarHBondContact O-N 3.41Å; Y244-T248 WeakPolarHBondContact CD1-OG1 3.33Å; Y244-T248 WeakPolarHBondContact CE1-OG1 3.22Å; Y244-T248 WeakPolarHBondContact O-CB 3.28Å; Y244-T248 PolarHBondContact O-N 2.88Å; Y244-T248 PolarHBondContact O-OG1 2.97Å; Y244-Q321 HydrophobicContact CD2-CB 4.3Å; Y244-Q321 HydrophobicContact CD2-CG 4.18Å; Y244-Q321 HydrophobicContact CE1-CG 4.44Å; Y244-Q321 HydrophobicContact CE2-CB 3.5Å; Y244-Q321 VanDerWaalsContact CE2-CB 3.5Å; Y244-Q321 HydrophobicContact CE2-CG 3.42Å; Y244-Q321 VanDerWaalsContact CE2-CG 3.42Å; Y244-Q321 PolarHBondContact OH-NE2 3.32Å; Y244-F325 AromaticContact CD2-CD2 3.64Å; Y244-F325 HydrophobicContact CD2-CD2 3.64Å; Y244-F325 AromaticContact CD2-CE2 3.29Å; Y244-F325 HydrophobicContact CD2-CE2 3.29Å; Y244-F325 HydrophobicContact CD2-CZ 4.15Å; Y244-F325 AromaticContact CE2-CD2 3.58Å; Y244-F325 HydrophobicContact CE2-CD2 3.58Å; Y244-F325 AromaticContact CE2-CE2 3.21Å; Y244-F325 HydrophobicContact CE2-CE2 3.21Å; Y244-F325 HydrophobicContact CE2-CZ 4.33Å; Y244-F325 HydrophobicContact CG-CE2 4.07Å; Y244-F325 AromaticContact CZ-CE2 3.98Å; Y244-L364 HydrophobicContact CD1-CB 4.01Å; Y244-L364 HydrophobicContact CD1-CD2 3.38Å; Y244-L364 HydrophobicContact CD1-CG 4.33Å; Y244-L364 HydrophobicContact CE1-CB 3.54Å; Y244-L364 HydrophobicContact CE1-CD2 3.77Å; Y244-L364 HydrophobicContact CE1-CG 4.31Å; Y244-L364 VanDerWaalsContact CE1-O 3.3Å; Y244-L364 WeakPolarHBondContact CE1-O 3.2Å; Y244-L364 HydrophobicContact CG-CD2 4.18Å; Y244-L364 PolarHBondContact OH-O 3.48Å; Y244-N365 WeakPolarHBondContact OH-CA 2.98Å; Y244-N365 PolarHBondContact OH-N 3.32Å; Y244-N365 VanDerWaalsContact OH-N 3.09Å; Y244-N365 PolarHBondContact OH-OD1 3.4Å
245	S	93.4	Very high	94.8	Very high	28 Å²	28	50.9 Å²	50.9	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-45.7	-177.5	-61.9	0	0	0	0	111.2	V241 A242 T243 T248 I249	V241-S245 VanDerWaalsContact O-CB 3.25Å; V241-S245 WeakPolarHBondContact O-CB 3.48Å; V241-S245 PolarHBondContact O-N 2.94Å; V241-S245 PolarHBondContact O-OG 3.1Å; A242-S245 PolarHBondContact O-N 3.01Å; T243-S245 PolarHBondContact O-N 3.49Å; S245-T248 PolarHBondContact O-N 3.39Å; S245-I249 WeakPolarHBondContact O-CB 3.48Å; S245-I249 WeakPolarHBondContact O-CD1 3.2Å; S245-I249 VanDerWaalsContact O-CG1 3.23Å; S245-I249 WeakPolarHBondContact O-CG1 3.45Å; S245-I249 PolarHBondContact O-N 2.94Å
246	V	95.3	Very high	94.6	Very high	88 Å²	88	46.2 Å²	46.2	53%	0.533	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-51	177.1	171.7	0	0	0	0	110.5	A242 T243 T248 I249 L250	A242-V246 WeakPolarHBondContact O-CG2 3.46Å; A242-V246 PolarHBondContact O-N 3.16Å; T243-V246 PolarHBondContact O-N 3.15Å; V246-T248 PolarHBondContact O-N 2.71Å; V246-I249 PolarHBondContact O-N 3.07Å; V246-L250 HydrophobicContact CG1-CD1 3.74Å; V246-L250 HydrophobicContact CG1-CG 4.36Å; V246-L250 WeakPolarHBondContact O-CB 3.11Å; V246-L250 VanDerWaalsContact O-CG 3.27Å; V246-L250 WeakPolarHBondContact O-CG 3.32Å; V246-L250 PolarHBondContact O-N 2.96Å
247	F	96.4	Very high	94.6	Very high	45 Å²	45	51.2 Å²	51.2	20%	0.197	27%	0.269	C	S	.	.	H	α-helix	trans	-55.7	-51.1	177.2	174.6	-101.6	0	0	0	111.6	T243 Y244 I249 L250 V251 F316 L317 Q321 I324	T243-F247 VanDerWaalsContact O-CB 3.26Å; T243-F247 WeakPolarHBondContact O-CB 3.42Å; T243-F247 PolarHBondContact O-N 3.39Å; Y244-F247 PolarHBondContact O-N 3.41Å; F247-I249 PolarHBondContact O-N 3.15Å; F247-L250 PolarHBondContact O-N 3.39Å; F247-V251 HydrophobicContact CD2-CG2 3.96Å; F247-V251 HydrophobicContact CE1-CG2 4.33Å; F247-V251 HydrophobicContact CE2-CG2 3.61Å; F247-V251 HydrophobicContact CG-CG2 4.45Å; F247-V251 HydrophobicContact CZ-CG2 3.81Å; F247-V251 WeakPolarHBondContact O-CB 3.45Å; F247-V251 WeakPolarHBondContact O-CG2 3.2Å; F247-V251 PolarHBondContact O-N 3.49Å; F247-F316 HydrophobicContact CE2-CE1 4.26Å; F247-F316 HydrophobicContact CZ-CE1 4.15Å; F247-L317 HydrophobicContact CD1-CD1 4.34Å; F247-L317 HydrophobicContact CE1-CD1 3.91Å; F247-Q321 HydrophobicContact CD1-CG 4.23Å; F247-Q321 HydrophobicContact CE1-CG 4.16Å; F247-I324 HydrophobicContact CB-CD1 3.78Å; F247-I324 HydrophobicContact CD1-CD1 3.77Å; F247-I324 HydrophobicContact CG-CD1 3.77Å
248	T	94.7	Very high	94.6	Very high	1 Å²	1	53 Å²	53	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-44.8	-178.3	-61.9	0	0	0	0	111.6	Y244 S245 V246 T252 L317 Q321 L367	Y244-T248 WeakPolarHBondContact CD1-OG1 3.33Å; Y244-T248 WeakPolarHBondContact CE1-OG1 3.22Å; Y244-T248 WeakPolarHBondContact O-CB 3.28Å; Y244-T248 PolarHBondContact O-N 2.88Å; Y244-T248 PolarHBondContact O-OG1 2.97Å; S245-T248 PolarHBondContact O-N 3.39Å; V246-T248 PolarHBondContact O-N 2.71Å; T248-T252 WeakPolarHBondContact O-CB 3.31Å; T248-T252 PolarHBondContact O-N 2.99Å; T248-T252 PolarHBondContact O-OG1 3.05Å; T248-L317 HydrophobicContact CG2-CD1 4.43Å; T248-Q321 PolarHBondContact OG1-NE2 3.45Å; T248-L367 HydrophobicContact CG2-CB 4.45Å
249	I	92.8	Very high	94.5	Very high	47 Å²	47	54.5 Å²	54.5	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-44.6	-179.7	-69.3	167.5	0	0	0	111.1	S245 V246 F247 T252 R253	S245-I249 WeakPolarHBondContact O-CB 3.48Å; S245-I249 WeakPolarHBondContact O-CD1 3.2Å; S245-I249 VanDerWaalsContact O-CG1 3.23Å; S245-I249 WeakPolarHBondContact O-CG1 3.45Å; S245-I249 PolarHBondContact O-N 2.94Å; V246-I249 PolarHBondContact O-N 3.07Å; F247-I249 PolarHBondContact O-N 3.15Å; I249-T252 PolarHBondContact O-N 3.3Å; I249-R253 VanDerWaalsContact O-CG 3.32Å; I249-R253 WeakPolarHBondContact O-CG 3.36Å; I249-R253 PolarHBondContact O-N 3.19Å
250	L	94.4	Very high	94.4	Very high	107 Å²	107	58.2 Å²	58.2	56%	0.56	28%	0.284	S	S	*	.	H	α-helix	trans	-64.4	-49.4	-178.8	-69.1	175.8	0	0	0	111.7	V246 F247 T252 R253 W254	V246-L250 HydrophobicContact CG1-CD1 3.74Å; V246-L250 HydrophobicContact CG1-CG 4.36Å; V246-L250 WeakPolarHBondContact O-CB 3.11Å; V246-L250 VanDerWaalsContact O-CG 3.27Å; V246-L250 WeakPolarHBondContact O-CG 3.32Å; V246-L250 PolarHBondContact O-N 2.96Å; F247-L250 PolarHBondContact O-N 3.39Å; L250-T252 VanDerWaalsContact C-N 3.35Å; L250-T252 PolarHBondContact O-N 3.41Å; L250-R253 PolarHBondContact O-N 3.46Å; L250-W254 PolarHBondContact O-N 2.8Å; L250-W254 VanDerWaalsContact O-N 3.1Å
251	V	95.1	Very high	94.4	Very high	16 Å²	16	61 Å²	61	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-37.8	179.1	176.5	0	0	0	0	111.1	F247 R253 W254 R255 F316 L317	F247-V251 HydrophobicContact CD2-CG2 3.96Å; F247-V251 HydrophobicContact CE1-CG2 4.33Å; F247-V251 HydrophobicContact CE2-CG2 3.61Å; F247-V251 HydrophobicContact CG-CG2 4.45Å; F247-V251 HydrophobicContact CZ-CG2 3.81Å; F247-V251 WeakPolarHBondContact O-CB 3.45Å; F247-V251 WeakPolarHBondContact O-CG2 3.2Å; F247-V251 PolarHBondContact O-N 3.49Å; V251-R253 VanDerWaalsContact C-N 3.34Å; V251-R253 PolarHBondContact O-N 3.38Å; V251-W254 HydrophobicContact CG1-CE3 4.48Å; V251-W254 PolarHBondContact O-N 2.98Å; V251-R255 WeakPolarHBondContact O-CB 3.47Å; V251-R255 PolarHBondContact O-N 3.47Å; V251-F316 HydrophobicContact CG1-CD1 4.18Å; V251-F316 HydrophobicContact CG2-CE1 4.22Å; V251-L317 HydrophobicContact CB-CD1 4.03Å; V251-L317 HydrophobicContact CG1-CB 3.93Å; V251-L317 HydrophobicContact CG1-CD1 3.95Å; V251-L317 HydrophobicContact CG1-CG 4.43Å
252	T	93.7	Very high	94.5	Very high	10 Å²	10	61.7 Å²	61.7	6%	0.061	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-38.9	175.2	-61.2	0	0	0	0	112	T248 I249 L250 R255 T256	T248-T252 WeakPolarHBondContact O-CB 3.31Å; T248-T252 PolarHBondContact O-N 2.99Å; T248-T252 PolarHBondContact O-OG1 3.05Å; I249-T252 PolarHBondContact O-N 3.3Å; L250-T252 VanDerWaalsContact C-N 3.35Å; L250-T252 PolarHBondContact O-N 3.41Å; T252-R255 WeakPolarHBondContact O-CG 3.19Å; T252-T256 WeakPolarHBondContact O-CB 3.32Å; T252-T256 PolarHBondContact O-N 2.74Å; T252-T256 VanDerWaalsContact O-N 3.15Å; T252-T256 PolarHBondContact O-OG1 2.92Å
253	R	91.6	Very high	94.4	Very high	139 Å²	139	62 Å²	62	53%	0.525	29%	0.294	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.1	-75.2	175.1	177.9	-168.5	0.6	111.8	I249 L250 V251 Y371	I249-R253 VanDerWaalsContact O-CG 3.32Å; I249-R253 WeakPolarHBondContact O-CG 3.36Å; I249-R253 PolarHBondContact O-N 3.19Å; L250-R253 PolarHBondContact O-N 3.46Å; V251-R253 VanDerWaalsContact C-N 3.34Å; V251-R253 PolarHBondContact O-N 3.38Å; R253-Y371 PolarHBondContact NH2-OH 3.44Å
254	W	94.3	Very high	94.3	Very high	128 Å²	128	64.5 Å²	64.5	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-62.9	-50.3	175.9	172.3	76.4	0	0	0	112	L250 V251 T256 K257 F258	L250-W254 PolarHBondContact O-N 2.8Å; L250-W254 VanDerWaalsContact O-N 3.1Å; V251-W254 HydrophobicContact CG1-CE3 4.48Å; V251-W254 PolarHBondContact O-N 2.98Å; W254-T256 PolarHBondContact O-N 3.03Å; W254-K257 WeakPolarHBondContact O-CB 3.1Å; W254-K257 PolarHBondContact O-N 3.35Å; W254-F258 HydrophobicContact CD2-CE2 4.02Å; W254-F258 AromaticContact CE2-CE2 3.59Å; W254-F258 AromaticContact CE2-CZ 3.83Å; W254-F258 HydrophobicContact CE3-CE2 4.22Å; W254-F258 AromaticContact CH2-CE2 3.67Å; W254-F258 HydrophobicContact CH2-CE2 3.67Å; W254-F258 HydrophobicContact CH2-CZ 4.28Å; W254-F258 AromaticContact CZ2-CE2 3.42Å; W254-F258 HydrophobicContact CZ2-CE2 3.42Å; W254-F258 VanDerWaalsContact CZ2-CE2 3.42Å; W254-F258 AromaticContact CZ2-CZ 3.63Å; W254-F258 HydrophobicContact CZ2-CZ 3.63Å; W254-F258 HydrophobicContact CZ3-CE2 4.06Å
255	R	95	Very high	94.3	Very high	29 Å²	29	67.7 Å²	67.7	11%	0.109	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-27.2	-177.7	87.1	-169.6	-50.3	-72.6	-35.2	114	V251 T252 K257 F258 R259 T310 S313 L314	V251-R255 WeakPolarHBondContact O-CB 3.47Å; V251-R255 PolarHBondContact O-N 3.47Å; T252-R255 WeakPolarHBondContact O-CG 3.19Å; R255-K257 PolarHBondContact O-N 3.37Å; R255-F258 PolarHBondContact O-N 2.98Å; R255-F258 VanDerWaalsContact O-N 3.14Å; R255-R259 PolarHBondContact O-N 2.72Å; R255-T310 PolarHBondContact NH2-O 3.23Å; R255-S313 PolarHBondContact NH2-OG 2.94Å; R255-L314 VanDerWaalsContact NH2-CB 3.34Å
256	T	91.7	Very high	94.4	Very high	27 Å²	27	70.7 Å²	70.7	17%	0.166	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-29	-179.6	-63.7	0	0	0	0	111.4	T252 W254 R259 H260	T252-T256 WeakPolarHBondContact O-CB 3.32Å; T252-T256 PolarHBondContact O-N 2.74Å; T252-T256 VanDerWaalsContact O-N 3.15Å; T252-T256 PolarHBondContact O-OG1 2.92Å; W254-T256 PolarHBondContact O-N 3.03Å; T256-R259 PolarHBondContact O-N 3Å; T256-H260 WeakPolarHBondContact CG2-NE2 3.39Å; T256-H260 PolarHBondContact O-CD2 3.3Å; T256-H260 PolarHBondContact O-N 3.35Å
257	K	94.5	Very high	94.3	Very high	145 Å²	145	71.3 Å²	71.3	63%	0.63	33%	0.327	S	S	*	.	H	α-helix	trans	-61.7	-44.9	175.2	-63.4	-176.7	177.8	-175.6	0	112.5	W254 R255 R259 H260 M261	W254-K257 WeakPolarHBondContact O-CB 3.1Å; W254-K257 PolarHBondContact O-N 3.35Å; R255-K257 PolarHBondContact O-N 3.37Å; K257-R259 VanDerWaalsContact C-N 3.33Å; K257-R259 PolarHBondContact O-N 3.1Å; K257-H260 PolarHBondContact O-N 3.38Å; K257-M261 WeakPolarHBondContact O-CG 3.38Å; K257-M261 PolarHBondContact O-N 2.93Å
258	F	95.4	Very high	94.2	Very high	38 Å²	38	71.3 Å²	71.3	17%	0.167	34%	0.335	C	S	.	.	H	α-helix	trans	-65.4	-38	178	-55.7	-52.2	0	0	0	112.2	W254 R255 H260 M261 M262 R309	W254-F258 HydrophobicContact CD2-CE2 4.02Å; W254-F258 AromaticContact CE2-CE2 3.59Å; W254-F258 AromaticContact CE2-CZ 3.83Å; W254-F258 HydrophobicContact CE3-CE2 4.22Å; W254-F258 AromaticContact CH2-CE2 3.67Å; W254-F258 HydrophobicContact CH2-CE2 3.67Å; W254-F258 HydrophobicContact CH2-CZ 4.28Å; W254-F258 AromaticContact CZ2-CE2 3.42Å; W254-F258 HydrophobicContact CZ2-CE2 3.42Å; W254-F258 VanDerWaalsContact CZ2-CE2 3.42Å; W254-F258 AromaticContact CZ2-CZ 3.63Å; W254-F258 HydrophobicContact CZ2-CZ 3.63Å; W254-F258 HydrophobicContact CZ3-CE2 4.06Å; R255-F258 PolarHBondContact O-N 2.98Å; R255-F258 VanDerWaalsContact O-N 3.14Å; F258-H260 VanDerWaalsContact C-N 3.31Å; F258-H260 PolarHBondContact O-N 3.49Å; F258-M261 PolarHBondContact O-N 3.25Å; F258-M262 WeakPolarHBondContact O-CB 3.08Å; F258-M262 PolarHBondContact O-N 2.89Å; F258-R309 HydrophobicContact CB-CB 4.38Å; F258-R309 HydrophobicContact CD1-CB 4.18Å; F258-R309 HydrophobicContact CD2-CB 4.47Å; F258-R309 HydrophobicContact CG-CB 4.1Å
259	R	92.8	Very high	94.2	Very high	105 Å²	105	71.4 Å²	71.4	40%	0.396	34%	0.337	S	S	.	.	H	α-helix	trans	-63.7	-37.6	174.8	-171.6	174.9	-175.9	166.5	2.9	112.1	R255 T256 K257 M262 N263	R255-R259 PolarHBondContact O-N 2.72Å; T256-R259 PolarHBondContact O-N 3Å; K257-R259 VanDerWaalsContact C-N 3.33Å; K257-R259 PolarHBondContact O-N 3.1Å; R259-M262 HydrophobicContact CG-CE 4.4Å; R259-N263 VanDerWaalsContact O-CG 3.27Å; R259-N263 PolarHBondContact O-N 3.04Å; R259-N263 VanDerWaalsContact O-N 3.08Å; R259-N263 PolarHBondContact O-OD1 3.44Å
260	H	93.2	Very high	94.2	Very high	112 Å²	112	70.7 Å²	70.7	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-64.6	-47.6	174.6	-79.1	-64.7	0	0	0	111.6	T256 K257 F258 M262 N263 E264	T256-H260 WeakPolarHBondContact CG2-NE2 3.39Å; T256-H260 PolarHBondContact O-CD2 3.3Å; T256-H260 PolarHBondContact O-N 3.35Å; K257-H260 PolarHBondContact O-N 3.38Å; F258-H260 VanDerWaalsContact C-N 3.31Å; F258-H260 PolarHBondContact O-N 3.49Å; H260-M262 PolarHBondContact O-N 2.89Å; H260-N263 PolarHBondContact O-N 3.37Å; H260-E264 WeakPolarHBondContact O-CG 3.47Å; H260-E264 PolarHBondContact O-N 3.46Å
261	M	95.9	Very high	94.1	Very high	67 Å²	67	71.2 Å²	71.2	33%	0.33	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-45.2	176.3	-65.1	174.5	67.9	0	0	112.1	K257 F258 N263 E264 Y265 A306	K257-M261 WeakPolarHBondContact O-CG 3.38Å; K257-M261 PolarHBondContact O-N 2.93Å; F258-M261 PolarHBondContact O-N 3.25Å; M261-N263 VanDerWaalsContact C-N 3.3Å; M261-N263 PolarHBondContact O-N 3.19Å; M261-E264 WeakPolarHBondContact O-CB 3.26Å; M261-E264 PolarHBondContact O-N 2.93Å; M261-E264 VanDerWaalsContact O-N 3.07Å; M261-Y265 HydrophobicContact CB-CE2 4.35Å; M261-Y265 HydrophobicContact CE-CE2 4.4Å; M261-Y265 WeakPolarHBondContact O-CD2 3.37Å; M261-Y265 PolarHBondContact O-N 2.92Å; M261-A306 HydrophobicContact CB-CB 4.44Å
262	M	96.9	Very high	94	Very high	28 Å²	28	72.4 Å²	72.4	14%	0.138	35%	0.35	C	S	.	.	H	α-helix	trans	-56.2	-45	176.2	-176.1	-166	78.9	0	0	111.4	F258 R259 H260 Y265 D266 Y303 A306 T310	F258-M262 WeakPolarHBondContact O-CB 3.08Å; F258-M262 PolarHBondContact O-N 2.89Å; R259-M262 HydrophobicContact CG-CE 4.4Å; H260-M262 PolarHBondContact O-N 2.89Å; M262-Y265 PolarHBondContact O-N 3.29Å; M262-D266 WeakPolarHBondContact O-CB 3.47Å; M262-D266 PolarHBondContact O-N 2.78Å; M262-Y303 HydrophobicContact CG-CD2 3.87Å; M262-Y303 HydrophobicContact CG-CE2 3.55Å; M262-Y303 WeakPolarHBondContact O-CD2 3.32Å; M262-Y303 HydrophobicContact SD-CE2 4.4Å; M262-A306 HydrophobicContact CB-CB 3.91Å; M262-T310 HydrophobicContact SD-CG2 4.33Å
263	N	93.5	Very high	94.1	Very high	63 Å²	63	74.6 Å²	74.6	34%	0.337	36%	0.361	S	S	.	.	H	α-helix	trans	-67.7	-33.3	176.4	-71.6	-0.7	0	0	0	112.8	R259 H260 M261 N267	R259-N263 VanDerWaalsContact O-CG 3.27Å; R259-N263 PolarHBondContact O-N 3.04Å; R259-N263 VanDerWaalsContact O-N 3.08Å; R259-N263 PolarHBondContact O-OD1 3.44Å; H260-N263 PolarHBondContact O-N 3.37Å; M261-N263 VanDerWaalsContact C-N 3.3Å; M261-N263 PolarHBondContact O-N 3.19Å; N263-N267 PolarHBondContact O-N 3.41Å; N263-N267 PolarHBondContact O-ND2 2.74Å
264	E	94.3	Very high	94.2	Very high	132 Å²	132	73.2 Å²	73.2	62%	0.617	36%	0.362	S	S	*	.	H	α-helix	trans	-65	-44.1	175.7	-75	176.7	173	0	0	111.1	H260 M261 N267 A268	H260-E264 WeakPolarHBondContact O-CG 3.47Å; H260-E264 PolarHBondContact O-N 3.46Å; M261-E264 WeakPolarHBondContact O-CB 3.26Å; M261-E264 PolarHBondContact O-N 2.93Å; M261-E264 VanDerWaalsContact O-N 3.07Å; E264-N267 PolarHBondContact O-N 3.37Å; E264-A268 WeakPolarHBondContact O-CB 3.44Å; E264-A268 PolarHBondContact O-N 2.63Å
265	Y	96.3	Very high	94.2	Very high	67 Å²	67	71.7 Å²	71.7	26%	0.263	36%	0.363	S	S	.	.	H	α-helix	trans	-69.1	-36.7	175.9	-64.2	-57.1	0	0	0	113.1	M261 M262 N267 A268 G269 T299 E302 A306	M261-Y265 HydrophobicContact CB-CE2 4.35Å; M261-Y265 HydrophobicContact CE-CE2 4.4Å; M261-Y265 WeakPolarHBondContact O-CD2 3.37Å; M261-Y265 PolarHBondContact O-N 2.92Å; M262-Y265 PolarHBondContact O-N 3.29Å; Y265-N267 PolarHBondContact O-N 3.5Å; Y265-A268 PolarHBondContact O-N 2.95Å; Y265-G269 PolarHBondContact O-N 3.44Å; Y265-T299 WeakPolarHBondContact O-CG2 3.36Å; Y265-E302 HydrophobicContact CD1-CB 3.66Å; Y265-E302 HydrophobicContact CD1-CG 4.44Å; Y265-E302 HydrophobicContact CD2-CB 4.01Å; Y265-E302 HydrophobicContact CE1-CB 3.6Å; Y265-E302 HydrophobicContact CE1-CG 4.01Å; Y265-E302 HydrophobicContact CE2-CB 3.95Å; Y265-E302 HydrophobicContact CG-CB 3.86Å; Y265-E302 PolarHBondContact OH-OE2 3.41Å; Y265-A306 HydrophobicContact CD2-CB 4.08Å; Y265-A306 HydrophobicContact CE2-CB 4.36Å
266	D	95.7	Very high	94.1	Very high	90 Å²	90	71.6 Å²	71.6	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-58.8	-46.9	172.5	-175.2	44.6	0	0	0	111.2	M262 G269 G270 Y303	M262-D266 WeakPolarHBondContact O-CB 3.47Å; M262-D266 PolarHBondContact O-N 2.78Å; D266-G269 PolarHBondContact O-N 2.79Å; D266-G270 PolarHBondContact O-N 3.47Å; D266-Y303 HydrophobicContact CB-CD2 4Å; D266-Y303 HydrophobicContact CB-CE2 3.95Å
267	N	92.5	Very high	94.3	Very high	101 Å²	101	75.7 Å²	75.7	54%	0.54	39%	0.387	S	S	.	.	H	α-helix	trans	-66.1	-38.9	176	-71.9	-54.7	0	0	0	112.7	N263 E264 Y265 G270 N271	N263-N267 PolarHBondContact O-N 3.41Å; N263-N267 PolarHBondContact O-ND2 2.74Å; E264-N267 PolarHBondContact O-N 3.37Å; Y265-N267 PolarHBondContact O-N 3.5Å; N267-G270 PolarHBondContact O-N 3.07Å; N267-N271 VanDerWaalsContact O-CG 3.28Å; N267-N271 PolarHBondContact O-N 2.86Å; N267-N271 PolarHBondContact O-ND2 3.18Å
268	A	94	Very high	94.3	Very high	45 Å²	45	74.6 Å²	74.6	37%	0.372	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.1	0	0	0	0	0	111.4	E264 Y265 N271 L272 T299	E264-A268 WeakPolarHBondContact O-CB 3.44Å; E264-A268 PolarHBondContact O-N 2.63Å; Y265-A268 PolarHBondContact O-N 2.95Å; A268-N271 PolarHBondContact O-N 3.32Å; A268-L272 PolarHBondContact O-N 3.03Å; A268-L272 VanDerWaalsContact O-N 3.08Å; A268-T299 HydrophobicContact CB-CG2 3.98Å
269	G	94.6	Very high	94.2	Very high	4 Å²	4	76.3 Å²	76.3	4%	0.041	40%	0.398	C	S	.	.	H	α-helix	trans	-64.2	-44	175.9	0	0	0	0	0	111.8	Y265 D266 N271 L272 I273	Y265-G269 PolarHBondContact O-N 3.44Å; D266-G269 PolarHBondContact O-N 2.79Å; G269-N271 PolarHBondContact O-N 2.85Å; G269-L272 PolarHBondContact O-N 3.05Å; G269-I273 WeakPolarHBondContact O-CG1 3.33Å; G269-I273 PolarHBondContact O-N 3.44Å
270	G	92.8	Very high	94.3	Very high	32 Å²	32	77.7 Å²	77.7	33%	0.33	40%	0.404	S	S	.	.	H	α-helix	trans	-58.8	-43.1	174.6	0	0	0	0	0	113	D266 N267 M274	D266-G270 PolarHBondContact O-N 3.47Å; N267-G270 PolarHBondContact O-N 3.07Å; G270-M274 WeakPolarHBondContact O-CB 3.43Å; G270-M274 WeakPolarHBondContact O-CG 3.33Å; G270-M274 PolarHBondContact O-N 3.39Å
271	N	92.6	Very high	94.5	Very high	117 Å²	117	77.4 Å²	77.4	63%	0.626	40%	0.403	S	S	*	.	H	α-helix	trans	-64.3	-42	176.8	-73.3	-24.6	0	0	0	112.3	N267 A268 G269 M274 D275	N267-N271 VanDerWaalsContact O-CG 3.28Å; N267-N271 PolarHBondContact O-N 2.86Å; N267-N271 PolarHBondContact O-ND2 3.18Å; A268-N271 PolarHBondContact O-N 3.32Å; G269-N271 PolarHBondContact O-N 2.85Å; N271-M274 PolarHBondContact O-N 3.17Å; N271-D275 PolarHBondContact O-N 3.44Å
272	L	93.6	Very high	94.5	Very high	42 Å²	42	77.7 Å²	77.7	22%	0.22	41%	0.409	C	S	.	.	H	α-helix	trans	-65.3	-43.6	179.8	-175.9	66.9	0	0	0	111.9	A268 G269 M274 D275 S276 Q295 Y296	A268-L272 PolarHBondContact O-N 3.03Å; A268-L272 VanDerWaalsContact O-N 3.08Å; G269-L272 PolarHBondContact O-N 3.05Å; L272-M274 VanDerWaalsContact C-N 3.33Å; L272-M274 PolarHBondContact O-N 2.65Å; L272-D275 PolarHBondContact O-N 3.37Å; L272-S276 PolarHBondContact O-N 3.26Å; L272-Q295 HydrophobicContact CD2-CB 3.89Å; L272-Y296 HydrophobicContact CD2-CD2 4.42Å
273	I	94.8	Very high	94.5	Very high	55 Å²	55	77.2 Å²	77.2	28%	0.282	41%	0.407	S	S	.	.	H	α-helix	trans	-59.6	-46.4	174.4	-69.7	166	0	0	0	110.7	G269 D275 S276 L277 Y296	G269-I273 WeakPolarHBondContact O-CG1 3.33Å; G269-I273 PolarHBondContact O-N 3.44Å; I273-D275 VanDerWaalsContact C-N 3.29Å; I273-D275 PolarHBondContact O-N 2.96Å; I273-S276 PolarHBondContact O-N 2.97Å; I273-L277 HydrophobicContact CG2-CD1 3.61Å; I273-L277 HydrophobicContact CG2-CG 4.09Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 WeakPolarHBondContact O-CG 3.36Å; I273-L277 PolarHBondContact O-N 3.44Å; I273-Y296 HydrophobicContact CD1-CD2 4.08Å; I273-Y296 HydrophobicContact CD1-CE1 3.82Å; I273-Y296 HydrophobicContact CD1-CE2 3.33Å; I273-Y296 WeakPolarHBondContact CD1-OH 3.44Å; I273-Y296 HydrophobicContact CG1-CD1 4.41Å; I273-Y296 HydrophobicContact CG1-CD2 3.8Å; I273-Y296 HydrophobicContact CG1-CE1 4.19Å; I273-Y296 HydrophobicContact CG1-CE2 3.59Å; I273-Y296 HydrophobicContact CG1-CG 4.23Å
274	M	94.1	Very high	94.7	Very high	111 Å²	111	79.7 Å²	79.7	55%	0.547	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-40	-178.5	-71.1	-65.3	-74.3	0	0	111.5	G270 N271 L272 I278	G270-M274 WeakPolarHBondContact O-CB 3.43Å; G270-M274 WeakPolarHBondContact O-CG 3.33Å; G270-M274 PolarHBondContact O-N 3.39Å; N271-M274 PolarHBondContact O-N 3.17Å; L272-M274 VanDerWaalsContact C-N 3.33Å; L272-M274 PolarHBondContact O-N 2.65Å; M274-I278 VanDerWaalsContact O-CB 3.3Å; M274-I278 WeakPolarHBondContact O-CB 3.32Å; M274-I278 WeakPolarHBondContact O-CD1 3.45Å; M274-I278 WeakPolarHBondContact O-CG1 3.18Å; M274-I278 PolarHBondContact O-N 2.89Å
275	D	93.4	Very high	94.9	Very high	95 Å²	95	81.5 Å²	81.5	51%	0.508	42%	0.417	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.3	-167.3	43.2	0	0	0	112	N271 L272 I273 L277 N279	N271-D275 PolarHBondContact O-N 3.44Å; L272-D275 PolarHBondContact O-N 3.37Å; I273-D275 VanDerWaalsContact C-N 3.29Å; I273-D275 PolarHBondContact O-N 2.96Å; D275-L277 PolarHBondContact O-N 3.48Å; D275-N279 WeakPolarHBondContact O-CB 3.46Å; D275-N279 PolarHBondContact O-N 3.17Å; D275-N279 VanDerWaalsContact O-N 3.08Å; D275-N279 PolarHBondContact O-ND2 3.42Å; D275-N279 VanDerWaalsContact O-ND2 3.1Å; D275-N279 PolarHBondContact OD1-ND2 2.96Å
276	S	94.5	Very high	95	Very high	28 Å²	28	85 Å²	85	20%	0.196	43%	0.434	C	S	.	.	H	α-helix	trans	-62.9	-41.1	177.8	-173.6	0	0	0	0	112.7	L272 I273 N279 Y280	L272-S276 PolarHBondContact O-N 3.26Å; I273-S276 PolarHBondContact O-N 2.97Å; S276-N279 CarbonylContact O-C 3.51Å; S276-Y280 WeakPolarHBondContact O-CA 3.35Å; S276-Y280 PolarHBondContact O-N 2.94Å; S276-Y280 VanDerWaalsContact O-N 3.14Å
277	L	94	Very high	95	Very high	112 Å²	112	87 Å²	87	59%	0.586	44%	0.444	S	S	*	.	H	α-helix	trans	-77.7	-36	-178.7	-68.7	179.9	0	0	0	113.6	I273 D275 N279	I273-L277 HydrophobicContact CG2-CD1 3.61Å; I273-L277 HydrophobicContact CG2-CG 4.09Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 WeakPolarHBondContact O-CG 3.36Å; I273-L277 PolarHBondContact O-N 3.44Å; D275-L277 PolarHBondContact O-N 3.48Å; L277-N279 VanDerWaalsContact C-N 3.27Å
278	I	94.6	Very high	95.2	Very high	122 Å²	122	85.8 Å²	85.8	63%	0.626	44%	0.438	S	S	*	.	H	α-helix	trans	-66	-37.6	174.6	-71.7	168.7	0	0	0	109.7	M274	M274-I278 VanDerWaalsContact O-CB 3.3Å; M274-I278 WeakPolarHBondContact O-CB 3.32Å; M274-I278 WeakPolarHBondContact O-CD1 3.45Å; M274-I278 WeakPolarHBondContact O-CG1 3.18Å; M274-I278 PolarHBondContact O-N 2.89Å
279	N	94.4	Very high	95.3	Very high	75 Å²	75	87.2 Å²	87.2	40%	0.401	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	30.9	-178.5	-59.2	-55.4	0	0	0	112.9	D275 S276 L277 E281 T282 V283	D275-N279 WeakPolarHBondContact O-CB 3.46Å; D275-N279 PolarHBondContact O-N 3.17Å; D275-N279 VanDerWaalsContact O-N 3.08Å; D275-N279 PolarHBondContact O-ND2 3.42Å; D275-N279 VanDerWaalsContact O-ND2 3.1Å; D275-N279 PolarHBondContact OD1-ND2 2.96Å; S276-N279 CarbonylContact O-C 3.51Å; L277-N279 VanDerWaalsContact C-N 3.27Å; N279-E281 PolarHBondContact O-N 2.9Å; N279-E281 VanDerWaalsContact O-N 3.12Å; N279-T282 WeakPolarHBondContact O-CB 3.4Å; N279-T282 PolarHBondContact O-N 3.15Å; N279-V283 PolarHBondContact O-N 3.35Å
280	Y	94.8	Very high	95.4	Very high	134 Å²	134	94.9 Å²	94.9	53%	0.525	47%	0.472	S	S	.	.	H	α-helix	trans	-58.2	-32.4	-172.4	94.3	-89.6	0	0	0	113.3	S276 T282 V283 K284	S276-Y280 WeakPolarHBondContact O-CA 3.35Å; S276-Y280 PolarHBondContact O-N 2.94Å; S276-Y280 VanDerWaalsContact O-N 3.14Å; Y280-T282 VanDerWaalsContact C-N 3.28Å; Y280-T282 PolarHBondContact O-N 3.28Å; Y280-V283 PolarHBondContact O-N 2.83Å; Y280-K284 HydrophobicContact CD2-CG 3.96Å; Y280-K284 HydrophobicContact CE2-CG 4.34Å; Y280-K284 WeakPolarHBondContact O-CG 3.4Å; Y280-K284 PolarHBondContact O-N 2.67Å
281	E	97.1	Very high	95.6	Very high	105 Å²	105	98.2 Å²	98.2	49%	0.491	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-42.3	178.5	-64	-176.9	166.4	0	0	111	N279 K284 Y285	N279-E281 PolarHBondContact O-N 2.9Å; N279-E281 VanDerWaalsContact O-N 3.12Å; E281-K284 PolarHBondContact O-N 3.44Å; E281-Y285 HydrophobicContact CB-CE2 4.12Å; E281-Y285 VanDerWaalsContact O-CD2 3.25Å; E281-Y285 WeakPolarHBondContact O-CD2 3.43Å; E281-Y285 PolarHBondContact O-N 3.25Å
282	T	96.9	Very high	95.8	Very high	74 Å²	74	94.9 Å²	94.9	45%	0.454	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-46	177.6	-59	0	0	0	0	110.4	N279 Y280 K284 Y285 F286	N279-T282 WeakPolarHBondContact O-CB 3.4Å; N279-T282 PolarHBondContact O-N 3.15Å; Y280-T282 VanDerWaalsContact C-N 3.28Å; Y280-T282 PolarHBondContact O-N 3.28Å; T282-K284 PolarHBondContact O-N 3.31Å; T282-Y285 PolarHBondContact O-N 3.07Å; T282-F286 HydrophobicContact CG2-CD2 3.98Å; T282-F286 HydrophobicContact CG2-CE2 4.01Å; T282-F286 VanDerWaalsContact O-CD2 3.27Å; T282-F286 WeakPolarHBondContact O-CD2 3.5Å; T282-F286 PolarHBondContact O-N 2.91Å
283	V	97.3	Very high	96	Very high	18 Å²	18	95.5 Å²	95.5	11%	0.109	47%	0.469	C	S	.	.	H	α-helix	trans	-56.9	-41.3	177.2	-176	0	0	0	0	110.8	N279 Y280 F286 N287 N288 E289 E292	N279-V283 PolarHBondContact O-N 3.35Å; Y280-V283 PolarHBondContact O-N 2.83Å; V283-F286 PolarHBondContact O-N 2.93Å; V283-N287 PolarHBondContact O-N 3.47Å; V283-N287 VanDerWaalsContact O-N 3.09Å; V283-N288 PolarHBondContact O-N 3.49Å; V283-N288 VanDerWaalsContact O-N 3.16Å; V283-E289 HydrophobicContact CG1-CG 4Å; V283-E292 HydrophobicContact CG1-CG 4.08Å; V283-E292 HydrophobicContact CG2-CG 4.09Å
284	K	97.4	Very high	96.1	Very high	114 Å²	114	98.1 Å²	98.1	50%	0.496	48%	0.483	S	S	.	.	H	α-helix	trans	-70.6	-37.7	177.7	-71.4	-70.5	174.8	-169.6	0	113.8	Y280 E281 T282 F286 N287 E289	Y280-K284 HydrophobicContact CD2-CG 3.96Å; Y280-K284 HydrophobicContact CE2-CG 4.34Å; Y280-K284 WeakPolarHBondContact O-CG 3.4Å; Y280-K284 PolarHBondContact O-N 2.67Å; E281-K284 PolarHBondContact O-N 3.44Å; T282-K284 PolarHBondContact O-N 3.31Å; K284-F286 PolarHBondContact O-N 3.39Å; K284-N287 PolarHBondContact O-N 3.05Å; K284-N287 PolarHBondContact O-OD1 3.45Å; K284-N287 VanDerWaalsContact O-OD1 3.06Å; K284-E289 VanDerWaalsContact CD-OE1 3.28Å; K284-E289 WeakPolarHBondContact CD-OE1 3.27Å; K284-E289 VanDerWaalsContact CE-OE1 3.28Å; K284-E289 WeakPolarHBondContact CE-OE1 3.21Å; K284-E289 IonicContact NZ-OE1 2.65Å; K284-E289 PolarHBondContact NZ-OE1 2.96Å
285	Y	97.5	Very high	96.2	Very high	170 Å²	170	96.5 Å²	96.5	67%	0.667	47%	0.474	S	S	*	.	H	α-helix	trans	-62.7	-28.4	176.6	-65.3	-31	0	0	0	112.8	E281 T282	E281-Y285 HydrophobicContact CB-CE2 4.12Å; E281-Y285 VanDerWaalsContact O-CD2 3.25Å; E281-Y285 WeakPolarHBondContact O-CD2 3.43Å; E281-Y285 PolarHBondContact O-N 3.25Å; T282-Y285 PolarHBondContact O-N 3.07Å
286	F	97.7	Very high	96.3	Very high	142 Å²	142	95.6 Å²	95.6	62%	0.623	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	2.3	-179.6	-67.3	-77.3	0	0	0	114.2	T282 V283 K284 N288	T282-F286 HydrophobicContact CG2-CD2 3.98Å; T282-F286 HydrophobicContact CG2-CE2 4.01Å; T282-F286 VanDerWaalsContact O-CD2 3.27Å; T282-F286 WeakPolarHBondContact O-CD2 3.5Å; T282-F286 PolarHBondContact O-N 2.91Å; V283-F286 PolarHBondContact O-N 2.93Å; K284-F286 PolarHBondContact O-N 3.39Å; F286-N288 HydrophobicContact CB-CB 4.35Å; F286-N288 PolarHBondContact O-N 3.05Å
287	N	96.6	Very high	96.5	Very high	130 Å²	130	96.9 Å²	96.9	70%	0.695	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	39.6	-176.5	-61.8	27.8	0	0	0	113.3	V283 K284 E289	V283-N287 PolarHBondContact O-N 3.47Å; V283-N287 VanDerWaalsContact O-N 3.09Å; K284-N287 PolarHBondContact O-N 3.05Å; K284-N287 PolarHBondContact O-OD1 3.45Å; K284-N287 VanDerWaalsContact O-OD1 3.06Å; N287-E289 WeakPolarHBondContact CA-OE2 3.18Å
288	N	95.9	Very high	96.6	Very high	76 Å²	76	98 Å²	98	41%	0.406	47%	0.469	S	S	.	.			trans	-103.4	25.7	-169.8	-89.9	-18.4	0	0	0	113.8	V283 F286 E290 F291 E292	V283-N288 PolarHBondContact O-N 3.49Å; V283-N288 VanDerWaalsContact O-N 3.16Å; F286-N288 HydrophobicContact CB-CB 4.35Å; F286-N288 PolarHBondContact O-N 3.05Å; N288-E290 VanDerWaalsContact C-N 3.3Å; N288-E290 PolarHBondContact O-N 3.46Å; N288-F291 HydrophobicContact CB-CB 4.22Å; N288-F291 WeakPolarHBondContact O-CB 3.31Å; N288-F291 PolarHBondContact O-N 3.32Å; N288-E292 PolarHBondContact O-N 3.4Å; N288-E292 VanDerWaalsContact O-N 3.12Å
289	E	96.6	Very high	96.7	Very high	76 Å²	76	93.5 Å²	93.5	36%	0.355	45%	0.447	S	S	.	.	H	α-helix	trans	-58.2	-40.1	-179.4	-64.3	92.1	146.1	0	0	112.7	V283 K284 N287 F291 E292 A293	V283-E289 HydrophobicContact CG1-CG 4Å; K284-E289 VanDerWaalsContact CD-OE1 3.28Å; K284-E289 WeakPolarHBondContact CD-OE1 3.27Å; K284-E289 VanDerWaalsContact CE-OE1 3.28Å; K284-E289 WeakPolarHBondContact CE-OE1 3.21Å; K284-E289 IonicContact NZ-OE1 2.65Å; K284-E289 PolarHBondContact NZ-OE1 2.96Å; N287-E289 WeakPolarHBondContact CA-OE2 3.18Å; E289-F291 VanDerWaalsContact C-N 3.31Å; E289-F291 PolarHBondContact O-N 2.92Å; E289-E292 PolarHBondContact O-N 3.23Å; E289-A293 WeakPolarHBondContact O-CB 3.33Å; E289-A293 PolarHBondContact O-N 2.88Å
290	E	97.6	Very high	96.8	Very high	164 Å²	164	93 Å²	93	77%	0.766	44%	0.444	S	S	*	.	H	α-helix	trans	-66.3	-34.7	176.4	-70.6	-162.6	171.1	0	0	112.2	N288 A293 L294	N288-E290 VanDerWaalsContact C-N 3.3Å; N288-E290 PolarHBondContact O-N 3.46Å; E290-A293 PolarHBondContact O-N 2.92Å; E290-L294 WeakPolarHBondContact O-CB 3.42Å; E290-L294 VanDerWaalsContact O-CG 3.24Å; E290-L294 WeakPolarHBondContact O-CG 3.35Å; E290-L294 PolarHBondContact O-N 2.93Å
291	F	97	Very high	97	Very high	102 Å²	102	93.5 Å²	93.5	45%	0.447	45%	0.445	S	S	.	.	H	α-helix	trans	-64	-48.1	176.3	175.2	-93.8	0	0	0	110.9	N288 E289 A293 L294 Q295	N288-F291 HydrophobicContact CB-CB 4.22Å; N288-F291 WeakPolarHBondContact O-CB 3.31Å; N288-F291 PolarHBondContact O-N 3.32Å; E289-F291 VanDerWaalsContact C-N 3.31Å; E289-F291 PolarHBondContact O-N 2.92Å; F291-A293 VanDerWaalsContact C-N 3.32Å; F291-A293 PolarHBondContact O-N 2.99Å; F291-L294 PolarHBondContact O-N 3.48Å; F291-Q295 HydrophobicContact CD1-CG 4.38Å; F291-Q295 HydrophobicContact CE1-CG 3.93Å; F291-Q295 HydrophobicContact CZ-CG 4.08Å; F291-Q295 WeakPolarHBondContact O-CG 3.36Å; F291-Q295 PolarHBondContact O-N 3.3Å
292	E	96.5	Very high	97	Very high	48 Å²	48	92 Å²	92	22%	0.224	44%	0.438	C	S	.	.	H	α-helix	trans	-62.7	-40	176	-66.6	-56.1	149	0	0	111.8	V283 N288 E289 L294 Q295 Y296	V283-E292 HydrophobicContact CG1-CG 4.08Å; V283-E292 HydrophobicContact CG2-CG 4.09Å; N288-E292 PolarHBondContact O-N 3.4Å; N288-E292 VanDerWaalsContact O-N 3.12Å; E289-E292 PolarHBondContact O-N 3.23Å; E292-L294 VanDerWaalsContact C-N 3.33Å; E292-L294 PolarHBondContact O-N 2.92Å; E292-Q295 PolarHBondContact O-N 2.86Å; E292-Y296 PolarHBondContact O-N 2.77Å
293	A	96.7	Very high	97	Very high	55 Å²	55	92.1 Å²	92.1	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-61	-40.4	174.9	0	0	0	0	0	112.2	E289 E290 F291 Y296 D297	E289-A293 WeakPolarHBondContact O-CB 3.33Å; E289-A293 PolarHBondContact O-N 2.88Å; E290-A293 PolarHBondContact O-N 2.92Å; F291-A293 VanDerWaalsContact C-N 3.32Å; F291-A293 PolarHBondContact O-N 2.99Å; A293-Y296 PolarHBondContact O-N 3.32Å; A293-D297 WeakPolarHBondContact O-CB 3.47Å; A293-D297 PolarHBondContact O-N 2.93Å
294	L	97.6	Very high	97.1	Very high	110 Å²	110	96.8 Å²	96.8	58%	0.576	45%	0.451	S	S	*	.	H	α-helix	trans	-68	-37.4	176.1	-72.9	169.9	0	0	0	112.6	E290 F291 E292 Y296 D297 K298	E290-L294 WeakPolarHBondContact O-CB 3.42Å; E290-L294 VanDerWaalsContact O-CG 3.24Å; E290-L294 WeakPolarHBondContact O-CG 3.35Å; E290-L294 PolarHBondContact O-N 2.93Å; F291-L294 PolarHBondContact O-N 3.48Å; E292-L294 VanDerWaalsContact C-N 3.33Å; E292-L294 PolarHBondContact O-N 2.92Å; L294-Y296 VanDerWaalsContact C-N 3.3Å; L294-D297 PolarHBondContact O-N 3Å; L294-K298 PolarHBondContact O-N 3.44Å; L294-K298 VanDerWaalsContact O-N 3.13Å
295	Q	95.6	Very high	97.1	Very high	76 Å²	76	95.8 Å²	95.8	36%	0.355	45%	0.449	S	S	.	.	H	α-helix	trans	-63.3	-40.7	173	-65.7	-53.7	-34.5	0	0	111.1	L272 F291 E292	L272-Q295 HydrophobicContact CD2-CB 3.89Å; F291-Q295 HydrophobicContact CD1-CG 4.38Å; F291-Q295 HydrophobicContact CE1-CG 3.93Å; F291-Q295 HydrophobicContact CZ-CG 4.08Å; F291-Q295 WeakPolarHBondContact O-CG 3.36Å; F291-Q295 PolarHBondContact O-N 3.3Å; E292-Q295 PolarHBondContact O-N 2.86Å
296	Y	96.7	Very high	97.1	Very high	76 Å²	76	87.9 Å²	87.9	30%	0.298	42%	0.419	S	S	.	.	H	α-helix	trans	-68	-44.3	176.9	-177.3	-126.2	0	0	0	112.4	L272 I273 E292 A293 L294 K298 T299 L300	L272-Y296 HydrophobicContact CD2-CD2 4.42Å; I273-Y296 HydrophobicContact CD1-CD2 4.08Å; I273-Y296 HydrophobicContact CD1-CE1 3.82Å; I273-Y296 HydrophobicContact CD1-CE2 3.33Å; I273-Y296 WeakPolarHBondContact CD1-OH 3.44Å; I273-Y296 HydrophobicContact CG1-CD1 4.41Å; I273-Y296 HydrophobicContact CG1-CD2 3.8Å; I273-Y296 HydrophobicContact CG1-CE1 4.19Å; I273-Y296 HydrophobicContact CG1-CE2 3.59Å; I273-Y296 HydrophobicContact CG1-CG 4.23Å; E292-Y296 PolarHBondContact O-N 2.77Å; A293-Y296 PolarHBondContact O-N 3.32Å; L294-Y296 VanDerWaalsContact C-N 3.3Å; Y296-K298 VanDerWaalsContact C-N 3.25Å; Y296-K298 PolarHBondContact O-N 3.11Å; Y296-T299 PolarHBondContact O-N 3.48Å; Y296-L300 HydrophobicContact CD1-CD1 3.84Å; Y296-L300 HydrophobicContact CD1-CG 4.24Å; Y296-L300 HydrophobicContact CD2-CG 4.45Å; Y296-L300 HydrophobicContact CE1-CD1 3.51Å; Y296-L300 HydrophobicContact CE1-CD2 4.15Å; Y296-L300 HydrophobicContact CE1-CG 3.9Å; Y296-L300 HydrophobicContact CE2-CD2 4.08Å; Y296-L300 HydrophobicContact CE2-CG 4.09Å; Y296-L300 PolarHBondContact O-N 3.47Å
297	D	97.9	Very high	97.1	Very high	55 Å²	55	82.6 Å²	82.6	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-56.8	-37.9	176.7	-173.6	62.8	0	0	0	112.3	A293 L294 T299 L300 R301	A293-D297 WeakPolarHBondContact O-CB 3.47Å; A293-D297 PolarHBondContact O-N 2.93Å; L294-D297 PolarHBondContact O-N 3Å; D297-T299 VanDerWaalsContact C-N 3.3Å; D297-T299 PolarHBondContact O-N 2.94Å; D297-L300 WeakPolarHBondContact O-CB 3.37Å; D297-L300 PolarHBondContact O-N 3.08Å; D297-R301 WeakPolarHBondContact O-CG 3.33Å; D297-R301 PolarHBondContact O-N 3.14Å; D297-R301 IonicContact OD2-CZ 3.81Å; D297-R301 IonicContact OD2-NE 2.71Å; D297-R301 PolarHBondContact OD2-NE 3.4Å; D297-R301 IonicContact OD2-NH2 3.75Å; D297-R301 PolarHBondContact OD2-NH2 3.16Å
298	K	96.9	Very high	97.2	Very high	137 Å²	137	81 Å²	81	60%	0.596	39%	0.39	S	S	*	.	H	α-helix	trans	-57.5	-42.9	173.8	-174.4	-177.9	178.1	-176.1	0	112.3	L294 Y296 E302	L294-K298 PolarHBondContact O-N 3.44Å; L294-K298 VanDerWaalsContact O-N 3.13Å; Y296-K298 VanDerWaalsContact C-N 3.25Å; Y296-K298 PolarHBondContact O-N 3.11Å; K298-E302 PolarHBondContact O-N 2.89Å
299	T	95.8	Very high	97.3	Very high	26 Å²	26	82.9 Å²	82.9	16%	0.16	39%	0.392	C	S	.	.	H	α-helix	trans	-72.7	-35.2	178.4	-53.5	0	0	0	0	111.3	Y265 A268 Y296 D297 E302 Y303	Y265-T299 WeakPolarHBondContact O-CG2 3.36Å; A268-T299 HydrophobicContact CB-CG2 3.98Å; Y296-T299 PolarHBondContact O-N 3.48Å; D297-T299 VanDerWaalsContact C-N 3.3Å; D297-T299 PolarHBondContact O-N 2.94Å; T299-E302 PolarHBondContact O-N 3.41Å; T299-Y303 WeakPolarHBondContact O-CB 3.26Å; T299-Y303 PolarHBondContact O-N 3.01Å
300	L	97.7	Very high	97.3	Very high	64 Å²	64	80.1 Å²	80.1	34%	0.335	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-39.4	174.3	-73.4	-179.2	0	0	0	112.8	Y296 D297 Y303 E304	Y296-L300 HydrophobicContact CD1-CD1 3.84Å; Y296-L300 HydrophobicContact CD1-CG 4.24Å; Y296-L300 HydrophobicContact CD2-CG 4.45Å; Y296-L300 HydrophobicContact CE1-CD1 3.51Å; Y296-L300 HydrophobicContact CE1-CD2 4.15Å; Y296-L300 HydrophobicContact CE1-CG 3.9Å; Y296-L300 HydrophobicContact CE2-CD2 4.08Å; Y296-L300 HydrophobicContact CE2-CG 4.09Å; Y296-L300 PolarHBondContact O-N 3.47Å; D297-L300 WeakPolarHBondContact O-CB 3.37Å; D297-L300 PolarHBondContact O-N 3.08Å; L300-Y303 WeakPolarHBondContact O-CB 3.48Å; L300-Y303 PolarHBondContact O-N 2.91Å; L300-E304 WeakPolarHBondContact O-CB 3.48Å; L300-E304 PolarHBondContact O-N 3.46Å
301	R	98.1	Very high	97.3	Very high	145 Å²	145	75.7 Å²	75.7	55%	0.547	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-44.4	176.2	-70.5	177.2	-165.2	173.1	2	112.2	D297 Y303 E304 E305	D297-R301 WeakPolarHBondContact O-CG 3.33Å; D297-R301 PolarHBondContact O-N 3.14Å; D297-R301 IonicContact OD2-CZ 3.81Å; D297-R301 IonicContact OD2-NE 2.71Å; D297-R301 PolarHBondContact OD2-NE 3.4Å; D297-R301 IonicContact OD2-NH2 3.75Å; D297-R301 PolarHBondContact OD2-NH2 3.16Å; R301-Y303 VanDerWaalsContact C-N 3.33Å; R301-Y303 PolarHBondContact O-N 3.46Å; R301-E304 WeakPolarHBondContact O-CB 3.12Å; R301-E304 PolarHBondContact O-N 3.13Å; R301-E305 PolarHBondContact O-N 3.3Å
302	E	97.2	Very high	97.4	Very high	74 Å²	74	75 Å²	75	35%	0.346	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-40.8	175.5	-67.3	-70.7	153.5	0	0	111.8	Y265 K298 T299 A306	Y265-E302 HydrophobicContact CD1-CB 3.66Å; Y265-E302 HydrophobicContact CD1-CG 4.44Å; Y265-E302 HydrophobicContact CD2-CB 4.01Å; Y265-E302 HydrophobicContact CE1-CB 3.6Å; Y265-E302 HydrophobicContact CE1-CG 4.01Å; Y265-E302 HydrophobicContact CE2-CB 3.95Å; Y265-E302 HydrophobicContact CG-CB 3.86Å; Y265-E302 PolarHBondContact OH-OE2 3.41Å; K298-E302 PolarHBondContact O-N 2.89Å; T299-E302 PolarHBondContact O-N 3.41Å; E302-A306 WeakPolarHBondContact O-CB 3.46Å; E302-A306 PolarHBondContact O-N 2.59Å
303	Y	97.5	Very high	97.4	Very high	77 Å²	77	72.9 Å²	72.9	30%	0.302	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-45.8	172.3	171.4	-93.5	0	0	0	111.9	M262 D266 T299 L300 R301 A306 S307	M262-Y303 HydrophobicContact CG-CD2 3.87Å; M262-Y303 HydrophobicContact CG-CE2 3.55Å; M262-Y303 WeakPolarHBondContact O-CD2 3.32Å; M262-Y303 HydrophobicContact SD-CE2 4.4Å; D266-Y303 HydrophobicContact CB-CD2 4Å; D266-Y303 HydrophobicContact CB-CE2 3.95Å; T299-Y303 WeakPolarHBondContact O-CB 3.26Å; T299-Y303 PolarHBondContact O-N 3.01Å; L300-Y303 WeakPolarHBondContact O-CB 3.48Å; L300-Y303 PolarHBondContact O-N 2.91Å; R301-Y303 VanDerWaalsContact C-N 3.33Å; R301-Y303 PolarHBondContact O-N 3.46Å; Y303-A306 PolarHBondContact O-N 3.2Å; Y303-S307 WeakPolarHBondContact O-CB 3.48Å; Y303-S307 PolarHBondContact O-N 3.1Å
304	E	98.2	Very high	97.3	Very high	115 Å²	115	73.8 Å²	73.8	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-58.4	-50.5	178.3	-177.9	-177.4	-176.1	0	0	110.5	L300 R301 A306 S307 L308	L300-E304 WeakPolarHBondContact O-CB 3.48Å; L300-E304 PolarHBondContact O-N 3.46Å; R301-E304 WeakPolarHBondContact O-CB 3.12Å; R301-E304 PolarHBondContact O-N 3.13Å; E304-A306 PolarHBondContact O-N 2.82Å; E304-S307 WeakPolarHBondContact O-CB 3.36Å; E304-S307 PolarHBondContact O-N 3.24Å; E304-L308 HydrophobicContact CG-CD1 4.03Å; E304-L308 HydrophobicContact CG-CG 4.36Å; E304-L308 WeakPolarHBondContact O-CB 3.47Å; E304-L308 VanDerWaalsContact O-CG 3.28Å; E304-L308 WeakPolarHBondContact O-CG 3.38Å; E304-L308 PolarHBondContact O-N 2.94Å
305	E	98	Very high	97.2	Very high	93 Å²	93	71.3 Å²	71.3	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-58.3	-46.3	176.9	-74.4	-165.5	-162.3	0	0	112.3	R301 S307 L308 R309	R301-E305 PolarHBondContact O-N 3.3Å; E305-S307 VanDerWaalsContact C-N 3.32Å; E305-S307 PolarHBondContact O-N 3.45Å; E305-L308 PolarHBondContact O-N 2.9Å; E305-R309 VanDerWaalsContact O-CG 3.32Å; E305-R309 WeakPolarHBondContact O-CG 3.43Å; E305-R309 PolarHBondContact O-N 3.09Å; E305-R309 IonicContact OE2-NH2 3.89Å; E305-R309 PolarHBondContact OE2-NH2 3.07Å; E305-R309 VanDerWaalsContact OE2-NH2 3.09Å
306	A	97.9	Very high	97.3	Very high	5 Å²	5	73 Å²	73	4%	0.041	36%	0.361	C	S	.	.	H	α-helix	trans	-66.1	-35	178.2	0	0	0	0	0	112.2	M261 M262 Y265 E302 Y303 E304 T310	M261-A306 HydrophobicContact CB-CB 4.44Å; M262-A306 HydrophobicContact CB-CB 3.91Å; Y265-A306 HydrophobicContact CD2-CB 4.08Å; Y265-A306 HydrophobicContact CE2-CB 4.36Å; E302-A306 WeakPolarHBondContact O-CB 3.46Å; E302-A306 PolarHBondContact O-N 2.59Å; Y303-A306 PolarHBondContact O-N 3.2Å; E304-A306 PolarHBondContact O-N 2.82Å; A306-T310 WeakPolarHBondContact O-CB 3.39Å; A306-T310 PolarHBondContact O-N 3.35Å; A306-T310 PolarHBondContact O-OG1 3.33Å
307	S	98.2	Very high	97.2	Very high	30 Å²	30	70 Å²	70	21%	0.21	35%	0.35	C	S	.	.	H	α-helix	trans	-69.8	-41.8	175.9	-176.5	0	0	0	0	111.8	Y303 E304 E305 T310 S311	Y303-S307 WeakPolarHBondContact O-CB 3.48Å; Y303-S307 PolarHBondContact O-N 3.1Å; E304-S307 WeakPolarHBondContact O-CB 3.36Å; E304-S307 PolarHBondContact O-N 3.24Å; E305-S307 VanDerWaalsContact C-N 3.32Å; E305-S307 PolarHBondContact O-N 3.45Å; S307-T310 CarbonylContact O-C 3.59Å; S307-T310 WeakPolarHBondContact O-CB 3.38Å; S307-T310 PolarHBondContact O-N 2.79Å; S307-S311 PolarHBondContact O-N 3.14Å; S307-S311 PolarHBondContact O-OG 3.06Å; S307-S311 VanDerWaalsContact O-OG 3.06Å
308	L	98.2	Very high	97	Very high	98 Å²	98	70.8 Å²	70.8	51%	0.513	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-44.3	173.6	-72.8	173	0	0	0	111.2	E304 E305 T310 S311 T312	E304-L308 HydrophobicContact CG-CD1 4.03Å; E304-L308 HydrophobicContact CG-CG 4.36Å; E304-L308 WeakPolarHBondContact O-CB 3.47Å; E304-L308 VanDerWaalsContact O-CG 3.28Å; E304-L308 WeakPolarHBondContact O-CG 3.38Å; E304-L308 PolarHBondContact O-N 2.94Å; E305-L308 PolarHBondContact O-N 2.9Å; L308-T310 VanDerWaalsContact C-N 3.3Å; L308-T310 PolarHBondContact O-N 3.2Å; L308-S311 PolarHBondContact O-N 2.7Å; L308-T312 WeakPolarHBondContact O-CB 3.26Å; L308-T312 WeakPolarHBondContact O-CG2 3.32Å; L308-T312 PolarHBondContact O-N 3.27Å; L308-T312 PolarHBondContact O-OG1 3.43Å
309	R	98.3	Very high	97	Very high	114 Å²	114	70.8 Å²	70.8	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-37.6	172.9	-69.5	176.6	-162.6	175.1	11.8	111.9	F258 E305 S311 T312 S313	F258-R309 HydrophobicContact CB-CB 4.38Å; F258-R309 HydrophobicContact CD1-CB 4.18Å; F258-R309 HydrophobicContact CD2-CB 4.47Å; F258-R309 HydrophobicContact CG-CB 4.1Å; E305-R309 VanDerWaalsContact O-CG 3.32Å; E305-R309 WeakPolarHBondContact O-CG 3.43Å; E305-R309 PolarHBondContact O-N 3.09Å; E305-R309 IonicContact OE2-NH2 3.89Å; E305-R309 PolarHBondContact OE2-NH2 3.07Å; E305-R309 VanDerWaalsContact OE2-NH2 3.09Å; R309-S311 VanDerWaalsContact C-N 3.35Å; R309-T312 WeakPolarHBondContact CA-OG1 3.49Å; R309-T312 PolarHBondContact O-OG1 3.02Å; R309-S313 WeakPolarHBondContact O-CB 3.33Å; R309-S313 PolarHBondContact O-N 3.4Å; R309-S313 PolarHBondContact O-OG 3.49Å
310	T	96.8	Very high	97	Very high	18 Å²	18	70.1 Å²	70.1	11%	0.11	35%	0.352	C	S	.	.	H	α-helix	trans	-66.9	-34.9	174.1	-62.5	0	0	0	0	111.7	R255 M262 A306 S307 L308 S313	R255-T310 PolarHBondContact NH2-O 3.23Å; M262-T310 HydrophobicContact SD-CG2 4.33Å; A306-T310 WeakPolarHBondContact O-CB 3.39Å; A306-T310 PolarHBondContact O-N 3.35Å; A306-T310 PolarHBondContact O-OG1 3.33Å; S307-T310 CarbonylContact O-C 3.59Å; S307-T310 WeakPolarHBondContact O-CB 3.38Å; S307-T310 PolarHBondContact O-N 2.79Å; L308-T310 VanDerWaalsContact C-N 3.3Å; L308-T310 PolarHBondContact O-N 3.2Å; T310-S313 PolarHBondContact O-OG 3.22Å
311	S	97.5	Very high	96.9	Very high	72 Å²	72	67.2 Å²	67.2	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-77.1	-46.6	178.8	-62.5	0	0	0	0	111.9	S307 L308 R309 S313 L314 A315	S307-S311 PolarHBondContact O-N 3.14Å; S307-S311 PolarHBondContact O-OG 3.06Å; S307-S311 VanDerWaalsContact O-OG 3.06Å; L308-S311 PolarHBondContact O-N 2.7Å; R309-S311 VanDerWaalsContact C-N 3.35Å; S311-S313 PolarHBondContact O-N 3.02Å; S311-L314 WeakPolarHBondContact O-CB 3.41Å; S311-L314 PolarHBondContact O-N 3.44Å; S311-A315 PolarHBondContact O-N 3.35Å; S311-A315 VanDerWaalsContact O-N 3.1Å
312	T	98	Very high	96.8	Very high	88 Å²	88	64.9 Å²	64.9	54%	0.54	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-39.3	179.2	51.4	0	0	0	0	112.5	L308 R309 L314 A315 F316	L308-T312 WeakPolarHBondContact O-CB 3.26Å; L308-T312 WeakPolarHBondContact O-CG2 3.32Å; L308-T312 PolarHBondContact O-N 3.27Å; L308-T312 PolarHBondContact O-OG1 3.43Å; R309-T312 WeakPolarHBondContact CA-OG1 3.49Å; R309-T312 PolarHBondContact O-OG1 3.02Å; T312-L314 PolarHBondContact O-N 3.05Å; T312-A315 PolarHBondContact O-N 3.36Å; T312-F316 PolarHBondContact O-N 3.36Å
313	S	96.8	Very high	96.8	Very high	3 Å²	3	64.4 Å²	64.4	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-20.8	173.7	60.7	0	0	0	0	113.8	R255 R309 T310 S311 L317	R255-S313 PolarHBondContact NH2-OG 2.94Å; R309-S313 WeakPolarHBondContact O-CB 3.33Å; R309-S313 PolarHBondContact O-N 3.4Å; R309-S313 PolarHBondContact O-OG 3.49Å; T310-S313 PolarHBondContact O-OG 3.22Å; S311-S313 PolarHBondContact O-N 3.02Å; S313-L317 PolarHBondContact O-N 3.09Å
314	L	94.4	Very high	96.8	Very high	73 Å²	73	62.1 Å²	62.1	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-78.1	-43.6	172.3	-178	57.8	0	0	0	110.1	R255 S311 T312 F316 L317 N318	R255-L314 VanDerWaalsContact NH2-CB 3.34Å; S311-L314 WeakPolarHBondContact O-CB 3.41Å; S311-L314 PolarHBondContact O-N 3.44Å; T312-L314 PolarHBondContact O-N 3.05Å; L314-F316 VanDerWaalsContact C-N 3.29Å; L314-F316 PolarHBondContact O-N 3.49Å; L314-L317 HydrophobicContact CD1-CD2 4.43Å; L314-L317 WeakPolarHBondContact O-CB 3.28Å; L314-L317 PolarHBondContact O-N 3.33Å; L314-N318 PolarHBondContact O-N 2.68Å
315	A	96.5	Very high	96.6	Very high	58 Å²	58	57 Å²	57	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-58.2	-43.4	175.2	0	0	0	0	0	111.4	S311 T312 L317 N318 F319	S311-A315 PolarHBondContact O-N 3.35Å; S311-A315 VanDerWaalsContact O-N 3.1Å; T312-A315 PolarHBondContact O-N 3.36Å; A315-L317 PolarHBondContact O-N 3.36Å; A315-N318 PolarHBondContact O-N 2.97Å; A315-F319 WeakPolarHBondContact O-CB 3.47Å; A315-F319 PolarHBondContact O-N 3.04Å
316	F	97.2	Very high	96.5	Very high	113 Å²	113	56 Å²	56	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-59.9	-44.4	174.4	179.4	-97.6	0	0	0	112.7	F247 V251 T312 L314 F319 G320	F247-F316 HydrophobicContact CE2-CE1 4.26Å; F247-F316 HydrophobicContact CZ-CE1 4.15Å; V251-F316 HydrophobicContact CG1-CD1 4.18Å; V251-F316 HydrophobicContact CG2-CE1 4.22Å; T312-F316 PolarHBondContact O-N 3.36Å; L314-F316 VanDerWaalsContact C-N 3.29Å; L314-F316 PolarHBondContact O-N 3.49Å; F316-F319 PolarHBondContact O-N 3.33Å; F316-G320 PolarHBondContact O-N 3.21Å
317	L	94.6	Very high	96.5	Very high	12 Å²	12	60.4 Å²	60.4	6%	0.063	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-51.5	176.3	173.9	62.8	0	0	0	110.9	F247 T248 V251 S313 L314 A315 F319 G320 Q321	F247-L317 HydrophobicContact CD1-CD1 4.34Å; F247-L317 HydrophobicContact CE1-CD1 3.91Å; T248-L317 HydrophobicContact CG2-CD1 4.43Å; V251-L317 HydrophobicContact CB-CD1 4.03Å; V251-L317 HydrophobicContact CG1-CB 3.93Å; V251-L317 HydrophobicContact CG1-CD1 3.95Å; V251-L317 HydrophobicContact CG1-CG 4.43Å; S313-L317 PolarHBondContact O-N 3.09Å; L314-L317 HydrophobicContact CD1-CD2 4.43Å; L314-L317 WeakPolarHBondContact O-CB 3.28Å; L314-L317 PolarHBondContact O-N 3.33Å; A315-L317 PolarHBondContact O-N 3.36Å; L317-F319 VanDerWaalsContact C-N 3.33Å; L317-F319 PolarHBondContact O-N 2.68Å; L317-G320 PolarHBondContact O-N 3.19Å; L317-Q321 HydrophobicContact CD1-CG 4.08Å; L317-Q321 WeakPolarHBondContact O-CB 3.33Å; L317-Q321 VanDerWaalsContact O-CG 3.26Å; L317-Q321 WeakPolarHBondContact O-CG 3.34Å; L317-Q321 PolarHBondContact O-N 3.37Å
318	N	94.2	Very high	96.5	Very high	72 Å²	72	59.4 Å²	59.4	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-41.8	-179.9	-67.7	-16.2	0	0	0	111.7	L314 A315 N322	L314-N318 PolarHBondContact O-N 2.68Å; A315-N318 PolarHBondContact O-N 2.97Å; N318-N322 WeakPolarHBondContact O-CB 3.32Å; N318-N322 PolarHBondContact O-N 3.39Å; N318-N322 PolarHBondContact O-ND2 2.98Å
319	F	96.7	Very high	96.4	Very high	137 Å²	137	56.7 Å²	56.7	60%	0.601	32%	0.315	S	S	*	.	H	α-helix	trans	-63.7	-49.8	176.8	178.7	-107.2	0	0	0	111.6	A315 F316 L317 Q321 N322 V323	A315-F319 WeakPolarHBondContact O-CB 3.47Å; A315-F319 PolarHBondContact O-N 3.04Å; F316-F319 PolarHBondContact O-N 3.33Å; L317-F319 VanDerWaalsContact C-N 3.33Å; L317-F319 PolarHBondContact O-N 2.68Å; F319-Q321 VanDerWaalsContact C-N 3.31Å; F319-Q321 PolarHBondContact O-N 3.06Å; F319-N322 PolarHBondContact O-N 3.11Å; F319-N322 VanDerWaalsContact O-N 3.16Å; F319-V323 HydrophobicContact CD1-CG2 4.21Å; F319-V323 HydrophobicContact CD2-CG2 4.4Å; F319-V323 HydrophobicContact CE1-CG2 3.78Å; F319-V323 HydrophobicContact CE2-CG2 3.99Å; F319-V323 HydrophobicContact CZ-CG2 3.66Å; F319-V323 WeakPolarHBondContact O-CG2 3.02Å; F319-V323 PolarHBondContact O-N 2.98Å
320	G	96.1	Very high	96.3	Very high	12 Å²	12	53.7 Å²	53.7	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-38.6	178.6	0	0	0	0	0	112.9	F316 L317 V323 I324	F316-G320 PolarHBondContact O-N 3.21Å; L317-G320 PolarHBondContact O-N 3.19Å; G320-V323 PolarHBondContact O-N 3.21Å; G320-I324 VanDerWaalsContact O-CG1 3.28Å; G320-I324 WeakPolarHBondContact O-CG1 3.48Å; G320-I324 PolarHBondContact O-N 3Å
321	Q	95.2	Very high	96.3	Very high	2 Å²	2	54 Å²	54	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-45.6	173.1	-77.7	178.1	-26.1	0	0	112.3	Y244 F247 T248 L317 F319 I324 F325	Y244-Q321 HydrophobicContact CD2-CB 4.3Å; Y244-Q321 HydrophobicContact CD2-CG 4.18Å; Y244-Q321 HydrophobicContact CE1-CG 4.44Å; Y244-Q321 HydrophobicContact CE2-CB 3.5Å; Y244-Q321 VanDerWaalsContact CE2-CB 3.5Å; Y244-Q321 HydrophobicContact CE2-CG 3.42Å; Y244-Q321 VanDerWaalsContact CE2-CG 3.42Å; Y244-Q321 PolarHBondContact OH-NE2 3.32Å; F247-Q321 HydrophobicContact CD1-CG 4.23Å; F247-Q321 HydrophobicContact CE1-CG 4.16Å; T248-Q321 PolarHBondContact OG1-NE2 3.45Å; L317-Q321 HydrophobicContact CD1-CG 4.08Å; L317-Q321 WeakPolarHBondContact O-CB 3.33Å; L317-Q321 VanDerWaalsContact O-CG 3.26Å; L317-Q321 WeakPolarHBondContact O-CG 3.34Å; L317-Q321 PolarHBondContact O-N 3.37Å; F319-Q321 VanDerWaalsContact C-N 3.31Å; F319-Q321 PolarHBondContact O-N 3.06Å; Q321-I324 PolarHBondContact O-N 3.08Å; Q321-F325 PolarHBondContact O-N 2.8Å
322	N	95.5	Very high	96.2	Very high	97 Å²	97	50.5 Å²	50.5	52%	0.519	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-39.9	175.5	-79.8	-45.7	0	0	0	112.4	N318 F319 F325 S326	N318-N322 WeakPolarHBondContact O-CB 3.32Å; N318-N322 PolarHBondContact O-N 3.39Å; N318-N322 PolarHBondContact O-ND2 2.98Å; F319-N322 PolarHBondContact O-N 3.11Å; F319-N322 VanDerWaalsContact O-N 3.16Å; N322-F325 PolarHBondContact O-N 2.87Å; N322-S326 WeakPolarHBondContact O-CB 3.31Å; N322-S326 PolarHBondContact O-N 3.06Å; N322-S326 PolarHBondContact O-OG 2.94Å
323	V	97.2	Very high	96.1	Very high	63 Å²	63	48.8 Å²	48.8	38%	0.382	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-46.8	176.3	170	0	0	0	0	110.8	F319 G320 F325 S326 V327	F319-V323 HydrophobicContact CD1-CG2 4.21Å; F319-V323 HydrophobicContact CD2-CG2 4.4Å; F319-V323 HydrophobicContact CE1-CG2 3.78Å; F319-V323 HydrophobicContact CE2-CG2 3.99Å; F319-V323 HydrophobicContact CZ-CG2 3.66Å; F319-V323 WeakPolarHBondContact O-CG2 3.02Å; F319-V323 PolarHBondContact O-N 2.98Å; G320-V323 PolarHBondContact O-N 3.21Å; V323-F325 PolarHBondContact O-N 3.17Å; V323-S326 PolarHBondContact O-N 3.32Å; V323-V327 HydrophobicContact CG1-CG2 4.3Å; V323-V327 WeakPolarHBondContact O-CB 3.24Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.38Å; V323-V327 PolarHBondContact O-N 3.2Å
324	I	97.1	Very high	96.1	Very high	30 Å²	30	54.4 Å²	54.4	15%	0.154	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-50	179.4	-66.6	163.8	0	0	0	110.8	T243 F247 G320 Q321 A328	T243-I324 HydrophobicContact CG2-CD1 4.33Å; T243-I324 HydrophobicContact CG2-CG1 4.46Å; T243-I324 HydrophobicContact CG2-CG2 4.4Å; F247-I324 HydrophobicContact CB-CD1 3.78Å; F247-I324 HydrophobicContact CD1-CD1 3.77Å; F247-I324 HydrophobicContact CG-CD1 3.77Å; G320-I324 VanDerWaalsContact O-CG1 3.28Å; G320-I324 WeakPolarHBondContact O-CG1 3.48Å; G320-I324 PolarHBondContact O-N 3Å; Q321-I324 PolarHBondContact O-N 3.08Å; I324-A328 WeakPolarHBondContact O-CB 3.47Å; I324-A328 PolarHBondContact O-N 3.06Å
325	F	95.1	Very high	96.2	Very high	8 Å²	8	53 Å²	53	4%	0.035	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-39.1	178.4	-87.9	-66.4	0	0	0	112.9	Y244 Q321 N322 V323 A328 I329 L357 L360 S361 L364	Y244-F325 AromaticContact CD2-CD2 3.64Å; Y244-F325 HydrophobicContact CD2-CD2 3.64Å; Y244-F325 AromaticContact CD2-CE2 3.29Å; Y244-F325 HydrophobicContact CD2-CE2 3.29Å; Y244-F325 HydrophobicContact CD2-CZ 4.15Å; Y244-F325 AromaticContact CE2-CD2 3.58Å; Y244-F325 HydrophobicContact CE2-CD2 3.58Å; Y244-F325 AromaticContact CE2-CE2 3.21Å; Y244-F325 HydrophobicContact CE2-CE2 3.21Å; Y244-F325 HydrophobicContact CE2-CZ 4.33Å; Y244-F325 HydrophobicContact CG-CE2 4.07Å; Y244-F325 AromaticContact CZ-CE2 3.98Å; Q321-F325 PolarHBondContact O-N 2.8Å; N322-F325 PolarHBondContact O-N 2.87Å; V323-F325 PolarHBondContact O-N 3.17Å; F325-A328 PolarHBondContact O-N 3.18Å; F325-I329 WeakPolarHBondContact O-CB 3.21Å; F325-I329 VanDerWaalsContact O-CG1 3.27Å; F325-I329 WeakPolarHBondContact O-CG1 3.44Å; F325-I329 PolarHBondContact O-N 3.44Å; F325-L357 HydrophobicContact CE1-CD1 4.41Å; F325-L360 HydrophobicContact CE1-CB 4.3Å; F325-L360 HydrophobicContact CZ-CB 4.43Å; F325-S361 VanDerWaalsContact CE2-CA 3.5Å; F325-S361 VanDerWaalsContact CZ-CA 3.45Å; F325-L364 HydrophobicContact CZ-CB 4.49Å; F325-L364 HydrophobicContact CZ-CD1 4.39Å
326	S	96.1	Very high	96.1	Very high	71 Å²	71	50.3 Å²	50.3	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-41	179.6	-59.3	0	0	0	0	111.6	N322 V323 I329 A330	N322-S326 WeakPolarHBondContact O-CB 3.31Å; N322-S326 PolarHBondContact O-N 3.06Å; N322-S326 PolarHBondContact O-OG 2.94Å; V323-S326 PolarHBondContact O-N 3.32Å; S326-I329 PolarHBondContact O-N 3.2Å; S326-A330 VanDerWaalsContact O-CB 3.29Å; S326-A330 WeakPolarHBondContact O-CB 3.48Å; S326-A330 PolarHBondContact O-N 3.44Å
327	V	97.2	Very high	96	Very high	97 Å²	97	46.8 Å²	46.8	59%	0.588	27%	0.273	S	S	*	.	H	α-helix	trans	-64.2	-43	173.9	171.3	0	0	0	0	110.9	V323 A330 G331	V323-V327 HydrophobicContact CG1-CG2 4.3Å; V323-V327 WeakPolarHBondContact O-CB 3.24Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.38Å; V323-V327 PolarHBondContact O-N 3.2Å; V327-A330 PolarHBondContact O-N 3.08Å; V327-G331 PolarHBondContact O-N 2.81Å
328	A	96.9	Very high	96	Very high	10 Å²	10	52.2 Å²	52.2	8%	0.083	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-43.8	177.6	0	0	0	0	0	112.3	L236 C240 I324 F325 G331 L332 L357	L236-A328 HydrophobicContact CD2-CB 4.28Å; C240-A328 HydrophobicContact CB-CB 3.74Å; C240-A328 WeakPolarHBondContact SG-CB 3.43Å; I324-A328 WeakPolarHBondContact O-CB 3.47Å; I324-A328 PolarHBondContact O-N 3.06Å; F325-A328 PolarHBondContact O-N 3.18Å; A328-G331 PolarHBondContact O-N 3.45Å; A328-L332 VanDerWaalsContact O-CB 3.27Å; A328-L332 WeakPolarHBondContact O-CB 3.39Å; A328-L332 PolarHBondContact O-N 3.44Å; A328-L357 HydrophobicContact CB-CD2 4.04Å
329	I	96.4	Very high	95.9	Very high	40 Å²	40	51.3 Å²	51.3	21%	0.205	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-48.5	174.9	-70.2	167.4	0	0	0	110	F325 S326 G331 L332 M333 N354 L357	F325-I329 WeakPolarHBondContact O-CB 3.21Å; F325-I329 VanDerWaalsContact O-CG1 3.27Å; F325-I329 WeakPolarHBondContact O-CG1 3.44Å; F325-I329 PolarHBondContact O-N 3.44Å; S326-I329 PolarHBondContact O-N 3.2Å; I329-G331 PolarHBondContact O-N 2.88Å; I329-L332 PolarHBondContact O-N 3.24Å; I329-M333 HydrophobicContact CG2-CE 4.34Å; I329-M333 HydrophobicContact CG2-CG 4.27Å; I329-M333 WeakPolarHBondContact O-CG 3.32Å; I329-M333 PolarHBondContact O-N 2.8Å; I329-N354 WeakPolarHBondContact CG2-OD1 3.48Å; I329-L357 HydrophobicContact CB-CD2 4.47Å; I329-L357 HydrophobicContact CG1-CD2 3.7Å; I329-L357 HydrophobicContact CG1-CG 4.15Å
330	A	97	Very high	95.8	Very high	51 Å²	51	47.1 Å²	47.1	42%	0.421	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-43.9	178.4	0	0	0	0	0	112.2	S326 V327 M333 L334	S326-A330 VanDerWaalsContact O-CB 3.29Å; S326-A330 WeakPolarHBondContact O-CB 3.48Å; S326-A330 PolarHBondContact O-N 3.44Å; V327-A330 PolarHBondContact O-N 3.08Å; A330-M333 PolarHBondContact O-N 2.86Å; A330-L334 WeakPolarHBondContact O-CG 3.49Å; A330-L334 PolarHBondContact O-N 2.75Å
331	G	96.6	Very high	95.7	Very high	24 Å²	24	53.7 Å²	53.7	25%	0.247	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-45.9	175.2	0	0	0	0	0	112.4	V327 A328 I329 M333 L334 M335	V327-G331 PolarHBondContact O-N 2.81Å; A328-G331 PolarHBondContact O-N 3.45Å; I329-G331 PolarHBondContact O-N 2.88Å; G331-M333 VanDerWaalsContact C-N 3.34Å; G331-M333 PolarHBondContact O-N 2.83Å; G331-L334 PolarHBondContact O-N 2.91Å; G331-M335 VanDerWaalsContact O-CG 3.27Å; G331-M335 WeakPolarHBondContact O-CG 3.44Å; G331-M335 PolarHBondContact O-N 2.95Å
332	L	96.1	Very high	95.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-40.6	175.7	177.1	156.4	0	0	0	112.3	M225 Y233 L236 A328 I329 S336 L353 L357	M225-L332 HydrophobicContact CE-CD1 3.5Å; M225-L332 VanDerWaalsContact CE-CD1 3.5Å; Y233-L332 HydrophobicContact CD1-CG 4.35Å; L236-L332 HydrophobicContact CD1-CB 4.47Å; L236-L332 HydrophobicContact CD2-CB 4.12Å; L236-L332 HydrophobicContact CD2-CD1 4.46Å; A328-L332 VanDerWaalsContact O-CB 3.27Å; A328-L332 WeakPolarHBondContact O-CB 3.39Å; A328-L332 PolarHBondContact O-N 3.44Å; I329-L332 PolarHBondContact O-N 3.24Å; L332-S336 WeakPolarHBondContact O-CB 3.28Å; L332-S336 PolarHBondContact O-N 2.97Å; L332-S336 PolarHBondContact O-OG 3.4Å; L332-L353 HydrophobicContact CD1-CB 4.13Å; L332-L353 HydrophobicContact CD2-CB 3.77Å; L332-L353 HydrophobicContact CG-CB 4.3Å; L332-L357 HydrophobicContact CB-CD2 4.48Å; L332-L357 HydrophobicContact CD1-CB 4.2Å; L332-L357 HydrophobicContact CD1-CD2 3.77Å
333	M	96.2	Very high	95.2	Very high	52 Å²	52	57.6 Å²	57.6	26%	0.256	34%	0.34	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176	-68.2	-60.8	-163.1	0	0	111.9	I329 A330 G331 S336 A337 M350 N354	I329-M333 HydrophobicContact CG2-CE 4.34Å; I329-M333 HydrophobicContact CG2-CG 4.27Å; I329-M333 WeakPolarHBondContact O-CG 3.32Å; I329-M333 PolarHBondContact O-N 2.8Å; A330-M333 PolarHBondContact O-N 2.86Å; G331-M333 VanDerWaalsContact C-N 3.34Å; G331-M333 PolarHBondContact O-N 2.83Å; M333-S336 WeakPolarHBondContact CA-OG 3.27Å; M333-S336 PolarHBondContact O-N 3.16Å; M333-S336 PolarHBondContact O-OG 3.05Å; M333-A337 WeakPolarHBondContact O-CB 3.47Å; M333-A337 PolarHBondContact O-N 3.17Å; M333-M350 HydrophobicContact SD-CG 3.32Å; M333-M350 WeakPolarHBondContact SD-CG 3.18Å; M333-M350 HydrophobicContact SD-SD 3.76Å; M333-N354 HydrophobicContact CE-CB 3.34Å; M333-N354 WeakPolarHBondContact CE-ND2 3.26Å; M333-N354 HydrophobicContact SD-CB 4.34Å
334	L	96.5	Very high	94.8	Very high	121 Å²	121	58.6 Å²	58.6	63%	0.634	35%	0.346	S	S	*	.	H	α-helix	trans	-65.4	-41.4	176.9	-72.1	171.3	0	0	0	112	A330 G331 A337 Q338	A330-L334 WeakPolarHBondContact O-CG 3.49Å; A330-L334 PolarHBondContact O-N 2.75Å; G331-L334 PolarHBondContact O-N 2.91Å; L334-A337 PolarHBondContact O-N 3.4Å; L334-Q338 WeakPolarHBondContact O-CG 3.35Å; L334-Q338 PolarHBondContact O-N 3.39Å
335	M	95.4	Very high	94.4	Very high	44 Å²	44	58 Å²	58	22%	0.217	34%	0.344	C	S	.	.	H	α-helix	trans	-62.8	-48	174.8	-69.8	169.8	72.5	0	0	111.4	Q232 Y233 L236 G331 A337 Q338 E339	Q232-M335 HydrophobicContact CB-CE 3.65Å; Y233-M335 HydrophobicContact CE1-CB 4.12Å; L236-M335 HydrophobicContact CD1-SD 3.59Å; L236-M335 VanDerWaalsContact CD1-SD 3.59Å; G331-M335 VanDerWaalsContact O-CG 3.27Å; G331-M335 WeakPolarHBondContact O-CG 3.44Å; G331-M335 PolarHBondContact O-N 2.95Å; M335-A337 VanDerWaalsContact C-N 3.32Å; M335-A337 PolarHBondContact O-N 3.41Å; M335-Q338 WeakPolarHBondContact O-CB 3.46Å; M335-Q338 PolarHBondContact O-N 3.49Å; M335-E339 PolarHBondContact O-N 2.9Å
336	S	95.1	Very high	94.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-32.9	179	52.3	0	0	0	0	112.8	Y233 L332 M333 Q338 E339 I340 M350	Y233-S336 WeakPolarHBondContact OH-CA 3.45Å; Y233-S336 PolarHBondContact OH-N 3.49Å; L332-S336 WeakPolarHBondContact O-CB 3.28Å; L332-S336 PolarHBondContact O-N 2.97Å; L332-S336 PolarHBondContact O-OG 3.4Å; M333-S336 WeakPolarHBondContact CA-OG 3.27Å; M333-S336 PolarHBondContact O-N 3.16Å; M333-S336 PolarHBondContact O-OG 3.05Å; S336-Q338 VanDerWaalsContact C-N 3.32Å; S336-Q338 PolarHBondContact O-N 3.27Å; S336-E339 PolarHBondContact O-N 3.36Å; S336-I340 WeakPolarHBondContact O-CB 3.47Å; S336-I340 WeakPolarHBondContact O-CD1 3.35Å; S336-I340 WeakPolarHBondContact O-CG1 3.37Å; S336-I340 PolarHBondContact O-N 3.19Å; S336-M350 WeakPolarHBondContact OG-CG 3.42Å
337	A	95.5	Very high	94.1	Very high	39 Å²	39	60 Å²	60	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-61.1	-39.6	173.2	0	0	0	0	0	112.4	M333 L334 M335 I340 I341	M333-A337 WeakPolarHBondContact O-CB 3.47Å; M333-A337 PolarHBondContact O-N 3.17Å; L334-A337 PolarHBondContact O-N 3.4Å; M335-A337 VanDerWaalsContact C-N 3.32Å; M335-A337 PolarHBondContact O-N 3.41Å; A337-I340 PolarHBondContact O-N 3.4Å; A337-I341 WeakPolarHBondContact O-CD1 3.25Å; A337-I341 VanDerWaalsContact O-CG1 3.27Å; A337-I341 WeakPolarHBondContact O-CG1 3.37Å; A337-I341 PolarHBondContact O-N 3.35Å; A337-I341 VanDerWaalsContact O-N 3.08Å
338	Q	93.8	Very high	93.9	Very high	126 Å²	126	55.4 Å²	55.4	59%	0.589	33%	0.325	S	S	*	.	H	α-helix	trans	-64.9	-45.1	176.2	-68.2	173.6	-7.6	0	0	111.6	L334 M335 S336 I340 I341 I342	L334-Q338 WeakPolarHBondContact O-CG 3.35Å; L334-Q338 PolarHBondContact O-N 3.39Å; M335-Q338 WeakPolarHBondContact O-CB 3.46Å; M335-Q338 PolarHBondContact O-N 3.49Å; S336-Q338 VanDerWaalsContact C-N 3.32Å; S336-Q338 PolarHBondContact O-N 3.27Å; Q338-I340 VanDerWaalsContact C-N 3.33Å; Q338-I340 PolarHBondContact O-N 2.92Å; Q338-I341 PolarHBondContact O-N 3.38Å; Q338-I342 VanDerWaalsContact O-CG1 3.32Å; Q338-I342 WeakPolarHBondContact O-CG1 3.34Å; Q338-I342 PolarHBondContact O-N 3.24Å
339	E	93.1	Very high	93.8	Very high	54 Å²	54	55.6 Å²	55.6	25%	0.252	33%	0.325	S	S	.	.	H	α-helix	trans	-65.3	-34.7	176.8	-66.3	-63.1	160.4	0	0	112.4	Y233 M335 S336 I342 G343 T344 M345	Y233-E339 WeakPolarHBondContact OH-CG 3.45Å; M335-E339 PolarHBondContact O-N 2.9Å; S336-E339 PolarHBondContact O-N 3.36Å; E339-I342 PolarHBondContact O-N 2.75Å; E339-G343 PolarHBondContact O-N 3.35Å; E339-T344 WeakPolarHBondContact CA-OG1 3.46Å; E339-T344 VanDerWaalsContact CB-OG1 3.31Å; E339-T344 WeakPolarHBondContact CB-OG1 3.35Å; E339-T344 PolarHBondContact O-N 3.06Å; E339-T344 PolarHBondContact O-OG1 2.77Å; E339-T344 WeakPolarHBondContact OE2-CB 3.27Å; E339-T344 PolarHBondContact OE2-OG1 3.01Å; E339-M345 HydrophobicContact CB-CB 4.02Å; E339-M345 HydrophobicContact CB-CG 3.88Å; E339-M345 HydrophobicContact CB-SD 3.59Å; E339-M345 VanDerWaalsContact CB-SD 3.59Å; E339-M345 HydrophobicContact CG-SD 3.96Å; E339-M345 PolarHBondContact O-N 3.44Å
340	I	93.5	Very high	93.7	Very high	49 Å²	49	55.9 Å²	55.9	25%	0.251	33%	0.326	S	S	.	.	H	α-helix	trans	-64.3	-41.2	173	-70.3	163.1	0	0	0	111.2	S336 A337 Q338 I342 G343 M345 M350	S336-I340 WeakPolarHBondContact O-CB 3.47Å; S336-I340 WeakPolarHBondContact O-CD1 3.35Å; S336-I340 WeakPolarHBondContact O-CG1 3.37Å; S336-I340 PolarHBondContact O-N 3.19Å; A337-I340 PolarHBondContact O-N 3.4Å; Q338-I340 VanDerWaalsContact C-N 3.33Å; Q338-I340 PolarHBondContact O-N 2.92Å; I340-I342 VanDerWaalsContact C-N 3.31Å; I340-I342 PolarHBondContact O-N 3.21Å; I340-G343 PolarHBondContact O-N 2.89Å; I340-G343 VanDerWaalsContact O-N 3.12Å; I340-M345 WeakPolarHBondContact CA-O 3.41Å; I340-M345 HydrophobicContact CG1-CB 4.15Å; I340-M345 WeakPolarHBondContact CG1-O 3.05Å; I340-M350 HydrophobicContact CD1-CB 3.98Å; I340-M350 HydrophobicContact CD1-SD 4.19Å
341	I	93.6	Very high	93.6	Very high	149 Å²	149	55.1 Å²	55.1	76%	0.764	32%	0.316	S	S	*	.	H	α-helix	trans	-64.5	-38	177.1	-67.5	162.7	0	0	0	110.9	A337 Q338 G343	A337-I341 WeakPolarHBondContact O-CD1 3.25Å; A337-I341 VanDerWaalsContact O-CG1 3.27Å; A337-I341 WeakPolarHBondContact O-CG1 3.37Å; A337-I341 PolarHBondContact O-N 3.35Å; A337-I341 VanDerWaalsContact O-N 3.08Å; Q338-I341 PolarHBondContact O-N 3.38Å; I341-G343 PolarHBondContact O-N 3.42Å
342	I	91.5	Very high	93.6	Very high	120 Å²	120	54 Å²	54	62%	0.615	30%	0.304	S	S	*	.	H	α-helix	trans	-72.7	-17.5	176.6	-61.7	164.5	0	0	0	111.4	Q338 E339 I340 T344	Q338-I342 VanDerWaalsContact O-CG1 3.32Å; Q338-I342 WeakPolarHBondContact O-CG1 3.34Å; Q338-I342 PolarHBondContact O-N 3.24Å; E339-I342 PolarHBondContact O-N 2.75Å; I340-I342 VanDerWaalsContact C-N 3.31Å; I340-I342 PolarHBondContact O-N 3.21Å; I342-T344 HydrophobicContact CG2-CG2 3.97Å
343	G	88.5	Confident	93.6	Very high	61 Å²	61	54 Å²	54	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	13.3	179.5	0	0	0	0	0	114.1	E339 I340 I341	E339-G343 PolarHBondContact O-N 3.35Å; I340-G343 PolarHBondContact O-N 2.89Å; I340-G343 VanDerWaalsContact O-N 3.12Å; I341-G343 PolarHBondContact O-N 3.42Å
344	T	88.7	Confident	93.5	Very high	84 Å²	84	53.5 Å²	53.5	52%	0.515	30%	0.303	S	S	.	.	S	Bend	trans	-81.7	-23.8	176.4	50.3	0	0	0	0	112.5	E339 I342	E339-T344 WeakPolarHBondContact CA-OG1 3.46Å; E339-T344 VanDerWaalsContact CB-OG1 3.31Å; E339-T344 WeakPolarHBondContact CB-OG1 3.35Å; E339-T344 PolarHBondContact O-N 3.06Å; E339-T344 PolarHBondContact O-OG1 2.77Å; E339-T344 WeakPolarHBondContact OE2-CB 3.27Å; E339-T344 PolarHBondContact OE2-OG1 3.01Å; I342-T344 HydrophobicContact CG2-CG2 3.97Å
345	M	89.9	Confident	93.4	Very high	19 Å²	19	48.4 Å²	48.4	9%	0.094	28%	0.279	C	S	.	.	S	Bend	trans	-132	155.6	-177	-72.6	-179.4	64.9	0	0	112.3	Y233 E339 I340 D349 L353	Y233-M345 HydrophobicContact CE2-SD 4.11Å; Y233-M345 PolarHBondContact OH-SD 3.07Å; E339-M345 HydrophobicContact CB-CB 4.02Å; E339-M345 HydrophobicContact CB-CG 3.88Å; E339-M345 HydrophobicContact CB-SD 3.59Å; E339-M345 VanDerWaalsContact CB-SD 3.59Å; E339-M345 HydrophobicContact CG-SD 3.96Å; E339-M345 PolarHBondContact O-N 3.44Å; I340-M345 WeakPolarHBondContact CA-O 3.41Å; I340-M345 HydrophobicContact CG1-CB 4.15Å; I340-M345 WeakPolarHBondContact CG1-O 3.05Å; M345-D349 HydrophobicContact CB-CB 4.29Å; M345-D349 HydrophobicContact CE-CB 3.54Å; M345-L353 HydrophobicContact CE-CD1 3.39Å
346	T	92.6	Very high	93.4	Very high	55 Å²	55	46.3 Å²	46.3	34%	0.337	27%	0.269	S	S	.	.			trans	-100	167.3	175.5	75.9	0	0	0	0	112.2	E106 G348 D349 M350	E106-T346 HydrophobicContact CG-CG2 4.48Å; E106-T346 WeakPolarHBondContact OE1-CB 3.33Å; E106-T346 WeakPolarHBondContact OE1-CG2 3.34Å; E106-T346 PolarHBondContact OE1-OG1 3.2Å; T346-G348 PolarHBondContact O-N 2.79Å; T346-G348 PolarHBondContact OG1-N 3.06Å; T346-G348 VanDerWaalsContact OG1-N 3.13Å; T346-D349 PolarHBondContact N-OD2 2.95Å; T346-D349 VanDerWaalsContact N-OD2 3.11Å; T346-D349 WeakPolarHBondContact O-CB 3.41Å; T346-D349 PolarHBondContact O-N 2.78Å; T346-D349 VanDerWaalsContact O-N 3.14Å; T346-D349 PolarHBondContact OG1-N 3.36Å; T346-D349 VanDerWaalsContact OG1-N 3.1Å; T346-D349 PolarHBondContact OG1-OD2 2.96Å; T346-M350 PolarHBondContact O-N 3.24Å
347	V	92.4	Very high	93.4	Very high	64 Å²	64	46.3 Å²	46.3	39%	0.388	27%	0.269	S	S	.	.	H	α-helix	trans	-58.9	-32.7	168.9	-178.7	0	0	0	0	111.1	V105 M350 V351	V105-V347 HydrophobicContact CG1-CG1 4.32Å; V347-M350 HydrophobicContact CG1-CE 4.34Å; V347-M350 PolarHBondContact O-N 2.79Å; V347-V351 WeakPolarHBondContact O-CG2 3.42Å; V347-V351 PolarHBondContact O-N 3.42Å
348	G	93.4	Very high	93.2	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-37	175.6	0	0	0	0	0	113	K102 T346 V351 M352	K102-G348 WeakPolarHBondContact CB-O 3.38Å; K102-G348 WeakPolarHBondContact CG-O 3.3Å; T346-G348 PolarHBondContact O-N 2.79Å; T346-G348 PolarHBondContact OG1-N 3.06Å; T346-G348 VanDerWaalsContact OG1-N 3.13Å; G348-V351 PolarHBondContact O-N 3.47Å; G348-M352 PolarHBondContact O-N 3.18Å
349	D	94.5	Very high	93.1	Very high	14 Å²	14	46 Å²	46	8%	0.075	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-44.7	174	-76.1	-55.1	0	0	0	112.1	K102 M345 T346 V351 M352 L353	K102-D349 WeakPolarHBondContact CE-OD1 3.48Å; K102-D349 VanDerWaalsContact NZ-CG 3.34Å; K102-D349 IonicContact NZ-OD1 3.57Å; K102-D349 PolarHBondContact NZ-OD1 3.33Å; K102-D349 IonicContact NZ-OD2 3.4Å; M345-D349 HydrophobicContact CB-CB 4.29Å; M345-D349 HydrophobicContact CE-CB 3.54Å; T346-D349 PolarHBondContact N-OD2 2.95Å; T346-D349 VanDerWaalsContact N-OD2 3.11Å; T346-D349 WeakPolarHBondContact O-CB 3.41Å; T346-D349 PolarHBondContact O-N 2.78Å; T346-D349 VanDerWaalsContact O-N 3.14Å; T346-D349 PolarHBondContact OG1-N 3.36Å; T346-D349 VanDerWaalsContact OG1-N 3.1Å; T346-D349 PolarHBondContact OG1-OD2 2.96Å; D349-V351 VanDerWaalsContact C-N 3.31Å; D349-V351 PolarHBondContact O-N 3.41Å; D349-M352 WeakPolarHBondContact O-CB 3.36Å; D349-M352 PolarHBondContact O-N 3.31Å; D349-L353 WeakPolarHBondContact O-CB 3.35Å; D349-L353 VanDerWaalsContact O-CG 3.3Å; D349-L353 WeakPolarHBondContact O-CG 3.37Å; D349-L353 PolarHBondContact O-N 3.05Å
350	M	94.9	Very high	93.1	Very high	47 Å²	47	43.5 Å²	43.5	23%	0.232	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-44.6	175.9	176.8	177.6	76.6	0	0	111.5	M333 S336 I340 T346 V347 L353 N354	M333-M350 HydrophobicContact SD-CG 3.32Å; M333-M350 WeakPolarHBondContact SD-CG 3.18Å; M333-M350 HydrophobicContact SD-SD 3.76Å; S336-M350 WeakPolarHBondContact OG-CG 3.42Å; I340-M350 HydrophobicContact CD1-CB 3.98Å; I340-M350 HydrophobicContact CD1-SD 4.19Å; T346-M350 PolarHBondContact O-N 3.24Å; V347-M350 HydrophobicContact CG1-CE 4.34Å; V347-M350 PolarHBondContact O-N 2.79Å; M350-L353 PolarHBondContact O-N 2.94Å; M350-N354 WeakPolarHBondContact O-CB 3.34Å; M350-N354 PolarHBondContact O-N 3.09Å
351	V	94.9	Very high	92.9	Very high	34 Å²	34	42.6 Å²	42.6	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-40.8	177.7	173.4	0	0	0	0	111.9	F101 V347 G348 D349 G355	F101-V351 HydrophobicContact CD1-CG1 3.28Å; F101-V351 HydrophobicContact CE1-CG1 3.23Å; F101-V351 HydrophobicContact CG-CG1 4.39Å; F101-V351 HydrophobicContact CZ-CG1 4.31Å; V347-V351 WeakPolarHBondContact O-CG2 3.42Å; V347-V351 PolarHBondContact O-N 3.42Å; G348-V351 PolarHBondContact O-N 3.47Å; D349-V351 VanDerWaalsContact C-N 3.31Å; D349-V351 PolarHBondContact O-N 3.41Å; V351-G355 PolarHBondContact O-N 3Å
352	M	95.6	Very high	92.6	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-51.3	174.4	-175.6	-166.4	67.1	0	0	111.3	P98 F99 K102 K228 G348 D349 N354 G355 L356	P98-M352 HydrophobicContact CB-CG 4.05Å; F99-M352 HydrophobicContact CD1-SD 3.67Å; F99-M352 HydrophobicContact CD2-CG 4.43Å; F99-M352 HydrophobicContact CD2-SD 4.24Å; F99-M352 HydrophobicContact CE1-SD 3.41Å; F99-M352 WeakPolarHBondContact CE1-SD 3.39Å; F99-M352 HydrophobicContact CE2-CG 4.48Å; F99-M352 HydrophobicContact CE2-SD 4.02Å; F99-M352 HydrophobicContact CG-SD 4.08Å; F99-M352 HydrophobicContact CZ-SD 3.6Å; K102-M352 HydrophobicContact CB-CB 3.96Å; K102-M352 HydrophobicContact CD-CB 4.16Å; K102-M352 HydrophobicContact CD-SD 3.96Å; K228-M352 HydrophobicContact CG-CE 3.99Å; G348-M352 PolarHBondContact O-N 3.18Å; D349-M352 WeakPolarHBondContact O-CB 3.36Å; D349-M352 PolarHBondContact O-N 3.31Å; M352-N354 VanDerWaalsContact C-N 3.32Å; M352-N354 PolarHBondContact O-N 2.97Å; M352-G355 PolarHBondContact O-N 2.95Å; M352-G355 VanDerWaalsContact O-N 3.14Å; M352-L356 HydrophobicContact CE-CD1 4.27Å; M352-L356 HydrophobicContact CG-CD1 3.96Å; M352-L356 HydrophobicContact CG-CG 4.4Å; M352-L356 WeakPolarHBondContact O-CG 3.16Å; M352-L356 PolarHBondContact O-N 2.79Å; M352-L356 HydrophobicContact SD-CD1 4.4Å
353	L	95.7	Very high	92.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-41.1	-177	-71.8	173.7	0	0	0	111.6	M225 S229 Y233 L332 M345 D349 M350 L356 L357	M225-L353 HydrophobicContact CE-CD2 3.73Å; M225-L353 HydrophobicContact CG-CD2 3.91Å; S229-L353 WeakPolarHBondContact OG-CD2 3.4Å; Y233-L353 HydrophobicContact CD1-CD1 3.87Å; Y233-L353 HydrophobicContact CE1-CD1 3.75Å; L332-L353 HydrophobicContact CD1-CB 4.13Å; L332-L353 HydrophobicContact CD2-CB 3.77Å; L332-L353 HydrophobicContact CG-CB 4.3Å; M345-L353 HydrophobicContact CE-CD1 3.39Å; D349-L353 WeakPolarHBondContact O-CB 3.35Å; D349-L353 VanDerWaalsContact O-CG 3.3Å; D349-L353 WeakPolarHBondContact O-CG 3.37Å; D349-L353 PolarHBondContact O-N 3.05Å; M350-L353 PolarHBondContact O-N 2.94Å; L353-L356 PolarHBondContact O-N 3.15Å; L353-L357 PolarHBondContact O-N 2.76Å
354	N	95.2	Very high	92.5	Very high	41 Å²	41	34.8 Å²	34.8	22%	0.219	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-48.9	171.4	-177	37.8	0	0	0	111.9	I329 M333 M350 M352 L356 L357 M358	I329-N354 WeakPolarHBondContact CG2-OD1 3.48Å; M333-N354 HydrophobicContact CE-CB 3.34Å; M333-N354 WeakPolarHBondContact CE-ND2 3.26Å; M333-N354 HydrophobicContact SD-CB 4.34Å; M350-N354 WeakPolarHBondContact O-CB 3.34Å; M350-N354 PolarHBondContact O-N 3.09Å; M352-N354 VanDerWaalsContact C-N 3.32Å; M352-N354 PolarHBondContact O-N 2.97Å; N354-L356 VanDerWaalsContact C-N 3.31Å; N354-L356 PolarHBondContact O-N 3.12Å; N354-L357 PolarHBondContact O-N 2.9Å; N354-M358 VanDerWaalsContact O-CB 3.27Å; N354-M358 WeakPolarHBondContact O-CB 3.48Å; N354-M358 PolarHBondContact O-N 3.38Å
355	G	94.5	Very high	92.4	Very high	14 Å²	14	34 Å²	34	14%	0.144	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-36.8	178.3	0	0	0	0	0	113.3	V351 M352 Q359	V351-G355 PolarHBondContact O-N 3Å; M352-G355 PolarHBondContact O-N 2.95Å; M352-G355 VanDerWaalsContact O-N 3.14Å; G355-Q359 WeakPolarHBondContact O-CG 3.12Å; G355-Q359 PolarHBondContact O-N 2.94Å; G355-Q359 PolarHBondContact O-NE2 2.92Å
356	L	94.9	Very high	92.2	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-68.9	-44.8	175.9	-71.3	171.4	0	0	0	112	V95 P98 F99 V221 M352 L353 N354 Q359	V95-L356 HydrophobicContact CG1-CD2 4.14Å; P98-L356 HydrophobicContact CB-CD2 4.42Å; P98-L356 HydrophobicContact CB-CG 4.25Å; P98-L356 HydrophobicContact CG-CD2 3.99Å; P98-L356 HydrophobicContact CG-CG 4.2Å; F99-L356 HydrophobicContact CE2-CD1 4.39Å; V221-L356 HydrophobicContact CG1-CB 4.07Å; V221-L356 HydrophobicContact CG2-CD2 4.27Å; M352-L356 HydrophobicContact CE-CD1 4.27Å; M352-L356 HydrophobicContact CG-CD1 3.96Å; M352-L356 HydrophobicContact CG-CG 4.4Å; M352-L356 WeakPolarHBondContact O-CG 3.16Å; M352-L356 PolarHBondContact O-N 2.79Å; M352-L356 HydrophobicContact SD-CD1 4.4Å; L353-L356 PolarHBondContact O-N 3.15Å; N354-L356 VanDerWaalsContact C-N 3.31Å; N354-L356 PolarHBondContact O-N 3.12Å; L356-Q359 PolarHBondContact O-N 2.89Å
357	L	94.1	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.6	-40.2	178.3	-176	59	0	0	0	111.8	L236 T237 F325 A328 I329 L332 L353 N354 Q359 L360	L236-L357 HydrophobicContact CD2-CD2 4.35Å; T237-L357 HydrophobicContact CG2-CD1 4.29Å; F325-L357 HydrophobicContact CE1-CD1 4.41Å; A328-L357 HydrophobicContact CB-CD2 4.04Å; I329-L357 HydrophobicContact CB-CD2 4.47Å; I329-L357 HydrophobicContact CG1-CD2 3.7Å; I329-L357 HydrophobicContact CG1-CG 4.15Å; L332-L357 HydrophobicContact CB-CD2 4.48Å; L332-L357 HydrophobicContact CD1-CB 4.2Å; L332-L357 HydrophobicContact CD1-CD2 3.77Å; L353-L357 PolarHBondContact O-N 2.76Å; N354-L357 PolarHBondContact O-N 2.9Å; L357-Q359 VanDerWaalsContact C-N 3.32Å; L357-Q359 PolarHBondContact O-N 2.91Å; L357-L360 HydrophobicContact CD1-CD1 4.38Å; L357-L360 WeakPolarHBondContact O-CB 3.38Å; L357-L360 PolarHBondContact O-N 3.19Å
358	M	93.1	Very high	91.6	Very high	108 Å²	108	35 Å²	35	53%	0.532	18%	0.184	S	C	.	.	H	α-helix	trans	-64	-34.9	178.5	-174.5	173.7	71.7	0	0	112.6	N354 L360 S361	N354-M358 VanDerWaalsContact O-CB 3.27Å; N354-M358 WeakPolarHBondContact O-CB 3.48Å; N354-M358 PolarHBondContact O-N 3.38Å; M358-L360 PolarHBondContact O-N 3.41Å; M358-S361 WeakPolarHBondContact O-CB 3.28Å; M358-S361 PolarHBondContact O-N 2.89Å; M358-S361 PolarHBondContact O-OG 3.35Å
359	Q	91.7	Very high	91.3	Very high	49 Å²	49	37 Å²	37	23%	0.229	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-33.5	175.3	-84	172.4	93.6	0	0	112.8	G94 G355 L356 L357 S361 P363	G94-Q359 PolarHBondContact O-OE1 2.94Å; G355-Q359 WeakPolarHBondContact O-CG 3.12Å; G355-Q359 PolarHBondContact O-N 2.94Å; G355-Q359 PolarHBondContact O-NE2 2.92Å; L356-Q359 PolarHBondContact O-N 2.89Å; L357-Q359 VanDerWaalsContact C-N 3.32Å; L357-Q359 PolarHBondContact O-N 2.91Å; Q359-S361 PolarHBondContact O-N 3.37Å; Q359-P363 WeakPolarHBondContact O-CD 3.33Å
360	L	91.7	Very high	91.2	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-23.8	176.9	-60.6	-179.3	0	0	0	112.7	E217 F218 V221 T237 V241 F325 L357 M358 M362 L364	E217-L360 HydrophobicContact CG-CD2 4.06Å; F218-L360 HydrophobicContact CB-CD2 4.44Å; V221-L360 HydrophobicContact CB-CD1 4.28Å; V221-L360 HydrophobicContact CB-CD2 4.17Å; V221-L360 HydrophobicContact CB-CG 4.45Å; V221-L360 HydrophobicContact CG1-CD1 3.83Å; V221-L360 HydrophobicContact CG1-CG 4.25Å; V221-L360 HydrophobicContact CG2-CD2 4Å; V221-L360 HydrophobicContact CG2-CG 4.4Å; T237-L360 HydrophobicContact CG2-CD1 3.65Å; V241-L360 HydrophobicContact CG2-CD1 4.12Å; F325-L360 HydrophobicContact CE1-CB 4.3Å; F325-L360 HydrophobicContact CZ-CB 4.43Å; L357-L360 HydrophobicContact CD1-CD1 4.38Å; L357-L360 WeakPolarHBondContact O-CB 3.38Å; L357-L360 PolarHBondContact O-N 3.19Å; M358-L360 PolarHBondContact O-N 3.41Å; L360-M362 PolarHBondContact O-N 2.95Å; L360-L364 HydrophobicContact CB-CD1 3.98Å; L360-L364 WeakPolarHBondContact O-CB 3.48Å; L360-L364 WeakPolarHBondContact O-CD1 3.32Å; L360-L364 PolarHBondContact O-N 3.41Å
361	S	89	Confident	90.8	Very high	31 Å²	31	38.3 Å²	38.3	22%	0.217	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-43.8	-175.5	69.5	0	0	0	0	113.9	F325 M358 Q359 L364 N365	F325-S361 VanDerWaalsContact CE2-CA 3.5Å; F325-S361 VanDerWaalsContact CZ-CA 3.45Å; M358-S361 WeakPolarHBondContact O-CB 3.28Å; M358-S361 PolarHBondContact O-N 2.89Å; M358-S361 PolarHBondContact O-OG 3.35Å; Q359-S361 PolarHBondContact O-N 3.37Å; S361-L364 PolarHBondContact O-N 2.87Å; S361-N365 PolarHBondContact O-N 3.03Å; S361-N365 VanDerWaalsContact O-N 3.15Å; S361-N365 PolarHBondContact O-ND2 2.82Å; S361-N365 PolarHBondContact O-OD1 3.05Å
362	M	88.2	Confident	90.4	Very high	135 Å²	135	40 Å²	40	67%	0.665	20%	0.203	S	C	*	.	H	α-helix	trans	-68	-49	-172.4	178	-172.9	-67.1	0	0	113.2	L360 L364 N365 F366	L360-M362 PolarHBondContact O-N 2.95Å; M362-L364 VanDerWaalsContact C-N 3.32Å; M362-L364 PolarHBondContact O-N 2.97Å; M362-N365 WeakPolarHBondContact O-CB 3.42Å; M362-N365 PolarHBondContact O-N 3.28Å; M362-F366 WeakPolarHBondContact O-CD2 3.35Å
363	P	87.8	Confident	90.1	Very high	27 Å²	27	43.3 Å²	43.3	18%	0.175	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-36.1	177.7	-20.3	32.6	0	0	0	112.8	T214 Q359 N365 F366	T214-P363 HydrophobicContact CG2-CB 4.05Å; T214-P363 VanDerWaalsContact OG1-CB 3.31Å; T214-P363 WeakPolarHBondContact OG1-CB 3.11Å; Q359-P363 WeakPolarHBondContact O-CD 3.33Å; P363-N365 VanDerWaalsContact C-N 3.3Å; P363-N365 PolarHBondContact O-N 2.93Å; P363-F366 PolarHBondContact O-N 3.5Å
364	L	88.9	Confident	89.9	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-68.3	-26.3	179.6	-89.9	124.2	0	0	0	112.9	T214 V241 Y244 F325 L360 S361 M362 F366 L367	T214-L364 HydrophobicContact CG2-CD1 4.49Å; T214-L364 HydrophobicContact CG2-CG 4.39Å; V241-L364 HydrophobicContact CG1-CD2 4.16Å; V241-L364 HydrophobicContact CG2-CD1 4.36Å; Y244-L364 HydrophobicContact CD1-CB 4.01Å; Y244-L364 HydrophobicContact CD1-CD2 3.38Å; Y244-L364 HydrophobicContact CD1-CG 4.33Å; Y244-L364 HydrophobicContact CE1-CB 3.54Å; Y244-L364 HydrophobicContact CE1-CD2 3.77Å; Y244-L364 HydrophobicContact CE1-CG 4.31Å; Y244-L364 VanDerWaalsContact CE1-O 3.3Å; Y244-L364 WeakPolarHBondContact CE1-O 3.2Å; Y244-L364 HydrophobicContact CG-CD2 4.18Å; Y244-L364 PolarHBondContact OH-O 3.48Å; F325-L364 HydrophobicContact CZ-CB 4.49Å; F325-L364 HydrophobicContact CZ-CD1 4.39Å; L360-L364 HydrophobicContact CB-CD1 3.98Å; L360-L364 WeakPolarHBondContact O-CB 3.48Å; L360-L364 WeakPolarHBondContact O-CD1 3.32Å; L360-L364 PolarHBondContact O-N 3.41Å; S361-L364 PolarHBondContact O-N 2.87Å; M362-L364 VanDerWaalsContact C-N 3.32Å; M362-L364 PolarHBondContact O-N 2.97Å; L364-F366 PolarHBondContact O-N 2.77Å; L364-F366 VanDerWaalsContact O-N 3.11Å; L364-L367 HydrophobicContact CD2-CD2 4.15Å; L364-L367 WeakPolarHBondContact O-CB 3.46Å; L364-L367 PolarHBondContact O-N 3.43Å
365	N	87.9	Confident	89.6	Confident	66 Å²	66	49.4 Å²	49.4	35%	0.353	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30	176.6	-71.6	-20.5	0	0	0	113.9	Y244 S361 M362 P363	Y244-N365 WeakPolarHBondContact OH-CA 2.98Å; Y244-N365 PolarHBondContact OH-N 3.32Å; Y244-N365 VanDerWaalsContact OH-N 3.09Å; Y244-N365 PolarHBondContact OH-OD1 3.4Å; S361-N365 PolarHBondContact O-N 3.03Å; S361-N365 VanDerWaalsContact O-N 3.15Å; S361-N365 PolarHBondContact O-ND2 2.82Å; S361-N365 PolarHBondContact O-OD1 3.05Å; M362-N365 WeakPolarHBondContact O-CB 3.42Å; M362-N365 PolarHBondContact O-N 3.28Å; P363-N365 VanDerWaalsContact C-N 3.3Å; P363-N365 PolarHBondContact O-N 2.93Å
366	F	86.2	Confident	89.4	Confident	110 Å²	110	53.3 Å²	53.3	48%	0.482	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	0.8	179.2	-56	-78.1	0	0	0	113.3	M362 P363 L364 G368 S369 V370	M362-F366 WeakPolarHBondContact O-CD2 3.35Å; P363-F366 PolarHBondContact O-N 3.5Å; L364-F366 PolarHBondContact O-N 2.77Å; L364-F366 VanDerWaalsContact O-N 3.11Å; F366-G368 VanDerWaalsContact C-N 3.3Å; F366-G368 PolarHBondContact O-N 3.24Å; F366-S369 PolarHBondContact O-N 2.87Å; F366-S369 PolarHBondContact O-OG 3.04Å; F366-V370 HydrophobicContact CB-CG2 4.25Å; F366-V370 VanDerWaalsContact O-CB 3.32Å; F366-V370 WeakPolarHBondContact O-CB 2.86Å; F366-V370 WeakPolarHBondContact O-CG2 3.19Å; F366-V370 PolarHBondContact O-N 3.45Å
367	L	86.3	Confident	89.3	Confident	49 Å²	49	53.3 Å²	53.3	26%	0.257	26%	0.261	S	S	.	.	H	α-helix	trans	-59.7	-40.3	-172.9	-174.8	64.4	0	0	0	112.4	T248 L364 Y371	T248-L367 HydrophobicContact CG2-CB 4.45Å; L364-L367 HydrophobicContact CD2-CD2 4.15Å; L364-L367 WeakPolarHBondContact O-CB 3.46Å; L364-L367 PolarHBondContact O-N 3.43Å; L367-Y371 WeakPolarHBondContact O-CB 3.44Å; L367-Y371 PolarHBondContact O-N 3.43Å
368	G	86	Confident	89.2	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-47	178.6	0	0	0	0	0	113.1	F366 Y371 R372	F366-G368 VanDerWaalsContact C-N 3.3Å; F366-G368 PolarHBondContact O-N 3.24Å; G368-Y371 PolarHBondContact O-N 2.66Å; G368-R372 PolarHBondContact O-N 2.84Å
369	S	87.2	Confident	89	Confident	42 Å²	42	52 Å²	52	29%	0.294	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-44.8	177.3	51.3	0	0	0	0	111.2	F366 Y371 R372 E373	F366-S369 PolarHBondContact O-N 2.87Å; F366-S369 PolarHBondContact O-OG 3.04Å; S369-Y371 VanDerWaalsContact C-N 3.34Å; S369-Y371 PolarHBondContact O-N 3.22Å; S369-R372 PolarHBondContact O-N 3.28Å; S369-E373 WeakPolarHBondContact O-CB 3.41Å; S369-E373 WeakPolarHBondContact O-CG 3.49Å; S369-E373 PolarHBondContact O-N 3.46Å
370	V	91	Very high	89	Confident	9 Å²	9	51 Å²	51	6%	0.055	25%	0.254	C	S	.	.	H	α-helix	trans	-57	-46	176.4	169.2	0	0	0	0	111.1	A206 N210 V211 F366 R372 E373 V374	A206-V370 HydrophobicContact CB-CG1 4.1Å; N210-V370 HydrophobicContact CB-CG1 4.33Å; N210-V370 HydrophobicContact CB-CG2 3.72Å; V211-V370 HydrophobicContact CG2-CG1 3.79Å; F366-V370 HydrophobicContact CB-CG2 4.25Å; F366-V370 VanDerWaalsContact O-CB 3.32Å; F366-V370 WeakPolarHBondContact O-CB 2.86Å; F366-V370 WeakPolarHBondContact O-CG2 3.19Å; F366-V370 PolarHBondContact O-N 3.45Å; V370-R372 PolarHBondContact O-N 3.41Å; V370-E373 PolarHBondContact O-N 3.06Å; V370-V374 HydrophobicContact CG1-CG2 4.21Å; V370-V374 VanDerWaalsContact O-CB 3.31Å; V370-V374 WeakPolarHBondContact O-CB 3.48Å; V370-V374 WeakPolarHBondContact O-CG2 3.45Å; V370-V374 PolarHBondContact O-N 3.07Å
371	Y	87.5	Confident	89.1	Confident	80 Å²	80	51 Å²	51	31%	0.314	25%	0.253	S	S	.	.	H	α-helix	trans	-59	-48.6	176.6	169.1	-98.7	0	0	0	112.2	R253 L367 G368 S369 K375	R253-Y371 PolarHBondContact NH2-OH 3.44Å; L367-Y371 WeakPolarHBondContact O-CB 3.44Å; L367-Y371 PolarHBondContact O-N 3.43Å; G368-Y371 PolarHBondContact O-N 2.66Å; S369-Y371 VanDerWaalsContact C-N 3.34Å; S369-Y371 PolarHBondContact O-N 3.22Å; Y371-K375 WeakPolarHBondContact O-CB 3.34Å; Y371-K375 PolarHBondContact O-N 3.3Å
372	R	85.4	Confident	89.2	Confident	69 Å²	69	50.4 Å²	50.4	26%	0.26	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-42.9	-179	-173.7	-172.2	64.9	86.5	10.8	111.5	G368 S369 V370 K375 Q376	G368-R372 PolarHBondContact O-N 2.84Å; S369-R372 PolarHBondContact O-N 3.28Å; V370-R372 PolarHBondContact O-N 3.41Å; R372-K375 PolarHBondContact O-N 3.08Å; R372-Q376 PolarHBondContact O-N 3.01Å
373	E	89	Confident	89.2	Confident	70 Å²	70	45.9 Å²	45.9	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-72.3	-39.8	-178	-75.1	163.3	-154.7	0	0	112.4	S369 V370 K375 Q376 G377	S369-E373 WeakPolarHBondContact O-CB 3.41Å; S369-E373 WeakPolarHBondContact O-CG 3.49Å; S369-E373 PolarHBondContact O-N 3.46Å; V370-E373 PolarHBondContact O-N 3.06Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.44Å; E373-Q376 PolarHBondContact O-N 3.36Å; E373-G377 PolarHBondContact O-N 3.17Å
374	V	91.8	Very high	89.4	Confident	38 Å²	38	44.6 Å²	44.6	23%	0.23	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-45.1	172	170.1	0	0	0	0	110	V203 A206 V370 Q376 G377 M378	V203-V374 HydrophobicContact CG2-CG1 4.45Å; A206-V374 HydrophobicContact CB-CG2 3.41Å; A206-V374 VanDerWaalsContact CB-CG2 3.41Å; V370-V374 HydrophobicContact CG1-CG2 4.21Å; V370-V374 VanDerWaalsContact O-CB 3.31Å; V370-V374 WeakPolarHBondContact O-CB 3.48Å; V370-V374 WeakPolarHBondContact O-CG2 3.45Å; V370-V374 PolarHBondContact O-N 3.07Å; V374-Q376 PolarHBondContact O-N 3.27Å; V374-G377 PolarHBondContact O-N 2.97Å; V374-M378 HydrophobicContact CG1-CG 4.37Å; V374-M378 WeakPolarHBondContact O-CB 3.45Å; V374-M378 WeakPolarHBondContact O-CG 3.47Å; V374-M378 PolarHBondContact O-N 3.26Å
375	K	90.4	Very high	89.6	Confident	131 Å²	131	44.4 Å²	44.4	57%	0.57	22%	0.218	S	C	*	.	H	α-helix	trans	-59.1	-48	177	-174.3	-178.8	177.4	-174.5	0	111.8	Y371 R372 E373 M378 V379	Y371-K375 WeakPolarHBondContact O-CB 3.34Å; Y371-K375 PolarHBondContact O-N 3.3Å; R372-K375 PolarHBondContact O-N 3.08Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.44Å; K375-M378 PolarHBondContact O-N 2.92Å; K375-V379 WeakPolarHBondContact O-CG2 3.47Å; K375-V379 PolarHBondContact O-N 3.13Å
376	Q	88.3	Confident	89.7	Confident	96 Å²	96	41.3 Å²	41.3	45%	0.449	20%	0.202	S	C	.	.	H	α-helix	trans	-64.9	-46.4	178.9	-178.7	56.8	48.4	0	0	111.8	R372 E373 V374 M378 V379 D380	R372-Q376 PolarHBondContact O-N 3.01Å; E373-Q376 PolarHBondContact O-N 3.36Å; V374-Q376 PolarHBondContact O-N 3.27Å; Q376-M378 PolarHBondContact O-N 3.34Å; Q376-V379 WeakPolarHBondContact O-CB 3.34Å; Q376-V379 PolarHBondContact O-N 2.9Å; Q376-D380 VanDerWaalsContact NE2-CG 3.3Å; Q376-D380 PolarHBondContact NE2-OD1 2.87Å; Q376-D380 VanDerWaalsContact NE2-OD1 3.13Å; Q376-D380 PolarHBondContact NE2-OD2 2.51Å; Q376-D380 PolarHBondContact O-N 2.94Å
377	G	92.8	Very high	89.8	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-33.8	178.9	0	0	0	0	0	112.6	E373 V374 M381	E373-G377 PolarHBondContact O-N 3.17Å; V374-G377 PolarHBondContact O-N 2.97Å; G377-M381 WeakPolarHBondContact O-CB 3.46Å; G377-M381 VanDerWaalsContact O-CG 3.31Å; G377-M381 WeakPolarHBondContact O-CG 3.36Å; G377-M381 PolarHBondContact O-N 2.99Å
378	M	92.7	Very high	90	Very high	25 Å²	25	35.3 Å²	35.3	12%	0.123	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-44.4	171.6	-73.4	-64.5	-65.5	0	0	112.2	N57 V60 V203 V374 K375 Q376 M381 Q382	N57-M378 HydrophobicContact CB-CE 3.9Å; N57-M378 WeakPolarHBondContact O-CE 3.32Å; V60-M378 HydrophobicContact CB-CE 4.05Å; V60-M378 HydrophobicContact CG1-CE 3.86Å; V60-M378 HydrophobicContact CG1-SD 4.16Å; V203-M378 HydrophobicContact CG1-SD 4.43Å; V203-M378 HydrophobicContact CG2-CG 4.29Å; V203-M378 HydrophobicContact CG2-SD 4.41Å; V374-M378 HydrophobicContact CG1-CG 4.37Å; V374-M378 WeakPolarHBondContact O-CB 3.45Å; V374-M378 WeakPolarHBondContact O-CG 3.47Å; V374-M378 PolarHBondContact O-N 3.26Å; K375-M378 PolarHBondContact O-N 2.92Å; Q376-M378 PolarHBondContact O-N 3.34Å; M378-M381 HydrophobicContact CG-CE 4.47Å; M378-M381 PolarHBondContact O-N 2.94Å; M378-M381 HydrophobicContact SD-CE 3.57Å; M378-M381 VanDerWaalsContact SD-CE 3.57Å; M378-Q382 VanDerWaalsContact O-CB 3.26Å; M378-Q382 WeakPolarHBondContact O-CB 3.48Å; M378-Q382 PolarHBondContact O-N 2.94Å
379	V	88.9	Confident	90.1	Very high	55 Å²	55	38.8 Å²	38.8	33%	0.333	20%	0.195	S	C	.	.	H	α-helix	trans	-63.9	-43.5	177.6	173.5	0	0	0	0	111.4	K375 Q376 Q382 T383	K375-V379 WeakPolarHBondContact O-CG2 3.47Å; K375-V379 PolarHBondContact O-N 3.13Å; Q376-V379 WeakPolarHBondContact O-CB 3.34Å; Q376-V379 PolarHBondContact O-N 2.9Å; V379-Q382 PolarHBondContact O-N 3.29Å; V379-T383 PolarHBondContact O-N 3.18Å; V379-T383 PolarHBondContact O-OG1 3.07Å
380	D	91.1	Very high	90.1	Very high	29 Å²	29	39 Å²	39	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-43.6	178.4	-69.4	-39.2	0	0	0	111.4	R195 Q376 T383 M384	R195-D380 HydrophobicContact CB-CB 4.22Å; Q376-D380 VanDerWaalsContact NE2-CG 3.3Å; Q376-D380 PolarHBondContact NE2-OD1 2.87Å; Q376-D380 VanDerWaalsContact NE2-OD1 3.13Å; Q376-D380 PolarHBondContact NE2-OD2 2.51Å; Q376-D380 PolarHBondContact O-N 2.94Å; D380-T383 PolarHBondContact O-N 2.9Å; D380-M384 PolarHBondContact O-N 2.96Å; D380-M384 VanDerWaalsContact O-N 3.14Å
381	M	93.6	Very high	89.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-40.6	174	-79.4	-167.3	-66.1	0	0	112.4	V60 M64 L200 V203 G377 M378 T383 M384 F385	V60-M381 HydrophobicContact CG1-CB 3.78Å; V60-M381 HydrophobicContact CG1-CE 4Å; V60-M381 HydrophobicContact CG1-SD 4.33Å; M64-M381 HydrophobicContact SD-CE 4.36Å; M64-M381 HydrophobicContact SD-SD 4.33Å; L200-M381 WeakPolarHBondContact CA-SD 3.32Å; L200-M381 HydrophobicContact CB-CG 4.14Å; L200-M381 HydrophobicContact CB-SD 3.81Å; L200-M381 HydrophobicContact CD1-SD 3.61Å; L200-M381 HydrophobicContact CG-SD 4.28Å; V203-M381 HydrophobicContact CB-CE 3.77Å; V203-M381 HydrophobicContact CG1-CE 4.05Å; V203-M381 HydrophobicContact CG2-CE 3.54Å; G377-M381 WeakPolarHBondContact O-CB 3.46Å; G377-M381 VanDerWaalsContact O-CG 3.31Å; G377-M381 WeakPolarHBondContact O-CG 3.36Å; G377-M381 PolarHBondContact O-N 2.99Å; M378-M381 HydrophobicContact CG-CE 4.47Å; M378-M381 PolarHBondContact O-N 2.94Å; M378-M381 HydrophobicContact SD-CE 3.57Å; M378-M381 VanDerWaalsContact SD-CE 3.57Å; M381-T383 VanDerWaalsContact C-N 3.28Å; M381-T383 PolarHBondContact O-N 3.34Å; M381-M384 PolarHBondContact O-N 3.46Å; M381-F385 HydrophobicContact CB-CD2 4.06Å; M381-F385 HydrophobicContact CB-CE2 4.08Å; M381-F385 HydrophobicContact CG-CE2 4.38Å; M381-F385 WeakPolarHBondContact O-CB 3.32Å; M381-F385 WeakPolarHBondContact O-CD2 3.41Å; M381-F385 PolarHBondContact O-N 3.34Å; M381-F385 HydrophobicContact SD-CE2 4.16Å
382	Q	91.8	Very high	89.6	Confident	19 Å²	19	40 Å²	40	9%	0.089	21%	0.212	C	C	.	.	H	α-helix	trans	-60.5	-41.8	178.9	-165.7	174.9	20.6	0	0	110.9	H53 I55 V60 M378 V379 T386	H53-Q382 VanDerWaalsContact CB-CD 3.41Å; H53-Q382 HydrophobicContact CB-CG 3.82Å; H53-Q382 VanDerWaalsContact ND1-CD 3.32Å; H53-Q382 WeakPolarHBondContact ND1-CG 3.17Å; H53-Q382 PolarHBondContact ND1-OE1 3.4Å; I55-Q382 PolarHBondContact O-NE2 3.49Å; V60-Q382 HydrophobicContact CG2-CB 4.05Å; V60-Q382 HydrophobicContact CG2-CG 4.09Å; M378-Q382 VanDerWaalsContact O-CB 3.26Å; M378-Q382 WeakPolarHBondContact O-CB 3.48Å; M378-Q382 PolarHBondContact O-N 2.94Å; V379-Q382 PolarHBondContact O-N 3.29Å; Q382-T386 WeakPolarHBondContact O-CB 3.48Å; Q382-T386 PolarHBondContact O-N 2.82Å; Q382-T386 PolarHBondContact O-OG1 3.33Å
383	T	89.1	Confident	89.3	Confident	40 Å²	40	42.4 Å²	42.4	25%	0.245	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-48.7	173.9	-56	0	0	0	0	111.2	L50 A192 V379 D380 M381 T386 L387	L50-T383 HydrophobicContact CD2-CG2 4.3Å; A192-T383 HydrophobicContact CB-CG2 4.14Å; V379-T383 PolarHBondContact O-N 3.18Å; V379-T383 PolarHBondContact O-OG1 3.07Å; D380-T383 PolarHBondContact O-N 2.9Å; M381-T383 VanDerWaalsContact C-N 3.28Å; M381-T383 PolarHBondContact O-N 3.34Å; T383-T386 PolarHBondContact O-N 2.95Å; T383-L387 PolarHBondContact O-N 3.26Å
384	M	91.9	Very high	88.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-43.5	179.3	176.4	-166.6	68.9	0	0	112.8	I165 V169 T197 D380 M381 T386 L387	I165-M384 HydrophobicContact CG2-CE 3.56Å; I165-M384 HydrophobicContact CG2-SD 3.8Å; V169-M384 HydrophobicContact CG2-CG 3.97Å; V169-M384 HydrophobicContact CG2-SD 4.27Å; T197-M384 HydrophobicContact CG2-SD 4.13Å; D380-M384 PolarHBondContact O-N 2.96Å; D380-M384 VanDerWaalsContact O-N 3.14Å; M381-M384 PolarHBondContact O-N 3.46Å; M384-T386 VanDerWaalsContact C-N 3.3Å; M384-T386 PolarHBondContact O-N 2.97Å; M384-L387 VanDerWaalsContact O-CB 3.24Å; M384-L387 WeakPolarHBondContact O-CB 3.2Å; M384-L387 PolarHBondContact O-N 3Å; M384-L387 VanDerWaalsContact O-N 3.08Å
385	F	92.3	Very high	88.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.9	-30.4	-179.9	-75.1	-53.2	0	0	0	112.1	I55 V60 Q63 Y67 I165 M381 L387 L388 T389	I55-F385 HydrophobicContact CD1-CB 3.54Å; I55-F385 VanDerWaalsContact CD1-O 3.27Å; I55-F385 WeakPolarHBondContact CD1-O 3.22Å; V60-F385 HydrophobicContact CB-CD2 4.32Å; V60-F385 HydrophobicContact CG1-CD2 3.83Å; V60-F385 HydrophobicContact CG1-CE2 3.97Å; V60-F385 HydrophobicContact CG2-CD2 4.24Å; Q63-F385 HydrophobicContact CB-CE1 4.23Å; Q63-F385 HydrophobicContact CB-CE2 4.45Å; Q63-F385 HydrophobicContact CB-CZ 4.16Å; Q63-F385 HydrophobicContact CG-CD1 3.88Å; Q63-F385 HydrophobicContact CG-CE1 3.54Å; Q63-F385 HydrophobicContact CG-CZ 3.93Å; Q63-F385 VanDerWaalsContact OE1-CG 3.24Å; Y67-F385 HydrophobicContact CE2-CE1 4.11Å; I165-F385 HydrophobicContact CD1-CE1 4.38Å; I165-F385 HydrophobicContact CD1-CZ 4.08Å; I165-F385 HydrophobicContact CG2-CE1 4.48Å; M381-F385 HydrophobicContact CB-CD2 4.06Å; M381-F385 HydrophobicContact CB-CE2 4.08Å; M381-F385 HydrophobicContact CG-CE2 4.38Å; M381-F385 WeakPolarHBondContact O-CB 3.32Å; M381-F385 WeakPolarHBondContact O-CD2 3.41Å; M381-F385 PolarHBondContact O-N 3.34Å; M381-F385 HydrophobicContact SD-CE2 4.16Å; F385-L387 PolarHBondContact O-N 3.05Å; F385-L388 HydrophobicContact CD1-CD1 3.96Å; F385-L388 HydrophobicContact CE1-CD1 4.37Å; F385-L388 WeakPolarHBondContact O-CA 3.5Å; F385-L388 WeakPolarHBondContact O-CB 3.19Å; F385-L388 PolarHBondContact O-N 3.49Å; F385-T389 PolarHBondContact O-N 2.65Å
386	T	89.9	Confident	88	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-29.6	171.1	-56.6	0	0	0	0	111	L50 L54 Q382 T383 M384 L388 T389	L50-T386 HydrophobicContact CD2-CG2 3.62Å; L50-T386 HydrophobicContact CG-CG2 4.01Å; L54-T386 HydrophobicContact CB-CG2 4.34Å; L54-T386 HydrophobicContact CD1-CG2 4.1Å; L54-T386 HydrophobicContact CG-CG2 4.3Å; Q382-T386 WeakPolarHBondContact O-CB 3.48Å; Q382-T386 PolarHBondContact O-N 2.82Å; Q382-T386 PolarHBondContact O-OG1 3.33Å; T383-T386 PolarHBondContact O-N 2.95Å; M384-T386 VanDerWaalsContact C-N 3.3Å; M384-T386 PolarHBondContact O-N 2.97Å; T386-L388 VanDerWaalsContact C-N 3.3Å; T386-L388 PolarHBondContact O-N 3.03Å; T386-T389 WeakPolarHBondContact CA-OG1 3.46Å; T386-T389 PolarHBondContact O-N 2.96Å; T386-T389 PolarHBondContact O-OG1 3.1Å
387	L	89	Confident	87.8	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-33.8	172.7	-56.3	175.7	0	0	0	112.2	V169 H172 L189 A192 V193 T383 M384 F385 T389 L390	V169-L387 HydrophobicContact CG1-CD1 4.47Å; H172-L387 PolarHBondContact CD2-O 2.97Å; H172-L387 PolarHBondContact NE2-O 2.88Å; L189-L387 HydrophobicContact CD2-CD2 4.05Å; A192-L387 HydrophobicContact CB-CD1 4.22Å; V193-L387 HydrophobicContact CG2-CD1 4.25Å; T383-L387 PolarHBondContact O-N 3.26Å; M384-L387 VanDerWaalsContact O-CB 3.24Å; M384-L387 WeakPolarHBondContact O-CB 3.2Å; M384-L387 PolarHBondContact O-N 3Å; M384-L387 VanDerWaalsContact O-N 3.08Å; F385-L387 PolarHBondContact O-N 3.05Å; L387-T389 VanDerWaalsContact C-N 3.27Å; L387-T389 PolarHBondContact O-N 3.07Å; L387-L390 HydrophobicContact CD2-CD1 4.27Å; L387-L390 PolarHBondContact O-N 3.43Å
388	L	90.1	Very high	87.4	Confident	30 Å²	30	67 Å²	67	16%	0.157	34%	0.342	C	S	.	.	H	α-helix	trans	-75.5	-14.2	178.6	-67	-175.8	0	0	0	113.7	T168 V169 H172 F385 T386	T168-L388 HydrophobicContact CG2-CD2 4.42Å; V169-L388 HydrophobicContact CB-CD2 4.2Å; V169-L388 HydrophobicContact CG2-CD1 3.97Å; V169-L388 HydrophobicContact CG2-CD2 3.75Å; V169-L388 HydrophobicContact CG2-CG 3.88Å; H172-L388 HydrophobicContact CB-CD2 3.66Å; F385-L388 HydrophobicContact CD1-CD1 3.96Å; F385-L388 HydrophobicContact CE1-CD1 4.37Å; F385-L388 WeakPolarHBondContact O-CA 3.5Å; F385-L388 WeakPolarHBondContact O-CB 3.19Å; F385-L388 PolarHBondContact O-N 3.49Å; T386-L388 VanDerWaalsContact C-N 3.3Å; T386-L388 PolarHBondContact O-N 3.03Å
389	T	87.7	Confident	87.1	Confident	74 Å²	74	74.2 Å²	74.2	45%	0.454	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.5	175.4	51.3	0	0	0	0	112.9	I55 F385 T386 L387	I55-T389 HydrophobicContact CD1-CG2 3.6Å; I55-T389 HydrophobicContact CG1-CG2 3.92Å; F385-T389 PolarHBondContact O-N 2.65Å; T386-T389 WeakPolarHBondContact CA-OG1 3.46Å; T386-T389 PolarHBondContact O-N 2.96Å; T386-T389 PolarHBondContact O-OG1 3.1Å; L387-T389 VanDerWaalsContact C-N 3.27Å; L387-T389 PolarHBondContact O-N 3.07Å
390	L	87	Confident	86.9	Confident	46 Å²	46	74.7 Å²	74.7	24%	0.241	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-75.9	131.6	177.1	-59.2	175	0	0	0	109.4	H172 M176 Y180 L387	H172-L390 PolarHBondContact CE1-O 2.95Å; H172-L390 PolarHBondContact NE2-O 2.79Å; M176-L390 HydrophobicContact SD-CB 4.26Å; Y180-L390 HydrophobicContact CE2-CD1 3.65Å; L387-L390 HydrophobicContact CD2-CD1 4.27Å; L387-L390 PolarHBondContact O-N 3.43Å
391	S	83.1	Confident	86.6	Confident	86 Å²	86	82.8 Å²	82.8	60%	0.601	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-99	145.4	171	50.7	0	0	0	0	109.8
392	P	85	Confident	86.2	Confident	26 Å²	26	88.2 Å²	88.2	17%	0.169	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-55.5	141.5	168.8	-17.1	29	0	0	0	110.2	K175 M176 I394 E395	K175-P392 VanDerWaalsContact O-CG 3.31Å; K175-P392 WeakPolarHBondContact O-CG 3.41Å; M176-P392 HydrophobicContact CE-CG 3.77Å; P392-I394 PolarHBondContact O-N 2.84Å; P392-E395 HydrophobicContact CB-CG 4.3Å
393	T	79.3	Confident	85.7	Confident	118 Å²	118	94.3 Å²	94.3	72%	0.724	49%	0.485	S	S	*	.	S	Bend	trans	-71.3	-27.1	175.7	-42.9	0	0	0	0	111.2	D177	D177-T393 WeakPolarHBondContact OD1-CB 3.37Å; D177-T393 PolarHBondContact OD1-N 3.2Å; D177-T393 PolarHBondContact OD1-OG1 3.13Å
394	I	81.2	Confident	85.4	Confident	136 Å²	136	99.8 Å²	99.8	70%	0.697	51%	0.507	S	S	*	.	S	Bend	trans	-110.3	105	-178.6	-55.2	173.7	0	0	0	107.4	D177 P392	D177-I394 HydrophobicContact CB-CD1 4.34Å; D177-I394 HydrophobicContact CB-CG1 4.42Å; P392-I394 PolarHBondContact O-N 2.84Å
395	E	80.3	Confident	84.9	Confident	130 Å²	130	105.7 Å²	105.7	61%	0.607	54%	0.538	S	S	*	.			trans	-118.3	142.5	174.3	-64.3	-172.1	166.6	0	0	110.1	P392 K397	P392-E395 HydrophobicContact CB-CG 4.3Å; E395-K397 PolarHBondContact O-N 3.49Å
396	D	82.1	Confident	84.4	Confident	152 Å²	152	108.7 Å²	108.7	81%	0.813	56%	0.558	S	S	*	*			trans	-63.8	135.2	169.5	-71.4	-41.6	0	0	0	109.8
397	K	84.5	Confident	83.8	Confident	177 Å²	177	113.5 Å²	113.5	77%	0.77	59%	0.589	S	S	*	*			trans	-63.5	141.7	172.8	-66.8	-176.9	-179.3	179.3	0	109	E395 E399 A400	E395-K397 PolarHBondContact O-N 3.49Å; K397-E399 PolarHBondContact O-N 3.07Å; K397-A400 WeakPolarHBondContact O-CB 3.21Å; K397-A400 PolarHBondContact O-N 2.92Å
398	R	84.4	Confident	83.3	Confident	258 Å²	258	120.2 Å²	120.2	97%	0.974	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.7	-29.3	177.9	-66.6	-176.2	-179.1	176.2	1.2	113.5
399	E	86.6	Confident	83	Confident	178 Å²	178	122 Å²	122	83%	0.832	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	30.3	-179.6	-60.3	176.8	-172	0	0	112.3	K397 K401	K397-E399 PolarHBondContact O-N 3.07Å; E399-K401 PolarHBondContact O-N 3.09Å
400	A	85	Confident	82.8	Confident	65 Å²	65	120.4 Å²	120.4	54%	0.537	62%	0.624	S	S	.	*			trans	-55.3	115.4	175.4	0	0	0	0	0	110	K397	K397-A400 WeakPolarHBondContact O-CB 3.21Å; K397-A400 PolarHBondContact O-N 2.92Å
401	K	84.7	Confident	82.7	Confident	198 Å²	198	124.5 Å²	124.5	86%	0.861	64%	0.637	S	S	*	*			trans	-71.3	138.7	-179.9	-64.1	-178.7	-178.2	180	0	109.5	E399 L403	E399-K401 PolarHBondContact O-N 3.09Å; K401-L403 PolarHBondContact O-N 3.47Å
402	V	84.6	Confident	82.8	Confident	114 Å²	114	124.7 Å²	124.7	69%	0.691	63%	0.63	S	S	*	*			trans	-65.5	129.1	172.2	-178	0	0	0	0	108.7	H404	V402-H404 PolarHBondContact O-CD2 2.83Å; V402-H404 PolarHBondContact O-N 3.42Å
403	L	82.3	Confident	82.8	Confident	148 Å²	148	129.6 Å²	129.6	78%	0.775	65%	0.645	S	S	*	*			trans	-73.3	110.4	174.8	-77.2	158.7	0	0	0	109.4	K401 L405	K401-L403 PolarHBondContact O-N 3.47Å; L403-L405 PolarHBondContact O-N 2.82Å
404	H	83.3	Confident	83	Confident	155 Å²	155	127.6 Å²	127.6	72%	0.718	63%	0.627	S	S	*	*			trans	-87.1	99.8	172	-64.1	-75.2	0	0	0	109.8	V402 N409	V402-H404 PolarHBondContact O-CD2 2.83Å; V402-H404 PolarHBondContact O-N 3.42Å; H404-N409 PolarHBondContact O-ND2 3.46Å
405	L	81.1	Confident	83.4	Confident	124 Å²	124	127.2 Å²	127.2	65%	0.649	62%	0.622	S	S	*	*			trans	-93.2	135.8	-178.7	-63.3	168.8	0	0	0	111	L403 N409	L403-L405 PolarHBondContact O-N 2.82Å; L405-N409 WeakPolarHBondContact CA-OD1 3.44Å
406	C	81.4	Confident	84	Confident	63 Å²	63	125.7 Å²	125.7	43%	0.426	62%	0.618	S	S	.	*			trans	-134.2	154.6	172.6	-65.3	0	0	0	0	108.4	E408 N409 A410	C406-E408 WeakPolarHBondContact CB-OE2 3.18Å; C406-E408 PolarHBondContact O-N 3.08Å; C406-N409 PolarHBondContact N-OD1 3.44Å; C406-N409 PolarHBondContact O-N 3.02Å; C406-N409 PolarHBondContact O-OD1 3.19Å; C406-A410 WeakPolarHBondContact O-CB 3.37Å; C406-A410 PolarHBondContact O-N 3.07Å
407	P	77.5	Confident	84.1	Confident	102 Å²	102	120.4 Å²	120.4	66%	0.662	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	-31.4	-179.6	-27.1	35.5	0	0	0	113.8	A437	P407-A437 WeakPolarHBondContact O-CB 3.3Å
408	E	78.7	Confident	84.1	Confident	144 Å²	144	119.3 Å²	119.3	67%	0.673	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-26.1	-179.7	-55.2	73.4	-155.5	0	0	113.3	C406 W411	C406-E408 WeakPolarHBondContact CB-OE2 3.18Å; C406-E408 PolarHBondContact O-N 3.08Å; E408-W411 VanDerWaalsContact O-CE3 3.27Å; E408-W411 WeakPolarHBondContact O-CZ3 3.46Å
409	N	82.8	Confident	83.9	Confident	69 Å²	69	110.7 Å²	110.7	37%	0.369	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.7	-0.8	-176.5	78	7.3	0	0	0	114	H404 L405 C406 W411	H404-N409 PolarHBondContact O-ND2 3.46Å; L405-N409 WeakPolarHBondContact CA-OD1 3.44Å; C406-N409 PolarHBondContact N-OD1 3.44Å; C406-N409 PolarHBondContact O-N 3.02Å; C406-N409 PolarHBondContact O-OD1 3.19Å; N409-W411 PolarHBondContact O-N 3.08Å
410	A	84.4	Confident	83.2	Confident	39 Å²	39	108.8 Å²	108.8	32%	0.322	54%	0.539	S	S	.	.			trans	-79	34.9	-177.4	0	0	0	0	0	113.4	C406 A437	C406-A410 WeakPolarHBondContact O-CB 3.37Å; C406-A410 PolarHBondContact O-N 3.07Å; A410-A437 HydrophobicContact CB-CB 4.27Å; A410-A437 WeakPolarHBondContact O-CA 3.47Å
411	W	84.3	Confident	82.2	Confident	133 Å²	133	109.7 Å²	109.7	50%	0.504	53%	0.529	S	S	.	.			trans	-83.6	144.2	169.1	62	68.2	0	0	0	110.1	E408 N409 I435	E408-W411 VanDerWaalsContact O-CE3 3.27Å; E408-W411 WeakPolarHBondContact O-CZ3 3.46Å; N409-W411 PolarHBondContact O-N 3.08Å; W411-I435 WeakPolarHBondContact CA-O 3.34Å
412	I	84.7	Confident	81.3	Confident	90 Å²	90	103.3 Å²	103.3	46%	0.462	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.6	172.7	-57.1	172.8	0	0	0	107.1	F414 T434 I435	I412-F414 HydrophobicContact CG2-CD2 4.03Å; I412-F414 HydrophobicContact CG2-CE2 3.43Å; I412-F414 VanDerWaalsContact CG2-CE2 3.43Å; I412-F414 HydrophobicContact CG2-CZ 4.11Å; I412-T434 CarbonylContact O-C 3.58Å; I412-T434 WeakPolarHBondContact O-CA 3.39Å; I412-I435 HydrophobicContact CB-CB 4.17Å; I412-I435 HydrophobicContact CB-CD1 4.37Å; I412-I435 HydrophobicContact CB-CG1 4.44Å; I412-I435 HydrophobicContact CD1-CD1 4.41Å; I412-I435 PolarHBondContact N-O 3.47Å; I412-I435 PolarHBondContact O-N 3.14Å
413	R	85.3	Confident	80.6	Confident	129 Å²	129	103 Å²	103	49%	0.487	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.7	178.9	-161	-177.7	-68.1	173.6	1	111	E415 L433	R413-E415 WeakPolarHBondContact CD-OE1 3.21Å; R413-E415 HydrophobicContact CG-CG 3.8Å; R413-E415 IonicContact CZ-OE1 2.61Å; R413-E415 IonicContact NE-OE1 3.49Å; R413-E415 IonicContact NH1-OE1 2.66Å; R413-E415 PolarHBondContact NH1-OE1 3.28Å; R413-E415 VanDerWaalsContact NH1-OE1 3.12Å; R413-L433 CarbonylContact C-O 3.56Å; R413-L433 WeakPolarHBondContact CA-O 3.47Å
414	F	84.1	Confident	80	Confident	76 Å²	76	101.7 Å²	101.7	33%	0.333	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.5	164.7	-60.9	-96.9	0	0	0	106.2	I412 V417 F431 T432 L433	I412-F414 HydrophobicContact CG2-CD2 4.03Å; I412-F414 HydrophobicContact CG2-CE2 3.43Å; I412-F414 VanDerWaalsContact CG2-CE2 3.43Å; I412-F414 HydrophobicContact CG2-CZ 4.11Å; F414-V417 HydrophobicContact CB-CG2 3.79Å; F414-V417 HydrophobicContact CD1-CG2 4.06Å; F414-V417 HydrophobicContact CG-CG2 4.44Å; F414-F431 HydrophobicContact CB-CD1 3.83Å; F414-F431 HydrophobicContact CB-CE1 4.01Å; F414-F431 HydrophobicContact CD1-CD1 4.28Å; F414-F431 HydrophobicContact CD1-CE1 4.28Å; F414-F431 HydrophobicContact CD2-CE1 4.06Å; F414-F431 HydrophobicContact CG-CD1 4.04Å; F414-F431 AromaticContact CG-CE1 3.86Å; F414-F431 HydrophobicContact CG-CE1 3.86Å; F414-T432 CarbonylContact O-C 3.3Å; F414-T432 WeakPolarHBondContact O-CA 3.3Å; F414-L433 HydrophobicContact CB-CB 4.21Å; F414-L433 HydrophobicContact CD2-CB 3.92Å; F414-L433 HydrophobicContact CD2-CD2 4.24Å; F414-L433 HydrophobicContact CD2-CG 4.4Å; F414-L433 HydrophobicContact CE2-CD2 4.39Å; F414-L433 HydrophobicContact CG-CB 4.44Å; F414-L433 PolarHBondContact N-O 2.98Å; F414-L433 PolarHBondContact O-N 3.06Å
415	E	90.3	Very high	79.1	Confident	128 Å²	128	100.1 Å²	100.1	60%	0.598	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.8	176.2	-63	-176.5	172	0	0	107.7	R413 V417	R413-E415 WeakPolarHBondContact CD-OE1 3.21Å; R413-E415 HydrophobicContact CG-CG 3.8Å; R413-E415 IonicContact CZ-OE1 2.61Å; R413-E415 IonicContact NE-OE1 3.49Å; R413-E415 IonicContact NH1-OE1 2.66Å; R413-E415 PolarHBondContact NH1-OE1 3.28Å; R413-E415 VanDerWaalsContact NH1-OE1 3.12Å; E415-V417 VanDerWaalsContact C-N 3.3Å; E415-V417 WeakPolarHBondContact O-CG2 3.22Å; E415-V417 PolarHBondContact O-N 3.12Å
416	D	91.1	Very high	78.7	Confident	97 Å²	97	96.8 Å²	96.8	52%	0.519	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.3	46.2	175.9	-163.2	37.2	0	0	0	114.5	Y418 G430 T432	D416-Y418 VanDerWaalsContact O-CD2 3.22Å; D416-Y418 WeakPolarHBondContact O-CD2 3.34Å; D416-Y418 PolarHBondContact O-N 3.05Å; D416-Y418 WeakPolarHBondContact OD1-CE2 2.97Å; D416-G430 WeakPolarHBondContact OD1-CA 3.25Å; D416-T432 PolarHBondContact N-OG1 2.9Å
417	V	84.7	Confident	78.1	Confident	42 Å²	42	98.4 Å²	98.4	26%	0.255	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	121.4	-170.8	179.5	0	0	0	0	111.3	F414 E415 L428 G430 F431	F414-V417 HydrophobicContact CB-CG2 3.79Å; F414-V417 HydrophobicContact CD1-CG2 4.06Å; F414-V417 HydrophobicContact CG-CG2 4.44Å; E415-V417 VanDerWaalsContact C-N 3.3Å; E415-V417 WeakPolarHBondContact O-CG2 3.22Å; E415-V417 PolarHBondContact O-N 3.12Å; V417-L428 HydrophobicContact CG1-CD1 4Å; V417-L428 WeakPolarHBondContact O-CB 3.5Å; V417-G430 PolarHBondContact O-N 3.32Å; V417-F431 HydrophobicContact CB-CB 4.4Å; V417-F431 WeakPolarHBondContact CB-O 3.39Å; V417-F431 PolarHBondContact N-O 3.12Å; V417-F431 WeakPolarHBondContact O-CB 3.5Å; V417-F431 PolarHBondContact O-N 2.99Å
418	Y	84.9	Confident	78.1	Confident	153 Å²	153	95.9 Å²	95.9	60%	0.6	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.4	168.5	-66.1	-98.8	0	0	0	109.3	D416 L428 R429 G430	D416-Y418 VanDerWaalsContact O-CD2 3.22Å; D416-Y418 WeakPolarHBondContact O-CD2 3.34Å; D416-Y418 PolarHBondContact O-N 3.05Å; D416-Y418 WeakPolarHBondContact OD1-CE2 2.97Å; Y418-L428 WeakPolarHBondContact CA-O 3.37Å; Y418-R429 HydrophobicContact CE1-CB 4.39Å; Y418-G430 VanDerWaalsContact CZ-CA 3.5Å; Y418-G430 VanDerWaalsContact CZ-N 3.26Å
419	F	79.9	Confident	78.2	Confident	77 Å²	77	97 Å²	97	34%	0.338	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	137.4	-178.1	-175	-100.3	0	0	0	111.6	Y421 I427 L428	F419-Y421 HydrophobicContact CE1-CD1 4.19Å; F419-Y421 AromaticContact CE1-CD2 3.9Å; F419-Y421 HydrophobicContact CE1-CD2 3.9Å; F419-Y421 AromaticContact CE1-CE1 3.84Å; F419-Y421 HydrophobicContact CE1-CE1 3.84Å; F419-Y421 AromaticContact CE1-CE2 3.48Å; F419-Y421 HydrophobicContact CE1-CE2 3.48Å; F419-Y421 VanDerWaalsContact CE1-CE2 3.48Å; F419-Y421 HydrophobicContact CE1-CG 4.21Å; F419-Y421 AromaticContact CE1-CZ 3.42Å; F419-Y421 VanDerWaalsContact CE1-CZ 3.42Å; F419-Y421 AromaticContact CZ-CD1 3.9Å; F419-Y421 HydrophobicContact CZ-CD1 3.9Å; F419-Y421 HydrophobicContact CZ-CD2 4.42Å; F419-Y421 AromaticContact CZ-CE1 3.43Å; F419-Y421 HydrophobicContact CZ-CE1 3.43Å; F419-Y421 VanDerWaalsContact CZ-CE1 3.43Å; F419-Y421 AromaticContact CZ-CE2 3.99Å; F419-Y421 HydrophobicContact CZ-CE2 3.99Å; F419-Y421 HydrophobicContact CZ-CG 4.36Å; F419-Y421 AromaticContact CZ-CZ 3.43Å; F419-Y421 VanDerWaalsContact CZ-CZ 3.43Å; F419-I427 HydrophobicContact CD1-CB 4.24Å; F419-I427 HydrophobicContact CD1-CD1 4.28Å; F419-I427 HydrophobicContact CE1-CD1 4.23Å; F419-I427 PolarHBondContact O-N 2.76Å; F419-L428 HydrophobicContact CB-CB 3.9Å; F419-L428 HydrophobicContact CB-CD1 3.95Å; F419-L428 HydrophobicContact CB-CG 4.02Å; F419-L428 PolarHBondContact N-O 3Å; F419-L428 PolarHBondContact O-N 2.97Å
420	Y	72.3	Confident	78.3	Confident	138 Å²	138	94.7 Å²	94.7	54%	0.541	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143.1	174.7	60.8	-96	0	0	0	109.3	P423	Y420-P423 HydrophobicContact CD2-CG 4.44Å; Y420-P423 HydrophobicContact CE2-CB 4.48Å; Y420-P423 HydrophobicContact CE2-CG 4.12Å
421	Y	64.7	Low	78.1	Confident	84 Å²	84	94.5 Å²	94.5	33%	0.329	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-42.7	164.4	-68.3	-67.7	0	0	0	110.2	L178 N179 L182 F419 I427	L178-Y421 HydrophobicContact CB-CE1 4.33Å; L178-Y421 HydrophobicContact CD2-CE1 4.09Å; L178-Y421 HydrophobicContact CD2-CE2 4.34Å; L178-Y421 HydrophobicContact CG-CE1 4.37Å; N179-Y421 HydrophobicContact CB-CD1 4.15Å; N179-Y421 PolarHBondContact OD1-O 3.1Å; N179-Y421 VanDerWaalsContact OD1-O 3.06Å; L182-Y421 HydrophobicContact CD1-CD2 4.1Å; L182-Y421 HydrophobicContact CD1-CE2 4.49Å; L182-Y421 HydrophobicContact CD1-CG 4.23Å; F419-Y421 HydrophobicContact CE1-CD1 4.19Å; F419-Y421 AromaticContact CE1-CD2 3.9Å; F419-Y421 HydrophobicContact CE1-CD2 3.9Å; F419-Y421 AromaticContact CE1-CE1 3.84Å; F419-Y421 HydrophobicContact CE1-CE1 3.84Å; F419-Y421 AromaticContact CE1-CE2 3.48Å; F419-Y421 HydrophobicContact CE1-CE2 3.48Å; F419-Y421 VanDerWaalsContact CE1-CE2 3.48Å; F419-Y421 HydrophobicContact CE1-CG 4.21Å; F419-Y421 AromaticContact CE1-CZ 3.42Å; F419-Y421 VanDerWaalsContact CE1-CZ 3.42Å; F419-Y421 AromaticContact CZ-CD1 3.9Å; F419-Y421 HydrophobicContact CZ-CD1 3.9Å; F419-Y421 HydrophobicContact CZ-CD2 4.42Å; F419-Y421 AromaticContact CZ-CE1 3.43Å; F419-Y421 HydrophobicContact CZ-CE1 3.43Å; F419-Y421 VanDerWaalsContact CZ-CE1 3.43Å; F419-Y421 AromaticContact CZ-CE2 3.99Å; F419-Y421 HydrophobicContact CZ-CE2 3.99Å; F419-Y421 HydrophobicContact CZ-CG 4.36Å; F419-Y421 AromaticContact CZ-CZ 3.43Å; F419-Y421 VanDerWaalsContact CZ-CZ 3.43Å; Y421-I427 HydrophobicContact CD2-CD1 3.36Å; Y421-I427 HydrophobicContact CE2-CD1 3.73Å; Y421-I427 HydrophobicContact CG-CD1 4.4Å
422	L	64.1	Low	78.1	Confident	64 Å²	64	91.8 Å²	91.8	34%	0.335	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.4	175.6	-66.5	168	0	0	0	109.2	T424 Q425	L422-T424 PolarHBondContact O-N 2.92Å; L422-Q425 HydrophobicContact CB-CB 4.38Å; L422-Q425 CarbonylContact O-C 3.42Å; L422-Q425 PolarHBondContact O-N 3.47Å
423	P	70.1	Confident	77.8	Confident	108 Å²	108	88 Å²	88	70%	0.701	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.7	178.5	-26.7	34.1	0	0	0	113.8	Y420 Q425	Y420-P423 HydrophobicContact CD2-CG 4.44Å; Y420-P423 HydrophobicContact CE2-CB 4.48Å; Y420-P423 HydrophobicContact CE2-CG 4.12Å; P423-Q425 VanDerWaalsContact C-N 3.31Å
424	T	71.4	Confident	77.6	Confident	121 Å²	121	85.2 Å²	85.2	74%	0.742	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.4	178.3	54	0	0	0	0	113.8	L422	L422-T424 PolarHBondContact O-N 2.92Å
425	Q	63.8	Low	77.4	Confident	122 Å²	122	83.1 Å²	83.1	57%	0.57	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	77.5	-174	-64.1	-177.5	-5.7	0	0	110.9	L422 P423 I427	L422-Q425 HydrophobicContact CB-CB 4.38Å; L422-Q425 CarbonylContact O-C 3.42Å; L422-Q425 PolarHBondContact O-N 3.47Å; P423-Q425 VanDerWaalsContact C-N 3.31Å; Q425-I427 PolarHBondContact O-N 3.39Å
426	P	72.4	Confident	76.9	Confident	54 Å²	54	80.4 Å²	80.4	35%	0.351	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	130.3	172.8	28.1	-34.6	0	0	0	111.3	R429	P426-R429 HydrophobicContact CB-CG 4.3Å
427	I	68.7	Low	76.5	Confident	96 Å²	96	77.9 Å²	77.9	49%	0.492	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-47.5	-177	-62.3	174.8	0	0	0	110.6	F419 Y421 Q425	F419-I427 HydrophobicContact CD1-CB 4.24Å; F419-I427 HydrophobicContact CD1-CD1 4.28Å; F419-I427 HydrophobicContact CE1-CD1 4.23Å; F419-I427 PolarHBondContact O-N 2.76Å; Y421-I427 HydrophobicContact CD2-CD1 3.36Å; Y421-I427 HydrophobicContact CE2-CD1 3.73Å; Y421-I427 HydrophobicContact CG-CD1 4.4Å; Q425-I427 PolarHBondContact O-N 3.39Å
428	L	78.4	Confident	75.9	Confident	49 Å²	49	79.7 Å²	79.7	26%	0.257	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.8	174	-57.4	178.3	0	0	0	109.4	V417 Y418 F419 F431	V417-L428 HydrophobicContact CG1-CD1 4Å; V417-L428 WeakPolarHBondContact O-CB 3.5Å; Y418-L428 WeakPolarHBondContact CA-O 3.37Å; F419-L428 HydrophobicContact CB-CB 3.9Å; F419-L428 HydrophobicContact CB-CD1 3.95Å; F419-L428 HydrophobicContact CB-CG 4.02Å; F419-L428 PolarHBondContact N-O 3Å; F419-L428 PolarHBondContact O-N 2.97Å; L428-F431 HydrophobicContact CB-CB 4Å; L428-F431 HydrophobicContact CD1-CB 4.39Å; L428-F431 HydrophobicContact CD1-CD1 4.32Å; L428-F431 HydrophobicContact CD1-CG 4.48Å; L428-F431 HydrophobicContact CD2-CB 4.17Å; L428-F431 HydrophobicContact CD2-CD1 4.49Å; L428-F431 HydrophobicContact CD2-CD2 4.22Å; L428-F431 HydrophobicContact CD2-CG 4.06Å; L428-F431 HydrophobicContact CG-CB 4.42Å
429	R	80.9	Confident	75.1	Confident	168 Å²	168	79.1 Å²	79.1	63%	0.634	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	102.7	179.4	-59	179.4	-171.5	-179.2	0.9	108.3	Y418 P426 F431	Y418-R429 HydrophobicContact CE1-CB 4.39Å; P426-R429 HydrophobicContact CB-CG 4.3Å; R429-F431 VanDerWaalsContact C-N 3.26Å; R429-F431 PolarHBondContact O-N 3.43Å
430	G	84.8	Confident	74.4	Confident	21 Å²	21	83.3 Å²	83.3	22%	0.216	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.1	34	-178.8	0	0	0	0	0	114.1	D416 V417 Y418 T432	D416-G430 WeakPolarHBondContact OD1-CA 3.25Å; V417-G430 PolarHBondContact O-N 3.32Å; Y418-G430 VanDerWaalsContact CZ-CA 3.5Å; Y418-G430 VanDerWaalsContact CZ-N 3.26Å; G430-T432 PolarHBondContact O-N 3.47Å
431	F	79.8	Confident	74.1	Confident	35 Å²	35	80.5 Å²	80.5	15%	0.154	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	113.5	-172.1	179	-99.6	0	0	0	111.5	F414 V417 L428 R429 L433	F414-F431 HydrophobicContact CB-CD1 3.83Å; F414-F431 HydrophobicContact CB-CE1 4.01Å; F414-F431 HydrophobicContact CD1-CD1 4.28Å; F414-F431 HydrophobicContact CD1-CE1 4.28Å; F414-F431 HydrophobicContact CD2-CE1 4.06Å; F414-F431 HydrophobicContact CG-CD1 4.04Å; F414-F431 AromaticContact CG-CE1 3.86Å; F414-F431 HydrophobicContact CG-CE1 3.86Å; V417-F431 HydrophobicContact CB-CB 4.4Å; V417-F431 WeakPolarHBondContact CB-O 3.39Å; V417-F431 PolarHBondContact N-O 3.12Å; V417-F431 WeakPolarHBondContact O-CB 3.5Å; V417-F431 PolarHBondContact O-N 2.99Å; L428-F431 HydrophobicContact CB-CB 4Å; L428-F431 HydrophobicContact CD1-CB 4.39Å; L428-F431 HydrophobicContact CD1-CD1 4.32Å; L428-F431 HydrophobicContact CD1-CG 4.48Å; L428-F431 HydrophobicContact CD2-CB 4.17Å; L428-F431 HydrophobicContact CD2-CD1 4.49Å; L428-F431 HydrophobicContact CD2-CD2 4.22Å; L428-F431 HydrophobicContact CD2-CG 4.06Å; L428-F431 HydrophobicContact CG-CB 4.42Å; R429-F431 VanDerWaalsContact C-N 3.26Å; R429-F431 PolarHBondContact O-N 3.43Å; F431-L433 HydrophobicContact CD1-CB 4.33Å; F431-L433 HydrophobicContact CE1-CB 3.5Å; F431-L433 VanDerWaalsContact CE1-CB 3.5Å; F431-L433 HydrophobicContact CE1-CD2 4.05Å; F431-L433 HydrophobicContact CE1-CG 4.43Å; F431-L433 HydrophobicContact CZ-CB 3.64Å; F431-L433 HydrophobicContact CZ-CD2 3.78Å; F431-L433 HydrophobicContact CZ-CG 4.29Å
432	T	83.2	Confident	74.1	Confident	75 Å²	75	78.6 Å²	78.6	46%	0.46	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	105.1	178.9	-62.8	0	0	0	0	111.9	F414 D416 G430 R492	F414-T432 CarbonylContact O-C 3.3Å; F414-T432 WeakPolarHBondContact O-CA 3.3Å; D416-T432 PolarHBondContact N-OG1 2.9Å; G430-T432 PolarHBondContact O-N 3.47Å; T432-R492 VanDerWaalsContact O-CZ 3.25Å; T432-R492 PolarHBondContact O-NH1 2.98Å; T432-R492 PolarHBondContact O-NH2 3.5Å
433	L	78.9	Confident	74.5	Confident	10 Å²	10	79.8 Å²	79.8	5%	0.052	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.7	-177.9	177.4	63.1	0	0	0	109.8	R413 F414 F431 I435 R492	R413-L433 CarbonylContact C-O 3.56Å; R413-L433 WeakPolarHBondContact CA-O 3.47Å; F414-L433 HydrophobicContact CB-CB 4.21Å; F414-L433 HydrophobicContact CD2-CB 3.92Å; F414-L433 HydrophobicContact CD2-CD2 4.24Å; F414-L433 HydrophobicContact CD2-CG 4.4Å; F414-L433 HydrophobicContact CE2-CD2 4.39Å; F414-L433 HydrophobicContact CG-CB 4.44Å; F414-L433 PolarHBondContact N-O 2.98Å; F414-L433 PolarHBondContact O-N 3.06Å; F431-L433 HydrophobicContact CD1-CB 4.33Å; F431-L433 HydrophobicContact CE1-CB 3.5Å; F431-L433 VanDerWaalsContact CE1-CB 3.5Å; F431-L433 HydrophobicContact CE1-CD2 4.05Å; F431-L433 HydrophobicContact CE1-CG 4.43Å; F431-L433 HydrophobicContact CZ-CB 3.64Å; F431-L433 HydrophobicContact CZ-CD2 3.78Å; F431-L433 HydrophobicContact CZ-CG 4.29Å; L433-I435 HydrophobicContact CD1-CG1 4.34Å; L433-I435 HydrophobicContact CD2-CD1 3.87Å; L433-I435 HydrophobicContact CD2-CG1 3.73Å; L433-I435 HydrophobicContact CG-CG1 3.86Å; L433-R492 VanDerWaalsContact CB-NH2 3.34Å
434	T	81.9	Confident	75	Confident	71 Å²	71	74.9 Å²	74.9	44%	0.436	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.8	164.6	-56.5	0	0	0	0	108.3	I412 P436	I412-T434 CarbonylContact O-C 3.58Å; I412-T434 WeakPolarHBondContact O-CA 3.39Å; T434-P436 WeakPolarHBondContact O-CD 3.12Å
435	I	80.2	Confident	75.5	Confident	32 Å²	32	73 Å²	73	16%	0.164	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.2	167.4	-49.4	178.7	0	0	0	106.4	W411 I412 L433 K439	W411-I435 WeakPolarHBondContact CA-O 3.34Å; I412-I435 HydrophobicContact CB-CB 4.17Å; I412-I435 HydrophobicContact CB-CD1 4.37Å; I412-I435 HydrophobicContact CB-CG1 4.44Å; I412-I435 HydrophobicContact CD1-CD1 4.41Å; I412-I435 PolarHBondContact N-O 3.47Å; I412-I435 PolarHBondContact O-N 3.14Å; L433-I435 HydrophobicContact CD1-CG1 4.34Å; L433-I435 HydrophobicContact CD2-CD1 3.87Å; L433-I435 HydrophobicContact CD2-CG1 3.73Å; L433-I435 HydrophobicContact CG-CG1 3.86Å; I435-K439 HydrophobicContact CG2-CB 4.19Å; I435-K439 WeakPolarHBondContact CG2-O 3.38Å
436	P	79.7	Confident	76.2	Confident	72 Å²	72	72.6 Å²	72.6	47%	0.468	40%	0.398	S	S	.	.			trans	-59.9	154.7	174.1	-21.1	32.2	0	0	0	111.3	T434 G438 K439	T434-P436 WeakPolarHBondContact O-CD 3.12Å; P436-G438 PolarHBondContact O-N 3.23Å; P436-K439 HydrophobicContact CB-CB 4.45Å; P436-K439 HydrophobicContact CB-CG 3.92Å; P436-K439 HydrophobicContact CG-CG 4.16Å; P436-K439 PolarHBondContact O-N 3.22Å
437	A	81.2	Confident	76.9	Confident	43 Å²	43	72.5 Å²	72.5	36%	0.355	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	131.1	174.6	0	0	0	0	0	110.7	P407 A410 K439	P407-A437 WeakPolarHBondContact O-CB 3.3Å; A410-A437 HydrophobicContact CB-CB 4.27Å; A410-A437 WeakPolarHBondContact O-CA 3.47Å; A437-K439 VanDerWaalsContact C-N 3.33Å; A437-K439 PolarHBondContact O-N 2.97Å
438	G	73.1	Confident	77.9	Confident	80 Å²	80	69.5 Å²	69.5	83%	0.825	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	4.3	-179.3	0	0	0	0	0	116.4	P436	P436-G438 PolarHBondContact O-N 3.23Å
439	K	68.7	Low	78.6	Confident	142 Å²	142	67.3 Å²	67.3	62%	0.617	37%	0.369	S	S	*	.			trans	-99.7	156.5	176.6	-62.8	-62.5	-175.7	-176.2	0	112.7	I435 P436 A437	I435-K439 HydrophobicContact CG2-CB 4.19Å; I435-K439 WeakPolarHBondContact CG2-O 3.38Å; P436-K439 HydrophobicContact CB-CB 4.45Å; P436-K439 HydrophobicContact CB-CG 3.92Å; P436-K439 HydrophobicContact CG-CG 4.16Å; P436-K439 PolarHBondContact O-N 3.22Å; A437-K439 VanDerWaalsContact C-N 3.33Å; A437-K439 PolarHBondContact O-N 2.97Å
440	K	64.4	Low	79.2	Confident	164 Å²	164	61.5 Å²	61.5	71%	0.713	35%	0.351	S	S	*	.			trans	-126.4	143.7	177.2	-58.8	178	-171.1	177.3	0	109	D520	K440-D520 IonicContact NZ-OD1 2.68Å; K440-D520 IonicContact NZ-OD2 3.05Å; K440-D520 PolarHBondContact NZ-OD2 3.08Å
441	D	65	Low	79.4	Confident	80 Å²	80	64.9 Å²	64.9	43%	0.428	36%	0.358	S	S	.	.			trans	-131.5	146.4	-179.1	-163.3	5	0	0	0	111.3
442	C	66.2	Low	79.9	Confident	44 Å²	44	63.2 Å²	63.2	30%	0.297	35%	0.35	S	S	.	.			trans	-99	112.1	178.6	-174.2	0	0	0	0	110	L444	C442-L444 PolarHBondContact O-N 3.34Å
443	V	71.1	Confident	80.4	Confident	89 Å²	89	59.7 Å²	59.7	54%	0.539	33%	0.329	S	S	.	.			trans	-86.4	115.3	-177.4	-171.3	0	0	0	0	110.6
444	L	82.5	Confident	81.1	Confident	5 Å²	5	62 Å²	62	3%	0.026	34%	0.339	C	S	.	.			trans	-104.1	142.5	169.8	-61.1	-179.9	0	0	0	110.3	C442 V489 L496 K501 V504	C442-L444 PolarHBondContact O-N 3.34Å; L444-V489 HydrophobicContact CB-CG2 4.26Å; L444-L496 HydrophobicContact CD1-CD1 3.82Å; L444-K501 HydrophobicContact CD1-CB 4.48Å; L444-K501 HydrophobicContact CD1-CG 4.05Å; L444-V504 HydrophobicContact CD1-CG1 4.39Å; L444-V504 HydrophobicContact CD2-CG1 3.68Å
445	F	80.4	Confident	81.4	Confident	81 Å²	81	63.7 Å²	63.7	36%	0.355	34%	0.338	S	S	.	.			trans	-70.2	144.4	175.4	-63.7	-81.5	0	0	0	110.2	N447 Y451 N452 Y455 V489	F445-N447 HydrophobicContact CB-CB 4.24Å; F445-N447 PolarHBondContact O-N 3.19Å; F445-Y451 HydrophobicContact CB-CD1 4.34Å; F445-Y451 HydrophobicContact CB-CE1 4.24Å; F445-Y451 HydrophobicContact CD2-CD1 4.37Å; F445-Y451 AromaticContact CD2-CE1 3.95Å; F445-Y451 HydrophobicContact CD2-CE1 3.95Å; F445-Y451 HydrophobicContact CE2-CE1 4.48Å; F445-Y451 HydrophobicContact CG-CE1 4.02Å; F445-N452 PolarHBondContact N-OD1 2.97Å; F445-N452 PolarHBondContact O-ND2 3.47Å; F445-Y455 HydrophobicContact CD2-CD2 4.42Å; F445-Y455 HydrophobicContact CE2-CD1 4.09Å; F445-Y455 AromaticContact CE2-CD2 3.62Å; F445-Y455 HydrophobicContact CE2-CD2 3.62Å; F445-Y455 HydrophobicContact CE2-CE1 4.1Å; F445-Y455 AromaticContact CE2-CE2 3.64Å; F445-Y455 HydrophobicContact CE2-CE2 3.64Å; F445-Y455 AromaticContact CE2-CG 3.84Å; F445-Y455 HydrophobicContact CE2-CG 3.84Å; F445-Y455 AromaticContact CE2-CZ 3.88Å; F445-Y455 HydrophobicContact CZ-CD2 4.12Å; F445-Y455 HydrophobicContact CZ-CE1 4.31Å; F445-Y455 AromaticContact CZ-CE2 3.65Å; F445-Y455 HydrophobicContact CZ-CE2 3.65Å; F445-Y455 AromaticContact CZ-CZ 3.75Å; F445-V489 WeakPolarHBondContact O-CG2 3.27Å
446	H	79.6	Confident	81.6	Confident	113 Å²	113	62.6 Å²	62.6	52%	0.523	34%	0.335	S	S	.	.	S	Bend	trans	-69.5	72.4	167.3	-172.1	91.3	0	0	0	110.1	E491	H446-E491 HydrophobicContact CB-CG 4.2Å; H446-E491 WeakPolarHBondContact ND1-CG 3.43Å; H446-E491 PolarHBondContact ND1-N 3.09Å
447	N	85.8	Confident	82	Confident	52 Å²	52	61.9 Å²	61.9	28%	0.278	33%	0.327	S	S	.	.	S	Bend	trans	-150	-176.5	-176.5	-151.7	-32.6	0	0	0	109.6	F445 Y451 L488 V489	F445-N447 HydrophobicContact CB-CB 4.24Å; F445-N447 PolarHBondContact O-N 3.19Å; N447-Y451 HydrophobicContact CB-CD1 3.71Å; N447-Y451 HydrophobicContact CB-CE1 4.47Å; N447-Y451 HydrophobicContact CB-CG 4.01Å; N447-Y451 WeakPolarHBondContact ND2-CD1 3.46Å; N447-Y451 VanDerWaalsContact ND2-CG 3.32Å; N447-L488 WeakPolarHBondContact O-CA 3.1Å; N447-V489 PolarHBondContact O-N 3.32Å
448	T	90.8	Very high	82.2	Confident	33 Å²	33	64.5 Å²	64.5	20%	0.202	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-61.5	154.3	177	64.4	0	0	0	0	111	L450 Y451 N452 G486 T487 L488	T448-L450 PolarHBondContact O-N 2.82Å; T448-Y451 PolarHBondContact O-N 2.8Å; T448-Y451 WeakPolarHBondContact OG1-CB 3.47Å; T448-Y451 PolarHBondContact OG1-N 2.88Å; T448-Y451 VanDerWaalsContact OG1-N 3.07Å; T448-N452 PolarHBondContact O-N 2.78Å; T448-N452 VanDerWaalsContact O-N 3.11Å; T448-N452 PolarHBondContact O-ND2 3.43Å; T448-G486 WeakPolarHBondContact CG2-O 3.46Å; T448-T487 CarbonylContact C-O 3.47Å; T448-T487 WeakPolarHBondContact CA-O 3.35Å; T448-L488 HydrophobicContact CG2-CD2 4.29Å
449	I	92.2	Very high	82.8	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-56.9	-41.3	170.5	-69.2	169.6	0	0	0	109.8	Y451 N452 L453 I478 M481 Y485 T487 V489 L496	I449-Y451 VanDerWaalsContact C-N 3.35Å; I449-Y451 PolarHBondContact O-N 3.37Å; I449-N452 PolarHBondContact O-N 2.94Å; I449-L453 HydrophobicContact CG2-CD1 3.65Å; I449-L453 HydrophobicContact CG2-CG 4.09Å; I449-L453 VanDerWaalsContact O-CG 3.31Å; I449-L453 WeakPolarHBondContact O-CG 3.4Å; I449-L453 PolarHBondContact O-N 3.02Å; I449-I478 HydrophobicContact CD1-CG1 4.11Å; I449-I478 HydrophobicContact CD1-CG2 4.39Å; I449-I478 HydrophobicContact CG2-CD1 3.55Å; I449-I478 HydrophobicContact CG2-CG1 3.97Å; I449-M481 HydrophobicContact CD1-CE 4.22Å; I449-M481 HydrophobicContact CD1-SD 3.41Å; I449-M481 WeakPolarHBondContact CD1-SD 3.49Å; I449-Y485 HydrophobicContact CG2-CD1 4.38Å; I449-Y485 PolarHBondContact N-O 2.85Å; I449-T487 HydrophobicContact CD1-CG2 4.5Å; I449-T487 WeakPolarHBondContact CG1-O 3.49Å; I449-T487 PolarHBondContact N-O 3.49Å; I449-V489 HydrophobicContact CB-CG1 4.29Å; I449-V489 HydrophobicContact CD1-CG1 4.41Å; I449-V489 HydrophobicContact CG1-CG1 3.33Å; I449-L496 HydrophobicContact CD1-CD2 4.32Å
450	L	93	Very high	83.8	Confident	47 Å²	47	61 Å²	61	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-51.5	-52.4	174.9	-177	61.3	0	0	0	111.9	T448 N452 L453 Q454 L462 V465 Y485	T448-L450 PolarHBondContact O-N 2.82Å; L450-N452 PolarHBondContact O-N 3.02Å; L450-L453 PolarHBondContact O-N 3.39Å; L450-Q454 VanDerWaalsContact O-CB 3.27Å; L450-Q454 WeakPolarHBondContact O-CB 3.38Å; L450-Q454 PolarHBondContact O-N 2.89Å; L450-L462 HydrophobicContact CD1-CD1 3.43Å; L450-L462 VanDerWaalsContact CD1-CD1 3.43Å; L450-L462 HydrophobicContact CD2-CD1 4.19Å; L450-L462 HydrophobicContact CG-CD1 4.47Å; L450-V465 HydrophobicContact CD1-CB 4.3Å; L450-V465 HydrophobicContact CD1-CG1 3.89Å; L450-Y485 WeakPolarHBondContact CB-O 3.05Å; L450-Y485 PolarHBondContact N-O 2.79Å
451	Y	89.2	Confident	85	Confident	91 Å²	91	55.5 Å²	55.5	36%	0.357	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-44.3	-179	-177.5	-89.6	0	0	0	111.7	F445 N447 T448 I449 L453 Y455	F445-Y451 HydrophobicContact CB-CD1 4.34Å; F445-Y451 HydrophobicContact CB-CE1 4.24Å; F445-Y451 HydrophobicContact CD2-CD1 4.37Å; F445-Y451 AromaticContact CD2-CE1 3.95Å; F445-Y451 HydrophobicContact CD2-CE1 3.95Å; F445-Y451 HydrophobicContact CE2-CE1 4.48Å; F445-Y451 HydrophobicContact CG-CE1 4.02Å; N447-Y451 HydrophobicContact CB-CD1 3.71Å; N447-Y451 HydrophobicContact CB-CE1 4.47Å; N447-Y451 HydrophobicContact CB-CG 4.01Å; N447-Y451 WeakPolarHBondContact ND2-CD1 3.46Å; N447-Y451 VanDerWaalsContact ND2-CG 3.32Å; T448-Y451 PolarHBondContact O-N 2.8Å; T448-Y451 WeakPolarHBondContact OG1-CB 3.47Å; T448-Y451 PolarHBondContact OG1-N 2.88Å; T448-Y451 VanDerWaalsContact OG1-N 3.07Å; I449-Y451 VanDerWaalsContact C-N 3.35Å; I449-Y451 PolarHBondContact O-N 3.37Å; Y451-L453 VanDerWaalsContact C-N 3.33Å; Y451-L453 PolarHBondContact O-N 2.89Å; Y451-Y455 HydrophobicContact CE1-CD2 4.42Å; Y451-Y455 PolarHBondContact O-N 3.14Å
452	N	91.6	Very high	86.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-38.7	179.1	-83.6	-79	0	0	0	112.4	F445 T448 I449 L450 Y455 V489 V504 R508	F445-N452 PolarHBondContact N-OD1 2.97Å; F445-N452 PolarHBondContact O-ND2 3.47Å; T448-N452 PolarHBondContact O-N 2.78Å; T448-N452 VanDerWaalsContact O-N 3.11Å; T448-N452 PolarHBondContact O-ND2 3.43Å; I449-N452 PolarHBondContact O-N 2.94Å; L450-N452 PolarHBondContact O-N 3.02Å; N452-Y455 WeakPolarHBondContact O-CB 3.34Å; N452-V489 WeakPolarHBondContact ND2-CG2 3.36Å; N452-V504 HydrophobicContact CB-CG1 4.49Å; N452-R508 WeakPolarHBondContact O-CD 3.36Å; N452-R508 WeakPolarHBondContact O-CG 3.44Å
453	L	93.7	Very high	87.7	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-71.1	-51.8	176.2	-67.1	171.3	0	0	0	111.5	I449 L450 Y451 Y455 G456 V465 A469 L474 I478 Y485 V504 A507 L511	I449-L453 HydrophobicContact CG2-CD1 3.65Å; I449-L453 HydrophobicContact CG2-CG 4.09Å; I449-L453 VanDerWaalsContact O-CG 3.31Å; I449-L453 WeakPolarHBondContact O-CG 3.4Å; I449-L453 PolarHBondContact O-N 3.02Å; L450-L453 PolarHBondContact O-N 3.39Å; Y451-L453 VanDerWaalsContact C-N 3.33Å; Y451-L453 PolarHBondContact O-N 2.89Å; L453-Y455 PolarHBondContact O-N 3.4Å; L453-G456 PolarHBondContact O-N 3.01Å; L453-V465 HydrophobicContact CB-CG1 3.59Å; L453-V465 HydrophobicContact CD1-CG1 3.85Å; L453-V465 HydrophobicContact CG-CG1 4.39Å; L453-A469 HydrophobicContact CD1-CB 4.21Å; L453-L474 HydrophobicContact CD2-CD2 4.09Å; L453-I478 HydrophobicContact CD1-CD1 4.11Å; L453-Y485 HydrophobicContact CD1-CD1 4.08Å; L453-Y485 HydrophobicContact CD1-CE1 3.82Å; L453-V504 HydrophobicContact CD2-CB 4.41Å; L453-V504 HydrophobicContact CD2-CG1 4.05Å; L453-V504 HydrophobicContact CD2-CG2 4.44Å; L453-A507 HydrophobicContact CD2-CB 3.44Å; L453-A507 VanDerWaalsContact CD2-CB 3.44Å; L453-L511 HydrophobicContact CB-CD1 4.38Å; L453-L511 WeakPolarHBondContact O-CD1 3.29Å
454	Q	92.3	Very high	88.7	Confident	59 Å²	59	62.1 Å²	62.1	28%	0.276	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-22	-179.7	-163.3	177.6	18.5	0	0	112.1	L450 G456 N457 I458 A460 V465	L450-Q454 VanDerWaalsContact O-CB 3.27Å; L450-Q454 WeakPolarHBondContact O-CB 3.38Å; L450-Q454 PolarHBondContact O-N 2.89Å; Q454-G456 PolarHBondContact O-N 2.91Å; Q454-G456 VanDerWaalsContact O-N 3.09Å; Q454-N457 CarbonylContact O-C 3.51Å; Q454-N457 WeakPolarHBondContact O-CA 3.24Å; Q454-N457 PolarHBondContact O-N 3.27Å; Q454-I458 WeakPolarHBondContact O-CA 3.32Å; Q454-I458 PolarHBondContact O-N 3.48Å; Q454-A460 PolarHBondContact NE2-O 3.42Å; Q454-V465 HydrophobicContact CB-CG2 4.03Å; Q454-V465 HydrophobicContact CG-CG2 4.13Å
455	Y	88.8	Confident	89.3	Confident	106 Å²	106	61.9 Å²	61.9	42%	0.416	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.9	171.6	-158.6	-90.3	0	0	0	113.8	F445 Y451 N452 L453 N457	F445-Y455 HydrophobicContact CD2-CD2 4.42Å; F445-Y455 HydrophobicContact CE2-CD1 4.09Å; F445-Y455 AromaticContact CE2-CD2 3.62Å; F445-Y455 HydrophobicContact CE2-CD2 3.62Å; F445-Y455 HydrophobicContact CE2-CE1 4.1Å; F445-Y455 AromaticContact CE2-CE2 3.64Å; F445-Y455 HydrophobicContact CE2-CE2 3.64Å; F445-Y455 AromaticContact CE2-CG 3.84Å; F445-Y455 HydrophobicContact CE2-CG 3.84Å; F445-Y455 AromaticContact CE2-CZ 3.88Å; F445-Y455 HydrophobicContact CZ-CD2 4.12Å; F445-Y455 HydrophobicContact CZ-CE1 4.31Å; F445-Y455 AromaticContact CZ-CE2 3.65Å; F445-Y455 HydrophobicContact CZ-CE2 3.65Å; F445-Y455 AromaticContact CZ-CZ 3.75Å; Y451-Y455 HydrophobicContact CE1-CD2 4.42Å; Y451-Y455 PolarHBondContact O-N 3.14Å; N452-Y455 WeakPolarHBondContact O-CB 3.34Å; L453-Y455 PolarHBondContact O-N 3.4Å; Y455-N457 VanDerWaalsContact C-N 3.28Å; Y455-N457 PolarHBondContact O-N 2.85Å
456	G	85.3	Confident	90	Very high	9 Å²	9	60.1 Å²	60.1	9%	0.093	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-36.3	170.6	0	0	0	0	0	113.1	L453 Q454 K512	L453-G456 PolarHBondContact O-N 3.01Å; Q454-G456 PolarHBondContact O-N 2.91Å; Q454-G456 VanDerWaalsContact O-N 3.09Å; G456-K512 WeakPolarHBondContact O-CA 3.39Å; G456-K512 WeakPolarHBondContact O-CB 3.25Å; G456-K512 WeakPolarHBondContact O-CD 3.43Å
457	N	87.7	Confident	90.6	Very high	57 Å²	57	59.8 Å²	59.8	31%	0.305	30%	0.298	S	S	.	.			trans	-152.7	103.4	172.1	175.3	1.8	0	0	0	108.8	Q454 Y455 N459 A460 L511	Q454-N457 CarbonylContact O-C 3.51Å; Q454-N457 WeakPolarHBondContact O-CA 3.24Å; Q454-N457 PolarHBondContact O-N 3.27Å; Y455-N457 VanDerWaalsContact C-N 3.28Å; Y455-N457 PolarHBondContact O-N 2.85Å; N457-N459 PolarHBondContact O-N 3.03Å; N457-N459 VanDerWaalsContact O-N 3.08Å; N457-N459 PolarHBondContact OD1-N 3.33Å; N457-N459 VanDerWaalsContact OD1-N 3.12Å; N457-A460 HydrophobicContact CB-CB 4.09Å; N457-A460 WeakPolarHBondContact O-CB 3.46Å; N457-A460 PolarHBondContact O-N 3.06Å; N457-L511 HydrophobicContact CB-CB 4.19Å; N457-L511 WeakPolarHBondContact CB-O 3.4Å
458	I	85.7	Confident	90.8	Very high	99 Å²	99	57.4 Å²	57.4	51%	0.508	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.2	-173.1	-60.2	167.7	0	0	0	111.7	P39 Q454 A460	P39-I458 HydrophobicContact CG-CG2 4.18Å; Q454-I458 WeakPolarHBondContact O-CA 3.32Å; Q454-I458 PolarHBondContact O-N 3.48Å; I458-A460 VanDerWaalsContact C-N 3.33Å
459	N	85.3	Confident	90.9	Very high	145 Å²	145	55.9 Å²	55.9	78%	0.775	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-1	178.7	-58	-28.7	0	0	0	112.9	N457 S461	N457-N459 PolarHBondContact O-N 3.03Å; N457-N459 VanDerWaalsContact O-N 3.08Å; N457-N459 PolarHBondContact OD1-N 3.33Å; N457-N459 VanDerWaalsContact OD1-N 3.12Å; N459-S461 PolarHBondContact O-N 3.41Å
460	A	88.6	Confident	90.8	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	30%	0.297	C	S	.	.			trans	-65.7	135	-179.7	0	0	0	0	0	110.7	Q454 N457 I458 Q464 V465 L511	Q454-A460 PolarHBondContact NE2-O 3.42Å; N457-A460 HydrophobicContact CB-CB 4.09Å; N457-A460 WeakPolarHBondContact O-CB 3.46Å; N457-A460 PolarHBondContact O-N 3.06Å; I458-A460 VanDerWaalsContact C-N 3.33Å; A460-Q464 HydrophobicContact CB-CB 4.21Å; A460-V465 HydrophobicContact CB-CG2 4.13Å; A460-L511 HydrophobicContact CB-CD2 3.82Å
461	S	91	Very high	90.5	Very high	49 Å²	49	60.2 Å²	60.2	34%	0.343	30%	0.296	S	S	.	.			trans	-68.1	159.6	172.1	72.8	0	0	0	0	110.5	N459 E463 Q464 V465	N459-S461 PolarHBondContact O-N 3.41Å; S461-E463 PolarHBondContact O-N 3.22Å; S461-Q464 PolarHBondContact O-N 2.96Å; S461-Q464 VanDerWaalsContact O-N 3.11Å; S461-Q464 WeakPolarHBondContact OG-CG 3.23Å; S461-Q464 PolarHBondContact OG-N 3.46Å; S461-V465 WeakPolarHBondContact O-CG2 3.35Å; S461-V465 PolarHBondContact O-N 3.33Å
462	L	92.6	Very high	90.4	Very high	96 Å²	96	55.9 Å²	55.9	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-55	-38.7	175	178.7	62.9	0	0	0	111.6	L450 V465 I466	L450-L462 HydrophobicContact CD1-CD1 3.43Å; L450-L462 VanDerWaalsContact CD1-CD1 3.43Å; L450-L462 HydrophobicContact CD2-CD1 4.19Å; L450-L462 HydrophobicContact CG-CD1 4.47Å; L462-V465 PolarHBondContact O-N 3.09Å; L462-I466 HydrophobicContact CD1-CD1 4.23Å; L462-I466 HydrophobicContact CD1-CG1 4.44Å; L462-I466 HydrophobicContact CG-CD1 3.93Å; L462-I466 VanDerWaalsContact O-CG1 3.29Å; L462-I466 WeakPolarHBondContact O-CG1 3.38Å; L462-I466 PolarHBondContact O-N 3.5Å
463	E	94.3	Very high	90.2	Very high	155 Å²	155	58.9 Å²	58.9	72%	0.724	30%	0.295	S	S	*	.	H	α-helix	trans	-61.9	-44.2	177.5	-63.7	176.7	174.5	0	0	112	S461 V465 I466 E467	S461-E463 PolarHBondContact O-N 3.22Å; E463-V465 VanDerWaalsContact C-N 3.32Å; E463-V465 PolarHBondContact O-N 3.01Å; E463-I466 PolarHBondContact O-N 3.35Å; E463-E467 WeakPolarHBondContact O-CB 3.49Å; E463-E467 PolarHBondContact O-N 3.43Å
464	Q	92.9	Very high	90	Very high	102 Å²	102	59 Å²	59	48%	0.477	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-37.8	176.3	-71.8	172.8	-27.4	0	0	112	A460 S461 E467 A468 L511	A460-Q464 HydrophobicContact CB-CB 4.21Å; S461-Q464 PolarHBondContact O-N 2.96Å; S461-Q464 VanDerWaalsContact O-N 3.11Å; S461-Q464 WeakPolarHBondContact OG-CG 3.23Å; S461-Q464 PolarHBondContact OG-N 3.46Å; Q464-E467 PolarHBondContact O-N 3Å; Q464-A468 WeakPolarHBondContact O-CB 3.29Å; Q464-A468 PolarHBondContact O-N 3.49Å; Q464-L511 HydrophobicContact CB-CD2 4.25Å
465	V	94.4	Very high	90	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-42.7	175.7	176.8	0	0	0	0	111.2	L450 L453 Q454 A460 S461 L462 E463 E467 A468 A469 L511	L450-V465 HydrophobicContact CD1-CB 4.3Å; L450-V465 HydrophobicContact CD1-CG1 3.89Å; L453-V465 HydrophobicContact CB-CG1 3.59Å; L453-V465 HydrophobicContact CD1-CG1 3.85Å; L453-V465 HydrophobicContact CG-CG1 4.39Å; Q454-V465 HydrophobicContact CB-CG2 4.03Å; Q454-V465 HydrophobicContact CG-CG2 4.13Å; A460-V465 HydrophobicContact CB-CG2 4.13Å; S461-V465 WeakPolarHBondContact O-CG2 3.35Å; S461-V465 PolarHBondContact O-N 3.33Å; L462-V465 PolarHBondContact O-N 3.09Å; E463-V465 VanDerWaalsContact C-N 3.32Å; E463-V465 PolarHBondContact O-N 3.01Å; V465-E467 VanDerWaalsContact C-N 3.33Å; V465-A468 PolarHBondContact O-N 3.44Å; V465-A469 WeakPolarHBondContact O-CB 3.4Å; V465-A469 PolarHBondContact O-N 3.3Å; V465-L511 HydrophobicContact CG2-CD1 4.07Å; V465-L511 HydrophobicContact CG2-CD2 4.34Å
466	I	95.3	Very high	90.1	Very high	44 Å²	44	57.9 Å²	57.9	23%	0.226	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176.4	-68.5	166.4	0	0	0	110.4	L462 E463 A469 K470 Y485	L462-I466 HydrophobicContact CD1-CD1 4.23Å; L462-I466 HydrophobicContact CD1-CG1 4.44Å; L462-I466 HydrophobicContact CG-CD1 3.93Å; L462-I466 VanDerWaalsContact O-CG1 3.29Å; L462-I466 WeakPolarHBondContact O-CG1 3.38Å; L462-I466 PolarHBondContact O-N 3.5Å; E463-I466 PolarHBondContact O-N 3.35Å; I466-A469 PolarHBondContact O-N 3.41Å; I466-K470 HydrophobicContact CG2-CD 4.39Å; I466-K470 WeakPolarHBondContact O-CG 3.46Å; I466-K470 PolarHBondContact O-N 2.94Å; I466-Y485 HydrophobicContact CG1-CE1 4.46Å; I466-Y485 HydrophobicContact CG1-CE2 3.82Å
467	E	91.9	Very high	90.2	Very high	105 Å²	105	57.8 Å²	57.8	49%	0.491	30%	0.296	S	S	.	.	H	α-helix	trans	-63.8	-45.8	178.6	-169.9	56.2	-152.9	0	0	111.6	E463 Q464 V465 A469 K470 V471	E463-E467 WeakPolarHBondContact O-CB 3.49Å; E463-E467 PolarHBondContact O-N 3.43Å; Q464-E467 PolarHBondContact O-N 3Å; V465-E467 VanDerWaalsContact C-N 3.33Å; E467-A469 VanDerWaalsContact C-N 3.27Å; E467-A469 PolarHBondContact O-N 2.96Å; E467-K470 WeakPolarHBondContact O-CB 3.31Å; E467-K470 PolarHBondContact O-N 3.12Å; E467-K470 VanDerWaalsContact O-N 3.1Å; E467-V471 WeakPolarHBondContact O-CG2 3.45Å; E467-V471 PolarHBondContact O-N 3.12Å
468	A	91.1	Very high	90.4	Very high	3 Å²	3	55.1 Å²	55.1	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-38	174.7	0	0	0	0	0	112.4	Q464 V465 A472 I510 L511	Q464-A468 WeakPolarHBondContact O-CB 3.29Å; Q464-A468 PolarHBondContact O-N 3.49Å; V465-A468 PolarHBondContact O-N 3.44Å; A468-A472 VanDerWaalsContact O-CB 3.25Å; A468-A472 WeakPolarHBondContact O-CB 3.48Å; A468-A472 PolarHBondContact O-N 3.07Å; A468-I510 HydrophobicContact CB-CB 4.18Å; A468-I510 HydrophobicContact CB-CG2 3.86Å; A468-L511 HydrophobicContact CB-CD1 4.16Å; A468-L511 HydrophobicContact CB-CD2 3.85Å; A468-L511 HydrophobicContact CB-CG 3.58Å
469	A	92.4	Very high	90.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-32.2	175.4	0	0	0	0	0	112.9	L453 V465 I466 E467 D473 L474 H475 I478 Y485	L453-A469 HydrophobicContact CD1-CB 4.21Å; V465-A469 WeakPolarHBondContact O-CB 3.4Å; V465-A469 PolarHBondContact O-N 3.3Å; I466-A469 PolarHBondContact O-N 3.41Å; E467-A469 VanDerWaalsContact C-N 3.27Å; E467-A469 PolarHBondContact O-N 2.96Å; A469-D473 PolarHBondContact O-N 2.86Å; A469-L474 HydrophobicContact CB-CB 4.5Å; A469-L474 WeakPolarHBondContact O-CA 3.11Å; A469-L474 WeakPolarHBondContact O-CB 3.39Å; A469-L474 PolarHBondContact O-N 2.87Å; A469-H475 PolarHBondContact O-N 2.88Å; A469-H475 VanDerWaalsContact O-N 3.1Å; A469-I478 HydrophobicContact CB-CD1 4.3Å; A469-Y485 HydrophobicContact CB-CE1 4.01Å; A469-Y485 VanDerWaalsContact CB-OH 3.28Å; A469-Y485 WeakPolarHBondContact CB-OH 3.1Å
470	K	90.7	Very high	91.1	Very high	105 Å²	105	58.5 Å²	58.5	46%	0.457	28%	0.283	S	S	.	.	H	α-helix	trans	-69.2	-47	172.9	-73.6	174.7	-179.6	175.8	0	111.7	I466 E467 A472 D473 H475	I466-K470 HydrophobicContact CG2-CD 4.39Å; I466-K470 WeakPolarHBondContact O-CG 3.46Å; I466-K470 PolarHBondContact O-N 2.94Å; E467-K470 WeakPolarHBondContact O-CB 3.31Å; E467-K470 PolarHBondContact O-N 3.12Å; E467-K470 VanDerWaalsContact O-N 3.1Å; K470-A472 PolarHBondContact O-N 2.76Å; K470-D473 PolarHBondContact O-N 3.3Å; K470-H475 HydrophobicContact CB-CB 4.4Å; K470-H475 HydrophobicContact CG-CB 3.64Å
471	V	86.1	Confident	91.2	Very high	37 Å²	37	60 Å²	60	22%	0.224	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-36.7	177.2	176.6	0	0	0	0	110.9	E467 D473 I510 S537 K540	E467-V471 WeakPolarHBondContact O-CG2 3.45Å; E467-V471 PolarHBondContact O-N 3.12Å; V471-D473 VanDerWaalsContact C-N 3.25Å; V471-D473 PolarHBondContact O-N 2.95Å; V471-I510 HydrophobicContact CB-CD1 3.9Å; V471-I510 HydrophobicContact CG1-CD1 3.59Å; V471-S537 WeakPolarHBondContact O-CB 3.33Å; V471-S537 PolarHBondContact O-OG 2.84Å; V471-K540 HydrophobicContact CG1-CB 3.93Å
472	A	87.9	Confident	90.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	8.9	175.9	0	0	0	0	0	114.9	A468 K470 L474 R503 I506 A507 I510	A468-A472 VanDerWaalsContact O-CB 3.25Å; A468-A472 WeakPolarHBondContact O-CB 3.48Å; A468-A472 PolarHBondContact O-N 3.07Å; K470-A472 PolarHBondContact O-N 2.76Å; A472-L474 PolarHBondContact O-N 2.93Å; A472-R503 WeakPolarHBondContact O-CD 3.35Å; A472-R503 VanDerWaalsContact O-CG 3.29Å; A472-R503 WeakPolarHBondContact O-CG 3.07Å; A472-I506 HydrophobicContact CB-CB 4.39Å; A472-I506 HydrophobicContact CB-CG2 4.12Å; A472-A507 HydrophobicContact CB-CB 3.75Å; A472-I510 HydrophobicContact CB-CD1 4.23Å
473	D	86.5	Confident	90.6	Very high	63 Å²	63	65.3 Å²	65.3	34%	0.337	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	35	-178.1	-166	39.3	0	0	0	113.8	A469 K470 V471 R503 N533 S537	A469-D473 PolarHBondContact O-N 2.86Å; K470-D473 PolarHBondContact O-N 3.3Å; V471-D473 VanDerWaalsContact C-N 3.25Å; V471-D473 PolarHBondContact O-N 2.95Å; D473-R503 VanDerWaalsContact O-CD 3.29Å; D473-R503 WeakPolarHBondContact O-CD 3.18Å; D473-R503 PolarHBondContact O-NE 3.47Å; D473-N533 PolarHBondContact OD2-ND2 2.93Å; D473-S537 WeakPolarHBondContact CB-OG 3.19Å
474	L	89.7	Confident	90.5	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	29%	0.294	C	S	.	.			trans	-109	-24	-176.7	-171.9	63.7	0	0	0	112.3	L453 A469 A472 D476 A477 I478 E500 R503 V504	L453-L474 HydrophobicContact CD2-CD2 4.09Å; A469-L474 HydrophobicContact CB-CB 4.5Å; A469-L474 WeakPolarHBondContact O-CA 3.11Å; A469-L474 WeakPolarHBondContact O-CB 3.39Å; A469-L474 PolarHBondContact O-N 2.87Å; A472-L474 PolarHBondContact O-N 2.93Å; L474-D476 PolarHBondContact O-N 3.25Å; L474-A477 HydrophobicContact CD1-CB 4.47Å; L474-A477 PolarHBondContact O-N 3.41Å; L474-I478 HydrophobicContact CB-CD1 4.42Å; L474-I478 HydrophobicContact CD1-CG1 4.42Å; L474-I478 HydrophobicContact CD2-CD1 3.78Å; L474-I478 HydrophobicContact CD2-CG1 4.41Å; L474-I478 HydrophobicContact CG-CD1 3.6Å; L474-I478 HydrophobicContact CG-CG1 3.88Å; L474-I478 WeakPolarHBondContact O-CG1 3.31Å; L474-I478 PolarHBondContact O-N 3.47Å; L474-E500 HydrophobicContact CD1-CB 4.31Å; L474-E500 HydrophobicContact CD1-CG 4.32Å; L474-R503 HydrophobicContact CB-CB 4.17Å; L474-R503 HydrophobicContact CD1-CB 4Å; L474-R503 HydrophobicContact CG-CB 4.43Å; L474-V504 HydrophobicContact CD2-CB 4.38Å; L474-V504 HydrophobicContact CD2-CG2 3.53Å
475	H	92.7	Very high	90.6	Very high	38 Å²	38	54.8 Å²	54.8	18%	0.176	28%	0.275	C	S	.	.	H	α-helix	trans	-54.1	-50.4	-173.6	-178.2	51.3	0	0	0	113.2	A469 K470 A477 I478 M479 Y485	A469-H475 PolarHBondContact O-N 2.88Å; A469-H475 VanDerWaalsContact O-N 3.1Å; K470-H475 HydrophobicContact CB-CB 4.4Å; K470-H475 HydrophobicContact CG-CB 3.64Å; H475-A477 VanDerWaalsContact C-N 3.33Å; H475-A477 PolarHBondContact O-N 2.78Å; H475-I478 WeakPolarHBondContact O-CB 3.4Å; H475-I478 PolarHBondContact O-N 3.12Å; H475-I478 VanDerWaalsContact O-N 3.16Å; H475-M479 VanDerWaalsContact CE1-CG 3.47Å; H475-M479 WeakPolarHBondContact CE1-CG 3.44Å; H475-M479 WeakPolarHBondContact O-CG 3.35Å; H475-M479 PolarHBondContact O-N 2.95Å; H475-Y485 AromaticContact CE1-CE2 3.93Å; H475-Y485 AromaticContact ND1-CE2 3.63Å; H475-Y485 AromaticContact ND1-CZ 3.64Å; H475-Y485 PolarHBondContact ND1-OH 2.94Å
476	D	89.6	Confident	90.4	Very high	105 Å²	105	56.6 Å²	56.6	56%	0.561	29%	0.294	S	S	*	.	H	α-helix	trans	-70	-32.1	-176.6	-62	-26.2	0	0	0	112.4	L474 M479 R480	L474-D476 PolarHBondContact O-N 3.25Å; D476-M479 PolarHBondContact O-N 3Å; D476-R480 WeakPolarHBondContact O-CG 3.3Å; D476-R480 PolarHBondContact O-N 3.46Å; D476-R480 VanDerWaalsContact O-N 3.16Å; D476-R480 PolarHBondContact O-NE 3.46Å
477	A	88.7	Confident	90.2	Very high	7 Å²	7	55.4 Å²	55.4	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-43.4	171.5	0	0	0	0	0	111.1	L474 H475 R480 M481	L474-A477 HydrophobicContact CD1-CB 4.47Å; L474-A477 PolarHBondContact O-N 3.41Å; H475-A477 VanDerWaalsContact C-N 3.33Å; H475-A477 PolarHBondContact O-N 2.78Å; A477-R480 PolarHBondContact O-N 2.92Å; A477-M481 WeakPolarHBondContact O-CG 3.36Å
478	I	92.4	Very high	89.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-45.8	175.6	-65.9	167.9	0	0	0	110.8	I449 L453 A469 L474 H475 R480 M481 G484 Y485	I449-I478 HydrophobicContact CD1-CG1 4.11Å; I449-I478 HydrophobicContact CD1-CG2 4.39Å; I449-I478 HydrophobicContact CG2-CD1 3.55Å; I449-I478 HydrophobicContact CG2-CG1 3.97Å; L453-I478 HydrophobicContact CD1-CD1 4.11Å; A469-I478 HydrophobicContact CB-CD1 4.3Å; L474-I478 HydrophobicContact CB-CD1 4.42Å; L474-I478 HydrophobicContact CD1-CG1 4.42Å; L474-I478 HydrophobicContact CD2-CD1 3.78Å; L474-I478 HydrophobicContact CD2-CG1 4.41Å; L474-I478 HydrophobicContact CG-CD1 3.6Å; L474-I478 HydrophobicContact CG-CG1 3.88Å; L474-I478 WeakPolarHBondContact O-CG1 3.31Å; L474-I478 PolarHBondContact O-N 3.47Å; H475-I478 WeakPolarHBondContact O-CB 3.4Å; H475-I478 PolarHBondContact O-N 3.12Å; H475-I478 VanDerWaalsContact O-N 3.16Å; I478-R480 PolarHBondContact O-N 3.3Å; I478-M481 VanDerWaalsContact O-CB 3.24Å; I478-M481 WeakPolarHBondContact O-CB 3.39Å; I478-M481 PolarHBondContact O-N 2.99Å; I478-G484 WeakPolarHBondContact O-CA 3.46Å; I478-Y485 HydrophobicContact CD1-CD1 4Å; I478-Y485 HydrophobicContact CD1-CE1 3.53Å; I478-Y485 HydrophobicContact CG2-CD1 4.02Å; I478-Y485 HydrophobicContact CG2-CD2 3.95Å; I478-Y485 HydrophobicContact CG2-CE1 4.24Å; I478-Y485 HydrophobicContact CG2-CE2 4.18Å; I478-Y485 HydrophobicContact CG2-CG 3.86Å; I478-Y485 VanDerWaalsContact CG2-N 3.33Å
479	M	92.8	Very high	89.5	Confident	110 Å²	110	53.8 Å²	53.8	54%	0.542	28%	0.283	S	S	.	.	H	α-helix	trans	-67.2	-23.5	-176.7	-69.3	-57	-64.9	0	0	113.3	H475 D476 M481 Y485	H475-M479 VanDerWaalsContact CE1-CG 3.47Å; H475-M479 WeakPolarHBondContact CE1-CG 3.44Å; H475-M479 WeakPolarHBondContact O-CG 3.35Å; H475-M479 PolarHBondContact O-N 2.95Å; D476-M479 PolarHBondContact O-N 3Å; M479-M481 PolarHBondContact O-N 3.21Å; M479-Y485 HydrophobicContact SD-CE2 4.34Å
480	R	91.5	Very high	88.5	Confident	205 Å²	205	54 Å²	54	77%	0.774	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.6	170.2	-74.9	-176.6	-69.3	169.8	-1.4	113.5	D476 A477 I478	D476-R480 WeakPolarHBondContact O-CG 3.3Å; D476-R480 PolarHBondContact O-N 3.46Å; D476-R480 VanDerWaalsContact O-N 3.16Å; D476-R480 PolarHBondContact O-NE 3.46Å; A477-R480 PolarHBondContact O-N 2.92Å; I478-R480 PolarHBondContact O-N 3.3Å
481	M	90.8	Very high	87.4	Confident	32 Å²	32	54.2 Å²	54.2	16%	0.158	29%	0.287	C	S	.	.	S	Bend	trans	-81.5	146.3	178.6	-57.3	179.5	-179.2	0	0	111.1	I449 A477 I478 M479 L483 G484 T487 L496	I449-M481 HydrophobicContact CD1-CE 4.22Å; I449-M481 HydrophobicContact CD1-SD 3.41Å; I449-M481 WeakPolarHBondContact CD1-SD 3.49Å; A477-M481 WeakPolarHBondContact O-CG 3.36Å; I478-M481 VanDerWaalsContact O-CB 3.24Å; I478-M481 WeakPolarHBondContact O-CB 3.39Å; I478-M481 PolarHBondContact O-N 2.99Å; M479-M481 PolarHBondContact O-N 3.21Å; M481-L483 PolarHBondContact O-N 3.11Å; M481-G484 PolarHBondContact O-N 3.38Å; M481-T487 HydrophobicContact CB-CG2 4.21Å; M481-T487 WeakPolarHBondContact CB-OG1 3.31Å; M481-T487 HydrophobicContact SD-CG2 3.88Å; M481-L496 HydrophobicContact CE-CD2 3.61Å; M481-L496 HydrophobicContact SD-CD2 4.48Å
482	P	81.6	Confident	86.3	Confident	132 Å²	132	55.2 Å²	55.2	86%	0.857	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.1	-174.1	-28	34.3	0	0	0	115.9
483	L	89.5	Confident	85.5	Confident	125 Å²	125	55.2 Å²	55.2	65%	0.654	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	10.5	-178.6	-64.7	173	0	0	0	112.7	M481 Y485 G486 T487	M481-L483 PolarHBondContact O-N 3.11Å; L483-Y485 PolarHBondContact O-N 3.24Å; L483-G486 WeakPolarHBondContact O-CA 3.49Å; L483-G486 PolarHBondContact O-N 3.01Å; L483-T487 PolarHBondContact N-OG1 3.31Å
484	G	92.7	Very high	84.7	Confident	13 Å²	13	58.4 Å²	58.4	13%	0.134	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	51.5	-130.1	-176.5	0	0	0	0	0	112	I478 M481 G486 T487	I478-G484 WeakPolarHBondContact O-CA 3.46Å; M481-G484 PolarHBondContact O-N 3.38Å; G484-G486 PolarHBondContact O-N 3.07Å; G484-T487 PolarHBondContact N-OG1 3.06Å; G484-T487 WeakPolarHBondContact O-CB 3.32Å; G484-T487 PolarHBondContact O-N 3.39Å; G484-T487 PolarHBondContact O-OG1 3.2Å
485	Y	94	Very high	84.1	Confident	24 Å²	24	65.2 Å²	65.2	9%	0.094	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-63.1	-20.8	176.3	-74.3	-84.1	0	0	0	114.4	I449 L450 L453 I466 A469 H475 I478 M479 L483 T487	I449-Y485 HydrophobicContact CG2-CD1 4.38Å; I449-Y485 PolarHBondContact N-O 2.85Å; L450-Y485 WeakPolarHBondContact CB-O 3.05Å; L450-Y485 PolarHBondContact N-O 2.79Å; L453-Y485 HydrophobicContact CD1-CD1 4.08Å; L453-Y485 HydrophobicContact CD1-CE1 3.82Å; I466-Y485 HydrophobicContact CG1-CE1 4.46Å; I466-Y485 HydrophobicContact CG1-CE2 3.82Å; A469-Y485 HydrophobicContact CB-CE1 4.01Å; A469-Y485 VanDerWaalsContact CB-OH 3.28Å; A469-Y485 WeakPolarHBondContact CB-OH 3.1Å; H475-Y485 AromaticContact CE1-CE2 3.93Å; H475-Y485 AromaticContact ND1-CE2 3.63Å; H475-Y485 AromaticContact ND1-CZ 3.64Å; H475-Y485 PolarHBondContact ND1-OH 2.94Å; I478-Y485 HydrophobicContact CD1-CD1 4Å; I478-Y485 HydrophobicContact CD1-CE1 3.53Å; I478-Y485 HydrophobicContact CG2-CD1 4.02Å; I478-Y485 HydrophobicContact CG2-CD2 3.95Å; I478-Y485 HydrophobicContact CG2-CE1 4.24Å; I478-Y485 HydrophobicContact CG2-CE2 4.18Å; I478-Y485 HydrophobicContact CG2-CG 3.86Å; I478-Y485 VanDerWaalsContact CG2-N 3.33Å; M479-Y485 HydrophobicContact SD-CE2 4.34Å; L483-Y485 PolarHBondContact O-N 3.24Å; Y485-T487 PolarHBondContact O-N 3.39Å
486	G	90.9	Very high	83.6	Confident	37 Å²	37	64 Å²	64	38%	0.381	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-77.7	-5.8	173.1	0	0	0	0	0	113.8	T448 L483 G484 L488	T448-G486 WeakPolarHBondContact CG2-O 3.46Å; L483-G486 WeakPolarHBondContact O-CA 3.49Å; L483-G486 PolarHBondContact O-N 3.01Å; G484-G486 PolarHBondContact O-N 3.07Å; G486-L488 PolarHBondContact O-N 3.16Å
487	T	91	Very high	83.1	Confident	19 Å²	19	61.8 Å²	61.8	12%	0.117	32%	0.321	C	S	.	.			trans	-61.8	126.3	178.4	-56.2	0	0	0	0	110.2	T448 I449 M481 L483 G484 Y485 V489	T448-T487 CarbonylContact C-O 3.47Å; T448-T487 WeakPolarHBondContact CA-O 3.35Å; I449-T487 HydrophobicContact CD1-CG2 4.5Å; I449-T487 WeakPolarHBondContact CG1-O 3.49Å; I449-T487 PolarHBondContact N-O 3.49Å; M481-T487 HydrophobicContact CB-CG2 4.21Å; M481-T487 WeakPolarHBondContact CB-OG1 3.31Å; M481-T487 HydrophobicContact SD-CG2 3.88Å; L483-T487 PolarHBondContact N-OG1 3.31Å; G484-T487 PolarHBondContact N-OG1 3.06Å; G484-T487 WeakPolarHBondContact O-CB 3.32Å; G484-T487 PolarHBondContact O-N 3.39Å; G484-T487 PolarHBondContact O-OG1 3.2Å; Y485-T487 PolarHBondContact O-N 3.39Å; T487-V489 PolarHBondContact O-N 3.3Å
488	L	84.6	Confident	82.5	Confident	74 Å²	74	63.8 Å²	63.8	39%	0.387	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-69.9	126.1	172.3	-67.9	171	0	0	0	109.1	N447 T448 G486 G490 K495	N447-L488 WeakPolarHBondContact O-CA 3.1Å; T448-L488 HydrophobicContact CG2-CD2 4.29Å; G486-L488 PolarHBondContact O-N 3.16Å; L488-G490 PolarHBondContact O-N 3.09Å; L488-K495 VanDerWaalsContact O-CD 3.3Å; L488-K495 WeakPolarHBondContact O-CD 3.36Å
489	V	83.1	Confident	81.8	Confident	1 Å²	1	64 Å²	64	1%	0.006	34%	0.344	C	S	.	.			trans	-71.3	-13.2	180	-56.4	0	0	0	0	112.6	L444 F445 N447 I449 N452 T487 G493 L494 K495 L496	L444-V489 HydrophobicContact CB-CG2 4.26Å; F445-V489 WeakPolarHBondContact O-CG2 3.27Å; N447-V489 PolarHBondContact O-N 3.32Å; I449-V489 HydrophobicContact CB-CG1 4.29Å; I449-V489 HydrophobicContact CD1-CG1 4.41Å; I449-V489 HydrophobicContact CG1-CG1 3.33Å; N452-V489 WeakPolarHBondContact ND2-CG2 3.36Å; T487-V489 PolarHBondContact O-N 3.3Å; V489-G493 CarbonylContact O-C 3.59Å; V489-G493 WeakPolarHBondContact O-CA 3.33Å; V489-L494 PolarHBondContact O-N 2.9Å; V489-K495 WeakPolarHBondContact O-CB 3.13Å; V489-K495 PolarHBondContact O-N 3.05Å; V489-L496 HydrophobicContact CB-CD1 4.1Å; V489-L496 HydrophobicContact CB-CG 4.31Å; V489-L496 HydrophobicContact CG1-CD1 3.83Å; V489-L496 HydrophobicContact CG1-CG 4.33Å
490	G	72.7	Confident	81.5	Confident	5 Å²	5	60.2 Å²	60.2	5%	0.052	33%	0.325	C	S	.	.			trans	77.9	173.9	-171	0	0	0	0	0	111.6	L488 R492 G493	L488-G490 PolarHBondContact O-N 3.09Å; G490-R492 PolarHBondContact O-N 3.24Å; G490-G493 PolarHBondContact O-N 3.19Å; G490-G493 VanDerWaalsContact O-N 3.12Å
491	E	67.9	Low	81.1	Confident	108 Å²	108	52.2 Å²	52.2	51%	0.505	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.9	133	175.8	-67	-169.3	154.2	0	0	109	H446 G493 L494	H446-E491 HydrophobicContact CB-CG 4.2Å; H446-E491 WeakPolarHBondContact ND1-CG 3.43Å; H446-E491 PolarHBondContact ND1-N 3.09Å; E491-G493 PolarHBondContact O-N 3.28Å; E491-L494 WeakPolarHBondContact O-CB 3.5Å; E491-L494 WeakPolarHBondContact O-CD1 3.46Å; E491-L494 WeakPolarHBondContact O-CG 3.5Å; E491-L494 PolarHBondContact O-N 3.4Å
492	R	62	Low	80.7	Confident	59 Å²	59	53.1 Å²	53.1	22%	0.223	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	57.6	17.3	-175.5	-52.5	-173.9	176.3	137.3	21.9	115.8	T432 L433 G490 L494 K501	T432-R492 VanDerWaalsContact O-CZ 3.25Å; T432-R492 PolarHBondContact O-NH1 2.98Å; T432-R492 PolarHBondContact O-NH2 3.5Å; L433-R492 VanDerWaalsContact CB-NH2 3.34Å; G490-R492 PolarHBondContact O-N 3.24Å; R492-L494 VanDerWaalsContact C-N 3.27Å; R492-L494 PolarHBondContact O-N 3.11Å; R492-K501 VanDerWaalsContact O-CE 3.25Å; R492-K501 WeakPolarHBondContact O-CE 3.34Å; R492-K501 PolarHBondContact O-NZ 2.67Å
493	G	70.7	Confident	80.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	65.5	28.9	-171.1	0	0	0	0	0	113.5	V489 G490 E491 K495 L496 K501	V489-G493 CarbonylContact O-C 3.59Å; V489-G493 WeakPolarHBondContact O-CA 3.33Å; G490-G493 PolarHBondContact O-N 3.19Å; G490-G493 VanDerWaalsContact O-N 3.12Å; E491-G493 PolarHBondContact O-N 3.28Å; G493-K495 PolarHBondContact O-N 2.83Å; G493-L496 WeakPolarHBondContact O-CA 3.4Å; G493-L496 WeakPolarHBondContact O-CB 3.3Å; G493-L496 PolarHBondContact O-N 3.23Å; G493-K501 WeakPolarHBondContact O-CE 3.3Å
494	L	70.5	Confident	80.9	Confident	130 Å²	130	42.3 Å²	42.3	68%	0.681	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-22.4	179.2	-81.4	166.3	0	0	0	114.2	V489 E491 R492 L496	V489-L494 PolarHBondContact O-N 2.9Å; E491-L494 WeakPolarHBondContact O-CB 3.5Å; E491-L494 WeakPolarHBondContact O-CD1 3.46Å; E491-L494 WeakPolarHBondContact O-CG 3.5Å; E491-L494 PolarHBondContact O-N 3.4Å; R492-L494 VanDerWaalsContact C-N 3.27Å; R492-L494 PolarHBondContact O-N 3.11Å; L494-L496 VanDerWaalsContact C-N 3.25Å
495	K	76.8	Confident	80.6	Confident	144 Å²	144	43.3 Å²	43.3	63%	0.626	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.4	174.8	-62.1	-179.8	172.4	-176.2	0	113.7	L488 V489 G493	L488-K495 VanDerWaalsContact O-CD 3.3Å; L488-K495 WeakPolarHBondContact O-CD 3.36Å; V489-K495 WeakPolarHBondContact O-CB 3.13Å; V489-K495 PolarHBondContact O-N 3.05Å; G493-K495 PolarHBondContact O-N 2.83Å
496	L	81.4	Confident	80.2	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.063	24%	0.239	C	C	.	.	S	Bend	trans	-108.4	137.7	176.1	-58.2	179.7	0	0	0	109.9	L444 I449 M481 V489 G493 L494 E500 K501 V504	L444-L496 HydrophobicContact CD1-CD1 3.82Å; I449-L496 HydrophobicContact CD1-CD2 4.32Å; M481-L496 HydrophobicContact CE-CD2 3.61Å; M481-L496 HydrophobicContact SD-CD2 4.48Å; V489-L496 HydrophobicContact CB-CD1 4.1Å; V489-L496 HydrophobicContact CB-CG 4.31Å; V489-L496 HydrophobicContact CG1-CD1 3.83Å; V489-L496 HydrophobicContact CG1-CG 4.33Å; G493-L496 WeakPolarHBondContact O-CA 3.4Å; G493-L496 WeakPolarHBondContact O-CB 3.3Å; G493-L496 PolarHBondContact O-N 3.23Å; L494-L496 VanDerWaalsContact C-N 3.25Å; L496-E500 WeakPolarHBondContact CA-OE2 3.46Å; L496-E500 HydrophobicContact CB-CB 3.96Å; L496-E500 HydrophobicContact CD2-CB 4.32Å; L496-K501 HydrophobicContact CB-CG 3.89Å; L496-K501 WeakPolarHBondContact O-CE 3.44Å; L496-V504 HydrophobicContact CD1-CG2 4Å
497	S	80.3	Confident	80.2	Confident	60 Å²	60	40.9 Å²	40.9	42%	0.42	22%	0.221	S	C	.	.			trans	-62.7	162	168	63.8	0	0	0	0	111.8	G499 E500 K501	S497-G499 VanDerWaalsContact C-N 3.31Å; S497-G499 PolarHBondContact O-N 3.45Å; S497-E500 WeakPolarHBondContact CB-OE2 2.97Å; S497-E500 PolarHBondContact N-OE2 2.97Å; S497-E500 PolarHBondContact O-N 3.05Å; S497-E500 VanDerWaalsContact O-N 3.12Å; S497-E500 WeakPolarHBondContact OG-CB 3.44Å; S497-E500 WeakPolarHBondContact OG-CG 3.5Å; S497-E500 PolarHBondContact OG-N 2.98Å; S497-E500 PolarHBondContact OG-OE2 3.13Å; S497-K501 WeakPolarHBondContact O-CG 3.33Å; S497-K501 PolarHBondContact O-N 3.09Å
498	G	76.2	Confident	80.2	Confident	48 Å²	48	42.4 Å²	42.4	50%	0.495	22%	0.224	S	C	.	.	H	α-helix	trans	-55.3	-44.2	177.1	0	0	0	0	0	112.9	E500 K501 Q502	G498-E500 PolarHBondContact O-N 3.16Å; G498-K501 PolarHBondContact O-N 3.26Å; G498-Q502 PolarHBondContact O-N 3.46Å; G498-Q502 VanDerWaalsContact O-N 3.09Å
499	G	77.2	Confident	80.3	Confident	6 Å²	6	41 Å²	41	6%	0.062	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-38.5	175.7	0	0	0	0	0	113.2	S497 Q502 R503	S497-G499 VanDerWaalsContact C-N 3.31Å; S497-G499 PolarHBondContact O-N 3.45Å; G499-Q502 PolarHBondContact O-N 3.46Å; G499-R503 WeakPolarHBondContact O-CG 3.41Å; G499-R503 PolarHBondContact O-N 2.85Å
500	E	85.8	Confident	80.5	Confident	30 Å²	30	42.3 Å²	42.3	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-41.1	175.1	-73.2	165.8	150.4	0	0	112.2	L474 L496 S497 G498 Q502 R503 V504	L474-E500 HydrophobicContact CD1-CB 4.31Å; L474-E500 HydrophobicContact CD1-CG 4.32Å; L496-E500 WeakPolarHBondContact CA-OE2 3.46Å; L496-E500 HydrophobicContact CB-CB 3.96Å; L496-E500 HydrophobicContact CD2-CB 4.32Å; S497-E500 WeakPolarHBondContact CB-OE2 2.97Å; S497-E500 PolarHBondContact N-OE2 2.97Å; S497-E500 PolarHBondContact O-N 3.05Å; S497-E500 VanDerWaalsContact O-N 3.12Å; S497-E500 WeakPolarHBondContact OG-CB 3.44Å; S497-E500 WeakPolarHBondContact OG-CG 3.5Å; S497-E500 PolarHBondContact OG-N 2.98Å; S497-E500 PolarHBondContact OG-OE2 3.13Å; G498-E500 PolarHBondContact O-N 3.16Å; E500-Q502 VanDerWaalsContact C-N 3.32Å; E500-Q502 PolarHBondContact O-N 2.73Å; E500-R503 VanDerWaalsContact CG-NH2 3.31Å; E500-R503 PolarHBondContact O-N 2.79Å; E500-V504 WeakPolarHBondContact O-CG2 3.42Å; E500-V504 PolarHBondContact O-N 3.24Å
501	K	84.1	Confident	81.4	Confident	37 Å²	37	42.9 Å²	42.9	16%	0.161	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-41.9	175.7	-67.8	-176.1	-170.6	-169.2	0	111.9	L444 R492 G493 L496 S497 G498 V504 A505	L444-K501 HydrophobicContact CD1-CB 4.48Å; L444-K501 HydrophobicContact CD1-CG 4.05Å; R492-K501 VanDerWaalsContact O-CE 3.25Å; R492-K501 WeakPolarHBondContact O-CE 3.34Å; R492-K501 PolarHBondContact O-NZ 2.67Å; G493-K501 WeakPolarHBondContact O-CE 3.3Å; L496-K501 HydrophobicContact CB-CG 3.89Å; L496-K501 WeakPolarHBondContact O-CE 3.44Å; S497-K501 WeakPolarHBondContact O-CG 3.33Å; S497-K501 PolarHBondContact O-N 3.09Å; G498-K501 PolarHBondContact O-N 3.26Å; K501-V504 WeakPolarHBondContact O-CB 3.38Å; K501-V504 PolarHBondContact O-N 3Å; K501-A505 PolarHBondContact O-N 3.12Å
502	Q	81.3	Confident	82.4	Confident	52 Å²	52	44.8 Å²	44.8	24%	0.243	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-43.5	175.2	-73.2	-172.9	-6.8	0	0	111.7	G498 G499 E500 V504 A505 I506 A522 L526 I534	G498-Q502 PolarHBondContact O-N 3.46Å; G498-Q502 VanDerWaalsContact O-N 3.09Å; G499-Q502 PolarHBondContact O-N 3.46Å; E500-Q502 VanDerWaalsContact C-N 3.32Å; E500-Q502 PolarHBondContact O-N 2.73Å; Q502-V504 VanDerWaalsContact C-N 3.28Å; Q502-V504 PolarHBondContact O-N 3.28Å; Q502-A505 WeakPolarHBondContact O-CA 3.39Å; Q502-A505 WeakPolarHBondContact O-CB 3.46Å; Q502-A505 PolarHBondContact O-N 2.97Å; Q502-I506 WeakPolarHBondContact O-CG1 3.41Å; Q502-I506 PolarHBondContact O-N 3.39Å; Q502-A522 VanDerWaalsContact CD-O 3.27Å; Q502-A522 PolarHBondContact NE2-O 3.24Å; Q502-A522 PolarHBondContact OE1-O 2.65Å; Q502-L526 VanDerWaalsContact OE1-CD1 3.24Å; Q502-I534 HydrophobicContact CB-CD1 4.14Å; Q502-I534 VanDerWaalsContact OE1-CD1 3.27Å
503	R	86	Confident	83.6	Confident	26 Å²	26	47.2 Å²	47.2	10%	0.098	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-34.1	174.5	-73	-171.5	-65.6	-94.4	6.2	112.8	A472 D473 L474 G499 E500 I506 A507 I534	A472-R503 WeakPolarHBondContact O-CD 3.35Å; A472-R503 VanDerWaalsContact O-CG 3.29Å; A472-R503 WeakPolarHBondContact O-CG 3.07Å; D473-R503 VanDerWaalsContact O-CD 3.29Å; D473-R503 WeakPolarHBondContact O-CD 3.18Å; D473-R503 PolarHBondContact O-NE 3.47Å; L474-R503 HydrophobicContact CB-CB 4.17Å; L474-R503 HydrophobicContact CD1-CB 4Å; L474-R503 HydrophobicContact CG-CB 4.43Å; G499-R503 WeakPolarHBondContact O-CG 3.41Å; G499-R503 PolarHBondContact O-N 2.85Å; E500-R503 VanDerWaalsContact CG-NH2 3.31Å; E500-R503 PolarHBondContact O-N 2.79Å; R503-I506 PolarHBondContact O-N 2.99Å; R503-A507 WeakPolarHBondContact O-CB 3.21Å; R503-A507 PolarHBondContact O-N 2.9Å; R503-I534 HydrophobicContact CG-CD1 4.45Å; R503-I534 HydrophobicContact CG-CG1 4.15Å
504	V	89.8	Confident	84.4	Confident	3 Å²	3	49 Å²	49	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-43.5	169.9	172.3	0	0	0	0	111.1	L444 N452 L453 L474 L496 E500 K501 Q502 A507 R508	L444-V504 HydrophobicContact CD1-CG1 4.39Å; L444-V504 HydrophobicContact CD2-CG1 3.68Å; N452-V504 HydrophobicContact CB-CG1 4.49Å; L453-V504 HydrophobicContact CD2-CB 4.41Å; L453-V504 HydrophobicContact CD2-CG1 4.05Å; L453-V504 HydrophobicContact CD2-CG2 4.44Å; L474-V504 HydrophobicContact CD2-CB 4.38Å; L474-V504 HydrophobicContact CD2-CG2 3.53Å; L496-V504 HydrophobicContact CD1-CG2 4Å; E500-V504 WeakPolarHBondContact O-CG2 3.42Å; E500-V504 PolarHBondContact O-N 3.24Å; K501-V504 WeakPolarHBondContact O-CB 3.38Å; K501-V504 PolarHBondContact O-N 3Å; Q502-V504 VanDerWaalsContact C-N 3.28Å; Q502-V504 PolarHBondContact O-N 3.28Å; V504-A507 PolarHBondContact O-N 2.68Å; V504-R508 VanDerWaalsContact O-CG 3.3Å; V504-R508 WeakPolarHBondContact O-CG 3.22Å; V504-R508 PolarHBondContact O-N 3.42Å
505	A	86.5	Confident	85.2	Confident	34 Å²	34	46.4 Å²	46.4	28%	0.281	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-39.2	176.6	0	0	0	0	0	112.6	K501 Q502 R508 T509	K501-A505 PolarHBondContact O-N 3.12Å; Q502-A505 WeakPolarHBondContact O-CA 3.39Å; Q502-A505 WeakPolarHBondContact O-CB 3.46Å; Q502-A505 PolarHBondContact O-N 2.97Å; A505-R508 PolarHBondContact O-N 3.42Å; A505-T509 PolarHBondContact O-N 3.38Å; A505-T509 PolarHBondContact O-OG1 3.34Å
506	I	85.9	Confident	85.7	Confident	11 Å²	11	45 Å²	45	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-47.9	174.6	-63.7	164.7	0	0	0	110.2	A472 Q502 R503 R508 T509 I510 I534 M538	A472-I506 HydrophobicContact CB-CB 4.39Å; A472-I506 HydrophobicContact CB-CG2 4.12Å; Q502-I506 WeakPolarHBondContact O-CG1 3.41Å; Q502-I506 PolarHBondContact O-N 3.39Å; R503-I506 PolarHBondContact O-N 2.99Å; I506-R508 VanDerWaalsContact C-N 3.33Å; I506-R508 PolarHBondContact O-N 3.23Å; I506-T509 WeakPolarHBondContact O-CA 3.45Å; I506-T509 VanDerWaalsContact O-CB 3.31Å; I506-T509 WeakPolarHBondContact O-CB 3.34Å; I506-T509 PolarHBondContact O-N 3.32Å; I506-I510 HydrophobicContact CG2-CD1 4.03Å; I506-I510 WeakPolarHBondContact O-CG1 3.41Å; I506-I510 PolarHBondContact O-N 3.41Å; I506-I534 HydrophobicContact CD1-CG2 3.81Å; I506-M538 HydrophobicContact CD1-CE 3.82Å; I506-M538 HydrophobicContact CD1-CG 4.14Å; I506-M538 HydrophobicContact CG1-CE 4.27Å
507	A	90.5	Very high	85.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-39.9	177.4	0	0	0	0	0	112.6	L453 A472 R503 V504 T509 I510 L511	L453-A507 HydrophobicContact CD2-CB 3.44Å; L453-A507 VanDerWaalsContact CD2-CB 3.44Å; A472-A507 HydrophobicContact CB-CB 3.75Å; R503-A507 WeakPolarHBondContact O-CB 3.21Å; R503-A507 PolarHBondContact O-N 2.9Å; V504-A507 PolarHBondContact O-N 2.68Å; A507-T509 VanDerWaalsContact C-N 3.28Å; A507-T509 PolarHBondContact O-N 3.24Å; A507-I510 PolarHBondContact O-N 2.83Å; A507-L511 WeakPolarHBondContact O-CG 3.41Å; A507-L511 PolarHBondContact O-N 3.28Å
508	R	90.7	Very high	86.2	Confident	51 Å²	51	47.2 Å²	47.2	19%	0.192	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-38.3	172.4	-73.4	171.9	68.9	174.9	-1.8	112	N452 V504 A505 I506 L511 K512	N452-R508 WeakPolarHBondContact O-CD 3.36Å; N452-R508 WeakPolarHBondContact O-CG 3.44Å; V504-R508 VanDerWaalsContact O-CG 3.3Å; V504-R508 WeakPolarHBondContact O-CG 3.22Å; V504-R508 PolarHBondContact O-N 3.42Å; A505-R508 PolarHBondContact O-N 3.42Å; I506-R508 VanDerWaalsContact C-N 3.33Å; I506-R508 PolarHBondContact O-N 3.23Å; R508-L511 PolarHBondContact O-N 3.27Å; R508-K512 VanDerWaalsContact O-CB 3.31Å; R508-K512 WeakPolarHBondContact O-CB 3.42Å; R508-K512 PolarHBondContact O-N 3.45Å
509	T	87.6	Confident	86.6	Confident	44 Å²	44	45.8 Å²	45.8	27%	0.27	24%	0.244	S	C	.	.	H	α-helix	trans	-66.9	-41.9	176.8	-55.6	0	0	0	0	111.1	A505 I506 A507 L511 K512 N513 P514 I517	A505-T509 PolarHBondContact O-N 3.38Å; A505-T509 PolarHBondContact O-OG1 3.34Å; I506-T509 WeakPolarHBondContact O-CA 3.45Å; I506-T509 VanDerWaalsContact O-CB 3.31Å; I506-T509 WeakPolarHBondContact O-CB 3.34Å; I506-T509 PolarHBondContact O-N 3.32Å; A507-T509 VanDerWaalsContact C-N 3.28Å; A507-T509 PolarHBondContact O-N 3.24Å; T509-L511 PolarHBondContact O-N 2.98Å; T509-K512 PolarHBondContact O-N 3.01Å; T509-N513 PolarHBondContact O-N 2.93Å; T509-P514 HydrophobicContact CG2-CG 3.88Å; T509-P514 WeakPolarHBondContact O-CD 3.42Å; T509-I517 HydrophobicContact CG2-CD1 3.98Å; T509-I517 HydrophobicContact CG2-CG1 4.15Å; T509-I517 HydrophobicContact CG2-CG2 4.2Å
510	I	87.4	Confident	86.8	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-47.5	174.9	-66.4	163.4	0	0	0	110.5	A468 V471 A472 I506 A507 K512 N513 A541	A468-I510 HydrophobicContact CB-CB 4.18Å; A468-I510 HydrophobicContact CB-CG2 3.86Å; V471-I510 HydrophobicContact CB-CD1 3.9Å; V471-I510 HydrophobicContact CG1-CD1 3.59Å; A472-I510 HydrophobicContact CB-CD1 4.23Å; I506-I510 HydrophobicContact CG2-CD1 4.03Å; I506-I510 WeakPolarHBondContact O-CG1 3.41Å; I506-I510 PolarHBondContact O-N 3.41Å; A507-I510 PolarHBondContact O-N 2.83Å; I510-K512 PolarHBondContact O-N 3.05Å; I510-N513 PolarHBondContact O-N 2.95Å; I510-A541 HydrophobicContact CD1-CB 4.01Å; I510-A541 HydrophobicContact CG1-CB 3.7Å
511	L	90.3	Very high	86.4	Confident	17 Å²	17	50.8 Å²	50.8	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-39.7	178.4	-75.4	169	0	0	0	113.4	L453 N457 A460 Q464 V465 A468 A507 R508 T509 N513	L453-L511 HydrophobicContact CB-CD1 4.38Å; L453-L511 WeakPolarHBondContact O-CD1 3.29Å; N457-L511 HydrophobicContact CB-CB 4.19Å; N457-L511 WeakPolarHBondContact CB-O 3.4Å; A460-L511 HydrophobicContact CB-CD2 3.82Å; Q464-L511 HydrophobicContact CB-CD2 4.25Å; V465-L511 HydrophobicContact CG2-CD1 4.07Å; V465-L511 HydrophobicContact CG2-CD2 4.34Å; A468-L511 HydrophobicContact CB-CD1 4.16Å; A468-L511 HydrophobicContact CB-CD2 3.85Å; A468-L511 HydrophobicContact CB-CG 3.58Å; A507-L511 WeakPolarHBondContact O-CG 3.41Å; A507-L511 PolarHBondContact O-N 3.28Å; R508-L511 PolarHBondContact O-N 3.27Å; T509-L511 PolarHBondContact O-N 2.98Å; L511-N513 PolarHBondContact O-N 3.28Å
512	K	90	Very high	85.8	Confident	148 Å²	148	50 Å²	50	64%	0.643	27%	0.268	S	S	*	.	H	α-helix	trans	-65.7	-29.1	177.2	-174	76.7	176.1	-171.8	0	112	G456 R508 T509 I510	G456-K512 WeakPolarHBondContact O-CA 3.39Å; G456-K512 WeakPolarHBondContact O-CB 3.25Å; G456-K512 WeakPolarHBondContact O-CD 3.43Å; R508-K512 VanDerWaalsContact O-CB 3.31Å; R508-K512 WeakPolarHBondContact O-CB 3.42Å; R508-K512 PolarHBondContact O-N 3.45Å; T509-K512 PolarHBondContact O-N 3.01Å; I510-K512 PolarHBondContact O-N 3.05Å
513	N	86.5	Confident	85.4	Confident	109 Å²	109	47.7 Å²	47.7	58%	0.583	26%	0.258	S	S	*	.			trans	49.3	55.2	-177	-170.4	31.3	0	0	0	113.9	T509 I510 L511 R545	T509-N513 PolarHBondContact O-N 2.93Å; I510-N513 PolarHBondContact O-N 2.95Å; L511-N513 PolarHBondContact O-N 3.28Å; N513-R545 PolarHBondContact OD1-NE 3.19Å; N513-R545 PolarHBondContact OD1-NH2 3.09Å
514	P	87.6	Confident	84.5	Confident	37 Å²	37	48.7 Å²	48.7	24%	0.24	27%	0.269	C	S	.	.			trans	-73.2	150.2	178.8	33.7	-36.5	0	0	0	111.7	T509 I517 R545	T509-P514 HydrophobicContact CG2-CG 3.88Å; T509-P514 WeakPolarHBondContact O-CD 3.42Å; P514-I517 HydrophobicContact CG-CD1 4.43Å; P514-I517 HydrophobicContact CG-CG1 3.86Å; P514-R545 WeakPolarHBondContact O-CD 3.46Å
515	A	86.9	Confident	83.3	Confident	77 Å²	77	54.2 Å²	54.2	64%	0.636	31%	0.307	S	S	*	.	S	Bend	trans	-73.3	-28.6	176.2	0	0	0	0	0	113.5	T546	A515-T546 PolarHBondContact O-N 3.28Å; A515-T546 VanDerWaalsContact O-N 3.14Å
516	I	87.8	Confident	82.4	Confident	113 Å²	113	53.7 Å²	53.7	58%	0.579	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.5	-179.6	-56	174.3	0	0	0	108.5	T546	I516-T546 CarbonylContact C-O 3.1Å; I516-T546 VanDerWaalsContact CA-O 3.3Å; I516-T546 WeakPolarHBondContact CA-O 3.17Å
517	I	86.6	Confident	81.6	Confident	9 Å²	9	57.2 Å²	57.2	5%	0.046	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.1	176	-53.3	173.2	0	0	0	109.1	T509 P514 Y519 T546 S547 L548	T509-I517 HydrophobicContact CG2-CD1 3.98Å; T509-I517 HydrophobicContact CG2-CG1 4.15Å; T509-I517 HydrophobicContact CG2-CG2 4.2Å; P514-I517 HydrophobicContact CG-CD1 4.43Å; P514-I517 HydrophobicContact CG-CG1 3.86Å; I517-Y519 HydrophobicContact CB-CE2 3.93Å; I517-Y519 HydrophobicContact CG2-CD2 3.91Å; I517-Y519 HydrophobicContact CG2-CE1 4.04Å; I517-Y519 HydrophobicContact CG2-CE2 3.34Å; I517-Y519 HydrophobicContact CG2-CG 4.48Å; I517-Y519 VanDerWaalsContact CG2-CZ 3.43Å; I517-T546 PolarHBondContact N-O 3.43Å; I517-S547 CarbonylContact O-C 2.84Å; I517-S547 WeakPolarHBondContact O-CA 3.41Å; I517-L548 PolarHBondContact O-N 2.96Å
518	I	86.4	Confident	80.7	Confident	110 Å²	110	60.9 Å²	60.9	56%	0.564	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.4	175.6	-56.4	175.8	0	0	0	107.7	L548	I518-L548 HydrophobicContact CG1-CB 4.48Å; I518-L548 HydrophobicContact CG2-CD2 4.41Å
519	Y	83.2	Confident	79.8	Confident	19 Å²	19	64.4 Å²	64.4	8%	0.075	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	111	174.8	-64.2	-82.2	0	0	0	108.4	I517 A522 M538 V542 L548 F549 I550	I517-Y519 HydrophobicContact CB-CE2 3.93Å; I517-Y519 HydrophobicContact CG2-CD2 3.91Å; I517-Y519 HydrophobicContact CG2-CE1 4.04Å; I517-Y519 HydrophobicContact CG2-CE2 3.34Å; I517-Y519 HydrophobicContact CG2-CG 4.48Å; I517-Y519 VanDerWaalsContact CG2-CZ 3.43Å; Y519-A522 HydrophobicContact CD1-CB 4.2Å; Y519-M538 HydrophobicContact CD1-CE 3.73Å; Y519-M538 HydrophobicContact CD1-CG 4.23Å; Y519-M538 HydrophobicContact CD1-SD 3.65Å; Y519-M538 HydrophobicContact CE1-CB 4.28Å; Y519-M538 HydrophobicContact CE1-CE 3.86Å; Y519-M538 HydrophobicContact CE1-CG 3.59Å; Y519-M538 HydrophobicContact CE1-SD 3.67Å; Y519-M538 HydrophobicContact CG-SD 4.43Å; Y519-V542 HydrophobicContact CE2-CG2 3.9Å; Y519-L548 PolarHBondContact N-O 3.29Å; Y519-F549 VanDerWaalsContact CB-CD1 3.48Å; Y519-F549 HydrophobicContact CD1-CE1 4.08Å; Y519-F549 AromaticContact CD2-CD1 3.69Å; Y519-F549 HydrophobicContact CD2-CD1 3.69Å; Y519-F549 HydrophobicContact CD2-CD2 4.11Å; Y519-F549 AromaticContact CD2-CE1 3.26Å; Y519-F549 HydrophobicContact CD2-CE1 3.26Å; Y519-F549 AromaticContact CD2-CE2 3.72Å; Y519-F549 HydrophobicContact CD2-CE2 3.72Å; Y519-F549 HydrophobicContact CD2-CG 4.1Å; Y519-F549 AromaticContact CD2-CZ 3.27Å; Y519-F549 HydrophobicContact CD2-CZ 3.27Å; Y519-F549 AromaticContact CE2-CE1 3.76Å; Y519-F549 HydrophobicContact CE2-CE1 3.76Å; Y519-F549 AromaticContact CE2-CE2 3.95Å; Y519-F549 HydrophobicContact CE2-CE2 3.95Å; Y519-F549 AromaticContact CE2-CZ 3.38Å; Y519-F549 HydrophobicContact CE2-CZ 3.38Å; Y519-F549 AromaticContact CG-CD1 3.71Å; Y519-F549 HydrophobicContact CG-CD1 3.71Å; Y519-F549 AromaticContact CG-CE1 3.42Å; Y519-F549 HydrophobicContact CG-CE1 3.42Å; Y519-F549 VanDerWaalsContact CG-CE1 3.42Å; Y519-F549 HydrophobicContact CG-CG 4.44Å; Y519-F549 AromaticContact CG-CZ 3.95Å; Y519-F549 HydrophobicContact CG-CZ 3.95Å; Y519-I550 PolarHBondContact O-N 3.31Å
520	D	82.7	Confident	78.9	Confident	66 Å²	66	63.7 Å²	63.7	35%	0.353	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	104.9	-177.7	-167.6	-7.3	0	0	0	109.7	K440 A522	K440-D520 IonicContact NZ-OD1 2.68Å; K440-D520 IonicContact NZ-OD2 3.05Å; K440-D520 PolarHBondContact NZ-OD2 3.08Å; D520-A522 PolarHBondContact O-N 3.11Å; D520-A522 VanDerWaalsContact O-N 3.07Å
521	E	77.8	Confident	78.2	Confident	75 Å²	75	63.4 Å²	63.4	35%	0.35	36%	0.364	S	S	.	.	S	Bend	trans	47.7	39.2	-177.2	-67.3	-178.2	-148.6	0	0	113.2	T523 S524 I550 H552	E521-T523 PolarHBondContact O-N 3.48Å; E521-S524 VanDerWaalsContact O-CB 3.29Å; E521-S524 WeakPolarHBondContact O-CB 3.43Å; E521-S524 PolarHBondContact O-N 3.29Å; E521-S524 PolarHBondContact O-OG 3.28Å; E521-I550 WeakPolarHBondContact CA-O 3.47Å; E521-I550 PolarHBondContact N-O 3.27Å; E521-H552 IonicContact OE1-CD2 2.97Å; E521-H552 PolarHBondContact OE1-CD2 2.95Å; E521-H552 IonicContact OE1-NE2 3.93Å; E521-H552 PolarHBondContact OE1-NE2 3.24Å; E521-H552 VanDerWaalsContact OE1-NE2 3.13Å; E521-H552 IonicContact OE2-CD2 3.62Å
522	A	71.4	Confident	77.6	Confident	19 Å²	19	68.8 Å²	68.8	16%	0.157	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.6	-164.6	0	0	0	0	0	113.8	Q502 Y519 D520 M538	Q502-A522 VanDerWaalsContact CD-O 3.27Å; Q502-A522 PolarHBondContact NE2-O 3.24Å; Q502-A522 PolarHBondContact OE1-O 2.65Å; Y519-A522 HydrophobicContact CD1-CB 4.2Å; D520-A522 PolarHBondContact O-N 3.11Å; D520-A522 VanDerWaalsContact O-N 3.07Å; A522-M538 HydrophobicContact CB-CE 3.38Å; A522-M538 HydrophobicContact CB-SD 4.29Å
523	T	71.5	Confident	76.8	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.031	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	2.4	177.1	66.3	0	0	0	0	113.9	E521 S525 L526 E531 T556	E521-T523 PolarHBondContact O-N 3.48Å; T523-S525 PolarHBondContact O-N 3.29Å; T523-L526 PolarHBondContact O-N 3.46Å; T523-E531 WeakPolarHBondContact CB-OE1 3.28Å; T523-E531 HydrophobicContact CG2-CG 3.83Å; T523-E531 PolarHBondContact OG1-OE1 3Å; T523-T556 HydrophobicContact CG2-CG2 4.43Å; T523-T556 PolarHBondContact OG1-OG1 3Å
524	S	67.2	Low	76.3	Confident	47 Å²	47	59.1 Å²	59.1	33%	0.329	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	136.6	-179.3	64.5	0	0	0	0	111.1	E521 L526	E521-S524 VanDerWaalsContact O-CB 3.29Å; E521-S524 WeakPolarHBondContact O-CB 3.43Å; E521-S524 PolarHBondContact O-N 3.29Å; E521-S524 PolarHBondContact O-OG 3.28Å; S524-L526 VanDerWaalsContact C-N 3.34Å; S524-L526 PolarHBondContact O-N 2.88Å
525	S	65.6	Low	75.7	Confident	118 Å²	118	58.7 Å²	58.7	83%	0.825	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	12.4	179.6	-37.9	0	0	0	0	117	T523	T523-S525 PolarHBondContact O-N 3.29Å
526	L	67.5	Low	75.3	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	33%	0.327	C	S	.	.			trans	-99	150.6	172.3	-63.6	175.4	0	0	0	112.3	Q502 T523 S524 T530 E531 I534	Q502-L526 VanDerWaalsContact OE1-CD1 3.24Å; T523-L526 PolarHBondContact O-N 3.46Å; S524-L526 VanDerWaalsContact C-N 3.34Å; S524-L526 PolarHBondContact O-N 2.88Å; L526-T530 HydrophobicContact CD1-CG2 4.1Å; L526-T530 HydrophobicContact CD2-CG2 3.95Å; L526-T530 HydrophobicContact CG-CG2 4.44Å; L526-E531 HydrophobicContact CB-CB 4.48Å; L526-I534 HydrophobicContact CD1-CD1 3.37Å; L526-I534 HydrophobicContact CD1-CG1 4.49Å
527	D	69	Low	74.6	Confident	85 Å²	85	54.1 Å²	54.1	46%	0.455	30%	0.3	S	S	.	.			trans	-66.9	157.4	167.3	67	93.9	0	0	0	110.9	I529 T530 E531	D527-I529 PolarHBondContact O-N 3.09Å; D527-I529 WeakPolarHBondContact OD1-CB 3.29Å; D527-I529 PolarHBondContact OD1-N 2.74Å; D527-I529 VanDerWaalsContact OD1-N 3.16Å; D527-T530 VanDerWaalsContact CG-OG1 3.26Å; D527-T530 PolarHBondContact O-N 3.27Å; D527-T530 PolarHBondContact OD1-N 3.4Å; D527-T530 PolarHBondContact OD1-OG1 3.06Å; D527-T530 WeakPolarHBondContact OD2-CB 3.49Å; D527-T530 PolarHBondContact OD2-OG1 3.35Å; D527-E531 WeakPolarHBondContact O-CB 3.4Å; D527-E531 PolarHBondContact O-N 3.19Å
528	A	70.5	Confident	74.1	Confident	77 Å²	77	54 Å²	54	64%	0.636	30%	0.3	S	S	*	.	H	α-helix	trans	-60.1	-30.1	-173.4	0	0	0	0	0	113.9	K532	A528-K532 WeakPolarHBondContact O-CB 3.28Å; A528-K532 PolarHBondContact O-N 3.27Å; A528-K532 VanDerWaalsContact O-N 3.15Å
529	I	72.7	Confident	73.5	Confident	125 Å²	125	53.7 Å²	53.7	64%	0.641	29%	0.294	S	S	*	.	H	α-helix	trans	-72.8	-49.9	178.6	-57.6	173	0	0	0	108.9	D527 E531 K532 N533	D527-I529 PolarHBondContact O-N 3.09Å; D527-I529 WeakPolarHBondContact OD1-CB 3.29Å; D527-I529 PolarHBondContact OD1-N 2.74Å; D527-I529 VanDerWaalsContact OD1-N 3.16Å; I529-E531 VanDerWaalsContact C-N 3.32Å; I529-E531 PolarHBondContact O-N 3.21Å; I529-K532 PolarHBondContact O-N 2.68Å; I529-N533 PolarHBondContact O-N 3.18Å; I529-N533 VanDerWaalsContact O-N 3.09Å; I529-N533 PolarHBondContact O-OD1 3.48Å
530	T	69.3	Low	72.9	Confident	29 Å²	29	59 Å²	59	18%	0.178	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-38.2	178.1	-53.7	0	0	0	0	112.1	L526 D527 N533 I534	L526-T530 HydrophobicContact CD1-CG2 4.1Å; L526-T530 HydrophobicContact CD2-CG2 3.95Å; L526-T530 HydrophobicContact CG-CG2 4.44Å; D527-T530 VanDerWaalsContact CG-OG1 3.26Å; D527-T530 PolarHBondContact O-N 3.27Å; D527-T530 PolarHBondContact OD1-N 3.4Å; D527-T530 PolarHBondContact OD1-OG1 3.06Å; D527-T530 WeakPolarHBondContact OD2-CB 3.49Å; D527-T530 PolarHBondContact OD2-OG1 3.35Å; T530-N533 PolarHBondContact O-N 3.09Å; T530-I534 HydrophobicContact CG2-CD1 4.13Å; T530-I534 HydrophobicContact CG2-CG1 4.48Å; T530-I534 WeakPolarHBondContact O-CB 3.5Å; T530-I534 WeakPolarHBondContact O-CG1 3.25Å; T530-I534 PolarHBondContact O-N 2.99Å
531	E	71.9	Confident	72.2	Confident	22 Å²	22	56.2 Å²	56.2	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-48.6	174.3	170.3	164.9	-140.9	0	0	111.7	T523 L526 D527 I529 N533 I534 M535 R553	T523-E531 WeakPolarHBondContact CB-OE1 3.28Å; T523-E531 HydrophobicContact CG2-CG 3.83Å; T523-E531 PolarHBondContact OG1-OE1 3Å; L526-E531 HydrophobicContact CB-CB 4.48Å; D527-E531 WeakPolarHBondContact O-CB 3.4Å; D527-E531 PolarHBondContact O-N 3.19Å; I529-E531 VanDerWaalsContact C-N 3.32Å; I529-E531 PolarHBondContact O-N 3.21Å; E531-N533 PolarHBondContact O-N 3.01Å; E531-I534 PolarHBondContact O-N 2.88Å; E531-M535 PolarHBondContact O-N 3.48Å; E531-R553 VanDerWaalsContact CD-NH1 3.31Å; E531-R553 WeakPolarHBondContact OE1-CD 3.48Å; E531-R553 IonicContact OE1-NH1 3.12Å; E531-R553 PolarHBondContact OE1-NH1 3.35Å; E531-R553 IonicContact OE2-CZ 3.09Å; E531-R553 IonicContact OE2-NH1 3.92Å; E531-R553 PolarHBondContact OE2-NH1 2.6Å
532	K	77.5	Confident	71.8	Confident	130 Å²	130	54.2 Å²	54.2	57%	0.565	30%	0.297	S	S	*	.	H	α-helix	trans	-59.7	-47.2	178.7	-174.7	-178.7	176.5	-176.4	0	111.6	A528 I529 I534 M535 E536	A528-K532 WeakPolarHBondContact O-CB 3.28Å; A528-K532 PolarHBondContact O-N 3.27Å; A528-K532 VanDerWaalsContact O-N 3.15Å; I529-K532 PolarHBondContact O-N 2.68Å; K532-I534 VanDerWaalsContact C-N 3.33Å; K532-I534 PolarHBondContact O-N 3.34Å; K532-M535 PolarHBondContact O-N 3.47Å; K532-E536 VanDerWaalsContact CE-OE1 3.28Å; K532-E536 WeakPolarHBondContact CE-OE1 3.41Å; K532-E536 PolarHBondContact O-N 2.94Å
533	N	74.4	Confident	71.8	Confident	55 Å²	55	57.5 Å²	57.5	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-44	178.6	-73.1	20.6	0	0	0	111.6	D473 I529 T530 E531 E536 S537	D473-N533 PolarHBondContact OD2-ND2 2.93Å; I529-N533 PolarHBondContact O-N 3.18Å; I529-N533 VanDerWaalsContact O-N 3.09Å; I529-N533 PolarHBondContact O-OD1 3.48Å; T530-N533 PolarHBondContact O-N 3.09Å; E531-N533 PolarHBondContact O-N 3.01Å; N533-E536 PolarHBondContact O-N 3.48Å; N533-S537 PolarHBondContact O-N 3.36Å; N533-S537 PolarHBondContact O-OG 3.24Å
534	I	74.7	Confident	71.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-41.2	178.3	-73.9	-175.9	0	0	0	111.4	Q502 R503 I506 L526 T530 E531 K532 E536 S537 M538	Q502-I534 HydrophobicContact CB-CD1 4.14Å; Q502-I534 VanDerWaalsContact OE1-CD1 3.27Å; R503-I534 HydrophobicContact CG-CD1 4.45Å; R503-I534 HydrophobicContact CG-CG1 4.15Å; I506-I534 HydrophobicContact CD1-CG2 3.81Å; L526-I534 HydrophobicContact CD1-CD1 3.37Å; L526-I534 HydrophobicContact CD1-CG1 4.49Å; T530-I534 HydrophobicContact CG2-CD1 4.13Å; T530-I534 HydrophobicContact CG2-CG1 4.48Å; T530-I534 WeakPolarHBondContact O-CB 3.5Å; T530-I534 WeakPolarHBondContact O-CG1 3.25Å; T530-I534 PolarHBondContact O-N 2.99Å; E531-I534 PolarHBondContact O-N 2.88Å; K532-I534 VanDerWaalsContact C-N 3.33Å; K532-I534 PolarHBondContact O-N 3.34Å; I534-E536 VanDerWaalsContact C-N 3.34Å; I534-E536 PolarHBondContact O-N 3.3Å; I534-S537 PolarHBondContact O-N 2.61Å; I534-M538 HydrophobicContact CG2-CE 3.27Å; I534-M538 HydrophobicContact CG2-CG 4.26Å; I534-M538 HydrophobicContact CG2-SD 3.91Å; I534-M538 WeakPolarHBondContact O-CB 3.36Å; I534-M538 WeakPolarHBondContact O-CG 3.42Å; I534-M538 PolarHBondContact O-N 3.29Å
535	M	75.9	Confident	72.7	Confident	28 Å²	28	65.8 Å²	65.8	14%	0.138	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-42.2	174	-106.2	-162.5	74.4	0	0	112.2	E531 K532 M538 K539	E531-M535 PolarHBondContact O-N 3.48Å; K532-M535 PolarHBondContact O-N 3.47Å; M535-M538 PolarHBondContact O-N 3.29Å; M535-K539 WeakPolarHBondContact O-CG 3.46Å; M535-K539 PolarHBondContact O-N 2.89Å
536	E	78.7	Confident	73.8	Confident	89 Å²	89	64.8 Å²	64.8	42%	0.416	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-43.5	176.1	-75.7	-178.4	-166.3	0	0	111.7	K532 N533 I534 K539 K540	K532-E536 VanDerWaalsContact CE-OE1 3.28Å; K532-E536 WeakPolarHBondContact CE-OE1 3.41Å; K532-E536 PolarHBondContact O-N 2.94Å; N533-E536 PolarHBondContact O-N 3.48Å; I534-E536 VanDerWaalsContact C-N 3.34Å; I534-E536 PolarHBondContact O-N 3.3Å; E536-K539 PolarHBondContact O-N 3.45Å; E536-K540 WeakPolarHBondContact O-CG 3.27Å; E536-K540 PolarHBondContact O-N 3.44Å; E536-K540 VanDerWaalsContact O-N 3.11Å
537	S	72.3	Confident	74.7	Confident	4 Å²	4	65.2 Å²	65.2	3%	0.028	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-41.1	173.1	-67.9	0	0	0	0	112.5	V471 D473 N533 I534 K540 A541	V471-S537 WeakPolarHBondContact O-CB 3.33Å; V471-S537 PolarHBondContact O-OG 2.84Å; D473-S537 WeakPolarHBondContact CB-OG 3.19Å; N533-S537 PolarHBondContact O-N 3.36Å; N533-S537 PolarHBondContact O-OG 3.24Å; I534-S537 PolarHBondContact O-N 2.61Å; S537-K540 PolarHBondContact O-N 2.81Å; S537-A541 WeakPolarHBondContact O-CB 3.33Å; S537-A541 PolarHBondContact O-N 3.15Å
538	M	75.3	Confident	75.7	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-49.2	176	-73.9	176.3	-178.3	0	0	110.8	I506 Y519 A522 I534 M535 K540 A541 V542 F549	I506-M538 HydrophobicContact CD1-CE 3.82Å; I506-M538 HydrophobicContact CD1-CG 4.14Å; I506-M538 HydrophobicContact CG1-CE 4.27Å; Y519-M538 HydrophobicContact CD1-CE 3.73Å; Y519-M538 HydrophobicContact CD1-CG 4.23Å; Y519-M538 HydrophobicContact CD1-SD 3.65Å; Y519-M538 HydrophobicContact CE1-CB 4.28Å; Y519-M538 HydrophobicContact CE1-CE 3.86Å; Y519-M538 HydrophobicContact CE1-CG 3.59Å; Y519-M538 HydrophobicContact CE1-SD 3.67Å; Y519-M538 HydrophobicContact CG-SD 4.43Å; A522-M538 HydrophobicContact CB-CE 3.38Å; A522-M538 HydrophobicContact CB-SD 4.29Å; I534-M538 HydrophobicContact CG2-CE 3.27Å; I534-M538 HydrophobicContact CG2-CG 4.26Å; I534-M538 HydrophobicContact CG2-SD 3.91Å; I534-M538 WeakPolarHBondContact O-CB 3.36Å; I534-M538 WeakPolarHBondContact O-CG 3.42Å; I534-M538 PolarHBondContact O-N 3.29Å; M535-M538 PolarHBondContact O-N 3.29Å; M538-K540 VanDerWaalsContact C-N 3.29Å; M538-K540 PolarHBondContact O-N 3.27Å; M538-A541 CarbonylContact O-C 3.58Å; M538-A541 WeakPolarHBondContact O-CA 3.18Å; M538-A541 WeakPolarHBondContact O-CB 3.44Å; M538-A541 PolarHBondContact O-N 3.43Å; M538-V542 WeakPolarHBondContact O-CB 3.4Å; M538-V542 WeakPolarHBondContact O-CG2 3.16Å; M538-V542 PolarHBondContact O-N 3.11Å; M538-F549 HydrophobicContact SD-CE1 4.12Å
539	K	74.6	Confident	76.5	Confident	104 Å²	104	64.6 Å²	64.6	45%	0.452	33%	0.332	S	S	.	.	H	α-helix	trans	-53.9	-44.5	176.4	-78	-177.5	178.2	-178.5	0	112.3	M535 E536 A541 V542 D559	M535-K539 WeakPolarHBondContact O-CG 3.46Å; M535-K539 PolarHBondContact O-N 2.89Å; E536-K539 PolarHBondContact O-N 3.45Å; K539-A541 VanDerWaalsContact C-N 3.32Å; K539-A541 PolarHBondContact O-N 3.45Å; K539-V542 PolarHBondContact O-N 3.05Å; K539-D559 WeakPolarHBondContact CE-OD2 3.2Å; K539-D559 IonicContact NZ-OD2 2.61Å; K539-D559 PolarHBondContact NZ-OD2 2.94Å
540	K	71.3	Confident	77.2	Confident	131 Å²	131	62.4 Å²	62.4	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-42.6	175.5	-70.1	173.1	-176.3	172.8	0	111.5	V471 E536 S537 M538 V542 S543	V471-K540 HydrophobicContact CG1-CB 3.93Å; E536-K540 WeakPolarHBondContact O-CG 3.27Å; E536-K540 PolarHBondContact O-N 3.44Å; E536-K540 VanDerWaalsContact O-N 3.11Å; S537-K540 PolarHBondContact O-N 2.81Å; M538-K540 VanDerWaalsContact C-N 3.29Å; M538-K540 PolarHBondContact O-N 3.27Å; K540-V542 VanDerWaalsContact C-N 3.32Å; K540-V542 PolarHBondContact O-N 3.18Å; K540-S543 PolarHBondContact O-OG 2.87Å
541	A	68.2	Low	77.7	Confident	7 Å²	7	62.5 Å²	62.5	6%	0.058	33%	0.325	C	S	.	.	H	α-helix	trans	-71.7	-20.6	178.2	0	0	0	0	0	114.6	I510 S537 M538 K539 R545	I510-A541 HydrophobicContact CD1-CB 4.01Å; I510-A541 HydrophobicContact CG1-CB 3.7Å; S537-A541 WeakPolarHBondContact O-CB 3.33Å; S537-A541 PolarHBondContact O-N 3.15Å; M538-A541 CarbonylContact O-C 3.58Å; M538-A541 WeakPolarHBondContact O-CA 3.18Å; M538-A541 WeakPolarHBondContact O-CB 3.44Å; M538-A541 PolarHBondContact O-N 3.43Å; K539-A541 VanDerWaalsContact C-N 3.32Å; K539-A541 PolarHBondContact O-N 3.45Å; A541-R545 PolarHBondContact O-NH1 3.45Å
542	V	68.4	Low	78	Confident	33 Å²	33	69.2 Å²	69.2	20%	0.2	36%	0.356	C	S	.	.	H	α-helix	trans	-84.5	-19.2	-176.2	164.9	0	0	0	0	112.9	Y519 M538 K539 K540 N544 R545 S547 F549	Y519-V542 HydrophobicContact CE2-CG2 3.9Å; M538-V542 WeakPolarHBondContact O-CB 3.4Å; M538-V542 WeakPolarHBondContact O-CG2 3.16Å; M538-V542 PolarHBondContact O-N 3.11Å; K539-V542 PolarHBondContact O-N 3.05Å; K540-V542 VanDerWaalsContact C-N 3.32Å; K540-V542 PolarHBondContact O-N 3.18Å; V542-N544 PolarHBondContact O-N 3.16Å; V542-N544 VanDerWaalsContact O-N 3.12Å; V542-R545 PolarHBondContact O-N 3.15Å; V542-S547 WeakPolarHBondContact CG1-OG 3.39Å; V542-S547 WeakPolarHBondContact CG2-OG 3.44Å; V542-F549 HydrophobicContact CG2-CE2 4.29Å; V542-F549 HydrophobicContact CG2-CZ 3.99Å
543	S	70.9	Confident	78	Confident	88 Å²	88	68 Å²	68	62%	0.615	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	122.7	-176.6	59.2	0	0	0	0	111.9	K540	K540-S543 PolarHBondContact O-OG 2.87Å
544	N	75.4	Confident	78.2	Confident	176 Å²	176	70.5 Å²	70.5	94%	0.941	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	29.5	-179.4	-151.7	30.6	0	0	0	115.9	V542	V542-N544 PolarHBondContact O-N 3.16Å; V542-N544 VanDerWaalsContact O-N 3.12Å
545	R	82.6	Confident	78.4	Confident	51 Å²	51	73.3 Å²	73.3	19%	0.192	38%	0.384	C	S	.	.	S	Bend	trans	-133.2	150.7	178.1	-59.9	177.6	-178.7	161.2	-2	112.1	N513 P514 A541 V542 S547	N513-R545 PolarHBondContact OD1-NE 3.19Å; N513-R545 PolarHBondContact OD1-NH2 3.09Å; P514-R545 WeakPolarHBondContact O-CD 3.46Å; A541-R545 PolarHBondContact O-NH1 3.45Å; V542-R545 PolarHBondContact O-N 3.15Å; R545-S547 PolarHBondContact O-N 2.99Å
546	T	88.7	Confident	78.5	Confident	97 Å²	97	72.5 Å²	72.5	60%	0.595	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.2	170.7	-56.9	0	0	0	0	109	A515 I516 I517	A515-T546 PolarHBondContact O-N 3.28Å; A515-T546 VanDerWaalsContact O-N 3.14Å; I516-T546 CarbonylContact C-O 3.1Å; I516-T546 VanDerWaalsContact CA-O 3.3Å; I516-T546 WeakPolarHBondContact CA-O 3.17Å; I517-T546 PolarHBondContact N-O 3.43Å
547	S	87.1	Confident	78.7	Confident	32 Å²	32	69.4 Å²	69.4	22%	0.224	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.6	-176.4	-60.1	0	0	0	0	111.1	I517 V542 R545	I517-S547 CarbonylContact O-C 2.84Å; I517-S547 WeakPolarHBondContact O-CA 3.41Å; V542-S547 WeakPolarHBondContact CG1-OG 3.39Å; V542-S547 WeakPolarHBondContact CG2-OG 3.44Å; R545-S547 PolarHBondContact O-N 2.99Å
548	L	88.5	Confident	79.3	Confident	96 Å²	96	71.4 Å²	71.4	50%	0.503	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119	177.3	177.3	64.1	0	0	0	109	I517 I518 Y519	I517-L548 PolarHBondContact O-N 2.96Å; I518-L548 HydrophobicContact CG1-CB 4.48Å; I518-L548 HydrophobicContact CG2-CD2 4.41Å; Y519-L548 PolarHBondContact N-O 3.29Å
549	F	87.7	Confident	79.7	Confident	53 Å²	53	76 Å²	76	23%	0.232	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.2	176.3	-70.6	-95.2	0	0	0	110.4	Y519 M538 V542 T556 V557	Y519-F549 VanDerWaalsContact CB-CD1 3.48Å; Y519-F549 HydrophobicContact CD1-CE1 4.08Å; Y519-F549 AromaticContact CD2-CD1 3.69Å; Y519-F549 HydrophobicContact CD2-CD1 3.69Å; Y519-F549 HydrophobicContact CD2-CD2 4.11Å; Y519-F549 AromaticContact CD2-CE1 3.26Å; Y519-F549 HydrophobicContact CD2-CE1 3.26Å; Y519-F549 AromaticContact CD2-CE2 3.72Å; Y519-F549 HydrophobicContact CD2-CE2 3.72Å; Y519-F549 HydrophobicContact CD2-CG 4.1Å; Y519-F549 AromaticContact CD2-CZ 3.27Å; Y519-F549 HydrophobicContact CD2-CZ 3.27Å; Y519-F549 AromaticContact CE2-CE1 3.76Å; Y519-F549 HydrophobicContact CE2-CE1 3.76Å; Y519-F549 AromaticContact CE2-CE2 3.95Å; Y519-F549 HydrophobicContact CE2-CE2 3.95Å; Y519-F549 AromaticContact CE2-CZ 3.38Å; Y519-F549 HydrophobicContact CE2-CZ 3.38Å; Y519-F549 AromaticContact CG-CD1 3.71Å; Y519-F549 HydrophobicContact CG-CD1 3.71Å; Y519-F549 AromaticContact CG-CE1 3.42Å; Y519-F549 HydrophobicContact CG-CE1 3.42Å; Y519-F549 VanDerWaalsContact CG-CE1 3.42Å; Y519-F549 HydrophobicContact CG-CG 4.44Å; Y519-F549 AromaticContact CG-CZ 3.95Å; Y519-F549 HydrophobicContact CG-CZ 3.95Å; M538-F549 HydrophobicContact SD-CE1 4.12Å; V542-F549 HydrophobicContact CG2-CE2 4.29Å; V542-F549 HydrophobicContact CG2-CZ 3.99Å; F549-T556 HydrophobicContact CD1-CG2 4.19Å; F549-V557 HydrophobicContact CB-CG1 4.29Å
550	I	87.2	Confident	80.2	Confident	79 Å²	79	72.6 Å²	72.6	41%	0.405	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.6	169.7	-53.6	170.8	0	0	0	105.8	Y519 E521	Y519-I550 PolarHBondContact O-N 3.31Å; E521-I550 WeakPolarHBondContact CA-O 3.47Å; E521-I550 PolarHBondContact N-O 3.27Å
551	A	81	Confident	81.1	Confident	32 Å²	32	73.9 Å²	73.9	26%	0.264	41%	0.409	S	S	.	.			trans	-145.7	150.1	-177.9	0	0	0	0	0	111.5	T556 V557	A551-T556 HydrophobicContact CB-CG2 3.88Å; A551-V557 HydrophobicContact CB-CG1 4.02Å
552	H	77.9	Confident	82.2	Confident	163 Å²	163	78.7 Å²	78.7	76%	0.755	43%	0.433	S	S	*	.	S	Bend	trans	-91.7	-9.1	168.3	-69	-65.3	0	0	0	112.9	E521	E521-H552 IonicContact OE1-CD2 2.97Å; E521-H552 PolarHBondContact OE1-CD2 2.95Å; E521-H552 IonicContact OE1-NE2 3.93Å; E521-H552 PolarHBondContact OE1-NE2 3.24Å; E521-H552 VanDerWaalsContact OE1-NE2 3.13Å; E521-H552 IonicContact OE2-CD2 3.62Å
553	R	76.5	Confident	83.3	Confident	105 Å²	105	77.8 Å²	77.8	40%	0.396	43%	0.427	S	S	.	.	S	Bend	trans	-107	126.4	-178.2	-66.4	-178.1	179.2	172.2	3.5	109.8	E531 A555 T556	E531-R553 VanDerWaalsContact CD-NH1 3.31Å; E531-R553 WeakPolarHBondContact OE1-CD 3.48Å; E531-R553 IonicContact OE1-NH1 3.12Å; E531-R553 PolarHBondContact OE1-NH1 3.35Å; E531-R553 IonicContact OE2-CZ 3.09Å; E531-R553 IonicContact OE2-NH1 3.92Å; E531-R553 PolarHBondContact OE2-NH1 2.6Å; R553-A555 PolarHBondContact O-N 3.18Å; R553-T556 PolarHBondContact O-N 2.83Å; R553-T556 VanDerWaalsContact O-N 3.13Å; R553-T556 PolarHBondContact O-OG1 3.39Å
554	L	78.7	Confident	84.2	Confident	107 Å²	107	77 Å²	77	56%	0.56	42%	0.418	S	S	*	.	H	α-helix	trans	-57.4	-36.6	177.4	-176.8	63.6	0	0	0	112.2	T556 V557 V558	L554-T556 PolarHBondContact O-N 3.23Å; L554-T556 VanDerWaalsContact O-N 3.09Å; L554-V557 HydrophobicContact CD1-CG2 4.24Å; L554-V557 WeakPolarHBondContact O-CG2 3.39Å; L554-V557 PolarHBondContact O-N 3.19Å; L554-V558 PolarHBondContact O-N 3.1Å
555	A	79	Confident	84.9	Confident	59 Å²	59	70.5 Å²	70.5	49%	0.488	39%	0.385	S	S	.	.	H	α-helix	trans	-55.7	-29.1	178.9	0	0	0	0	0	113.7	R553	R553-A555 PolarHBondContact O-N 3.18Å
556	T	78.1	Confident	85	Confident	11 Å²	11	74.1 Å²	74.1	7%	0.067	41%	0.407	C	S	.	.	H	α-helix	trans	-78.3	-25.8	-179.3	-42.1	0	0	0	0	113	T523 F549 A551 R553 L554	T523-T556 HydrophobicContact CG2-CG2 4.43Å; T523-T556 PolarHBondContact OG1-OG1 3Å; F549-T556 HydrophobicContact CD1-CG2 4.19Å; A551-T556 HydrophobicContact CB-CG2 3.88Å; R553-T556 PolarHBondContact O-N 2.83Å; R553-T556 VanDerWaalsContact O-N 3.13Å; R553-T556 PolarHBondContact O-OG1 3.39Å; L554-T556 PolarHBondContact O-N 3.23Å; L554-T556 VanDerWaalsContact O-N 3.09Å
557	V	84.5	Confident	84.7	Confident	23 Å²	23	73.2 Å²	73.2	14%	0.139	40%	0.396	C	S	.	.	H	α-helix	trans	-113.5	-5.1	-173.1	-62.3	0	0	0	0	113.4	F549 A551 L554 D559 A560 I563	F549-V557 HydrophobicContact CB-CG1 4.29Å; A551-V557 HydrophobicContact CB-CG1 4.02Å; L554-V557 HydrophobicContact CD1-CG2 4.24Å; L554-V557 WeakPolarHBondContact O-CG2 3.39Å; L554-V557 PolarHBondContact O-N 3.19Å; V557-D559 PolarHBondContact O-N 3.31Å; V557-D559 VanDerWaalsContact O-N 3.16Å; V557-A560 WeakPolarHBondContact O-CB 3.29Å; V557-A560 PolarHBondContact O-N 3.1Å; V557-I563 HydrophobicContact CB-CG1 4.41Å; V557-I563 HydrophobicContact CG2-CD1 4.48Å; V557-I563 VanDerWaalsContact O-CD1 3.3Å; V557-I563 WeakPolarHBondContact O-CD1 3.47Å; V557-I563 WeakPolarHBondContact O-CG1 3.1Å
558	V	84.1	Confident	84.5	Confident	47 Å²	47	79.2 Å²	79.2	29%	0.285	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-34.1	-175.2	74.6	0	0	0	0	113.4	L554 H577	L554-V558 PolarHBondContact O-N 3.1Å; V558-H577 HydrophobicContact CG2-CB 4.32Å; V558-H577 WeakPolarHBondContact CG2-CD2 3.28Å; V558-H577 WeakPolarHBondContact O-CB 3.32Å
559	D	82.4	Confident	84.2	Confident	102 Å²	102	78.4 Å²	78.4	55%	0.545	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	9	-179.2	-57.4	-62.2	0	0	0	113.3	K539 V557	K539-D559 WeakPolarHBondContact CE-OD2 3.2Å; K539-D559 IonicContact NZ-OD2 2.61Å; K539-D559 PolarHBondContact NZ-OD2 2.94Å; V557-D559 PolarHBondContact O-N 3.31Å; V557-D559 VanDerWaalsContact O-N 3.16Å
560	A	87	Confident	83.7	Confident	32 Å²	32	83.5 Å²	83.5	26%	0.264	46%	0.463	S	S	.	.			trans	-72.7	140.5	-179.6	0	0	0	0	0	111.2	V557 L562 I563	V557-A560 WeakPolarHBondContact O-CB 3.29Å; V557-A560 PolarHBondContact O-N 3.1Å; A560-L562 PolarHBondContact O-N 2.91Å; A560-I563 HydrophobicContact CB-CG1 4.03Å
561	D	88.7	Confident	83.6	Confident	159 Å²	159	84 Å²	84	85%	0.85	47%	0.469	S	S	*	.	S	Bend	trans	-60.8	-28	173.3	-57	-60.3	0	0	0	111.9
562	L	91.6	Very high	83.9	Confident	107 Å²	107	85 Å²	85	56%	0.56	48%	0.477	S	S	*	.			trans	-146.2	120	176.7	-178.8	67.4	0	0	0	109.7	A560 V564	A560-L562 PolarHBondContact O-N 2.91Å; L562-V564 HydrophobicContact CD2-CG2 4.15Å; L562-V564 HydrophobicContact CG-CG2 4.08Å
563	I	91.7	Very high	84.4	Confident	15 Å²	15	78.7 Å²	78.7	8%	0.077	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.7	169.8	-60.7	170	0	0	0	107.6	V557 A560 V565 S574 G575 H577 L580	V557-I563 HydrophobicContact CB-CG1 4.41Å; V557-I563 HydrophobicContact CG2-CD1 4.48Å; V557-I563 VanDerWaalsContact O-CD1 3.3Å; V557-I563 WeakPolarHBondContact O-CD1 3.47Å; V557-I563 WeakPolarHBondContact O-CG1 3.1Å; A560-I563 HydrophobicContact CB-CG1 4.03Å; I563-V565 HydrophobicContact CG2-CG2 4.42Å; I563-S574 VanDerWaalsContact O-CA 3.23Å; I563-S574 WeakPolarHBondContact O-CA 3.33Å; I563-G575 WeakPolarHBondContact CB-O 3.42Å; I563-G575 PolarHBondContact N-O 3.29Å; I563-G575 PolarHBondContact O-N 3.16Å; I563-H577 HydrophobicContact CD1-CB 3.77Å; I563-L580 HydrophobicContact CB-CD1 3.87Å; I563-L580 HydrophobicContact CG2-CD1 3.79Å
564	V	90.4	Very high	85	Confident	70 Å²	70	76.7 Å²	76.7	42%	0.424	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.1	175.6	-178.8	0	0	0	0	108.2	L562 L566 V571	L562-V564 HydrophobicContact CD2-CG2 4.15Å; L562-V564 HydrophobicContact CG-CG2 4.08Å; V564-L566 HydrophobicContact CG1-CD2 4.33Å; V564-V571 HydrophobicContact CG1-CB 4.29Å; V564-V571 HydrophobicContact CG1-CG1 3.72Å; V564-V571 HydrophobicContact CG1-CG2 3.73Å
565	V	88.8	Confident	85.6	Confident	41 Å²	41	71.8 Å²	71.8	25%	0.248	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.3	178.3	-175	0	0	0	0	108.6	I563 A572 E573 L580	I563-V565 HydrophobicContact CG2-CG2 4.42Å; V565-A572 PolarHBondContact O-N 3.16Å; V565-E573 HydrophobicContact CB-CB 4.11Å; V565-E573 HydrophobicContact CG2-CB 4.16Å; V565-E573 PolarHBondContact N-O 2.88Å; V565-E573 PolarHBondContact O-N 2.88Å; V565-L580 HydrophobicContact CG2-CD1 4.34Å
566	L	84.7	Confident	86	Confident	126 Å²	126	70.9 Å²	70.9	66%	0.66	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	126	179.2	-66.3	174.3	0	0	0	110.5	V564 K570 V571	V564-L566 HydrophobicContact CG1-CD2 4.33Å; L566-K570 CarbonylContact C-O 3.56Å; L566-K570 WeakPolarHBondContact CA-O 3.47Å; L566-V571 HydrophobicContact CD2-CG2 3.88Å
567	E	82.8	Confident	86.5	Confident	79 Å²	79	72.5 Å²	72.5	37%	0.369	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.8	172.6	-170.6	169.9	-140.9	0	0	109.8	G569 K570 A572 R587	E567-G569 PolarHBondContact O-N 3.35Å; E567-G569 VanDerWaalsContact O-N 3.07Å; E567-K570 PolarHBondContact N-O 2.88Å; E567-K570 PolarHBondContact O-N 3.46Å; E567-A572 HydrophobicContact CB-CB 3.96Å; E567-R587 IonicContact OE1-CZ 2.67Å; E567-R587 IonicContact OE1-NH1 3.46Å; E567-R587 PolarHBondContact OE1-NH1 3.43Å; E567-R587 IonicContact OE1-NH2 2.68Å; E567-R587 PolarHBondContact OE1-NH2 3.16Å
568	N	83.4	Confident	86.6	Confident	158 Å²	158	76.3 Å²	76.3	85%	0.845	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	36.1	180	-61.8	-41.7	0	0	0	114.1	K570	N568-K570 VanDerWaalsContact C-N 3.29Å; N568-K570 PolarHBondContact O-N 3.21Å
569	G	82.5	Confident	86.7	Confident	79 Å²	79	78.8 Å²	78.8	81%	0.814	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	9.7	-179.4	0	0	0	0	0	115.1	E567	E567-G569 PolarHBondContact O-N 3.35Å; E567-G569 VanDerWaalsContact O-N 3.07Å
570	K	76.1	Confident	86.9	Confident	160 Å²	160	74.4 Å²	74.4	70%	0.696	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	151.7	175.3	-63.5	-177.8	-177.8	178	0	110.4	L566 E567 N568 A572	L566-K570 CarbonylContact C-O 3.56Å; L566-K570 WeakPolarHBondContact CA-O 3.47Å; E567-K570 PolarHBondContact N-O 2.88Å; E567-K570 PolarHBondContact O-N 3.46Å; N568-K570 VanDerWaalsContact C-N 3.29Å; N568-K570 PolarHBondContact O-N 3.21Å; K570-A572 PolarHBondContact O-N 2.97Å
571	V	86.5	Confident	86.8	Confident	90 Å²	90	78.7 Å²	78.7	55%	0.545	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	111.4	169	177.8	0	0	0	0	107.7	V564 L566	V564-V571 HydrophobicContact CG1-CB 4.29Å; V564-V571 HydrophobicContact CG1-CG1 3.72Å; V564-V571 HydrophobicContact CG1-CG2 3.73Å; L566-V571 HydrophobicContact CD2-CG2 3.88Å
572	A	85.9	Confident	86.7	Confident	51 Å²	51	75.4 Å²	75.4	42%	0.421	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-44.6	174.7	0	0	0	0	0	110	V565 E567 K570	V565-A572 PolarHBondContact O-N 3.16Å; E567-A572 HydrophobicContact CB-CB 3.96Å; K570-A572 PolarHBondContact O-N 2.97Å
573	E	88.4	Confident	86.3	Confident	31 Å²	31	74.6 Å²	74.6	15%	0.145	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.6	-176.3	-56.4	-177.2	-128.3	0	0	111.1	V565 L580 S586 R587	V565-E573 HydrophobicContact CB-CB 4.11Å; V565-E573 HydrophobicContact CG2-CB 4.16Å; V565-E573 PolarHBondContact N-O 2.88Å; V565-E573 PolarHBondContact O-N 2.88Å; E573-L580 HydrophobicContact CB-CD2 3.9Å; E573-S586 WeakPolarHBondContact OE1-CA 3.48Å; E573-S586 VanDerWaalsContact OE2-CB 3.32Å; E573-S586 WeakPolarHBondContact OE2-CB 3.45Å; E573-S586 PolarHBondContact OE2-OG 3.44Å; E573-R587 PolarHBondContact OE1-N 3.27Å
574	S	90.1	Very high	85.5	Confident	63 Å²	63	80 Å²	80	44%	0.441	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	141.8	170.5	62.9	0	0	0	0	110.5	I563	I563-S574 VanDerWaalsContact O-CA 3.23Å; I563-S574 WeakPolarHBondContact O-CA 3.33Å
575	G	89.8	Confident	84.9	Confident	5 Å²	5	83.8 Å²	83.8	5%	0.052	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.9	-176.5	177.1	0	0	0	0	0	111.6	I563 E579	I563-G575 WeakPolarHBondContact CB-O 3.42Å; I563-G575 PolarHBondContact N-O 3.29Å; I563-G575 PolarHBondContact O-N 3.16Å; G575-E579 WeakPolarHBondContact CA-OE2 3.24Å
576	T	89.2	Confident	84.3	Confident	39 Å²	39	83.2 Å²	83.2	24%	0.239	48%	0.48	C	S	.	.			trans	-74.7	163.3	168.1	63.8	0	0	0	0	110.8	T578 E579 L580	T576-T578 VanDerWaalsContact C-N 3.27Å; T576-T578 PolarHBondContact O-N 3.48Å; T576-T578 PolarHBondContact OG1-OG1 3.44Å; T576-E579 PolarHBondContact N-OE2 3.5Å; T576-E579 PolarHBondContact O-N 2.94Å; T576-E579 WeakPolarHBondContact OG1-CB 3.41Å; T576-E579 WeakPolarHBondContact OG1-CG 3.39Å; T576-E579 PolarHBondContact OG1-N 3.01Å; T576-E579 PolarHBondContact OG1-OE2 3.37Å; T576-L580 WeakPolarHBondContact O-CG 3.28Å; T576-L580 PolarHBondContact O-N 3.43Å
577	H	87.3	Confident	83.3	Confident	45 Å²	45	88.5 Å²	88.5	21%	0.208	49%	0.491	C	S	.	.	H	α-helix	trans	-55.9	-41.5	179.1	-178.8	53.5	0	0	0	113.1	V558 I563 L580 L581	V558-H577 HydrophobicContact CG2-CB 4.32Å; V558-H577 WeakPolarHBondContact CG2-CD2 3.28Å; V558-H577 WeakPolarHBondContact O-CB 3.32Å; I563-H577 HydrophobicContact CD1-CB 3.77Å; H577-L580 PolarHBondContact O-N 3.23Å; H577-L581 WeakPolarHBondContact NE2-CD1 3.39Å; H577-L581 WeakPolarHBondContact O-CG 3.47Å; H577-L581 PolarHBondContact O-N 3.21Å; H577-L581 VanDerWaalsContact O-N 3.09Å
578	T	86	Confident	83.3	Confident	103 Å²	103	89 Å²	89	63%	0.632	50%	0.497	S	S	*	.	H	α-helix	trans	-69.8	-38	178.7	47.3	0	0	0	0	112.5	T576 S582	T576-T578 VanDerWaalsContact C-N 3.27Å; T576-T578 PolarHBondContact O-N 3.48Å; T576-T578 PolarHBondContact OG1-OG1 3.44Å; T578-S582 PolarHBondContact O-N 3.4Å
579	E	87.3	Confident	83.3	Confident	99 Å²	99	85.3 Å²	85.3	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-64.4	-41.8	175.1	-76.2	166.5	-175.8	0	0	111.8	G575 T576 S582	G575-E579 WeakPolarHBondContact CA-OE2 3.24Å; T576-E579 PolarHBondContact N-OE2 3.5Å; T576-E579 PolarHBondContact O-N 2.94Å; T576-E579 WeakPolarHBondContact OG1-CB 3.41Å; T576-E579 WeakPolarHBondContact OG1-CG 3.39Å; T576-E579 PolarHBondContact OG1-N 3.01Å; T576-E579 PolarHBondContact OG1-OE2 3.37Å; E579-S582 PolarHBondContact O-N 3.26Å; E579-S582 PolarHBondContact O-OG 3.48Å
580	L	87	Confident	83.4	Confident	10 Å²	10	85.7 Å²	85.7	5%	0.052	46%	0.46	C	S	.	.	H	α-helix	trans	-65.3	-47.2	177.6	-66.4	179.9	0	0	0	110.9	I563 V565 E573 T576 H577 S582 K583 S586	I563-L580 HydrophobicContact CB-CD1 3.87Å; I563-L580 HydrophobicContact CG2-CD1 3.79Å; V565-L580 HydrophobicContact CG2-CD1 4.34Å; E573-L580 HydrophobicContact CB-CD2 3.9Å; T576-L580 WeakPolarHBondContact O-CG 3.28Å; T576-L580 PolarHBondContact O-N 3.43Å; H577-L580 PolarHBondContact O-N 3.23Å; L580-S582 PolarHBondContact O-N 2.8Å; L580-S582 VanDerWaalsContact O-N 3.11Å; L580-K583 WeakPolarHBondContact O-CB 3.37Å; L580-K583 PolarHBondContact O-N 3.24Å; L580-S586 WeakPolarHBondContact O-CB 3.49Å; L580-S586 PolarHBondContact O-OG 3.04Å
581	L	85.2	Confident	83.8	Confident	122 Å²	122	81.3 Å²	81.3	64%	0.639	45%	0.447	S	S	*	.	H	α-helix	trans	-59.1	-26.3	175.7	-76.6	177.2	0	0	0	114.5	H577 K583	H577-L581 WeakPolarHBondContact NE2-CD1 3.39Å; H577-L581 WeakPolarHBondContact O-CG 3.47Å; H577-L581 PolarHBondContact O-N 3.21Å; H577-L581 VanDerWaalsContact O-N 3.09Å; L581-K583 VanDerWaalsContact C-N 3.26Å; L581-K583 PolarHBondContact O-N 3.38Å
582	S	85.7	Confident	83.6	Confident	91 Å²	91	80.8 Å²	80.8	64%	0.636	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.9	178.2	75.7	0	0	0	0	113.7	T578 E579 L580	T578-S582 PolarHBondContact O-N 3.4Å; E579-S582 PolarHBondContact O-N 3.26Å; E579-S582 PolarHBondContact O-OG 3.48Å; L580-S582 PolarHBondContact O-N 2.8Å; L580-S582 VanDerWaalsContact O-N 3.11Å
583	K	83.3	Confident	83.5	Confident	89 Å²	89	82.7 Å²	82.7	39%	0.387	44%	0.442	S	S	.	.	S	Bend	trans	-86.9	122.3	177.9	-64.2	174.7	-171.5	171.9	0	109.1	L580 L581 D585 S586	L580-K583 WeakPolarHBondContact O-CB 3.37Å; L580-K583 PolarHBondContact O-N 3.24Å; L581-K583 VanDerWaalsContact C-N 3.26Å; L581-K583 PolarHBondContact O-N 3.38Å; K583-D585 PolarHBondContact O-N 3.24Å; K583-D585 VanDerWaalsContact O-N 3.09Å; K583-S586 WeakPolarHBondContact O-CB 3.47Å; K583-S586 PolarHBondContact O-N 3.27Å; K583-S586 VanDerWaalsContact O-N 3.09Å
584	P	75.2	Confident	83.1	Confident	128 Å²	128	86.4 Å²	86.4	83%	0.831	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.1	-175.2	-1.1	-0.9	0	0	0	114.2
585	D	77.3	Confident	82.6	Confident	150 Å²	150	88.2 Å²	88.2	80%	0.802	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	7.9	-177.3	-57.1	-40	0	0	0	113.4	K583	K583-D585 PolarHBondContact O-N 3.24Å; K583-D585 VanDerWaalsContact O-N 3.09Å
586	S	76	Confident	82	Confident	29 Å²	29	95.2 Å²	95.2	20%	0.203	50%	0.499	C	S	.	.			trans	-67.3	136.1	177.3	175.1	0	0	0	0	110.7	E573 L580 K583	E573-S586 WeakPolarHBondContact OE1-CA 3.48Å; E573-S586 VanDerWaalsContact OE2-CB 3.32Å; E573-S586 WeakPolarHBondContact OE2-CB 3.45Å; E573-S586 PolarHBondContact OE2-OG 3.44Å; L580-S586 WeakPolarHBondContact O-CB 3.49Å; L580-S586 PolarHBondContact O-OG 3.04Å; K583-S586 WeakPolarHBondContact O-CB 3.47Å; K583-S586 PolarHBondContact O-N 3.27Å; K583-S586 VanDerWaalsContact O-N 3.09Å
587	R	64	Low	81.3	Confident	237 Å²	237	100.3 Å²	100.3	89%	0.894	52%	0.523	S	S	*	.			trans	-76.7	0	175.6	-85	-157.3	179.2	151	13.9	115.2	E567 E573	E567-R587 IonicContact OE1-CZ 2.67Å; E567-R587 IonicContact OE1-NH1 3.46Å; E567-R587 PolarHBondContact OE1-NH1 3.43Å; E567-R587 IonicContact OE1-NH2 2.68Å; E567-R587 PolarHBondContact OE1-NH2 3.16Å; E573-R587 PolarHBondContact OE1-N 3.27Å

Retrieved 587 of 587 residues in 1339.7 ms (Link to these results)

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