A0A061IIP9_CRIGR Loading...

Proton myo-inositol cotransporter

H(+)-myo-inositol cotransporter. Can also transport related stereoisomers.

AlphaFold DB , UniProt , Accession A0A061IIP9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100750437, Length 639 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	35.6	Very low	28.5	Very low	255 Å²	255	162.6 Å²	162.6	100%	1.256	83%	0.825	S	S	*	*				0	124.9	0	-81.3	172.9	172.7	0	0	107.8
2	S	26.8	Very low	28.4	Very low	107 Å²	107	158.4 Å²	158.4	75%	0.748	81%	0.814	S	S	*	*			trans	-115.4	135.7	-162.8	-157.4	0	0	0	0	109.7
3	R	27.1	Very low	28.8	Very low	223 Å²	223	160 Å²	160	84%	0.842	82%	0.823	S	S	*	*				126.7	150.6	116.8	-98.1	171.3	-176.3	-170.3	-0.2	108.6
4	K	29.3	Very low	28.9	Very low	193 Å²	193	164.8 Å²	164.8	84%	0.839	83%	0.826	S	S	*	*			cis	-173.8	152.3	-20.1	-132	-171.7	179.9	-166.3	0	105.2
5	A	28.2	Very low	29	Very low	90 Å²	90	160.7 Å²	160.7	74%	0.744	82%	0.819	S	S	*	*			trans	-102	159.3	167.6	0	0	0	0	0	111.4
6	S	27.6	Very low	29.3	Very low	109 Å²	109	160.7 Å²	160.7	76%	0.762	82%	0.82	S	S	*	*			trans	71.2	147.2	151.7	-140.9	0	0	0	0	123
7	E	25.4	Very low	29.5	Very low	164 Å²	164	157.8 Å²	157.8	77%	0.766	82%	0.818	S	S	*	*			trans	94.3	123.3	154.8	-76	171.5	-177.7	0	0	122.3
8	D	28.2	Very low	29.6	Very low	142 Å²	142	154.7 Å²	154.7	76%	0.759	81%	0.812	S	S	*	*			trans	44.1	119.6	135.3	-63.2	-24.7	0	0	0	121.2
9	V	28	Very low	29.7	Very low	115 Å²	115	154.9 Å²	154.9	70%	0.697	81%	0.813	S	S	*	*			trans	-146	110.7	145.7	-175.6	0	0	0	0	111.6	Y11	V9-Y11 HydrophobicContact CG1-CE2 4.37Å
10	E	28.1	Very low	30.1	Very low	172 Å²	172	156.2 Å²	156.2	80%	0.804	82%	0.817	S	S	*	*			trans	-59.4	119.5	158.5	-173.7	178.2	-158.8	0	0	110.6	T12	E10-T12 PolarHBondContact O-N 2.97Å
11	Y	28.8	Very low	30.2	Very low	219 Å²	219	152.1 Å²	152.1	86%	0.859	81%	0.813	S	S	*	*			trans	-90.9	101.3	175.9	-88.8	-82.2	0	0	0	111.3	V9	V9-Y11 HydrophobicContact CG1-CE2 4.37Å
12	T	28.2	Very low	30.1	Very low	112 Å²	112	148.7 Å²	148.7	69%	0.687	79%	0.794	S	S	*	*			trans	-74.8	146.3	176	-6.7	0	0	0	0	112.2	E10 R14	E10-T12 PolarHBondContact O-N 2.97Å; T12-R14 PolarHBondContact O-N 2.88Å
13	L	33.4	Very low	30.4	Very low	179 Å²	179	155.2 Å²	155.2	94%	0.937	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	36.2	-177	-112.5	154.6	0	0	0	116.9
14	R	30.7	Very low	30.6	Very low	227 Å²	227	156.8 Å²	156.8	86%	0.857	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	-1.7	-171.3	-95.8	-175.8	177.4	174	0.1	117.7	T12	T12-R14 PolarHBondContact O-N 2.88Å
15	S	29.8	Very low	30.6	Very low	104 Å²	104	159.3 Å²	159.3	73%	0.727	81%	0.812	S	S	*	*	S	Bend	trans	-94.5	-1.3	-178	83.2	0	0	0	0	116.4
16	L	33.6	Very low	30.6	Very low	160 Å²	160	166.1 Å²	166.1	84%	0.838	82%	0.818	S	S	*	*	G	3₁₀ helix	trans	-90.7	-1.6	-177.7	-88.6	157.7	0	0	0	114.9
17	S	32.1	Very low	30.6	Very low	111 Å²	111	169.8 Å²	169.8	78%	0.776	82%	0.824	S	S	*	*	G	3₁₀ helix	trans	-87.4	-2	-176.4	79.8	0	0	0	0	115.2
18	S	31.6	Very low	30.6	Very low	103 Å²	103	171 Å²	171	72%	0.72	83%	0.829	S	S	*	*	G	3₁₀ helix	trans	-101.2	8.5	-173.1	83.5	0	0	0	0	115.9
19	L	32.1	Very low	30.5	Very low	158 Å²	158	173.2 Å²	173.2	83%	0.827	84%	0.835	S	S	*	*	S	Bend	trans	-113.7	4.2	-175.6	-94.5	158.4	0	0	0	115.8
20	M	36.8	Very low	30.8	Very low	181 Å²	181	173.7 Å²	173.7	89%	0.892	84%	0.84	S	S	*	*	S	Bend	trans	-112.6	25.8	176.5	-75.2	-159.2	-72	0	0	114.1
21	G	32.6	Very low	30.8	Very low	71 Å²	71	169.1 Å²	169.1	73%	0.732	84%	0.84	S	S	*	*			trans	-88.4	-7.2	-175.9	0	0	0	0	0	117
22	E	33.8	Very low	30.7	Very low	182 Å²	182	163.7 Å²	163.7	85%	0.85	84%	0.84	S	S	*	*	S	Bend	trans	-139.5	88.5	-172.4	-77.4	-174.7	145	0	0	112.6
23	R	33.7	Very low	31.1	Very low	245 Å²	245	164.7 Å²	164.7	93%	0.925	85%	0.849	S	S	*	*			trans	174.4	93.1	143.3	-99.2	165.5	-173.3	-168.7	3.7	110.1
24	R	30.8	Very low	31.2	Very low	256 Å²	256	159.7 Å²	159.7	97%	0.966	84%	0.84	S	S	*	*			trans	-175.8	94.3	137.7	-102.6	164.3	-175.9	-173.2	1.9	110.2
25	R	29.7	Very low	31.4	Very low	245 Å²	245	151.3 Å²	151.3	93%	0.925	82%	0.824	S	S	*	*			trans	-108.4	148.5	156.1	-108.7	-177.1	174.1	179.7	-0.8	107.3
26	R	28.5	Very low	31.7	Very low	233 Å²	233	154.4 Å²	154.4	88%	0.879	83%	0.827	S	S	*	*			trans	95.3	128	-174.4	-60.4	-179.7	177.6	-172.5	-0.9	111.9
27	Q	26	Very low	31.9	Very low	187 Å²	187	157.9 Å²	157.9	87%	0.874	83%	0.829	S	S	*	*			cis	-161.3	149.5	7.1	-144.8	165.1	-11.2	0	0	106.3
28	Q	26.4	Very low	32.3	Very low	188 Å²	188	156.7 Å²	156.7	88%	0.879	82%	0.821	S	S	*	*			trans	-112.2	129.9	-171	-170.4	166	8.8	0	0	110.1
29	E	25.9	Very low	32.5	Very low	190 Å²	190	157.8 Å²	157.8	89%	0.888	82%	0.818	S	S	*	*			trans	-139.1	150.8	155.7	-94.5	-165.6	161.8	0	0	110
30	P	35.2	Very low	32.9	Very low	124 Å²	124	156.2 Å²	156.2	81%	0.805	81%	0.81	S	S	*	*			trans	-110.2	145.5	-155.1	36.5	-24.3	0	0	0	114
31	G	26.3	Very low	33.1	Very low	77 Å²	77	150 Å²	150	79%	0.794	79%	0.787	S	S	*	*			trans	168.3	113.2	164	0	0	0	0	0	116.9
32	A	27.9	Very low	33.5	Very low	104 Å²	104	149.2 Å²	149.2	86%	0.86	77%	0.774	S	S	*	*			trans	82.8	145.2	156.2	0	0	0	0	0	120.8
33	P	35.8	Very low	33.7	Very low	134 Å²	134	143.1 Å²	143.1	87%	0.87	76%	0.755	S	S	*	*			trans	-101.9	138.9	-160.4	37.3	-26.9	0	0	0	113.3
34	G	35	Very low	34	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	74%	0.742	S	S	*	*			trans	164.8	63.2	173.7	0	0	0	0	0	112.2
35	G	35.2	Very low	34.5	Very low	51 Å²	51	129.1 Å²	129.1	53%	0.526	72%	0.718	S	S	.	*			trans	-114.3	11.7	-151.9	0	0	0	0	0	119.5	L39	G35-L39 VanDerWaalsContact O-CD1 3.3Å; G35-L39 WeakPolarHBondContact O-CD1 2.92Å
36	E	37.3	Very low	35	Very low	170 Å²	170	119.9 Å²	119.9	79%	0.794	69%	0.693	S	S	*	*	S	Bend	trans	-114.9	-36	-177.1	-74.6	-177.1	149	0	0	114.9
37	R	37.1	Very low	35.9	Very low	233 Å²	233	113.4 Å²	113.4	88%	0.879	68%	0.68	S	S	*	*	H	α-helix	trans	-75.8	-25.4	176.7	-84.8	-178.1	171.8	174.6	-2.5	114.2
38	S	40	Very low	36.9	Very low	86 Å²	86	108.1 Å²	108.1	60%	0.601	66%	0.664	S	S	*	*	H	α-helix	trans	-78.2	-28.8	-179.2	-157.6	0	0	0	0	112.6	A42	S38-A42 VanDerWaalsContact O-CB 3.25Å; S38-A42 WeakPolarHBondContact O-CB 3.27Å; S38-A42 PolarHBondContact O-N 3.42Å
39	L	36.4	Very low	37.8	Very low	125 Å²	125	103.9 Å²	103.9	65%	0.654	65%	0.646	S	S	*	*	H	α-helix	trans	-73.3	-34.6	178.8	-74.2	173.4	0	0	0	112.7	G35 A43	G35-L39 VanDerWaalsContact O-CD1 3.3Å; G35-L39 WeakPolarHBondContact O-CD1 2.92Å; L39-A43 VanDerWaalsContact O-CB 3.26Å; L39-A43 WeakPolarHBondContact O-CB 3.43Å; L39-A43 PolarHBondContact O-N 3.46Å
40	L	40.6	Very low	38.8	Very low	125 Å²	125	100.8 Å²	100.8	65%	0.654	63%	0.632	S	S	*	*	H	α-helix	trans	-69.8	-42.1	175.2	-77.9	161.3	0	0	0	112	A42 A43 E44	L40-A42 VanDerWaalsContact C-N 3.35Å; L40-A42 PolarHBondContact O-N 3.37Å; L40-A43 PolarHBondContact O-N 2.92Å; L40-E44 PolarHBondContact O-N 3.07Å
41	A	41	Very low	39.5	Very low	50 Å²	50	96.6 Å²	96.6	41%	0.413	61%	0.611	S	S	.	*	H	α-helix	trans	-67.4	-34.5	175.3	0	0	0	0	0	112.7	S45	A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.38Å; A41-S45 PolarHBondContact O-N 3.37Å; A41-S45 PolarHBondContact O-OG 2.99Å
42	A	40.8	Very low	40.7	Very low	56 Å²	56	94.2 Å²	94.2	46%	0.463	58%	0.582	S	S	.	*	H	α-helix	trans	-71	-36.2	173.1	0	0	0	0	0	112.2	S38 L40 A46	S38-A42 VanDerWaalsContact O-CB 3.25Å; S38-A42 WeakPolarHBondContact O-CB 3.27Å; S38-A42 PolarHBondContact O-N 3.42Å; L40-A42 VanDerWaalsContact C-N 3.35Å; L40-A42 PolarHBondContact O-N 3.37Å; A42-A46 VanDerWaalsContact O-CB 3.25Å; A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 2.69Å
43	A	39	Very low	41.7	Very low	54 Å²	54	95.1 Å²	95.1	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-67.4	-45.6	174.5	0	0	0	0	0	111.6	L39 L40 A46 T47	L39-A43 VanDerWaalsContact O-CB 3.26Å; L39-A43 WeakPolarHBondContact O-CB 3.43Å; L39-A43 PolarHBondContact O-N 3.46Å; L40-A43 PolarHBondContact O-N 2.92Å; A43-A46 PolarHBondContact O-N 3.29Å; A43-T47 PolarHBondContact O-N 3.42Å; A43-T47 PolarHBondContact O-OG1 3.41Å
44	E	40.1	Very low	42.6	Very low	143 Å²	143	95 Å²	95	67%	0.668	56%	0.56	S	S	*	*	H	α-helix	trans	-62.7	-41.5	174.9	-79.9	-177.4	156	0	0	112.2	L40 T47 S48	L40-E44 PolarHBondContact O-N 3.07Å; E44-T47 WeakPolarHBondContact CA-OG1 3.41Å; E44-T47 PolarHBondContact O-N 3.09Å; E44-T47 PolarHBondContact O-OG1 3.01Å; E44-T47 VanDerWaalsContact O-OG1 3.06Å; E44-S48 PolarHBondContact O-N 3.29Å; E44-S48 PolarHBondContact O-OG 3.49Å
45	S	40.9	Very low	43.5	Very low	64 Å²	64	97.4 Å²	97.4	45%	0.448	55%	0.552	S	S	.	*	H	α-helix	trans	-64	-39.4	172.9	-68.1	0	0	0	0	111.9	A41 S48 L49	A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.38Å; A41-S45 PolarHBondContact O-N 3.37Å; A41-S45 PolarHBondContact O-OG 2.99Å; S45-S48 PolarHBondContact O-N 3.18Å; S45-S48 PolarHBondContact O-OG 3.43Å; S45-L49 VanDerWaalsContact O-CB 3.28Å; S45-L49 WeakPolarHBondContact O-CB 3.5Å; S45-L49 WeakPolarHBondContact O-CD1 3.42Å; S45-L49 PolarHBondContact O-N 3.36Å
46	A	39.8	Very low	44.4	Very low	50 Å²	50	101.1 Å²	101.1	41%	0.413	55%	0.55	S	S	.	*	H	α-helix	trans	-66.4	-42.2	176.6	0	0	0	0	0	112	A42 A43 L49 Q50	A42-A46 VanDerWaalsContact O-CB 3.25Å; A42-A46 WeakPolarHBondContact O-CB 3.44Å; A42-A46 PolarHBondContact O-N 2.69Å; A43-A46 PolarHBondContact O-N 3.29Å; A46-L49 PolarHBondContact O-N 2.88Å; A46-Q50 WeakPolarHBondContact O-CB 3.32Å; A46-Q50 PolarHBondContact O-N 3.46Å
47	T	47.4	Very low	45	Very low	98 Å²	98	95 Å²	95	60%	0.601	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-37.4	174.2	25.2	0	0	0	0	113.3	A43 E44 Q50 G51	A43-T47 PolarHBondContact O-N 3.42Å; A43-T47 PolarHBondContact O-OG1 3.41Å; E44-T47 WeakPolarHBondContact CA-OG1 3.41Å; E44-T47 PolarHBondContact O-N 3.09Å; E44-T47 PolarHBondContact O-OG1 3.01Å; E44-T47 VanDerWaalsContact O-OG1 3.06Å; T47-Q50 PolarHBondContact O-N 3.44Å; T47-G51 PolarHBondContact O-N 3.38Å
48	S	45.8	Very low	45.6	Very low	75 Å²	75	86.6 Å²	86.6	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-73.3	-37.4	177.2	67.8	0	0	0	0	112.4	E44 S45 S52	E44-S48 PolarHBondContact O-N 3.29Å; E44-S48 PolarHBondContact O-OG 3.49Å; S45-S48 PolarHBondContact O-N 3.18Å; S45-S48 PolarHBondContact O-OG 3.43Å; S48-S52 WeakPolarHBondContact O-CB 3.46Å; S48-S52 PolarHBondContact O-N 3.42Å; S48-S52 PolarHBondContact O-OG 3.03Å
49	L	45.8	Very low	46.1	Very low	99 Å²	99	91 Å²	91	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-44.4	170	-92.7	145.7	0	0	0	110.9	S45 A46 S52 E53	S45-L49 VanDerWaalsContact O-CB 3.28Å; S45-L49 WeakPolarHBondContact O-CB 3.5Å; S45-L49 WeakPolarHBondContact O-CD1 3.42Å; S45-L49 PolarHBondContact O-N 3.36Å; A46-L49 PolarHBondContact O-N 2.88Å; L49-S52 PolarHBondContact O-N 2.94Å; L49-S52 PolarHBondContact O-OG 3.06Å; L49-E53 WeakPolarHBondContact O-CB 3.2Å; L49-E53 WeakPolarHBondContact O-CG 3.42Å; L49-E53 PolarHBondContact O-N 3.27Å
50	Q	47.5	Very low	46.4	Very low	125 Å²	125	93.4 Å²	93.4	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-69.3	-36.6	-179.3	-157.2	151.8	17.1	0	0	112.5	A46 T47 E53 L54	A46-Q50 WeakPolarHBondContact O-CB 3.32Å; A46-Q50 PolarHBondContact O-N 3.46Å; T47-Q50 PolarHBondContact O-N 3.44Å; Q50-E53 PolarHBondContact O-N 3.24Å; Q50-L54 VanDerWaalsContact O-CB 3.31Å; Q50-L54 WeakPolarHBondContact O-CB 3.41Å; Q50-L54 PolarHBondContact O-N 3.45Å
51	G	50.6	Low	46.5	Very low	36 Å²	36	94 Å²	94	37%	0.371	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-42.1	169.5	0	0	0	0	0	112.8	T47 E53 L54 E55	T47-G51 PolarHBondContact O-N 3.38Å; G51-E53 PolarHBondContact O-N 3.04Å; G51-L54 PolarHBondContact O-N 3.38Å; G51-E55 WeakPolarHBondContact O-CB 3.5Å; G51-E55 PolarHBondContact O-N 3.28Å
52	S	49.8	Very low	46.7	Very low	27 Å²	27	99.4 Å²	99.4	19%	0.189	53%	0.527	C	S	.	.	H	α-helix	trans	-69.6	-31	176.8	80.9	0	0	0	0	113	S48 L49 R56	S48-S52 WeakPolarHBondContact O-CB 3.46Å; S48-S52 PolarHBondContact O-N 3.42Å; S48-S52 PolarHBondContact O-OG 3.03Å; L49-S52 PolarHBondContact O-N 2.94Å; L49-S52 PolarHBondContact O-OG 3.06Å; S52-R56 VanDerWaalsContact O-CB 3.31Å; S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 VanDerWaalsContact O-CG 3.24Å; S52-R56 WeakPolarHBondContact O-CG 3.22Å; S52-R56 PolarHBondContact O-N 3.3Å; S52-R56 PolarHBondContact O-NH1 3.08Å; S52-R56 PolarHBondContact OG-NH1 2.99Å
53	E	49.5	Very low	46.8	Very low	124 Å²	124	104.7 Å²	104.7	58%	0.579	54%	0.542	S	S	*	.	H	α-helix	trans	-76.4	-35.1	172.8	-76.8	-162.5	150.2	0	0	111.7	L49 Q50 G51 R56 A57	L49-E53 WeakPolarHBondContact O-CB 3.2Å; L49-E53 WeakPolarHBondContact O-CG 3.42Å; L49-E53 PolarHBondContact O-N 3.27Å; Q50-E53 PolarHBondContact O-N 3.24Å; G51-E53 PolarHBondContact O-N 3.04Å; E53-R56 PolarHBondContact O-N 2.99Å; E53-A57 WeakPolarHBondContact O-CA 3.23Å; E53-A57 WeakPolarHBondContact O-CB 3.23Å; E53-A57 PolarHBondContact O-N 3.49Å
54	L	55	Low	46.7	Very low	130 Å²	130	112.1 Å²	112.1	68%	0.681	56%	0.559	S	S	*	*	H	α-helix	trans	-66.4	-39.6	171.3	-150.2	92.8	0	0	0	111.1	Q50 G51 A57 A58	Q50-L54 VanDerWaalsContact O-CB 3.31Å; Q50-L54 WeakPolarHBondContact O-CB 3.41Å; Q50-L54 PolarHBondContact O-N 3.45Å; G51-L54 PolarHBondContact O-N 3.38Å; L54-A57 PolarHBondContact O-N 2.94Å; L54-A58 WeakPolarHBondContact O-CB 3.35Å; L54-A58 PolarHBondContact O-N 2.88Å
55	E	53.8	Low	47.3	Very low	125 Å²	125	109 Å²	109	58%	0.584	55%	0.546	S	S	*	.	H	α-helix	trans	-67.9	-41	172.1	-82.9	-171.5	143.4	0	0	112.2	G51 A57 R59	G51-E55 WeakPolarHBondContact O-CB 3.5Å; G51-E55 PolarHBondContact O-N 3.28Å; E55-A57 VanDerWaalsContact C-N 3.33Å; E55-R59 VanDerWaalsContact O-CB 3.26Å; E55-R59 WeakPolarHBondContact O-CB 3.3Å; E55-R59 VanDerWaalsContact O-CG 3.24Å; E55-R59 WeakPolarHBondContact O-CG 3.09Å; E55-R59 PolarHBondContact O-N 3.36Å
56	R	54.3	Low	48.1	Very low	128 Å²	128	114.7 Å²	114.7	48%	0.483	57%	0.566	S	S	.	*	H	α-helix	trans	-67.7	-34.8	173.4	-77.8	-177	-151.6	95.3	1.1	111.5	S52 E53 R60	S52-R56 VanDerWaalsContact O-CB 3.31Å; S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 VanDerWaalsContact O-CG 3.24Å; S52-R56 WeakPolarHBondContact O-CG 3.22Å; S52-R56 PolarHBondContact O-N 3.3Å; S52-R56 PolarHBondContact O-NH1 3.08Å; S52-R56 PolarHBondContact OG-NH1 2.99Å; E53-R56 PolarHBondContact O-N 2.99Å; R56-R60 VanDerWaalsContact O-CB 3.24Å; R56-R60 WeakPolarHBondContact O-CB 3.47Å; R56-R60 WeakPolarHBondContact O-CG 3.33Å; R56-R60 PolarHBondContact O-N 3.5Å
57	A	50	Low	49.4	Very low	42 Å²	42	114.1 Å²	114.1	35%	0.347	56%	0.557	S	S	.	*	H	α-helix	trans	-70.4	-44.8	175.2	0	0	0	0	0	110.4	E53 L54 E55 R59 R60 Q61	E53-A57 WeakPolarHBondContact O-CA 3.23Å; E53-A57 WeakPolarHBondContact O-CB 3.23Å; E53-A57 PolarHBondContact O-N 3.49Å; L54-A57 PolarHBondContact O-N 2.94Å; E55-A57 VanDerWaalsContact C-N 3.33Å; A57-R59 PolarHBondContact O-N 3.12Å; A57-R60 CarbonylContact O-C 3.39Å; A57-R60 WeakPolarHBondContact O-CA 3.42Å; A57-R60 WeakPolarHBondContact O-CB 3.38Å; A57-R60 PolarHBondContact O-N 3.1Å; A57-R60 VanDerWaalsContact O-N 3.14Å; A57-Q61 VanDerWaalsContact O-CB 3.31Å; A57-Q61 WeakPolarHBondContact O-CB 3.45Å; A57-Q61 PolarHBondContact O-N 2.91Å
58	A	50.3	Low	50.8	Low	57 Å²	57	111.1 Å²	111.1	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-61.3	-42.5	172.7	0	0	0	0	0	111.3	L54 Q61 F62	L54-A58 WeakPolarHBondContact O-CB 3.35Å; L54-A58 PolarHBondContact O-N 2.88Å; A58-Q61 PolarHBondContact O-N 3.37Å; A58-F62 VanDerWaalsContact O-CB 3.24Å; A58-F62 WeakPolarHBondContact O-CB 3.45Å; A58-F62 PolarHBondContact O-N 3.42Å
59	R	49	Very low	52.3	Low	177 Å²	177	111.4 Å²	111.4	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-65	-37.3	171.7	-76.5	179.5	-175.6	-156.1	3.5	112.6	E55 A57 Q61 Q63	E55-R59 VanDerWaalsContact O-CB 3.26Å; E55-R59 WeakPolarHBondContact O-CB 3.3Å; E55-R59 VanDerWaalsContact O-CG 3.24Å; E55-R59 WeakPolarHBondContact O-CG 3.09Å; E55-R59 PolarHBondContact O-N 3.36Å; A57-R59 PolarHBondContact O-N 3.12Å; R59-Q61 VanDerWaalsContact C-N 3.34Å; R59-Q63 WeakPolarHBondContact O-CB 3.29Å; R59-Q63 WeakPolarHBondContact O-CG 3.28Å; R59-Q63 PolarHBondContact O-N 2.93Å
60	R	44.2	Very low	54	Low	176 Å²	176	110.1 Å²	110.1	66%	0.664	54%	0.537	S	S	*	.	H	α-helix	trans	-69.5	-31.9	173.7	-78.8	172.1	-174.3	179.3	3.6	111.9	R56 A57 Q63 R64	R56-R60 VanDerWaalsContact O-CB 3.24Å; R56-R60 WeakPolarHBondContact O-CB 3.47Å; R56-R60 WeakPolarHBondContact O-CG 3.33Å; R56-R60 PolarHBondContact O-N 3.5Å; A57-R60 CarbonylContact O-C 3.39Å; A57-R60 WeakPolarHBondContact O-CA 3.42Å; A57-R60 WeakPolarHBondContact O-CB 3.38Å; A57-R60 PolarHBondContact O-N 3.1Å; A57-R60 VanDerWaalsContact O-N 3.14Å; R60-Q63 PolarHBondContact O-N 3.41Å; R60-R64 VanDerWaalsContact O-CB 3.28Å; R60-R64 WeakPolarHBondContact O-CB 3.09Å; R60-R64 PolarHBondContact O-N 3.15Å
61	Q	41.3	Very low	55.5	Low	138 Å²	138	104.3 Å²	104.3	65%	0.645	51%	0.51	S	S	*	.	H	α-helix	trans	-75	-41.3	175.7	-144	148.6	-27.4	0	0	110.1	A57 A58 R59 Q63 R64 D65	A57-Q61 VanDerWaalsContact O-CB 3.31Å; A57-Q61 WeakPolarHBondContact O-CB 3.45Å; A57-Q61 PolarHBondContact O-N 2.91Å; A58-Q61 PolarHBondContact O-N 3.37Å; R59-Q61 VanDerWaalsContact C-N 3.34Å; Q61-Q63 PolarHBondContact O-N 3.23Å; Q61-R64 PolarHBondContact O-N 3.01Å; Q61-D65 PolarHBondContact O-N 3.08Å
62	F	45.9	Very low	56.9	Low	164 Å²	164	106.8 Å²	106.8	72%	0.719	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-29.7	169.8	-154.1	-91.8	0	0	0	112.8	A58	A58-F62 VanDerWaalsContact O-CB 3.24Å; A58-F62 WeakPolarHBondContact O-CB 3.45Å; A58-F62 PolarHBondContact O-N 3.42Å
63	Q	42.1	Very low	58.5	Low	167 Å²	167	107.6 Å²	107.6	78%	0.78	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.8	172.2	-81.9	-179.7	-21.5	0	0	114	R59 R60 Q61	R59-Q63 WeakPolarHBondContact O-CB 3.29Å; R59-Q63 WeakPolarHBondContact O-CG 3.28Å; R59-Q63 PolarHBondContact O-N 2.93Å; R60-Q63 PolarHBondContact O-N 3.41Å; Q61-Q63 PolarHBondContact O-N 3.23Å
64	R	38.6	Very low	60	Low	210 Å²	210	101.7 Å²	101.7	79%	0.792	49%	0.49	S	S	*	.			trans	-107.9	6.7	-173.9	-156.1	172.2	-176.4	170.2	0.9	113.3	R60 Q61 E66	R60-R64 VanDerWaalsContact O-CB 3.28Å; R60-R64 WeakPolarHBondContact O-CB 3.09Å; R60-R64 PolarHBondContact O-N 3.15Å; Q61-R64 PolarHBondContact O-N 3.01Å; R64-E66 PolarHBondContact O-N 3.47Å
65	D	52.6	Low	61.1	Low	77 Å²	77	95.7 Å²	95.7	41%	0.412	46%	0.459	S	S	.	.			trans	-73.3	106.4	170.9	-72.7	-20.9	0	0	0	109.4	Q61 T67 Q276	Q61-D65 PolarHBondContact O-N 3.08Å; D65-T67 PolarHBondContact O-N 2.9Å; D65-Q276 VanDerWaalsContact CB-NE2 3.33Å; D65-Q276 PolarHBondContact OD2-NE2 2.89Å
66	E	57.7	Low	62.4	Low	183 Å²	183	93.3 Å²	93.3	86%	0.855	45%	0.452	S	S	*	.			trans	-62.5	109.9	175.9	-67.8	-175	165.2	0	0	109.3	R64	R64-E66 PolarHBondContact O-N 3.47Å
67	T	66.6	Low	63.9	Low	38 Å²	38	90.9 Å²	90.9	23%	0.233	45%	0.446	C	S	.	.			trans	-55.4	125.7	171.6	45.9	0	0	0	0	109.1	D65 A69 Y72 P191 L194	D65-T67 PolarHBondContact O-N 2.9Å; T67-A69 PolarHBondContact O-N 3.45Å; T67-Y72 WeakPolarHBondContact OG1-CE2 3.29Å; T67-Y72 PolarHBondContact OG1-OH 2.82Å; T67-P191 HydrophobicContact CG2-CG 4.05Å; T67-L194 HydrophobicContact CG2-CD1 3.76Å
68	P	76.7	Confident	65.4	Low	35 Å²	35	88.9 Å²	88.9	23%	0.227	43%	0.429	C	S	.	.			trans	-55.2	139	-175	-26.4	33.6	0	0	0	111.6	F70 V71 M272	P68-F70 HydrophobicContact CB-CB 4.24Å; P68-F70 PolarHBondContact O-N 2.72Å; P68-V71 PolarHBondContact O-N 3.21Å; P68-M272 WeakPolarHBondContact CG-O 3.43Å
69	A	77.8	Confident	67	Low	81 Å²	81	86.2 Å²	86.2	67%	0.669	41%	0.407	S	S	*	.	H	α-helix	trans	-52.6	-27.4	175.3	0	0	0	0	0	112.5	T67 V71 Y72 A73	T67-A69 PolarHBondContact O-N 3.45Å; A69-V71 VanDerWaalsContact C-N 3.32Å; A69-V71 PolarHBondContact O-N 3.39Å; A69-Y72 PolarHBondContact O-N 3.14Å; A69-A73 PolarHBondContact O-N 3.4Å
70	F	81.1	Confident	68.9	Low	73 Å²	73	79.2 Å²	79.2	32%	0.32	38%	0.383	S	S	.	.	H	α-helix	trans	-53.4	-41.7	172	-179.3	-100.3	0	0	0	114	P68 A73 A74 L249 P250 M272	P68-F70 HydrophobicContact CB-CB 4.24Å; P68-F70 PolarHBondContact O-N 2.72Å; F70-A73 PolarHBondContact O-N 3.15Å; F70-A74 WeakPolarHBondContact O-CB 3.37Å; F70-A74 PolarHBondContact O-N 2.91Å; F70-L249 HydrophobicContact CE2-CD2 4.2Å; F70-L249 HydrophobicContact CZ-CD2 4.17Å; F70-P250 HydrophobicContact CE1-CG 4.21Å; F70-P250 HydrophobicContact CZ-CG 3.81Å; F70-M272 HydrophobicContact CD1-CG 4.46Å; F70-M272 HydrophobicContact CE1-CG 4.1Å
71	V	79.1	Confident	70.9	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.018	36%	0.356	C	S	.	.	H	α-helix	trans	-68.4	-39.8	-178.9	178.4	0	0	0	0	111	P68 A69 S75 L198 M272	P68-V71 PolarHBondContact O-N 3.21Å; A69-V71 VanDerWaalsContact C-N 3.32Å; A69-V71 PolarHBondContact O-N 3.39Å; V71-S75 WeakPolarHBondContact O-CB 3.26Å; V71-S75 PolarHBondContact O-N 2.99Å; V71-S75 PolarHBondContact O-OG 3.48Å; V71-L198 HydrophobicContact CG1-CD1 4.27Å; V71-M272 WeakPolarHBondContact CG2-O 3.27Å
72	Y	80.1	Confident	73.2	Confident	87 Å²	87	64.9 Å²	64.9	34%	0.341	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-45.8	174.4	-69.9	-70.6	0	0	0	111.2	T67 A69 A74 S75 T76 L194 R197 L198	T67-Y72 WeakPolarHBondContact OG1-CE2 3.29Å; T67-Y72 PolarHBondContact OG1-OH 2.82Å; A69-Y72 PolarHBondContact O-N 3.14Å; Y72-A74 PolarHBondContact O-N 2.88Å; Y72-S75 PolarHBondContact O-N 3.44Å; Y72-T76 WeakPolarHBondContact O-CB 3.41Å; Y72-T76 PolarHBondContact O-N 3.01Å; Y72-T76 PolarHBondContact O-OG1 2.95Å; Y72-T76 VanDerWaalsContact O-OG1 3.05Å; Y72-L194 WeakPolarHBondContact OH-CD1 3.25Å; Y72-R197 PolarHBondContact OH-NH2 3.01Å; Y72-L198 HydrophobicContact CD1-CD2 4.29Å; Y72-L198 HydrophobicContact CE1-CD2 4.32Å
73	A	83.1	Confident	75.5	Confident	44 Å²	44	58.9 Å²	58.9	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-48.8	175.3	0	0	0	0	0	111.5	A69 F70 S75 T76 F77	A69-A73 PolarHBondContact O-N 3.4Å; F70-A73 PolarHBondContact O-N 3.15Å; A73-S75 VanDerWaalsContact C-N 3.32Å; A73-S75 PolarHBondContact O-N 3.34Å; A73-T76 PolarHBondContact O-N 2.89Å; A73-F77 WeakPolarHBondContact O-CD2 3.34Å; A73-F77 PolarHBondContact O-N 3.5Å
74	A	80.4	Confident	77.9	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-43.4	177.4	0	0	0	0	0	111.8	F70 Y72 S78 V189 L249	F70-A74 WeakPolarHBondContact O-CB 3.37Å; F70-A74 PolarHBondContact O-N 2.91Å; Y72-A74 PolarHBondContact O-N 2.88Å; A74-S78 VanDerWaalsContact O-CB 3.28Å; A74-S78 WeakPolarHBondContact O-CB 3.35Å; A74-S78 PolarHBondContact O-N 3.47Å; A74-S78 PolarHBondContact O-OG 3.34Å; A74-V189 HydrophobicContact CB-CG1 4.41Å; A74-L249 HydrophobicContact CB-CD2 3.68Å
75	S	78.7	Confident	80.4	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.028	24%	0.237	C	C	.	.	H	α-helix	trans	-67.5	-40.1	178.4	-66.7	0	0	0	0	112.5	V71 Y72 A73 S78 A79	V71-S75 WeakPolarHBondContact O-CB 3.26Å; V71-S75 PolarHBondContact O-N 2.99Å; V71-S75 PolarHBondContact O-OG 3.48Å; Y72-S75 PolarHBondContact O-N 3.44Å; A73-S75 VanDerWaalsContact C-N 3.32Å; A73-S75 PolarHBondContact O-N 3.34Å; S75-S78 WeakPolarHBondContact O-CB 3.5Å; S75-S78 PolarHBondContact O-N 3.31Å; S75-A79 VanDerWaalsContact O-CB 3.32Å; S75-A79 WeakPolarHBondContact O-CB 3.42Å; S75-A79 PolarHBondContact O-N 2.97Å
76	T	81.9	Confident	82.3	Confident	74 Å²	74	39.7 Å²	39.7	45%	0.454	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-45.4	176.6	-59.8	0	0	0	0	112	Y72 A73 S78 A79 L80 F205	Y72-T76 WeakPolarHBondContact O-CB 3.41Å; Y72-T76 PolarHBondContact O-N 3.01Å; Y72-T76 PolarHBondContact O-OG1 2.95Å; Y72-T76 VanDerWaalsContact O-OG1 3.05Å; A73-T76 PolarHBondContact O-N 2.89Å; T76-S78 VanDerWaalsContact C-N 3.28Å; T76-S78 PolarHBondContact O-N 3.17Å; T76-A79 PolarHBondContact O-N 2.9Å; T76-L80 PolarHBondContact O-N 3.35Å; T76-F205 HydrophobicContact CG2-CZ 4.18Å
77	F	84.4	Confident	84.1	Confident	78 Å²	78	31.2 Å²	31.2	34%	0.342	18%	0.178	S	C	.	.	H	α-helix	trans	-64.2	-35.2	174.4	-80.2	-69.2	0	0	0	112	A73 L80 I241 F246 L249	A73-F77 WeakPolarHBondContact O-CD2 3.34Å; A73-F77 PolarHBondContact O-N 3.5Å; F77-L80 HydrophobicContact CD1-CD1 3.95Å; F77-L80 WeakPolarHBondContact O-CB 3.4Å; F77-L80 PolarHBondContact O-N 3.39Å; F77-I241 HydrophobicContact CD1-CG2 4.46Å; F77-I241 HydrophobicContact CE1-CG2 4.01Å; F77-F246 HydrophobicContact CB-CE2 4.48Å; F77-L249 HydrophobicContact CB-CD1 3.99Å
78	S	81.8	Confident	85.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65	-44.3	173.8	-57	0	0	0	0	111.4	A74 S75 T76 L80 G81 V182 Y185 I186 F246	A74-S78 VanDerWaalsContact O-CB 3.28Å; A74-S78 WeakPolarHBondContact O-CB 3.35Å; A74-S78 PolarHBondContact O-N 3.47Å; A74-S78 PolarHBondContact O-OG 3.34Å; S75-S78 WeakPolarHBondContact O-CB 3.5Å; S75-S78 PolarHBondContact O-N 3.31Å; T76-S78 VanDerWaalsContact C-N 3.28Å; T76-S78 PolarHBondContact O-N 3.17Å; S78-L80 PolarHBondContact O-N 3.01Å; S78-L80 VanDerWaalsContact O-N 3.13Å; S78-G81 PolarHBondContact O-N 3.32Å; S78-V182 WeakPolarHBondContact O-CG1 3.41Å; S78-Y185 VanDerWaalsContact OG-CD1 3.24Å; S78-Y185 WeakPolarHBondContact OG-CD1 3.26Å; S78-Y185 WeakPolarHBondContact OG-CE1 3.31Å; S78-I186 VanDerWaalsContact CB-CG1 3.48Å; S78-F246 WeakPolarHBondContact OG-CZ 3.37Å
79	A	84.1	Confident	86	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-18.2	-179.4	0	0	0	0	0	113.4	S75 T76 G81 G82 F83 I201 F205	S75-A79 VanDerWaalsContact O-CB 3.32Å; S75-A79 WeakPolarHBondContact O-CB 3.42Å; S75-A79 PolarHBondContact O-N 2.97Å; T76-A79 PolarHBondContact O-N 2.9Å; A79-G81 PolarHBondContact O-N 3.32Å; A79-G82 WeakPolarHBondContact O-CA 3.2Å; A79-G82 PolarHBondContact O-N 3.5Å; A79-F83 PolarHBondContact O-N 2.9Å; A79-I201 HydrophobicContact CB-CG2 4.35Å; A79-F205 HydrophobicContact CB-CB 4.15Å; A79-F205 HydrophobicContact CB-CD1 3.67Å; A79-F205 HydrophobicContact CB-CD2 3.88Å; A79-F205 HydrophobicContact CB-CE1 3.99Å; A79-F205 HydrophobicContact CB-CE2 4.17Å; A79-F205 HydrophobicContact CB-CG 3.62Å; A79-F205 HydrophobicContact CB-CZ 4.24Å; A79-F205 VanDerWaalsContact O-CB 3.29Å; A79-F205 WeakPolarHBondContact O-CB 3.49Å; A79-F205 VanDerWaalsContact O-CD1 3.3Å; A79-F205 WeakPolarHBondContact O-CD1 3.25Å
80	L	88.7	Confident	86.6	Confident	29 Å²	29	24.8 Å²	24.8	15%	0.152	13%	0.129	C	C	.	.	H	α-helix	trans	-58.2	-27.6	169.8	-67.9	175.1	0	0	0	112.8	T76 F77 S78 G82 F83 L84 F205 I241 Q242	T76-L80 PolarHBondContact O-N 3.35Å; F77-L80 HydrophobicContact CD1-CD1 3.95Å; F77-L80 WeakPolarHBondContact O-CB 3.4Å; F77-L80 PolarHBondContact O-N 3.39Å; S78-L80 PolarHBondContact O-N 3.01Å; S78-L80 VanDerWaalsContact O-N 3.13Å; L80-G82 VanDerWaalsContact C-N 3.34Å; L80-F83 WeakPolarHBondContact O-CB 3.47Å; L80-F83 PolarHBondContact O-N 3.13Å; L80-L84 WeakPolarHBondContact O-CG 3.3Å; L80-L84 PolarHBondContact O-N 3.06Å; L80-F205 HydrophobicContact CD2-CE1 4.29Å; L80-I241 HydrophobicContact CD1-CB 4.49Å; L80-I241 HydrophobicContact CD1-CG2 3.78Å; L80-Q242 HydrophobicContact CB-CB 4.14Å; L80-Q242 HydrophobicContact CB-CG 4.3Å; L80-Q242 HydrophobicContact CD1-CB 4.27Å
81	G	87.2	Confident	87.2	Confident	10 Å²	10	21.4 Å²	21.4	10%	0.103	11%	0.114	C	C	.	.	H	α-helix	trans	-66.7	-36.8	173.1	0	0	0	0	0	112.6	S78 A79 L84 F85 Q242	S78-G81 PolarHBondContact O-N 3.32Å; A79-G81 PolarHBondContact O-N 3.32Å; G81-L84 PolarHBondContact O-N 2.71Å; G81-F85 PolarHBondContact O-N 3.4Å; G81-Q242 VanDerWaalsContact CA-OE1 3.31Å
82	G	89.1	Confident	87.9	Confident	4 Å²	4	21.5 Å²	21.5	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-63.2	-42.1	168.7	0	0	0	0	0	111.7	A79 L80 L84 F85 G86 N202 I206	A79-G82 WeakPolarHBondContact O-CA 3.2Å; A79-G82 PolarHBondContact O-N 3.5Å; L80-G82 VanDerWaalsContact C-N 3.34Å; G82-L84 PolarHBondContact O-N 3.37Å; G82-F85 PolarHBondContact O-N 3.49Å; G82-G86 PolarHBondContact O-N 2.78Å; G82-N202 WeakPolarHBondContact CA-OD1 3.43Å; G82-N202 PolarHBondContact N-OD1 3.05Å; G82-I206 WeakPolarHBondContact O-CA 3.3Å; G82-I206 VanDerWaalsContact O-CG1 3.31Å; G82-I206 WeakPolarHBondContact O-CG1 3.44Å
83	F	93.4	Very high	88.4	Confident	37 Å²	37	17.4 Å²	17.4	16%	0.162	10%	0.099	C	C	.	.	H	α-helix	trans	-59.4	-42.8	175.3	-177	-84.7	0	0	0	112.8	A79 L80 F85 G86 Y87 F205 G209 F212 P238	A79-F83 PolarHBondContact O-N 2.9Å; L80-F83 WeakPolarHBondContact O-CB 3.47Å; L80-F83 PolarHBondContact O-N 3.13Å; F83-F85 PolarHBondContact O-N 3.36Å; F83-G86 PolarHBondContact O-N 3.24Å; F83-Y87 AromaticContact CE1-CD2 3.87Å; F83-Y87 HydrophobicContact CE1-CD2 3.87Å; F83-Y87 HydrophobicContact CZ-CD2 4.27Å; F83-Y87 VanDerWaalsContact O-CB 3.29Å; F83-Y87 WeakPolarHBondContact O-CB 3.38Å; F83-Y87 PolarHBondContact O-N 2.85Å; F83-F205 VanDerWaalsContact CA-O 3.31Å; F83-F205 WeakPolarHBondContact CA-O 3.45Å; F83-F205 HydrophobicContact CB-CB 4.3Å; F83-F205 HydrophobicContact CB-CD1 4.04Å; F83-G209 VanDerWaalsContact CD2-CA 3.49Å; F83-F212 HydrophobicContact CE2-CB 4.15Å; F83-F212 AromaticContact CE2-CD2 3.85Å; F83-F212 HydrophobicContact CE2-CD2 3.85Å; F83-F212 HydrophobicContact CE2-CG 4.32Å; F83-F212 HydrophobicContact CZ-CB 4.06Å; F83-P238 HydrophobicContact CD1-CB 4.1Å; F83-P238 HydrophobicContact CD1-CG 4.25Å; F83-P238 HydrophobicContact CE1-CB 4.23Å; F83-P238 HydrophobicContact CE1-CG 4.04Å
84	L	93.5	Very high	88.7	Confident	12 Å²	12	15.4 Å²	15.4	6%	0.063	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-42.1	176.5	-72.9	172.2	0	0	0	112.5	L80 G81 G82 G86 Y87 D88 C148 P238 A239	L80-L84 WeakPolarHBondContact O-CG 3.3Å; L80-L84 PolarHBondContact O-N 3.06Å; G81-L84 PolarHBondContact O-N 2.71Å; G82-L84 PolarHBondContact O-N 3.37Å; L84-G86 VanDerWaalsContact C-N 3.34Å; L84-Y87 PolarHBondContact O-N 3.45Å; L84-D88 PolarHBondContact O-N 2.86Å; L84-C148 HydrophobicContact CD1-CB 4.3Å; L84-P238 HydrophobicContact CD2-CB 3.95Å; L84-P238 HydrophobicContact CD2-CG 3.7Å; L84-A239 HydrophobicContact CD1-CB 3.99Å; L84-A239 HydrophobicContact CD2-CB 4Å
85	F	91.2	Very high	89.3	Confident	40 Å²	40	15.4 Å²	15.4	18%	0.175	8%	0.082	C	C	.	.	H	α-helix	trans	-61.8	-44.7	174.9	173.9	-129.4	0	0	0	111.7	G81 G82 F83 T89 I175 I206 W544	G81-F85 PolarHBondContact O-N 3.4Å; G82-F85 PolarHBondContact O-N 3.49Å; F83-F85 PolarHBondContact O-N 3.36Å; F85-T89 PolarHBondContact O-N 2.94Å; F85-T89 VanDerWaalsContact O-N 3.17Å; F85-T89 PolarHBondContact O-OG1 3.28Å; F85-I175 HydrophobicContact CB-CG2 4.13Å; F85-I175 HydrophobicContact CD2-CG2 3.25Å; F85-I175 HydrophobicContact CE2-CG2 3.92Å; F85-I175 HydrophobicContact CG-CG2 3.99Å; F85-I206 HydrophobicContact CD1-CD1 3.96Å; F85-I206 HydrophobicContact CD1-CG1 4.02Å; F85-I206 HydrophobicContact CD1-CG2 3.71Å; F85-I206 HydrophobicContact CE1-CD1 4.46Å; F85-I206 HydrophobicContact CE1-CG2 4.06Å; F85-W544 HydrophobicContact CE2-CH2 4.06Å; F85-W544 HydrophobicContact CZ-CH2 4.04Å
86	G	92.6	Very high	89.8	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.5	-45.5	174.5	0	0	0	0	0	112.9	G82 F83 L84 T89 G90 I206 G209 Q210	G82-G86 PolarHBondContact O-N 2.78Å; F83-G86 PolarHBondContact O-N 3.24Å; L84-G86 VanDerWaalsContact C-N 3.34Å; G86-T89 WeakPolarHBondContact O-CB 3.37Å; G86-T89 PolarHBondContact O-N 3.36Å; G86-G90 PolarHBondContact O-N 2.87Å; G86-I206 WeakPolarHBondContact CA-O 3.44Å; G86-G209 VanDerWaalsContact C-C 3.5Å; G86-Q210 VanDerWaalsContact O-CA 3.3Å; G86-Q210 WeakPolarHBondContact O-CA 3.34Å; G86-Q210 WeakPolarHBondContact O-CG 3.4Å; G86-Q210 PolarHBondContact O-N 2.89Å
87	Y	94.9	Very high	90.1	Very high	5 Å²	5	12 Å²	12	2%	0.02	6%	0.061	C	C	.	.	H	α-helix	trans	-60.9	-49.7	-178.9	-172.5	-74.4	0	0	0	111.2	F83 L84 T89 G90 V91 A213 I216 M231 L234 A235	F83-Y87 AromaticContact CE1-CD2 3.87Å; F83-Y87 HydrophobicContact CE1-CD2 3.87Å; F83-Y87 HydrophobicContact CZ-CD2 4.27Å; F83-Y87 VanDerWaalsContact O-CB 3.29Å; F83-Y87 WeakPolarHBondContact O-CB 3.38Å; F83-Y87 PolarHBondContact O-N 2.85Å; L84-Y87 PolarHBondContact O-N 3.45Å; Y87-T89 VanDerWaalsContact C-N 3.28Å; Y87-T89 PolarHBondContact O-N 3.36Å; Y87-G90 PolarHBondContact O-N 3.31Å; Y87-V91 HydrophobicContact CD1-CB 4.1Å; Y87-V91 HydrophobicContact CD1-CG1 4.08Å; Y87-V91 HydrophobicContact CE1-CB 3.82Å; Y87-V91 HydrophobicContact CE1-CG1 4.03Å; Y87-V91 HydrophobicContact CE1-CG2 3.88Å; Y87-V91 VanDerWaalsContact O-CB 3.31Å; Y87-V91 WeakPolarHBondContact O-CB 3.3Å; Y87-V91 VanDerWaalsContact O-CG1 3.27Å; Y87-V91 WeakPolarHBondContact O-CG1 3.36Å; Y87-V91 PolarHBondContact O-N 3.49Å; Y87-A213 HydrophobicContact CD1-CB 4.27Å; Y87-A213 HydrophobicContact CD2-CB 3.78Å; Y87-A213 HydrophobicContact CE1-CB 4.48Å; Y87-A213 HydrophobicContact CE2-CB 4.08Å; Y87-A213 HydrophobicContact CG-CB 3.9Å; Y87-A213 WeakPolarHBondContact O-CB 3.31Å; Y87-I216 HydrophobicContact CE2-CD1 3.64Å; Y87-M231 PolarHBondContact OH-O 2.87Å; Y87-L234 WeakPolarHBondContact OH-CB 3.22Å; Y87-A235 HydrophobicContact CD1-CB 3.66Å; Y87-A235 HydrophobicContact CE1-CB 3.61Å; Y87-A235 HydrophobicContact CG-CB 4.48Å
88	D	93.3	Very high	90.3	Very high	18 Å²	18	9.5 Å²	9.5	10%	0.096	5%	0.052	C	C	.	.	H	α-helix	trans	-60.1	-40.7	178.3	-175.3	67.3	0	0	0	111.3	L84 V91 V92 R168 V171 I175	L84-D88 PolarHBondContact O-N 2.86Å; D88-V91 WeakPolarHBondContact O-CG1 3.4Å; D88-V92 WeakPolarHBondContact O-CG2 3.39Å; D88-R168 IonicContact OD1-NH1 3.19Å; D88-R168 PolarHBondContact OD1-NH1 3.34Å; D88-V171 HydrophobicContact CB-CG1 4.34Å; D88-I175 HydrophobicContact CB-CD1 3.42Å; D88-I175 VanDerWaalsContact CB-CD1 3.42Å; D88-I175 WeakPolarHBondContact OD2-CD1 3.47Å
89	T	89.2	Confident	90.6	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-62.5	-44.3	175.3	-57.7	0	0	0	0	112.8	F85 G86 Y87 Q210 M336 Y337	F85-T89 PolarHBondContact O-N 2.94Å; F85-T89 VanDerWaalsContact O-N 3.17Å; F85-T89 PolarHBondContact O-OG1 3.28Å; G86-T89 WeakPolarHBondContact O-CB 3.37Å; G86-T89 PolarHBondContact O-N 3.36Å; Y87-T89 VanDerWaalsContact C-N 3.28Å; Y87-T89 PolarHBondContact O-N 3.36Å; T89-Q210 HydrophobicContact CG2-CG 4.27Å; T89-Q210 VanDerWaalsContact CG2-NE2 3.33Å; T89-M336 HydrophobicContact CG2-CB 3.93Å; T89-Y337 HydrophobicContact CG2-CD1 3.95Å; T89-Y337 HydrophobicContact CG2-CE1 3.56Å
90	G	91.3	Very high	90.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-74.3	-42.7	-176.3	0	0	0	0	0	113.6	G86 Y87 V92 S93	G86-G90 PolarHBondContact O-N 2.87Å; Y87-G90 PolarHBondContact O-N 3.31Å; G90-V92 VanDerWaalsContact C-N 3.29Å; G90-V92 PolarHBondContact O-N 2.94Å; G90-S93 VanDerWaalsContact O-CB 3.25Å; G90-S93 WeakPolarHBondContact O-CB 3.48Å; G90-S93 PolarHBondContact O-N 3.44Å
91	V	94.3	Very high	90.2	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.012	6%	0.062	C	C	.	.	H	α-helix	trans	-67.9	-28.9	-173.9	74.7	0	0	0	0	112.5	Y87 D88 S93 A95 A213 D217 M231 L232	Y87-V91 HydrophobicContact CD1-CB 4.1Å; Y87-V91 HydrophobicContact CD1-CG1 4.08Å; Y87-V91 HydrophobicContact CE1-CB 3.82Å; Y87-V91 HydrophobicContact CE1-CG1 4.03Å; Y87-V91 HydrophobicContact CE1-CG2 3.88Å; Y87-V91 VanDerWaalsContact O-CB 3.31Å; Y87-V91 WeakPolarHBondContact O-CB 3.3Å; Y87-V91 VanDerWaalsContact O-CG1 3.27Å; Y87-V91 WeakPolarHBondContact O-CG1 3.36Å; Y87-V91 PolarHBondContact O-N 3.49Å; D88-V91 WeakPolarHBondContact O-CG1 3.4Å; V91-S93 PolarHBondContact O-N 2.97Å; V91-A95 WeakPolarHBondContact O-CB 3.34Å; V91-A95 PolarHBondContact O-N 2.88Å; V91-A213 HydrophobicContact CB-CB 4.03Å; V91-D217 WeakPolarHBondContact CA-OD2 3.24Å; V91-D217 VanDerWaalsContact CG2-OD1 3.27Å; V91-D217 WeakPolarHBondContact CG2-OD1 3.34Å; V91-D217 VanDerWaalsContact O-OD2 3.13Å; V91-M231 VanDerWaalsContact CG2-C 3.47Å; V91-M231 HydrophobicContact CG2-CB 3.83Å; V91-M231 VanDerWaalsContact CG2-O 3.26Å; V91-M231 WeakPolarHBondContact CG2-O 3.23Å; V91-L232 HydrophobicContact CB-CD2 4.44Å; V91-L232 HydrophobicContact CG1-CD2 3.69Å; V91-L232 HydrophobicContact CG2-CD2 3.92Å
92	V	92.4	Very high	90.1	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.024	8%	0.076	C	C	.	.	H	α-helix	trans	-59.9	-39.4	177.4	179.5	0	0	0	0	110.2	D88 G90 M96 V114	D88-V92 WeakPolarHBondContact O-CG2 3.39Å; G90-V92 VanDerWaalsContact C-N 3.29Å; G90-V92 PolarHBondContact O-N 2.94Å; V92-M96 HydrophobicContact CG1-CE 3.9Å; V92-M96 VanDerWaalsContact O-CB 3.23Å; V92-M96 WeakPolarHBondContact O-CB 3.39Å; V92-M96 PolarHBondContact O-N 3.33Å; V92-V114 HydrophobicContact CG1-CG2 3.81Å
93	S	90.4	Very high	89.7	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.014	8%	0.083	C	C	.	.	H	α-helix	trans	-58.1	-53.6	-174.9	-153.4	0	0	0	0	112	G90 V91 M336 Y337 S339 A340	G90-S93 VanDerWaalsContact O-CB 3.25Å; G90-S93 WeakPolarHBondContact O-CB 3.48Å; G90-S93 PolarHBondContact O-N 3.44Å; V91-S93 PolarHBondContact O-N 2.97Å; S93-M336 WeakPolarHBondContact CB-O 3.47Å; S93-M336 PolarHBondContact OG-O 2.96Å; S93-Y337 VanDerWaalsContact CA-O 3.24Å; S93-Y337 WeakPolarHBondContact CA-O 3.32Å; S93-S339 VanDerWaalsContact OG-CB 3.23Å; S93-S339 WeakPolarHBondContact OG-CB 3.31Å; S93-S339 PolarHBondContact OG-N 3.35Å; S93-S339 VanDerWaalsContact OG-N 3.08Å; S93-A340 WeakPolarHBondContact O-CB 3.33Å; S93-A340 PolarHBondContact OG-N 2.7Å
94	G	90.4	Very high	89	Confident	2 Å²	2	22.7 Å²	22.7	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-80.5	-35.9	-179.1	0	0	0	0	0	113.2	M96 P98 D217	G94-M96 VanDerWaalsContact C-N 3.27Å; G94-M96 PolarHBondContact O-N 3.25Å; G94-P98 WeakPolarHBondContact O-CD 3.29Å; G94-D217 WeakPolarHBondContact CA-OD2 3.15Å; G94-D217 PolarHBondContact N-OD2 2.98Å; G94-D217 VanDerWaalsContact N-OD2 3.07Å
95	A	92.4	Very high	88.5	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-68.7	-23	178.6	0	0	0	0	0	113.5	V91 L97 P98 L99 M231 L232	V91-A95 WeakPolarHBondContact O-CB 3.34Å; V91-A95 PolarHBondContact O-N 2.88Å; A95-L97 PolarHBondContact O-N 3.07Å; A95-P98 VanDerWaalsContact O-CD 3.27Å; A95-P98 WeakPolarHBondContact O-CD 3.31Å; A95-P98 VanDerWaalsContact O-CG 3.32Å; A95-P98 WeakPolarHBondContact O-CG 3.09Å; A95-L99 HydrophobicContact CB-CD1 4.25Å; A95-L99 VanDerWaalsContact O-CB 3.24Å; A95-L99 WeakPolarHBondContact O-CB 3.4Å; A95-L99 WeakPolarHBondContact O-CD1 3.41Å; A95-L99 VanDerWaalsContact O-CG 3.23Å; A95-L99 WeakPolarHBondContact O-CG 3.32Å; A95-L99 PolarHBondContact O-N 3.18Å; A95-L99 VanDerWaalsContact O-N 3.07Å; A95-M231 HydrophobicContact CB-CB 4.35Å; A95-M231 HydrophobicContact CB-SD 4.04Å; A95-L232 HydrophobicContact CB-CD2 4.12Å; A95-L232 HydrophobicContact CB-CG 4.38Å
96	M	89.9	Confident	88.2	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-39.1	-177.8	-169.4	61.8	75	0	0	112.7	V92 G94 L99 R100 L105 Q110 V114	V92-M96 HydrophobicContact CG1-CE 3.9Å; V92-M96 VanDerWaalsContact O-CB 3.23Å; V92-M96 WeakPolarHBondContact O-CB 3.39Å; V92-M96 PolarHBondContact O-N 3.33Å; G94-M96 VanDerWaalsContact C-N 3.27Å; G94-M96 PolarHBondContact O-N 3.25Å; M96-L99 PolarHBondContact O-N 3.27Å; M96-R100 WeakPolarHBondContact O-CB 3.33Å; M96-R100 PolarHBondContact O-N 3.1Å; M96-L105 HydrophobicContact SD-CD1 4.43Å; M96-Q110 HydrophobicContact CE-CB 4.26Å; M96-Q110 HydrophobicContact CG-CG 4.42Å; M96-Q110 HydrophobicContact SD-CB 3.95Å; M96-Q110 HydrophobicContact SD-CG 3.69Å; M96-V114 HydrophobicContact CE-CG2 3.62Å
97	L	88.1	Confident	87.8	Confident	5 Å²	5	24 Å²	24	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-59.1	-56.6	179.9	-77.2	81.6	0	0	0	112.3	A95 L99 R100 R101 A340 D351 A354	A95-L97 PolarHBondContact O-N 3.07Å; L97-L99 VanDerWaalsContact C-N 3.35Å; L97-L99 PolarHBondContact O-N 3.42Å; L97-R100 PolarHBondContact O-N 3.37Å; L97-R101 PolarHBondContact O-N 3.31Å; L97-A340 HydrophobicContact CD1-CB 3.44Å; L97-A340 VanDerWaalsContact CD1-CB 3.44Å; L97-D351 HydrophobicContact CD2-CB 4Å; L97-A354 HydrophobicContact CD2-CB 4.33Å
98	P	88.6	Confident	87.5	Confident	25 Å²	25	29.5 Å²	29.5	16%	0.162	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-34	177	24.6	-32.9	0	0	0	112.7	G94 A95 R101 Q102 W228	G94-P98 WeakPolarHBondContact O-CD 3.29Å; A95-P98 VanDerWaalsContact O-CD 3.27Å; A95-P98 WeakPolarHBondContact O-CD 3.31Å; A95-P98 VanDerWaalsContact O-CG 3.32Å; A95-P98 WeakPolarHBondContact O-CG 3.09Å; P98-R101 PolarHBondContact O-N 3.03Å; P98-Q102 WeakPolarHBondContact O-CB 3.38Å; P98-Q102 WeakPolarHBondContact O-CG 3.07Å; P98-Q102 PolarHBondContact O-N 3.25Å; P98-W228 HydrophobicContact CB-CB 4.49Å; P98-W228 HydrophobicContact CG-CB 4.09Å
99	L	88.5	Confident	87.4	Confident	1 Å²	1	31 Å²	31	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-45	175.8	-83.8	170.5	0	0	0	112.1	A95 M96 L97 R101 Q102 M103 L105 L164 W228 L232	A95-L99 HydrophobicContact CB-CD1 4.25Å; A95-L99 VanDerWaalsContact O-CB 3.24Å; A95-L99 WeakPolarHBondContact O-CB 3.4Å; A95-L99 WeakPolarHBondContact O-CD1 3.41Å; A95-L99 VanDerWaalsContact O-CG 3.23Å; A95-L99 WeakPolarHBondContact O-CG 3.32Å; A95-L99 PolarHBondContact O-N 3.18Å; A95-L99 VanDerWaalsContact O-N 3.07Å; M96-L99 PolarHBondContact O-N 3.27Å; L97-L99 VanDerWaalsContact C-N 3.35Å; L97-L99 PolarHBondContact O-N 3.42Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 2.84Å; L99-Q102 PolarHBondContact O-N 2.69Å; L99-M103 HydrophobicContact CD2-CG 4.39Å; L99-M103 WeakPolarHBondContact O-CB 3.47Å; L99-M103 PolarHBondContact O-N 3.41Å; L99-L105 HydrophobicContact CB-CD1 3.96Å; L99-L164 HydrophobicContact CD1-CD2 4.16Å; L99-L164 HydrophobicContact CD2-CD1 4.38Å; L99-L164 HydrophobicContact CD2-CD2 3.78Å; L99-W228 HydrophobicContact CD2-CD2 3.58Å; L99-W228 HydrophobicContact CD2-CE3 3.49Å; L99-W228 VanDerWaalsContact CD2-CE3 3.49Å; L99-W228 HydrophobicContact CD2-CG 4.11Å; L99-W228 HydrophobicContact CD2-CH2 4.24Å; L99-W228 HydrophobicContact CD2-CZ2 4.33Å; L99-W228 HydrophobicContact CD2-CZ3 3.84Å; L99-W228 HydrophobicContact CG-CB 4.32Å; L99-W228 HydrophobicContact CG-CD2 4.18Å; L99-W228 HydrophobicContact CG-CE3 4.21Å; L99-W228 HydrophobicContact CG-CG 4.25Å; L99-L232 HydrophobicContact CD1-CD1 4.27Å
100	R	85.4	Confident	87.5	Confident	18 Å²	18	31.3 Å²	31.3	7%	0.068	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-44.3	177.9	-170.1	-173.9	82.1	-175.9	-1.1	111.1	M96 L97 R104 L105 Y489 S490	M96-R100 WeakPolarHBondContact O-CB 3.33Å; M96-R100 PolarHBondContact O-N 3.1Å; L97-R100 PolarHBondContact O-N 3.37Å; R100-R104 WeakPolarHBondContact O-CA 3.28Å; R100-R104 PolarHBondContact O-N 3.44Å; R100-L105 PolarHBondContact O-N 2.67Å; R100-Y489 VanDerWaalsContact NH2-CD1 3.31Å; R100-S490 PolarHBondContact NH1-OG 3.42Å; R100-S490 PolarHBondContact NH2-OG 3.16Å
101	R	78.9	Confident	87.5	Confident	77 Å²	77	31.5 Å²	31.5	29%	0.291	15%	0.149	S	C	.	.	H	α-helix	trans	-68.3	-48.8	179.9	-70.3	-176.9	172	163.4	1.7	112.6	L97 P98 L99 D351 N467	L97-R101 PolarHBondContact O-N 3.31Å; P98-R101 PolarHBondContact O-N 3.03Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 2.84Å; R101-D351 IonicContact CZ-OD1 3.31Å; R101-D351 IonicContact CZ-OD2 3.86Å; R101-D351 IonicContact NE-OD2 3.76Å; R101-D351 IonicContact NH1-OD1 3.88Å; R101-D351 PolarHBondContact NH1-OD1 3.34Å; R101-D351 IonicContact NH1-OD2 3.7Å; R101-D351 PolarHBondContact NH1-OD2 3.09Å; R101-D351 VanDerWaalsContact NH2-CG 3.3Å; R101-D351 IonicContact NH2-OD1 3.94Å; R101-D351 PolarHBondContact NH2-OD1 2.91Å; R101-D351 IonicContact NH2-OD2 3.97Å; R101-D351 PolarHBondContact NH2-OD2 3.45Å; R101-N467 WeakPolarHBondContact CD-OD1 3.13Å; R101-N467 WeakPolarHBondContact CG-OD1 3.16Å; R101-N467 PolarHBondContact NE-OD1 3.47Å
102	Q	83.4	Confident	87.5	Confident	84 Å²	84	34.1 Å²	34.1	39%	0.393	16%	0.162	S	C	.	.	H	α-helix	trans	-78.3	-35.8	-173.1	-66.8	-176.2	14.3	0	0	113.5	P98 L99 W228	P98-Q102 WeakPolarHBondContact O-CB 3.38Å; P98-Q102 WeakPolarHBondContact O-CG 3.07Å; P98-Q102 PolarHBondContact O-N 3.25Å; L99-Q102 PolarHBondContact O-N 2.69Å; Q102-W228 VanDerWaalsContact OE1-CD1 3.23Å
103	M	81.8	Confident	87.5	Confident	40 Å²	40	34.1 Å²	34.1	20%	0.197	16%	0.162	C	C	.	.	H	α-helix	trans	-103.6	5.7	-175	-65.5	-74.4	-177.2	0	0	113.5	L99 L105 W228	L99-M103 HydrophobicContact CD2-CG 4.39Å; L99-M103 WeakPolarHBondContact O-CB 3.47Å; L99-M103 PolarHBondContact O-N 3.41Å; M103-L105 HydrophobicContact CB-CD2 4.04Å; M103-L105 HydrophobicContact CB-CG 4.04Å; M103-L105 PolarHBondContact O-N 3.15Å; M103-W228 HydrophobicContact CE-CH2 3.89Å; M103-W228 HydrophobicContact CE-CZ2 3.59Å
104	R	78.4	Confident	87.6	Confident	138 Å²	138	34.2 Å²	34.2	52%	0.521	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	52	179.2	-54.4	176.4	-172.3	172.1	-3.6	112.3	R100 S106 E464	R100-R104 WeakPolarHBondContact O-CA 3.28Å; R100-R104 PolarHBondContact O-N 3.44Å; R104-S106 PolarHBondContact O-N 3.24Å; R104-E464 VanDerWaalsContact CZ-CA 3.4Å; R104-E464 PolarHBondContact NE-O 3.46Å; R104-E464 PolarHBondContact NH2-O 3.01Å
105	L	82.8	Confident	87.8	Confident	8 Å²	8	34.3 Å²	34.3	4%	0.042	16%	0.163	C	C	.	.			trans	-79.6	117.9	-176.9	-57.1	173.4	0	0	0	110.1	M96 L99 R100 M103 W109 Q110 L113 K161	M96-L105 HydrophobicContact SD-CD1 4.43Å; L99-L105 HydrophobicContact CB-CD1 3.96Å; R100-L105 PolarHBondContact O-N 2.67Å; M103-L105 HydrophobicContact CB-CD2 4.04Å; M103-L105 HydrophobicContact CB-CG 4.04Å; M103-L105 PolarHBondContact O-N 3.15Å; L105-W109 HydrophobicContact CB-CB 4.14Å; L105-W109 HydrophobicContact CD2-CB 4.05Å; L105-Q110 HydrophobicContact CB-CG 3.93Å; L105-Q110 PolarHBondContact O-NE2 3.18Å; L105-L113 HydrophobicContact CD1-CD1 3.62Å; L105-L113 HydrophobicContact CD2-CD1 4.17Å; L105-K161 HydrophobicContact CD2-CB 3.91Å
106	S	84.8	Confident	87.8	Confident	56 Å²	56	34.8 Å²	34.8	39%	0.392	17%	0.168	S	C	.	.			trans	-66.5	165.6	167	70.6	0	0	0	0	110.9	R104 M108 W109 Q110	R104-S106 PolarHBondContact O-N 3.24Å; S106-M108 PolarHBondContact O-N 3.28Å; S106-W109 PolarHBondContact O-N 2.92Å; S106-W109 VanDerWaalsContact OG-CD1 3.28Å; S106-W109 PolarHBondContact OG-N 2.83Å; S106-Q110 PolarHBondContact O-N 3.48Å
107	S	84.3	Confident	87.9	Confident	17 Å²	17	34.9 Å²	34.9	12%	0.119	17%	0.169	C	C	.	.	H	α-helix	trans	-54.4	-42.3	176.8	-54.9	0	0	0	0	112.1	W109 Q110 E111 E559	S107-W109 VanDerWaalsContact C-N 3.33Å; S107-W109 PolarHBondContact O-N 3.44Å; S107-Q110 PolarHBondContact O-N 3.26Å; S107-E111 WeakPolarHBondContact O-CG 3.45Å; S107-E111 PolarHBondContact O-N 3.49Å; S107-E559 WeakPolarHBondContact CB-OE1 3.44Å; S107-E559 PolarHBondContact OG-OE1 2.8Å
108	M	88.4	Confident	88.1	Confident	120 Å²	120	35 Å²	35	59%	0.591	17%	0.17	S	C	*	.	H	α-helix	trans	-57.1	-41.8	172.5	-175.1	-174	-179.7	0	0	113	S106 L112	S106-M108 PolarHBondContact O-N 3.28Å; M108-L112 VanDerWaalsContact O-CB 3.22Å; M108-L112 WeakPolarHBondContact O-CB 3.43Å; M108-L112 PolarHBondContact O-N 3.49Å
109	W	90.9	Very high	88.3	Confident	49 Å²	49	34.8 Å²	34.8	19%	0.186	17%	0.172	C	C	.	.	H	α-helix	trans	-70.7	-37.7	178.5	-81.4	106.1	0	0	0	112.4	L105 S106 S107 L112 L113 K161 E162 L165	L105-W109 HydrophobicContact CB-CB 4.14Å; L105-W109 HydrophobicContact CD2-CB 4.05Å; S106-W109 PolarHBondContact O-N 2.92Å; S106-W109 VanDerWaalsContact OG-CD1 3.28Å; S106-W109 PolarHBondContact OG-N 2.83Å; S107-W109 VanDerWaalsContact C-N 3.33Å; S107-W109 PolarHBondContact O-N 3.44Å; W109-L112 HydrophobicContact CE3-CD2 4.07Å; W109-L112 HydrophobicContact CH2-CD2 4.47Å; W109-L112 HydrophobicContact CZ3-CD2 3.87Å; W109-L112 PolarHBondContact O-N 3.21Å; W109-L113 WeakPolarHBondContact O-CB 3.31Å; W109-L113 VanDerWaalsContact O-CG 3.23Å; W109-L113 WeakPolarHBondContact O-CG 3.38Å; W109-L113 PolarHBondContact O-N 3.11Å; W109-K161 HydrophobicContact CD2-CD 3.99Å; W109-K161 HydrophobicContact CE3-CD 4.36Å; W109-K161 HydrophobicContact CG-CD 4.45Å; W109-K161 HydrophobicContact CH2-CD 4.43Å; W109-K161 HydrophobicContact CZ2-CD 4.07Å; W109-E162 WeakPolarHBondContact CH2-OE1 3.31Å; W109-E162 WeakPolarHBondContact CH2-OE2 3Å; W109-E162 WeakPolarHBondContact CZ2-OE1 3.35Å; W109-L165 HydrophobicContact CZ3-CD2 4.2Å
110	Q	91.3	Very high	88.6	Confident	7 Å²	7	35.2 Å²	35.2	3%	0.033	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-48.2	175.4	-65.6	174.8	59.4	0	0	110.5	M96 L105 S106 S107 L112 L113 V114 L555	M96-Q110 HydrophobicContact CE-CB 4.26Å; M96-Q110 HydrophobicContact CG-CG 4.42Å; M96-Q110 HydrophobicContact SD-CB 3.95Å; M96-Q110 HydrophobicContact SD-CG 3.69Å; L105-Q110 HydrophobicContact CB-CG 3.93Å; L105-Q110 PolarHBondContact O-NE2 3.18Å; S106-Q110 PolarHBondContact O-N 3.48Å; S107-Q110 PolarHBondContact O-N 3.26Å; Q110-L112 PolarHBondContact O-N 3.32Å; Q110-L113 PolarHBondContact O-N 2.91Å; Q110-V114 VanDerWaalsContact O-CG2 3.32Å; Q110-V114 WeakPolarHBondContact O-CG2 3.41Å; Q110-V114 PolarHBondContact O-N 3.3Å; Q110-V114 VanDerWaalsContact O-N 3.1Å; Q110-L555 HydrophobicContact CB-CD1 3.7Å; Q110-L555 HydrophobicContact CG-CD1 4.44Å
111	E	92.6	Very high	88.9	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.019	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-42.1	175.9	-74	173.3	160.6	0	0	112.4	S107 L113 V114 S115 Y338 F554 L555 H556	S107-E111 WeakPolarHBondContact O-CG 3.45Å; S107-E111 PolarHBondContact O-N 3.49Å; E111-L113 VanDerWaalsContact C-N 3.34Å; E111-L113 PolarHBondContact O-N 3.47Å; E111-V114 PolarHBondContact O-N 2.93Å; E111-S115 WeakPolarHBondContact O-CB 3.49Å; E111-S115 PolarHBondContact O-N 2.7Å; E111-S115 PolarHBondContact O-OG 2.99Å; E111-Y338 WeakPolarHBondContact CA-OH 3.29Å; E111-F554 PolarHBondContact OE1-N 3.26Å; E111-L555 HydrophobicContact CG-CB 4.1Å; E111-L555 HydrophobicContact CG-CD1 4.13Å; E111-L555 HydrophobicContact CG-CG 4.14Å; E111-L555 WeakPolarHBondContact OE1-CA 3.28Å; E111-L555 WeakPolarHBondContact OE1-CB 3.36Å; E111-L555 PolarHBondContact OE1-N 3.16Å; E111-H556 VanDerWaalsContact CD-ND1 3.3Å; E111-H556 PolarHBondContact OE1-N 2.91Å; E111-H556 IonicContact OE1-ND1 3.99Å; E111-H556 PolarHBondContact OE1-ND1 2.86Å; E111-H556 IonicContact OE2-CE1 3.36Å; E111-H556 PolarHBondContact OE2-CE1 2.88Å; E111-H556 IonicContact OE2-CG 2.81Å; E111-H556 IonicContact OE2-ND1 3.82Å; E111-H556 PolarHBondContact OE2-ND1 3.35Å
112	L	94.1	Very high	89.4	Confident	57 Å²	57	31.4 Å²	31.4	30%	0.298	17%	0.165	S	C	.	.	H	α-helix	trans	-65	-36.8	177.7	-174.1	61.4	0	0	0	112.3	M108 W109 Q110 G116 L165	M108-L112 VanDerWaalsContact O-CB 3.22Å; M108-L112 WeakPolarHBondContact O-CB 3.43Å; M108-L112 PolarHBondContact O-N 3.49Å; W109-L112 HydrophobicContact CE3-CD2 4.07Å; W109-L112 HydrophobicContact CH2-CD2 4.47Å; W109-L112 HydrophobicContact CZ3-CD2 3.87Å; W109-L112 PolarHBondContact O-N 3.21Å; Q110-L112 PolarHBondContact O-N 3.32Å; L112-G116 VanDerWaalsContact O-CA 3.31Å; L112-G116 WeakPolarHBondContact O-CA 3.46Å; L112-G116 PolarHBondContact O-N 3.35Å; L112-L165 HydrophobicContact CD2-CD2 3.79Å; L112-L165 HydrophobicContact CG-CD1 4.1Å; L112-L165 HydrophobicContact CG-CD2 4.06Å
113	L	93.1	Very high	89.8	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-44	176.5	-75.7	166.9	0	0	0	112.2	L105 W109 Q110 E111 L164 L165 R168	L105-L113 HydrophobicContact CD1-CD1 3.62Å; L105-L113 HydrophobicContact CD2-CD1 4.17Å; W109-L113 WeakPolarHBondContact O-CB 3.31Å; W109-L113 VanDerWaalsContact O-CG 3.23Å; W109-L113 WeakPolarHBondContact O-CG 3.38Å; W109-L113 PolarHBondContact O-N 3.11Å; Q110-L113 PolarHBondContact O-N 2.91Å; E111-L113 VanDerWaalsContact C-N 3.34Å; E111-L113 PolarHBondContact O-N 3.47Å; L113-L164 HydrophobicContact CD1-CD2 3.68Å; L113-L164 HydrophobicContact CD2-CB 4.18Å; L113-L164 HydrophobicContact CD2-CD2 3.83Å; L113-L164 HydrophobicContact CD2-CG 3.85Å; L113-L164 HydrophobicContact CG-CD2 4.43Å; L113-L165 HydrophobicContact CD2-CB 4.03Å; L113-L165 HydrophobicContact CD2-CD1 4.34Å; L113-R168 HydrophobicContact CD2-CG 4.12Å
114	V	92.3	Very high	90.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.024	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-56.1	178.9	176.1	0	0	0	0	109.9	V92 M96 Q110 E111 G116 A117 V118 Y337 Y338	V92-V114 HydrophobicContact CG1-CG2 3.81Å; M96-V114 HydrophobicContact CE-CG2 3.62Å; Q110-V114 VanDerWaalsContact O-CG2 3.32Å; Q110-V114 WeakPolarHBondContact O-CG2 3.41Å; Q110-V114 PolarHBondContact O-N 3.3Å; Q110-V114 VanDerWaalsContact O-N 3.1Å; E111-V114 PolarHBondContact O-N 2.93Å; V114-G116 VanDerWaalsContact C-N 3.34Å; V114-G116 PolarHBondContact O-N 3.46Å; V114-A117 PolarHBondContact O-N 2.94Å; V114-V118 WeakPolarHBondContact O-CG2 3.43Å; V114-V118 PolarHBondContact O-N 2.9Å; V114-Y337 HydrophobicContact CG1-CD1 4.13Å; V114-Y337 HydrophobicContact CG1-CD2 3.32Å; V114-Y337 HydrophobicContact CG1-CE2 3.89Å; V114-Y337 HydrophobicContact CG1-CG 3.48Å; V114-Y337 VanDerWaalsContact CG1-CG 3.48Å; V114-Y338 HydrophobicContact CG1-CE2 4.45Å; V114-Y338 HydrophobicContact CG2-CE1 3.97Å; V114-Y338 HydrophobicContact CG2-CE2 4.5Å
115	S	93	Very high	90.6	Very high	5 Å²	5	24.5 Å²	24.5	4%	0.035	15%	0.148	C	C	.	.	H	α-helix	trans	-70.8	-27.5	-176	63.7	0	0	0	0	113.9	E111 V118 G119 L552	E111-S115 WeakPolarHBondContact O-CB 3.49Å; E111-S115 PolarHBondContact O-N 2.7Å; E111-S115 PolarHBondContact O-OG 2.99Å; S115-V118 PolarHBondContact O-N 3.32Å; S115-G119 PolarHBondContact O-N 3.5Å; S115-L552 WeakPolarHBondContact OG-CD2 3.31Å; S115-L552 VanDerWaalsContact OG-CG 3.32Å; S115-L552 WeakPolarHBondContact OG-CG 3.41Å
116	G	93.8	Very high	90.6	Very high	10 Å²	10	30 Å²	30	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-46.5	176.7	0	0	0	0	0	111.3	L112 V114 V118 G119 A120 L169	L112-G116 VanDerWaalsContact O-CA 3.31Å; L112-G116 WeakPolarHBondContact O-CA 3.46Å; L112-G116 PolarHBondContact O-N 3.35Å; V114-G116 VanDerWaalsContact C-N 3.34Å; V114-G116 PolarHBondContact O-N 3.46Å; G116-V118 PolarHBondContact O-N 3.26Å; G116-G119 PolarHBondContact O-N 3.42Å; G116-A120 WeakPolarHBondContact O-CB 3.45Å; G116-A120 PolarHBondContact O-N 2.86Å; G116-L169 WeakPolarHBondContact O-CD2 3.3Å
117	A	92.4	Very high	90.7	Very high	4 Å²	4	30 Å²	30	3%	0.033	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-46.4	175.3	0	0	0	0	0	111.7	V114 A120 A121 R168 G172	V114-A117 PolarHBondContact O-N 2.94Å; A117-A120 PolarHBondContact O-N 3.46Å; A117-A121 WeakPolarHBondContact O-CB 3.43Å; A117-A121 PolarHBondContact O-N 3.13Å; A117-R168 HydrophobicContact CB-CB 4.25Å; A117-G172 VanDerWaalsContact O-CA 3.26Å; A117-G172 WeakPolarHBondContact O-CA 3.28Å
118	V	91.6	Very high	90.4	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-42	178.8	-179.6	0	0	0	0	111.9	V114 S115 G116 A121 A122 Y337 W544 N547 V548	V114-V118 WeakPolarHBondContact O-CG2 3.43Å; V114-V118 PolarHBondContact O-N 2.9Å; S115-V118 PolarHBondContact O-N 3.32Å; G116-V118 PolarHBondContact O-N 3.26Å; V118-A121 CarbonylContact O-C 3.52Å; V118-A121 WeakPolarHBondContact O-CB 3.46Å; V118-A121 PolarHBondContact O-N 2.85Å; V118-A122 WeakPolarHBondContact O-CB 3.45Å; V118-A122 PolarHBondContact O-N 3.31Å; V118-Y337 HydrophobicContact CG2-CE2 3.95Å; V118-Y337 WeakPolarHBondContact CG2-OH 3.48Å; V118-W544 HydrophobicContact CG1-CE3 3.85Å; V118-W544 HydrophobicContact CG1-CZ3 4Å; V118-N547 HydrophobicContact CG1-CB 3.99Å; V118-N547 VanDerWaalsContact CG1-CG 3.41Å; V118-N547 WeakPolarHBondContact CG1-ND2 3.43Å; V118-V548 HydrophobicContact CB-CG2 4.23Å; V118-V548 HydrophobicContact CG1-CG2 3.74Å
119	G	92.7	Very high	89.9	Confident	20 Å²	20	25.3 Å²	25.3	21%	0.206	17%	0.165	C	C	.	.	H	α-helix	trans	-67	-41.7	178.8	0	0	0	0	0	111.8	S115 G116 A121 A122 V123	S115-G119 PolarHBondContact O-N 3.5Å; G116-G119 PolarHBondContact O-N 3.42Å; G119-A121 VanDerWaalsContact C-N 3.33Å; G119-A122 WeakPolarHBondContact O-CB 3.38Å; G119-A122 PolarHBondContact O-N 3.26Å; G119-V123 WeakPolarHBondContact O-CG2 3.45Å; G119-V123 PolarHBondContact O-N 2.79Å; G119-V123 VanDerWaalsContact O-N 3.07Å
120	A	94.6	Very high	89.4	Confident	10 Å²	10	26.7 Å²	26.7	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-42.8	170.8	0	0	0	0	0	111.4	G116 A117 A122 V123 A124 L169 L173	G116-A120 WeakPolarHBondContact O-CB 3.45Å; G116-A120 PolarHBondContact O-N 2.86Å; A117-A120 PolarHBondContact O-N 3.46Å; A120-A122 VanDerWaalsContact C-N 3.34Å; A120-A122 PolarHBondContact O-N 3.41Å; A120-V123 PolarHBondContact O-N 2.93Å; A120-A124 VanDerWaalsContact O-CB 3.28Å; A120-A124 WeakPolarHBondContact O-CB 3.47Å; A120-A124 PolarHBondContact O-N 3.07Å; A120-L169 HydrophobicContact CB-CD2 4.06Å; A120-L169 WeakPolarHBondContact CB-O 3.39Å; A120-L173 HydrophobicContact CB-CD2 4.21Å; A120-L173 HydrophobicContact CB-CG 4.17Å
121	A	91.7	Very high	89.1	Confident	2 Å²	2	28.8 Å²	28.8	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-39.8	175.3	0	0	0	0	0	112.4	A117 V118 G119 A124 A125 G172 I175 G176 W544	A117-A121 WeakPolarHBondContact O-CB 3.43Å; A117-A121 PolarHBondContact O-N 3.13Å; V118-A121 CarbonylContact O-C 3.52Å; V118-A121 WeakPolarHBondContact O-CB 3.46Å; V118-A121 PolarHBondContact O-N 2.85Å; G119-A121 VanDerWaalsContact C-N 3.33Å; A121-A124 PolarHBondContact O-N 2.66Å; A121-A125 VanDerWaalsContact O-CB 3.22Å; A121-A125 WeakPolarHBondContact O-CB 3.46Å; A121-A125 PolarHBondContact O-N 2.94Å; A121-G172 WeakPolarHBondContact CA-O 3.41Å; A121-G172 VanDerWaalsContact CB-O 3.3Å; A121-G172 WeakPolarHBondContact CB-O 3.46Å; A121-G172 PolarHBondContact N-O 3.41Å; A121-I175 HydrophobicContact CB-CG2 4.18Å; A121-G176 VanDerWaalsContact O-CA 3.26Å; A121-G176 WeakPolarHBondContact O-CA 3.27Å; A121-W544 HydrophobicContact CB-CH2 4.33Å; A121-W544 HydrophobicContact CB-CZ3 4.21Å
122	A	89.9	Confident	88.8	Confident	13 Å²	13	29 Å²	29	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-50	176.3	0	0	0	0	0	111.9	V118 G119 A120 A124 A125 L126 W544	V118-A122 WeakPolarHBondContact O-CB 3.45Å; V118-A122 PolarHBondContact O-N 3.31Å; G119-A122 WeakPolarHBondContact O-CB 3.38Å; G119-A122 PolarHBondContact O-N 3.26Å; A120-A122 VanDerWaalsContact C-N 3.34Å; A120-A122 PolarHBondContact O-N 3.41Å; A122-A124 PolarHBondContact O-N 3.42Å; A122-A125 PolarHBondContact O-N 3.29Å; A122-L126 WeakPolarHBondContact O-CG 3.32Å; A122-L126 PolarHBondContact O-N 2.95Å; A122-L126 VanDerWaalsContact O-N 3.09Å; A122-W544 HydrophobicContact CB-CB 3.59Å; A122-W544 HydrophobicContact CB-CD2 4.35Å; A122-W544 HydrophobicContact CB-CG 3.98Å
123	V	91.6	Very high	88.2	Confident	95 Å²	95	27.5 Å²	27.5	58%	0.576	20%	0.199	S	C	*	.	H	α-helix	trans	-62.1	-45	178.3	173.8	0	0	0	0	110.6	G119 A120 L126 A127	G119-V123 WeakPolarHBondContact O-CG2 3.45Å; G119-V123 PolarHBondContact O-N 2.79Å; G119-V123 VanDerWaalsContact O-N 3.07Å; A120-V123 PolarHBondContact O-N 2.93Å; V123-L126 PolarHBondContact O-N 3.36Å; V123-A127 PolarHBondContact O-N 3.11Å
124	A	91.1	Very high	87.8	Confident	6 Å²	6	30.3 Å²	30.3	5%	0.05	22%	0.222	C	C	.	.	H	α-helix	trans	-66.1	-36.5	178.2	0	0	0	0	0	113.2	A120 A121 A122 A127 G128 L173 I177	A120-A124 VanDerWaalsContact O-CB 3.28Å; A120-A124 WeakPolarHBondContact O-CB 3.47Å; A120-A124 PolarHBondContact O-N 3.07Å; A121-A124 PolarHBondContact O-N 2.66Å; A122-A124 PolarHBondContact O-N 3.42Å; A124-A127 PolarHBondContact O-N 3Å; A124-G128 WeakPolarHBondContact O-CA 3.46Å; A124-G128 PolarHBondContact O-N 3.49Å; A124-L173 HydrophobicContact CB-CB 4.46Å; A124-L173 HydrophobicContact CB-CD2 3.92Å; A124-L173 WeakPolarHBondContact CB-O 3.25Å; A124-I177 HydrophobicContact CB-CG1 4.11Å
125	A	85.4	Confident	87.6	Confident	16 Å²	16	33.3 Å²	33.3	13%	0.132	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-41	176.2	0	0	0	0	0	111.6	A121 A122 G128	A121-A125 VanDerWaalsContact O-CB 3.22Å; A121-A125 WeakPolarHBondContact O-CB 3.46Å; A121-A125 PolarHBondContact O-N 2.94Å; A122-A125 PolarHBondContact O-N 3.29Å; A125-G128 PolarHBondContact O-N 3.46Å
126	L	83.4	Confident	87.4	Confident	123 Å²	123	33 Å²	33	64%	0.644	24%	0.239	S	C	*	.	H	α-helix	trans	-64.6	-43	175	-69.3	172.9	0	0	0	111.9	A122 V123 G128	A122-L126 WeakPolarHBondContact O-CG 3.32Å; A122-L126 PolarHBondContact O-N 2.95Å; A122-L126 VanDerWaalsContact O-N 3.09Å; V123-L126 PolarHBondContact O-N 3.36Å; L126-G128 VanDerWaalsContact C-N 3.31Å
127	A	85.8	Confident	87.2	Confident	57 Å²	57	33.7 Å²	33.7	47%	0.471	24%	0.238	S	C	.	.	H	α-helix	trans	-72.4	-24.8	175.3	0	0	0	0	0	113.1	V123 A124 G129 A130 L131	V123-A127 PolarHBondContact O-N 3.11Å; A124-A127 PolarHBondContact O-N 3Å; A127-G129 VanDerWaalsContact C-N 3.27Å; A127-G129 PolarHBondContact O-N 2.5Å; A127-A130 PolarHBondContact O-N 2.94Å; A127-L131 PolarHBondContact O-N 3.42Å
128	G	78.8	Confident	87.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-31.7	-174.5	0	0	0	0	0	113.6	A124 A125 L126 L131 N132	A124-G128 WeakPolarHBondContact O-CA 3.46Å; A124-G128 PolarHBondContact O-N 3.49Å; A125-G128 PolarHBondContact O-N 3.46Å; L126-G128 VanDerWaalsContact C-N 3.31Å; G128-L131 PolarHBondContact O-N 2.76Å; G128-N132 VanDerWaalsContact O-CB 3.29Å; G128-N132 WeakPolarHBondContact O-CB 3.45Å; G128-N132 PolarHBondContact O-N 2.79Å; G128-N132 PolarHBondContact O-ND2 3.02Å
129	G	77.1	Confident	87.2	Confident	38 Å²	38	39.9 Å²	39.9	39%	0.392	27%	0.269	S	S	.	.	H	α-helix	trans	-61.4	-48.8	174.6	0	0	0	0	0	112.9	A127 N132 G133	A127-G129 VanDerWaalsContact C-N 3.27Å; A127-G129 PolarHBondContact O-N 2.5Å; G129-N132 PolarHBondContact O-N 3.34Å; G129-G133 PolarHBondContact O-N 3.4Å
130	A	81.2	Confident	87.2	Confident	79 Å²	79	39 Å²	39	65%	0.653	26%	0.259	S	S	*	.	H	α-helix	trans	-65.8	-41	176.8	0	0	0	0	0	111.4	A127 N132 G133 A134	A127-A130 PolarHBondContact O-N 2.94Å; A130-N132 PolarHBondContact O-N 3.45Å; A130-G133 PolarHBondContact O-N 3.39Å; A130-A134 PolarHBondContact O-N 3.07Å
131	L	86.1	Confident	87.1	Confident	50 Å²	50	38.5 Å²	38.5	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-59.9	-46.9	176.8	-170.9	69.5	0	0	0	111.5	A127 G128 G133 A134 V135 L143 I177	A127-L131 PolarHBondContact O-N 3.42Å; G128-L131 PolarHBondContact O-N 2.76Å; L131-G133 VanDerWaalsContact C-N 3.26Å; L131-G133 PolarHBondContact O-N 3.29Å; L131-A134 PolarHBondContact O-N 3.09Å; L131-A134 VanDerWaalsContact O-N 3.08Å; L131-V135 HydrophobicContact CD1-CG2 3.57Å; L131-V135 HydrophobicContact CG-CG2 3.71Å; L131-V135 WeakPolarHBondContact O-CG2 3.29Å; L131-V135 PolarHBondContact O-N 2.88Å; L131-L143 HydrophobicContact CD2-CD2 4.13Å; L131-I177 HydrophobicContact CD2-CD1 4Å; L131-I177 HydrophobicContact CD2-CG1 4.27Å; L131-I177 HydrophobicContact CD2-CG2 4.04Å
132	N	84.6	Confident	87.2	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.043	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-31.9	179.2	-73.7	-15.4	0	0	0	113.3	G128 G129 A130 G136 R137 S140 T181	G128-N132 VanDerWaalsContact O-CB 3.29Å; G128-N132 WeakPolarHBondContact O-CB 3.45Å; G128-N132 PolarHBondContact O-N 2.79Å; G128-N132 PolarHBondContact O-ND2 3.02Å; G129-N132 PolarHBondContact O-N 3.34Å; A130-N132 PolarHBondContact O-N 3.45Å; N132-G136 WeakPolarHBondContact O-CA 3.48Å; N132-G136 PolarHBondContact O-N 3.26Å; N132-R137 PolarHBondContact O-NH1 3.05Å; N132-S140 WeakPolarHBondContact OD1-CB 3.35Å; N132-S140 PolarHBondContact OD1-OG 2.92Å; N132-T181 PolarHBondContact ND2-OG1 2.94Å; N132-T181 WeakPolarHBondContact OD1-CG2 3.5Å; N132-T181 PolarHBondContact OD1-OG1 3.28Å
133	G	81.6	Confident	87.4	Confident	27 Å²	27	42.8 Å²	42.8	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-72.1	-41	172.2	0	0	0	0	0	112.9	G129 A130 L131 W255 K259	G129-G133 PolarHBondContact O-N 3.4Å; A130-G133 PolarHBondContact O-N 3.39Å; L131-G133 VanDerWaalsContact C-N 3.26Å; L131-G133 PolarHBondContact O-N 3.29Å; G133-W255 PolarHBondContact O-NE1 3.41Å; G133-K259 WeakPolarHBondContact O-CE 3.2Å; G133-K259 PolarHBondContact O-NZ 2.99Å
134	A	84.7	Confident	87.6	Confident	63 Å²	63	38.4 Å²	38.4	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-73.5	-55.8	-175.7	0	0	0	0	0	113.2	A130 L131	A130-A134 PolarHBondContact O-N 3.07Å; L131-A134 PolarHBondContact O-N 3.09Å; L131-A134 VanDerWaalsContact O-N 3.08Å
135	V	88.2	Confident	87.7	Confident	66 Å²	66	38.2 Å²	38.2	40%	0.4	25%	0.247	S	C	.	.	H	α-helix	trans	-104	-9.7	-170.8	-78.5	0	0	0	0	114.7	L131 C139	L131-V135 HydrophobicContact CD1-CG2 3.57Å; L131-V135 HydrophobicContact CG-CG2 3.71Å; L131-V135 WeakPolarHBondContact O-CG2 3.29Å; L131-V135 PolarHBondContact O-N 2.88Å; V135-C139 HydrophobicContact CB-CB 4.07Å; V135-C139 HydrophobicContact CG2-CB 4.47Å; V135-C139 WeakPolarHBondContact O-CB 3.38Å; V135-C139 PolarHBondContact O-SG 2.95Å
136	G	88.3	Confident	88.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	26%	0.255	C	S	.	.			trans	90.7	169.2	-177.4	0	0	0	0	0	113.2	N132 S140 E251 W255	N132-G136 WeakPolarHBondContact O-CA 3.48Å; N132-G136 PolarHBondContact O-N 3.26Å; G136-S140 PolarHBondContact O-N 3.43Å; G136-S140 PolarHBondContact O-OG 3.33Å; G136-S140 VanDerWaalsContact O-OG 3.06Å; G136-E251 WeakPolarHBondContact CA-OE2 3.44Å; G136-W255 VanDerWaalsContact CA-CE2 3.46Å
137	R	90.1	Very high	88.9	Confident	24 Å²	24	35.4 Å²	35.4	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-78.3	-39.8	-172.6	-72.4	62.2	166.3	149	-0.6	111	N132 S140 I141 T181 Y185 E188 E251	N132-R137 PolarHBondContact O-NH1 3.05Å; R137-S140 PolarHBondContact O-N 3.18Å; R137-I141 WeakPolarHBondContact O-CG1 3.48Å; R137-I141 PolarHBondContact O-N 2.97Å; R137-T181 HydrophobicContact CB-CG2 3.93Å; R137-T181 HydrophobicContact CG-CG2 4.12Å; R137-Y185 HydrophobicContact CB-CD2 3.74Å; R137-Y185 HydrophobicContact CB-CG 4.44Å; R137-E188 IonicContact CZ-OE1 3.46Å; R137-E188 IonicContact CZ-OE2 3.73Å; R137-E188 IonicContact NE-OE1 3.31Å; R137-E188 PolarHBondContact NE-OE1 3.38Å; R137-E188 IonicContact NE-OE2 2.89Å; R137-E188 PolarHBondContact NE-OE2 3.36Å; R137-E188 IonicContact NH2-OE1 2.78Å; R137-E188 PolarHBondContact NH2-OE1 3.44Å; R137-E188 IonicContact NH2-OE2 3.79Å; R137-E251 WeakPolarHBondContact CA-OE1 3.31Å; R137-E251 WeakPolarHBondContact CB-OE1 3.45Å; R137-E251 VanDerWaalsContact N-CD 3.33Å; R137-E251 PolarHBondContact N-OE1 3.46Å; R137-E251 PolarHBondContact N-OE2 3.43Å
138	R	91.9	Very high	89.3	Confident	79 Å²	79	33 Å²	33	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-61.5	-47.9	178.5	-179.4	-171.8	174.3	-161.1	0.5	111.1	I141 L142 F246 L247 L249 E251	R138-I141 PolarHBondContact O-N 3Å; R138-L142 HydrophobicContact CG-CD1 4.18Å; R138-L142 WeakPolarHBondContact O-CG 3.37Å; R138-L142 PolarHBondContact O-N 2.85Å; R138-F246 HydrophobicContact CG-CD1 4.39Å; R138-F246 PolarHBondContact NE-O 3.35Å; R138-L247 PolarHBondContact NH2-O 3.18Å; R138-L249 VanDerWaalsContact CD-O 3.23Å; R138-L249 WeakPolarHBondContact CD-O 3.38Å; R138-L249 PolarHBondContact NE-O 2.96Å; R138-E251 HydrophobicContact CB-CB 4.43Å; R138-E251 VanDerWaalsContact CB-OE2 3.22Å; R138-E251 WeakPolarHBondContact CB-OE2 3.35Å; R138-E251 PolarHBondContact N-OE1 3.34Å; R138-E251 PolarHBondContact N-OE2 3.25Å
139	C	92.3	Very high	90.2	Very high	62 Å²	62	33.7 Å²	33.7	42%	0.419	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-42.4	178.7	-68.1	0	0	0	0	111.9	V135 I141 L142 L143	V135-C139 HydrophobicContact CB-CB 4.07Å; V135-C139 HydrophobicContact CG2-CB 4.47Å; V135-C139 WeakPolarHBondContact O-CB 3.38Å; V135-C139 PolarHBondContact O-SG 2.95Å; C139-I141 PolarHBondContact O-N 2.95Å; C139-L142 PolarHBondContact O-N 3.25Å; C139-L143 WeakPolarHBondContact O-CB 3.38Å; C139-L143 PolarHBondContact O-N 3.04Å
140	S	91.9	Very high	91.1	Very high	0 Å²	0	36 Å²	36	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-42	175.1	-70.3	0	0	0	0	112.6	N132 G136 R137 L143 A144 I177	N132-S140 WeakPolarHBondContact OD1-CB 3.35Å; N132-S140 PolarHBondContact OD1-OG 2.92Å; G136-S140 PolarHBondContact O-N 3.43Å; G136-S140 PolarHBondContact O-OG 3.33Å; G136-S140 VanDerWaalsContact O-OG 3.06Å; R137-S140 PolarHBondContact O-N 3.18Å; S140-L143 PolarHBondContact O-N 2.87Å; S140-A144 WeakPolarHBondContact O-CB 3.28Å; S140-A144 PolarHBondContact O-N 3.26Å; S140-I177 WeakPolarHBondContact O-CG2 3.39Å
141	I	92.6	Very high	91.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-41.7	176.9	-67.7	167.2	0	0	0	111	R137 R138 C139 L143 A144 S145 T181 V182 Y185 Q242 F246	R137-I141 WeakPolarHBondContact O-CG1 3.48Å; R137-I141 PolarHBondContact O-N 2.97Å; R138-I141 PolarHBondContact O-N 3Å; C139-I141 PolarHBondContact O-N 2.95Å; I141-L143 VanDerWaalsContact C-N 3.34Å; I141-L143 PolarHBondContact O-N 3.47Å; I141-A144 WeakPolarHBondContact O-CB 3.34Å; I141-A144 PolarHBondContact O-N 3.46Å; I141-S145 WeakPolarHBondContact O-CB 3.31Å; I141-S145 PolarHBondContact O-N 3.33Å; I141-S145 PolarHBondContact O-OG 3.27Å; I141-S145 VanDerWaalsContact O-OG 3.13Å; I141-T181 HydrophobicContact CD1-CG2 4.01Å; I141-T181 HydrophobicContact CG1-CG2 3.65Å; I141-V182 HydrophobicContact CD1-CG2 4.19Å; I141-V182 HydrophobicContact CG1-CG2 4.19Å; I141-Y185 HydrophobicContact CD1-CD1 4.25Å; I141-Y185 HydrophobicContact CD1-CG 3.96Å; I141-Q242 HydrophobicContact CG2-CG 4.43Å; I141-F246 HydrophobicContact CB-CD1 4.07Å; I141-F246 HydrophobicContact CB-CE1 4.06Å; I141-F246 HydrophobicContact CB-CG 4.44Å; I141-F246 HydrophobicContact CB-CZ 4.41Å; I141-F246 HydrophobicContact CD1-CD1 4.24Å; I141-F246 HydrophobicContact CD1-CE1 3.4Å; I141-F246 HydrophobicContact CD1-CZ 3.61Å; I141-F246 HydrophobicContact CG1-CE1 4.31Å; I141-F246 HydrophobicContact CG2-CD1 3.81Å; I141-F246 HydrophobicContact CG2-CD2 3.71Å; I141-F246 HydrophobicContact CG2-CE1 3.81Å; I141-F246 HydrophobicContact CG2-CE2 3.7Å; I141-F246 HydrophobicContact CG2-CG 3.75Å; I141-F246 HydrophobicContact CG2-CZ 3.75Å
142	L	95	Very high	92.2	Very high	27 Å²	27	30.1 Å²	30.1	14%	0.141	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-43.4	174.7	-74.5	170.5	0	0	0	111.8	R138 C139 S145 A146 F243 F246 L247	R138-L142 HydrophobicContact CG-CD1 4.18Å; R138-L142 WeakPolarHBondContact O-CG 3.37Å; R138-L142 PolarHBondContact O-N 2.85Å; C139-L142 PolarHBondContact O-N 3.25Å; L142-S145 PolarHBondContact O-N 2.91Å; L142-A146 WeakPolarHBondContact O-CB 3.42Å; L142-A146 PolarHBondContact O-N 3.29Å; L142-F243 HydrophobicContact CB-CD2 4.44Å; L142-F243 HydrophobicContact CB-CE2 4.22Å; L142-F243 HydrophobicContact CD2-CD2 3.82Å; L142-F243 HydrophobicContact CD2-CE2 3.94Å; L142-F243 HydrophobicContact CD2-CG 4.21Å; L142-F243 HydrophobicContact CD2-CZ 4.44Å; L142-F243 VanDerWaalsContact CD2-O 3.25Å; L142-F243 WeakPolarHBondContact CD2-O 3.26Å; L142-F243 WeakPolarHBondContact O-CD2 3.42Å; L142-F246 HydrophobicContact CD2-CB 3.62Å; L142-F246 HydrophobicContact CG-CB 3.98Å; L142-L247 HydrophobicContact CD1-CD2 4.35Å; L142-L247 HydrophobicContact CD2-CD2 4.01Å; L142-L247 HydrophobicContact CD2-CG 4.39Å
143	L	94.6	Very high	92.8	Very high	78 Å²	78	32 Å²	32	41%	0.408	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-45.8	174.9	178.4	61.8	0	0	0	111.2	L131 C139 S140 I141 S145 A146 L147 I177	L131-L143 HydrophobicContact CD2-CD2 4.13Å; C139-L143 WeakPolarHBondContact O-CB 3.38Å; C139-L143 PolarHBondContact O-N 3.04Å; S140-L143 PolarHBondContact O-N 2.87Å; I141-L143 VanDerWaalsContact C-N 3.34Å; I141-L143 PolarHBondContact O-N 3.47Å; L143-S145 PolarHBondContact O-N 2.9Å; L143-A146 PolarHBondContact O-N 2.9Å; L143-L147 HydrophobicContact CD1-CD1 4.22Å; L143-L147 HydrophobicContact CD1-CG 4.24Å; L143-L147 HydrophobicContact CG-CD1 4.09Å; L143-L147 WeakPolarHBondContact O-CB 3.29Å; L143-L147 VanDerWaalsContact O-CG 3.32Å; L143-L147 WeakPolarHBondContact O-CG 3.38Å; L143-L147 PolarHBondContact O-N 3.29Å; L143-I177 HydrophobicContact CD2-CD1 4.07Å; L143-I177 HydrophobicContact CG-CD1 4.34Å
144	A	94.1	Very high	93.4	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-48.8	176.6	0	0	0	0	0	111.8	S140 I141 A146 L147 C148 G174 I177	S140-A144 WeakPolarHBondContact O-CB 3.28Å; S140-A144 PolarHBondContact O-N 3.26Å; I141-A144 WeakPolarHBondContact O-CB 3.34Å; I141-A144 PolarHBondContact O-N 3.46Å; A144-A146 PolarHBondContact O-N 3.24Å; A144-L147 PolarHBondContact O-N 3.47Å; A144-C148 PolarHBondContact O-N 3.01Å; A144-C148 PolarHBondContact O-SG 2.9Å; A144-C148 VanDerWaalsContact O-SG 3.33Å; A144-G174 WeakPolarHBondContact CB-O 3.36Å; A144-I177 HydrophobicContact CB-CB 4Å; A144-I177 HydrophobicContact CB-CG2 3.95Å
145	S	95.1	Very high	93.9	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-38.1	178.2	-61.9	0	0	0	0	112.4	I141 L142 L143 C148 A149 Q242	I141-S145 WeakPolarHBondContact O-CB 3.31Å; I141-S145 PolarHBondContact O-N 3.33Å; I141-S145 PolarHBondContact O-OG 3.27Å; I141-S145 VanDerWaalsContact O-OG 3.13Å; L142-S145 PolarHBondContact O-N 2.91Å; L143-S145 PolarHBondContact O-N 2.9Å; S145-C148 PolarHBondContact O-N 2.97Å; S145-A149 WeakPolarHBondContact O-CB 3.24Å; S145-A149 PolarHBondContact O-N 2.91Å; S145-Q242 VanDerWaalsContact OG-CD 3.25Å; S145-Q242 WeakPolarHBondContact OG-CG 3.36Å; S145-Q242 PolarHBondContact OG-OE1 3.33Å
146	A	95.7	Very high	94.2	Very high	35 Å²	35	28.7 Å²	28.7	29%	0.289	17%	0.173	S	C	.	.	H	α-helix	trans	-65	-44.7	175	0	0	0	0	0	111.8	L142 L143 A144 A149 V150 F243	L142-A146 WeakPolarHBondContact O-CB 3.42Å; L142-A146 PolarHBondContact O-N 3.29Å; L143-A146 PolarHBondContact O-N 2.9Å; A144-A146 PolarHBondContact O-N 3.24Å; A146-A149 PolarHBondContact O-N 3.34Å; A146-V150 WeakPolarHBondContact O-CB 3.44Å; A146-V150 VanDerWaalsContact O-CG2 3.3Å; A146-V150 WeakPolarHBondContact O-CG2 3.42Å; A146-V150 PolarHBondContact O-N 3.03Å; A146-F243 HydrophobicContact CB-CD2 4.2Å; A146-F243 HydrophobicContact CB-CE2 4.04Å
147	L	96.6	Very high	94.4	Very high	45 Å²	45	32.2 Å²	32.2	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-45.2	175.4	-71.6	171.6	0	0	0	111.4	L143 A144 A149 V150 G151 V170 L173 I177	L143-L147 HydrophobicContact CD1-CD1 4.22Å; L143-L147 HydrophobicContact CD1-CG 4.24Å; L143-L147 HydrophobicContact CG-CD1 4.09Å; L143-L147 WeakPolarHBondContact O-CB 3.29Å; L143-L147 VanDerWaalsContact O-CG 3.32Å; L143-L147 WeakPolarHBondContact O-CG 3.38Å; L143-L147 PolarHBondContact O-N 3.29Å; A144-L147 PolarHBondContact O-N 3.47Å; L147-A149 PolarHBondContact O-N 3.49Å; L147-V150 PolarHBondContact O-N 3.48Å; L147-G151 PolarHBondContact O-N 2.89Å; L147-V170 HydrophobicContact CD2-CG1 4.26Å; L147-V170 WeakPolarHBondContact O-CG1 3.12Å; L147-L173 HydrophobicContact CD1-CB 4.28Å; L147-I177 HydrophobicContact CD1-CD1 3.94Å
148	C	95.8	Very high	94.5	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.041	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-46	175.1	-69.9	0	0	0	0	111.8	L84 A144 S145 G151 S152 A239	L84-C148 HydrophobicContact CD1-CB 4.3Å; A144-C148 PolarHBondContact O-N 3.01Å; A144-C148 PolarHBondContact O-SG 2.9Å; A144-C148 VanDerWaalsContact O-SG 3.33Å; S145-C148 PolarHBondContact O-N 2.97Å; C148-G151 PolarHBondContact O-N 3.43Å; C148-S152 WeakPolarHBondContact O-CB 3.35Å; C148-S152 PolarHBondContact O-N 3.46Å; C148-S152 PolarHBondContact O-OG 3.48Å; C148-A239 HydrophobicContact CB-CB 4.07Å
149	A	96	Very high	94.4	Very high	16 Å²	16	30.4 Å²	30.4	13%	0.132	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-45.8	179.5	0	0	0	0	0	112.4	S145 A146 L147 A153 T236 A239 V240	S145-A149 WeakPolarHBondContact O-CB 3.24Å; S145-A149 PolarHBondContact O-N 2.91Å; A146-A149 PolarHBondContact O-N 3.34Å; L147-A149 PolarHBondContact O-N 3.49Å; A149-A153 WeakPolarHBondContact O-CB 3.26Å; A149-A153 PolarHBondContact O-N 2.61Å; A149-T236 HydrophobicContact CB-CG2 4.29Å; A149-A239 HydrophobicContact CB-CB 3.93Å; A149-V240 HydrophobicContact CB-CG2 4.24Å
150	V	96.6	Very high	94.3	Very high	87 Å²	87	32.5 Å²	32.5	53%	0.527	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-45.4	176.8	172	0	0	0	0	110.5	A146 L147 A153 V154	A146-V150 WeakPolarHBondContact O-CB 3.44Å; A146-V150 VanDerWaalsContact O-CG2 3.3Å; A146-V150 WeakPolarHBondContact O-CG2 3.42Å; A146-V150 PolarHBondContact O-N 3.03Å; L147-V150 PolarHBondContact O-N 3.48Å; V150-A153 PolarHBondContact O-N 2.91Å; V150-V154 HydrophobicContact CG1-CG2 4.41Å; V150-V154 VanDerWaalsContact O-CG2 3.29Å; V150-V154 WeakPolarHBondContact O-CG2 3.5Å; V150-V154 PolarHBondContact O-N 2.87Å
151	G	96.2	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-46.6	178.6	0	0	0	0	0	112.3	L147 C148 A153 V154 L155 V171	L147-G151 PolarHBondContact O-N 2.89Å; C148-G151 PolarHBondContact O-N 3.43Å; G151-A153 PolarHBondContact O-N 3.39Å; G151-V154 PolarHBondContact O-N 3.12Å; G151-L155 VanDerWaalsContact O-CG 3.31Å; G151-L155 WeakPolarHBondContact O-CG 3.47Å; G151-L155 PolarHBondContact O-N 2.91Å; G151-V171 VanDerWaalsContact C-CG2 3.41Å
152	S	95.3	Very high	94.2	Very high	4 Å²	4	40.7 Å²	40.7	3%	0.028	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-37.4	176.2	-62.8	0	0	0	0	112.9	C148 L155 A156 A235 T236	C148-S152 WeakPolarHBondContact O-CB 3.35Å; C148-S152 PolarHBondContact O-N 3.46Å; C148-S152 PolarHBondContact O-OG 3.48Å; S152-L155 PolarHBondContact O-N 3.13Å; S152-A156 PolarHBondContact O-N 3.33Å; S152-A235 VanDerWaalsContact OG-CB 3.29Å; S152-A235 WeakPolarHBondContact OG-CB 3.32Å; S152-T236 VanDerWaalsContact CB-OG1 3.32Å; S152-T236 WeakPolarHBondContact CB-OG1 3.43Å
153	A	95.3	Very high	94.2	Very high	49 Å²	49	42 Å²	42	41%	0.405	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-40.8	173.6	0	0	0	0	0	112.1	A149 V150 G151 A156 A157	A149-A153 WeakPolarHBondContact O-CB 3.26Å; A149-A153 PolarHBondContact O-N 2.61Å; V150-A153 PolarHBondContact O-N 2.91Å; G151-A153 PolarHBondContact O-N 3.39Å; A153-A156 PolarHBondContact O-N 2.86Å; A153-A157 WeakPolarHBondContact O-CB 3.11Å; A153-A157 PolarHBondContact O-N 3.5Å
154	V	96.1	Very high	94.2	Very high	55 Å²	55	38.4 Å²	38.4	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-42.6	173.9	171	0	0	0	0	110.9	V150 G151 A156 A157 A158	V150-V154 HydrophobicContact CG1-CG2 4.41Å; V150-V154 VanDerWaalsContact O-CG2 3.29Å; V150-V154 WeakPolarHBondContact O-CG2 3.5Å; V150-V154 PolarHBondContact O-N 2.87Å; G151-V154 PolarHBondContact O-N 3.12Å; V154-A156 VanDerWaalsContact C-N 3.35Å; V154-A156 PolarHBondContact O-N 2.66Å; V154-A157 CarbonylContact O-C 3.48Å; V154-A157 PolarHBondContact O-N 2.89Å; V154-A158 PolarHBondContact O-N 2.81Å
155	L	94.3	Very high	94.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-43.3	175.6	-70.7	173.1	0	0	0	111.8	G151 S152 A157 A158 L164 R168 V171 L232	G151-L155 VanDerWaalsContact O-CG 3.31Å; G151-L155 WeakPolarHBondContact O-CG 3.47Å; G151-L155 PolarHBondContact O-N 2.91Å; S152-L155 PolarHBondContact O-N 3.13Å; L155-A157 VanDerWaalsContact C-N 3.31Å; L155-A157 PolarHBondContact O-N 2.88Å; L155-A158 WeakPolarHBondContact O-CB 3.26Å; L155-A158 PolarHBondContact O-N 3.02Å; L155-L164 HydrophobicContact CD2-CD1 3.64Å; L155-L164 HydrophobicContact CD2-CG 4.21Å; L155-L164 VanDerWaalsContact CD2-O 3.29Å; L155-L164 WeakPolarHBondContact CD2-O 3.36Å; L155-R168 HydrophobicContact CD2-CG 3.97Å; L155-V171 HydrophobicContact CD1-CG2 3.86Å; L155-L232 HydrophobicContact CB-CB 3.98Å; L155-L232 HydrophobicContact CB-CD1 4.17Å; L155-L232 HydrophobicContact CD1-CB 4.41Å; L155-L232 HydrophobicContact CD2-CD1 4.4Å
156	A	93.7	Very high	94.3	Very high	29 Å²	29	41.7 Å²	41.7	24%	0.24	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-36.2	176.7	0	0	0	0	0	112.5	S152 A153 V154 R229	S152-A156 PolarHBondContact O-N 3.33Å; A153-A156 PolarHBondContact O-N 2.86Å; V154-A156 VanDerWaalsContact C-N 3.35Å; V154-A156 PolarHBondContact O-N 2.66Å; A156-R229 VanDerWaalsContact O-CD 3.32Å; A156-R229 WeakPolarHBondContact O-CD 3.23Å; A156-R229 WeakPolarHBondContact O-CG 3.39Å; A156-R229 PolarHBondContact O-NH1 3.3Å
157	A	93.2	Very high	94.3	Very high	75 Å²	75	40 Å²	40	62%	0.62	25%	0.254	S	S	*	.	H	α-helix	trans	-89	-0.8	-179.3	0	0	0	0	0	114.3	A153 V154 L155 A159	A153-A157 WeakPolarHBondContact O-CB 3.11Å; A153-A157 PolarHBondContact O-N 3.5Å; V154-A157 CarbonylContact O-C 3.48Å; V154-A157 PolarHBondContact O-N 2.89Å; L155-A157 VanDerWaalsContact C-N 3.31Å; L155-A157 PolarHBondContact O-N 2.88Å; A157-A159 PolarHBondContact O-N 3.42Å
158	A	93.1	Very high	94.2	Very high	1 Å²	1	38 Å²	38	1%	0.008	24%	0.243	C	C	.	.			trans	-61.7	125.3	-171.8	0	0	0	0	0	112.3	V154 L155 L164 W228 R229	V154-A158 PolarHBondContact O-N 2.81Å; L155-A158 WeakPolarHBondContact O-CB 3.26Å; L155-A158 PolarHBondContact O-N 3.02Å; A158-L164 HydrophobicContact CB-CB 4.23Å; A158-L164 HydrophobicContact CB-CD1 4.07Å; A158-W228 HydrophobicContact CB-CH2 4.31Å; A158-R229 VanDerWaalsContact O-CZ 3.24Å; A158-R229 PolarHBondContact O-NH1 3.43Å; A158-R229 PolarHBondContact O-NH2 3.35Å
159	A	89.1	Confident	94.3	Very high	64 Å²	64	41.2 Å²	41.2	53%	0.529	26%	0.259	S	S	.	.			trans	-100.4	-26	177	0	0	0	0	0	112.4	A157 T163	A157-A159 PolarHBondContact O-N 3.42Å; A159-T163 PolarHBondContact N-OG1 2.97Å
160	N	90.6	Very high	94.3	Very high	106 Å²	106	42.4 Å²	42.4	57%	0.567	27%	0.265	S	S	*	.	S	Bend	trans	-128.6	156.2	-176.1	-59.5	-45.8	0	0	0	110.7	E162 T163 L164	N160-E162 PolarHBondContact O-N 3.33Å; N160-T163 PolarHBondContact N-OG1 3.47Å; N160-T163 VanDerWaalsContact N-OG1 3.12Å; N160-T163 PolarHBondContact O-N 2.89Å; N160-T163 VanDerWaalsContact O-N 3.1Å; N160-T163 PolarHBondContact O-OG1 3.28Å; N160-L164 PolarHBondContact O-N 3.37Å; N160-L164 VanDerWaalsContact O-N 3.12Å
161	K	89.6	Confident	94.3	Very high	74 Å²	74	38.5 Å²	38.5	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-55.4	-34	175.5	64.3	-175.2	-176.4	178.1	0	113.8	L105 W109 L164 L165	L105-K161 HydrophobicContact CD2-CB 3.91Å; W109-K161 HydrophobicContact CD2-CD 3.99Å; W109-K161 HydrophobicContact CE3-CD 4.36Å; W109-K161 HydrophobicContact CG-CD 4.45Å; W109-K161 HydrophobicContact CH2-CD 4.43Å; W109-K161 HydrophobicContact CZ2-CD 4.07Å; K161-L164 WeakPolarHBondContact O-CB 3.46Å; K161-L164 PolarHBondContact O-N 3.26Å; K161-L165 PolarHBondContact O-N 2.88Å
162	E	93.1	Very high	94.2	Very high	97 Å²	97	38.5 Å²	38.5	45%	0.453	24%	0.241	S	C	.	.	H	α-helix	trans	-67.8	-41.1	177.4	-51.2	-52.8	150.6	0	0	112.3	W109 N160 L164 L165 A166	W109-E162 WeakPolarHBondContact CH2-OE1 3.31Å; W109-E162 WeakPolarHBondContact CH2-OE2 3Å; W109-E162 WeakPolarHBondContact CZ2-OE1 3.35Å; N160-E162 PolarHBondContact O-N 3.33Å; E162-L164 VanDerWaalsContact C-N 3.26Å; E162-L164 PolarHBondContact O-N 2.75Å; E162-L165 PolarHBondContact O-N 3.36Å; E162-A166 PolarHBondContact O-N 3.2Å
163	T	94.2	Very high	94.2	Very high	55 Å²	55	41.4 Å²	41.4	34%	0.337	26%	0.256	S	S	.	.	H	α-helix	trans	-67.1	-32.1	176	53.3	0	0	0	0	111.7	A159 N160 A166 G167	A159-T163 PolarHBondContact N-OG1 2.97Å; N160-T163 PolarHBondContact N-OG1 3.47Å; N160-T163 VanDerWaalsContact N-OG1 3.12Å; N160-T163 PolarHBondContact O-N 2.89Å; N160-T163 VanDerWaalsContact O-N 3.1Å; N160-T163 PolarHBondContact O-OG1 3.28Å; T163-A166 PolarHBondContact O-N 3.5Å; T163-G167 PolarHBondContact O-N 2.91Å
164	L	93.7	Very high	94.1	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-45.2	173.8	-168.9	73.9	0	0	0	110.8	L99 L113 L155 A158 N160 K161 E162 G167 R168 W228 L232	L99-L164 HydrophobicContact CD1-CD2 4.16Å; L99-L164 HydrophobicContact CD2-CD1 4.38Å; L99-L164 HydrophobicContact CD2-CD2 3.78Å; L113-L164 HydrophobicContact CD1-CD2 3.68Å; L113-L164 HydrophobicContact CD2-CB 4.18Å; L113-L164 HydrophobicContact CD2-CD2 3.83Å; L113-L164 HydrophobicContact CD2-CG 3.85Å; L113-L164 HydrophobicContact CG-CD2 4.43Å; L155-L164 HydrophobicContact CD2-CD1 3.64Å; L155-L164 HydrophobicContact CD2-CG 4.21Å; L155-L164 VanDerWaalsContact CD2-O 3.29Å; L155-L164 WeakPolarHBondContact CD2-O 3.36Å; A158-L164 HydrophobicContact CB-CB 4.23Å; A158-L164 HydrophobicContact CB-CD1 4.07Å; N160-L164 PolarHBondContact O-N 3.37Å; N160-L164 VanDerWaalsContact O-N 3.12Å; K161-L164 WeakPolarHBondContact O-CB 3.46Å; K161-L164 PolarHBondContact O-N 3.26Å; E162-L164 VanDerWaalsContact C-N 3.26Å; E162-L164 PolarHBondContact O-N 2.75Å; L164-G167 PolarHBondContact O-N 3.28Å; L164-R168 WeakPolarHBondContact O-CG 3.32Å; L164-R168 PolarHBondContact O-N 3.12Å; L164-W228 HydrophobicContact CD1-CZ3 3.99Å; L164-L232 HydrophobicContact CD1-CD1 4.02Å
165	L	95.5	Very high	93.9	Very high	25 Å²	25	37 Å²	37	13%	0.131	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-44.4	174.7	-179.5	61.3	0	0	0	111.7	W109 L112 L113 K161 E162 G167 R168 L169	W109-L165 HydrophobicContact CZ3-CD2 4.2Å; L112-L165 HydrophobicContact CD2-CD2 3.79Å; L112-L165 HydrophobicContact CG-CD1 4.1Å; L112-L165 HydrophobicContact CG-CD2 4.06Å; L113-L165 HydrophobicContact CD2-CB 4.03Å; L113-L165 HydrophobicContact CD2-CD1 4.34Å; K161-L165 PolarHBondContact O-N 2.88Å; E162-L165 PolarHBondContact O-N 3.36Å; L165-G167 VanDerWaalsContact C-N 3.33Å; L165-G167 PolarHBondContact O-N 2.99Å; L165-R168 WeakPolarHBondContact O-CB 3.37Å; L165-R168 PolarHBondContact O-N 2.97Å; L165-R168 VanDerWaalsContact O-N 3.15Å; L165-L169 HydrophobicContact CD1-CG 4.42Å; L165-L169 HydrophobicContact CG-CD1 4.33Å; L165-L169 WeakPolarHBondContact O-CG 3.31Å; L165-L169 PolarHBondContact O-N 3.5Å
166	A	96.2	Very high	93.7	Very high	48 Å²	48	36.9 Å²	36.9	40%	0.397	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-44.5	175.4	0	0	0	0	0	111.8	E162 T163 R168 L169 V170	E162-A166 PolarHBondContact O-N 3.2Å; T163-A166 PolarHBondContact O-N 3.5Å; A166-R168 PolarHBondContact O-N 3.1Å; A166-L169 PolarHBondContact O-N 3.35Å; A166-V170 VanDerWaalsContact O-CG2 3.31Å; A166-V170 WeakPolarHBondContact O-CG2 3.26Å; A166-V170 PolarHBondContact O-N 2.91Å
167	G	95.8	Very high	93.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-44.5	173.9	0	0	0	0	0	112.6	T163 L164 L165 L169 V170 V171	T163-G167 PolarHBondContact O-N 2.91Å; L164-G167 PolarHBondContact O-N 3.28Å; L165-G167 VanDerWaalsContact C-N 3.33Å; L165-G167 PolarHBondContact O-N 2.99Å; G167-L169 PolarHBondContact O-N 2.9Å; G167-V170 PolarHBondContact O-N 3.43Å; G167-V171 WeakPolarHBondContact O-CG2 3.45Å; G167-V171 PolarHBondContact O-N 3.3Å
168	R	95.4	Very high	93.4	Very high	4 Å²	4	33 Å²	33	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-42.7	176.9	-74.5	-59.6	-172.3	171.9	5.5	112.6	D88 L113 A117 L155 L164 L165 A166 V170 V171 G172 L232	D88-R168 IonicContact OD1-NH1 3.19Å; D88-R168 PolarHBondContact OD1-NH1 3.34Å; L113-R168 HydrophobicContact CD2-CG 4.12Å; A117-R168 HydrophobicContact CB-CB 4.25Å; L155-R168 HydrophobicContact CD2-CG 3.97Å; L164-R168 WeakPolarHBondContact O-CG 3.32Å; L164-R168 PolarHBondContact O-N 3.12Å; L165-R168 WeakPolarHBondContact O-CB 3.37Å; L165-R168 PolarHBondContact O-N 2.97Å; L165-R168 VanDerWaalsContact O-N 3.15Å; A166-R168 PolarHBondContact O-N 3.1Å; R168-V170 VanDerWaalsContact C-N 3.35Å; R168-V171 PolarHBondContact O-N 3.15Å; R168-G172 PolarHBondContact O-N 2.94Å; R168-L232 VanDerWaalsContact NH2-CD2 3.32Å
169	L	96.9	Very high	93	Very high	72 Å²	72	34.7 Å²	34.7	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-43.7	175.9	-67.9	172.7	0	0	0	111.2	G116 A120 L165 A166 G167 G172 L173	G116-L169 WeakPolarHBondContact O-CD2 3.3Å; A120-L169 HydrophobicContact CB-CD2 4.06Å; A120-L169 WeakPolarHBondContact CB-O 3.39Å; L165-L169 HydrophobicContact CD1-CG 4.42Å; L165-L169 HydrophobicContact CG-CD1 4.33Å; L165-L169 WeakPolarHBondContact O-CG 3.31Å; L165-L169 PolarHBondContact O-N 3.5Å; A166-L169 PolarHBondContact O-N 3.35Å; G167-L169 PolarHBondContact O-N 2.9Å; L169-G172 PolarHBondContact O-N 2.94Å; L169-L173 WeakPolarHBondContact O-CG 3.26Å; L169-L173 PolarHBondContact O-N 3.28Å
170	V	97.1	Very high	92.7	Very high	42 Å²	42	35.7 Å²	35.7	26%	0.255	20%	0.196	S	C	.	.	H	α-helix	trans	-65.7	-45.5	179.4	173.9	0	0	0	0	111.7	L147 A166 G167 R168 G172 L173 G174	L147-V170 HydrophobicContact CD2-CG1 4.26Å; L147-V170 WeakPolarHBondContact O-CG1 3.12Å; A166-V170 VanDerWaalsContact O-CG2 3.31Å; A166-V170 WeakPolarHBondContact O-CG2 3.26Å; A166-V170 PolarHBondContact O-N 2.91Å; G167-V170 PolarHBondContact O-N 3.43Å; R168-V170 VanDerWaalsContact C-N 3.35Å; V170-G172 VanDerWaalsContact C-N 3.31Å; V170-G172 PolarHBondContact O-N 3.27Å; V170-L173 PolarHBondContact O-N 3.05Å; V170-G174 PolarHBondContact O-N 3.48Å
171	V	95.6	Very high	92.5	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-44.5	173.6	172.9	0	0	0	0	110.5	D88 G151 L155 G167 R168 L173 G174 I175	D88-V171 HydrophobicContact CB-CG1 4.34Å; G151-V171 VanDerWaalsContact C-CG2 3.41Å; L155-V171 HydrophobicContact CD1-CG2 3.86Å; G167-V171 WeakPolarHBondContact O-CG2 3.45Å; G167-V171 PolarHBondContact O-N 3.3Å; R168-V171 PolarHBondContact O-N 3.15Å; V171-L173 PolarHBondContact O-N 3.35Å; V171-G174 PolarHBondContact O-N 3.48Å; V171-G174 VanDerWaalsContact O-N 3.12Å; V171-I175 HydrophobicContact CG1-CD1 3.61Å; V171-I175 HydrophobicContact CG1-CG1 4.18Å; V171-I175 WeakPolarHBondContact O-CG1 3.22Å; V171-I175 PolarHBondContact O-N 3.19Å
172	G	94.6	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.5	-45.7	176.8	0	0	0	0	0	113	A117 A121 R168 L169 V170 G174 I175 G176	A117-G172 VanDerWaalsContact O-CA 3.26Å; A117-G172 WeakPolarHBondContact O-CA 3.28Å; A121-G172 WeakPolarHBondContact CA-O 3.41Å; A121-G172 VanDerWaalsContact CB-O 3.3Å; A121-G172 WeakPolarHBondContact CB-O 3.46Å; A121-G172 PolarHBondContact N-O 3.41Å; R168-G172 PolarHBondContact O-N 2.94Å; L169-G172 PolarHBondContact O-N 2.94Å; V170-G172 VanDerWaalsContact C-N 3.31Å; V170-G172 PolarHBondContact O-N 3.27Å; G172-G174 VanDerWaalsContact C-N 3.33Å; G172-G174 PolarHBondContact O-N 3.32Å; G172-I175 PolarHBondContact O-N 2.88Å; G172-G176 PolarHBondContact O-N 3.46Å
173	L	94.8	Very high	91.9	Very high	66 Å²	66	24.3 Å²	24.3	35%	0.346	14%	0.144	S	C	.	.	H	α-helix	trans	-58.6	-44.5	174.7	-69.6	174.5	0	0	0	111.9	A120 A124 L147 L169 V170 V171 G176 I177	A120-L173 HydrophobicContact CB-CD2 4.21Å; A120-L173 HydrophobicContact CB-CG 4.17Å; A124-L173 HydrophobicContact CB-CB 4.46Å; A124-L173 HydrophobicContact CB-CD2 3.92Å; A124-L173 WeakPolarHBondContact CB-O 3.25Å; L147-L173 HydrophobicContact CD1-CB 4.28Å; L169-L173 WeakPolarHBondContact O-CG 3.26Å; L169-L173 PolarHBondContact O-N 3.28Å; V170-L173 PolarHBondContact O-N 3.05Å; V171-L173 PolarHBondContact O-N 3.35Å; L173-G176 PolarHBondContact O-N 2.94Å; L173-I177 WeakPolarHBondContact O-CG1 3.26Å; L173-I177 PolarHBondContact O-N 3.42Å; L173-I177 VanDerWaalsContact O-N 3.11Å
174	G	94	Very high	91.5	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-46.3	176.8	0	0	0	0	0	112.4	A144 V170 V171 G172 G176 I177 G178	A144-G174 WeakPolarHBondContact CB-O 3.36Å; V170-G174 PolarHBondContact O-N 3.48Å; V171-G174 PolarHBondContact O-N 3.48Å; V171-G174 VanDerWaalsContact O-N 3.12Å; G172-G174 VanDerWaalsContact C-N 3.33Å; G172-G174 PolarHBondContact O-N 3.32Å; G174-G176 VanDerWaalsContact C-N 3.35Å; G174-G176 PolarHBondContact O-N 2.86Å; G174-I177 PolarHBondContact O-N 3.12Å; G174-G178 PolarHBondContact O-N 3.5Å
175	I	92.3	Very high	91.2	Very high	9 Å²	9	23.7 Å²	23.7	5%	0.046	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-43.7	175.5	-73.2	173.3	0	0	0	111.4	F85 D88 A121 V171 G172 G178 S179	F85-I175 HydrophobicContact CB-CG2 4.13Å; F85-I175 HydrophobicContact CD2-CG2 3.25Å; F85-I175 HydrophobicContact CE2-CG2 3.92Å; F85-I175 HydrophobicContact CG-CG2 3.99Å; D88-I175 HydrophobicContact CB-CD1 3.42Å; D88-I175 VanDerWaalsContact CB-CD1 3.42Å; D88-I175 WeakPolarHBondContact OD2-CD1 3.47Å; A121-I175 HydrophobicContact CB-CG2 4.18Å; V171-I175 HydrophobicContact CG1-CD1 3.61Å; V171-I175 HydrophobicContact CG1-CG1 4.18Å; V171-I175 WeakPolarHBondContact O-CG1 3.22Å; V171-I175 PolarHBondContact O-N 3.19Å; G172-I175 PolarHBondContact O-N 2.88Å; I175-G178 PolarHBondContact O-N 3.32Å; I175-S179 VanDerWaalsContact O-CB 3.23Å; I175-S179 WeakPolarHBondContact O-CB 3.38Å; I175-S179 PolarHBondContact O-N 2.87Å; I175-S179 PolarHBondContact O-OG 3.3Å
176	G	90.2	Very high	90.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-48.3	179.4	0	0	0	0	0	112.4	A121 G172 L173 G174 S179 M180	A121-G176 VanDerWaalsContact O-CA 3.26Å; A121-G176 WeakPolarHBondContact O-CA 3.27Å; G172-G176 PolarHBondContact O-N 3.46Å; L173-G176 PolarHBondContact O-N 2.94Å; G174-G176 VanDerWaalsContact C-N 3.35Å; G174-G176 PolarHBondContact O-N 2.86Å; G176-S179 PolarHBondContact O-OG 3.2Å; G176-M180 PolarHBondContact O-N 2.89Å
177	I	91.1	Very high	90.1	Very high	15 Å²	15	21.5 Å²	21.5	8%	0.077	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-45.8	175.8	-62.2	170.8	0	0	0	110.3	A124 L131 S140 L143 A144 L147 L173 G174 T181	A124-I177 HydrophobicContact CB-CG1 4.11Å; L131-I177 HydrophobicContact CD2-CD1 4Å; L131-I177 HydrophobicContact CD2-CG1 4.27Å; L131-I177 HydrophobicContact CD2-CG2 4.04Å; S140-I177 WeakPolarHBondContact O-CG2 3.39Å; L143-I177 HydrophobicContact CD2-CD1 4.07Å; L143-I177 HydrophobicContact CG-CD1 4.34Å; A144-I177 HydrophobicContact CB-CB 4Å; A144-I177 HydrophobicContact CB-CG2 3.95Å; L147-I177 HydrophobicContact CD1-CD1 3.94Å; L173-I177 WeakPolarHBondContact O-CG1 3.26Å; L173-I177 PolarHBondContact O-N 3.42Å; L173-I177 VanDerWaalsContact O-N 3.11Å; G174-I177 PolarHBondContact O-N 3.12Å; I177-T181 VanDerWaalsContact O-CB 3.28Å; I177-T181 WeakPolarHBondContact O-CB 3.41Å; I177-T181 PolarHBondContact O-N 3.42Å; I177-T181 VanDerWaalsContact O-N 3.07Å; I177-T181 PolarHBondContact O-OG1 2.77Å
178	G	88.4	Confident	89.5	Confident	6 Å²	6	22.6 Å²	22.6	6%	0.062	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-45.1	-179.4	0	0	0	0	0	113.1	G174 I175 M180 T181 V182	G174-G178 PolarHBondContact O-N 3.5Å; I175-G178 PolarHBondContact O-N 3.32Å; G178-M180 VanDerWaalsContact C-N 3.3Å; G178-M180 PolarHBondContact O-N 3.2Å; G178-T181 PolarHBondContact O-N 3.33Å; G178-V182 VanDerWaalsContact O-CB 3.26Å; G178-V182 WeakPolarHBondContact O-CB 3.06Å; G178-V182 VanDerWaalsContact O-CG2 3.29Å; G178-V182 WeakPolarHBondContact O-CG2 3.35Å; G178-V182 PolarHBondContact O-N 2.86Å
179	S	84.8	Confident	89	Confident	38 Å²	38	22.5 Å²	22.5	27%	0.266	13%	0.13	S	C	.	.	H	α-helix	trans	-62.2	-35.2	-176.8	68.8	0	0	0	0	113	I175 G176 P183	I175-S179 VanDerWaalsContact O-CB 3.23Å; I175-S179 WeakPolarHBondContact O-CB 3.38Å; I175-S179 PolarHBondContact O-N 2.87Å; I175-S179 PolarHBondContact O-OG 3.3Å; G176-S179 PolarHBondContact O-OG 3.2Å; S179-P183 WeakPolarHBondContact O-CD 3.36Å; S179-P183 WeakPolarHBondContact O-CG 3.32Å
180	M	82.5	Confident	88.3	Confident	84 Å²	84	19 Å²	19	41%	0.414	11%	0.112	S	C	.	.	H	α-helix	trans	-80.6	-36.8	175.4	-175.6	57.6	-178	0	0	112.2	G176 G178 V184	G176-M180 PolarHBondContact O-N 2.89Å; G178-M180 VanDerWaalsContact C-N 3.3Å; G178-M180 PolarHBondContact O-N 3.2Å; M180-V184 VanDerWaalsContact O-CG2 3.28Å; M180-V184 WeakPolarHBondContact O-CG2 3.39Å
181	T	86.4	Confident	87.4	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-85.7	-39.2	-169.7	-49.1	0	0	0	0	113.2	N132 R137 I141 I177 G178 V184 Y185	N132-T181 PolarHBondContact ND2-OG1 2.94Å; N132-T181 WeakPolarHBondContact OD1-CG2 3.5Å; N132-T181 PolarHBondContact OD1-OG1 3.28Å; R137-T181 HydrophobicContact CB-CG2 3.93Å; R137-T181 HydrophobicContact CG-CG2 4.12Å; I141-T181 HydrophobicContact CD1-CG2 4.01Å; I141-T181 HydrophobicContact CG1-CG2 3.65Å; I177-T181 VanDerWaalsContact O-CB 3.28Å; I177-T181 WeakPolarHBondContact O-CB 3.41Å; I177-T181 PolarHBondContact O-N 3.42Å; I177-T181 VanDerWaalsContact O-N 3.07Å; I177-T181 PolarHBondContact O-OG1 2.77Å; G178-T181 PolarHBondContact O-N 3.33Å; T181-V184 PolarHBondContact O-N 3.19Å; T181-Y185 WeakPolarHBondContact O-CB 3.29Å; T181-Y185 PolarHBondContact O-N 3.46Å
182	V	88	Confident	86.2	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-50.2	-174.6	164.7	0	0	0	0	112.4	S78 I141 G178 V184 Y185 I186 N202	S78-V182 WeakPolarHBondContact O-CG1 3.41Å; I141-V182 HydrophobicContact CD1-CG2 4.19Å; I141-V182 HydrophobicContact CG1-CG2 4.19Å; G178-V182 VanDerWaalsContact O-CB 3.26Å; G178-V182 WeakPolarHBondContact O-CB 3.06Å; G178-V182 VanDerWaalsContact O-CG2 3.29Å; G178-V182 WeakPolarHBondContact O-CG2 3.35Å; G178-V182 PolarHBondContact O-N 2.86Å; V182-V184 VanDerWaalsContact C-N 3.27Å; V182-V184 PolarHBondContact O-N 3.34Å; V182-Y185 PolarHBondContact O-N 2.9Å; V182-I186 HydrophobicContact CG1-CD1 3.79Å; V182-I186 HydrophobicContact CG1-CG1 4.48Å; V182-I186 VanDerWaalsContact O-CG1 3.31Å; V182-I186 WeakPolarHBondContact O-CG1 3.19Å; V182-I186 PolarHBondContact O-N 2.9Å; V182-N202 WeakPolarHBondContact CG1-OD1 3.29Å
183	P	83.3	Confident	85.1	Confident	37 Å²	37	27.1 Å²	27.1	24%	0.24	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-37.5	178.1	-22.2	34	0	0	0	112.4	S179 A187	S179-P183 WeakPolarHBondContact O-CD 3.36Å; S179-P183 WeakPolarHBondContact O-CG 3.32Å; P183-A187 VanDerWaalsContact O-CB 3.31Å; P183-A187 WeakPolarHBondContact O-CB 3.43Å; P183-A187 PolarHBondContact O-N 2.91Å
184	V	84.1	Confident	84	Confident	44 Å²	44	25.2 Å²	25.2	27%	0.267	15%	0.149	S	C	.	.	H	α-helix	trans	-66	-45.9	177.8	174	0	0	0	0	110.8	M180 T181 V182 A187 E188	M180-V184 VanDerWaalsContact O-CG2 3.28Å; M180-V184 WeakPolarHBondContact O-CG2 3.39Å; T181-V184 PolarHBondContact O-N 3.19Å; V182-V184 VanDerWaalsContact C-N 3.27Å; V182-V184 PolarHBondContact O-N 3.34Å; V184-A187 PolarHBondContact O-N 3.31Å; V184-E188 HydrophobicContact CG1-CG 4.32Å; V184-E188 WeakPolarHBondContact CG1-OE1 3.44Å; V184-E188 WeakPolarHBondContact O-CB 3.32Å; V184-E188 VanDerWaalsContact O-CG 3.31Å; V184-E188 WeakPolarHBondContact O-CG 3.44Å; V184-E188 PolarHBondContact O-N 2.91Å
185	Y	88.4	Confident	83	Confident	2 Å²	2	30 Å²	30	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-45.7	176.9	-178.3	-99	0	0	0	111.6	S78 R137 I141 T181 V182 A187 E188 V189 F246 P250	S78-Y185 VanDerWaalsContact OG-CD1 3.24Å; S78-Y185 WeakPolarHBondContact OG-CD1 3.26Å; S78-Y185 WeakPolarHBondContact OG-CE1 3.31Å; R137-Y185 HydrophobicContact CB-CD2 3.74Å; R137-Y185 HydrophobicContact CB-CG 4.44Å; I141-Y185 HydrophobicContact CD1-CD1 4.25Å; I141-Y185 HydrophobicContact CD1-CG 3.96Å; T181-Y185 WeakPolarHBondContact O-CB 3.29Å; T181-Y185 PolarHBondContact O-N 3.46Å; V182-Y185 PolarHBondContact O-N 2.9Å; Y185-A187 VanDerWaalsContact C-N 3.28Å; Y185-A187 PolarHBondContact O-N 3.45Å; Y185-E188 PolarHBondContact O-N 2.91Å; Y185-V189 HydrophobicContact CD1-CG2 4.24Å; Y185-V189 HydrophobicContact CD2-CG2 4.15Å; Y185-V189 HydrophobicContact CE1-CG2 3.9Å; Y185-V189 HydrophobicContact CE2-CG2 3.82Å; Y185-V189 HydrophobicContact CG-CG2 4.37Å; Y185-V189 WeakPolarHBondContact O-CB 3.38Å; Y185-V189 VanDerWaalsContact O-CG2 3.29Å; Y185-V189 WeakPolarHBondContact O-CG2 3.32Å; Y185-V189 PolarHBondContact O-N 2.85Å; Y185-F246 AromaticContact CD1-CE1 3.96Å; Y185-F246 HydrophobicContact CD1-CE1 3.96Å; Y185-F246 HydrophobicContact CD1-CZ 4.07Å; Y185-F246 AromaticContact CE1-CE1 3.65Å; Y185-F246 HydrophobicContact CE1-CE1 3.65Å; Y185-F246 AromaticContact CE1-CZ 3.92Å; Y185-F246 HydrophobicContact CE1-CZ 3.92Å; Y185-F246 HydrophobicContact CE2-CE1 4.45Å; Y185-F246 HydrophobicContact CG-CE1 4.48Å; Y185-F246 AromaticContact CZ-CE1 3.92Å; Y185-P250 WeakPolarHBondContact CE2-O 3.14Å; Y185-P250 PolarHBondContact OH-O 2.95Å
186	I	85.3	Confident	81.8	Confident	1 Å²	1	32 Å²	32	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-45.8	174.4	-66.9	168	0	0	0	109.7	S78 V182 E188 V189 S190 L198 V199 N202	S78-I186 VanDerWaalsContact CB-CG1 3.48Å; V182-I186 HydrophobicContact CG1-CD1 3.79Å; V182-I186 HydrophobicContact CG1-CG1 4.48Å; V182-I186 VanDerWaalsContact O-CG1 3.31Å; V182-I186 WeakPolarHBondContact O-CG1 3.19Å; V182-I186 PolarHBondContact O-N 2.9Å; I186-E188 PolarHBondContact O-N 3.41Å; I186-V189 PolarHBondContact O-N 3.39Å; I186-S190 WeakPolarHBondContact O-CB 3.24Å; I186-S190 PolarHBondContact O-N 3.25Å; I186-S190 PolarHBondContact O-OG 2.94Å; I186-L198 HydrophobicContact CG2-CB 3.87Å; I186-V199 HydrophobicContact CG2-CG2 4.06Å; I186-N202 HydrophobicContact CD1-CB 3.97Å
187	A	82.3	Confident	80.9	Confident	26 Å²	26	38.6 Å²	38.6	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-37.7	-178.8	0	0	0	0	0	113.7	P183 V184 Y185 R195 V199	P183-A187 VanDerWaalsContact O-CB 3.31Å; P183-A187 WeakPolarHBondContact O-CB 3.43Å; P183-A187 PolarHBondContact O-N 2.91Å; V184-A187 PolarHBondContact O-N 3.31Å; Y185-A187 VanDerWaalsContact C-N 3.28Å; Y185-A187 PolarHBondContact O-N 3.45Å; A187-R195 HydrophobicContact CB-CG 4.2Å; A187-R195 PolarHBondContact O-NE 3.5Å; A187-V199 HydrophobicContact CB-CG2 4.26Å
188	E	84.3	Confident	80.2	Confident	23 Å²	23	38.1 Å²	38.1	11%	0.107	21%	0.211	C	C	.	.	H	α-helix	trans	-76.8	-29.7	-179.4	-71.2	174.2	169.4	0	0	112.9	R137 V184 Y185 I186 S252 R254	R137-E188 IonicContact CZ-OE1 3.46Å; R137-E188 IonicContact CZ-OE2 3.73Å; R137-E188 IonicContact NE-OE1 3.31Å; R137-E188 PolarHBondContact NE-OE1 3.38Å; R137-E188 IonicContact NE-OE2 2.89Å; R137-E188 PolarHBondContact NE-OE2 3.36Å; R137-E188 IonicContact NH2-OE1 2.78Å; R137-E188 PolarHBondContact NH2-OE1 3.44Å; R137-E188 IonicContact NH2-OE2 3.79Å; V184-E188 HydrophobicContact CG1-CG 4.32Å; V184-E188 WeakPolarHBondContact CG1-OE1 3.44Å; V184-E188 WeakPolarHBondContact O-CB 3.32Å; V184-E188 VanDerWaalsContact O-CG 3.31Å; V184-E188 WeakPolarHBondContact O-CG 3.44Å; V184-E188 PolarHBondContact O-N 2.91Å; Y185-E188 PolarHBondContact O-N 2.91Å; I186-E188 PolarHBondContact O-N 3.41Å; E188-S252 WeakPolarHBondContact CB-OG 3.3Å; E188-S252 VanDerWaalsContact CD-OG 3.29Å; E188-S252 WeakPolarHBondContact OE2-CB 3.48Å; E188-S252 PolarHBondContact OE2-OG 3.14Å; E188-R254 HydrophobicContact CG-CB 4.21Å
189	V	84.4	Confident	79.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-85.9	-31.8	177.3	173.8	0	0	0	0	111.8	A74 Y185 I186 M272 R273	A74-V189 HydrophobicContact CB-CG1 4.41Å; Y185-V189 HydrophobicContact CD1-CG2 4.24Å; Y185-V189 HydrophobicContact CD2-CG2 4.15Å; Y185-V189 HydrophobicContact CE1-CG2 3.9Å; Y185-V189 HydrophobicContact CE2-CG2 3.82Å; Y185-V189 HydrophobicContact CG-CG2 4.37Å; Y185-V189 WeakPolarHBondContact O-CB 3.38Å; Y185-V189 VanDerWaalsContact O-CG2 3.29Å; Y185-V189 WeakPolarHBondContact O-CG2 3.32Å; Y185-V189 PolarHBondContact O-N 2.85Å; I186-V189 PolarHBondContact O-N 3.39Å; V189-M272 HydrophobicContact CB-CE 4.48Å; V189-M272 HydrophobicContact CB-SD 4.28Å; V189-M272 HydrophobicContact CG1-CE 4.09Å; V189-M272 HydrophobicContact CG1-CG 4.49Å; V189-M272 HydrophobicContact CG1-SD 3.82Å; V189-M272 HydrophobicContact CG2-CE 3.93Å; V189-M272 HydrophobicContact CG2-SD 4.3Å; V189-R273 PolarHBondContact O-NH1 3.36Å
190	S	81.6	Confident	79	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	-70.8	142.9	-176.1	-65	0	0	0	0	112.8	I186 L198 R273	I186-S190 WeakPolarHBondContact O-CB 3.24Å; I186-S190 PolarHBondContact O-N 3.25Å; I186-S190 PolarHBondContact O-OG 2.94Å; S190-L198 WeakPolarHBondContact OG-CD1 3.28Å; S190-R273 PolarHBondContact O-NH2 3.36Å
191	P	78.8	Confident	78.9	Confident	7 Å²	7	38.8 Å²	38.8	5%	0.045	22%	0.215	C	C	.	.			trans	-68.1	151.3	172	31.1	-35.3	0	0	0	110.5	T67 N193 L194 R195	T67-P191 HydrophobicContact CG2-CG 4.05Å; P191-N193 VanDerWaalsContact CB-OD1 3.29Å; P191-N193 WeakPolarHBondContact CB-OD1 3.29Å; P191-N193 WeakPolarHBondContact CG-OD1 3.36Å; P191-N193 PolarHBondContact O-N 3.44Å; P191-N193 VanDerWaalsContact O-N 3.14Å; P191-L194 HydrophobicContact CG-CB 4.15Å; P191-L194 HydrophobicContact CG-CD1 4.36Å; P191-L194 HydrophobicContact CG-CG 4.37Å; P191-L194 PolarHBondContact O-N 3.29Å; P191-L194 VanDerWaalsContact O-N 3.11Å; P191-R195 PolarHBondContact O-N 2.73Å
192	P	70.7	Confident	78.7	Confident	88 Å²	88	39.2 Å²	39.2	57%	0.571	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.6	-173.3	-26.4	34.1	0	0	0	114.3
193	N	72.3	Confident	78.4	Confident	121 Å²	121	41.7 Å²	41.7	65%	0.647	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.9	-178.9	62.9	-23.6	0	0	0	114.4	P191	P191-N193 VanDerWaalsContact CB-OD1 3.29Å; P191-N193 WeakPolarHBondContact CB-OD1 3.29Å; P191-N193 WeakPolarHBondContact CG-OD1 3.36Å; P191-N193 PolarHBondContact O-N 3.44Å; P191-N193 VanDerWaalsContact O-N 3.14Å
194	L	70.4	Confident	78.5	Confident	25 Å²	25	41.5 Å²	41.5	13%	0.131	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-6.8	-178.2	-61.6	-176.6	0	0	0	113.8	T67 Y72 P191 G196 R197 L198	T67-L194 HydrophobicContact CG2-CD1 3.76Å; Y72-L194 WeakPolarHBondContact OH-CD1 3.25Å; P191-L194 HydrophobicContact CG-CB 4.15Å; P191-L194 HydrophobicContact CG-CD1 4.36Å; P191-L194 HydrophobicContact CG-CG 4.37Å; P191-L194 PolarHBondContact O-N 3.29Å; P191-L194 VanDerWaalsContact O-N 3.11Å; L194-G196 VanDerWaalsContact C-N 3.33Å; L194-G196 PolarHBondContact O-N 3.35Å; L194-R197 PolarHBondContact O-N 3.32Å; L194-L198 HydrophobicContact CB-CD1 4.08Å; L194-L198 HydrophobicContact CB-CG 4.34Å; L194-L198 PolarHBondContact O-N 2.97Å
195	R	73.3	Confident	78.8	Confident	102 Å²	102	42.1 Å²	42.1	39%	0.385	23%	0.228	S	C	.	.	H	α-helix	trans	-48.5	-51.3	-175.6	-176	-179.9	-68.9	153.6	3.5	112.7	A187 P191 R197 L198 V199	A187-R195 HydrophobicContact CB-CG 4.2Å; A187-R195 PolarHBondContact O-NE 3.5Å; P191-R195 PolarHBondContact O-N 2.73Å; R195-R197 PolarHBondContact O-N 2.82Å; R195-L198 PolarHBondContact O-N 3.42Å; R195-V199 HydrophobicContact CG-CG2 4.47Å; R195-V199 VanDerWaalsContact O-CG2 3.28Å; R195-V199 WeakPolarHBondContact O-CG2 3.36Å; R195-V199 PolarHBondContact O-N 2.87Å
196	G	66.6	Low	78.8	Confident	50 Å²	50	43.6 Å²	43.6	52%	0.515	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-45.2	179.9	0	0	0	0	0	112.6	L194 L198 V199 T200	L194-G196 VanDerWaalsContact C-N 3.33Å; L194-G196 PolarHBondContact O-N 3.35Å; G196-L198 PolarHBondContact O-N 3.21Å; G196-V199 PolarHBondContact O-N 3Å; G196-T200 PolarHBondContact O-N 3.17Å; G196-T200 PolarHBondContact O-OG1 3.03Å
197	R	72.1	Confident	79.1	Confident	140 Å²	140	44 Å²	44	53%	0.528	24%	0.239	S	C	.	.	H	α-helix	trans	-63.9	-43.4	179	-170.6	175.6	71.8	-178.2	3.8	112	Y72 L194 R195 T200 I201	Y72-R197 PolarHBondContact OH-NH2 3.01Å; L194-R197 PolarHBondContact O-N 3.32Å; R195-R197 PolarHBondContact O-N 2.82Å; R197-T200 PolarHBondContact O-N 3.47Å; R197-I201 WeakPolarHBondContact O-CG1 3.15Å; R197-I201 PolarHBondContact O-N 2.9Å; R197-I201 VanDerWaalsContact O-N 3.15Å
198	L	75.7	Confident	79.6	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-36.5	-179	-67.9	173.9	0	0	0	112.1	V71 Y72 I186 S190 L194 R195 G196 I201	V71-L198 HydrophobicContact CG1-CD1 4.27Å; Y72-L198 HydrophobicContact CD1-CD2 4.29Å; Y72-L198 HydrophobicContact CE1-CD2 4.32Å; I186-L198 HydrophobicContact CG2-CB 3.87Å; S190-L198 WeakPolarHBondContact OG-CD1 3.28Å; L194-L198 HydrophobicContact CB-CD1 4.08Å; L194-L198 HydrophobicContact CB-CG 4.34Å; L194-L198 PolarHBondContact O-N 2.97Å; R195-L198 PolarHBondContact O-N 3.42Å; G196-L198 PolarHBondContact O-N 3.21Å; L198-I201 HydrophobicContact CD2-CD1 3.92Å; L198-I201 WeakPolarHBondContact O-CB 3.5Å; L198-I201 PolarHBondContact O-N 3.48Å
199	V	74.4	Confident	80.1	Confident	45 Å²	45	42 Å²	42	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-65.2	-40.6	172.5	173	0	0	0	0	110.9	I186 A187 R195 G196 I201 N202	I186-V199 HydrophobicContact CG2-CG2 4.06Å; A187-V199 HydrophobicContact CB-CG2 4.26Å; R195-V199 HydrophobicContact CG-CG2 4.47Å; R195-V199 VanDerWaalsContact O-CG2 3.28Å; R195-V199 WeakPolarHBondContact O-CG2 3.36Å; R195-V199 PolarHBondContact O-N 2.87Å; G196-V199 PolarHBondContact O-N 3Å; V199-I201 VanDerWaalsContact C-N 3.27Å; V199-I201 PolarHBondContact O-N 2.99Å; V199-N202 VanDerWaalsContact O-CB 3.26Å; V199-N202 WeakPolarHBondContact O-CB 3.31Å; V199-N202 PolarHBondContact O-N 3.41Å
200	T	75.2	Confident	80.6	Confident	44 Å²	44	42.6 Å²	42.6	27%	0.27	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-30.7	176.3	-58.7	0	0	0	0	113.3	G196 R197 N202 T203 L204 V373	G196-T200 PolarHBondContact O-N 3.17Å; G196-T200 PolarHBondContact O-OG1 3.03Å; R197-T200 PolarHBondContact O-N 3.47Å; T200-N202 PolarHBondContact O-N 3.02Å; T200-T203 WeakPolarHBondContact O-CB 3.39Å; T200-T203 PolarHBondContact O-N 3.41Å; T200-T203 VanDerWaalsContact O-N 3.12Å; T200-L204 PolarHBondContact O-N 3.5Å; T200-L204 VanDerWaalsContact O-N 3.15Å; T200-V373 HydrophobicContact CG2-CB 4.14Å; T200-V373 HydrophobicContact CG2-CG1 3.61Å; T200-V373 HydrophobicContact CG2-CG2 3.35Å
201	I	79.5	Confident	81.2	Confident	53 Å²	53	44.5 Å²	44.5	27%	0.272	24%	0.238	S	C	.	.	H	α-helix	trans	-59	-36	172.9	-68.9	170.8	0	0	0	111	A79 R197 L198 V199 T203 L204 F205	A79-I201 HydrophobicContact CB-CG2 4.35Å; R197-I201 WeakPolarHBondContact O-CG1 3.15Å; R197-I201 PolarHBondContact O-N 2.9Å; R197-I201 VanDerWaalsContact O-N 3.15Å; L198-I201 HydrophobicContact CD2-CD1 3.92Å; L198-I201 WeakPolarHBondContact O-CB 3.5Å; L198-I201 PolarHBondContact O-N 3.48Å; V199-I201 VanDerWaalsContact C-N 3.27Å; V199-I201 PolarHBondContact O-N 2.99Å; I201-T203 VanDerWaalsContact C-N 3.32Å; I201-T203 PolarHBondContact O-N 3.31Å; I201-L204 WeakPolarHBondContact O-CB 3.32Å; I201-L204 PolarHBondContact O-N 3.41Å; I201-L204 VanDerWaalsContact O-N 3.14Å; I201-F205 HydrophobicContact CG2-CD2 3.72Å; I201-F205 HydrophobicContact CG2-CE2 3.61Å; I201-F205 VanDerWaalsContact O-CD2 3.29Å; I201-F205 WeakPolarHBondContact O-CD2 3.37Å; I201-F205 PolarHBondContact O-N 3.03Å
202	N	82.4	Confident	82	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.053	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-42.3	175.7	-175.1	62.5	0	0	0	111.8	G82 V182 I186 V199 T200 L204 F205 I206	G82-N202 WeakPolarHBondContact CA-OD1 3.43Å; G82-N202 PolarHBondContact N-OD1 3.05Å; V182-N202 WeakPolarHBondContact CG1-OD1 3.29Å; I186-N202 HydrophobicContact CD1-CB 3.97Å; V199-N202 VanDerWaalsContact O-CB 3.26Å; V199-N202 WeakPolarHBondContact O-CB 3.31Å; V199-N202 PolarHBondContact O-N 3.41Å; T200-N202 PolarHBondContact O-N 3.02Å; N202-L204 VanDerWaalsContact C-N 3.3Å; N202-L204 PolarHBondContact O-N 2.85Å; N202-F205 WeakPolarHBondContact O-CB 3.29Å; N202-F205 PolarHBondContact O-N 3.18Å; N202-F205 VanDerWaalsContact O-N 3.13Å; N202-I206 WeakPolarHBondContact O-CG1 3.45Å; N202-I206 PolarHBondContact O-N 3.47Å
203	T	81.3	Confident	83.2	Confident	52 Å²	52	45.1 Å²	45.1	32%	0.319	23%	0.231	S	C	.	.	H	α-helix	trans	-61.9	-38.1	175.1	-53.4	0	0	0	0	112.1	T200 I201 F205 I206 T207 T369	T200-T203 WeakPolarHBondContact O-CB 3.39Å; T200-T203 PolarHBondContact O-N 3.41Å; T200-T203 VanDerWaalsContact O-N 3.12Å; I201-T203 VanDerWaalsContact C-N 3.32Å; I201-T203 PolarHBondContact O-N 3.31Å; T203-F205 VanDerWaalsContact C-N 3.33Å; T203-I206 WeakPolarHBondContact O-CB 3.29Å; T203-I206 PolarHBondContact O-N 3.08Å; T203-T207 PolarHBondContact O-N 3.13Å; T203-T207 PolarHBondContact O-OG1 2.95Å; T203-T369 HydrophobicContact CG2-CG2 4.36Å
204	L	84.8	Confident	84.2	Confident	34 Å²	34	39.7 Å²	39.7	18%	0.178	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-35.5	174	-63.9	177.4	0	0	0	112.5	T200 I201 N202 I206 T207 G208 T369 L370	T200-L204 PolarHBondContact O-N 3.5Å; T200-L204 VanDerWaalsContact O-N 3.15Å; I201-L204 WeakPolarHBondContact O-CB 3.32Å; I201-L204 PolarHBondContact O-N 3.41Å; I201-L204 VanDerWaalsContact O-N 3.14Å; N202-L204 VanDerWaalsContact C-N 3.3Å; N202-L204 PolarHBondContact O-N 2.85Å; L204-I206 VanDerWaalsContact C-N 3.32Å; L204-T207 PolarHBondContact O-OG1 3.38Å; L204-G208 PolarHBondContact O-N 3.21Å; L204-T369 HydrophobicContact CD2-CG2 4.22Å; L204-L370 HydrophobicContact CD1-CD2 3.65Å; L204-L370 HydrophobicContact CD2-CD2 3.37Å; L204-L370 HydrophobicContact CD2-CG 3.83Å; L204-L370 HydrophobicContact CG-CD2 4.13Å
205	F	90.3	Very high	85.4	Confident	56 Å²	56	40.7 Å²	40.7	25%	0.246	21%	0.209	C	C	.	.	H	α-helix	trans	-67.8	-33.4	174.7	-88.5	-121.1	0	0	0	111.7	T76 A79 L80 F83 I201 N202 T203 G209	T76-F205 HydrophobicContact CG2-CZ 4.18Å; A79-F205 HydrophobicContact CB-CB 4.15Å; A79-F205 HydrophobicContact CB-CD1 3.67Å; A79-F205 HydrophobicContact CB-CD2 3.88Å; A79-F205 HydrophobicContact CB-CE1 3.99Å; A79-F205 HydrophobicContact CB-CE2 4.17Å; A79-F205 HydrophobicContact CB-CG 3.62Å; A79-F205 HydrophobicContact CB-CZ 4.24Å; A79-F205 VanDerWaalsContact O-CB 3.29Å; A79-F205 WeakPolarHBondContact O-CB 3.49Å; A79-F205 VanDerWaalsContact O-CD1 3.3Å; A79-F205 WeakPolarHBondContact O-CD1 3.25Å; L80-F205 HydrophobicContact CD2-CE1 4.29Å; F83-F205 VanDerWaalsContact CA-O 3.31Å; F83-F205 WeakPolarHBondContact CA-O 3.45Å; F83-F205 HydrophobicContact CB-CB 4.3Å; F83-F205 HydrophobicContact CB-CD1 4.04Å; I201-F205 HydrophobicContact CG2-CD2 3.72Å; I201-F205 HydrophobicContact CG2-CE2 3.61Å; I201-F205 VanDerWaalsContact O-CD2 3.29Å; I201-F205 WeakPolarHBondContact O-CD2 3.37Å; I201-F205 PolarHBondContact O-N 3.03Å; N202-F205 WeakPolarHBondContact O-CB 3.29Å; N202-F205 PolarHBondContact O-N 3.18Å; N202-F205 VanDerWaalsContact O-N 3.13Å; T203-F205 VanDerWaalsContact C-N 3.33Å; F205-G209 PolarHBondContact O-N 3.3Å
206	I	90.1	Very high	86.4	Confident	33 Å²	33	37.8 Å²	37.8	17%	0.169	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-54.9	173.4	-63	167.3	0	0	0	110.6	G82 F85 G86 N202 T203 L204 G208 G209 Q210	G82-I206 WeakPolarHBondContact O-CA 3.3Å; G82-I206 VanDerWaalsContact O-CG1 3.31Å; G82-I206 WeakPolarHBondContact O-CG1 3.44Å; F85-I206 HydrophobicContact CD1-CD1 3.96Å; F85-I206 HydrophobicContact CD1-CG1 4.02Å; F85-I206 HydrophobicContact CD1-CG2 3.71Å; F85-I206 HydrophobicContact CE1-CD1 4.46Å; F85-I206 HydrophobicContact CE1-CG2 4.06Å; G86-I206 WeakPolarHBondContact CA-O 3.44Å; N202-I206 WeakPolarHBondContact O-CG1 3.45Å; N202-I206 PolarHBondContact O-N 3.47Å; T203-I206 WeakPolarHBondContact O-CB 3.29Å; T203-I206 PolarHBondContact O-N 3.08Å; L204-I206 VanDerWaalsContact C-N 3.32Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.35Å; I206-G209 PolarHBondContact O-N 3.49Å; I206-Q210 PolarHBondContact O-N 3Å; I206-Q210 VanDerWaalsContact O-N 3.12Å
207	T	91.2	Very high	87.7	Confident	11 Å²	11	35.5 Å²	35.5	7%	0.067	18%	0.177	C	C	.	.	H	α-helix	trans	-70.7	-30.2	-178.5	55.5	0	0	0	0	112.4	T203 L204 Q210 F211 F366 T369	T203-T207 PolarHBondContact O-N 3.13Å; T203-T207 PolarHBondContact O-OG1 2.95Å; L204-T207 PolarHBondContact O-OG1 3.38Å; T207-Q210 PolarHBondContact O-N 3.19Å; T207-F211 PolarHBondContact O-N 3.37Å; T207-F211 VanDerWaalsContact O-N 3.16Å; T207-F366 WeakPolarHBondContact OG1-CD2 3.32Å; T207-T369 HydrophobicContact CG2-CG2 4.1Å
208	G	92.9	Very high	88.7	Confident	5 Å²	5	28.8 Å²	28.8	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-44.6	169.7	0	0	0	0	0	112	L204 I206 Q210 F211 F212	L204-G208 PolarHBondContact O-N 3.21Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.35Å; G208-Q210 VanDerWaalsContact C-N 3.3Å; G208-Q210 PolarHBondContact O-N 2.86Å; G208-F211 PolarHBondContact O-N 3.36Å; G208-F212 WeakPolarHBondContact O-CD2 3.05Å; G208-F212 PolarHBondContact O-N 2.99Å
209	G	94.4	Very high	89.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-42.6	175.5	0	0	0	0	0	112.5	F83 G86 F205 I206 A213	F83-G209 VanDerWaalsContact CD2-CA 3.49Å; G86-G209 VanDerWaalsContact C-C 3.5Å; F205-G209 PolarHBondContact O-N 3.3Å; I206-G209 PolarHBondContact O-N 3.49Å; G209-A213 VanDerWaalsContact O-CB 3.23Å; G209-A213 WeakPolarHBondContact O-CB 3.13Å; G209-A213 PolarHBondContact O-N 3.44Å
210	Q	94.2	Very high	90.4	Very high	15 Å²	15	31.9 Å²	31.9	7%	0.07	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-49.4	174.5	-68.9	172.5	-21.7	0	0	111.6	G86 T89 I206 T207 G208 A213 S214 M336 N365	G86-Q210 VanDerWaalsContact O-CA 3.3Å; G86-Q210 WeakPolarHBondContact O-CA 3.34Å; G86-Q210 WeakPolarHBondContact O-CG 3.4Å; G86-Q210 PolarHBondContact O-N 2.89Å; T89-Q210 HydrophobicContact CG2-CG 4.27Å; T89-Q210 VanDerWaalsContact CG2-NE2 3.33Å; I206-Q210 PolarHBondContact O-N 3Å; I206-Q210 VanDerWaalsContact O-N 3.12Å; T207-Q210 PolarHBondContact O-N 3.19Å; G208-Q210 VanDerWaalsContact C-N 3.3Å; G208-Q210 PolarHBondContact O-N 2.86Å; Q210-A213 PolarHBondContact O-N 3.42Å; Q210-S214 PolarHBondContact O-N 2.87Å; Q210-S214 PolarHBondContact O-OG 2.97Å; Q210-S214 VanDerWaalsContact O-OG 3.09Å; Q210-M336 HydrophobicContact CB-CE 4.22Å; Q210-M336 HydrophobicContact CG-CE 4.27Å; Q210-N365 PolarHBondContact OE1-ND2 3.39Å
211	F	94.8	Very high	91.1	Very high	40 Å²	40	30.8 Å²	30.8	18%	0.175	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-50.5	179.2	167.8	-115.9	0	0	0	112.4	T207 G208 A213 S214 V215 F363 F366	T207-F211 PolarHBondContact O-N 3.37Å; T207-F211 VanDerWaalsContact O-N 3.16Å; G208-F211 PolarHBondContact O-N 3.36Å; F211-A213 VanDerWaalsContact C-N 3.31Å; F211-A213 PolarHBondContact O-N 2.92Å; F211-S214 PolarHBondContact O-N 3.29Å; F211-V215 HydrophobicContact CD2-CG2 4.07Å; F211-V215 HydrophobicContact CE1-CG2 4.47Å; F211-V215 HydrophobicContact CE2-CG2 3.55Å; F211-V215 HydrophobicContact CZ-CG2 3.79Å; F211-V215 WeakPolarHBondContact O-CG2 3.37Å; F211-V215 PolarHBondContact O-N 2.97Å; F211-F363 HydrophobicContact CD2-CB 3.62Å; F211-F363 AromaticContact CD2-CD2 3.98Å; F211-F363 HydrophobicContact CD2-CD2 3.98Å; F211-F363 HydrophobicContact CD2-CG 4.3Å; F211-F363 HydrophobicContact CE1-CD2 4.25Å; F211-F363 HydrophobicContact CE2-CB 3.64Å; F211-F363 AromaticContact CE2-CD2 3.61Å; F211-F363 HydrophobicContact CE2-CD2 3.61Å; F211-F363 HydrophobicContact CE2-CG 4.01Å; F211-F363 HydrophobicContact CG-CD2 4.45Å; F211-F363 AromaticContact CZ-CD2 3.75Å; F211-F363 HydrophobicContact CZ-CD2 3.75Å; F211-F363 HydrophobicContact CZ-CE2 4.45Å; F211-F366 HydrophobicContact CB-CB 4.34Å
212	F	95.2	Very high	91.5	Very high	108 Å²	108	34.6 Å²	34.6	47%	0.474	18%	0.177	S	C	.	.	H	α-helix	trans	-63.9	-36.8	-179.7	-78.3	-70.3	0	0	0	112.2	F83 G208 V215 I216	F83-F212 HydrophobicContact CE2-CB 4.15Å; F83-F212 AromaticContact CE2-CD2 3.85Å; F83-F212 HydrophobicContact CE2-CD2 3.85Å; F83-F212 HydrophobicContact CE2-CG 4.32Å; F83-F212 HydrophobicContact CZ-CB 4.06Å; G208-F212 WeakPolarHBondContact O-CD2 3.05Å; G208-F212 PolarHBondContact O-N 2.99Å; F212-V215 PolarHBondContact O-N 3.44Å; F212-I216 WeakPolarHBondContact O-CG1 3.29Å; F212-I216 PolarHBondContact O-N 3.3Å
213	A	95.6	Very high	91.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-46.8	173.2	0	0	0	0	0	112	Y87 V91 G209 Q210 F211 V215 I216 D217	Y87-A213 HydrophobicContact CD1-CB 4.27Å; Y87-A213 HydrophobicContact CD2-CB 3.78Å; Y87-A213 HydrophobicContact CE1-CB 4.48Å; Y87-A213 HydrophobicContact CE2-CB 4.08Å; Y87-A213 HydrophobicContact CG-CB 3.9Å; Y87-A213 WeakPolarHBondContact O-CB 3.31Å; V91-A213 HydrophobicContact CB-CB 4.03Å; G209-A213 VanDerWaalsContact O-CB 3.23Å; G209-A213 WeakPolarHBondContact O-CB 3.13Å; G209-A213 PolarHBondContact O-N 3.44Å; Q210-A213 PolarHBondContact O-N 3.42Å; F211-A213 VanDerWaalsContact C-N 3.31Å; F211-A213 PolarHBondContact O-N 2.92Å; A213-V215 VanDerWaalsContact C-N 3.26Å; A213-V215 PolarHBondContact O-N 2.86Å; A213-I216 WeakPolarHBondContact O-CB 3.1Å; A213-I216 PolarHBondContact O-N 3.45Å; A213-I216 VanDerWaalsContact O-N 3.09Å; A213-D217 PolarHBondContact O-N 2.87Å
214	S	93.9	Very high	91.1	Very high	6 Å²	6	45 Å²	45	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-28.2	177.8	-56.3	0	0	0	0	113.2	Q210 F211 G218 S359	Q210-S214 PolarHBondContact O-N 2.87Å; Q210-S214 PolarHBondContact O-OG 2.97Å; Q210-S214 VanDerWaalsContact O-OG 3.09Å; F211-S214 PolarHBondContact O-N 3.29Å; S214-G218 PolarHBondContact O-N 3.29Å; S214-G218 VanDerWaalsContact O-N 3.12Å; S214-S359 PolarHBondContact O-OG 3.26Å
215	V	95.3	Very high	90.8	Very high	47 Å²	47	51.8 Å²	51.8	29%	0.285	25%	0.25	S	C	.	.	H	α-helix	trans	-71.7	-39.4	171.9	172.8	0	0	0	0	111.2	F211 F212 A213 D217 G218 A219	F211-V215 HydrophobicContact CD2-CG2 4.07Å; F211-V215 HydrophobicContact CE1-CG2 4.47Å; F211-V215 HydrophobicContact CE2-CG2 3.55Å; F211-V215 HydrophobicContact CZ-CG2 3.79Å; F211-V215 WeakPolarHBondContact O-CG2 3.37Å; F211-V215 PolarHBondContact O-N 2.97Å; F212-V215 PolarHBondContact O-N 3.44Å; A213-V215 VanDerWaalsContact C-N 3.26Å; A213-V215 PolarHBondContact O-N 2.86Å; V215-D217 VanDerWaalsContact C-N 3.33Å; V215-G218 PolarHBondContact O-N 3.09Å; V215-A219 WeakPolarHBondContact O-CB 3.43Å; V215-A219 PolarHBondContact O-N 3.44Å
216	I	95	Very high	90.4	Very high	41 Å²	41	52.3 Å²	52.3	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-42.5	174	-72.6	163.4	0	0	0	110.1	Y87 F212 A213 G218 A219 F220 L234	Y87-I216 HydrophobicContact CE2-CD1 3.64Å; F212-I216 WeakPolarHBondContact O-CG1 3.29Å; F212-I216 PolarHBondContact O-N 3.3Å; A213-I216 WeakPolarHBondContact O-CB 3.1Å; A213-I216 PolarHBondContact O-N 3.45Å; A213-I216 VanDerWaalsContact O-N 3.09Å; I216-G218 VanDerWaalsContact C-N 3.34Å; I216-G218 PolarHBondContact O-N 2.98Å; I216-A219 PolarHBondContact O-N 2.89Å; I216-F220 HydrophobicContact CG2-CD2 3.76Å; I216-F220 HydrophobicContact CG2-CE2 4.11Å; I216-F220 WeakPolarHBondContact O-CD2 3.46Å; I216-F220 PolarHBondContact O-N 2.83Å; I216-L234 HydrophobicContact CG2-CD1 3.75Å
217	D	94	Very high	90.3	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-47.7	173.2	-69.4	-13.9	0	0	0	111.3	V91 G94 A213 V215 A219 F220 S221 M231 I355	V91-D217 WeakPolarHBondContact CA-OD2 3.24Å; V91-D217 VanDerWaalsContact CG2-OD1 3.27Å; V91-D217 WeakPolarHBondContact CG2-OD1 3.34Å; V91-D217 VanDerWaalsContact O-OD2 3.13Å; G94-D217 WeakPolarHBondContact CA-OD2 3.15Å; G94-D217 PolarHBondContact N-OD2 2.98Å; G94-D217 VanDerWaalsContact N-OD2 3.07Å; A213-D217 PolarHBondContact O-N 2.87Å; V215-D217 VanDerWaalsContact C-N 3.33Å; D217-A219 PolarHBondContact O-N 2.9Å; D217-F220 PolarHBondContact O-N 2.77Å; D217-S221 VanDerWaalsContact O-CB 3.24Å; D217-S221 WeakPolarHBondContact O-CB 3.4Å; D217-S221 PolarHBondContact O-N 3.35Å; D217-M231 HydrophobicContact CB-SD 4.31Å; D217-M231 VanDerWaalsContact O-CE 3.23Å; D217-M231 WeakPolarHBondContact O-CE 3.5Å; D217-M231 WeakPolarHBondContact OD1-CB 3.33Å; D217-M231 WeakPolarHBondContact OD1-CG 3.45Å; D217-I355 HydrophobicContact CB-CG2 3.72Å
218	G	92.1	Very high	90.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-45.3	175.6	0	0	0	0	0	112.7	S214 V215 I216 S221 Y222	S214-G218 PolarHBondContact O-N 3.29Å; S214-G218 VanDerWaalsContact O-N 3.12Å; V215-G218 PolarHBondContact O-N 3.09Å; I216-G218 VanDerWaalsContact C-N 3.34Å; I216-G218 PolarHBondContact O-N 2.98Å; G218-S221 PolarHBondContact O-N 2.95Å; G218-S221 PolarHBondContact O-OG 3.38Å; G218-Y222 WeakPolarHBondContact O-CD2 3.31Å; G218-Y222 WeakPolarHBondContact O-CE2 3.36Å
219	A	93.4	Very high	90.3	Very high	55 Å²	55	53 Å²	53	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-43	-179.6	0	0	0	0	0	113.1	V215 I216 D217	V215-A219 WeakPolarHBondContact O-CB 3.43Å; V215-A219 PolarHBondContact O-N 3.44Å; I216-A219 PolarHBondContact O-N 2.89Å; D217-A219 PolarHBondContact O-N 2.9Å
220	F	93.1	Very high	90.2	Very high	59 Å²	59	59.1 Å²	59.1	26%	0.259	28%	0.277	S	S	.	.	H	α-helix	trans	-85.2	-8.5	-179.2	-75.2	-93	0	0	0	113.1	I216 D217 Y222 L223 Y230 M231 L234	I216-F220 HydrophobicContact CG2-CD2 3.76Å; I216-F220 HydrophobicContact CG2-CE2 4.11Å; I216-F220 WeakPolarHBondContact O-CD2 3.46Å; I216-F220 PolarHBondContact O-N 2.83Å; D217-F220 PolarHBondContact O-N 2.77Å; F220-Y222 PolarHBondContact O-N 3.43Å; F220-L223 HydrophobicContact CD1-CD1 3.62Å; F220-L223 HydrophobicContact CE1-CD1 4.2Å; F220-L223 PolarHBondContact O-N 3.22Å; F220-L223 VanDerWaalsContact O-N 3.17Å; F220-Y230 VanDerWaalsContact CD1-CB 3.45Å; F220-Y230 HydrophobicContact CD1-CD2 4.24Å; F220-Y230 AromaticContact CD1-CG 3.98Å; F220-Y230 HydrophobicContact CD1-CG 3.98Å; F220-Y230 HydrophobicContact CE1-CD1 4.39Å; F220-Y230 HydrophobicContact CE1-CD2 4.43Å; F220-Y230 AromaticContact CE1-CG 3.9Å; F220-Y230 HydrophobicContact CE1-CG 3.9Å; F220-M231 HydrophobicContact CB-CE 3.77Å; F220-M231 HydrophobicContact CB-CG 3.88Å; F220-L234 HydrophobicContact CD2-CD1 4.25Å; F220-L234 HydrophobicContact CE2-CD1 3.53Å; F220-L234 HydrophobicContact CZ-CD1 3.79Å
221	S	89.6	Confident	90.2	Very high	20 Å²	20	58.4 Å²	58.4	14%	0.14	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23	175.3	72.7	0	0	0	0	113.6	D217 G218 L223 M231	D217-S221 VanDerWaalsContact O-CB 3.24Å; D217-S221 WeakPolarHBondContact O-CB 3.4Å; D217-S221 PolarHBondContact O-N 3.35Å; G218-S221 PolarHBondContact O-N 2.95Å; G218-S221 PolarHBondContact O-OG 3.38Å; S221-L223 VanDerWaalsContact C-N 3.26Å; S221-L223 PolarHBondContact O-N 2.97Å; S221-M231 VanDerWaalsContact N-CE 3.29Å
222	Y	88.1	Confident	90.2	Very high	134 Å²	134	56.7 Å²	56.7	53%	0.525	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.5	177.3	-66.4	-82.3	0	0	0	113.2	G218 F220 K224 K352 W356	G218-Y222 WeakPolarHBondContact O-CD2 3.31Å; G218-Y222 WeakPolarHBondContact O-CE2 3.36Å; F220-Y222 PolarHBondContact O-N 3.43Å; Y222-K224 PolarHBondContact O-N 3.47Å; Y222-K352 HydrophobicContact CD1-CD 4.13Å; Y222-K352 HydrophobicContact CE1-CD 4.11Å; Y222-W356 HydrophobicContact CE2-CZ2 4.43Å; Y222-W356 AromaticContact CE2-NE1 3.61Å; Y222-W356 AromaticContact CZ-NE1 3.81Å; Y222-W356 PolarHBondContact OH-NE1 3.39Å
223	L	86.4	Confident	90.1	Very high	89 Å²	89	52.1 Å²	52.1	47%	0.466	25%	0.25	S	C	.	.			trans	-80.1	105.1	177.2	-66.3	171.9	0	0	0	110.1	F220 S221 K225 Y230	F220-L223 HydrophobicContact CD1-CD1 3.62Å; F220-L223 HydrophobicContact CE1-CD1 4.2Å; F220-L223 PolarHBondContact O-N 3.22Å; F220-L223 VanDerWaalsContact O-N 3.17Å; S221-L223 VanDerWaalsContact C-N 3.26Å; S221-L223 PolarHBondContact O-N 2.97Å; L223-K225 PolarHBondContact O-N 3.36Å; L223-Y230 HydrophobicContact CD1-CD2 4.41Å
224	K	69.1	Low	90	Very high	192 Å²	192	54.3 Å²	54.3	84%	0.835	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.3	179.9	-78.5	-169.8	174.6	-169.9	0	113.9	Y222	Y222-K224 PolarHBondContact O-N 3.47Å
225	K	77.4	Confident	90	Very high	176 Å²	176	54.5 Å²	54.5	77%	0.765	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	132.1	179.1	-68.1	-173.5	178.9	-177.1	0	110	L223 G227	L223-K225 PolarHBondContact O-N 3.36Å; K225-G227 PolarHBondContact O-N 3.13Å
226	D	82.4	Confident	90	Very high	67 Å²	67	54 Å²	54	36%	0.358	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	12.1	170.4	-64.6	-54.3	0	0	0	117.1	W228 R229 Y230	D226-W228 VanDerWaalsContact C-N 3.27Å; D226-W228 PolarHBondContact O-N 2.71Å; D226-R229 HydrophobicContact CB-CG 4.25Å; D226-R229 VanDerWaalsContact O-CB 3.31Å; D226-R229 WeakPolarHBondContact O-CB 3.26Å; D226-R229 PolarHBondContact O-N 3.15Å; D226-R229 WeakPolarHBondContact OD1-CD 3.45Å; D226-R229 IonicContact OD1-CZ 3.49Å; D226-R229 IonicContact OD1-NE 2.92Å; D226-R229 PolarHBondContact OD1-NE 2.97Å; D226-R229 IonicContact OD1-NH2 2.75Å; D226-Y230 WeakPolarHBondContact O-CD2 3.46Å
227	G	87.6	Confident	90	Very high	3 Å²	3	56.6 Å²	56.6	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-54.5	-40.3	179.1	0	0	0	0	0	113.7	K225 R229 Y230 M231	K225-G227 PolarHBondContact O-N 3.13Å; G227-R229 PolarHBondContact O-N 3.41Å; G227-Y230 PolarHBondContact O-N 3.44Å; G227-Y230 VanDerWaalsContact O-N 3.13Å; G227-M231 WeakPolarHBondContact O-CG 3.34Å; G227-M231 PolarHBondContact O-N 2.94Å; G227-M231 VanDerWaalsContact O-N 3.14Å
228	W	91	Very high	90	Very high	1 Å²	1	57.3 Å²	57.3	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-26.4	178	67.3	-95.4	0	0	0	113.6	P98 L99 Q102 M103 A158 L164 D226 Y230 M231 L232	P98-W228 HydrophobicContact CB-CB 4.49Å; P98-W228 HydrophobicContact CG-CB 4.09Å; L99-W228 HydrophobicContact CD2-CD2 3.58Å; L99-W228 HydrophobicContact CD2-CE3 3.49Å; L99-W228 VanDerWaalsContact CD2-CE3 3.49Å; L99-W228 HydrophobicContact CD2-CG 4.11Å; L99-W228 HydrophobicContact CD2-CH2 4.24Å; L99-W228 HydrophobicContact CD2-CZ2 4.33Å; L99-W228 HydrophobicContact CD2-CZ3 3.84Å; L99-W228 HydrophobicContact CG-CB 4.32Å; L99-W228 HydrophobicContact CG-CD2 4.18Å; L99-W228 HydrophobicContact CG-CE3 4.21Å; L99-W228 HydrophobicContact CG-CG 4.25Å; Q102-W228 VanDerWaalsContact OE1-CD1 3.23Å; M103-W228 HydrophobicContact CE-CH2 3.89Å; M103-W228 HydrophobicContact CE-CZ2 3.59Å; A158-W228 HydrophobicContact CB-CH2 4.31Å; L164-W228 HydrophobicContact CD1-CZ3 3.99Å; D226-W228 VanDerWaalsContact C-N 3.27Å; D226-W228 PolarHBondContact O-N 2.71Å; W228-Y230 VanDerWaalsContact C-N 3.33Å; W228-M231 HydrophobicContact CB-SD 4.41Å; W228-M231 PolarHBondContact O-N 3.26Å; W228-L232 HydrophobicContact CE3-CD1 4.06Å; W228-L232 HydrophobicContact CZ3-CD1 4.38Å; W228-L232 PolarHBondContact O-N 3.38Å; W228-L232 VanDerWaalsContact O-N 3.13Å
229	R	93.6	Very high	90.1	Very high	58 Å²	58	57.3 Å²	57.3	22%	0.219	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-40.1	176	-62.3	-176.4	179.3	-81.8	-6.4	110.8	A156 A158 D226 G227 G233	A156-R229 VanDerWaalsContact O-CD 3.32Å; A156-R229 WeakPolarHBondContact O-CD 3.23Å; A156-R229 WeakPolarHBondContact O-CG 3.39Å; A156-R229 PolarHBondContact O-NH1 3.3Å; A158-R229 VanDerWaalsContact O-CZ 3.24Å; A158-R229 PolarHBondContact O-NH1 3.43Å; A158-R229 PolarHBondContact O-NH2 3.35Å; D226-R229 HydrophobicContact CB-CG 4.25Å; D226-R229 VanDerWaalsContact O-CB 3.31Å; D226-R229 WeakPolarHBondContact O-CB 3.26Å; D226-R229 PolarHBondContact O-N 3.15Å; D226-R229 WeakPolarHBondContact OD1-CD 3.45Å; D226-R229 IonicContact OD1-CZ 3.49Å; D226-R229 IonicContact OD1-NE 2.92Å; D226-R229 PolarHBondContact OD1-NE 2.97Å; D226-R229 IonicContact OD1-NH2 2.75Å; G227-R229 PolarHBondContact O-N 3.41Å; R229-G233 WeakPolarHBondContact O-CA 3.15Å; R229-G233 PolarHBondContact O-N 3.26Å
230	Y	92.8	Very high	90.2	Very high	129 Å²	129	57.7 Å²	57.7	51%	0.506	28%	0.275	S	S	.	.	H	α-helix	trans	-71.1	-40.6	176.4	-64	-76.1	0	0	0	111.5	F220 L223 D226 G227 W228 L232 G233 L234	F220-Y230 VanDerWaalsContact CD1-CB 3.45Å; F220-Y230 HydrophobicContact CD1-CD2 4.24Å; F220-Y230 AromaticContact CD1-CG 3.98Å; F220-Y230 HydrophobicContact CD1-CG 3.98Å; F220-Y230 HydrophobicContact CE1-CD1 4.39Å; F220-Y230 HydrophobicContact CE1-CD2 4.43Å; F220-Y230 AromaticContact CE1-CG 3.9Å; F220-Y230 HydrophobicContact CE1-CG 3.9Å; L223-Y230 HydrophobicContact CD1-CD2 4.41Å; D226-Y230 WeakPolarHBondContact O-CD2 3.46Å; G227-Y230 PolarHBondContact O-N 3.44Å; G227-Y230 VanDerWaalsContact O-N 3.13Å; W228-Y230 VanDerWaalsContact C-N 3.33Å; Y230-L232 PolarHBondContact O-N 3.31Å; Y230-G233 PolarHBondContact O-N 2.92Å; Y230-L234 WeakPolarHBondContact O-CB 3.28Å; Y230-L234 WeakPolarHBondContact O-CG 2.92Å; Y230-L234 PolarHBondContact O-N 3.25Å
231	M	94.3	Very high	90.2	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-52.1	-55.8	175.1	-64.6	171.6	-173.4	0	0	110.8	Y87 V91 A95 D217 F220 S221 G227 W228	Y87-M231 PolarHBondContact OH-O 2.87Å; V91-M231 VanDerWaalsContact CG2-C 3.47Å; V91-M231 HydrophobicContact CG2-CB 3.83Å; V91-M231 VanDerWaalsContact CG2-O 3.26Å; V91-M231 WeakPolarHBondContact CG2-O 3.23Å; A95-M231 HydrophobicContact CB-CB 4.35Å; A95-M231 HydrophobicContact CB-SD 4.04Å; D217-M231 HydrophobicContact CB-SD 4.31Å; D217-M231 VanDerWaalsContact O-CE 3.23Å; D217-M231 WeakPolarHBondContact O-CE 3.5Å; D217-M231 WeakPolarHBondContact OD1-CB 3.33Å; D217-M231 WeakPolarHBondContact OD1-CG 3.45Å; F220-M231 HydrophobicContact CB-CE 3.77Å; F220-M231 HydrophobicContact CB-CG 3.88Å; S221-M231 VanDerWaalsContact N-CE 3.29Å; G227-M231 WeakPolarHBondContact O-CG 3.34Å; G227-M231 PolarHBondContact O-N 2.94Å; G227-M231 VanDerWaalsContact O-N 3.14Å; W228-M231 HydrophobicContact CB-SD 4.41Å; W228-M231 PolarHBondContact O-N 3.26Å
232	L	93.6	Very high	90.4	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-73.4	-35.3	-179.7	-59.3	-179.7	0	0	0	113.3	V91 A95 L99 L155 L164 R168 W228 Y230	V91-L232 HydrophobicContact CB-CD2 4.44Å; V91-L232 HydrophobicContact CG1-CD2 3.69Å; V91-L232 HydrophobicContact CG2-CD2 3.92Å; A95-L232 HydrophobicContact CB-CD2 4.12Å; A95-L232 HydrophobicContact CB-CG 4.38Å; L99-L232 HydrophobicContact CD1-CD1 4.27Å; L155-L232 HydrophobicContact CB-CB 3.98Å; L155-L232 HydrophobicContact CB-CD1 4.17Å; L155-L232 HydrophobicContact CD1-CB 4.41Å; L155-L232 HydrophobicContact CD2-CD1 4.4Å; L164-L232 HydrophobicContact CD1-CD1 4.02Å; R168-L232 VanDerWaalsContact NH2-CD2 3.32Å; W228-L232 HydrophobicContact CE3-CD1 4.06Å; W228-L232 HydrophobicContact CZ3-CD1 4.38Å; W228-L232 PolarHBondContact O-N 3.38Å; W228-L232 VanDerWaalsContact O-N 3.13Å; Y230-L232 PolarHBondContact O-N 3.31Å
233	G	93.6	Very high	90.7	Very high	12 Å²	12	55 Å²	55	12%	0.124	27%	0.266	C	S	.	.	H	α-helix	trans	-73.3	-30.9	-174.7	0	0	0	0	0	114.4	R229 Y230 A235 T236	R229-G233 WeakPolarHBondContact O-CA 3.15Å; R229-G233 PolarHBondContact O-N 3.26Å; Y230-G233 PolarHBondContact O-N 2.92Å; G233-A235 PolarHBondContact O-N 3.47Å; G233-A235 VanDerWaalsContact O-N 3.15Å; G233-T236 VanDerWaalsContact O-CB 3.24Å; G233-T236 WeakPolarHBondContact O-CB 3.39Å; G233-T236 PolarHBondContact O-N 3.05Å; G233-T236 PolarHBondContact O-OG1 3.18Å
234	L	94.4	Very high	91	Very high	47 Å²	47	55 Å²	55	25%	0.246	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.3	-178.6	-79.4	171.3	0	0	0	113.4	Y87 I216 F220 Y230 T236 I237 P238	Y87-L234 WeakPolarHBondContact OH-CB 3.22Å; I216-L234 HydrophobicContact CG2-CD1 3.75Å; F220-L234 HydrophobicContact CD2-CD1 4.25Å; F220-L234 HydrophobicContact CE2-CD1 3.53Å; F220-L234 HydrophobicContact CZ-CD1 3.79Å; Y230-L234 WeakPolarHBondContact O-CB 3.28Å; Y230-L234 WeakPolarHBondContact O-CG 2.92Å; Y230-L234 PolarHBondContact O-N 3.25Å; L234-T236 PolarHBondContact O-N 2.97Å; L234-T236 VanDerWaalsContact O-N 3.13Å; L234-I237 HydrophobicContact CD2-CD1 3.63Å; L234-I237 PolarHBondContact O-N 3.07Å; L234-I237 VanDerWaalsContact O-N 3.09Å; L234-P238 VanDerWaalsContact O-CD 3.28Å; L234-P238 WeakPolarHBondContact O-CD 3.26Å
235	A	93.6	Very high	92.1	Very high	9 Å²	9	46.3 Å²	46.3	7%	0.074	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.5	169	0	0	0	0	0	113.5	Y87 S152 G233 I237 P238 A239	Y87-A235 HydrophobicContact CD1-CB 3.66Å; Y87-A235 HydrophobicContact CE1-CB 3.61Å; Y87-A235 HydrophobicContact CG-CB 4.48Å; S152-A235 VanDerWaalsContact OG-CB 3.29Å; S152-A235 WeakPolarHBondContact OG-CB 3.32Å; G233-A235 PolarHBondContact O-N 3.47Å; G233-A235 VanDerWaalsContact O-N 3.15Å; A235-I237 PolarHBondContact O-N 3.17Å; A235-P238 VanDerWaalsContact O-CD 3.29Å; A235-P238 WeakPolarHBondContact O-CD 3.46Å; A235-P238 WeakPolarHBondContact O-CG 3.21Å; A235-A239 WeakPolarHBondContact O-CB 3.29Å; A235-A239 PolarHBondContact O-N 3Å
236	T	95.1	Very high	92.7	Very high	36 Å²	36	38 Å²	38	22%	0.221	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-33.6	175.7	-48.4	0	0	0	0	111.7	A149 S152 G233 L234 A239 V240	A149-T236 HydrophobicContact CB-CG2 4.29Å; S152-T236 VanDerWaalsContact CB-OG1 3.32Å; S152-T236 WeakPolarHBondContact CB-OG1 3.43Å; G233-T236 VanDerWaalsContact O-CB 3.24Å; G233-T236 WeakPolarHBondContact O-CB 3.39Å; G233-T236 PolarHBondContact O-N 3.05Å; G233-T236 PolarHBondContact O-OG1 3.18Å; L234-T236 PolarHBondContact O-N 2.97Å; L234-T236 VanDerWaalsContact O-N 3.13Å; T236-A239 PolarHBondContact O-N 3.34Å; T236-V240 HydrophobicContact CG2-CG2 4.07Å; T236-V240 WeakPolarHBondContact O-CB 3.42Å; T236-V240 VanDerWaalsContact O-CG2 3.27Å; T236-V240 WeakPolarHBondContact O-CG2 3.36Å; T236-V240 PolarHBondContact O-N 3.44Å
237	I	94.3	Very high	93.1	Very high	97 Å²	97	38.1 Å²	38.1	50%	0.497	20%	0.196	S	C	.	.	H	α-helix	trans	-63.3	-59.6	-177.7	-60.8	174.8	0	0	0	111.5	L234 A235 A239 V240 I241	L234-I237 HydrophobicContact CD2-CD1 3.63Å; L234-I237 PolarHBondContact O-N 3.07Å; L234-I237 VanDerWaalsContact O-N 3.09Å; A235-I237 PolarHBondContact O-N 3.17Å; I237-A239 PolarHBondContact O-N 3.4Å; I237-V240 PolarHBondContact O-N 2.96Å; I237-I241 HydrophobicContact CG2-CD1 3.82Å; I237-I241 VanDerWaalsContact O-CG1 3.31Å; I237-I241 WeakPolarHBondContact O-CG1 3.46Å; I237-I241 PolarHBondContact O-N 3.33Å
238	P	93.9	Very high	93.2	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.104	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-31.8	177.1	21	-30.6	0	0	0	112.6	F83 L84 L234 A235 I241 Q242	F83-P238 HydrophobicContact CD1-CB 4.1Å; F83-P238 HydrophobicContact CD1-CG 4.25Å; F83-P238 HydrophobicContact CE1-CB 4.23Å; F83-P238 HydrophobicContact CE1-CG 4.04Å; L84-P238 HydrophobicContact CD2-CB 3.95Å; L84-P238 HydrophobicContact CD2-CG 3.7Å; L234-P238 VanDerWaalsContact O-CD 3.28Å; L234-P238 WeakPolarHBondContact O-CD 3.26Å; A235-P238 VanDerWaalsContact O-CD 3.29Å; A235-P238 WeakPolarHBondContact O-CD 3.46Å; A235-P238 WeakPolarHBondContact O-CG 3.21Å; P238-I241 PolarHBondContact O-N 3.23Å; P238-Q242 WeakPolarHBondContact O-CB 3.38Å; P238-Q242 PolarHBondContact O-N 3Å
239	A	94.6	Very high	93.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-44	176.6	0	0	0	0	0	112.5	L84 C148 A149 A235 T236 I237 Q242 F243	L84-A239 HydrophobicContact CD1-CB 3.99Å; L84-A239 HydrophobicContact CD2-CB 4Å; C148-A239 HydrophobicContact CB-CB 4.07Å; A149-A239 HydrophobicContact CB-CB 3.93Å; A235-A239 WeakPolarHBondContact O-CB 3.29Å; A235-A239 PolarHBondContact O-N 3Å; T236-A239 PolarHBondContact O-N 3.34Å; I237-A239 PolarHBondContact O-N 3.4Å; A239-Q242 PolarHBondContact O-N 3.48Å; A239-F243 WeakPolarHBondContact O-CB 3.38Å; A239-F243 PolarHBondContact O-N 3.23Å
240	V	95	Very high	92.9	Very high	62 Å²	62	45.1 Å²	45.1	38%	0.376	23%	0.23	S	C	.	.	H	α-helix	trans	-67.9	-40.2	175.6	171.1	0	0	0	0	111.1	A149 T236 I237 Q242 F243 L244	A149-V240 HydrophobicContact CB-CG2 4.24Å; T236-V240 HydrophobicContact CG2-CG2 4.07Å; T236-V240 WeakPolarHBondContact O-CB 3.42Å; T236-V240 VanDerWaalsContact O-CG2 3.27Å; T236-V240 WeakPolarHBondContact O-CG2 3.36Å; T236-V240 PolarHBondContact O-N 3.44Å; I237-V240 PolarHBondContact O-N 2.96Å; V240-Q242 VanDerWaalsContact C-N 3.33Å; V240-Q242 PolarHBondContact O-N 2.9Å; V240-F243 PolarHBondContact O-N 3.43Å; V240-L244 HydrophobicContact CG1-CD1 3.91Å; V240-L244 HydrophobicContact CG1-CG 4.2Å; V240-L244 WeakPolarHBondContact O-CB 3.38Å; V240-L244 WeakPolarHBondContact O-CG 2.95Å; V240-L244 PolarHBondContact O-N 2.85Å
241	I	94.1	Very high	92.8	Very high	81 Å²	81	39.8 Å²	39.8	42%	0.415	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-45.8	175.4	-68	168.4	0	0	0	110.4	F77 L80 I237 P238 G245	F77-I241 HydrophobicContact CD1-CG2 4.46Å; F77-I241 HydrophobicContact CE1-CG2 4.01Å; L80-I241 HydrophobicContact CD1-CB 4.49Å; L80-I241 HydrophobicContact CD1-CG2 3.78Å; I237-I241 HydrophobicContact CG2-CD1 3.82Å; I237-I241 VanDerWaalsContact O-CG1 3.31Å; I237-I241 WeakPolarHBondContact O-CG1 3.46Å; I237-I241 PolarHBondContact O-N 3.33Å; P238-I241 PolarHBondContact O-N 3.23Å; I241-G245 PolarHBondContact O-N 3.18Å
242	Q	93.2	Very high	92.6	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-45.2	176.2	-173	179.7	-0.9	0	0	111.3	L80 G81 I141 S145 P238 A239 V240 L244 G245 F246	L80-Q242 HydrophobicContact CB-CB 4.14Å; L80-Q242 HydrophobicContact CB-CG 4.3Å; L80-Q242 HydrophobicContact CD1-CB 4.27Å; G81-Q242 VanDerWaalsContact CA-OE1 3.31Å; I141-Q242 HydrophobicContact CG2-CG 4.43Å; S145-Q242 VanDerWaalsContact OG-CD 3.25Å; S145-Q242 WeakPolarHBondContact OG-CG 3.36Å; S145-Q242 PolarHBondContact OG-OE1 3.33Å; P238-Q242 WeakPolarHBondContact O-CB 3.38Å; P238-Q242 PolarHBondContact O-N 3Å; A239-Q242 PolarHBondContact O-N 3.48Å; V240-Q242 VanDerWaalsContact C-N 3.33Å; V240-Q242 PolarHBondContact O-N 2.9Å; Q242-L244 PolarHBondContact O-N 2.59Å; Q242-G245 PolarHBondContact O-N 3.49Å; Q242-F246 HydrophobicContact CG-CD2 3.89Å; Q242-F246 HydrophobicContact CG-CE2 4.04Å; Q242-F246 WeakPolarHBondContact O-CD2 3.3Å; Q242-F246 PolarHBondContact O-N 2.79Å
243	F	94.6	Very high	92.4	Very high	73 Å²	73	39.7 Å²	39.7	32%	0.32	21%	0.209	S	C	.	.	H	α-helix	trans	-56.7	-52.2	177.4	-175.2	-92	0	0	0	111.5	L142 A146 A239 V240 G245 F246 L247	L142-F243 HydrophobicContact CB-CD2 4.44Å; L142-F243 HydrophobicContact CB-CE2 4.22Å; L142-F243 HydrophobicContact CD2-CD2 3.82Å; L142-F243 HydrophobicContact CD2-CE2 3.94Å; L142-F243 HydrophobicContact CD2-CG 4.21Å; L142-F243 HydrophobicContact CD2-CZ 4.44Å; L142-F243 VanDerWaalsContact CD2-O 3.25Å; L142-F243 WeakPolarHBondContact CD2-O 3.26Å; L142-F243 WeakPolarHBondContact O-CD2 3.42Å; A146-F243 HydrophobicContact CB-CD2 4.2Å; A146-F243 HydrophobicContact CB-CE2 4.04Å; A239-F243 WeakPolarHBondContact O-CB 3.38Å; A239-F243 PolarHBondContact O-N 3.23Å; V240-F243 PolarHBondContact O-N 3.43Å; F243-G245 VanDerWaalsContact C-N 3.34Å; F243-G245 PolarHBondContact O-N 3Å; F243-F246 PolarHBondContact O-N 3.13Å; F243-L247 HydrophobicContact CD1-CD1 4.41Å; F243-L247 HydrophobicContact CE1-CD1 4.15Å; F243-L247 HydrophobicContact CE1-CD2 4.25Å; F243-L247 HydrophobicContact CE1-CG 4.36Å; F243-L247 HydrophobicContact CZ-CD2 4.48Å; F243-L247 WeakPolarHBondContact O-CG 3.22Å; F243-L247 PolarHBondContact O-N 3.05Å
244	L	93.9	Very high	92.1	Very high	89 Å²	89	42.7 Å²	42.7	47%	0.466	22%	0.217	S	C	.	.	H	α-helix	trans	-63	-39.3	178.6	-67.7	177.2	0	0	0	112	V240 Q242 F246 L247 F248	V240-L244 HydrophobicContact CG1-CD1 3.91Å; V240-L244 HydrophobicContact CG1-CG 4.2Å; V240-L244 WeakPolarHBondContact O-CB 3.38Å; V240-L244 WeakPolarHBondContact O-CG 2.95Å; V240-L244 PolarHBondContact O-N 2.85Å; Q242-L244 PolarHBondContact O-N 2.59Å; L244-F246 PolarHBondContact O-N 2.77Å; L244-L247 HydrophobicContact CD2-CD1 3.98Å; L244-L247 WeakPolarHBondContact O-CB 3.43Å; L244-L247 PolarHBondContact O-N 2.73Å; L244-F248 WeakPolarHBondContact O-CD2 3.43Å
245	G	90.4	Very high	91.8	Very high	10 Å²	10	41.9 Å²	41.9	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-44.9	175.6	0	0	0	0	0	112.5	I241 Q242 F243 L247 F248 L249	I241-G245 PolarHBondContact O-N 3.18Å; Q242-G245 PolarHBondContact O-N 3.49Å; F243-G245 VanDerWaalsContact C-N 3.34Å; F243-G245 PolarHBondContact O-N 3Å; G245-L247 VanDerWaalsContact C-N 3.25Å; G245-L247 PolarHBondContact O-N 2.84Å; G245-F248 PolarHBondContact O-N 3.42Å; G245-F248 VanDerWaalsContact O-N 3.11Å; G245-L249 WeakPolarHBondContact O-CG 3.3Å; G245-L249 PolarHBondContact O-N 3.25Å
246	F	90.9	Very high	91.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-74.1	-10.9	179.8	-86.8	-95.1	0	0	0	114.5	F77 S78 R138 I141 L142 Y185 Q242 F243 L244 F248 L249	F77-F246 HydrophobicContact CB-CE2 4.48Å; S78-F246 WeakPolarHBondContact OG-CZ 3.37Å; R138-F246 HydrophobicContact CG-CD1 4.39Å; R138-F246 PolarHBondContact NE-O 3.35Å; I141-F246 HydrophobicContact CB-CD1 4.07Å; I141-F246 HydrophobicContact CB-CE1 4.06Å; I141-F246 HydrophobicContact CB-CG 4.44Å; I141-F246 HydrophobicContact CB-CZ 4.41Å; I141-F246 HydrophobicContact CD1-CD1 4.24Å; I141-F246 HydrophobicContact CD1-CE1 3.4Å; I141-F246 HydrophobicContact CD1-CZ 3.61Å; I141-F246 HydrophobicContact CG1-CE1 4.31Å; I141-F246 HydrophobicContact CG2-CD1 3.81Å; I141-F246 HydrophobicContact CG2-CD2 3.71Å; I141-F246 HydrophobicContact CG2-CE1 3.81Å; I141-F246 HydrophobicContact CG2-CE2 3.7Å; I141-F246 HydrophobicContact CG2-CG 3.75Å; I141-F246 HydrophobicContact CG2-CZ 3.75Å; L142-F246 HydrophobicContact CD2-CB 3.62Å; L142-F246 HydrophobicContact CG-CB 3.98Å; Y185-F246 AromaticContact CD1-CE1 3.96Å; Y185-F246 HydrophobicContact CD1-CE1 3.96Å; Y185-F246 HydrophobicContact CD1-CZ 4.07Å; Y185-F246 AromaticContact CE1-CE1 3.65Å; Y185-F246 HydrophobicContact CE1-CE1 3.65Å; Y185-F246 AromaticContact CE1-CZ 3.92Å; Y185-F246 HydrophobicContact CE1-CZ 3.92Å; Y185-F246 HydrophobicContact CE2-CE1 4.45Å; Y185-F246 HydrophobicContact CG-CE1 4.48Å; Y185-F246 AromaticContact CZ-CE1 3.92Å; Q242-F246 HydrophobicContact CG-CD2 3.89Å; Q242-F246 HydrophobicContact CG-CE2 4.04Å; Q242-F246 WeakPolarHBondContact O-CD2 3.3Å; Q242-F246 PolarHBondContact O-N 2.79Å; F243-F246 PolarHBondContact O-N 3.13Å; L244-F246 PolarHBondContact O-N 2.77Å; F246-F248 PolarHBondContact O-N 2.78Å; F246-L249 HydrophobicContact CD1-CB 4.41Å; F246-L249 HydrophobicContact CD1-CD1 4.25Å; F246-L249 HydrophobicContact CD2-CD1 4.04Å; F246-L249 HydrophobicContact CE1-CD1 4.24Å; F246-L249 HydrophobicContact CE2-CD1 4.04Å; F246-L249 HydrophobicContact CG-CD1 4.16Å; F246-L249 HydrophobicContact CZ-CD1 4.14Å
247	L	91.1	Very high	91.3	Very high	71 Å²	71	40.7 Å²	40.7	37%	0.372	20%	0.201	S	C	.	.	H	α-helix	trans	-66.5	-28.5	166.7	-65.3	179.2	0	0	0	111.9	R138 L142 F243 L244 G245	R138-L247 PolarHBondContact NH2-O 3.18Å; L142-L247 HydrophobicContact CD1-CD2 4.35Å; L142-L247 HydrophobicContact CD2-CD2 4.01Å; L142-L247 HydrophobicContact CD2-CG 4.39Å; F243-L247 HydrophobicContact CD1-CD1 4.41Å; F243-L247 HydrophobicContact CE1-CD1 4.15Å; F243-L247 HydrophobicContact CE1-CD2 4.25Å; F243-L247 HydrophobicContact CE1-CG 4.36Å; F243-L247 HydrophobicContact CZ-CD2 4.48Å; F243-L247 WeakPolarHBondContact O-CG 3.22Å; F243-L247 PolarHBondContact O-N 3.05Å; L244-L247 HydrophobicContact CD2-CD1 3.98Å; L244-L247 WeakPolarHBondContact O-CB 3.43Å; L244-L247 PolarHBondContact O-N 2.73Å; G245-L247 VanDerWaalsContact C-N 3.25Å; G245-L247 PolarHBondContact O-N 2.84Å
248	F	89.1	Confident	90.8	Very high	177 Å²	177	39.9 Å²	39.9	78%	0.776	20%	0.195	S	C	*	.	H	α-helix	trans	-101.1	-17.4	-179.6	-57.5	-74.6	0	0	0	113.7	L244 G245 F246	L244-F248 WeakPolarHBondContact O-CD2 3.43Å; G245-F248 PolarHBondContact O-N 3.42Å; G245-F248 VanDerWaalsContact O-N 3.11Å; F246-F248 PolarHBondContact O-N 2.78Å
249	L	88.8	Confident	90.5	Very high	12 Å²	12	44.2 Å²	44.2	6%	0.063	21%	0.212	C	C	.	.	S	Bend	trans	-78.6	144.1	179.1	-69.3	168	0	0	0	112.3	F70 A74 F77 R138 G245 F246	F70-L249 HydrophobicContact CE2-CD2 4.2Å; F70-L249 HydrophobicContact CZ-CD2 4.17Å; A74-L249 HydrophobicContact CB-CD2 3.68Å; F77-L249 HydrophobicContact CB-CD1 3.99Å; R138-L249 VanDerWaalsContact CD-O 3.23Å; R138-L249 WeakPolarHBondContact CD-O 3.38Å; R138-L249 PolarHBondContact NE-O 2.96Å; G245-L249 WeakPolarHBondContact O-CG 3.3Å; G245-L249 PolarHBondContact O-N 3.25Å; F246-L249 HydrophobicContact CD1-CB 4.41Å; F246-L249 HydrophobicContact CD1-CD1 4.25Å; F246-L249 HydrophobicContact CD2-CD1 4.04Å; F246-L249 HydrophobicContact CE1-CD1 4.24Å; F246-L249 HydrophobicContact CE2-CD1 4.04Å; F246-L249 HydrophobicContact CG-CD1 4.16Å; F246-L249 HydrophobicContact CZ-CD1 4.14Å
250	P	89.5	Confident	90.1	Very high	19 Å²	19	46.7 Å²	46.7	12%	0.123	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-76.4	162.2	178.7	32.2	-35.9	0	0	0	111.6	F70 Y185 I268 M272	F70-P250 HydrophobicContact CE1-CG 4.21Å; F70-P250 HydrophobicContact CZ-CG 3.81Å; Y185-P250 WeakPolarHBondContact CE2-O 3.14Å; Y185-P250 PolarHBondContact OH-O 2.95Å; P250-I268 HydrophobicContact CB-CD1 3.83Å; P250-I268 HydrophobicContact CB-CG1 3.98Å; P250-I268 HydrophobicContact CB-CG2 3.88Å; P250-I268 HydrophobicContact CG-CG2 4.09Å; P250-M272 HydrophobicContact CG-CE 3.77Å
251	E	91.9	Very high	89.9	Confident	18 Å²	18	47.3 Å²	47.3	8%	0.084	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-71.8	159.5	170.8	-173.3	54.3	-89.6	0	0	111.4	G136 R137 R138 W255 L256	G136-E251 WeakPolarHBondContact CA-OE2 3.44Å; R137-E251 WeakPolarHBondContact CA-OE1 3.31Å; R137-E251 WeakPolarHBondContact CB-OE1 3.45Å; R137-E251 VanDerWaalsContact N-CD 3.33Å; R137-E251 PolarHBondContact N-OE1 3.46Å; R137-E251 PolarHBondContact N-OE2 3.43Å; R138-E251 HydrophobicContact CB-CB 4.43Å; R138-E251 VanDerWaalsContact CB-OE2 3.22Å; R138-E251 WeakPolarHBondContact CB-OE2 3.35Å; R138-E251 PolarHBondContact N-OE1 3.34Å; R138-E251 PolarHBondContact N-OE2 3.25Å; E251-W255 HydrophobicContact CG-CD2 4.25Å; E251-W255 HydrophobicContact CG-CE3 3.47Å; E251-W255 VanDerWaalsContact CG-CE3 3.47Å; E251-W255 HydrophobicContact CG-CZ3 3.9Å; E251-L256 HydrophobicContact CB-CD1 4.44Å; E251-L256 HydrophobicContact CB-CG 4.45Å; E251-L256 HydrophobicContact CG-CG 4.38Å
252	S	90.2	Very high	89.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-56.9	131	176.4	167.9	0	0	0	0	112.4	E188 R254 W255 L256	E188-S252 WeakPolarHBondContact CB-OG 3.3Å; E188-S252 VanDerWaalsContact CD-OG 3.29Å; E188-S252 WeakPolarHBondContact OE2-CB 3.48Å; E188-S252 PolarHBondContact OE2-OG 3.14Å; S252-R254 VanDerWaalsContact C-N 3.29Å; S252-R254 PolarHBondContact O-N 3Å; S252-R254 PolarHBondContact OG-N 2.83Å; S252-W255 PolarHBondContact O-N 3.11Å; S252-W255 PolarHBondContact OG-N 3.1Å; S252-L256 WeakPolarHBondContact O-CG 3.5Å; S252-L256 PolarHBondContact O-N 3.28Å; S252-L256 VanDerWaalsContact O-N 3.13Å
253	P	87.9	Confident	89.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-35.3	178.3	26	-30.5	0	0	0	111.5	W255 L256 I257 L269 M272	P253-W255 PolarHBondContact O-N 2.93Å; P253-L256 PolarHBondContact O-N 3.47Å; P253-I257 VanDerWaalsContact O-CG1 3.29Å; P253-I257 WeakPolarHBondContact O-CG1 3.32Å; P253-I257 PolarHBondContact O-N 3.06Å; P253-L269 HydrophobicContact CB-CB 4.38Å; P253-L269 HydrophobicContact CB-CD1 4.18Å; P253-L269 HydrophobicContact CG-CD1 4.12Å; P253-M272 HydrophobicContact CG-SD 4.18Å
254	R	87.4	Confident	88.9	Confident	76 Å²	76	56.7 Å²	56.7	29%	0.287	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-45	176.7	-175.6	176.3	177	169.2	-0.4	111.6	E188 S252 I257 Q258 I285 I289 E292	E188-R254 HydrophobicContact CG-CB 4.21Å; S252-R254 VanDerWaalsContact C-N 3.29Å; S252-R254 PolarHBondContact O-N 3Å; S252-R254 PolarHBondContact OG-N 2.83Å; R254-I257 PolarHBondContact O-N 3.31Å; R254-Q258 PolarHBondContact O-N 3.43Å; R254-I285 HydrophobicContact CB-CG2 4.27Å; R254-I285 HydrophobicContact CG-CG2 3.99Å; R254-I289 HydrophobicContact CG-CD1 4.18Å; R254-E292 IonicContact CZ-OE1 2.79Å; R254-E292 IonicContact NH2-OE1 2.69Å; R254-E292 PolarHBondContact NH2-OE1 3.43Å; R254-E292 IonicContact NH2-OE2 2.84Å; R254-E292 PolarHBondContact NH2-OE2 2.96Å
255	W	88.4	Confident	88.6	Confident	30 Å²	30	52.4 Å²	52.4	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-38	177.8	-178.2	81.3	0	0	0	112.6	G133 G136 E251 S252 P253 I257 Q258 K259	G133-W255 PolarHBondContact O-NE1 3.41Å; G136-W255 VanDerWaalsContact CA-CE2 3.46Å; E251-W255 HydrophobicContact CG-CD2 4.25Å; E251-W255 HydrophobicContact CG-CE3 3.47Å; E251-W255 VanDerWaalsContact CG-CE3 3.47Å; E251-W255 HydrophobicContact CG-CZ3 3.9Å; S252-W255 PolarHBondContact O-N 3.11Å; S252-W255 PolarHBondContact OG-N 3.1Å; P253-W255 PolarHBondContact O-N 2.93Å; W255-I257 VanDerWaalsContact C-N 3.32Å; W255-I257 PolarHBondContact O-N 3.48Å; W255-Q258 WeakPolarHBondContact O-CB 3.19Å; W255-Q258 PolarHBondContact O-N 2.91Å; W255-K259 HydrophobicContact CD2-CG 4.08Å; W255-K259 HydrophobicContact CE3-CG 4.32Å; W255-K259 HydrophobicContact CH2-CG 4Å; W255-K259 HydrophobicContact CZ2-CD 4.26Å; W255-K259 HydrophobicContact CZ2-CG 3.7Å; W255-K259 HydrophobicContact CZ3-CG 4.28Å; W255-K259 PolarHBondContact O-N 2.62Å
256	L	88.9	Confident	88.4	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-37.9	176.5	-70.9	170.6	0	0	0	112.3	E251 S252 P253 K259 G260 Q261 K264 A265 I268	E251-L256 HydrophobicContact CB-CD1 4.44Å; E251-L256 HydrophobicContact CB-CG 4.45Å; E251-L256 HydrophobicContact CG-CG 4.38Å; S252-L256 WeakPolarHBondContact O-CG 3.5Å; S252-L256 PolarHBondContact O-N 3.28Å; S252-L256 VanDerWaalsContact O-N 3.13Å; P253-L256 PolarHBondContact O-N 3.47Å; L256-K259 PolarHBondContact O-N 2.84Å; L256-G260 PolarHBondContact O-N 3.48Å; L256-Q261 HydrophobicContact CD2-CB 4.28Å; L256-Q261 PolarHBondContact O-N 3.48Å; L256-K264 HydrophobicContact CD1-CB 4.48Å; L256-A265 HydrophobicContact CB-CB 3.82Å; L256-I268 HydrophobicContact CD1-CD1 3.37Å
257	I	88.9	Confident	88.3	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.072	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-45.6	173.5	-65.1	167	0	0	0	110	P253 R254 W255 K259 G260 A265 Y282 I285 R286 I289	P253-I257 VanDerWaalsContact O-CG1 3.29Å; P253-I257 WeakPolarHBondContact O-CG1 3.32Å; P253-I257 PolarHBondContact O-N 3.06Å; R254-I257 PolarHBondContact O-N 3.31Å; W255-I257 VanDerWaalsContact C-N 3.32Å; W255-I257 PolarHBondContact O-N 3.48Å; I257-K259 VanDerWaalsContact C-N 3.25Å; I257-K259 PolarHBondContact O-N 2.86Å; I257-G260 PolarHBondContact O-N 2.95Å; I257-A265 HydrophobicContact CD1-CB 4.42Å; I257-A265 HydrophobicContact CG1-CB 3.63Å; I257-Y282 HydrophobicContact CD1-CD2 3.7Å; I257-Y282 HydrophobicContact CD1-CE2 3.68Å; I257-Y282 HydrophobicContact CG1-CD2 4.18Å; I257-Y282 HydrophobicContact CG1-CE2 3.63Å; I257-I285 HydrophobicContact CD1-CB 4.08Å; I257-I285 HydrophobicContact CD1-CG2 3.71Å; I257-R286 HydrophobicContact CG2-CB 4.17Å; I257-R286 HydrophobicContact CG2-CG 4.46Å; I257-I289 HydrophobicContact CB-CD1 4.07Å; I257-I289 HydrophobicContact CG2-CD1 3.78Å
258	Q	84.9	Confident	88.1	Confident	80 Å²	80	63.6 Å²	63.6	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-58.5	-34.8	177.3	-169.9	179.9	25.8	0	0	113	R254 W255 G260 I289	R254-Q258 PolarHBondContact O-N 3.43Å; W255-Q258 WeakPolarHBondContact O-CB 3.19Å; W255-Q258 PolarHBondContact O-N 2.91Å; Q258-G260 VanDerWaalsContact C-N 3.27Å; Q258-G260 PolarHBondContact O-N 3.24Å; Q258-I289 HydrophobicContact CB-CD1 4.2Å; Q258-I289 HydrophobicContact CB-CG2 4.46Å; Q258-I289 HydrophobicContact CG-CG2 4.23Å
259	K	87	Confident	87.9	Confident	106 Å²	106	55.1 Å²	55.1	46%	0.461	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	5.4	175.4	-67.1	-63.7	-175.2	-175.2	0	114.2	G133 W255 L256 I257 Q261	G133-K259 WeakPolarHBondContact O-CE 3.2Å; G133-K259 PolarHBondContact O-NZ 2.99Å; W255-K259 HydrophobicContact CD2-CG 4.08Å; W255-K259 HydrophobicContact CE3-CG 4.32Å; W255-K259 HydrophobicContact CH2-CG 4Å; W255-K259 HydrophobicContact CZ2-CD 4.26Å; W255-K259 HydrophobicContact CZ2-CG 3.7Å; W255-K259 HydrophobicContact CZ3-CG 4.28Å; W255-K259 PolarHBondContact O-N 2.62Å; L256-K259 PolarHBondContact O-N 2.84Å; I257-K259 VanDerWaalsContact C-N 3.25Å; I257-K259 PolarHBondContact O-N 2.86Å; K259-Q261 VanDerWaalsContact C-N 3.28Å; K259-Q261 PolarHBondContact O-N 2.67Å
260	G	86.3	Confident	87.7	Confident	52 Å²	52	56.7 Å²	56.7	54%	0.536	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	10.7	-179.3	0	0	0	0	0	114.9	L256 I257 Q258 T262	L256-G260 PolarHBondContact O-N 3.48Å; I257-G260 PolarHBondContact O-N 2.95Å; Q258-G260 VanDerWaalsContact C-N 3.27Å; Q258-G260 PolarHBondContact O-N 3.24Å; G260-T262 PolarHBondContact O-N 3.46Å
261	Q	89.6	Confident	87.3	Confident	75 Å²	75	60.8 Å²	60.8	35%	0.35	29%	0.287	S	S	.	.			trans	-84.2	60.5	179.9	-62	-171.1	12.2	0	0	111.8	L256 K259 Q263 K264 A265	L256-Q261 HydrophobicContact CD2-CB 4.28Å; L256-Q261 PolarHBondContact O-N 3.48Å; K259-Q261 VanDerWaalsContact C-N 3.28Å; K259-Q261 PolarHBondContact O-N 2.67Å; Q261-Q263 PolarHBondContact O-N 2.94Å; Q261-K264 HydrophobicContact CB-CB 4.49Å; Q261-K264 PolarHBondContact O-N 3.47Å; Q261-A265 WeakPolarHBondContact O-CB 3.35Å; Q261-A265 PolarHBondContact O-N 2.92Å
262	T	86.3	Confident	86.8	Confident	58 Å²	58	60 Å²	60	36%	0.356	28%	0.284	S	S	.	.	H	α-helix	trans	-57	-44.3	-171.4	51.8	0	0	0	0	114.4	G260 A265 R266 Y282	G260-T262 PolarHBondContact O-N 3.46Å; T262-A265 PolarHBondContact O-N 3.35Å; T262-R266 PolarHBondContact O-N 2.97Å; T262-Y282 VanDerWaalsContact CB-OH 3.27Å; T262-Y282 WeakPolarHBondContact CB-OH 3.44Å; T262-Y282 WeakPolarHBondContact CG2-OH 3.31Å
263	Q	87.6	Confident	86.4	Confident	169 Å²	169	60.6 Å²	60.6	79%	0.79	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-42.7	179.8	-72.2	-173.4	-13.5	0	0	113	Q261 R267	Q261-Q263 PolarHBondContact O-N 2.94Å; Q263-R267 PolarHBondContact O-N 3.36Å
264	K	88.3	Confident	85.8	Confident	127 Å²	127	62 Å²	62	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-68.3	-41.2	177.5	-74.5	-179.5	-177.7	173.7	0	111.2	L256 Q261 R267 I268	L256-K264 HydrophobicContact CD1-CB 4.48Å; Q261-K264 HydrophobicContact CB-CB 4.49Å; Q261-K264 PolarHBondContact O-N 3.47Å; K264-R267 PolarHBondContact O-N 2.92Å; K264-I268 PolarHBondContact O-N 3.35Å
265	A	87	Confident	84.8	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.5	-48	176.5	0	0	0	0	0	111.6	L256 I257 Q261 T262 R267 I268 L269 Y282	L256-A265 HydrophobicContact CB-CB 3.82Å; I257-A265 HydrophobicContact CD1-CB 4.42Å; I257-A265 HydrophobicContact CG1-CB 3.63Å; Q261-A265 WeakPolarHBondContact O-CB 3.35Å; Q261-A265 PolarHBondContact O-N 2.92Å; T262-A265 PolarHBondContact O-N 3.35Å; A265-R267 PolarHBondContact O-N 3.46Å; A265-I268 PolarHBondContact O-N 3.41Å; A265-L269 VanDerWaalsContact O-CB 3.23Å; A265-L269 WeakPolarHBondContact O-CB 3.39Å; A265-L269 PolarHBondContact O-N 3.09Å; A265-Y282 HydrophobicContact CB-CE2 4.21Å
266	R	87.1	Confident	83.8	Confident	111 Å²	111	68.5 Å²	68.5	42%	0.419	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-43	177.4	-75.2	-173.2	178	-152.9	-3.7	112.6	T262 L269 S270 D279 Y282	T262-R266 PolarHBondContact O-N 2.97Å; R266-L269 PolarHBondContact O-N 3.22Å; R266-S270 WeakPolarHBondContact O-CB 3.07Å; R266-S270 PolarHBondContact O-N 3.49Å; R266-S270 PolarHBondContact O-OG 3.09Å; R266-D279 IonicContact CZ-OD1 3.59Å; R266-D279 IonicContact NH1-OD1 3.42Å; R266-D279 PolarHBondContact NH1-OD1 3.34Å; R266-D279 IonicContact NH2-OD1 3.72Å; R266-Y282 HydrophobicContact CG-CD2 3.85Å; R266-Y282 HydrophobicContact CG-CE2 3.89Å; R266-Y282 HydrophobicContact CG-CG 4.41Å
267	R	87.6	Confident	82.9	Confident	180 Å²	180	72.6 Å²	72.6	68%	0.679	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-42.1	177.9	-172.7	-179.9	-172	170.9	3.9	112.8	Q263 K264 A265 S270 Q271	Q263-R267 PolarHBondContact O-N 3.36Å; K264-R267 PolarHBondContact O-N 2.92Å; A265-R267 PolarHBondContact O-N 3.46Å; R267-S270 PolarHBondContact O-OG 3.02Å; R267-Q271 WeakPolarHBondContact O-CG 3.26Å; R267-Q271 PolarHBondContact O-N 3.49Å; R267-Q271 VanDerWaalsContact O-N 3.15Å
268	I	86.8	Confident	82.6	Confident	24 Å²	24	73.2 Å²	73.2	12%	0.123	37%	0.374	C	S	.	.	H	α-helix	trans	-71	-43.3	179.2	-74.5	168.1	0	0	0	110.3	P250 L256 K264 A265 S270 Q271 M272	P250-I268 HydrophobicContact CB-CD1 3.83Å; P250-I268 HydrophobicContact CB-CG1 3.98Å; P250-I268 HydrophobicContact CB-CG2 3.88Å; P250-I268 HydrophobicContact CG-CG2 4.09Å; L256-I268 HydrophobicContact CD1-CD1 3.37Å; K264-I268 PolarHBondContact O-N 3.35Å; A265-I268 PolarHBondContact O-N 3.41Å; I268-S270 VanDerWaalsContact C-N 3.3Å; I268-S270 PolarHBondContact O-N 3Å; I268-Q271 WeakPolarHBondContact O-CB 3.48Å; I268-Q271 PolarHBondContact O-N 3.48Å; I268-Q271 VanDerWaalsContact O-N 3.16Å; I268-M272 HydrophobicContact CG2-CE 3.17Å; I268-M272 HydrophobicContact CG2-CG 4.49Å; I268-M272 HydrophobicContact CG2-SD 4.13Å; I268-M272 WeakPolarHBondContact O-CG 3.31Å; I268-M272 PolarHBondContact O-N 3.26Å
269	L	85.2	Confident	82.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-36.9	178.8	-166.4	58.9	0	0	0	111.1	P253 A265 R266 M272 R273 I278	P253-L269 HydrophobicContact CB-CB 4.38Å; P253-L269 HydrophobicContact CB-CD1 4.18Å; P253-L269 HydrophobicContact CG-CD1 4.12Å; A265-L269 VanDerWaalsContact O-CB 3.23Å; A265-L269 WeakPolarHBondContact O-CB 3.39Å; A265-L269 PolarHBondContact O-N 3.09Å; R266-L269 PolarHBondContact O-N 3.22Å; L269-M272 PolarHBondContact O-N 3.43Å; L269-R273 HydrophobicContact CD1-CG 4.16Å; L269-R273 HydrophobicContact CG-CG 4.43Å; L269-R273 WeakPolarHBondContact O-CB 3.45Å; L269-R273 WeakPolarHBondContact O-CG 3.28Å; L269-R273 PolarHBondContact O-N 3.14Å; L269-I278 HydrophobicContact CB-CG2 3.82Å; L269-I278 HydrophobicContact CD2-CG2 3.29Å; L269-I278 HydrophobicContact CG-CG2 3.42Å; L269-I278 VanDerWaalsContact CG-CG2 3.42Å
270	S	84.5	Confident	82.3	Confident	44 Å²	44	75.6 Å²	75.6	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-64.8	-39	172.5	79.2	0	0	0	0	113.1	R266 R267 I268 M272 G274 I278	R266-S270 WeakPolarHBondContact O-CB 3.07Å; R266-S270 PolarHBondContact O-N 3.49Å; R266-S270 PolarHBondContact O-OG 3.09Å; R267-S270 PolarHBondContact O-OG 3.02Å; I268-S270 VanDerWaalsContact C-N 3.3Å; I268-S270 PolarHBondContact O-N 3Å; S270-M272 VanDerWaalsContact C-N 3.33Å; S270-M272 PolarHBondContact O-N 2.85Å; S270-G274 WeakPolarHBondContact O-CA 3.27Å; S270-G274 PolarHBondContact O-N 2.78Å; S270-I278 VanDerWaalsContact CA-CD1 3.4Å
271	Q	81.9	Confident	82	Confident	106 Å²	106	75.1 Å²	75.1	50%	0.495	37%	0.373	S	S	.	.	H	α-helix	trans	-64.9	-36.6	174.2	-74.5	176.8	-26.9	0	0	112.4	R267 I268	R267-Q271 WeakPolarHBondContact O-CG 3.26Å; R267-Q271 PolarHBondContact O-N 3.49Å; R267-Q271 VanDerWaalsContact O-N 3.15Å; I268-Q271 WeakPolarHBondContact O-CB 3.48Å; I268-Q271 PolarHBondContact O-N 3.48Å; I268-Q271 VanDerWaalsContact O-N 3.16Å
272	M	81.2	Confident	81.8	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-77	-32.7	-179.8	-67.6	177.2	-171.1	0	0	113.5	P68 F70 V71 V189 P250 P253 I268 L269 S270	P68-M272 WeakPolarHBondContact CG-O 3.43Å; F70-M272 HydrophobicContact CD1-CG 4.46Å; F70-M272 HydrophobicContact CE1-CG 4.1Å; V71-M272 WeakPolarHBondContact CG2-O 3.27Å; V189-M272 HydrophobicContact CB-CE 4.48Å; V189-M272 HydrophobicContact CB-SD 4.28Å; V189-M272 HydrophobicContact CG1-CE 4.09Å; V189-M272 HydrophobicContact CG1-CG 4.49Å; V189-M272 HydrophobicContact CG1-SD 3.82Å; V189-M272 HydrophobicContact CG2-CE 3.93Å; V189-M272 HydrophobicContact CG2-SD 4.3Å; P250-M272 HydrophobicContact CG-CE 3.77Å; P253-M272 HydrophobicContact CG-SD 4.18Å; I268-M272 HydrophobicContact CG2-CE 3.17Å; I268-M272 HydrophobicContact CG2-CG 4.49Å; I268-M272 HydrophobicContact CG2-SD 4.13Å; I268-M272 WeakPolarHBondContact O-CG 3.31Å; I268-M272 PolarHBondContact O-N 3.26Å; L269-M272 PolarHBondContact O-N 3.43Å; S270-M272 VanDerWaalsContact C-N 3.33Å; S270-M272 PolarHBondContact O-N 2.85Å
273	R	81.4	Confident	81.9	Confident	11 Å²	11	72.3 Å²	72.3	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-98.1	-9.5	-177.1	-59.2	-64.7	-179.6	-107.2	-1.4	113.5	V189 S190 L269 N275 Q276 I278 E281	V189-R273 PolarHBondContact O-NH1 3.36Å; S190-R273 PolarHBondContact O-NH2 3.36Å; L269-R273 HydrophobicContact CD1-CG 4.16Å; L269-R273 HydrophobicContact CG-CG 4.43Å; L269-R273 WeakPolarHBondContact O-CB 3.45Å; L269-R273 WeakPolarHBondContact O-CG 3.28Å; L269-R273 PolarHBondContact O-N 3.14Å; R273-N275 PolarHBondContact O-N 3.3Å; R273-Q276 HydrophobicContact CB-CB 4.23Å; R273-Q276 PolarHBondContact O-N 2.98Å; R273-I278 HydrophobicContact CB-CG1 4.27Å; R273-E281 IonicContact CZ-OE1 3.68Å; R273-E281 IonicContact CZ-OE2 3.64Å; R273-E281 IonicContact NE-OE1 3.93Å; R273-E281 PolarHBondContact NE-OE1 2.97Å; R273-E281 IonicContact NE-OE2 3.01Å; R273-E281 PolarHBondContact NE-OE2 2.88Å; R273-E281 IonicContact NH2-OE1 3.71Å; R273-E281 PolarHBondContact NH2-OE1 3.3Å; R273-E281 IonicContact NH2-OE2 3.67Å
274	G	76.1	Confident	81.7	Confident	32 Å²	32	68 Å²	68	33%	0.33	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	-119.8	179.5	0	0	0	0	0	111.6	S270	S270-G274 WeakPolarHBondContact O-CA 3.27Å; S270-G274 PolarHBondContact O-N 2.78Å
275	N	65.1	Low	81.5	Confident	176 Å²	176	63.3 Å²	63.3	94%	0.941	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	5	-175.7	-75.6	-5.9	0	0	0	114.5	R273	R273-N275 PolarHBondContact O-N 3.3Å
276	Q	67.9	Low	81.5	Confident	66 Å²	66	68.4 Å²	68.4	31%	0.308	35%	0.347	S	S	.	.	S	Bend	trans	-74.7	150	-178.8	-66.5	-177	-25.5	0	0	112.1	D65 R273 I278	D65-Q276 VanDerWaalsContact CB-NE2 3.33Å; D65-Q276 PolarHBondContact OD2-NE2 2.89Å; R273-Q276 HydrophobicContact CB-CB 4.23Å; R273-Q276 PolarHBondContact O-N 2.98Å; Q276-I278 VanDerWaalsContact O-CD1 3.3Å; Q276-I278 WeakPolarHBondContact O-CD1 3.31Å; Q276-I278 WeakPolarHBondContact O-CG1 3.29Å; Q276-I278 PolarHBondContact O-N 3.33Å; Q276-I278 VanDerWaalsContact O-N 3.13Å
277	S	70.8	Confident	81.4	Confident	91 Å²	91	67.2 Å²	67.2	64%	0.636	35%	0.349	S	S	*	.			trans	-65.4	109	171.9	50.6	0	0	0	0	110.1
278	I	82.8	Confident	81	Confident	27 Å²	27	60.5 Å²	60.5	14%	0.138	33%	0.329	C	S	.	.			trans	-84.9	-21.2	-174.1	-62.8	123.1	0	0	0	112.4	L269 S270 R273 Q276 E280 E281 Y282	L269-I278 HydrophobicContact CB-CG2 3.82Å; L269-I278 HydrophobicContact CD2-CG2 3.29Å; L269-I278 HydrophobicContact CG-CG2 3.42Å; L269-I278 VanDerWaalsContact CG-CG2 3.42Å; S270-I278 VanDerWaalsContact CA-CD1 3.4Å; R273-I278 HydrophobicContact CB-CG1 4.27Å; Q276-I278 VanDerWaalsContact O-CD1 3.3Å; Q276-I278 WeakPolarHBondContact O-CD1 3.31Å; Q276-I278 WeakPolarHBondContact O-CG1 3.29Å; Q276-I278 PolarHBondContact O-N 3.33Å; Q276-I278 VanDerWaalsContact O-N 3.13Å; I278-E280 PolarHBondContact O-N 3.5Å; I278-E281 PolarHBondContact O-N 3.33Å; I278-Y282 VanDerWaalsContact O-CB 3.28Å; I278-Y282 WeakPolarHBondContact O-CB 3.43Å; I278-Y282 PolarHBondContact O-N 2.94Å
279	D	82.8	Confident	80.8	Confident	84 Å²	84	59.9 Å²	59.9	45%	0.449	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-40.4	-170.9	-66.2	-53.6	0	0	0	112.4	R266 Y282 D283	R266-D279 IonicContact CZ-OD1 3.59Å; R266-D279 IonicContact NH1-OD1 3.42Å; R266-D279 PolarHBondContact NH1-OD1 3.34Å; R266-D279 IonicContact NH2-OD1 3.72Å; D279-Y282 PolarHBondContact O-N 3.3Å; D279-D283 WeakPolarHBondContact O-CB 3.43Å; D279-D283 PolarHBondContact O-N 2.88Å
280	E	81.3	Confident	80.7	Confident	153 Å²	153	63.1 Å²	63.1	72%	0.715	34%	0.341	S	S	*	.	H	α-helix	trans	-62.9	-44.6	176.6	-66	-177.9	177.6	0	0	112.6	I278 S284	I278-E280 PolarHBondContact O-N 3.5Å; E280-S284 VanDerWaalsContact O-CB 3.25Å; E280-S284 WeakPolarHBondContact O-CB 3.29Å; E280-S284 PolarHBondContact O-N 3.33Å
281	E	80.9	Confident	80.3	Confident	41 Å²	41	67 Å²	67	19%	0.192	35%	0.354	C	S	.	.	H	α-helix	trans	-68.1	-39.8	177.6	-174.7	176.4	-171.4	0	0	110.8	R273 I278 S284 I285	R273-E281 IonicContact CZ-OE1 3.68Å; R273-E281 IonicContact CZ-OE2 3.64Å; R273-E281 IonicContact NE-OE1 3.93Å; R273-E281 PolarHBondContact NE-OE1 2.97Å; R273-E281 IonicContact NE-OE2 3.01Å; R273-E281 PolarHBondContact NE-OE2 2.88Å; R273-E281 IonicContact NH2-OE1 3.71Å; R273-E281 PolarHBondContact NH2-OE1 3.3Å; R273-E281 IonicContact NH2-OE2 3.67Å; I278-E281 PolarHBondContact O-N 3.33Å; E281-S284 PolarHBondContact O-N 3.18Å; E281-I285 HydrophobicContact CG-CD1 3.95Å; E281-I285 VanDerWaalsContact O-CG1 3.26Å; E281-I285 WeakPolarHBondContact O-CG1 3.49Å; E281-I285 PolarHBondContact O-N 2.97Å
282	Y	86	Confident	79.9	Confident	3 Å²	3	66.1 Å²	66.1	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-49.6	177.5	179.2	-89.9	0	0	0	111.8	I257 T262 A265 R266 I278 D279 S284 I285 R286	I257-Y282 HydrophobicContact CD1-CD2 3.7Å; I257-Y282 HydrophobicContact CD1-CE2 3.68Å; I257-Y282 HydrophobicContact CG1-CD2 4.18Å; I257-Y282 HydrophobicContact CG1-CE2 3.63Å; T262-Y282 VanDerWaalsContact CB-OH 3.27Å; T262-Y282 WeakPolarHBondContact CB-OH 3.44Å; T262-Y282 WeakPolarHBondContact CG2-OH 3.31Å; A265-Y282 HydrophobicContact CB-CE2 4.21Å; R266-Y282 HydrophobicContact CG-CD2 3.85Å; R266-Y282 HydrophobicContact CG-CE2 3.89Å; R266-Y282 HydrophobicContact CG-CG 4.41Å; I278-Y282 VanDerWaalsContact O-CB 3.28Å; I278-Y282 WeakPolarHBondContact O-CB 3.43Å; I278-Y282 PolarHBondContact O-N 2.94Å; D279-Y282 PolarHBondContact O-N 3.3Å; Y282-S284 VanDerWaalsContact C-N 3.35Å; Y282-I285 PolarHBondContact O-N 3.4Å; Y282-R286 WeakPolarHBondContact O-CB 3.45Å; Y282-R286 PolarHBondContact O-N 3.19Å
283	D	86.6	Confident	79.5	Confident	72 Å²	72	71 Å²	71	39%	0.385	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-37.4	179.7	-70.9	-21.4	0	0	0	110.9	D279 R286 N287	D279-D283 WeakPolarHBondContact O-CB 3.43Å; D279-D283 PolarHBondContact O-N 2.88Å; D283-R286 PolarHBondContact O-N 3.03Å; D283-N287 WeakPolarHBondContact O-CB 3.34Å; D283-N287 PolarHBondContact O-N 3.4Å; D283-N287 PolarHBondContact O-ND2 3.35Å; D283-N287 PolarHBondContact O-OD1 2.88Å
284	S	84.4	Confident	79	Confident	78 Å²	78	76.9 Å²	76.9	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-59.9	-47.6	172.8	178	0	0	0	0	112.3	E280 E281 Y282 N287 S288	E280-S284 VanDerWaalsContact O-CB 3.25Å; E280-S284 WeakPolarHBondContact O-CB 3.29Å; E280-S284 PolarHBondContact O-N 3.33Å; E281-S284 PolarHBondContact O-N 3.18Å; Y282-S284 VanDerWaalsContact C-N 3.35Å; S284-N287 PolarHBondContact O-N 3.44Å; S284-S288 PolarHBondContact O-N 3.05Å
285	I	83.6	Confident	78.5	Confident	28 Å²	28	80.4 Å²	80.4	14%	0.144	41%	0.407	C	S	.	.	H	α-helix	trans	-64	-43.3	177.9	-67.3	165.6	0	0	0	110.4	R254 I257 E281 Y282 S288 I289	R254-I285 HydrophobicContact CB-CG2 4.27Å; R254-I285 HydrophobicContact CG-CG2 3.99Å; I257-I285 HydrophobicContact CD1-CB 4.08Å; I257-I285 HydrophobicContact CD1-CG2 3.71Å; E281-I285 HydrophobicContact CG-CD1 3.95Å; E281-I285 VanDerWaalsContact O-CG1 3.26Å; E281-I285 WeakPolarHBondContact O-CG1 3.49Å; E281-I285 PolarHBondContact O-N 2.97Å; Y282-I285 PolarHBondContact O-N 3.4Å; I285-S288 PolarHBondContact O-N 3.01Å; I285-S288 PolarHBondContact O-OG 2.88Å; I285-I289 HydrophobicContact CG2-CD1 3.86Å; I285-I289 WeakPolarHBondContact O-CG1 3.47Å; I285-I289 PolarHBondContact O-N 2.87Å; I285-I289 VanDerWaalsContact O-N 3.1Å
286	R	86.9	Confident	78.5	Confident	108 Å²	108	77.7 Å²	77.7	41%	0.408	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-49.4	178.8	-177.9	-179	-179.5	166	5.8	111.8	I257 Y282 D283 S288 I289 E290	I257-R286 HydrophobicContact CG2-CB 4.17Å; I257-R286 HydrophobicContact CG2-CG 4.46Å; Y282-R286 WeakPolarHBondContact O-CB 3.45Å; Y282-R286 PolarHBondContact O-N 3.19Å; D283-R286 PolarHBondContact O-N 3.03Å; R286-S288 VanDerWaalsContact C-N 3.27Å; R286-S288 PolarHBondContact O-N 3.27Å; R286-I289 PolarHBondContact O-N 3.32Å; R286-I289 VanDerWaalsContact O-N 3.12Å; R286-E290 IonicContact CZ-OE1 3.75Å; R286-E290 IonicContact NE-OE1 2.94Å; R286-E290 PolarHBondContact NE-OE1 3.16Å; R286-E290 IonicContact NH2-OE1 3.71Å; R286-E290 PolarHBondContact O-N 2.76Å
287	N	84.9	Confident	78.3	Confident	86 Å²	86	80.2 Å²	80.2	46%	0.46	42%	0.416	S	S	.	.	H	α-helix	trans	-58.9	-41.5	178	-68.5	-14.4	0	0	0	110.9	D283 S284 I289 E290 E291	D283-N287 WeakPolarHBondContact O-CB 3.34Å; D283-N287 PolarHBondContact O-N 3.4Å; D283-N287 PolarHBondContact O-ND2 3.35Å; D283-N287 PolarHBondContact O-OD1 2.88Å; S284-N287 PolarHBondContact O-N 3.44Å; N287-I289 VanDerWaalsContact C-N 3.32Å; N287-I289 PolarHBondContact O-N 3.35Å; N287-E290 PolarHBondContact O-N 2.72Å; N287-E291 WeakPolarHBondContact O-CB 3.36Å; N287-E291 WeakPolarHBondContact O-CG 3.31Å; N287-E291 PolarHBondContact O-N 2.81Å
288	S	80.4	Confident	77.7	Confident	39 Å²	39	79.9 Å²	79.9	27%	0.273	42%	0.419	S	S	.	.	H	α-helix	trans	-62.3	-35.6	177	74.5	0	0	0	0	113.6	S284 I285 R286 E292	S284-S288 PolarHBondContact O-N 3.05Å; I285-S288 PolarHBondContact O-N 3.01Å; I285-S288 PolarHBondContact O-OG 2.88Å; R286-S288 VanDerWaalsContact C-N 3.27Å; R286-S288 PolarHBondContact O-N 3.27Å; S288-E292 WeakPolarHBondContact O-CB 3.24Å; S288-E292 WeakPolarHBondContact O-CG 3.43Å; S288-E292 PolarHBondContact O-N 3.25Å
289	I	81.3	Confident	76.4	Confident	10 Å²	10	80.5 Å²	80.5	5%	0.051	43%	0.428	C	S	.	.	H	α-helix	trans	-73	-42.5	177.3	-66.9	164	0	0	0	110.5	R254 I257 Q258 I285 R286 N287 E291 E292 E293	R254-I289 HydrophobicContact CG-CD1 4.18Å; I257-I289 HydrophobicContact CB-CD1 4.07Å; I257-I289 HydrophobicContact CG2-CD1 3.78Å; Q258-I289 HydrophobicContact CB-CD1 4.2Å; Q258-I289 HydrophobicContact CB-CG2 4.46Å; Q258-I289 HydrophobicContact CG-CG2 4.23Å; I285-I289 HydrophobicContact CG2-CD1 3.86Å; I285-I289 WeakPolarHBondContact O-CG1 3.47Å; I285-I289 PolarHBondContact O-N 2.87Å; I285-I289 VanDerWaalsContact O-N 3.1Å; R286-I289 PolarHBondContact O-N 3.32Å; R286-I289 VanDerWaalsContact O-N 3.12Å; N287-I289 VanDerWaalsContact C-N 3.32Å; N287-I289 PolarHBondContact O-N 3.35Å; I289-E291 VanDerWaalsContact C-N 3.28Å; I289-E291 PolarHBondContact O-N 3Å; I289-E292 PolarHBondContact O-N 3.23Å; I289-E293 PolarHBondContact O-N 3.14Å
290	E	82.9	Confident	74.9	Confident	68 Å²	68	82.2 Å²	82.2	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-64.2	-34.2	177.5	-70.3	-180	-168.8	0	0	111.7	R286 N287 K294	R286-E290 IonicContact CZ-OE1 3.75Å; R286-E290 IonicContact NE-OE1 2.94Å; R286-E290 PolarHBondContact NE-OE1 3.16Å; R286-E290 IonicContact NH2-OE1 3.71Å; R286-E290 PolarHBondContact O-N 2.76Å; N287-E290 PolarHBondContact O-N 2.72Å; E290-K294 WeakPolarHBondContact O-CB 3.24Å; E290-K294 WeakPolarHBondContact O-CD 3.45Å; E290-K294 WeakPolarHBondContact O-CG 3.5Å; E290-K294 PolarHBondContact O-N 3.31Å; E290-K294 VanDerWaalsContact O-N 3.15Å
291	E	77.6	Confident	74.1	Confident	125 Å²	125	77 Å²	77	58%	0.584	44%	0.442	S	S	*	.	H	α-helix	trans	-67.3	-47	170.5	-75.2	176.1	178.8	0	0	111.9	N287 I289 E293 K294 E295	N287-E291 WeakPolarHBondContact O-CB 3.36Å; N287-E291 WeakPolarHBondContact O-CG 3.31Å; N287-E291 PolarHBondContact O-N 2.81Å; I289-E291 VanDerWaalsContact C-N 3.28Å; I289-E291 PolarHBondContact O-N 3Å; E291-E293 VanDerWaalsContact C-N 3.32Å; E291-E293 PolarHBondContact O-N 3.42Å; E291-K294 PolarHBondContact O-N 3.13Å; E291-E295 WeakPolarHBondContact O-CG 3.14Å; E291-E295 PolarHBondContact O-N 3.34Å
292	E	72.5	Confident	74	Confident	89 Å²	89	79 Å²	79	42%	0.416	46%	0.458	S	S	.	.	H	α-helix	trans	-57.9	-41.8	176.1	-78.9	176	176	0	0	111.9	R254 S288 I289 E295 V296	R254-E292 IonicContact CZ-OE1 2.79Å; R254-E292 IonicContact NH2-OE1 2.69Å; R254-E292 PolarHBondContact NH2-OE1 3.43Å; R254-E292 IonicContact NH2-OE2 2.84Å; R254-E292 PolarHBondContact NH2-OE2 2.96Å; S288-E292 WeakPolarHBondContact O-CB 3.24Å; S288-E292 WeakPolarHBondContact O-CG 3.43Å; S288-E292 PolarHBondContact O-N 3.25Å; I289-E292 PolarHBondContact O-N 3.23Å; E292-E295 PolarHBondContact O-N 3.34Å; E292-V296 WeakPolarHBondContact O-CG2 3.26Å; E292-V296 PolarHBondContact O-N 2.85Å; E292-V296 VanDerWaalsContact O-N 3.1Å
293	E	72.4	Confident	73.7	Confident	105 Å²	105	81.2 Å²	81.2	49%	0.491	47%	0.472	S	S	.	.	H	α-helix	trans	-67.2	-39.5	177.4	-75.5	-176.6	174.2	0	0	112.6	I289 E291 V296 T297	I289-E293 PolarHBondContact O-N 3.14Å; E291-E293 VanDerWaalsContact C-N 3.32Å; E291-E293 PolarHBondContact O-N 3.42Å; E293-V296 PolarHBondContact O-N 3.43Å; E293-T297 PolarHBondContact O-N 2.73Å; E293-T297 PolarHBondContact O-OG1 2.97Å
294	K	72.3	Confident	73.5	Confident	133 Å²	133	80.3 Å²	80.3	58%	0.578	47%	0.466	S	S	*	.	H	α-helix	trans	-65.2	-39.8	174.6	-75.4	169.1	-171.3	167	0	111.6	E290 E291 T297 A298	E290-K294 WeakPolarHBondContact O-CB 3.24Å; E290-K294 WeakPolarHBondContact O-CD 3.45Å; E290-K294 WeakPolarHBondContact O-CG 3.5Å; E290-K294 PolarHBondContact O-N 3.31Å; E290-K294 VanDerWaalsContact O-N 3.15Å; E291-K294 PolarHBondContact O-N 3.13Å; K294-T297 WeakPolarHBondContact CA-OG1 3.39Å; K294-T297 PolarHBondContact O-N 3.49Å; K294-T297 PolarHBondContact O-OG1 2.8Å; K294-A298 WeakPolarHBondContact O-CB 3.22Å; K294-A298 PolarHBondContact O-N 2.69Å
295	E	65.9	Low	73.5	Confident	107 Å²	107	79.8 Å²	79.8	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-64.2	-41.5	176.3	-74.9	-168.4	164.5	0	0	112	E291 E292 T297 A298 A299	E291-E295 WeakPolarHBondContact O-CG 3.14Å; E291-E295 PolarHBondContact O-N 3.34Å; E292-E295 PolarHBondContact O-N 3.34Å; E295-T297 VanDerWaalsContact C-N 3.34Å; E295-T297 PolarHBondContact O-N 3.13Å; E295-A298 PolarHBondContact O-N 3.21Å; E295-A299 VanDerWaalsContact O-CB 3.3Å; E295-A299 WeakPolarHBondContact O-CB 3.25Å; E295-A299 PolarHBondContact O-N 3.25Å; E295-A299 VanDerWaalsContact O-N 3.08Å
296	V	65	Low	73.6	Confident	118 Å²	118	85.7 Å²	85.7	72%	0.715	48%	0.482	S	S	*	.	H	α-helix	trans	-65.3	-37.3	177	172.5	0	0	0	0	111.7	E292 E293	E292-V296 WeakPolarHBondContact O-CG2 3.26Å; E292-V296 PolarHBondContact O-N 2.85Å; E292-V296 VanDerWaalsContact O-N 3.1Å; E293-V296 PolarHBondContact O-N 3.43Å
297	T	63.7	Low	73.6	Confident	120 Å²	120	80.5 Å²	80.5	74%	0.736	46%	0.463	S	S	*	.	H	α-helix	trans	-80.4	-29.5	177.8	31.7	0	0	0	0	113.8	E293 K294 E295	E293-T297 PolarHBondContact O-N 2.73Å; E293-T297 PolarHBondContact O-OG1 2.97Å; K294-T297 WeakPolarHBondContact CA-OG1 3.39Å; K294-T297 PolarHBondContact O-N 3.49Å; K294-T297 PolarHBondContact O-OG1 2.8Å; E295-T297 VanDerWaalsContact C-N 3.34Å; E295-T297 PolarHBondContact O-N 3.13Å
298	A	58.3	Low	73.7	Confident	83 Å²	83	80.5 Å²	80.5	69%	0.686	46%	0.462	S	S	*	.	H	α-helix	trans	-83.1	-20.2	-179.8	0	0	0	0	0	113.7	K294 E295 A300	K294-A298 WeakPolarHBondContact O-CB 3.22Å; K294-A298 PolarHBondContact O-N 2.69Å; E295-A298 PolarHBondContact O-N 3.21Å; A298-A300 PolarHBondContact O-N 3.25Å
299	A	54.3	Low	74.1	Confident	41 Å²	41	83.2 Å²	83.2	34%	0.339	48%	0.481	S	S	.	.			trans	-77.7	117.7	-178.5	0	0	0	0	0	112.5	E295 G301	E295-A299 VanDerWaalsContact O-CB 3.3Å; E295-A299 WeakPolarHBondContact O-CB 3.25Å; E295-A299 PolarHBondContact O-N 3.25Å; E295-A299 VanDerWaalsContact O-N 3.08Å; A299-G301 PolarHBondContact O-N 3.48Å
300	A	51.8	Low	74.3	Confident	120 Å²	120	87.1 Å²	87.1	99%	0.992	50%	0.496	S	S	*	.	S	Bend	trans	-75.1	51.8	175.2	0	0	0	0	0	113.5	A298	A298-A300 PolarHBondContact O-N 3.25Å
301	G	65.4	Low	74.5	Confident	44 Å²	44	86.4 Å²	86.4	45%	0.454	50%	0.497	S	S	.	.	S	Bend	trans	142.3	177	174.8	0	0	0	0	0	114.6	A299 V303	A299-G301 PolarHBondContact O-N 3.48Å; G301-V303 PolarHBondContact O-N 2.76Å
302	P	77.4	Confident	75	Confident	82 Å²	82	80.8 Å²	80.8	53%	0.532	47%	0.472	S	S	.	.			trans	-59.7	133.9	178.8	-22.6	33.2	0	0	0	112	I304 C305 R306	P302-I304 HydrophobicContact CB-CG2 3.78Å; P302-I304 PolarHBondContact O-N 3.41Å; P302-I304 VanDerWaalsContact O-N 3.09Å; P302-C305 WeakPolarHBondContact O-CB 3.23Å; P302-C305 PolarHBondContact O-N 2.92Å; P302-R306 PolarHBondContact O-N 3.41Å
303	V	79.3	Confident	75.7	Confident	49 Å²	49	76.6 Å²	76.6	30%	0.297	45%	0.452	S	S	.	.	H	α-helix	trans	-52.9	-34.4	177.1	178.6	0	0	0	0	111.7	G301 C305 R306 M307 W530 T534	G301-V303 PolarHBondContact O-N 2.76Å; V303-C305 VanDerWaalsContact C-N 3.34Å; V303-C305 PolarHBondContact O-N 3.13Å; V303-R306 PolarHBondContact O-N 2.93Å; V303-M307 HydrophobicContact CG1-CG 4.35Å; V303-M307 HydrophobicContact CG1-SD 4.43Å; V303-M307 WeakPolarHBondContact O-CG 3.42Å; V303-M307 PolarHBondContact O-N 3.14Å; V303-W530 HydrophobicContact CG1-CE3 4.06Å; V303-W530 HydrophobicContact CG1-CZ3 4.1Å; V303-T534 HydrophobicContact CG1-CG2 4.49Å
304	I	82.9	Confident	76.5	Confident	53 Å²	53	77.1 Å²	77.1	27%	0.272	45%	0.45	S	S	.	.	H	α-helix	trans	-60.9	-38.8	176.8	-166.9	66.5	0	0	0	112.9	P302 M307 L308 L317 T534 C538	P302-I304 HydrophobicContact CB-CG2 3.78Å; P302-I304 PolarHBondContact O-N 3.41Å; P302-I304 VanDerWaalsContact O-N 3.09Å; I304-M307 PolarHBondContact O-N 3.49Å; I304-L308 HydrophobicContact CG1-CD1 4.41Å; I304-L308 VanDerWaalsContact O-CG 3.31Å; I304-L308 WeakPolarHBondContact O-CG 3.13Å; I304-L308 PolarHBondContact O-N 3.46Å; I304-L317 HydrophobicContact CD1-CD2 4.44Å; I304-T534 HydrophobicContact CB-CG2 4.05Å; I304-T534 HydrophobicContact CD1-CG2 3.86Å; I304-C538 WeakPolarHBondContact CD1-SG 3.14Å
305	C	84.9	Confident	77.4	Confident	67 Å²	67	73.1 Å²	73.1	45%	0.453	43%	0.431	S	S	.	.	H	α-helix	trans	-66.2	-43.5	177.9	-65.8	0	0	0	0	110.4	P302 V303 M307 L308 S309	P302-C305 WeakPolarHBondContact O-CB 3.23Å; P302-C305 PolarHBondContact O-N 2.92Å; V303-C305 VanDerWaalsContact C-N 3.34Å; V303-C305 PolarHBondContact O-N 3.13Å; C305-M307 VanDerWaalsContact C-N 3.34Å; C305-M307 PolarHBondContact O-N 3.14Å; C305-L308 PolarHBondContact O-N 2.82Å; C305-S309 PolarHBondContact O-N 2.7Å; C305-S309 PolarHBondContact O-OG 2.89Å
306	R	85.7	Confident	78.6	Confident	152 Å²	152	68.1 Å²	68.1	57%	0.574	41%	0.408	S	S	*	.	H	α-helix	trans	-61.1	-42.3	174.9	-173	-179.9	176	-173.2	-2.2	111.7	P302 V303 L308 S309 Y310 W530	P302-R306 PolarHBondContact O-N 3.41Å; V303-R306 PolarHBondContact O-N 2.93Å; R306-L308 VanDerWaalsContact C-N 3.32Å; R306-L308 PolarHBondContact O-N 2.89Å; R306-S309 PolarHBondContact O-N 3.32Å; R306-Y310 WeakPolarHBondContact O-CB 3.24Å; R306-Y310 PolarHBondContact O-N 2.86Å; R306-W530 HydrophobicContact CB-CZ3 4.2Å; R306-W530 HydrophobicContact CG-CH2 3.9Å; R306-W530 HydrophobicContact CG-CZ3 3.86Å
307	M	86.5	Confident	79.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-61.5	-38.3	176.6	-74.9	-176.4	74.2	0	0	112.8	V303 I304 C305 T313 R314 L317 Y527 W530 A531 T534	V303-M307 HydrophobicContact CG1-CG 4.35Å; V303-M307 HydrophobicContact CG1-SD 4.43Å; V303-M307 WeakPolarHBondContact O-CG 3.42Å; V303-M307 PolarHBondContact O-N 3.14Å; I304-M307 PolarHBondContact O-N 3.49Å; C305-M307 VanDerWaalsContact C-N 3.34Å; C305-M307 PolarHBondContact O-N 3.14Å; M307-T313 WeakPolarHBondContact CA-OG1 2.95Å; M307-T313 PolarHBondContact O-OG1 2.81Å; M307-R314 PolarHBondContact O-N 3.48Å; M307-L317 HydrophobicContact CE-CD1 4.25Å; M307-Y527 HydrophobicContact CE-CD1 3.9Å; M307-Y527 HydrophobicContact CE-CE1 3.99Å; M307-W530 HydrophobicContact CG-CH2 4.01Å; M307-W530 HydrophobicContact CG-CZ3 3.8Å; M307-A531 HydrophobicContact CE-CB 3.91Å; M307-A531 HydrophobicContact CG-CB 3.81Å; M307-A531 HydrophobicContact SD-CB 3.76Å; M307-T534 HydrophobicContact SD-CG2 3.84Å
308	L	88	Confident	81.3	Confident	86 Å²	86	61.2 Å²	61.2	45%	0.45	37%	0.365	S	S	.	.	H	α-helix	trans	-75.1	-31.2	179.1	-69.3	172.9	0	0	0	112.8	I304 C305 R306 R314 L317	I304-L308 HydrophobicContact CG1-CD1 4.41Å; I304-L308 VanDerWaalsContact O-CG 3.31Å; I304-L308 WeakPolarHBondContact O-CG 3.13Å; I304-L308 PolarHBondContact O-N 3.46Å; C305-L308 PolarHBondContact O-N 2.82Å; R306-L308 VanDerWaalsContact C-N 3.32Å; R306-L308 PolarHBondContact O-N 2.89Å; L308-R314 WeakPolarHBondContact O-CD 3.49Å; L308-L317 HydrophobicContact CD2-CD2 3.95Å
309	S	87.8	Confident	82.9	Confident	96 Å²	96	57.2 Å²	57.2	67%	0.671	33%	0.332	S	S	*	.	H	α-helix	trans	-75.7	-37.3	176.1	-63.8	0	0	0	0	112.6	C305 R306 P311	C305-S309 PolarHBondContact O-N 2.7Å; C305-S309 PolarHBondContact O-OG 2.89Å; R306-S309 PolarHBondContact O-N 3.32Å; S309-P311 WeakPolarHBondContact O-CD 3.15Å
310	Y	85.8	Confident	84.7	Confident	91 Å²	91	55.3 Å²	55.3	36%	0.357	32%	0.316	S	S	.	.	S	Bend	trans	-83.1	119.2	-177.8	-174.4	-121	0	0	0	111.6	R306 P312 T313 R314 W530 E597	R306-Y310 WeakPolarHBondContact O-CB 3.24Å; R306-Y310 PolarHBondContact O-N 2.86Å; Y310-P312 HydrophobicContact CD1-CB 4.36Å; Y310-P312 HydrophobicContact CD1-CG 4.3Å; Y310-P312 HydrophobicContact CE1-CB 3.84Å; Y310-P312 HydrophobicContact CE1-CG 3.66Å; Y310-P312 HydrophobicContact CE2-CG 4.24Å; Y310-T313 WeakPolarHBondContact CB-OG1 3.43Å; Y310-T313 HydrophobicContact CD1-CG2 3.88Å; Y310-T313 WeakPolarHBondContact CD1-OG1 3.43Å; Y310-T313 HydrophobicContact CE1-CG2 4.47Å; Y310-T313 PolarHBondContact O-N 2.69Å; Y310-T313 PolarHBondContact O-OG1 3.2Å; Y310-R314 WeakPolarHBondContact O-CB 3.3Å; Y310-R314 PolarHBondContact O-N 3.4Å; Y310-W530 HydrophobicContact CD1-CZ2 4.29Å; Y310-E597 WeakPolarHBondContact CE1-OE1 3.48Å
311	P	87.1	Confident	86.8	Confident	53 Å²	53	50.4 Å²	50.4	34%	0.344	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-43.3	-169.5	-22.2	31.2	0	0	0	116	S309 R314 R315	S309-P311 WeakPolarHBondContact O-CD 3.15Å; P311-R314 PolarHBondContact O-N 2.92Å; P311-R315 VanDerWaalsContact O-CG 3.29Å; P311-R315 WeakPolarHBondContact O-CG 3.34Å; P311-R315 PolarHBondContact O-N 3.36Å
312	P	87.5	Confident	88.2	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-46.1	178.1	-26.1	36.9	0	0	0	112.8	Y310 R314 R315 A316 F600 D601	Y310-P312 HydrophobicContact CD1-CB 4.36Å; Y310-P312 HydrophobicContact CD1-CG 4.3Å; Y310-P312 HydrophobicContact CE1-CB 3.84Å; Y310-P312 HydrophobicContact CE1-CG 3.66Å; Y310-P312 HydrophobicContact CE2-CG 4.24Å; P312-R314 VanDerWaalsContact C-N 3.35Å; P312-R314 PolarHBondContact O-N 3.43Å; P312-R315 WeakPolarHBondContact O-CB 3.31Å; P312-R315 PolarHBondContact O-N 3.37Å; P312-A316 PolarHBondContact O-N 3.49Å; P312-F600 HydrophobicContact CB-CB 3.94Å; P312-D601 VanDerWaalsContact CG-OD1 3.26Å; P312-D601 WeakPolarHBondContact CG-OD1 3.26Å
313	T	87	Confident	89	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-67.5	-34.7	177.2	47.1	0	0	0	0	113	M307 Y310 R315 A316 L317 P528 W530 A531	M307-T313 WeakPolarHBondContact CA-OG1 2.95Å; M307-T313 PolarHBondContact O-OG1 2.81Å; Y310-T313 WeakPolarHBondContact CB-OG1 3.43Å; Y310-T313 HydrophobicContact CD1-CG2 3.88Å; Y310-T313 WeakPolarHBondContact CD1-OG1 3.43Å; Y310-T313 HydrophobicContact CE1-CG2 4.47Å; Y310-T313 PolarHBondContact O-N 2.69Å; Y310-T313 PolarHBondContact O-OG1 3.2Å; T313-R315 VanDerWaalsContact C-N 3.31Å; T313-R315 PolarHBondContact O-N 3.28Å; T313-A316 PolarHBondContact O-N 2.68Å; T313-L317 VanDerWaalsContact O-CB 3.32Å; T313-L317 WeakPolarHBondContact O-CB 3.4Å; T313-L317 PolarHBondContact O-N 2.86Å; T313-P528 HydrophobicContact CG2-CG 3.62Å; T313-W530 HydrophobicContact CG2-CH2 3.82Å; T313-W530 HydrophobicContact CG2-CZ2 3.52Å; T313-A531 HydrophobicContact CG2-CB 4.26Å
314	R	90.5	Very high	89.7	Confident	116 Å²	116	42.6 Å²	42.6	44%	0.438	22%	0.218	S	C	.	.	H	α-helix	trans	-62.6	-40.9	173.3	-176.5	179.1	64.3	-159.3	2.9	111	M307 L308 Y310 P311 P312 L317 V318	M307-R314 PolarHBondContact O-N 3.48Å; L308-R314 WeakPolarHBondContact O-CD 3.49Å; Y310-R314 WeakPolarHBondContact O-CB 3.3Å; Y310-R314 PolarHBondContact O-N 3.4Å; P311-R314 PolarHBondContact O-N 2.92Å; P312-R314 VanDerWaalsContact C-N 3.35Å; P312-R314 PolarHBondContact O-N 3.43Å; R314-L317 PolarHBondContact O-N 2.91Å; R314-V318 WeakPolarHBondContact O-CG2 3.24Å; R314-V318 PolarHBondContact O-N 3.37Å
315	R	91.1	Very high	90.4	Very high	49 Å²	49	42.5 Å²	42.5	19%	0.185	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-46.8	176.5	-74.4	169.3	-179.4	162.5	0.2	111.5	P311 P312 T313 L317 V318 V319 F600 D601 N602 L604	P311-R315 VanDerWaalsContact O-CG 3.29Å; P311-R315 WeakPolarHBondContact O-CG 3.34Å; P311-R315 PolarHBondContact O-N 3.36Å; P312-R315 WeakPolarHBondContact O-CB 3.31Å; P312-R315 PolarHBondContact O-N 3.37Å; T313-R315 VanDerWaalsContact C-N 3.31Å; T313-R315 PolarHBondContact O-N 3.28Å; R315-L317 VanDerWaalsContact C-N 3.26Å; R315-L317 PolarHBondContact O-N 3.34Å; R315-V318 PolarHBondContact O-N 2.96Å; R315-V319 WeakPolarHBondContact O-CG2 3.34Å; R315-V319 PolarHBondContact O-N 3.04Å; R315-F600 HydrophobicContact CB-CB 4.34Å; R315-F600 HydrophobicContact CB-CD1 3.97Å; R315-F600 WeakPolarHBondContact CD-O 3.4Å; R315-F600 PolarHBondContact NH1-O 3.24Å; R315-D601 PolarHBondContact NH1-O 3.17Å; R315-N602 VanDerWaalsContact CZ-O 3.25Å; R315-N602 VanDerWaalsContact NH1-C 3.26Å; R315-N602 PolarHBondContact NH1-O 3.48Å; R315-L604 HydrophobicContact CB-CD1 3.52Å; R315-L604 HydrophobicContact CB-CD2 4.39Å; R315-L604 HydrophobicContact CB-CG 3.83Å; R315-L604 HydrophobicContact CG-CD1 3.67Å; R315-L604 HydrophobicContact CG-CG 3.82Å
316	A	90.3	Very high	90.9	Very high	1 Å²	1	40 Å²	40	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-58.1	-40	173.3	0	0	0	0	0	111.7	P312 T313 V319 G320 I526 Y527 F600	P312-A316 PolarHBondContact O-N 3.49Å; T313-A316 PolarHBondContact O-N 2.68Å; A316-V319 PolarHBondContact O-N 3.19Å; A316-G320 PolarHBondContact O-N 3.28Å; A316-I526 VanDerWaalsContact O-CD1 3.31Å; A316-I526 WeakPolarHBondContact O-CD1 3.35Å; A316-Y527 HydrophobicContact CB-CD1 4Å; A316-Y527 HydrophobicContact CB-CE1 4Å; A316-F600 HydrophobicContact CB-CD1 4.31Å; A316-F600 HydrophobicContact CB-CD2 4.01Å; A316-F600 HydrophobicContact CB-CE1 4.23Å; A316-F600 HydrophobicContact CB-CE2 3.93Å; A316-F600 HydrophobicContact CB-CG 4.2Å; A316-F600 HydrophobicContact CB-CZ 4.03Å
317	L	91.7	Very high	91.4	Very high	17 Å²	17	33.1 Å²	33.1	9%	0.089	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-45.5	175.8	-171.1	66.1	0	0	0	111.7	I304 M307 L308 T313 R314 R315 V319 G320 C321 Y527 C538	I304-L317 HydrophobicContact CD1-CD2 4.44Å; M307-L317 HydrophobicContact CE-CD1 4.25Å; L308-L317 HydrophobicContact CD2-CD2 3.95Å; T313-L317 VanDerWaalsContact O-CB 3.32Å; T313-L317 WeakPolarHBondContact O-CB 3.4Å; T313-L317 PolarHBondContact O-N 2.86Å; R314-L317 PolarHBondContact O-N 2.91Å; R315-L317 VanDerWaalsContact C-N 3.26Å; R315-L317 PolarHBondContact O-N 3.34Å; L317-V319 VanDerWaalsContact C-N 3.32Å; L317-V319 PolarHBondContact O-N 2.96Å; L317-G320 PolarHBondContact O-N 3.12Å; L317-C321 WeakPolarHBondContact O-CB 3.26Å; L317-C321 PolarHBondContact O-N 3.32Å; L317-C321 PolarHBondContact O-SG 3.15Å; L317-Y527 HydrophobicContact CB-CE1 4.35Å; L317-Y527 HydrophobicContact CD1-CE1 4.31Å; L317-C538 HydrophobicContact CD1-CB 3.87Å
318	V	93.5	Very high	91.8	Very high	76 Å²	76	33.4 Å²	33.4	46%	0.461	17%	0.174	S	C	.	.	H	α-helix	trans	-58.6	-43.2	175.4	170.1	0	0	0	0	111.5	R314 R315 G322 F580	R314-V318 WeakPolarHBondContact O-CG2 3.24Å; R314-V318 PolarHBondContact O-N 3.37Å; R315-V318 PolarHBondContact O-N 2.96Å; V318-G322 WeakPolarHBondContact O-CA 3.46Å; V318-G322 PolarHBondContact O-N 3.15Å; V318-F580 HydrophobicContact CG1-CE2 4.48Å
319	V	93.2	Very high	92.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-51.3	177.1	175.4	0	0	0	0	111.2	R315 A316 L317 C321 G322 L323 C584 L585 F600 L604	R315-V319 WeakPolarHBondContact O-CG2 3.34Å; R315-V319 PolarHBondContact O-N 3.04Å; A316-V319 PolarHBondContact O-N 3.19Å; L317-V319 VanDerWaalsContact C-N 3.32Å; L317-V319 PolarHBondContact O-N 2.96Å; V319-C321 PolarHBondContact O-N 3.05Å; V319-G322 PolarHBondContact O-N 3.36Å; V319-L323 HydrophobicContact CG1-CD1 4.17Å; V319-L323 HydrophobicContact CG1-CG 4.47Å; V319-L323 VanDerWaalsContact O-CG 3.29Å; V319-L323 WeakPolarHBondContact O-CG 3.28Å; V319-L323 PolarHBondContact O-N 3.03Å; V319-C584 HydrophobicContact CG2-CB 4.44Å; V319-C584 WeakPolarHBondContact CG2-O 3.39Å; V319-L585 HydrophobicContact CG1-CD1 3.96Å; V319-F600 HydrophobicContact CB-CE1 4.44Å; V319-F600 HydrophobicContact CG2-CE1 4.03Å; V319-L604 HydrophobicContact CG2-CD1 4.04Å; V319-L604 HydrophobicContact CG2-CD2 3.92Å
320	G	91.7	Very high	92.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61	-46.5	-178.6	0	0	0	0	0	114	A316 L317 Q324 N523 S539	A316-G320 PolarHBondContact O-N 3.28Å; L317-G320 PolarHBondContact O-N 3.12Å; G320-Q324 WeakPolarHBondContact O-CG 3.48Å; G320-Q324 PolarHBondContact O-N 3.41Å; G320-N523 WeakPolarHBondContact CA-OD1 3.26Å; G320-N523 PolarHBondContact O-ND2 2.81Å; G320-N523 VanDerWaalsContact O-ND2 3.09Å; G320-S539 VanDerWaalsContact C-OG 3.23Å
321	C	94.7	Very high	92.6	Very high	18 Å²	18	21.1 Å²	21.1	12%	0.122	11%	0.108	C	C	.	.	H	α-helix	trans	-65.6	-43.2	175.8	-68.9	0	0	0	0	111.8	L317 V319 Q324 M325 S539 I542	L317-C321 WeakPolarHBondContact O-CB 3.26Å; L317-C321 PolarHBondContact O-N 3.32Å; L317-C321 PolarHBondContact O-SG 3.15Å; V319-C321 PolarHBondContact O-N 3.05Å; C321-Q324 PolarHBondContact O-N 3.33Å; C321-M325 WeakPolarHBondContact O-CB 3.32Å; C321-M325 PolarHBondContact O-N 3.32Å; C321-S539 PolarHBondContact N-OG 3.18Å; C321-I542 HydrophobicContact CB-CD1 3.39Å; C321-I542 WeakPolarHBondContact SG-CD1 3.2Å
322	G	95.8	Very high	92.8	Very high	8 Å²	8	19.3 Å²	19.3	8%	0.082	10%	0.095	C	C	.	.	H	α-helix	trans	-63.5	-42	178.5	0	0	0	0	0	112.6	V318 V319 Q324 M325 F326	V318-G322 WeakPolarHBondContact O-CA 3.46Å; V318-G322 PolarHBondContact O-N 3.15Å; V319-G322 PolarHBondContact O-N 3.36Å; G322-Q324 VanDerWaalsContact C-N 3.34Å; G322-Q324 PolarHBondContact O-N 3.49Å; G322-M325 PolarHBondContact O-N 2.96Å; G322-F326 WeakPolarHBondContact O-CD2 3.35Å; G322-F326 PolarHBondContact O-N 3.05Å
323	L	94.2	Very high	92.8	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-59.2	-44.3	175	-72.7	172.3	0	0	0	112	V319 Q327 T385 P519 V522 V581 L585	V319-L323 HydrophobicContact CG1-CD1 4.17Å; V319-L323 HydrophobicContact CG1-CG 4.47Å; V319-L323 VanDerWaalsContact O-CG 3.29Å; V319-L323 WeakPolarHBondContact O-CG 3.28Å; V319-L323 PolarHBondContact O-N 3.03Å; L323-Q327 WeakPolarHBondContact O-CB 2.98Å; L323-Q327 PolarHBondContact O-N 2.95Å; L323-T385 HydrophobicContact CD2-CG2 4.34Å; L323-P519 HydrophobicContact CB-CB 4.19Å; L323-V522 HydrophobicContact CD1-CB 4.01Å; L323-V522 HydrophobicContact CD1-CG1 3.66Å; L323-V581 HydrophobicContact CD2-CG2 3.95Å; L323-L585 HydrophobicContact CD1-CD1 3.95Å; L323-L585 HydrophobicContact CD2-CD2 4.35Å
324	Q	94.8	Very high	93	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-68.4	-38.7	179.1	-68.8	-70.8	20.4	0	0	112.3	G320 C321 G322 Q327 Q328 N523 S539 N543	G320-Q324 WeakPolarHBondContact O-CG 3.48Å; G320-Q324 PolarHBondContact O-N 3.41Å; C321-Q324 PolarHBondContact O-N 3.33Å; G322-Q324 VanDerWaalsContact C-N 3.34Å; G322-Q324 PolarHBondContact O-N 3.49Å; Q324-Q327 WeakPolarHBondContact O-CB 3.33Å; Q324-Q328 PolarHBondContact O-N 3.21Å; Q324-N523 WeakPolarHBondContact CG-ND2 3.23Å; Q324-S539 WeakPolarHBondContact CB-O 3.49Å; Q324-S539 WeakPolarHBondContact CG-O 2.99Å; Q324-N543 HydrophobicContact CB-CB 4Å; Q324-N543 HydrophobicContact CG-CB 4.36Å; Q324-N543 PolarHBondContact OE1-ND2 2.98Å
325	M	96.3	Very high	93.1	Very high	50 Å²	50	14.2 Å²	14.2	25%	0.246	8%	0.076	C	C	.	.	H	α-helix	trans	-61.4	-52	173.8	179.6	-177	75.1	0	0	111.3	C321 G322 Q327 Q328 L329 I542 F546	C321-M325 WeakPolarHBondContact O-CB 3.32Å; C321-M325 PolarHBondContact O-N 3.32Å; G322-M325 PolarHBondContact O-N 2.96Å; M325-Q327 VanDerWaalsContact C-N 3.3Å; M325-Q327 PolarHBondContact O-N 2.85Å; M325-Q328 PolarHBondContact O-N 3.26Å; M325-Q328 VanDerWaalsContact O-N 3.11Å; M325-L329 HydrophobicContact CE-CD1 4.41Å; M325-L329 HydrophobicContact CG-CD1 3.69Å; M325-L329 HydrophobicContact CG-CG 4.17Å; M325-L329 WeakPolarHBondContact O-CG 3.35Å; M325-L329 PolarHBondContact O-N 2.97Å; M325-L329 HydrophobicContact SD-CD1 4.27Å; M325-I542 HydrophobicContact CB-CG2 3.93Å; M325-F546 HydrophobicContact CB-CD2 4.23Å; M325-F546 HydrophobicContact CB-CE2 4.21Å; M325-F546 HydrophobicContact CG-CD1 4.02Å; M325-F546 HydrophobicContact CG-CD2 3.85Å; M325-F546 HydrophobicContact CG-CE1 3.77Å; M325-F546 HydrophobicContact CG-CE2 3.59Å; M325-F546 HydrophobicContact CG-CG 4.05Å; M325-F546 HydrophobicContact CG-CZ 3.54Å; M325-F546 HydrophobicContact SD-CE1 4.13Å; M325-F546 HydrophobicContact SD-CE2 3.89Å; M325-F546 HydrophobicContact SD-CZ 3.54Å; M325-F546 VanDerWaalsContact SD-CZ 3.54Å
326	F	96.3	Very high	93	Very high	14 Å²	14	12.2 Å²	12.2	6%	0.061	7%	0.069	C	C	.	.	H	α-helix	trans	-68.8	-27.1	-178.8	-74.5	-61.8	0	0	0	113.4	G322 Q328 L329 S330 M576 G577 F580	G322-F326 WeakPolarHBondContact O-CD2 3.35Å; G322-F326 PolarHBondContact O-N 3.05Å; F326-Q328 VanDerWaalsContact C-N 3.31Å; F326-Q328 PolarHBondContact O-N 2.93Å; F326-L329 HydrophobicContact CD1-CD1 4.34Å; F326-L329 HydrophobicContact CE1-CD1 4.49Å; F326-S330 WeakPolarHBondContact O-CB 3.21Å; F326-S330 PolarHBondContact O-N 3.43Å; F326-S330 VanDerWaalsContact O-N 3.1Å; F326-M576 HydrophobicContact CE1-CB 3.92Å; F326-M576 HydrophobicContact CZ-CB 4.31Å; F326-G577 VanDerWaalsContact CG-CA 3.49Å; F326-F580 HydrophobicContact CD2-CB 4.15Å; F326-F580 AromaticContact CD2-CD1 3.76Å; F326-F580 HydrophobicContact CD2-CD1 3.76Å; F326-F580 HydrophobicContact CD2-CE1 4.36Å; F326-F580 HydrophobicContact CD2-CG 4Å; F326-F580 HydrophobicContact CE2-CB 3.59Å; F326-F580 AromaticContact CE2-CD1 3.81Å; F326-F580 HydrophobicContact CE2-CD1 3.81Å; F326-F580 HydrophobicContact CE2-CD2 4.08Å; F326-F580 HydrophobicContact CE2-CE1 4.5Å; F326-F580 AromaticContact CE2-CG 3.55Å; F326-F580 HydrophobicContact CE2-CG 3.55Å; F326-F580 HydrophobicContact CZ-CB 4.24Å
327	Q	94.8	Very high	93	Very high	9 Å²	9	12.5 Å²	12.5	4%	0.042	7%	0.069	C	C	.	.	H	α-helix	trans	-56.4	-48	168.4	-173.4	-174.5	59.3	0	0	110.8	L323 Q324 M325 S330 F511 M515 G516 P519 N543	L323-Q327 WeakPolarHBondContact O-CB 2.98Å; L323-Q327 PolarHBondContact O-N 2.95Å; Q324-Q327 WeakPolarHBondContact O-CB 3.33Å; M325-Q327 VanDerWaalsContact C-N 3.3Å; M325-Q327 PolarHBondContact O-N 2.85Å; Q327-S330 PolarHBondContact O-OG 2.91Å; Q327-F511 HydrophobicContact CG-CE2 4.49Å; Q327-F511 HydrophobicContact CG-CZ 3.88Å; Q327-M515 HydrophobicContact CB-CE 4Å; Q327-M515 PolarHBondContact NE2-O 2.8Å; Q327-G516 PolarHBondContact NE2-O 3.43Å; Q327-P519 HydrophobicContact CB-CG 4.07Å; Q327-P519 HydrophobicContact CG-CG 4.21Å; Q327-N543 PolarHBondContact OE1-ND2 3.08Å
328	Q	95.1	Very high	93.1	Very high	5 Å²	5	11.7 Å²	11.7	2%	0.023	7%	0.065	C	C	.	.	H	α-helix	trans	-76	-42.7	-177.8	-64.3	-61.7	-18.2	0	0	113.1	Q324 M325 F326 S330 G331 N333 N543 F546 N547	Q324-Q328 PolarHBondContact O-N 3.21Å; M325-Q328 PolarHBondContact O-N 3.26Å; M325-Q328 VanDerWaalsContact O-N 3.11Å; F326-Q328 VanDerWaalsContact C-N 3.31Å; F326-Q328 PolarHBondContact O-N 2.93Å; Q328-S330 PolarHBondContact O-N 2.89Å; Q328-G331 PolarHBondContact O-N 3.18Å; Q328-N333 PolarHBondContact NE2-ND2 3.27Å; Q328-N333 VanDerWaalsContact NE2-ND2 3.18Å; Q328-N333 PolarHBondContact OE1-ND2 2.9Å; Q328-N543 WeakPolarHBondContact CG-O 3.46Å; Q328-N543 VanDerWaalsContact NE2-CG 3.3Å; Q328-N543 PolarHBondContact NE2-ND2 3.44Å; Q328-N543 PolarHBondContact NE2-OD1 2.88Å; Q328-F546 HydrophobicContact CB-CB 3.65Å; Q328-F546 HydrophobicContact CG-CB 4.15Å; Q328-N547 HydrophobicContact CG-CB 4.34Å
329	L	94.5	Very high	93	Very high	16 Å²	16	8.2 Å²	8.2	8%	0.084	4%	0.044	C	C	.	.	H	α-helix	trans	-64.1	-22.3	178.2	-69.5	179.1	0	0	0	113.3	M325 F326 G331 F546 I550 F573	M325-L329 HydrophobicContact CE-CD1 4.41Å; M325-L329 HydrophobicContact CG-CD1 3.69Å; M325-L329 HydrophobicContact CG-CG 4.17Å; M325-L329 WeakPolarHBondContact O-CG 3.35Å; M325-L329 PolarHBondContact O-N 2.97Å; M325-L329 HydrophobicContact SD-CD1 4.27Å; F326-L329 HydrophobicContact CD1-CD1 4.34Å; F326-L329 HydrophobicContact CE1-CD1 4.49Å; L329-G331 PolarHBondContact O-N 2.87Å; L329-F546 HydrophobicContact CD1-CD1 4.43Å; L329-F546 HydrophobicContact CD1-CE1 4.25Å; L329-F546 HydrophobicContact CD2-CD1 3.62Å; L329-F546 HydrophobicContact CD2-CE1 3.93Å; L329-F546 HydrophobicContact CG-CD1 3.92Å; L329-F546 HydrophobicContact CG-CE1 4.22Å; L329-I550 HydrophobicContact CD2-CD1 3.91Å; L329-I550 HydrophobicContact CD2-CG1 4.19Å; L329-F573 HydrophobicContact CB-CB 3.9Å; L329-F573 HydrophobicContact CB-CD2 4.14Å; L329-F573 HydrophobicContact CB-CG 4.19Å; L329-F573 HydrophobicContact CD1-CG 4.46Å; L329-F573 HydrophobicContact CD2-CD2 4.13Å; L329-F573 HydrophobicContact CD2-CE2 4.25Å
330	S	93.6	Very high	93	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.9	172.2	75.9	0	0	0	0	113.9	F326 Q327 Q328 Y507 F511	F326-S330 WeakPolarHBondContact O-CB 3.21Å; F326-S330 PolarHBondContact O-N 3.43Å; F326-S330 VanDerWaalsContact O-N 3.1Å; Q327-S330 PolarHBondContact O-OG 2.91Å; Q328-S330 PolarHBondContact O-N 2.89Å; S330-Y507 WeakPolarHBondContact O-CE2 3.5Å; S330-Y507 PolarHBondContact O-OH 3.16Å; S330-F511 VanDerWaalsContact OG-CE2 3.27Å; S330-F511 WeakPolarHBondContact OG-CE2 3.39Å
331	G	92	Very high	93	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	15	168.3	0	0	0	0	0	115.9	Q328 L329 N333 T334 I335	Q328-G331 PolarHBondContact O-N 3.18Å; L329-G331 PolarHBondContact O-N 2.87Å; G331-N333 VanDerWaalsContact C-N 3.34Å; G331-N333 PolarHBondContact O-N 2.99Å; G331-T334 WeakPolarHBondContact O-CB 3.36Å; G331-T334 PolarHBondContact O-N 3.28Å; G331-I335 WeakPolarHBondContact O-CG1 3.04Å; G331-I335 PolarHBondContact O-N 3.5Å
332	I	91.2	Very high	92.9	Very high	14 Å²	14	7.6 Å²	7.6	7%	0.072	4%	0.04	C	C	.	.	H	α-helix	trans	-57.6	-47.1	-176.5	-179.8	62.5	0	0	0	111.8	T334 I335 M336 Y507 L508 F511	I332-T334 VanDerWaalsContact C-N 3.35Å; I332-T334 PolarHBondContact O-N 2.89Å; I332-I335 PolarHBondContact O-N 3.43Å; I332-M336 HydrophobicContact CD1-CG 4.06Å; I332-M336 HydrophobicContact CD1-SD 4.32Å; I332-M336 HydrophobicContact CG1-CG 4.26Å; I332-M336 VanDerWaalsContact O-CG 3.3Å; I332-M336 WeakPolarHBondContact O-CG 3.31Å; I332-M336 PolarHBondContact O-N 3.22Å; I332-Y507 VanDerWaalsContact CA-OH 3.26Å; I332-Y507 WeakPolarHBondContact CA-OH 3.33Å; I332-Y507 HydrophobicContact CD1-CE1 3.79Å; I332-Y507 PolarHBondContact N-OH 3.01Å; I332-L508 HydrophobicContact CD1-CD2 3.65Å; I332-F511 HydrophobicContact CB-CD1 4.22Å; I332-F511 HydrophobicContact CB-CD2 4.43Å; I332-F511 HydrophobicContact CB-CE1 3.66Å; I332-F511 HydrophobicContact CB-CE2 3.9Å; I332-F511 HydrophobicContact CB-CZ 3.48Å; I332-F511 VanDerWaalsContact CB-CZ 3.48Å; I332-F511 HydrophobicContact CD1-CD1 3.54Å; I332-F511 HydrophobicContact CD1-CE1 3.7Å; I332-F511 HydrophobicContact CD1-CG 4.14Å; I332-F511 HydrophobicContact CD1-CZ 4.39Å; I332-F511 HydrophobicContact CG1-CD1 3.81Å; I332-F511 HydrophobicContact CG1-CE1 3.38Å; I332-F511 HydrophobicContact CG1-CZ 3.79Å; I332-F511 HydrophobicContact CG2-CE1 4Å; I332-F511 HydrophobicContact CG2-CE2 4.17Å; I332-F511 HydrophobicContact CG2-CZ 3.53Å
333	N	87.4	Confident	92.8	Very high	19 Å²	19	7.2 Å²	7.2	10%	0.102	4%	0.036	C	C	.	.	H	α-helix	trans	-68.7	-36.3	-177.2	-81	-30.5	0	0	0	111.8	Q328 G331 I335 M336 Y337 N547	Q328-N333 PolarHBondContact NE2-ND2 3.27Å; Q328-N333 VanDerWaalsContact NE2-ND2 3.18Å; Q328-N333 PolarHBondContact OE1-ND2 2.9Å; G331-N333 VanDerWaalsContact C-N 3.34Å; G331-N333 PolarHBondContact O-N 2.99Å; N333-I335 PolarHBondContact O-N 3.31Å; N333-M336 PolarHBondContact O-N 2.99Å; N333-Y337 HydrophobicContact CB-CD2 4.14Å; N333-Y337 HydrophobicContact CB-CE2 3.69Å; N333-Y337 WeakPolarHBondContact O-CB 3.46Å; N333-Y337 WeakPolarHBondContact O-CD2 3.49Å; N333-Y337 VanDerWaalsContact O-CG 3.24Å; N333-Y337 PolarHBondContact O-N 3.3Å; N333-N547 PolarHBondContact ND2-ND2 3.33Å; N333-N547 PolarHBondContact ND2-OD1 3.03Å
334	T	90.1	Very high	92.6	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-56.7	-50.2	168.9	-60.7	0	0	0	0	111.7	G331 I332 M336 Y337 Y338 I550 F554 Y570	G331-T334 WeakPolarHBondContact O-CB 3.36Å; G331-T334 PolarHBondContact O-N 3.28Å; I332-T334 VanDerWaalsContact C-N 3.35Å; I332-T334 PolarHBondContact O-N 2.89Å; T334-M336 VanDerWaalsContact C-N 3.26Å; T334-M336 PolarHBondContact O-N 3.47Å; T334-Y337 PolarHBondContact O-N 3.49Å; T334-Y338 HydrophobicContact CG2-CD2 4.08Å; T334-Y338 WeakPolarHBondContact O-CB 3.4Å; T334-Y338 PolarHBondContact O-N 2.95Å; T334-I550 WeakPolarHBondContact OG1-CG2 3.16Å; T334-F554 HydrophobicContact CG2-CB 3.87Å; T334-F554 HydrophobicContact CG2-CD1 3.48Å; T334-F554 VanDerWaalsContact CG2-CD1 3.48Å; T334-F554 HydrophobicContact CG2-CD2 3.26Å; T334-F554 HydrophobicContact CG2-CE1 3.73Å; T334-F554 HydrophobicContact CG2-CE2 3.53Å; T334-F554 HydrophobicContact CG2-CG 3.21Å; T334-F554 HydrophobicContact CG2-CZ 3.75Å; T334-Y570 HydrophobicContact CG2-CE2 4.11Å; T334-Y570 PolarHBondContact OG1-OH 2.02Å
335	I	92.1	Very high	92.3	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.9	-36	-179.5	-74.5	166.6	0	0	0	111.1	G331 I332 N333 S339 I342 L396 L504 Y507 L508	G331-I335 WeakPolarHBondContact O-CG1 3.04Å; G331-I335 PolarHBondContact O-N 3.5Å; I332-I335 PolarHBondContact O-N 3.43Å; N333-I335 PolarHBondContact O-N 3.31Å; I335-S339 WeakPolarHBondContact O-CA 3.36Å; I335-S339 WeakPolarHBondContact O-CB 3.39Å; I335-S339 PolarHBondContact O-N 3.33Å; I335-S339 PolarHBondContact O-OG 3.32Å; I335-I342 HydrophobicContact CG1-CD1 4.39Å; I335-L396 HydrophobicContact CD1-CD2 4.43Å; I335-L504 HydrophobicContact CD1-CD2 4.32Å; I335-L504 HydrophobicContact CG1-CD2 4.06Å; I335-L504 HydrophobicContact CG2-CD2 3.83Å; I335-Y507 HydrophobicContact CB-CE1 4.45Å; I335-Y507 HydrophobicContact CD1-CD1 3.53Å; I335-Y507 HydrophobicContact CD1-CD2 3.85Å; I335-Y507 HydrophobicContact CD1-CE1 3.37Å; I335-Y507 HydrophobicContact CD1-CE2 3.66Å; I335-Y507 HydrophobicContact CD1-CG 3.79Å; I335-Y507 VanDerWaalsContact CD1-CZ 3.44Å; I335-Y507 HydrophobicContact CG1-CE1 4.49Å; I335-Y507 HydrophobicContact CG2-CD1 4.36Å; I335-Y507 HydrophobicContact CG2-CE1 4.44Å; I335-L508 HydrophobicContact CG2-CD2 4.42Å
336	M	90.3	Very high	92	Very high	7 Å²	7	5.6 Å²	5.6	3%	0.034	3%	0.028	C	C	.	.	H	α-helix	trans	-72.4	-51.9	177.2	-65.6	-50.8	-56.8	0	0	112	T89 S93 Q210 I332 N333 T334 Y338 L508	T89-M336 HydrophobicContact CG2-CB 3.93Å; S93-M336 WeakPolarHBondContact CB-O 3.47Å; S93-M336 PolarHBondContact OG-O 2.96Å; Q210-M336 HydrophobicContact CB-CE 4.22Å; Q210-M336 HydrophobicContact CG-CE 4.27Å; I332-M336 HydrophobicContact CD1-CG 4.06Å; I332-M336 HydrophobicContact CD1-SD 4.32Å; I332-M336 HydrophobicContact CG1-CG 4.26Å; I332-M336 VanDerWaalsContact O-CG 3.3Å; I332-M336 WeakPolarHBondContact O-CG 3.31Å; I332-M336 PolarHBondContact O-N 3.22Å; N333-M336 PolarHBondContact O-N 2.99Å; T334-M336 VanDerWaalsContact C-N 3.26Å; T334-M336 PolarHBondContact O-N 3.47Å; M336-Y338 PolarHBondContact O-N 2.95Å; M336-L508 HydrophobicContact SD-CD2 4.13Å
337	Y	90.8	Very high	91.5	Very high	6 Å²	6	5.2 Å²	5.2	2%	0.024	3%	0.028	C	C	.	.	H	α-helix	trans	-69.4	-31.7	-176.5	-61.8	-46.2	0	0	0	113.7	T89 S93 V114 V118 N333 T334 S551	T89-Y337 HydrophobicContact CG2-CD1 3.95Å; T89-Y337 HydrophobicContact CG2-CE1 3.56Å; S93-Y337 VanDerWaalsContact CA-O 3.24Å; S93-Y337 WeakPolarHBondContact CA-O 3.32Å; V114-Y337 HydrophobicContact CG1-CD1 4.13Å; V114-Y337 HydrophobicContact CG1-CD2 3.32Å; V114-Y337 HydrophobicContact CG1-CE2 3.89Å; V114-Y337 HydrophobicContact CG1-CG 3.48Å; V114-Y337 VanDerWaalsContact CG1-CG 3.48Å; V118-Y337 HydrophobicContact CG2-CE2 3.95Å; V118-Y337 WeakPolarHBondContact CG2-OH 3.48Å; N333-Y337 HydrophobicContact CB-CD2 4.14Å; N333-Y337 HydrophobicContact CB-CE2 3.69Å; N333-Y337 WeakPolarHBondContact O-CB 3.46Å; N333-Y337 WeakPolarHBondContact O-CD2 3.49Å; N333-Y337 VanDerWaalsContact O-CG 3.24Å; N333-Y337 PolarHBondContact O-N 3.3Å; T334-Y337 PolarHBondContact O-N 3.49Å; Y337-S551 WeakPolarHBondContact CE2-OG 3.18Å
338	Y	91.9	Very high	91.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	15.6	-176.1	-59.4	-75.3	0	0	0	112.9	E111 V114 T334 M336 A340 T341 I342 S551 F554 L555	E111-Y338 WeakPolarHBondContact CA-OH 3.29Å; V114-Y338 HydrophobicContact CG1-CE2 4.45Å; V114-Y338 HydrophobicContact CG2-CE1 3.97Å; V114-Y338 HydrophobicContact CG2-CE2 4.5Å; T334-Y338 HydrophobicContact CG2-CD2 4.08Å; T334-Y338 WeakPolarHBondContact O-CB 3.4Å; T334-Y338 PolarHBondContact O-N 2.95Å; M336-Y338 PolarHBondContact O-N 2.95Å; Y338-A340 PolarHBondContact O-N 3.18Å; Y338-T341 CarbonylContact O-C 3.07Å; Y338-T341 WeakPolarHBondContact O-CA 3.49Å; Y338-T341 WeakPolarHBondContact O-CB 3.29Å; Y338-T341 PolarHBondContact O-N 2.76Å; Y338-I342 WeakPolarHBondContact O-CB 3.16Å; Y338-I342 VanDerWaalsContact O-CG1 3.24Å; Y338-I342 WeakPolarHBondContact O-CG1 3.39Å; Y338-I342 PolarHBondContact O-N 3.21Å; Y338-S551 PolarHBondContact OH-O 3.18Å; Y338-F554 AromaticContact CD2-CD1 3.49Å; Y338-F554 HydrophobicContact CD2-CD1 3.49Å; Y338-F554 VanDerWaalsContact CD2-CD1 3.49Å; Y338-F554 HydrophobicContact CD2-CE1 4.01Å; Y338-F554 HydrophobicContact CD2-CG 4.36Å; Y338-F554 HydrophobicContact CE2-CB 4.33Å; Y338-F554 AromaticContact CE2-CD1 3.84Å; Y338-F554 HydrophobicContact CE2-CD1 3.84Å; Y338-F554 AromaticContact CG-CD1 3.87Å; Y338-F554 HydrophobicContact CG-CD1 3.87Å; Y338-F554 AromaticContact CG-CE1 3.99Å; Y338-F554 HydrophobicContact CG-CE1 3.99Å; Y338-L555 HydrophobicContact CD1-CD2 4.43Å; Y338-L555 HydrophobicContact CE1-CD1 4.03Å; Y338-L555 HydrophobicContact CE1-CD2 4.43Å; Y338-L555 HydrophobicContact CE1-CG 4.19Å
339	S	93.1	Very high	90.6	Very high	3 Å²	3	8.6 Å²	8.6	2%	0.021	4%	0.044	C	C	.	.	H	α-helix	trans	-49.1	-53.1	-176.6	-150.8	0	0	0	0	113.3	S93 I335 T341 I342 L343 T361	S93-S339 VanDerWaalsContact OG-CB 3.23Å; S93-S339 WeakPolarHBondContact OG-CB 3.31Å; S93-S339 PolarHBondContact OG-N 3.35Å; S93-S339 VanDerWaalsContact OG-N 3.08Å; I335-S339 WeakPolarHBondContact O-CA 3.36Å; I335-S339 WeakPolarHBondContact O-CB 3.39Å; I335-S339 PolarHBondContact O-N 3.33Å; I335-S339 PolarHBondContact O-OG 3.32Å; S339-T341 VanDerWaalsContact C-N 3.34Å; S339-T341 PolarHBondContact O-N 3.25Å; S339-I342 PolarHBondContact O-N 3.45Å; S339-L343 WeakPolarHBondContact O-CG 3.15Å; S339-L343 PolarHBondContact O-N 2.75Å; S339-T361 PolarHBondContact OG-OG1 3.18Å
340	A	92.9	Very high	90.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.3	-37	179.4	0	0	0	0	0	111.9	S93 L97 Y338 L343 Q344 I355 A358	S93-A340 WeakPolarHBondContact O-CB 3.33Å; S93-A340 PolarHBondContact OG-N 2.7Å; L97-A340 HydrophobicContact CD1-CB 3.44Å; L97-A340 VanDerWaalsContact CD1-CB 3.44Å; Y338-A340 PolarHBondContact O-N 3.18Å; A340-L343 PolarHBondContact O-N 3.08Å; A340-Q344 PolarHBondContact O-N 2.85Å; A340-I355 HydrophobicContact CB-CG1 4.38Å; A340-A358 HydrophobicContact CB-CB 3.85Å
341	T	91.7	Very high	89.8	Confident	4 Å²	4	12.3 Å²	12.3	3%	0.025	6%	0.064	C	C	.	.	H	α-helix	trans	-65.6	-42.4	175.6	-46.3	0	0	0	0	111.7	Y338 S339 L343 Q344 M345	Y338-T341 CarbonylContact O-C 3.07Å; Y338-T341 WeakPolarHBondContact O-CA 3.49Å; Y338-T341 WeakPolarHBondContact O-CB 3.29Å; Y338-T341 PolarHBondContact O-N 2.76Å; S339-T341 VanDerWaalsContact C-N 3.34Å; S339-T341 PolarHBondContact O-N 3.25Å; T341-L343 VanDerWaalsContact C-N 3.29Å; T341-L343 PolarHBondContact O-N 3.11Å; T341-Q344 WeakPolarHBondContact O-CB 3.18Å; T341-Q344 PolarHBondContact O-N 3.22Å; T341-Q344 VanDerWaalsContact O-N 3.14Å; T341-M345 HydrophobicContact CG2-CE 3.72Å; T341-M345 VanDerWaalsContact O-CG 3.28Å; T341-M345 WeakPolarHBondContact O-CG 3.26Å; T341-M345 PolarHBondContact O-N 3.22Å
342	I	92.8	Very high	89.7	Confident	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-62.6	-39.5	176.7	-67.3	162.7	0	0	0	110.2	I335 Y338 S339 M345 S346 F403 L504 F554 F567	I335-I342 HydrophobicContact CG1-CD1 4.39Å; Y338-I342 WeakPolarHBondContact O-CB 3.16Å; Y338-I342 VanDerWaalsContact O-CG1 3.24Å; Y338-I342 WeakPolarHBondContact O-CG1 3.39Å; Y338-I342 PolarHBondContact O-N 3.21Å; S339-I342 PolarHBondContact O-N 3.45Å; I342-M345 WeakPolarHBondContact O-CB 3.29Å; I342-M345 PolarHBondContact O-N 3.41Å; I342-S346 PolarHBondContact O-N 2.64Å; I342-F403 HydrophobicContact CG2-CE2 4.07Å; I342-F403 HydrophobicContact CG2-CZ 3.77Å; I342-L504 HydrophobicContact CG2-CD1 3.97Å; I342-L504 HydrophobicContact CG2-CD2 4.38Å; I342-F554 HydrophobicContact CD1-CE1 4.37Å; I342-F554 HydrophobicContact CD1-CZ 4.08Å; I342-F554 HydrophobicContact CG1-CE1 4.11Å; I342-F554 HydrophobicContact CG1-CZ 3.86Å; I342-F567 HydrophobicContact CD1-CZ 4.02Å; I342-F567 HydrophobicContact CG1-CZ 4.19Å; I342-F567 HydrophobicContact CG2-CE2 4.24Å; I342-F567 HydrophobicContact CG2-CZ 3.86Å
343	L	92.4	Very high	89.8	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-67.2	-35.6	174.5	-72.3	164	0	0	0	112.2	S339 A340 T341 S346 V348 A354 L357 A358 L501 L504	S339-L343 WeakPolarHBondContact O-CG 3.15Å; S339-L343 PolarHBondContact O-N 2.75Å; A340-L343 PolarHBondContact O-N 3.08Å; T341-L343 VanDerWaalsContact C-N 3.29Å; T341-L343 PolarHBondContact O-N 3.11Å; L343-S346 PolarHBondContact O-N 3.07Å; L343-S346 PolarHBondContact O-OG 2.61Å; L343-V348 VanDerWaalsContact O-CB 3.31Å; L343-V348 WeakPolarHBondContact O-CB 3.34Å; L343-V348 VanDerWaalsContact O-CG2 3.26Å; L343-V348 WeakPolarHBondContact O-CG2 3.28Å; L343-V348 PolarHBondContact O-N 3.31Å; L343-A354 HydrophobicContact CB-CB 4.35Å; L343-L357 HydrophobicContact CD1-CB 3.58Å; L343-L357 HydrophobicContact CD2-CB 4.49Å; L343-A358 HydrophobicContact CD1-CB 4.2Å; L343-L501 HydrophobicContact CD2-CB 4.07Å; L343-L501 HydrophobicContact CD2-CD1 3.73Å; L343-L501 HydrophobicContact CD2-CG 4.5Å; L343-L504 HydrophobicContact CD2-CD1 3.84Å; L343-L504 HydrophobicContact CG-CD1 3.96Å
344	Q	90.6	Very high	90	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-65	-47.7	170.8	-164.3	-174.6	52.8	0	0	110.4	A340 T341 S346 G347 D351 S490 F491	A340-Q344 PolarHBondContact O-N 2.85Å; T341-Q344 WeakPolarHBondContact O-CB 3.18Å; T341-Q344 PolarHBondContact O-N 3.22Å; T341-Q344 VanDerWaalsContact O-N 3.14Å; Q344-S346 PolarHBondContact O-N 2.97Å; Q344-S346 VanDerWaalsContact O-N 3.08Å; Q344-G347 PolarHBondContact O-N 2.79Å; Q344-D351 PolarHBondContact NE2-OD1 3.43Å; Q344-S490 PolarHBondContact OE1-OG 3.34Å; Q344-F491 HydrophobicContact CG-CB 4.49Å; Q344-F491 HydrophobicContact CG-CD1 4.23Å; Q344-F491 WeakPolarHBondContact O-CB 3.4Å
345	M	88.9	Confident	90.1	Very high	16 Å²	16	18.5 Å²	18.5	8%	0.079	9%	0.093	C	C	.	.	H	α-helix	trans	-55.9	-28	176.6	-68	172.3	-174.6	0	0	113	T341 I342 G347 F403 S490 F554 L555 Y563	T341-M345 HydrophobicContact CG2-CE 3.72Å; T341-M345 VanDerWaalsContact O-CG 3.28Å; T341-M345 WeakPolarHBondContact O-CG 3.26Å; T341-M345 PolarHBondContact O-N 3.22Å; I342-M345 WeakPolarHBondContact O-CB 3.29Å; I342-M345 PolarHBondContact O-N 3.41Å; M345-G347 VanDerWaalsContact C-N 3.27Å; M345-G347 PolarHBondContact O-N 3.21Å; M345-F403 HydrophobicContact CB-CE1 4.11Å; M345-S490 WeakPolarHBondContact CA-O 3.23Å; M345-F554 HydrophobicContact CE-CE1 4.5Å; M345-L555 HydrophobicContact CE-CD2 3.49Å; M345-L555 VanDerWaalsContact CE-CD2 3.49Å; M345-Y563 HydrophobicContact CB-CD2 4.33Å; M345-Y563 HydrophobicContact CB-CE1 4.41Å; M345-Y563 HydrophobicContact CB-CE2 4.18Å; M345-Y563 HydrophobicContact CE-CE1 4.21Å; M345-Y563 HydrophobicContact CG-CD1 4.37Å; M345-Y563 HydrophobicContact CG-CE1 3.92Å; M345-Y563 HydrophobicContact CG-CE2 4.37Å; M345-Y563 HydrophobicContact SD-CD1 3.78Å; M345-Y563 HydrophobicContact SD-CE1 3.63Å
346	S	88.8	Confident	90.2	Very high	1 Å²	1	23 Å²	23	1%	0.007	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.9	179.4	78.9	0	0	0	0	114.4	I342 L343 Q344 S406 T494 F497 A500	I342-S346 PolarHBondContact O-N 2.64Å; L343-S346 PolarHBondContact O-N 3.07Å; L343-S346 PolarHBondContact O-OG 2.61Å; Q344-S346 PolarHBondContact O-N 2.97Å; Q344-S346 VanDerWaalsContact O-N 3.08Å; S346-S406 PolarHBondContact O-OG 2.83Å; S346-T494 WeakPolarHBondContact O-CG2 3.22Å; S346-F497 WeakPolarHBondContact O-CB 3.45Å; S346-A500 VanDerWaalsContact CB-CB 3.43Å
347	G	86.3	Confident	90.4	Very high	6 Å²	6	24 Å²	24	6%	0.062	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	119.2	9	179	0	0	0	0	0	115.1	Q344 M345 E349 C492	Q344-G347 PolarHBondContact O-N 2.79Å; M345-G347 VanDerWaalsContact C-N 3.27Å; M345-G347 PolarHBondContact O-N 3.21Å; G347-E349 PolarHBondContact O-N 3.31Å; G347-C492 WeakPolarHBondContact CA-O 3.15Å
348	V	88.3	Confident	90.5	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.03	12%	0.116	C	C	.	.			trans	-76	111.7	175.8	179.8	0	0	0	0	109.7	L343 L353 A354 L357 F497	L343-V348 VanDerWaalsContact O-CB 3.31Å; L343-V348 WeakPolarHBondContact O-CB 3.34Å; L343-V348 VanDerWaalsContact O-CG2 3.26Å; L343-V348 WeakPolarHBondContact O-CG2 3.28Å; L343-V348 PolarHBondContact O-N 3.31Å; V348-L353 HydrophobicContact CG1-CB 4.06Å; V348-L353 HydrophobicContact CG1-CD2 3.95Å; V348-L353 HydrophobicContact CG1-CG 4.02Å; V348-A354 HydrophobicContact CB-CB 4.46Å; V348-A354 HydrophobicContact CG1-CB 4.03Å; V348-L357 HydrophobicContact CG2-CD1 4.17Å; V348-F497 HydrophobicContact CG2-CB 4.48Å; V348-F497 HydrophobicContact CG2-CD2 3.75Å; V348-F497 HydrophobicContact CG2-CE2 4.41Å; V348-F497 HydrophobicContact CG2-CG 4.37Å
349	E	82.3	Confident	90.6	Very high	80 Å²	80	24.1 Å²	24.1	37%	0.374	12%	0.118	S	C	.	.			trans	-72.2	-41.9	-174	-47.4	-170.4	153.6	0	0	113.1	G347 Y446 F491	G347-E349 PolarHBondContact O-N 3.31Å; E349-Y446 PolarHBondContact OE1-OH 3.41Å; E349-F491 HydrophobicContact CB-CE2 3.82Å; E349-F491 HydrophobicContact CB-CZ 3.87Å; E349-F491 HydrophobicContact CG-CD2 4.18Å; E349-F491 HydrophobicContact CG-CE2 3.56Å; E349-F491 HydrophobicContact CG-CZ 4.14Å
350	D	85.9	Confident	90.7	Very high	78 Å²	78	27.1 Å²	27.1	42%	0.417	14%	0.136	S	C	.	.			trans	-86.3	118.1	-178.2	-173.7	0.1	0	0	0	111.4	K352 L353 A354	D350-K352 PolarHBondContact O-N 2.98Å; D350-K352 WeakPolarHBondContact OD1-CB 3.42Å; D350-K352 PolarHBondContact OD1-N 3.43Å; D350-L353 HydrophobicContact CB-CB 4.02Å; D350-L353 WeakPolarHBondContact O-CB 3.46Å; D350-L353 PolarHBondContact O-N 2.77Å; D350-L353 VanDerWaalsContact O-N 3.11Å; D350-A354 PolarHBondContact O-N 3.32Å
351	D	86.3	Confident	90.7	Very high	16 Å²	16	27.2 Å²	27.2	9%	0.086	14%	0.136	C	C	.	.	H	α-helix	trans	-52.5	-40.2	173.3	-79.7	30.8	0	0	0	112.9	L97 R101 Q344 L353 A354 I355	L97-D351 HydrophobicContact CD2-CB 4Å; R101-D351 IonicContact CZ-OD1 3.31Å; R101-D351 IonicContact CZ-OD2 3.86Å; R101-D351 IonicContact NE-OD2 3.76Å; R101-D351 IonicContact NH1-OD1 3.88Å; R101-D351 PolarHBondContact NH1-OD1 3.34Å; R101-D351 IonicContact NH1-OD2 3.7Å; R101-D351 PolarHBondContact NH1-OD2 3.09Å; R101-D351 VanDerWaalsContact NH2-CG 3.3Å; R101-D351 IonicContact NH2-OD1 3.94Å; R101-D351 PolarHBondContact NH2-OD1 2.91Å; R101-D351 IonicContact NH2-OD2 3.97Å; R101-D351 PolarHBondContact NH2-OD2 3.45Å; Q344-D351 PolarHBondContact NE2-OD1 3.43Å; D351-L353 VanDerWaalsContact C-N 3.3Å; D351-L353 PolarHBondContact O-N 2.8Å; D351-A354 PolarHBondContact O-N 3.48Å; D351-I355 WeakPolarHBondContact O-CG1 3.43Å; D351-I355 PolarHBondContact O-N 2.96Å
352	K	90.6	Very high	90.8	Very high	75 Å²	75	27 Å²	27	33%	0.326	14%	0.135	S	C	.	.	H	α-helix	trans	-65	-42.1	-178	-60.5	169.6	-171.1	164.5	0	110	Y222 D350 I355 W356	Y222-K352 HydrophobicContact CD1-CD 4.13Å; Y222-K352 HydrophobicContact CE1-CD 4.11Å; D350-K352 PolarHBondContact O-N 2.98Å; D350-K352 WeakPolarHBondContact OD1-CB 3.42Å; D350-K352 PolarHBondContact OD1-N 3.43Å; K352-I355 PolarHBondContact O-N 2.97Å; K352-W356 VanDerWaalsContact O-CD1 3.23Å; K352-W356 PolarHBondContact O-N 2.69Å
353	L	91.6	Very high	90.9	Very high	83 Å²	83	31.4 Å²	31.4	44%	0.435	15%	0.154	S	C	.	.	H	α-helix	trans	-63.7	-44.7	176	-176.7	62.4	0	0	0	110.5	V348 D350 D351 I355 W356 L357	V348-L353 HydrophobicContact CG1-CB 4.06Å; V348-L353 HydrophobicContact CG1-CD2 3.95Å; V348-L353 HydrophobicContact CG1-CG 4.02Å; D350-L353 HydrophobicContact CB-CB 4.02Å; D350-L353 WeakPolarHBondContact O-CB 3.46Å; D350-L353 PolarHBondContact O-N 2.77Å; D350-L353 VanDerWaalsContact O-N 3.11Å; D351-L353 VanDerWaalsContact C-N 3.3Å; D351-L353 PolarHBondContact O-N 2.8Å; L353-I355 VanDerWaalsContact C-N 3.34Å; L353-I355 PolarHBondContact O-N 2.84Å; L353-W356 PolarHBondContact O-N 2.68Å; L353-L357 HydrophobicContact CD1-CD1 4.44Å; L353-L357 HydrophobicContact CD1-CG 4.29Å; L353-L357 HydrophobicContact CG-CD1 4.08Å; L353-L357 HydrophobicContact CG-CG 4.36Å; L353-L357 WeakPolarHBondContact O-CB 3.35Å; L353-L357 VanDerWaalsContact O-CG 3.23Å; L353-L357 WeakPolarHBondContact O-CG 3.33Å; L353-L357 PolarHBondContact O-N 3.35Å
354	A	91.6	Very high	91	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-42.4	176.9	0	0	0	0	0	112.4	L97 L343 V348 D350 D351 L357 A358	L97-A354 HydrophobicContact CD2-CB 4.33Å; L343-A354 HydrophobicContact CB-CB 4.35Å; V348-A354 HydrophobicContact CB-CB 4.46Å; V348-A354 HydrophobicContact CG1-CB 4.03Å; D350-A354 PolarHBondContact O-N 3.32Å; D351-A354 PolarHBondContact O-N 3.48Å; A354-L357 PolarHBondContact O-N 3.11Å; A354-A358 PolarHBondContact O-N 3.39Å
355	I	93.1	Very high	91.1	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-45.5	176.7	-65.5	164.9	0	0	0	111	D217 A340 D351 K352 L353 L357 A358 S359	D217-I355 HydrophobicContact CB-CG2 3.72Å; A340-I355 HydrophobicContact CB-CG1 4.38Å; D351-I355 WeakPolarHBondContact O-CG1 3.43Å; D351-I355 PolarHBondContact O-N 2.96Å; K352-I355 PolarHBondContact O-N 2.97Å; L353-I355 VanDerWaalsContact C-N 3.34Å; L353-I355 PolarHBondContact O-N 2.84Å; I355-L357 PolarHBondContact O-N 3.33Å; I355-A358 WeakPolarHBondContact O-CB 3.46Å; I355-A358 PolarHBondContact O-N 3.33Å; I355-S359 PolarHBondContact O-N 2.08Å; I355-S359 PolarHBondContact O-OG 3.23Å; I355-S359 VanDerWaalsContact O-OG 3.13Å
356	W	94.9	Very high	91.3	Very high	94 Å²	94	34 Å²	34	36%	0.356	17%	0.167	S	C	.	.	H	α-helix	trans	-66	-37.2	177.3	-85.1	110.2	0	0	0	113.1	Y222 K352 L353 A358 S359 V360	Y222-W356 HydrophobicContact CE2-CZ2 4.43Å; Y222-W356 AromaticContact CE2-NE1 3.61Å; Y222-W356 AromaticContact CZ-NE1 3.81Å; Y222-W356 PolarHBondContact OH-NE1 3.39Å; K352-W356 VanDerWaalsContact O-CD1 3.23Å; K352-W356 PolarHBondContact O-N 2.69Å; L353-W356 PolarHBondContact O-N 2.68Å; W356-A358 VanDerWaalsContact C-N 3.29Å; W356-A358 PolarHBondContact O-N 3.44Å; W356-S359 VanDerWaalsContact O-CB 3.31Å; W356-S359 WeakPolarHBondContact O-CB 3.32Å; W356-S359 PolarHBondContact O-N 3.3Å; W356-S359 VanDerWaalsContact O-N 3.11Å; W356-V360 PolarHBondContact O-N 3.18Å
357	L	93.9	Very high	91.5	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-35.8	173	-73.1	177.8	0	0	0	111.2	L343 V348 L353 A354 I355 S359 V360 T361 L501	L343-L357 HydrophobicContact CD1-CB 3.58Å; L343-L357 HydrophobicContact CD2-CB 4.49Å; V348-L357 HydrophobicContact CG2-CD1 4.17Å; L353-L357 HydrophobicContact CD1-CD1 4.44Å; L353-L357 HydrophobicContact CD1-CG 4.29Å; L353-L357 HydrophobicContact CG-CD1 4.08Å; L353-L357 HydrophobicContact CG-CG 4.36Å; L353-L357 WeakPolarHBondContact O-CB 3.35Å; L353-L357 VanDerWaalsContact O-CG 3.23Å; L353-L357 WeakPolarHBondContact O-CG 3.33Å; L353-L357 PolarHBondContact O-N 3.35Å; A354-L357 PolarHBondContact O-N 3.11Å; I355-L357 PolarHBondContact O-N 3.33Å; L357-S359 VanDerWaalsContact C-N 3.32Å; L357-S359 PolarHBondContact O-N 3.2Å; L357-V360 WeakPolarHBondContact O-CB 3.17Å; L357-V360 PolarHBondContact O-N 2.9Å; L357-V360 VanDerWaalsContact O-N 3.15Å; L357-T361 PolarHBondContact O-N 2.91Å; L357-T361 VanDerWaalsContact O-N 3.16Å; L357-L501 HydrophobicContact CB-CD1 4.31Å; L357-L501 HydrophobicContact CD1-CD2 4.35Å; L357-L501 HydrophobicContact CD2-CD1 4.21Å; L357-L501 HydrophobicContact CD2-CD2 3.71Å
358	A	93.3	Very high	91.8	Very high	3 Å²	3	39.5 Å²	39.5	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-31.7	170.4	0	0	0	0	0	112.7	A340 L343 A354 I355 W356 V360 T361 A362	A340-A358 HydrophobicContact CB-CB 3.85Å; L343-A358 HydrophobicContact CD1-CB 4.2Å; A354-A358 PolarHBondContact O-N 3.39Å; I355-A358 WeakPolarHBondContact O-CB 3.46Å; I355-A358 PolarHBondContact O-N 3.33Å; W356-A358 VanDerWaalsContact C-N 3.29Å; W356-A358 PolarHBondContact O-N 3.44Å; A358-V360 VanDerWaalsContact C-N 3.27Å; A358-V360 PolarHBondContact O-N 2.91Å; A358-T361 WeakPolarHBondContact CA-OG1 3.4Å; A358-T361 PolarHBondContact O-N 3.04Å; A358-T361 PolarHBondContact O-OG1 3.06Å; A358-A362 PolarHBondContact O-N 2.87Å
359	S	94.1	Very high	91.9	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-34.6	170.8	-38.3	0	0	0	0	111.9	S214 I355 W356 L357 F363	S214-S359 PolarHBondContact O-OG 3.26Å; I355-S359 PolarHBondContact O-N 2.08Å; I355-S359 PolarHBondContact O-OG 3.23Å; I355-S359 VanDerWaalsContact O-OG 3.13Å; W356-S359 VanDerWaalsContact O-CB 3.31Å; W356-S359 WeakPolarHBondContact O-CB 3.32Å; W356-S359 PolarHBondContact O-N 3.3Å; W356-S359 VanDerWaalsContact O-N 3.11Å; L357-S359 VanDerWaalsContact C-N 3.32Å; L357-S359 PolarHBondContact O-N 3.2Å; S359-F363 WeakPolarHBondContact O-CB 3.23Å; S359-F363 PolarHBondContact O-N 3.01Å
360	V	94.5	Very high	92.2	Very high	67 Å²	67	39.1 Å²	39.1	41%	0.406	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-40.2	175.7	177.1	0	0	0	0	111.5	W356 L357 A358 F363 T364 I505	W356-V360 PolarHBondContact O-N 3.18Å; L357-V360 WeakPolarHBondContact O-CB 3.17Å; L357-V360 PolarHBondContact O-N 2.9Å; L357-V360 VanDerWaalsContact O-N 3.15Å; A358-V360 VanDerWaalsContact C-N 3.27Å; A358-V360 PolarHBondContact O-N 2.91Å; V360-F363 PolarHBondContact O-N 2.95Å; V360-T364 PolarHBondContact O-N 2.96Å; V360-T364 PolarHBondContact O-OG1 3.07Å; V360-I505 HydrophobicContact CG1-CD1 4.3Å
361	T	92.2	Very high	92.4	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-46.4	175.5	61.5	0	0	0	0	110.4	S339 L357 A358 F363 T364 N365 L501 L504 I505 L508	S339-T361 PolarHBondContact OG-OG1 3.18Å; L357-T361 PolarHBondContact O-N 2.91Å; L357-T361 VanDerWaalsContact O-N 3.16Å; A358-T361 WeakPolarHBondContact CA-OG1 3.4Å; A358-T361 PolarHBondContact O-N 3.04Å; A358-T361 PolarHBondContact O-OG1 3.06Å; T361-F363 PolarHBondContact O-N 3.4Å; T361-T364 WeakPolarHBondContact O-CB 3.43Å; T361-T364 PolarHBondContact O-N 3.35Å; T361-T364 VanDerWaalsContact O-N 3.14Å; T361-N365 PolarHBondContact O-N 3.21Å; T361-L501 HydrophobicContact CG2-CD1 4.46Å; T361-L504 HydrophobicContact CG2-CB 4.21Å; T361-I505 HydrophobicContact CG2-CG1 4.35Å; T361-L508 WeakPolarHBondContact O-CD1 3.47Å
362	A	93.9	Very high	92.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-40.7	175.8	0	0	0	0	0	113.1	A358 T364 N365 F366	A358-A362 PolarHBondContact O-N 2.87Å; A362-T364 VanDerWaalsContact C-N 3.33Å; A362-T364 PolarHBondContact O-N 3.3Å; A362-N365 WeakPolarHBondContact O-CB 3.4Å; A362-N365 PolarHBondContact O-N 3.23Å; A362-F366 PolarHBondContact O-N 3.18Å
363	F	94.9	Very high	91.9	Very high	92 Å²	92	36.3 Å²	36.3	40%	0.404	18%	0.184	S	C	.	.	H	α-helix	trans	-60.6	-43	174.1	179.3	-110.1	0	0	0	112.1	F211 S359 V360 T361 N365 F366 I367	F211-F363 HydrophobicContact CD2-CB 3.62Å; F211-F363 AromaticContact CD2-CD2 3.98Å; F211-F363 HydrophobicContact CD2-CD2 3.98Å; F211-F363 HydrophobicContact CD2-CG 4.3Å; F211-F363 HydrophobicContact CE1-CD2 4.25Å; F211-F363 HydrophobicContact CE2-CB 3.64Å; F211-F363 AromaticContact CE2-CD2 3.61Å; F211-F363 HydrophobicContact CE2-CD2 3.61Å; F211-F363 HydrophobicContact CE2-CG 4.01Å; F211-F363 HydrophobicContact CG-CD2 4.45Å; F211-F363 AromaticContact CZ-CD2 3.75Å; F211-F363 HydrophobicContact CZ-CD2 3.75Å; F211-F363 HydrophobicContact CZ-CE2 4.45Å; S359-F363 WeakPolarHBondContact O-CB 3.23Å; S359-F363 PolarHBondContact O-N 3.01Å; V360-F363 PolarHBondContact O-N 2.95Å; T361-F363 PolarHBondContact O-N 3.4Å; F363-N365 VanDerWaalsContact C-N 3.33Å; F363-N365 PolarHBondContact O-N 3.42Å; F363-F366 PolarHBondContact O-N 2.75Å; F363-I367 HydrophobicContact CD1-CG1 4.36Å; F363-I367 HydrophobicContact CD2-CG1 4.29Å; F363-I367 HydrophobicContact CE1-CG1 3.88Å; F363-I367 HydrophobicContact CE2-CD1 3.96Å; F363-I367 HydrophobicContact CE2-CG1 3.81Å; F363-I367 HydrophobicContact CZ-CD1 3.87Å; F363-I367 HydrophobicContact CZ-CG1 3.58Å; F363-I367 WeakPolarHBondContact O-CG1 3.11Å; F363-I367 PolarHBondContact O-N 3.34Å
364	T	94.6	Very high	91.5	Very high	15 Å²	15	39.8 Å²	39.8	9%	0.092	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-46.1	176.5	-57.2	0	0	0	0	110.5	V360 T361 A362 F366 I367 F368 I505 L508 I509	V360-T364 PolarHBondContact O-N 2.96Å; V360-T364 PolarHBondContact O-OG1 3.07Å; T361-T364 WeakPolarHBondContact O-CB 3.43Å; T361-T364 PolarHBondContact O-N 3.35Å; T361-T364 VanDerWaalsContact O-N 3.14Å; A362-T364 VanDerWaalsContact C-N 3.33Å; A362-T364 PolarHBondContact O-N 3.3Å; T364-F366 VanDerWaalsContact C-N 3.34Å; T364-F366 PolarHBondContact O-N 3.06Å; T364-I367 PolarHBondContact O-N 3.33Å; T364-F368 HydrophobicContact CG2-CD2 3.79Å; T364-F368 HydrophobicContact CG2-CE2 4.12Å; T364-F368 WeakPolarHBondContact O-CD2 3.33Å; T364-F368 PolarHBondContact O-N 2.91Å; T364-I505 HydrophobicContact CG2-CG2 4.23Å; T364-L508 HydrophobicContact CG2-CB 4.26Å; T364-I509 HydrophobicContact CG2-CD1 4.38Å; T364-I509 HydrophobicContact CG2-CG1 3.56Å
365	N	92.9	Very high	91.3	Very high	10 Å²	10	41.9 Å²	41.9	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-45.7	175.9	-172.4	40.3	0	0	0	112.1	Q210 T361 A362 F363 T369 L508 A512	Q210-N365 PolarHBondContact OE1-ND2 3.39Å; T361-N365 PolarHBondContact O-N 3.21Å; A362-N365 WeakPolarHBondContact O-CB 3.4Å; A362-N365 PolarHBondContact O-N 3.23Å; F363-N365 VanDerWaalsContact C-N 3.33Å; F363-N365 PolarHBondContact O-N 3.42Å; N365-T369 WeakPolarHBondContact O-CB 3.36Å; N365-T369 PolarHBondContact O-N 3.07Å; N365-T369 PolarHBondContact O-OG1 3.44Å; N365-L508 HydrophobicContact CB-CD1 4.34Å; N365-L508 HydrophobicContact CB-CD2 4.32Å; N365-A512 VanDerWaalsContact OD1-CB 3.28Å; N365-A512 WeakPolarHBondContact OD1-CB 3.21Å
366	F	92.9	Very high	90.7	Very high	48 Å²	48	42.3 Å²	42.3	21%	0.211	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-50.2	178.6	176.7	-113.7	0	0	0	112.5	T207 F211 A362 F363 T364 T369 L370	T207-F366 WeakPolarHBondContact OG1-CD2 3.32Å; F211-F366 HydrophobicContact CB-CB 4.34Å; A362-F366 PolarHBondContact O-N 3.18Å; F363-F366 PolarHBondContact O-N 2.75Å; T364-F366 VanDerWaalsContact C-N 3.34Å; T364-F366 PolarHBondContact O-N 3.06Å; F366-T369 PolarHBondContact O-N 2.94Å; F366-L370 HydrophobicContact CE1-CD1 4.24Å; F366-L370 HydrophobicContact CZ-CD1 4.27Å; F366-L370 PolarHBondContact O-N 3.37Å
367	I	93.9	Very high	90	Very high	61 Å²	61	43.5 Å²	43.5	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-64	-45.9	-179.7	-65.7	-62	0	0	0	111.6	F363 T364 T369 L370 V371	F363-I367 HydrophobicContact CD1-CG1 4.36Å; F363-I367 HydrophobicContact CD2-CG1 4.29Å; F363-I367 HydrophobicContact CE1-CG1 3.88Å; F363-I367 HydrophobicContact CE2-CD1 3.96Å; F363-I367 HydrophobicContact CE2-CG1 3.81Å; F363-I367 HydrophobicContact CZ-CD1 3.87Å; F363-I367 HydrophobicContact CZ-CG1 3.58Å; F363-I367 WeakPolarHBondContact O-CG1 3.11Å; F363-I367 PolarHBondContact O-N 3.34Å; T364-I367 PolarHBondContact O-N 3.33Å; I367-T369 VanDerWaalsContact C-N 3.28Å; I367-T369 PolarHBondContact O-N 3.41Å; I367-L370 WeakPolarHBondContact O-CB 3.43Å; I367-L370 PolarHBondContact O-N 3.36Å; I367-V371 WeakPolarHBondContact O-CG2 3.23Å; I367-V371 PolarHBondContact O-N 2.84Å
368	F	93.1	Very high	89.5	Confident	62 Å²	62	48.2 Å²	48.2	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-74.8	-19	-177.7	-80.5	-89	0	0	0	113.3	T364 V371 G372 I509 A512	T364-F368 HydrophobicContact CG2-CD2 3.79Å; T364-F368 HydrophobicContact CG2-CE2 4.12Å; T364-F368 WeakPolarHBondContact O-CD2 3.33Å; T364-F368 PolarHBondContact O-N 2.91Å; F368-V371 PolarHBondContact O-N 3.46Å; F368-G372 PolarHBondContact O-N 3.38Å; F368-I509 HydrophobicContact CD1-CB 4.41Å; F368-I509 HydrophobicContact CD1-CG2 4Å; F368-I509 HydrophobicContact CD2-CB 4.48Å; F368-I509 HydrophobicContact CD2-CG1 3.87Å; F368-I509 HydrophobicContact CE1-CB 4.33Å; F368-I509 HydrophobicContact CE1-CG1 4.29Å; F368-I509 HydrophobicContact CE1-CG2 3.63Å; F368-I509 HydrophobicContact CE2-CB 4.4Å; F368-I509 HydrophobicContact CE2-CD1 4.16Å; F368-I509 HydrophobicContact CE2-CG1 3.56Å; F368-I509 HydrophobicContact CE2-CG2 4.45Å; F368-I509 HydrophobicContact CG-CB 4.48Å; F368-I509 HydrophobicContact CG-CG1 4.36Å; F368-I509 HydrophobicContact CZ-CB 4.31Å; F368-I509 HydrophobicContact CZ-CD1 4.18Å; F368-I509 HydrophobicContact CZ-CG1 3.77Å; F368-I509 HydrophobicContact CZ-CG2 3.87Å; F368-A512 HydrophobicContact CB-CB 3.82Å
369	T	89.4	Confident	89.2	Confident	6 Å²	6	51 Å²	51	4%	0.037	25%	0.25	C	S	.	.	H	α-helix	trans	-66.7	-41.9	167.3	-58.7	0	0	0	0	111.6	T203 L204 T207 N365 F366 I367 V371 G372 V373	T203-T369 HydrophobicContact CG2-CG2 4.36Å; L204-T369 HydrophobicContact CD2-CG2 4.22Å; T207-T369 HydrophobicContact CG2-CG2 4.1Å; N365-T369 WeakPolarHBondContact O-CB 3.36Å; N365-T369 PolarHBondContact O-N 3.07Å; N365-T369 PolarHBondContact O-OG1 3.44Å; F366-T369 PolarHBondContact O-N 2.94Å; I367-T369 VanDerWaalsContact C-N 3.28Å; I367-T369 PolarHBondContact O-N 3.41Å; T369-V371 VanDerWaalsContact C-N 3.29Å; T369-V371 PolarHBondContact O-N 3.35Å; T369-G372 PolarHBondContact O-N 3.09Å; T369-G372 VanDerWaalsContact O-N 3.16Å; T369-V373 PolarHBondContact O-N 3.12Å; T369-V373 VanDerWaalsContact O-N 3.08Å
370	L	88.4	Confident	88.8	Confident	72 Å²	72	50.7 Å²	50.7	38%	0.377	25%	0.248	S	C	.	.	H	α-helix	trans	-59.9	-42.3	173.7	-71.2	163.6	0	0	0	111.3	L204 F366 I367 G372 V373 W374	L204-L370 HydrophobicContact CD1-CD2 3.65Å; L204-L370 HydrophobicContact CD2-CD2 3.37Å; L204-L370 HydrophobicContact CD2-CG 3.83Å; L204-L370 HydrophobicContact CG-CD2 4.13Å; F366-L370 HydrophobicContact CE1-CD1 4.24Å; F366-L370 HydrophobicContact CZ-CD1 4.27Å; F366-L370 PolarHBondContact O-N 3.37Å; I367-L370 WeakPolarHBondContact O-CB 3.43Å; I367-L370 PolarHBondContact O-N 3.36Å; L370-G372 VanDerWaalsContact C-N 3.34Å; L370-V373 PolarHBondContact O-N 2.95Å; L370-W374 PolarHBondContact O-N 3.04Å
371	V	89.4	Confident	88.4	Confident	53 Å²	53	48.7 Å²	48.7	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-61	-44.3	175.1	172.6	0	0	0	0	110.2	I367 F368 T369 V373 W374 L375	I367-V371 WeakPolarHBondContact O-CG2 3.23Å; I367-V371 PolarHBondContact O-N 2.84Å; F368-V371 PolarHBondContact O-N 3.46Å; T369-V371 VanDerWaalsContact C-N 3.29Å; T369-V371 PolarHBondContact O-N 3.35Å; V371-V373 PolarHBondContact O-N 3.43Å; V371-W374 WeakPolarHBondContact O-CB 3.44Å; V371-W374 PolarHBondContact O-N 3.21Å; V371-W374 VanDerWaalsContact O-N 3.15Å; V371-L375 HydrophobicContact CB-CD1 4.39Å; V371-L375 HydrophobicContact CG1-CD1 3.18Å; V371-L375 VanDerWaalsContact O-CD1 3.27Å; V371-L375 WeakPolarHBondContact O-CD1 3.4Å; V371-L375 PolarHBondContact O-N 3.16Å
372	G	85.6	Confident	88.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-52.9	-53.1	174.4	0	0	0	0	0	113.6	F368 T369 L370 W374 L375 V376 P513	F368-G372 PolarHBondContact O-N 3.38Å; T369-G372 PolarHBondContact O-N 3.09Å; T369-G372 VanDerWaalsContact O-N 3.16Å; L370-G372 VanDerWaalsContact C-N 3.34Å; G372-W374 PolarHBondContact O-N 2.84Å; G372-W374 VanDerWaalsContact O-N 3.15Å; G372-L375 PolarHBondContact O-N 3.22Å; G372-V376 VanDerWaalsContact O-CG2 3.24Å; G372-V376 WeakPolarHBondContact O-CG2 3.2Å; G372-V376 PolarHBondContact O-N 3.45Å; G372-P513 VanDerWaalsContact CA-CA 3.43Å; G372-P513 VanDerWaalsContact CA-CB 3.45Å; G372-P513 WeakPolarHBondContact CA-O 3.27Å
373	V	81.7	Confident	88.2	Confident	57 Å²	57	59.2 Å²	59.2	35%	0.345	28%	0.277	S	S	.	.	H	α-helix	trans	-52.8	-39.6	178.5	171.1	0	0	0	0	111.9	T200 T369 L370 V371	T200-V373 HydrophobicContact CG2-CB 4.14Å; T200-V373 HydrophobicContact CG2-CG1 3.61Å; T200-V373 HydrophobicContact CG2-CG2 3.35Å; T369-V373 PolarHBondContact O-N 3.12Å; T369-V373 VanDerWaalsContact O-N 3.08Å; L370-V373 PolarHBondContact O-N 2.95Å; V371-V373 PolarHBondContact O-N 3.43Å
374	W	83.3	Confident	88.1	Confident	156 Å²	156	55.6 Å²	55.6	59%	0.591	26%	0.262	S	S	*	.	H	α-helix	trans	-74.5	-37.2	177.2	178.2	87.6	0	0	0	113.4	L370 V371 G372 K378	L370-W374 PolarHBondContact O-N 3.04Å; V371-W374 WeakPolarHBondContact O-CB 3.44Å; V371-W374 PolarHBondContact O-N 3.21Å; V371-W374 VanDerWaalsContact O-N 3.15Å; G372-W374 PolarHBondContact O-N 2.84Å; G372-W374 VanDerWaalsContact O-N 3.15Å; W374-K378 HydrophobicContact CH2-CD 3.96Å; W374-K378 HydrophobicContact CZ2-CD 3.93Å; W374-K378 HydrophobicContact CZ3-CD 4.28Å
375	L	86.6	Confident	88	Confident	44 Å²	44	54.9 Å²	54.9	23%	0.23	26%	0.257	C	S	.	.	H	α-helix	trans	-72.5	-31.1	-178.8	-94.7	120.3	0	0	0	113.9	V371 G372 E377 K378 V379 L384	V371-L375 HydrophobicContact CB-CD1 4.39Å; V371-L375 HydrophobicContact CG1-CD1 3.18Å; V371-L375 VanDerWaalsContact O-CD1 3.27Å; V371-L375 WeakPolarHBondContact O-CD1 3.4Å; V371-L375 PolarHBondContact O-N 3.16Å; G372-L375 PolarHBondContact O-N 3.22Å; L375-E377 VanDerWaalsContact C-N 3.29Å; L375-E377 PolarHBondContact O-N 3.4Å; L375-K378 PolarHBondContact O-N 3.48Å; L375-V379 HydrophobicContact CD2-CG2 3.81Å; L375-V379 PolarHBondContact O-N 3.01Å; L375-L384 HydrophobicContact CB-CD1 4.18Å; L375-L384 HydrophobicContact CB-CD2 4.31Å; L375-L384 HydrophobicContact CD2-CD1 4.26Å
376	V	80.9	Confident	88.1	Confident	13 Å²	13	57.9 Å²	57.9	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-52.9	-45.7	-177.1	164.9	0	0	0	0	112.6	G372 G380 R381 L384 M518	G372-V376 VanDerWaalsContact O-CG2 3.24Å; G372-V376 WeakPolarHBondContact O-CG2 3.2Å; G372-V376 PolarHBondContact O-N 3.45Å; V376-G380 PolarHBondContact O-N 2.93Å; V376-R381 PolarHBondContact O-NH1 3.47Å; V376-L384 HydrophobicContact CB-CD2 4.33Å; V376-L384 HydrophobicContact CG2-CD2 3.49Å; V376-L384 VanDerWaalsContact CG2-CD2 3.49Å; V376-M518 HydrophobicContact CB-CE 4.23Å; V376-M518 HydrophobicContact CG1-CE 4.03Å; V376-M518 HydrophobicContact CG1-SD 4.49Å; V376-M518 HydrophobicContact CG2-CE 3.11Å; V376-M518 HydrophobicContact CG2-SD 3.81Å
377	E	79.5	Confident	88.2	Confident	118 Å²	118	57.4 Å²	57.4	55%	0.551	28%	0.279	S	S	*	.	H	α-helix	trans	-74.2	-28.4	-178.7	-66.5	-55	140.2	0	0	112.4	L375 R381 K589	L375-E377 VanDerWaalsContact C-N 3.29Å; L375-E377 PolarHBondContact O-N 3.4Å; E377-R381 IonicContact OE1-CZ 3.97Å; E377-R381 IonicContact OE1-NH1 2.61Å; E377-R381 IonicContact OE1-NH2 3.45Å; E377-R381 PolarHBondContact OE1-NH2 2.84Å; E377-R381 IonicContact OE2-NH1 3.07Å; E377-R381 IonicContact OE2-NH2 3.63Å; E377-K589 WeakPolarHBondContact O-CE 3.34Å; E377-K589 PolarHBondContact O-NZ 3.11Å
378	K	84.6	Confident	88.3	Confident	128 Å²	128	54.8 Å²	54.8	56%	0.557	27%	0.266	S	S	*	.	H	α-helix	trans	-80.6	-53	179.7	-70.3	-166.2	174.4	-169.3	0	112.7	W374 L375 K589	W374-K378 HydrophobicContact CH2-CD 3.96Å; W374-K378 HydrophobicContact CZ2-CD 3.93Å; W374-K378 HydrophobicContact CZ3-CD 4.28Å; L375-K378 PolarHBondContact O-N 3.48Å; K378-K589 PolarHBondContact O-NZ 3.27Å
379	V	87.7	Confident	88.5	Confident	60 Å²	60	51.9 Å²	51.9	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-86.3	-31.3	-168.5	174.9	0	0	0	0	112.9	L375 K383 L384	L375-V379 HydrophobicContact CD2-CG2 3.81Å; L375-V379 PolarHBondContact O-N 3.01Å; V379-K383 HydrophobicContact CG1-CB 3.69Å; V379-L384 HydrophobicContact CG1-CB 4.33Å
380	G	84.1	Confident	88.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.262	C	S	.	.			trans	95	163.2	-170.4	0	0	0	0	0	112.7	V376 L384	V376-G380 PolarHBondContact O-N 2.93Å; G380-L384 WeakPolarHBondContact O-CB 3.25Å; G380-L384 PolarHBondContact O-N 3.36Å
381	R	86.5	Confident	89.2	Confident	25 Å²	25	49.9 Å²	49.9	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-78.5	-44.1	-166.2	-71.5	75.3	173.3	138.9	5	110.6	V376 E377 T385 M518 V522 E525 E587	V376-R381 PolarHBondContact O-NH1 3.47Å; E377-R381 IonicContact OE1-CZ 3.97Å; E377-R381 IonicContact OE1-NH1 2.61Å; E377-R381 IonicContact OE1-NH2 3.45Å; E377-R381 PolarHBondContact OE1-NH2 2.84Å; E377-R381 IonicContact OE2-NH1 3.07Å; E377-R381 IonicContact OE2-NH2 3.63Å; R381-T385 WeakPolarHBondContact O-CB 3.33Å; R381-T385 PolarHBondContact O-N 2.9Å; R381-T385 PolarHBondContact O-OG1 2.95Å; R381-M518 HydrophobicContact CB-SD 4.31Å; R381-M518 HydrophobicContact CG-SD 4.12Å; R381-V522 HydrophobicContact CB-CG2 4.12Å; R381-V522 HydrophobicContact CG-CG2 4.43Å; R381-E525 IonicContact CZ-OE1 3.22Å; R381-E525 IonicContact NE-OE1 3.58Å; R381-E525 PolarHBondContact NE-OE1 3.14Å; R381-E525 IonicContact NE-OE2 3.32Å; R381-E525 IonicContact NH2-OE1 2.58Å; R381-E587 PolarHBondContact N-OE1 3.46Å
382	R	90.4	Very high	89.6	Confident	76 Å²	76	47.3 Å²	47.3	29%	0.287	23%	0.233	S	C	.	.	H	α-helix	trans	-65.2	-52.4	-178.5	-176.9	-175.7	-177.8	-174.8	3.6	111.6	L384 T385 F386 Y582 L585 E587	R382-L384 VanDerWaalsContact C-N 3.34Å; R382-L384 PolarHBondContact O-N 3.28Å; R382-T385 PolarHBondContact O-N 2.94Å; R382-F386 WeakPolarHBondContact O-CB 3.24Å; R382-F386 PolarHBondContact O-N 2.52Å; R382-Y582 PolarHBondContact NH2-O 3.34Å; R382-L585 HydrophobicContact CB-CD2 4.37Å; R382-L585 HydrophobicContact CB-CG 4.45Å; R382-L585 WeakPolarHBondContact CD-O 3.28Å; R382-L585 HydrophobicContact CG-CD2 4.32Å; R382-L585 HydrophobicContact CG-CG 4.28Å; R382-L585 WeakPolarHBondContact CG-O 3.46Å; R382-L585 PolarHBondContact NE-O 2.89Å; R382-E587 HydrophobicContact CB-CB 4.21Å; R382-E587 WeakPolarHBondContact CB-OE2 3.23Å; R382-E587 PolarHBondContact N-OE1 3.33Å; R382-E587 PolarHBondContact N-OE2 3.02Å
383	K	91.9	Very high	90.1	Very high	148 Å²	148	48 Å²	48	64%	0.643	24%	0.237	S	C	*	.	H	α-helix	trans	-62	-40.6	-178.2	-68.7	179.2	-175.9	176.1	0	112.2	V379 G387	V379-K383 HydrophobicContact CG1-CB 3.69Å; K383-G387 PolarHBondContact O-N 2.89Å
384	L	92.3	Very high	90.9	Very high	15 Å²	15	49.1 Å²	49.1	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-43.6	178.6	-174.1	62.8	0	0	0	112.1	L375 V376 V379 G380 R382 S388 P513 M518	L375-L384 HydrophobicContact CB-CD1 4.18Å; L375-L384 HydrophobicContact CB-CD2 4.31Å; L375-L384 HydrophobicContact CD2-CD1 4.26Å; V376-L384 HydrophobicContact CB-CD2 4.33Å; V376-L384 HydrophobicContact CG2-CD2 3.49Å; V376-L384 VanDerWaalsContact CG2-CD2 3.49Å; V379-L384 HydrophobicContact CG1-CB 4.33Å; G380-L384 WeakPolarHBondContact O-CB 3.25Å; G380-L384 PolarHBondContact O-N 3.36Å; R382-L384 VanDerWaalsContact C-N 3.34Å; R382-L384 PolarHBondContact O-N 3.28Å; L384-S388 WeakPolarHBondContact O-CB 3.29Å; L384-S388 PolarHBondContact O-N 2.95Å; L384-P513 WeakPolarHBondContact CD2-O 3.35Å; L384-M518 HydrophobicContact CD2-CG 4.42Å; L384-M518 HydrophobicContact CD2-SD 4.24Å
385	T	93.4	Very high	91.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-46.1	176.9	-53	0	0	0	0	111.1	L323 R381 R382 S388 L389 M515 M518 V581 L585	L323-T385 HydrophobicContact CD2-CG2 4.34Å; R381-T385 WeakPolarHBondContact O-CB 3.33Å; R381-T385 PolarHBondContact O-N 2.9Å; R381-T385 PolarHBondContact O-OG1 2.95Å; R382-T385 PolarHBondContact O-N 2.94Å; T385-S388 PolarHBondContact O-N 3.46Å; T385-L389 WeakPolarHBondContact O-CB 3.25Å; T385-L389 PolarHBondContact O-N 2.91Å; T385-M515 HydrophobicContact CG2-SD 3.63Å; T385-M518 HydrophobicContact CG2-CB 4.48Å; T385-M518 WeakPolarHBondContact OG1-CB 3.44Å; T385-M518 WeakPolarHBondContact OG1-CG 3.23Å; T385-V581 HydrophobicContact CG2-CG1 4.24Å; T385-V581 HydrophobicContact CG2-CG2 4.3Å; T385-L585 HydrophobicContact CG2-CD2 4.13Å
386	F	95.1	Very high	92	Very high	74 Å²	74	39.6 Å²	39.6	33%	0.325	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-49.3	177.9	-179.5	-95.9	0	0	0	112.2	R382 S388 L389 A390 L578 V581 Y582	R382-F386 WeakPolarHBondContact O-CB 3.24Å; R382-F386 PolarHBondContact O-N 2.52Å; F386-S388 VanDerWaalsContact C-N 3.32Å; F386-S388 PolarHBondContact O-N 3.26Å; F386-L389 PolarHBondContact O-N 3.01Å; F386-A390 WeakPolarHBondContact O-CB 3.5Å; F386-A390 PolarHBondContact O-N 3.49Å; F386-L578 HydrophobicContact CD2-CD1 3.56Å; F386-L578 HydrophobicContact CD2-CG 4.35Å; F386-L578 HydrophobicContact CE2-CD1 3.4Å; F386-L578 VanDerWaalsContact CE2-CD1 3.4Å; F386-L578 HydrophobicContact CE2-CG 3.78Å; F386-L578 HydrophobicContact CG-CD1 4.24Å; F386-L578 HydrophobicContact CZ-CD1 3.99Å; F386-L578 HydrophobicContact CZ-CG 4.36Å; F386-V581 HydrophobicContact CB-CG1 3.98Å; F386-V581 HydrophobicContact CD2-CG1 4.27Å; F386-Y582 HydrophobicContact CE2-CD2 4.06Å; F386-Y582 HydrophobicContact CE2-CG 4.4Å; F386-Y582 HydrophobicContact CZ-CD2 4.42Å
387	G	95	Very high	92.7	Very high	38 Å²	38	42.1 Å²	42.1	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-62.2	-39.5	178.8	0	0	0	0	0	112.7	K383 G391	K383-G387 PolarHBondContact O-N 2.89Å; G387-G391 PolarHBondContact O-N 3.17Å
388	S	96	Very high	93.5	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-49	174.9	172.9	0	0	0	0	112	L384 T385 F386 A390 G391 T392 F510 F511 M515	L384-S388 WeakPolarHBondContact O-CB 3.29Å; L384-S388 PolarHBondContact O-N 2.95Å; T385-S388 PolarHBondContact O-N 3.46Å; F386-S388 VanDerWaalsContact C-N 3.32Å; F386-S388 PolarHBondContact O-N 3.26Å; S388-A390 PolarHBondContact O-N 3.35Å; S388-G391 PolarHBondContact O-N 3.05Å; S388-T392 VanDerWaalsContact O-CB 3.32Å; S388-T392 WeakPolarHBondContact O-CB 3.15Å; S388-T392 PolarHBondContact O-N 3.06Å; S388-T392 PolarHBondContact O-OG1 3.18Å; S388-F510 WeakPolarHBondContact CA-O 3.36Å; S388-F510 VanDerWaalsContact CB-O 3.23Å; S388-F510 WeakPolarHBondContact CB-O 3.38Å; S388-F510 PolarHBondContact OG-O 3.41Å; S388-F511 PolarHBondContact OG-O 3.17Å; S388-M515 PolarHBondContact OG-N 3.37Å
389	L	95.9	Very high	94	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.1	-35.1	-179.9	-170.7	54.2	0	0	0	112.5	T385 F386 T392 T393 M515 A574 G577 L578 V581	T385-L389 WeakPolarHBondContact O-CB 3.25Å; T385-L389 PolarHBondContact O-N 2.91Å; F386-L389 PolarHBondContact O-N 3.01Å; L389-T392 PolarHBondContact O-N 3.16Å; L389-T393 WeakPolarHBondContact O-CB 3.3Å; L389-T393 PolarHBondContact O-N 3.47Å; L389-T393 PolarHBondContact O-OG1 2.9Å; L389-M515 HydrophobicContact CB-CG 3.93Å; L389-M515 HydrophobicContact CB-SD 4.13Å; L389-M515 HydrophobicContact CD1-CE 4.4Å; L389-M515 HydrophobicContact CD1-CG 4.19Å; L389-M515 HydrophobicContact CD1-SD 4.39Å; L389-M515 HydrophobicContact CD2-SD 4.23Å; L389-A574 HydrophobicContact CD1-CB 4.19Å; L389-G577 WeakPolarHBondContact CD2-O 3.42Å; L389-L578 HydrophobicContact CB-CD1 4.17Å; L389-L578 HydrophobicContact CD2-CB 4.4Å; L389-L578 HydrophobicContact CG-CB 4.38Å; L389-L578 HydrophobicContact CG-CD1 4.33Å; L389-V581 HydrophobicContact CD2-CG2 3.97Å
390	A	97.1	Very high	94.3	Very high	27 Å²	27	30.4 Å²	30.4	22%	0.223	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-50.1	173.5	0	0	0	0	0	111.3	F386 S388 T392 T393 V394 L578	F386-A390 WeakPolarHBondContact O-CB 3.5Å; F386-A390 PolarHBondContact O-N 3.49Å; S388-A390 PolarHBondContact O-N 3.35Å; A390-T392 VanDerWaalsContact C-N 3.32Å; A390-T392 PolarHBondContact O-N 2.9Å; A390-T393 WeakPolarHBondContact O-CB 3.39Å; A390-T393 PolarHBondContact O-N 3.42Å; A390-V394 WeakPolarHBondContact O-CG2 3.3Å; A390-V394 PolarHBondContact O-N 3.26Å; A390-L578 HydrophobicContact CB-CD1 3.85Å; A390-L578 HydrophobicContact CB-CD2 4.24Å
391	G	96.8	Very high	94.8	Very high	9 Å²	9	34.2 Å²	34.2	9%	0.093	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-39	176.5	0	0	0	0	0	112.7	G387 S388 T393 V394 A395 F510	G387-G391 PolarHBondContact O-N 3.17Å; S388-G391 PolarHBondContact O-N 3.05Å; G391-T393 VanDerWaalsContact C-N 3.34Å; G391-T393 PolarHBondContact O-N 3.07Å; G391-V394 PolarHBondContact O-N 3Å; G391-A395 WeakPolarHBondContact O-CB 3.39Å; G391-A395 PolarHBondContact O-N 3.42Å; G391-F510 WeakPolarHBondContact O-CD2 3.48Å
392	T	96.5	Very high	95.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-43	174.6	-56.4	0	0	0	0	111.1	S388 L389 A390 A395 L396 Y507 F511	S388-T392 VanDerWaalsContact O-CB 3.32Å; S388-T392 WeakPolarHBondContact O-CB 3.15Å; S388-T392 PolarHBondContact O-N 3.06Å; S388-T392 PolarHBondContact O-OG1 3.18Å; L389-T392 PolarHBondContact O-N 3.16Å; A390-T392 VanDerWaalsContact C-N 3.32Å; A390-T392 PolarHBondContact O-N 2.9Å; T392-A395 PolarHBondContact O-N 3.03Å; T392-L396 HydrophobicContact CG2-CD1 4.45Å; T392-L396 WeakPolarHBondContact O-CG 3.26Å; T392-L396 PolarHBondContact O-N 2.89Å; T392-Y507 HydrophobicContact CG2-CD2 3.52Å; T392-Y507 HydrophobicContact CG2-CE2 3.18Å; T392-Y507 HydrophobicContact CG2-CG 4.47Å; T392-F511 HydrophobicContact CG2-CD2 4.14Å
393	T	97.4	Very high	95.2	Very high	13 Å²	13	29.8 Å²	29.8	8%	0.08	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-45	177.1	-55.1	0	0	0	0	111	L389 A390 G391 A395 L396 I397 T571 A575	L389-T393 WeakPolarHBondContact O-CB 3.3Å; L389-T393 PolarHBondContact O-N 3.47Å; L389-T393 PolarHBondContact O-OG1 2.9Å; A390-T393 WeakPolarHBondContact O-CB 3.39Å; A390-T393 PolarHBondContact O-N 3.42Å; G391-T393 VanDerWaalsContact C-N 3.34Å; G391-T393 PolarHBondContact O-N 3.07Å; T393-A395 PolarHBondContact O-N 2.96Å; T393-L396 PolarHBondContact O-N 2.7Å; T393-I397 HydrophobicContact CG2-CD1 4.44Å; T393-I397 WeakPolarHBondContact O-CG1 3.11Å; T393-I397 PolarHBondContact O-N 3.04Å; T393-T571 HydrophobicContact CG2-CG2 4.13Å; T393-A575 HydrophobicContact CG2-CB 4.22Å
394	V	97.1	Very high	95.3	Very high	81 Å²	81	25 Å²	25	49%	0.491	15%	0.147	S	C	.	.	H	α-helix	trans	-62.8	-42.4	176	175.2	0	0	0	0	111.4	A390 G391 I397 I398	A390-V394 WeakPolarHBondContact O-CG2 3.3Å; A390-V394 PolarHBondContact O-N 3.26Å; G391-V394 PolarHBondContact O-N 3Å; V394-I397 WeakPolarHBondContact O-CB 3.5Å; V394-I397 PolarHBondContact O-N 2.91Å; V394-I398 HydrophobicContact CG1-CD1 4.19Å; V394-I398 WeakPolarHBondContact O-CG1 3.27Å; V394-I398 PolarHBondContact O-N 3.3Å
395	A	96.9	Very high	95.3	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-39.3	177.5	0	0	0	0	0	112.8	G391 T392 T393 I397 I398 L399 L506 Y507	G391-A395 WeakPolarHBondContact O-CB 3.39Å; G391-A395 PolarHBondContact O-N 3.42Å; T392-A395 PolarHBondContact O-N 3.03Å; T393-A395 PolarHBondContact O-N 2.96Å; A395-I397 VanDerWaalsContact C-N 3.33Å; A395-I397 PolarHBondContact O-N 3.24Å; A395-I398 PolarHBondContact O-N 3.21Å; A395-L399 WeakPolarHBondContact O-CB 3.1Å; A395-L399 PolarHBondContact O-N 2.69Å; A395-L506 HydrophobicContact CB-CB 3.88Å; A395-Y507 VanDerWaalsContact CB-CA 3.46Å; A395-Y507 VanDerWaalsContact CB-N 3.33Å
396	L	96.2	Very high	95.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-36.1	173.4	-73.4	175.5	0	0	0	112.1	I335 T392 T393 L399 S400 Y507 F567 T571 A574	I335-L396 HydrophobicContact CD1-CD2 4.43Å; T392-L396 HydrophobicContact CG2-CD1 4.45Å; T392-L396 WeakPolarHBondContact O-CG 3.26Å; T392-L396 PolarHBondContact O-N 2.89Å; T393-L396 PolarHBondContact O-N 2.7Å; L396-L399 HydrophobicContact CD2-CD2 4.46Å; L396-L399 PolarHBondContact O-N 2.91Å; L396-S400 WeakPolarHBondContact O-CB 3.15Å; L396-S400 PolarHBondContact O-N 3.1Å; L396-S400 PolarHBondContact O-OG 2.9Å; L396-Y507 HydrophobicContact CD1-CD2 4.47Å; L396-Y507 HydrophobicContact CD1-CE2 4.07Å; L396-Y507 HydrophobicContact CD2-CD2 3.57Å; L396-Y507 HydrophobicContact CD2-CE2 3.62Å; L396-Y507 HydrophobicContact CG-CD2 3.7Å; L396-Y507 HydrophobicContact CG-CE2 3.78Å; L396-F567 HydrophobicContact CD2-CD1 4.35Å; L396-T571 WeakPolarHBondContact CB-OG1 3.27Å; L396-A574 HydrophobicContact CD1-CB 3.94Å
397	I	96.4	Very high	94.8	Very high	66 Å²	66	26 Å²	26	34%	0.338	16%	0.158	S	C	.	.	H	α-helix	trans	-61.8	-47.7	172.4	-68	165.2	0	0	0	110.1	T393 V394 A395 L399 S400 L401 T571	T393-I397 HydrophobicContact CG2-CD1 4.44Å; T393-I397 WeakPolarHBondContact O-CG1 3.11Å; T393-I397 PolarHBondContact O-N 3.04Å; V394-I397 WeakPolarHBondContact O-CB 3.5Å; V394-I397 PolarHBondContact O-N 2.91Å; A395-I397 VanDerWaalsContact C-N 3.33Å; A395-I397 PolarHBondContact O-N 3.24Å; I397-L399 VanDerWaalsContact C-N 3.32Å; I397-L399 PolarHBondContact O-N 3.37Å; I397-S400 PolarHBondContact O-N 3.47Å; I397-L401 HydrophobicContact CG2-CD1 3.79Å; I397-L401 HydrophobicContact CG2-CG 4.26Å; I397-L401 WeakPolarHBondContact O-CB 3.37Å; I397-L401 VanDerWaalsContact O-CG 3.28Å; I397-L401 WeakPolarHBondContact O-CG 3.43Å; I397-L401 PolarHBondContact O-N 3.49Å; I397-T571 HydrophobicContact CD1-CG2 4.17Å; I397-T571 HydrophobicContact CG1-CG2 3.47Å; I397-T571 VanDerWaalsContact CG1-CG2 3.47Å
398	I	95.6	Very high	94.5	Very high	59 Å²	59	31.2 Å²	31.2	30%	0.303	17%	0.172	S	C	.	.	H	α-helix	trans	-59.8	-44.5	178.1	-66.5	167	0	0	0	110.6	V394 A395 L401 G402 L506	V394-I398 HydrophobicContact CG1-CD1 4.19Å; V394-I398 WeakPolarHBondContact O-CG1 3.27Å; V394-I398 PolarHBondContact O-N 3.3Å; A395-I398 PolarHBondContact O-N 3.21Å; I398-L401 PolarHBondContact O-N 3.38Å; I398-G402 PolarHBondContact O-N 3.3Å; I398-L506 HydrophobicContact CD1-CD1 3.83Å
399	L	94.8	Very high	94.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-47.7	176.6	-177.1	57.9	0	0	0	111.8	A395 L396 I397 L401 G402 F403 A500 L504 F567	A395-L399 WeakPolarHBondContact O-CB 3.1Å; A395-L399 PolarHBondContact O-N 2.69Å; L396-L399 HydrophobicContact CD2-CD2 4.46Å; L396-L399 PolarHBondContact O-N 2.91Å; I397-L399 VanDerWaalsContact C-N 3.32Å; I397-L399 PolarHBondContact O-N 3.37Å; L399-L401 PolarHBondContact O-N 2.89Å; L399-G402 PolarHBondContact O-N 3.4Å; L399-F403 HydrophobicContact CD1-CD2 4.03Å; L399-F403 HydrophobicContact CD1-CE2 3.64Å; L399-F403 HydrophobicContact CG-CD2 4.21Å; L399-F403 HydrophobicContact CG-CE2 4.07Å; L399-F403 WeakPolarHBondContact O-CD2 3.27Å; L399-F403 PolarHBondContact O-N 2.82Å; L399-A500 HydrophobicContact CD1-CB 3.85Å; L399-A500 VanDerWaalsContact CD1-O 3.27Å; L399-A500 WeakPolarHBondContact CD1-O 3.32Å; L399-L504 HydrophobicContact CD1-CD2 4.5Å; L399-L504 HydrophobicContact CD1-CG 4.05Å; L399-L504 HydrophobicContact CD2-CD2 3.85Å; L399-L504 HydrophobicContact CD2-CG 4.27Å; L399-F567 HydrophobicContact CD2-CD1 3.59Å; L399-F567 HydrophobicContact CD2-CD2 4.48Å; L399-F567 HydrophobicContact CD2-CE1 3.54Å; L399-F567 HydrophobicContact CD2-CE2 4.46Å; L399-F567 HydrophobicContact CD2-CG 4.09Å; L399-F567 HydrophobicContact CD2-CZ 4.01Å; L399-F567 HydrophobicContact CG-CD1 4.24Å; L399-F567 HydrophobicContact CG-CD2 4.41Å; L399-F567 HydrophobicContact CG-CE1 4.44Å; L399-F567 HydrophobicContact CG-CG 4.23Å
400	S	94.9	Very high	93.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-43.2	179.2	-53.3	0	0	0	0	111.7	L396 I397 G402 F403 L404 Y564 F567 F568	L396-S400 WeakPolarHBondContact O-CB 3.15Å; L396-S400 PolarHBondContact O-N 3.1Å; L396-S400 PolarHBondContact O-OG 2.9Å; I397-S400 PolarHBondContact O-N 3.47Å; S400-G402 VanDerWaalsContact C-N 3.34Å; S400-F403 PolarHBondContact O-N 3.46Å; S400-L404 WeakPolarHBondContact O-CB 3.35Å; S400-L404 PolarHBondContact O-N 3.33Å; S400-Y564 WeakPolarHBondContact O-CB 3.36Å; S400-F567 WeakPolarHBondContact OG-CB 3.46Å; S400-F567 PolarHBondContact OG-O 3.03Å; S400-F568 PolarHBondContact OG-N 2.93Å
401	L	94.6	Very high	93.3	Very high	80 Å²	80	33 Å²	33	42%	0.419	19%	0.185	S	C	.	.	H	α-helix	trans	-65.6	-36.9	174.9	-70.6	174.2	0	0	0	111.9	I397 I398 L399 L404 M405 F568	I397-L401 HydrophobicContact CG2-CD1 3.79Å; I397-L401 HydrophobicContact CG2-CG 4.26Å; I397-L401 WeakPolarHBondContact O-CB 3.37Å; I397-L401 VanDerWaalsContact O-CG 3.28Å; I397-L401 WeakPolarHBondContact O-CG 3.43Å; I397-L401 PolarHBondContact O-N 3.49Å; I398-L401 PolarHBondContact O-N 3.38Å; L399-L401 PolarHBondContact O-N 2.89Å; L401-L404 HydrophobicContact CD2-CD2 4.37Å; L401-L404 PolarHBondContact O-N 2.85Å; L401-M405 WeakPolarHBondContact O-CB 3.19Å; L401-M405 VanDerWaalsContact O-CG 3.32Å; L401-M405 WeakPolarHBondContact O-CG 3.39Å; L401-M405 PolarHBondContact O-N 3.21Å; L401-F568 HydrophobicContact CD2-CZ 4.18Å
402	G	93.2	Very high	93	Very high	4 Å²	4	41.2 Å²	41.2	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-45.8	173.8	0	0	0	0	0	112.3	I398 L399 S400 M405 S406	I398-G402 PolarHBondContact O-N 3.3Å; L399-G402 PolarHBondContact O-N 3.4Å; S400-G402 VanDerWaalsContact C-N 3.34Å; G402-M405 PolarHBondContact O-N 2.97Å; G402-S406 WeakPolarHBondContact O-CB 3.36Å; G402-S406 PolarHBondContact O-N 3.37Å
403	F	92.9	Very high	92.6	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.022	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-37.3	173.7	-81.8	-71.2	0	0	0	112.8	I342 M345 L399 S400 S406 A407 A500 Y563 F567	I342-F403 HydrophobicContact CG2-CE2 4.07Å; I342-F403 HydrophobicContact CG2-CZ 3.77Å; M345-F403 HydrophobicContact CB-CE1 4.11Å; L399-F403 HydrophobicContact CD1-CD2 4.03Å; L399-F403 HydrophobicContact CD1-CE2 3.64Å; L399-F403 HydrophobicContact CG-CD2 4.21Å; L399-F403 HydrophobicContact CG-CE2 4.07Å; L399-F403 WeakPolarHBondContact O-CD2 3.27Å; L399-F403 PolarHBondContact O-N 2.82Å; S400-F403 PolarHBondContact O-N 3.46Å; F403-S406 PolarHBondContact O-N 3.25Å; F403-A407 WeakPolarHBondContact O-CB 3.41Å; F403-A407 PolarHBondContact O-N 2.93Å; F403-A500 HydrophobicContact CE2-CB 4.15Å; F403-A500 HydrophobicContact CZ-CB 4.25Å; F403-Y563 HydrophobicContact CD1-CG 4.46Å; F403-F567 AromaticContact CD2-CD2 3.64Å; F403-F567 HydrophobicContact CD2-CD2 3.64Å; F403-F567 AromaticContact CD2-CE2 3.83Å; F403-F567 HydrophobicContact CD2-CE2 3.83Å; F403-F567 AromaticContact CE2-CD2 3.67Å; F403-F567 HydrophobicContact CE2-CD2 3.67Å; F403-F567 AromaticContact CE2-CE2 3.34Å; F403-F567 HydrophobicContact CE2-CE2 3.34Å; F403-F567 HydrophobicContact CE2-CZ 4.2Å; F403-F567 HydrophobicContact CZ-CE2 4Å
404	L	93.1	Very high	92.1	Very high	46 Å²	46	44.6 Å²	44.6	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-43.7	176.3	-179.5	62.3	0	0	0	111.7	S400 L401 S406 A407 Q408 Y564	S400-L404 WeakPolarHBondContact O-CB 3.35Å; S400-L404 PolarHBondContact O-N 3.33Å; L401-L404 HydrophobicContact CD2-CD2 4.37Å; L401-L404 PolarHBondContact O-N 2.85Å; L404-S406 VanDerWaalsContact C-N 3.32Å; L404-A407 PolarHBondContact O-N 3.4Å; L404-Q408 WeakPolarHBondContact O-CG 3.41Å; L404-Q408 PolarHBondContact O-N 2.96Å; L404-Y564 HydrophobicContact CB-CG 4.29Å; L404-Y564 HydrophobicContact CD1-CD1 4.28Å; L404-Y564 HydrophobicContact CD1-CD2 4.14Å; L404-Y564 HydrophobicContact CD1-CE1 4.34Å; L404-Y564 HydrophobicContact CD1-CE2 4.22Å; L404-Y564 HydrophobicContact CD1-CG 4.19Å
405	M	91.3	Very high	91.4	Very high	85 Å²	85	45.4 Å²	45.4	42%	0.419	23%	0.231	S	C	.	.	H	α-helix	trans	-62.8	-41.1	174.6	-72.1	-179.2	69.8	0	0	111.3	L401 G402 Q408 A409 Y496	L401-M405 WeakPolarHBondContact O-CB 3.19Å; L401-M405 VanDerWaalsContact O-CG 3.32Å; L401-M405 WeakPolarHBondContact O-CG 3.39Å; L401-M405 PolarHBondContact O-N 3.21Å; G402-M405 PolarHBondContact O-N 2.97Å; M405-Q408 PolarHBondContact O-N 3.47Å; M405-A409 VanDerWaalsContact O-CB 3.26Å; M405-A409 WeakPolarHBondContact O-CB 3.36Å; M405-A409 PolarHBondContact O-N 3.42Å; M405-Y496 HydrophobicContact CB-CG 4.44Å; M405-Y496 HydrophobicContact CE-CD1 3.73Å; M405-Y496 HydrophobicContact CE-CE1 3.65Å; M405-Y496 HydrophobicContact CE-CG 4.39Å
406	S	89.6	Confident	90.7	Very high	11 Å²	11	50.9 Å²	50.9	8%	0.077	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-43.2	175.3	-170.3	0	0	0	0	112	S346 G402 F403 L404 A409 S410 T494	S346-S406 PolarHBondContact O-OG 2.83Å; G402-S406 WeakPolarHBondContact O-CB 3.36Å; G402-S406 PolarHBondContact O-N 3.37Å; F403-S406 PolarHBondContact O-N 3.25Å; L404-S406 VanDerWaalsContact C-N 3.32Å; S406-A409 PolarHBondContact O-N 2.95Å; S406-S410 PolarHBondContact O-N 3.03Å; S406-S410 VanDerWaalsContact O-N 3.1Å; S406-T494 WeakPolarHBondContact OG-CG2 3.06Å; S406-T494 PolarHBondContact OG-OG1 2.85Å
407	A	88.9	Confident	89.9	Confident	15 Å²	15	51.6 Å²	51.6	12%	0.124	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-43.3	177	0	0	0	0	0	112.4	F403 L404 S410 N434 Y564	F403-A407 WeakPolarHBondContact O-CB 3.41Å; F403-A407 PolarHBondContact O-N 2.93Å; L404-A407 PolarHBondContact O-N 3.4Å; A407-S410 VanDerWaalsContact O-CB 3.27Å; A407-S410 WeakPolarHBondContact O-CB 3.16Å; A407-S410 PolarHBondContact O-N 3.26Å; A407-S410 PolarHBondContact O-OG 2.93Å; A407-N434 HydrophobicContact CB-CB 4.5Å; A407-Y564 HydrophobicContact CB-CD1 4.04Å; A407-Y564 HydrophobicContact CB-CE1 3.93Å
408	Q	89.1	Confident	88.9	Confident	147 Å²	147	54.8 Å²	54.8	69%	0.687	29%	0.286	S	S	*	.	H	α-helix	trans	-68.9	-33.3	178.3	-71.1	178.8	14.2	0	0	113.2	L404 M405 S410	L404-Q408 WeakPolarHBondContact O-CG 3.41Å; L404-Q408 PolarHBondContact O-N 2.96Å; M405-Q408 PolarHBondContact O-N 3.47Å; Q408-S410 VanDerWaalsContact C-N 3.26Å
409	A	88.2	Confident	87.9	Confident	42 Å²	42	54 Å²	54	35%	0.347	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.3	176.6	0	0	0	0	0	113.3	M405 S406 Y496	M405-A409 VanDerWaalsContact O-CB 3.26Å; M405-A409 WeakPolarHBondContact O-CB 3.36Å; M405-A409 PolarHBondContact O-N 3.42Å; S406-A409 PolarHBondContact O-N 2.95Å; A409-Y496 HydrophobicContact CB-CD2 3.56Å; A409-Y496 HydrophobicContact CB-CE2 3.5Å
410	S	87.4	Confident	87.1	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.063	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-63.8	140.3	-176.7	69.7	0	0	0	0	111.4	S406 A407 Q408	S406-S410 PolarHBondContact O-N 3.03Å; S406-S410 VanDerWaalsContact O-N 3.1Å; A407-S410 VanDerWaalsContact O-CB 3.27Å; A407-S410 WeakPolarHBondContact O-CB 3.16Å; A407-S410 PolarHBondContact O-N 3.26Å; A407-S410 PolarHBondContact O-OG 2.93Å; Q408-S410 VanDerWaalsContact C-N 3.26Å
411	P	88.6	Confident	86	Confident	21 Å²	21	63.1 Å²	63.1	14%	0.136	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-66.3	142.9	-177.7	27.3	-35.7	0	0	0	111.3	C433 F444 V453 P493	P411-C433 HydrophobicContact CG-CB 3.87Å; P411-C433 WeakPolarHBondContact O-CB 3.49Å; P411-C433 PolarHBondContact O-N 3.43Å; P411-F444 HydrophobicContact CB-CZ 4.22Å; P411-F444 HydrophobicContact CG-CE1 3.81Å; P411-F444 HydrophobicContact CG-CZ 3.7Å; P411-V453 HydrophobicContact CB-CB 4.05Å; P411-V453 HydrophobicContact CB-CG1 4.3Å; P411-V453 HydrophobicContact CB-CG2 4.08Å; P411-V453 HydrophobicContact CG-CG2 4.17Å; P411-P493 HydrophobicContact CG-CG 3.96Å
412	R	89.2	Confident	84.6	Confident	180 Å²	180	63.4 Å²	63.4	68%	0.679	37%	0.369	S	S	*	.	B	Isolated β-bridge	trans	-70.5	150.8	170.8	66	-177.5	-178.7	-177.7	1.2	110.9	T414 Y432 S456	R412-T414 HydrophobicContact CG-CG2 4.24Å; R412-T414 PolarHBondContact O-N 3.05Å; R412-Y432 HydrophobicContact CB-CE1 4.45Å; R412-S456 PolarHBondContact O-OG 3.38Å
413	V	88.6	Confident	83.5	Confident	25 Å²	25	67.8 Å²	67.8	15%	0.152	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-73.4	117.9	168.1	177.7	0	0	0	0	108.3	S431 F444 S456 C458	V413-S431 PolarHBondContact N-O 3.1Å; V413-F444 HydrophobicContact CG2-CE2 4.05Å; V413-S456 WeakPolarHBondContact CA-OG 3.42Å; V413-C458 HydrophobicContact CG2-CB 4.1Å
414	T	87.3	Confident	82.2	Confident	59 Å²	59	73.5 Å²	73.5	36%	0.362	42%	0.42	S	S	.	.			trans	-93.9	-25.9	-177.7	62.2	0	0	0	0	113.3	R412 D455 S456	R412-T414 HydrophobicContact CG-CG2 4.24Å; R412-T414 PolarHBondContact O-N 3.05Å; T414-D455 WeakPolarHBondContact OG1-CA 3.48Å; T414-S456 PolarHBondContact N-O 3.47Å; T414-S456 PolarHBondContact N-OG 3.38Å; T414-S456 PolarHBondContact OG1-N 3.4Å; T414-S456 PolarHBondContact OG1-O 3.28Å
415	F	83.3	Confident	81.1	Confident	99 Å²	99	73.6 Å²	73.6	43%	0.434	43%	0.427	S	S	.	.			trans	-131.6	124.4	-176.5	-178.4	-92.5	0	0	0	111.1	P417 S456 S457	F415-P417 HydrophobicContact CD1-CB 4.2Å; F415-P417 HydrophobicContact CE1-CB 3.83Å; F415-P417 WeakPolarHBondContact O-CD 3.31Å; F415-S456 PolarHBondContact N-O 3.02Å; F415-S457 WeakPolarHBondContact CD1-OG 3.28Å; F415-S457 WeakPolarHBondContact O-CA 3.42Å; F415-S457 WeakPolarHBondContact O-CB 3.4Å; F415-S457 PolarHBondContact O-OG 3.35Å
416	I	82.2	Confident	80.6	Confident	115 Å²	115	74 Å²	74	59%	0.59	43%	0.434	S	S	*	.			trans	-98.7	106	176.8	-56.4	175.7	0	0	0	107.6	T428	I416-T428 HydrophobicContact CG2-CG2 4.44Å
417	P	78.2	Confident	80.3	Confident	15 Å²	15	73.6 Å²	73.6	10%	0.097	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-73.8	140.1	-179.4	30.6	-32.4	0	0	0	110.4	F415 P419 V459 W471	F415-P417 HydrophobicContact CD1-CB 4.2Å; F415-P417 HydrophobicContact CE1-CB 3.83Å; F415-P417 WeakPolarHBondContact O-CD 3.31Å; P417-P419 WeakPolarHBondContact O-CD 3.31Å; P417-V459 HydrophobicContact CG-CG1 3.5Å; P417-V459 VanDerWaalsContact CG-CG1 3.5Å; P417-W471 HydrophobicContact CB-CH2 4.28Å; P417-W471 HydrophobicContact CB-CZ3 3.85Å; P417-W471 HydrophobicContact CG-CH2 4.06Å; P417-W471 HydrophobicContact CG-CZ3 4.03Å
418	V	76.1	Confident	80	Confident	133 Å²	133	74.3 Å²	74.3	81%	0.806	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-72.8	121.9	176.3	-179.3	0	0	0	0	108.5
419	P	75.4	Confident	79.7	Confident	43 Å²	43	70.2 Å²	70.2	28%	0.279	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-65.3	140.3	-179.3	25.1	-32.4	0	0	0	111.1	P417 A425 W471	P417-P419 WeakPolarHBondContact O-CD 3.31Å; P419-A425 HydrophobicContact CG-CB 4.06Å; P419-W471 HydrophobicContact CB-CH2 3.97Å; P419-W471 HydrophobicContact CB-CZ2 4.03Å
420	P	76.9	Confident	79.6	Confident	56 Å²	56	70.5 Å²	70.5	36%	0.364	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.5	145.2	170	-19	29	0	0	0	110.5	G422 Q423 W471	P420-G422 PolarHBondContact O-N 3.27Å; P420-G422 VanDerWaalsContact O-N 3.08Å; P420-Q423 HydrophobicContact CB-CG 4.38Å; P420-Q423 PolarHBondContact O-N 3.42Å; P420-W471 HydrophobicContact CG-CD2 4.07Å; P420-W471 HydrophobicContact CG-CE3 4.15Å; P420-W471 HydrophobicContact CG-CG 4.23Å
421	S	70.9	Confident	79.7	Confident	135 Å²	135	73.6 Å²	73.6	94%	0.944	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	117.2	-177.9	-51.3	0	0	0	0	111.5
422	G	65.9	Low	79.8	Confident	86 Å²	86	78.2 Å²	78.2	89%	0.887	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.2	6.1	179	0	0	0	0	0	116.2	P420	P420-G422 PolarHBondContact O-N 3.27Å; P420-G422 VanDerWaalsContact O-N 3.08Å
423	Q	70.3	Confident	79.8	Confident	96 Å²	96	69.6 Å²	69.6	45%	0.449	43%	0.43	S	S	.	.	S	Bend	trans	-104.9	151.4	175.3	-63.6	-158.7	8.8	0	0	113.6	P420 A425	P420-Q423 HydrophobicContact CB-CG 4.38Å; P420-Q423 PolarHBondContact O-N 3.42Å; Q423-A425 PolarHBondContact O-N 3.17Å
424	N	65.7	Low	79.8	Confident	126 Å²	126	69.5 Å²	69.5	67%	0.674	43%	0.429	S	S	*	.			trans	-65.5	128.4	-176	-72.6	-8.1	0	0	0	111.6
425	A	69.3	Low	79.9	Confident	47 Å²	47	70.8 Å²	70.8	39%	0.388	43%	0.431	S	S	.	.			trans	-93.9	7.5	178.9	0	0	0	0	0	113.5	P419 Q423 C427 T428	P419-A425 HydrophobicContact CG-CB 4.06Å; Q423-A425 PolarHBondContact O-N 3.17Å; A425-C427 VanDerWaalsContact C-N 3.33Å; A425-C427 PolarHBondContact O-N 2.87Å; A425-T428 WeakPolarHBondContact O-CB 3.47Å; A425-T428 PolarHBondContact O-N 2.68Å; A425-T428 PolarHBondContact O-OG1 3.26Å
426	T	81.2	Confident	80.1	Confident	94 Å²	94	66.1 Å²	66.1	58%	0.577	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-54	-46.8	-172.1	3	0	0	0	0	112.4	T428 G429	T426-T428 PolarHBondContact O-N 3.22Å; T426-G429 PolarHBondContact O-N 3.48Å; T426-G429 VanDerWaalsContact O-N 3.16Å
427	C	83.9	Confident	80.4	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.014	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-62.6	-26.4	179.5	-56.9	0	0	0	0	114	A425 G429 H430 C442 C458 P460	A425-C427 VanDerWaalsContact C-N 3.33Å; A425-C427 PolarHBondContact O-N 2.87Å; C427-G429 PolarHBondContact O-N 3.44Å; C427-H430 PolarHBondContact O-N 2.88Å; C427-C442 WeakPolarHBondContact CA-SG 3.42Å; C427-C442 HydrophobicContact CB-CB 3.78Å; C427-C442 WeakPolarHBondContact CB-SG 3.33Å; C427-C442 WeakPolarHBondContact SG-CA 3.48Å; C427-C442 WeakPolarHBondContact SG-CB 3.29Å; C427-C442 CovalentContact SG-SG 2.03Å; C427-C442 PolarHBondContact SG-SG 3.32Å; C427-C458 WeakPolarHBondContact O-CB 3.46Å; C427-C458 PolarHBondContact O-SG 3.29Å; C427-P460 HydrophobicContact CB-CG 4.25Å
428	T	81.3	Confident	80.8	Confident	31 Å²	31	61.8 Å²	61.8	19%	0.19	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-74.4	-9.3	-178.8	67	0	0	0	0	113.4	I416 A425 T426	I416-T428 HydrophobicContact CG2-CG2 4.44Å; A425-T428 WeakPolarHBondContact O-CB 3.47Å; A425-T428 PolarHBondContact O-N 2.68Å; A425-T428 PolarHBondContact O-OG1 3.26Å; T426-T428 PolarHBondContact O-N 3.22Å
429	G	82.8	Confident	81.2	Confident	61 Å²	61	57.5 Å²	57.5	63%	0.629	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-79.3	-13.9	176.2	0	0	0	0	0	114.7	T426 C427	T426-G429 PolarHBondContact O-N 3.48Å; T426-G429 VanDerWaalsContact O-N 3.16Å; C427-G429 PolarHBondContact O-N 3.44Å
430	H	87.6	Confident	81.5	Confident	48 Å²	48	58.3 Å²	58.3	22%	0.222	37%	0.365	C	S	.	.			trans	-83.9	133.8	-177.8	-61.4	-65.2	0	0	0	111.9	C427 E435 C436 D439	C427-H430 PolarHBondContact O-N 2.88Å; H430-E435 HydrophobicContact CB-CB 4.18Å; H430-C436 HydrophobicContact CB-CB 4.24Å; H430-D439 IonicContact NE2-OD2 2.67Å
431	S	88.8	Confident	81.9	Confident	73 Å²	73	61.3 Å²	61.3	51%	0.51	38%	0.378	S	S	.	.			trans	-96.6	-20.9	-175.3	-64.6	0	0	0	0	113.3	V413 E435	V413-S431 PolarHBondContact N-O 3.1Å; S431-E435 PolarHBondContact N-OE2 3Å
432	Y	90.4	Very high	82.8	Confident	118 Å²	118	54.9 Å²	54.9	46%	0.463	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-125.2	150.9	-177.9	-68	-88.6	0	0	0	111.6	R412 N434 E435 C436	R412-Y432 HydrophobicContact CB-CE1 4.45Å; Y432-N434 VanDerWaalsContact C-N 3.27Å; Y432-N434 PolarHBondContact O-N 2.9Å; Y432-E435 PolarHBondContact O-N 3.42Å; Y432-C436 PolarHBondContact O-N 3.26Å; Y432-C436 VanDerWaalsContact O-N 3.12Å
433	C	89.7	Confident	83.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55	-44.4	175.1	177.7	0	0	0	0	111.8	P411 E435 C436 I437 F444 C492	P411-C433 HydrophobicContact CG-CB 3.87Å; P411-C433 WeakPolarHBondContact O-CB 3.49Å; P411-C433 PolarHBondContact O-N 3.43Å; C433-E435 VanDerWaalsContact C-N 3.29Å; C433-E435 PolarHBondContact O-N 3.09Å; C433-C436 WeakPolarHBondContact O-CB 3.43Å; C433-C436 PolarHBondContact O-N 3.12Å; C433-C436 VanDerWaalsContact O-N 3.08Å; C433-I437 WeakPolarHBondContact O-CG1 3.11Å; C433-I437 PolarHBondContact O-N 2.8Å; C433-F444 HydrophobicContact CB-CD1 4.15Å; C433-F444 HydrophobicContact CB-CD2 3.72Å; C433-F444 HydrophobicContact CB-CE1 4.03Å; C433-F444 HydrophobicContact CB-CE2 3.59Å; C433-F444 HydrophobicContact CB-CG 3.99Å; C433-F444 HydrophobicContact CB-CZ 3.74Å; C433-F444 WeakPolarHBondContact SG-CD1 3.2Å; C433-F444 WeakPolarHBondContact SG-CG 3.41Å; C433-C492 HydrophobicContact CB-CB 4Å; C433-C492 WeakPolarHBondContact CB-SG 3.36Å; C433-C492 PolarHBondContact O-SG 2.57Å; C433-C492 VanDerWaalsContact SG-CA 3.55Å; C433-C492 WeakPolarHBondContact SG-CB 3.47Å; C433-C492 CovalentContact SG-SG 2.04Å; C433-C492 PolarHBondContact SG-SG 2.87Å
434	N	88.9	Confident	84.8	Confident	23 Å²	23	46.2 Å²	46.2	12%	0.123	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-37.8	-177.7	-176.3	73	0	0	0	112.7	A407 Y432 L438 C492	A407-N434 HydrophobicContact CB-CB 4.5Å; Y432-N434 VanDerWaalsContact C-N 3.27Å; Y432-N434 PolarHBondContact O-N 2.9Å; N434-L438 WeakPolarHBondContact O-CD1 3.45Å; N434-L438 WeakPolarHBondContact O-CG 3.41Å; N434-C492 PolarHBondContact N-SG 3.04Å
435	E	88.1	Confident	85.9	Confident	86 Å²	86	40.4 Å²	40.4	40%	0.402	24%	0.239	S	C	.	.	H	α-helix	trans	-71	-39.3	175.8	-63.5	175.4	168.2	0	0	111.5	H430 S431 Y432 C433 L438	H430-E435 HydrophobicContact CB-CB 4.18Å; S431-E435 PolarHBondContact N-OE2 3Å; Y432-E435 PolarHBondContact O-N 3.42Å; C433-E435 VanDerWaalsContact C-N 3.29Å; C433-E435 PolarHBondContact O-N 3.09Å; E435-L438 PolarHBondContact O-N 3.02Å
436	C	88.8	Confident	86.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-44.6	179.3	-177.9	0	0	0	0	112.6	H430 Y432 C433 L438 D439 C442 G443 C458	H430-C436 HydrophobicContact CB-CB 4.24Å; Y432-C436 PolarHBondContact O-N 3.26Å; Y432-C436 VanDerWaalsContact O-N 3.12Å; C433-C436 WeakPolarHBondContact O-CB 3.43Å; C433-C436 PolarHBondContact O-N 3.12Å; C433-C436 VanDerWaalsContact O-N 3.08Å; C436-L438 VanDerWaalsContact C-N 3.31Å; C436-L438 PolarHBondContact O-N 3.31Å; C436-D439 PolarHBondContact O-N 3.33Å; C436-C442 WeakPolarHBondContact O-CB 3.24Å; C436-G443 VanDerWaalsContact SG-C 3.59Å; C436-G443 PolarHBondContact SG-O 3.01Å; C436-G443 VanDerWaalsContact SG-O 3.34Å; C436-C458 HydrophobicContact CB-CB 3.8Å; C436-C458 WeakPolarHBondContact CB-SG 3.24Å; C436-C458 VanDerWaalsContact SG-CA 3.54Å; C436-C458 WeakPolarHBondContact SG-CB 3.47Å; C436-C458 CovalentContact SG-SG 2.02Å; C436-C458 PolarHBondContact SG-SG 2.81Å
437	I	88.3	Confident	87.2	Confident	10 Å²	10	37.2 Å²	37.2	5%	0.051	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.7	-175.9	66.2	161.8	0	0	0	114	C433 F444 C492 Y563	C433-I437 WeakPolarHBondContact O-CG1 3.11Å; C433-I437 PolarHBondContact O-N 2.8Å; I437-F444 HydrophobicContact CG2-CB 4.1Å; I437-C492 VanDerWaalsContact CD1-SG 3.5Å; I437-Y563 HydrophobicContact CD1-CE2 3.93Å
438	L	86.1	Confident	87.1	Confident	29 Å²	29	39.5 Å²	39.5	15%	0.152	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-23.5	174.1	-74.9	168.9	0	0	0	111.6	N434 E435 C436 T562 Y563	N434-L438 WeakPolarHBondContact O-CD1 3.45Å; N434-L438 WeakPolarHBondContact O-CG 3.41Å; E435-L438 PolarHBondContact O-N 3.02Å; C436-L438 VanDerWaalsContact C-N 3.31Å; C436-L438 PolarHBondContact O-N 3.31Å; L438-T562 HydrophobicContact CD1-CG2 3.8Å; L438-Y563 HydrophobicContact CD2-CE1 4.16Å; L438-Y563 HydrophobicContact CD2-CE2 4.36Å
439	D	85.6	Confident	87.2	Confident	44 Å²	44	42.7 Å²	42.7	24%	0.235	24%	0.235	C	C	.	.	S	Bend	trans	-79.9	118.7	171	-170.9	-34.9	0	0	0	109.1	H430 C436 D441 C442	H430-D439 IonicContact NE2-OD2 2.67Å; C436-D439 PolarHBondContact O-N 3.33Å; D439-D441 PolarHBondContact O-N 3.25Å; D439-D441 VanDerWaalsContact O-N 3.16Å; D439-D441 PolarHBondContact OD1-N 3.22Å; D439-C442 HydrophobicContact CB-CB 4.01Å; D439-C442 VanDerWaalsContact CG-SG 3.56Å; D439-C442 PolarHBondContact O-N 2.58Å; D439-C442 VanDerWaalsContact O-N 3.09Å
440	P	81.2	Confident	86.9	Confident	60 Å²	60	45.3 Å²	45.3	39%	0.39	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.8	-175.1	27.2	-36.3	0	0	0	114	Y489	P440-Y489 WeakPolarHBondContact O-CE2 3.45Å; P440-Y489 PolarHBondContact O-OH 3.48Å
441	D	85.7	Confident	86.3	Confident	118 Å²	118	48.2 Å²	48.2	63%	0.631	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-5	179.1	-71	-35.3	0	0	0	112.8	D439 P460 V461	D439-D441 PolarHBondContact O-N 3.25Å; D439-D441 VanDerWaalsContact O-N 3.16Å; D439-D441 PolarHBondContact OD1-N 3.22Å; D441-P460 WeakPolarHBondContact O-CA 3.49Å; D441-V461 PolarHBondContact O-N 2.83Å
442	C	88.3	Confident	85.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	156.4	-174.5	-56.9	0	0	0	0	112.8	C427 C436 D439 V461	C427-C442 WeakPolarHBondContact CA-SG 3.42Å; C427-C442 HydrophobicContact CB-CB 3.78Å; C427-C442 WeakPolarHBondContact CB-SG 3.33Å; C427-C442 WeakPolarHBondContact SG-CA 3.48Å; C427-C442 WeakPolarHBondContact SG-CB 3.29Å; C427-C442 CovalentContact SG-SG 2.03Å; C427-C442 PolarHBondContact SG-SG 3.32Å; C436-C442 WeakPolarHBondContact O-CB 3.24Å; D439-C442 HydrophobicContact CB-CB 4.01Å; D439-C442 VanDerWaalsContact CG-SG 3.56Å; D439-C442 PolarHBondContact O-N 2.58Å; D439-C442 VanDerWaalsContact O-N 3.09Å; C442-V461 WeakPolarHBondContact O-CG2 3.36Å
443	G	88.2	Confident	85.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	157.7	179.7	0	0	0	0	0	111.9	C436 V459	C436-G443 VanDerWaalsContact SG-C 3.59Å; C436-G443 PolarHBondContact SG-O 3.01Å; C436-G443 VanDerWaalsContact SG-O 3.34Å; G443-V459 PolarHBondContact N-O 2.89Å; G443-V459 PolarHBondContact O-N 3.01Å
444	F	90.1	Very high	85.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.7	-172.6	-169.5	-105.7	0	0	0	110.9	P411 V413 C433 I437 Y446 A488	P411-F444 HydrophobicContact CB-CZ 4.22Å; P411-F444 HydrophobicContact CG-CE1 3.81Å; P411-F444 HydrophobicContact CG-CZ 3.7Å; V413-F444 HydrophobicContact CG2-CE2 4.05Å; C433-F444 HydrophobicContact CB-CD1 4.15Å; C433-F444 HydrophobicContact CB-CD2 3.72Å; C433-F444 HydrophobicContact CB-CE1 4.03Å; C433-F444 HydrophobicContact CB-CE2 3.59Å; C433-F444 HydrophobicContact CB-CG 3.99Å; C433-F444 HydrophobicContact CB-CZ 3.74Å; C433-F444 WeakPolarHBondContact SG-CD1 3.2Å; C433-F444 WeakPolarHBondContact SG-CG 3.41Å; I437-F444 HydrophobicContact CG2-CB 4.1Å; F444-Y446 AromaticContact CD1-CD1 3.5Å; F444-Y446 HydrophobicContact CD1-CD1 3.5Å; F444-Y446 HydrophobicContact CD1-CE1 4.25Å; F444-Y446 HydrophobicContact CD1-CG 4.1Å; F444-Y446 AromaticContact CE1-CD1 3.7Å; F444-Y446 HydrophobicContact CE1-CD1 3.7Å; F444-Y446 AromaticContact CE1-CG 3.82Å; F444-Y446 HydrophobicContact CE1-CG 3.82Å; F444-A488 PolarHBondContact N-O 3.02Å; F444-A488 PolarHBondContact O-N 3.4Å
445	C	89.7	Confident	85.1	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.8	177.9	-180	0	0	0	0	109	S456 S457 V459 C474 W487	C445-S456 CarbonylContact O-C 3.59Å; C445-S456 VanDerWaalsContact O-CA 3.26Å; C445-S456 WeakPolarHBondContact O-CA 3.37Å; C445-S457 PolarHBondContact N-O 3.42Å; C445-S457 PolarHBondContact O-N 3.33Å; C445-V459 HydrophobicContact CB-CG2 4.33Å; C445-C474 VanDerWaalsContact CA-SG 3.56Å; C445-C474 HydrophobicContact CB-CB 3.75Å; C445-C474 WeakPolarHBondContact CB-SG 3.27Å; C445-C474 WeakPolarHBondContact SG-CB 3.35Å; C445-C474 CovalentContact SG-SG 2.02Å; C445-C474 PolarHBondContact SG-SG 2.99Å; C445-W487 HydrophobicContact CB-CE3 4.02Å; C445-W487 HydrophobicContact CB-CZ3 4.11Å
446	Y	89.4	Confident	85.2	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.008	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.8	-175.9	68.4	-80.6	0	0	0	114.7	E349 F444 M448 V453 D455 H486 A488 P493	E349-Y446 PolarHBondContact OE1-OH 3.41Å; F444-Y446 AromaticContact CD1-CD1 3.5Å; F444-Y446 HydrophobicContact CD1-CD1 3.5Å; F444-Y446 HydrophobicContact CD1-CE1 4.25Å; F444-Y446 HydrophobicContact CD1-CG 4.1Å; F444-Y446 AromaticContact CE1-CD1 3.7Å; F444-Y446 HydrophobicContact CE1-CD1 3.7Å; F444-Y446 AromaticContact CE1-CG 3.82Å; F444-Y446 HydrophobicContact CE1-CG 3.82Å; Y446-M448 HydrophobicContact CD2-CG 3.93Å; Y446-M448 HydrophobicContact CE2-CE 3.95Å; Y446-M448 HydrophobicContact CE2-CG 3.74Å; Y446-M448 HydrophobicContact CE2-SD 3.83Å; Y446-V453 HydrophobicContact CD2-CG1 4.36Å; Y446-V453 HydrophobicContact CD2-CG2 3.83Å; Y446-V453 HydrophobicContact CE2-CG2 4.36Å; Y446-V453 HydrophobicContact CG-CG1 4.46Å; Y446-V453 HydrophobicContact CG-CG2 4.47Å; Y446-D455 CarbonylContact C-O 3.47Å; Y446-D455 WeakPolarHBondContact CA-O 3.46Å; Y446-H486 HydrophobicContact CD1-CB 4.16Å; Y446-H486 HydrophobicContact CD2-CB 4.28Å; Y446-H486 HydrophobicContact CE1-CB 3.72Å; Y446-H486 HydrophobicContact CE2-CB 3.85Å; Y446-H486 HydrophobicContact CG-CB 4.43Å; Y446-H486 PolarHBondContact N-O 3.33Å; Y446-H486 PolarHBondContact O-N 2.88Å; Y446-A488 HydrophobicContact CE1-CB 3.98Å; Y446-P493 HydrophobicContact CD2-CG 4.37Å; Y446-P493 HydrophobicContact CE1-CG 4.31Å; Y446-P493 HydrophobicContact CE2-CB 4.29Å; Y446-P493 HydrophobicContact CE2-CG 3.94Å
447	K	87.8	Confident	85.3	Confident	72 Å²	72	46 Å²	46	31%	0.313	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.1	172.1	-175.4	162.6	-176.5	150	0	109.9	I454 D455 E483 L485	K447-I454 PolarHBondContact O-N 3.06Å; K447-D455 HydrophobicContact CB-CB 4.31Å; K447-D455 PolarHBondContact N-O 2.76Å; K447-E483 WeakPolarHBondContact CE-O 3.15Å; K447-E483 PolarHBondContact NZ-O 2.98Å; K447-L485 HydrophobicContact CB-CD2 4.17Å
448	M	82.9	Confident	85.4	Confident	50 Å²	50	45.6 Å²	45.6	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.3	177.1	-92.4	-177.7	164.7	0	0	111.8	Y446 A452 V453 P493	Y446-M448 HydrophobicContact CD2-CG 3.93Å; Y446-M448 HydrophobicContact CE2-CE 3.95Å; Y446-M448 HydrophobicContact CE2-CG 3.74Å; Y446-M448 HydrophobicContact CE2-SD 3.83Å; M448-A452 WeakPolarHBondContact CA-O 3.37Å; M448-V453 HydrophobicContact CE-CG2 4.16Å; M448-V453 HydrophobicContact CG-CG2 4.22Å; M448-P493 HydrophobicContact CE-CB 3.45Å; M448-P493 VanDerWaalsContact CE-CB 3.45Å; M448-P493 HydrophobicContact CE-CG 4.16Å
449	N	82.8	Confident	85.5	Confident	98 Å²	98	44.4 Å²	44.4	52%	0.524	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	112.4	158.9	179	3.7	0	0	0	108.6	S451 A452 I454	N449-S451 VanDerWaalsContact C-N 3.26Å; N449-S451 PolarHBondContact O-N 3.22Å; N449-A452 PolarHBondContact N-O 3.44Å; N449-A452 PolarHBondContact O-N 3.4Å; N449-I454 HydrophobicContact CB-CD1 3.22Å; N449-I454 HydrophobicContact CB-CG1 3.89Å
450	S	76.5	Confident	85.6	Confident	115 Å²	115	43.2 Å²	43.2	80%	0.804	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	-79.5	-173	-51.9	0	0	0	0	112.5
451	S	75.2	Confident	85.9	Confident	110 Å²	110	41.1 Å²	41.1	77%	0.769	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139.8	2.7	-176.1	39.4	0	0	0	0	114.4	N449	N449-S451 VanDerWaalsContact C-N 3.26Å; N449-S451 PolarHBondContact O-N 3.22Å
452	A	79.4	Confident	85.7	Confident	58 Å²	58	37.4 Å²	37.4	48%	0.479	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.8	176.5	0	0	0	0	0	111.3	M448 N449 I454	M448-A452 WeakPolarHBondContact CA-O 3.37Å; N449-A452 PolarHBondContact N-O 3.44Å; N449-A452 PolarHBondContact O-N 3.4Å; A452-I454 PolarHBondContact O-N 2.92Å
453	V	82.9	Confident	85.1	Confident	36 Å²	36	46.8 Å²	46.8	22%	0.218	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118	172.5	178.1	0	0	0	0	108.8	P411 Y446 M448 P493	P411-V453 HydrophobicContact CB-CB 4.05Å; P411-V453 HydrophobicContact CB-CG1 4.3Å; P411-V453 HydrophobicContact CB-CG2 4.08Å; P411-V453 HydrophobicContact CG-CG2 4.17Å; Y446-V453 HydrophobicContact CD2-CG1 4.36Å; Y446-V453 HydrophobicContact CD2-CG2 3.83Å; Y446-V453 HydrophobicContact CE2-CG2 4.36Å; Y446-V453 HydrophobicContact CG-CG1 4.46Å; Y446-V453 HydrophobicContact CG-CG2 4.47Å; M448-V453 HydrophobicContact CE-CG2 4.16Å; M448-V453 HydrophobicContact CG-CG2 4.22Å; V453-P493 HydrophobicContact CG2-CG 3.78Å
454	I	84.9	Confident	84.3	Confident	88 Å²	88	52.9 Å²	52.9	45%	0.451	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-52.6	178.6	-61.8	-179.4	0	0	0	110.1	K447 N449 A452	K447-I454 PolarHBondContact O-N 3.06Å; N449-I454 HydrophobicContact CB-CD1 3.22Å; N449-I454 HydrophobicContact CB-CG1 3.89Å; A452-I454 PolarHBondContact O-N 2.92Å
455	D	86.2	Confident	83.4	Confident	67 Å²	67	54 Å²	54	36%	0.358	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.3	-177.2	-80.4	-31.5	0	0	0	110.2	T414 Y446 K447	T414-D455 WeakPolarHBondContact OG1-CA 3.48Å; Y446-D455 CarbonylContact C-O 3.47Å; Y446-D455 WeakPolarHBondContact CA-O 3.46Å; K447-D455 HydrophobicContact CB-CB 4.31Å; K447-D455 PolarHBondContact N-O 2.76Å
456	S	89.7	Confident	82.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.7	-178.8	58.3	0	0	0	0	112.2	R412 V413 T414 F415 C445	R412-S456 PolarHBondContact O-OG 3.38Å; V413-S456 WeakPolarHBondContact CA-OG 3.42Å; T414-S456 PolarHBondContact N-O 3.47Å; T414-S456 PolarHBondContact N-OG 3.38Å; T414-S456 PolarHBondContact OG1-N 3.4Å; T414-S456 PolarHBondContact OG1-O 3.28Å; F415-S456 PolarHBondContact N-O 3.02Å; C445-S456 CarbonylContact O-C 3.59Å; C445-S456 VanDerWaalsContact O-CA 3.26Å; C445-S456 WeakPolarHBondContact O-CA 3.37Å
457	S	89.8	Confident	82.1	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	134.8	178.9	-63.3	0	0	0	0	110.1	F415 C445 R473	F415-S457 WeakPolarHBondContact CD1-OG 3.28Å; F415-S457 WeakPolarHBondContact O-CA 3.42Å; F415-S457 WeakPolarHBondContact O-CB 3.4Å; F415-S457 PolarHBondContact O-OG 3.35Å; C445-S457 PolarHBondContact N-O 3.42Å; C445-S457 PolarHBondContact O-N 3.33Å; S457-R473 PolarHBondContact OG-NH2 3.19Å
458	C	90.2	Very high	81.8	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.8	166.7	-173.8	0	0	0	0	108.8	V413 C427 C436	V413-C458 HydrophobicContact CG2-CB 4.1Å; C427-C458 WeakPolarHBondContact O-CB 3.46Å; C427-C458 PolarHBondContact O-SG 3.29Å; C436-C458 HydrophobicContact CB-CB 3.8Å; C436-C458 WeakPolarHBondContact CB-SG 3.24Å; C436-C458 VanDerWaalsContact SG-CA 3.54Å; C436-C458 WeakPolarHBondContact SG-CB 3.47Å; C436-C458 CovalentContact SG-SG 2.02Å; C436-C458 PolarHBondContact SG-SG 2.81Å
459	V	89.7	Confident	81.9	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	154.3	-176.1	-69.7	0	0	0	0	111.3	P417 G443 C445 A469 W487	P417-V459 HydrophobicContact CG-CG1 3.5Å; P417-V459 VanDerWaalsContact CG-CG1 3.5Å; G443-V459 PolarHBondContact N-O 2.89Å; G443-V459 PolarHBondContact O-N 3.01Å; C445-V459 HydrophobicContact CB-CG2 4.33Å; V459-A469 HydrophobicContact CB-CB 4.49Å; V459-A469 HydrophobicContact CG2-CB 3.53Å; V459-W487 HydrophobicContact CG2-CH2 3.98Å; V459-W487 HydrophobicContact CG2-CZ3 3.57Å
460	P	88.3	Confident	81.9	Confident	20 Å²	20	50.4 Å²	50.4	13%	0.13	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	144.4	175.8	-22.1	34	0	0	0	112.1	C427 D441 A469 A470 W471	C427-P460 HydrophobicContact CB-CG 4.25Å; D441-P460 WeakPolarHBondContact O-CA 3.49Å; P460-A469 WeakPolarHBondContact O-CA 3.13Å; P460-A470 HydrophobicContact CB-CB 4.25Å; P460-A470 PolarHBondContact O-N 3.36Å; P460-W471 HydrophobicContact CG-CZ2 4.08Å
461	V	86.3	Confident	82.2	Confident	16 Å²	16	45.7 Å²	45.7	10%	0.097	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	143.9	179.3	178.9	0	0	0	0	109.4	D441 C442 K463 T466 W487 Y489	D441-V461 PolarHBondContact O-N 2.83Å; C442-V461 WeakPolarHBondContact O-CG2 3.36Å; V461-K463 PolarHBondContact O-N 2.75Å; V461-T466 HydrophobicContact CG1-CG2 4.26Å; V461-W487 HydrophobicContact CB-CZ2 4.31Å; V461-W487 HydrophobicContact CG1-CZ2 4.3Å; V461-W487 HydrophobicContact CG2-CH2 4.15Å; V461-W487 HydrophobicContact CG2-CZ2 3.77Å; V461-Y489 HydrophobicContact CB-CD2 4.44Å; V461-Y489 HydrophobicContact CB-CE2 4.27Å; V461-Y489 HydrophobicContact CG1-CD2 4.04Å; V461-Y489 HydrophobicContact CG1-CE2 3.98Å; V461-Y489 HydrophobicContact CG2-CD2 3.57Å; V461-Y489 HydrophobicContact CG2-CE2 3.62Å
462	N	81.9	Confident	82.4	Confident	40 Å²	40	41.8 Å²	41.8	21%	0.214	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127	175.9	-172.9	-5.8	0	0	0	109.9	E464 S465 E468	N462-E464 PolarHBondContact O-N 3.35Å; N462-E464 VanDerWaalsContact O-N 3.11Å; N462-E464 PolarHBondContact OD1-N 2.88Å; N462-S465 WeakPolarHBondContact CB-O 3.23Å; N462-S465 CarbonylContact O-C 3.57Å; N462-S465 PolarHBondContact O-N 3.14Å; N462-E468 HydrophobicContact CB-CG 3.69Å; N462-E468 PolarHBondContact N-O 2.94Å; N462-E468 PolarHBondContact ND2-OE1 3.02Å
463	K	76.5	Confident	82.2	Confident	198 Å²	198	42.5 Å²	42.5	86%	0.861	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.5	175.1	-65.8	-174.3	178.7	-178.3	0	112.3	V461	V461-K463 PolarHBondContact O-N 2.75Å
464	E	70.6	Confident	82.2	Confident	127 Å²	127	40.8 Å²	40.8	59%	0.593	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-14.8	176.8	-66.9	-166.5	-172.1	0	0	114.5	R104 N462	R104-E464 VanDerWaalsContact CZ-CA 3.4Å; R104-E464 PolarHBondContact NE-O 3.46Å; R104-E464 PolarHBondContact NH2-O 3.01Å; N462-E464 PolarHBondContact O-N 3.35Å; N462-E464 VanDerWaalsContact O-N 3.11Å; N462-E464 PolarHBondContact OD1-N 2.88Å
465	S	71.7	Confident	82	Confident	25 Å²	25	41 Å²	41	18%	0.175	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	124.9	179.8	179.3	0	0	0	0	110.4	N462 N467 E468	N462-S465 WeakPolarHBondContact CB-O 3.23Å; N462-S465 CarbonylContact O-C 3.57Å; N462-S465 PolarHBondContact O-N 3.14Å; S465-N467 PolarHBondContact O-N 3.02Å; S465-N467 PolarHBondContact OG-N 3.44Å; S465-E468 WeakPolarHBondContact CB-OE1 3.05Å
466	T	73.8	Confident	81.5	Confident	21 Å²	21	41.7 Å²	41.7	13%	0.129	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-2.1	174.7	49.9	0	0	0	0	113	V461 W487 Y489	V461-T466 HydrophobicContact CG1-CG2 4.26Å; T466-W487 PolarHBondContact O-NE1 2.83Å; T466-Y489 HydrophobicContact CG2-CE1 4.46Å; T466-Y489 HydrophobicContact CG2-CE2 4.33Å
467	N	76.7	Confident	80.2	Confident	52 Å²	52	47.6 Å²	47.6	28%	0.278	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-1.9	-179.6	-60.3	-29.8	0	0	0	113.4	R101 S465 W487	R101-N467 WeakPolarHBondContact CD-OD1 3.13Å; R101-N467 WeakPolarHBondContact CG-OD1 3.16Å; R101-N467 PolarHBondContact NE-OD1 3.47Å; S465-N467 PolarHBondContact O-N 3.02Å; S465-N467 PolarHBondContact OG-N 3.44Å; N467-W487 VanDerWaalsContact C-NE1 3.35Å
468	E	82.7	Confident	78.7	Confident	41 Å²	41	52.2 Å²	52.2	19%	0.192	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	158.8	-179.3	68.9	-162.2	173.6	0	0	111.3	N462 S465 W487	N462-E468 HydrophobicContact CB-CG 3.69Å; N462-E468 PolarHBondContact N-O 2.94Å; N462-E468 PolarHBondContact ND2-OE1 3.02Å; S465-E468 WeakPolarHBondContact CB-OE1 3.05Å; E468-W487 WeakPolarHBondContact O-CZ2 3.28Å
469	A	84.3	Confident	77.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	148.4	172	0	0	0	0	0	110.3	V459 P460 W471 C474 E475 W487	V459-A469 HydrophobicContact CB-CB 4.49Å; V459-A469 HydrophobicContact CG2-CB 3.53Å; P460-A469 WeakPolarHBondContact O-CA 3.13Å; A469-W471 PolarHBondContact O-N 3.29Å; A469-C474 HydrophobicContact CB-CB 4Å; A469-C474 WeakPolarHBondContact CB-O 3.36Å; A469-C474 PolarHBondContact N-O 3.42Å; A469-E475 WeakPolarHBondContact O-CA 3.5Å; A469-W487 HydrophobicContact CB-CE3 4.35Å; A469-W487 HydrophobicContact CB-CH2 3.76Å; A469-W487 HydrophobicContact CB-CZ3 3.67Å
470	A	83.8	Confident	75.8	Confident	35 Å²	35	57.8 Å²	57.8	29%	0.289	29%	0.294	S	S	.	.	S	Bend	trans	-62.9	-28.7	173.5	0	0	0	0	0	112.6	P460	P460-A470 HydrophobicContact CB-CB 4.25Å; P460-A470 PolarHBondContact O-N 3.36Å
471	W	82.2	Confident	74.4	Confident	17 Å²	17	63.8 Å²	63.8	6%	0.064	33%	0.325	C	S	.	.	S	Bend	trans	-163.2	157.6	178.2	53.2	-87.5	0	0	0	109.8	P417 P419 P420 P460 A469	P417-W471 HydrophobicContact CB-CH2 4.28Å; P417-W471 HydrophobicContact CB-CZ3 3.85Å; P417-W471 HydrophobicContact CG-CH2 4.06Å; P417-W471 HydrophobicContact CG-CZ3 4.03Å; P419-W471 HydrophobicContact CB-CH2 3.97Å; P419-W471 HydrophobicContact CB-CZ2 4.03Å; P420-W471 HydrophobicContact CG-CD2 4.07Å; P420-W471 HydrophobicContact CG-CE3 4.15Å; P420-W471 HydrophobicContact CG-CG 4.23Å; P460-W471 HydrophobicContact CG-CZ2 4.08Å; A469-W471 PolarHBondContact O-N 3.29Å
472	G	78.5	Confident	73.2	Confident	27 Å²	27	68.1 Å²	68.1	28%	0.278	35%	0.351	S	S	.	.	S	Bend	trans	105.5	-146.9	173	0	0	0	0	0	113.8	C474 E475	G472-C474 PolarHBondContact O-N 3.32Å; G472-E475 PolarHBondContact N-OE2 3.03Å; G472-E475 WeakPolarHBondContact O-CB 3.24Å
473	R	76.4	Confident	72.4	Confident	73 Å²	73	70.5 Å²	70.5	28%	0.275	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-31.4	-170.6	-73.7	-168.8	-86.8	-169.1	3	113.6	S457 L485	S457-R473 PolarHBondContact OG-NH2 3.19Å; R473-L485 HydrophobicContact CB-CD1 4.06Å; R473-L485 WeakPolarHBondContact O-CD1 3.09Å
474	C	82.5	Confident	72.5	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	30.1	-179.7	-70.6	0	0	0	0	113.2	C445 A469 G472 F480 W487	C445-C474 VanDerWaalsContact CA-SG 3.56Å; C445-C474 HydrophobicContact CB-CB 3.75Å; C445-C474 WeakPolarHBondContact CB-SG 3.27Å; C445-C474 WeakPolarHBondContact SG-CB 3.35Å; C445-C474 CovalentContact SG-SG 2.02Å; C445-C474 PolarHBondContact SG-SG 2.99Å; A469-C474 HydrophobicContact CB-CB 4Å; A469-C474 WeakPolarHBondContact CB-O 3.36Å; A469-C474 PolarHBondContact N-O 3.42Å; G472-C474 PolarHBondContact O-N 3.32Å; C474-F480 HydrophobicContact CB-CE1 3.65Å; C474-F480 HydrophobicContact CB-CZ 3.94Å; C474-F480 VanDerWaalsContact SG-CE1 3.59Å; C474-W487 HydrophobicContact CB-CD2 4.36Å; C474-W487 HydrophobicContact CB-CE3 3.58Å; C474-W487 HydrophobicContact CB-CZ3 4.13Å
475	E	80.3	Confident	73.1	Confident	94 Å²	94	60.9 Å²	60.9	44%	0.439	32%	0.323	S	S	.	.	S	Bend	trans	-79.4	-27.1	-174.5	-176.6	-178.1	170	0	0	114.6	A469 G472	A469-E475 WeakPolarHBondContact O-CA 3.5Å; G472-E475 PolarHBondContact N-OE2 3.03Å; G472-E475 WeakPolarHBondContact O-CB 3.24Å
476	N	76.6	Confident	73.7	Confident	81 Å²	81	63.4 Å²	63.4	43%	0.433	33%	0.332	S	S	.	.			trans	-140.2	134.7	-174.1	-172	-15.9	0	0	0	111.3	T478 K479 F480	N476-T478 PolarHBondContact ND2-OG1 2.67Å; N476-T478 PolarHBondContact O-N 3.06Å; N476-T478 PolarHBondContact OD1-N 3.08Å; N476-T478 PolarHBondContact OD1-OG1 2.96Å; N476-K479 WeakPolarHBondContact O-CB 3.37Å; N476-K479 PolarHBondContact O-N 2.9Å; N476-F480 PolarHBondContact O-N 3.45Å
477	E	62.4	Low	74.3	Confident	125 Å²	125	64 Å²	64	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-56.6	-34.5	179.9	-75.2	-169.4	166.4	0	0	114	K479 F480	E477-K479 PolarHBondContact O-N 3.44Å; E477-F480 HydrophobicContact CB-CD2 4.06Å; E477-F480 HydrophobicContact CG-CD2 3.88Å; E477-F480 HydrophobicContact CG-CE2 3.96Å; E477-F480 WeakPolarHBondContact O-CB 3.22Å; E477-F480 PolarHBondContact O-N 3.08Å
478	T	57.5	Low	74.6	Confident	99 Å²	99	61.5 Å²	61.5	61%	0.607	32%	0.319	S	S	*	.	H	α-helix	trans	-69.3	-18	178	56	0	0	0	0	113.5	N476 T482	N476-T478 PolarHBondContact ND2-OG1 2.67Å; N476-T478 PolarHBondContact O-N 3.06Å; N476-T478 PolarHBondContact OD1-N 3.08Å; N476-T478 PolarHBondContact OD1-OG1 2.96Å; T478-T482 PolarHBondContact O-OG1 3.03Å
479	K	57.7	Low	74.6	Confident	94 Å²	94	61.5 Å²	61.5	41%	0.409	32%	0.317	S	S	.	.	H	α-helix	trans	-83.2	-25.6	170.6	-84.4	-176.2	175.1	177.2	0	112.4	N476 E477 T482 E483	N476-K479 WeakPolarHBondContact O-CB 3.37Å; N476-K479 PolarHBondContact O-N 2.9Å; E477-K479 PolarHBondContact O-N 3.44Å; K479-T482 WeakPolarHBondContact CA-OG1 3.48Å; K479-T482 PolarHBondContact O-N 3.43Å; K479-T482 PolarHBondContact O-OG1 2.98Å; K479-E483 PolarHBondContact O-N 3.15Å
480	F	60.3	Low	74.3	Confident	29 Å²	29	61.9 Å²	61.9	13%	0.127	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-51.1	178.3	-75.2	-54.2	0	0	0	111.4	C474 N476 E477 T482 D484 L485 W487	C474-F480 HydrophobicContact CB-CE1 3.65Å; C474-F480 HydrophobicContact CB-CZ 3.94Å; C474-F480 VanDerWaalsContact SG-CE1 3.59Å; N476-F480 PolarHBondContact O-N 3.45Å; E477-F480 HydrophobicContact CB-CD2 4.06Å; E477-F480 HydrophobicContact CG-CD2 3.88Å; E477-F480 HydrophobicContact CG-CE2 3.96Å; E477-F480 WeakPolarHBondContact O-CB 3.22Å; E477-F480 PolarHBondContact O-N 3.08Å; F480-T482 VanDerWaalsContact C-N 3.34Å; F480-T482 PolarHBondContact O-N 3.16Å; F480-D484 PolarHBondContact O-N 2.93Å; F480-D484 VanDerWaalsContact O-N 3.17Å; F480-L485 HydrophobicContact CD1-CB 3.98Å; F480-L485 VanDerWaalsContact CD1-O 3.27Å; F480-L485 WeakPolarHBondContact CD1-O 3.5Å; F480-L485 PolarHBondContact O-N 3.15Å; F480-W487 HydrophobicContact CE1-CB 3.7Å; F480-W487 HydrophobicContact CZ-CB 3.64Å; F480-W487 HydrophobicContact CZ-CG 4.37Å
481	D	59.2	Low	74.4	Confident	145 Å²	145	60.8 Å²	60.8	78%	0.775	31%	0.309	S	S	*	.	H	α-helix	trans	-73.2	-26.1	-174.5	-74.1	-19.5	0	0	0	112.9
482	T	61.2	Low	74.6	Confident	107 Å²	107	60.2 Å²	60.2	66%	0.656	31%	0.307	S	S	*	.	H	α-helix	trans	-84.1	-25.7	-179	51	0	0	0	0	113.8	T478 K479 F480	T478-T482 PolarHBondContact O-OG1 3.03Å; K479-T482 WeakPolarHBondContact CA-OG1 3.48Å; K479-T482 PolarHBondContact O-N 3.43Å; K479-T482 PolarHBondContact O-OG1 2.98Å; F480-T482 VanDerWaalsContact C-N 3.34Å; F480-T482 PolarHBondContact O-N 3.16Å
483	E	66.6	Low	74.9	Confident	90 Å²	90	59.5 Å²	59.5	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-114.6	4.1	-175.2	-67.4	-170.3	-174.1	0	0	114.2	K447 K479 L485	K447-E483 WeakPolarHBondContact CE-O 3.15Å; K447-E483 PolarHBondContact NZ-O 2.98Å; K479-E483 PolarHBondContact O-N 3.15Å; E483-L485 HydrophobicContact CB-CD1 3.8Å; E483-L485 HydrophobicContact CB-CG 3.93Å
484	D	77.4	Confident	75.5	Confident	108 Å²	108	56.8 Å²	56.8	58%	0.578	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	49.1	-173.9	-60.8	-47.7	0	0	0	112.2	F480	F480-D484 PolarHBondContact O-N 2.93Å; F480-D484 VanDerWaalsContact O-N 3.17Å
485	L	83.3	Confident	75.5	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	142.1	-180	-69.9	167.2	0	0	0	110.9	K447 R473 F480 E483	K447-L485 HydrophobicContact CB-CD2 4.17Å; R473-L485 HydrophobicContact CB-CD1 4.06Å; R473-L485 WeakPolarHBondContact O-CD1 3.09Å; F480-L485 HydrophobicContact CD1-CB 3.98Å; F480-L485 VanDerWaalsContact CD1-O 3.27Å; F480-L485 WeakPolarHBondContact CD1-O 3.5Å; F480-L485 PolarHBondContact O-N 3.15Å; E483-L485 HydrophobicContact CB-CD1 3.8Å; E483-L485 HydrophobicContact CB-CG 3.93Å
486	H	84.9	Confident	75.8	Confident	78 Å²	78	60.5 Å²	60.5	36%	0.361	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.3	177.6	-63	-86.4	0	0	0	110.6	Y446	Y446-H486 HydrophobicContact CD1-CB 4.16Å; Y446-H486 HydrophobicContact CD2-CB 4.28Å; Y446-H486 HydrophobicContact CE1-CB 3.72Å; Y446-H486 HydrophobicContact CE2-CB 3.85Å; Y446-H486 HydrophobicContact CG-CB 4.43Å; Y446-H486 PolarHBondContact N-O 3.33Å; Y446-H486 PolarHBondContact O-N 2.88Å
487	W	86.1	Confident	76.3	Confident	33 Å²	33	60.2 Å²	60.2	13%	0.125	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.1	176.7	177.2	-108.3	0	0	0	111	C445 V459 V461 T466 N467 E468 A469 C474 F480	C445-W487 HydrophobicContact CB-CE3 4.02Å; C445-W487 HydrophobicContact CB-CZ3 4.11Å; V459-W487 HydrophobicContact CG2-CH2 3.98Å; V459-W487 HydrophobicContact CG2-CZ3 3.57Å; V461-W487 HydrophobicContact CB-CZ2 4.31Å; V461-W487 HydrophobicContact CG1-CZ2 4.3Å; V461-W487 HydrophobicContact CG2-CH2 4.15Å; V461-W487 HydrophobicContact CG2-CZ2 3.77Å; T466-W487 PolarHBondContact O-NE1 2.83Å; N467-W487 VanDerWaalsContact C-NE1 3.35Å; E468-W487 WeakPolarHBondContact O-CZ2 3.28Å; A469-W487 HydrophobicContact CB-CE3 4.35Å; A469-W487 HydrophobicContact CB-CH2 3.76Å; A469-W487 HydrophobicContact CB-CZ3 3.67Å; C474-W487 HydrophobicContact CB-CD2 4.36Å; C474-W487 HydrophobicContact CB-CE3 3.58Å; C474-W487 HydrophobicContact CB-CZ3 4.13Å; F480-W487 HydrophobicContact CE1-CB 3.7Å; F480-W487 HydrophobicContact CZ-CB 3.64Å; F480-W487 HydrophobicContact CZ-CG 4.37Å
488	A	83.8	Confident	77.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116	176.2	0	0	0	0	0	110.8	F444 Y446 F491	F444-A488 PolarHBondContact N-O 3.02Å; F444-A488 PolarHBondContact O-N 3.4Å; Y446-A488 HydrophobicContact CE1-CB 3.98Å; A488-F491 HydrophobicContact CB-CD1 4.09Å; A488-F491 HydrophobicContact CB-CD2 3.92Å; A488-F491 HydrophobicContact CB-CE1 3.81Å; A488-F491 HydrophobicContact CB-CE2 3.6Å; A488-F491 HydrophobicContact CB-CG 4.13Å; A488-F491 HydrophobicContact CB-CZ 3.55Å; A488-F491 VanDerWaalsContact CB-O 3.25Å; A488-F491 WeakPolarHBondContact CB-O 3.35Å
489	Y	81.4	Confident	79.1	Confident	42 Å²	42	56.9 Å²	56.9	17%	0.165	28%	0.279	C	S	.	.	S	Bend	trans	-91.1	-40.1	177.8	177.8	-103.6	0	0	0	112.5	R100 P440 V461 T466	R100-Y489 VanDerWaalsContact NH2-CD1 3.31Å; P440-Y489 WeakPolarHBondContact O-CE2 3.45Å; P440-Y489 PolarHBondContact O-OH 3.48Å; V461-Y489 HydrophobicContact CB-CD2 4.44Å; V461-Y489 HydrophobicContact CB-CE2 4.27Å; V461-Y489 HydrophobicContact CG1-CD2 4.04Å; V461-Y489 HydrophobicContact CG1-CE2 3.98Å; V461-Y489 HydrophobicContact CG2-CD2 3.57Å; V461-Y489 HydrophobicContact CG2-CE2 3.62Å; T466-Y489 HydrophobicContact CG2-CE1 4.46Å; T466-Y489 HydrophobicContact CG2-CE2 4.33Å
490	S	77.6	Confident	80.6	Confident	7 Å²	7	52.5 Å²	52.5	5%	0.049	26%	0.261	C	S	.	.	S	Bend	trans	-133.7	19.5	-170.2	51.6	0	0	0	0	113.6	R100 Q344 M345	R100-S490 PolarHBondContact NH1-OG 3.42Å; R100-S490 PolarHBondContact NH2-OG 3.16Å; Q344-S490 PolarHBondContact OE1-OG 3.34Å; M345-S490 WeakPolarHBondContact CA-O 3.23Å
491	F	85.9	Confident	82.1	Confident	13 Å²	13	52.6 Å²	52.6	6%	0.057	26%	0.262	C	S	.	.			trans	-145.4	157.5	176.4	70.6	-94.5	0	0	0	109.9	Q344 E349 A488	Q344-F491 HydrophobicContact CG-CB 4.49Å; Q344-F491 HydrophobicContact CG-CD1 4.23Å; Q344-F491 WeakPolarHBondContact O-CB 3.4Å; E349-F491 HydrophobicContact CB-CE2 3.82Å; E349-F491 HydrophobicContact CB-CZ 3.87Å; E349-F491 HydrophobicContact CG-CD2 4.18Å; E349-F491 HydrophobicContact CG-CE2 3.56Å; E349-F491 HydrophobicContact CG-CZ 4.14Å; A488-F491 HydrophobicContact CB-CD1 4.09Å; A488-F491 HydrophobicContact CB-CD2 3.92Å; A488-F491 HydrophobicContact CB-CE1 3.81Å; A488-F491 HydrophobicContact CB-CE2 3.6Å; A488-F491 HydrophobicContact CB-CG 4.13Å; A488-F491 HydrophobicContact CB-CZ 3.55Å; A488-F491 VanDerWaalsContact CB-O 3.25Å; A488-F491 WeakPolarHBondContact CB-O 3.35Å
492	C	87.2	Confident	83.8	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.034	24%	0.244	C	C	.	.			trans	-121.7	138.6	169.3	-71.9	0	0	0	0	108.6	G347 C433 N434 I437 T494	G347-C492 WeakPolarHBondContact CA-O 3.15Å; C433-C492 HydrophobicContact CB-CB 4Å; C433-C492 WeakPolarHBondContact CB-SG 3.36Å; C433-C492 PolarHBondContact O-SG 2.57Å; C433-C492 VanDerWaalsContact SG-CA 3.55Å; C433-C492 WeakPolarHBondContact SG-CB 3.47Å; C433-C492 CovalentContact SG-SG 2.04Å; C433-C492 PolarHBondContact SG-SG 2.87Å; N434-C492 PolarHBondContact N-SG 3.04Å; I437-C492 VanDerWaalsContact CD1-SG 3.5Å; C492-T494 WeakPolarHBondContact O-CG2 3Å; C492-T494 PolarHBondContact O-N 2.83Å
493	P	85.4	Confident	85.4	Confident	11 Å²	11	44.2 Å²	44.2	7%	0.071	21%	0.213	C	C	.	.			trans	-64.7	126.1	177.9	26.8	-33.4	0	0	0	109.3	P411 Y446 M448 V453	P411-P493 HydrophobicContact CG-CG 3.96Å; Y446-P493 HydrophobicContact CD2-CG 4.37Å; Y446-P493 HydrophobicContact CE1-CG 4.31Å; Y446-P493 HydrophobicContact CE2-CB 4.29Å; Y446-P493 HydrophobicContact CE2-CG 3.94Å; M448-P493 HydrophobicContact CE-CB 3.45Å; M448-P493 VanDerWaalsContact CE-CB 3.45Å; M448-P493 HydrophobicContact CE-CG 4.16Å; V453-P493 HydrophobicContact CG2-CG 3.78Å
494	T	87.3	Confident	86.7	Confident	16 Å²	16	39.9 Å²	39.9	10%	0.098	19%	0.193	C	C	.	.			trans	-151.8	139.5	-174.8	178.2	0	0	0	0	111	S346 S406 C492 Y496 F497	S346-T494 WeakPolarHBondContact O-CG2 3.22Å; S406-T494 WeakPolarHBondContact OG-CG2 3.06Å; S406-T494 PolarHBondContact OG-OG1 2.85Å; C492-T494 WeakPolarHBondContact O-CG2 3Å; C492-T494 PolarHBondContact O-N 2.83Å; T494-Y496 PolarHBondContact O-N 3.28Å; T494-Y496 PolarHBondContact OG1-N 2.85Å; T494-F497 HydrophobicContact CG2-CB 4.29Å
495	P	84.4	Confident	87.5	Confident	87 Å²	87	36.6 Å²	36.6	57%	0.565	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.3	173.6	31.4	-34.4	0	0	0	112.8	W498	P495-W498 PolarHBondContact O-NE1 3.28Å
496	Y	86.6	Confident	88.2	Confident	85 Å²	85	38 Å²	38	33%	0.333	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	8.6	-172.6	-58.9	-71.9	0	0	0	114.7	M405 A409 T494 W498 A499	M405-Y496 HydrophobicContact CB-CG 4.44Å; M405-Y496 HydrophobicContact CE-CD1 3.73Å; M405-Y496 HydrophobicContact CE-CE1 3.65Å; M405-Y496 HydrophobicContact CE-CG 4.39Å; A409-Y496 HydrophobicContact CB-CD2 3.56Å; A409-Y496 HydrophobicContact CB-CE2 3.5Å; T494-Y496 PolarHBondContact O-N 3.28Å; T494-Y496 PolarHBondContact OG1-N 2.85Å; Y496-W498 PolarHBondContact O-N 3.09Å; Y496-W498 VanDerWaalsContact O-N 3.1Å; Y496-A499 WeakPolarHBondContact O-CB 3.32Å; Y496-A499 PolarHBondContact O-N 3.08Å
497	F	85.2	Confident	88.8	Confident	76 Å²	76	34.2 Å²	34.2	33%	0.333	17%	0.165	S	C	.	.	H	α-helix	trans	-56.5	-30.6	-178.8	76.4	-90	0	0	0	113.4	S346 V348 T494 A499 A500 L501	S346-F497 WeakPolarHBondContact O-CB 3.45Å; V348-F497 HydrophobicContact CG2-CB 4.48Å; V348-F497 HydrophobicContact CG2-CD2 3.75Å; V348-F497 HydrophobicContact CG2-CE2 4.41Å; V348-F497 HydrophobicContact CG2-CG 4.37Å; T494-F497 HydrophobicContact CG2-CB 4.29Å; F497-A499 VanDerWaalsContact C-N 3.26Å; F497-A499 PolarHBondContact O-N 3.46Å; F497-A500 PolarHBondContact O-N 2.03Å; F497-L501 PolarHBondContact O-N 3.27Å
498	W	89.1	Confident	89.2	Confident	143 Å²	143	32.7 Å²	32.7	54%	0.542	16%	0.159	S	C	.	.	H	α-helix	trans	-64.9	-26.6	179.5	66.1	-90.6	0	0	0	113.4	P495 Y496 A500 L501 L502	P495-W498 PolarHBondContact O-NE1 3.28Å; Y496-W498 PolarHBondContact O-N 3.09Å; Y496-W498 VanDerWaalsContact O-N 3.1Å; W498-A500 VanDerWaalsContact C-N 3.34Å; W498-L501 PolarHBondContact O-N 2.77Å; W498-L502 HydrophobicContact CZ3-CD2 4.23Å; W498-L502 WeakPolarHBondContact O-CB 3.39Å; W498-L502 PolarHBondContact O-N 2.66Å
499	A	91.3	Very high	89.8	Confident	11 Å²	11	34.6 Å²	34.6	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-66.5	-38.6	178.6	0	0	0	0	0	111.2	Y496 F497 L502 G503	Y496-A499 WeakPolarHBondContact O-CB 3.32Å; Y496-A499 PolarHBondContact O-N 3.08Å; F497-A499 VanDerWaalsContact C-N 3.26Å; F497-A499 PolarHBondContact O-N 3.46Å; A499-L502 PolarHBondContact O-N 3.47Å; A499-G503 PolarHBondContact O-N 3.47Å
500	A	88.7	Confident	90.5	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-67.9	-41	175.2	0	0	0	0	0	111.8	S346 L399 F403 F497 W498 L502 G503 L504	S346-A500 VanDerWaalsContact CB-CB 3.43Å; L399-A500 HydrophobicContact CD1-CB 3.85Å; L399-A500 VanDerWaalsContact CD1-O 3.27Å; L399-A500 WeakPolarHBondContact CD1-O 3.32Å; F403-A500 HydrophobicContact CE2-CB 4.15Å; F403-A500 HydrophobicContact CZ-CB 4.25Å; F497-A500 PolarHBondContact O-N 2.03Å; W498-A500 VanDerWaalsContact C-N 3.34Å; A500-L502 PolarHBondContact O-N 3.46Å; A500-G503 PolarHBondContact O-N 3.2Å; A500-L504 WeakPolarHBondContact O-CG 3Å; A500-L504 PolarHBondContact O-N 3.48Å
501	L	91.7	Very high	91.3	Very high	30 Å²	30	36.5 Å²	36.5	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-46.4	173.9	176.3	65.4	0	0	0	111.6	L343 L357 T361 F497 W498 G503 L504 I505	L343-L501 HydrophobicContact CD2-CB 4.07Å; L343-L501 HydrophobicContact CD2-CD1 3.73Å; L343-L501 HydrophobicContact CD2-CG 4.5Å; L357-L501 HydrophobicContact CB-CD1 4.31Å; L357-L501 HydrophobicContact CD1-CD2 4.35Å; L357-L501 HydrophobicContact CD2-CD1 4.21Å; L357-L501 HydrophobicContact CD2-CD2 3.71Å; T361-L501 HydrophobicContact CG2-CD1 4.46Å; F497-L501 PolarHBondContact O-N 3.27Å; W498-L501 PolarHBondContact O-N 2.77Å; L501-G503 VanDerWaalsContact C-N 3.33Å; L501-G503 PolarHBondContact O-N 2.98Å; L501-L504 PolarHBondContact O-N 2.86Å; L501-I505 HydrophobicContact CD1-CD1 4.02Å; L501-I505 HydrophobicContact CD1-CG1 4.35Å; L501-I505 HydrophobicContact CG-CD1 4.02Å; L501-I505 WeakPolarHBondContact O-CG1 3.38Å; L501-I505 PolarHBondContact O-N 3.37Å
502	L	94.2	Very high	91.6	Very high	76 Å²	76	36 Å²	36	40%	0.398	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-44.1	176.3	179.3	64.5	0	0	0	111.3	W498 A499 A500 L504 I505 L506	W498-L502 HydrophobicContact CZ3-CD2 4.23Å; W498-L502 WeakPolarHBondContact O-CB 3.39Å; W498-L502 PolarHBondContact O-N 2.66Å; A499-L502 PolarHBondContact O-N 3.47Å; A500-L502 PolarHBondContact O-N 3.46Å; L502-L504 PolarHBondContact O-N 2.93Å; L502-I505 PolarHBondContact O-N 2.94Å; L502-L506 HydrophobicContact CD1-CD1 4.13Å; L502-L506 HydrophobicContact CD1-CG 4.2Å; L502-L506 HydrophobicContact CG-CD1 3.97Å; L502-L506 HydrophobicContact CG-CG 4.44Å; L502-L506 WeakPolarHBondContact O-CB 3.14Å; L502-L506 VanDerWaalsContact O-CG 3.3Å; L502-L506 WeakPolarHBondContact O-CG 3.16Å; L502-L506 PolarHBondContact O-N 3.33Å
503	G	94.8	Very high	91.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.4	-45.1	175.5	0	0	0	0	0	112.8	A499 A500 L501 Y507	A499-G503 PolarHBondContact O-N 3.47Å; A500-G503 PolarHBondContact O-N 3.2Å; L501-G503 VanDerWaalsContact C-N 3.33Å; L501-G503 PolarHBondContact O-N 2.98Å; G503-Y507 VanDerWaalsContact O-CB 3.25Å; G503-Y507 WeakPolarHBondContact O-CB 3.37Å; G503-Y507 PolarHBondContact O-N 3.38Å
504	L	94.1	Very high	92.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-42.6	177.1	-74.6	171.4	0	0	0	112.9	I335 I342 L343 T361 L399 A500 L501 L502 Y507 L508	I335-L504 HydrophobicContact CD1-CD2 4.32Å; I335-L504 HydrophobicContact CG1-CD2 4.06Å; I335-L504 HydrophobicContact CG2-CD2 3.83Å; I342-L504 HydrophobicContact CG2-CD1 3.97Å; I342-L504 HydrophobicContact CG2-CD2 4.38Å; L343-L504 HydrophobicContact CD2-CD1 3.84Å; L343-L504 HydrophobicContact CG-CD1 3.96Å; T361-L504 HydrophobicContact CG2-CB 4.21Å; L399-L504 HydrophobicContact CD1-CD2 4.5Å; L399-L504 HydrophobicContact CD1-CG 4.05Å; L399-L504 HydrophobicContact CD2-CD2 3.85Å; L399-L504 HydrophobicContact CD2-CG 4.27Å; A500-L504 WeakPolarHBondContact O-CG 3Å; A500-L504 PolarHBondContact O-N 3.48Å; L501-L504 PolarHBondContact O-N 2.86Å; L502-L504 PolarHBondContact O-N 2.93Å; L504-Y507 WeakPolarHBondContact O-CB 3.43Å; L504-Y507 PolarHBondContact O-N 3.48Å; L504-L508 PolarHBondContact O-N 3.42Å; L504-L508 VanDerWaalsContact O-N 3.14Å
505	I	95.7	Very high	92.3	Very high	39 Å²	39	35.1 Å²	35.1	20%	0.2	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-49.6	177.3	-69.4	171.2	0	0	0	109.9	V360 T361 T364 L501 L502 Y507 L508 I509	V360-I505 HydrophobicContact CG1-CD1 4.3Å; T361-I505 HydrophobicContact CG2-CG1 4.35Å; T364-I505 HydrophobicContact CG2-CG2 4.23Å; L501-I505 HydrophobicContact CD1-CD1 4.02Å; L501-I505 HydrophobicContact CD1-CG1 4.35Å; L501-I505 HydrophobicContact CG-CD1 4.02Å; L501-I505 WeakPolarHBondContact O-CG1 3.38Å; L501-I505 PolarHBondContact O-N 3.37Å; L502-I505 PolarHBondContact O-N 2.94Å; I505-Y507 VanDerWaalsContact C-N 3.26Å; I505-Y507 PolarHBondContact O-N 3.42Å; I505-L508 PolarHBondContact O-N 3.07Å; I505-I509 HydrophobicContact CG2-CD1 3.81Å; I505-I509 HydrophobicContact CG2-CG1 4.36Å; I505-I509 VanDerWaalsContact O-CG1 3.28Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 2.97Å
506	L	96.7	Very high	92.4	Very high	43 Å²	43	32 Å²	32	23%	0.225	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-39.4	177.3	-72.4	174.4	0	0	0	111.7	A395 I398 L502 L508 I509 F510	A395-L506 HydrophobicContact CB-CB 3.88Å; I398-L506 HydrophobicContact CD1-CD1 3.83Å; L502-L506 HydrophobicContact CD1-CD1 4.13Å; L502-L506 HydrophobicContact CD1-CG 4.2Å; L502-L506 HydrophobicContact CG-CD1 3.97Å; L502-L506 HydrophobicContact CG-CG 4.44Å; L502-L506 WeakPolarHBondContact O-CB 3.14Å; L502-L506 VanDerWaalsContact O-CG 3.3Å; L502-L506 WeakPolarHBondContact O-CG 3.16Å; L502-L506 PolarHBondContact O-N 3.33Å; L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 2.96Å; L506-I509 HydrophobicContact CD2-CD1 4.45Å; L506-I509 PolarHBondContact O-N 3.18Å; L506-F510 HydrophobicContact CD2-CE2 4.4Å; L506-F510 WeakPolarHBondContact O-CD2 3.46Å; L506-F510 PolarHBondContact O-N 3.33Å; L506-F510 VanDerWaalsContact O-N 3.09Å
507	Y	97.1	Very high	92.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-56.2	-50.1	176.1	174.7	-84.6	0	0	0	110.8	S330 I332 I335 T392 A395 L396 G503 L504 I505 F510 F511	S330-Y507 WeakPolarHBondContact O-CE2 3.5Å; S330-Y507 PolarHBondContact O-OH 3.16Å; I332-Y507 VanDerWaalsContact CA-OH 3.26Å; I332-Y507 WeakPolarHBondContact CA-OH 3.33Å; I332-Y507 HydrophobicContact CD1-CE1 3.79Å; I332-Y507 PolarHBondContact N-OH 3.01Å; I335-Y507 HydrophobicContact CB-CE1 4.45Å; I335-Y507 HydrophobicContact CD1-CD1 3.53Å; I335-Y507 HydrophobicContact CD1-CD2 3.85Å; I335-Y507 HydrophobicContact CD1-CE1 3.37Å; I335-Y507 HydrophobicContact CD1-CE2 3.66Å; I335-Y507 HydrophobicContact CD1-CG 3.79Å; I335-Y507 VanDerWaalsContact CD1-CZ 3.44Å; I335-Y507 HydrophobicContact CG1-CE1 4.49Å; I335-Y507 HydrophobicContact CG2-CD1 4.36Å; I335-Y507 HydrophobicContact CG2-CE1 4.44Å; T392-Y507 HydrophobicContact CG2-CD2 3.52Å; T392-Y507 HydrophobicContact CG2-CE2 3.18Å; T392-Y507 HydrophobicContact CG2-CG 4.47Å; A395-Y507 VanDerWaalsContact CB-CA 3.46Å; A395-Y507 VanDerWaalsContact CB-N 3.33Å; L396-Y507 HydrophobicContact CD1-CD2 4.47Å; L396-Y507 HydrophobicContact CD1-CE2 4.07Å; L396-Y507 HydrophobicContact CD2-CD2 3.57Å; L396-Y507 HydrophobicContact CD2-CE2 3.62Å; L396-Y507 HydrophobicContact CG-CD2 3.7Å; L396-Y507 HydrophobicContact CG-CE2 3.78Å; G503-Y507 VanDerWaalsContact O-CB 3.25Å; G503-Y507 WeakPolarHBondContact O-CB 3.37Å; G503-Y507 PolarHBondContact O-N 3.38Å; L504-Y507 WeakPolarHBondContact O-CB 3.43Å; L504-Y507 PolarHBondContact O-N 3.48Å; I505-Y507 VanDerWaalsContact C-N 3.26Å; I505-Y507 PolarHBondContact O-N 3.42Å; Y507-F510 PolarHBondContact O-N 2.62Å; Y507-F511 HydrophobicContact CD1-CB 4.37Å; Y507-F511 HydrophobicContact CE1-CB 4.07Å; Y507-F511 HydrophobicContact CE1-CD2 4.36Å; Y507-F511 HydrophobicContact CE1-CG 4.16Å; Y507-F511 WeakPolarHBondContact O-CB 3.32Å; Y507-F511 PolarHBondContact O-N 3.37Å
508	L	95.4	Very high	92.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.8	-34	-178.8	-66.6	174.3	0	0	0	112.9	I332 I335 M336 T361 T364 N365 L504 I505 L506 F510 A512	I332-L508 HydrophobicContact CD1-CD2 3.65Å; I335-L508 HydrophobicContact CG2-CD2 4.42Å; M336-L508 HydrophobicContact SD-CD2 4.13Å; T361-L508 WeakPolarHBondContact O-CD1 3.47Å; T364-L508 HydrophobicContact CG2-CB 4.26Å; N365-L508 HydrophobicContact CB-CD1 4.34Å; N365-L508 HydrophobicContact CB-CD2 4.32Å; L504-L508 PolarHBondContact O-N 3.42Å; L504-L508 VanDerWaalsContact O-N 3.14Å; I505-L508 PolarHBondContact O-N 3.07Å; L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 2.96Å; L508-F510 VanDerWaalsContact C-N 3.29Å; L508-F510 PolarHBondContact O-N 3.47Å; L508-A512 WeakPolarHBondContact O-CB 3.42Å; L508-A512 PolarHBondContact O-N 3.33Å
509	I	96.1	Very high	92.4	Very high	40 Å²	40	18.6 Å²	18.6	21%	0.205	10%	0.102	C	C	.	.	H	α-helix	trans	-56.4	-44.8	173	-73	174.9	0	0	0	111	T364 F368 I505 L506 P513	T364-I509 HydrophobicContact CG2-CD1 4.38Å; T364-I509 HydrophobicContact CG2-CG1 3.56Å; F368-I509 HydrophobicContact CD1-CB 4.41Å; F368-I509 HydrophobicContact CD1-CG2 4Å; F368-I509 HydrophobicContact CD2-CB 4.48Å; F368-I509 HydrophobicContact CD2-CG1 3.87Å; F368-I509 HydrophobicContact CE1-CB 4.33Å; F368-I509 HydrophobicContact CE1-CG1 4.29Å; F368-I509 HydrophobicContact CE1-CG2 3.63Å; F368-I509 HydrophobicContact CE2-CB 4.4Å; F368-I509 HydrophobicContact CE2-CD1 4.16Å; F368-I509 HydrophobicContact CE2-CG1 3.56Å; F368-I509 HydrophobicContact CE2-CG2 4.45Å; F368-I509 HydrophobicContact CG-CB 4.48Å; F368-I509 HydrophobicContact CG-CG1 4.36Å; F368-I509 HydrophobicContact CZ-CB 4.31Å; F368-I509 HydrophobicContact CZ-CD1 4.18Å; F368-I509 HydrophobicContact CZ-CG1 3.77Å; F368-I509 HydrophobicContact CZ-CG2 3.87Å; I505-I509 HydrophobicContact CG2-CD1 3.81Å; I505-I509 HydrophobicContact CG2-CG1 4.36Å; I505-I509 VanDerWaalsContact O-CG1 3.28Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 2.97Å; L506-I509 HydrophobicContact CD2-CD1 4.45Å; L506-I509 PolarHBondContact O-N 3.18Å; I509-P513 WeakPolarHBondContact O-CD 3.46Å; I509-P513 WeakPolarHBondContact O-CG 3.33Å
510	F	96.3	Very high	92.2	Very high	84 Å²	84	23.3 Å²	23.3	37%	0.368	12%	0.118	S	C	.	.	H	α-helix	trans	-84.5	-35.2	-178.2	-71	-63.8	0	0	0	113.1	S388 G391 L506 Y507 L508 P513	S388-F510 WeakPolarHBondContact CA-O 3.36Å; S388-F510 VanDerWaalsContact CB-O 3.23Å; S388-F510 WeakPolarHBondContact CB-O 3.38Å; S388-F510 PolarHBondContact OG-O 3.41Å; G391-F510 WeakPolarHBondContact O-CD2 3.48Å; L506-F510 HydrophobicContact CD2-CE2 4.4Å; L506-F510 WeakPolarHBondContact O-CD2 3.46Å; L506-F510 PolarHBondContact O-N 3.33Å; L506-F510 VanDerWaalsContact O-N 3.09Å; Y507-F510 PolarHBondContact O-N 2.62Å; L508-F510 VanDerWaalsContact C-N 3.29Å; L508-F510 PolarHBondContact O-N 3.47Å; F510-P513 WeakPolarHBondContact O-CD 3.31Å
511	F	95.1	Very high	91.9	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-72.6	-49.4	-177.2	-175.4	-84.5	0	0	0	112.5	Q327 S330 I332 S388 T392 Y507 G514 M515 G516	Q327-F511 HydrophobicContact CG-CE2 4.49Å; Q327-F511 HydrophobicContact CG-CZ 3.88Å; S330-F511 VanDerWaalsContact OG-CE2 3.27Å; S330-F511 WeakPolarHBondContact OG-CE2 3.39Å; I332-F511 HydrophobicContact CB-CD1 4.22Å; I332-F511 HydrophobicContact CB-CD2 4.43Å; I332-F511 HydrophobicContact CB-CE1 3.66Å; I332-F511 HydrophobicContact CB-CE2 3.9Å; I332-F511 HydrophobicContact CB-CZ 3.48Å; I332-F511 VanDerWaalsContact CB-CZ 3.48Å; I332-F511 HydrophobicContact CD1-CD1 3.54Å; I332-F511 HydrophobicContact CD1-CE1 3.7Å; I332-F511 HydrophobicContact CD1-CG 4.14Å; I332-F511 HydrophobicContact CD1-CZ 4.39Å; I332-F511 HydrophobicContact CG1-CD1 3.81Å; I332-F511 HydrophobicContact CG1-CE1 3.38Å; I332-F511 HydrophobicContact CG1-CZ 3.79Å; I332-F511 HydrophobicContact CG2-CE1 4Å; I332-F511 HydrophobicContact CG2-CE2 4.17Å; I332-F511 HydrophobicContact CG2-CZ 3.53Å; S388-F511 PolarHBondContact OG-O 3.17Å; T392-F511 HydrophobicContact CG2-CD2 4.14Å; Y507-F511 HydrophobicContact CD1-CB 4.37Å; Y507-F511 HydrophobicContact CE1-CB 4.07Å; Y507-F511 HydrophobicContact CE1-CD2 4.36Å; Y507-F511 HydrophobicContact CE1-CG 4.16Å; Y507-F511 WeakPolarHBondContact O-CB 3.32Å; Y507-F511 PolarHBondContact O-N 3.37Å; F511-G514 PolarHBondContact O-N 3.36Å; F511-M515 HydrophobicContact CD2-CB 3.66Å; F511-M515 HydrophobicContact CE2-CB 3.46Å; F511-M515 VanDerWaalsContact CE2-CB 3.46Å; F511-M515 HydrophobicContact CE2-CG 4.47Å; F511-M515 HydrophobicContact CG-CB 4.27Å; F511-M515 HydrophobicContact CZ-CB 3.93Å; F511-M515 PolarHBondContact O-N 2.79Å; F511-M515 VanDerWaalsContact O-N 3.16Å; F511-G516 PolarHBondContact O-N 3.36Å
512	A	92.1	Very high	91.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-43.8	-171.7	0	0	0	0	0	115	N365 F368 L508 G514 P517	N365-A512 VanDerWaalsContact OD1-CB 3.28Å; N365-A512 WeakPolarHBondContact OD1-CB 3.21Å; F368-A512 HydrophobicContact CB-CB 3.82Å; L508-A512 WeakPolarHBondContact O-CB 3.42Å; L508-A512 PolarHBondContact O-N 3.33Å; A512-G514 PolarHBondContact O-N 2.86Å; A512-P517 WeakPolarHBondContact O-CD 3.5Å
513	P	91.3	Very high	91.3	Very high	15 Å²	15	20.1 Å²	20.1	10%	0.097	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-22.5	-174.2	28.2	-34	0	0	0	114.3	G372 L384 I509 F510	G372-P513 VanDerWaalsContact CA-CA 3.43Å; G372-P513 VanDerWaalsContact CA-CB 3.45Å; G372-P513 WeakPolarHBondContact CA-O 3.27Å; L384-P513 WeakPolarHBondContact CD2-O 3.35Å; I509-P513 WeakPolarHBondContact O-CD 3.46Å; I509-P513 WeakPolarHBondContact O-CG 3.33Å; F510-P513 WeakPolarHBondContact O-CD 3.31Å
514	G	90.4	Very high	90.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-78.5	-175.6	0	0	0	0	0	112.6	F511 A512 G516 P517 M518	F511-G514 PolarHBondContact O-N 3.36Å; A512-G514 PolarHBondContact O-N 2.86Å; G514-G516 PolarHBondContact O-N 3.28Å; G514-P517 VanDerWaalsContact O-CD 3.27Å; G514-P517 WeakPolarHBondContact O-CD 3.46Å; G514-M518 WeakPolarHBondContact O-CB 3.43Å; G514-M518 WeakPolarHBondContact O-CG 3.43Å; G514-M518 PolarHBondContact O-N 2.88Å
515	M	91.6	Very high	90.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.2	-176.3	-77.4	-62	-62.7	0	0	113.9	Q327 T385 S388 L389 F511 P519	Q327-M515 HydrophobicContact CB-CE 4Å; Q327-M515 PolarHBondContact NE2-O 2.8Å; T385-M515 HydrophobicContact CG2-SD 3.63Å; S388-M515 PolarHBondContact OG-N 3.37Å; L389-M515 HydrophobicContact CB-CG 3.93Å; L389-M515 HydrophobicContact CB-SD 4.13Å; L389-M515 HydrophobicContact CD1-CE 4.4Å; L389-M515 HydrophobicContact CD1-CG 4.19Å; L389-M515 HydrophobicContact CD1-SD 4.39Å; L389-M515 HydrophobicContact CD2-SD 4.23Å; F511-M515 HydrophobicContact CD2-CB 3.66Å; F511-M515 HydrophobicContact CE2-CB 3.46Å; F511-M515 VanDerWaalsContact CE2-CB 3.46Å; F511-M515 HydrophobicContact CE2-CG 4.47Å; F511-M515 HydrophobicContact CG-CB 4.27Å; F511-M515 HydrophobicContact CZ-CB 3.93Å; F511-M515 PolarHBondContact O-N 2.79Å; F511-M515 VanDerWaalsContact O-N 3.16Å; M515-P519 HydrophobicContact CE-CG 4.43Å; M515-P519 WeakPolarHBondContact O-CD 3.42Å; M515-P519 WeakPolarHBondContact O-CG 3.36Å
516	G	86.9	Confident	89.7	Confident	20 Å²	20	22.9 Å²	22.9	21%	0.206	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-71	169.2	0	0	0	0	0	113.4	Q327 F511 G514	Q327-G516 PolarHBondContact NE2-O 3.43Å; F511-G516 PolarHBondContact O-N 3.36Å; G514-G516 PolarHBondContact O-N 3.28Å
517	P	84	Confident	89.1	Confident	21 Å²	21	21 Å²	21	14%	0.136	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-30	-175.4	28.2	-34.9	0	0	0	114.9	A512 G514 W520 T521	A512-P517 WeakPolarHBondContact O-CD 3.5Å; G514-P517 VanDerWaalsContact O-CD 3.27Å; G514-P517 WeakPolarHBondContact O-CD 3.46Å; P517-W520 PolarHBondContact O-N 3.3Å; P517-T521 PolarHBondContact O-N 3.41Å; P517-T521 VanDerWaalsContact O-N 3.11Å; P517-T521 PolarHBondContact O-OG1 2.9Å
518	M	87.8	Confident	88.2	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-40.9	-167.3	-66	-61.9	91.2	0	0	115.7	V376 R381 L384 T385 G514 W520 T521 V522	V376-M518 HydrophobicContact CB-CE 4.23Å; V376-M518 HydrophobicContact CG1-CE 4.03Å; V376-M518 HydrophobicContact CG1-SD 4.49Å; V376-M518 HydrophobicContact CG2-CE 3.11Å; V376-M518 HydrophobicContact CG2-SD 3.81Å; R381-M518 HydrophobicContact CB-SD 4.31Å; R381-M518 HydrophobicContact CG-SD 4.12Å; L384-M518 HydrophobicContact CD2-CG 4.42Å; L384-M518 HydrophobicContact CD2-SD 4.24Å; T385-M518 HydrophobicContact CG2-CB 4.48Å; T385-M518 WeakPolarHBondContact OG1-CB 3.44Å; T385-M518 WeakPolarHBondContact OG1-CG 3.23Å; G514-M518 WeakPolarHBondContact O-CB 3.43Å; G514-M518 WeakPolarHBondContact O-CG 3.43Å; G514-M518 PolarHBondContact O-N 2.88Å; M518-W520 PolarHBondContact O-N 3.43Å; M518-T521 PolarHBondContact O-N 2.76Å; M518-V522 WeakPolarHBondContact O-CB 3.38Å; M518-V522 VanDerWaalsContact O-CG2 3.29Å; M518-V522 WeakPolarHBondContact O-CG2 3.47Å; M518-V522 PolarHBondContact O-N 2.91Å
519	P	90.4	Very high	87.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.4	-35.7	176	-29.3	38.7	0	0	0	113	L323 Q327 M515 N523	L323-P519 HydrophobicContact CB-CB 4.19Å; Q327-P519 HydrophobicContact CB-CG 4.07Å; Q327-P519 HydrophobicContact CG-CG 4.21Å; M515-P519 HydrophobicContact CE-CG 4.43Å; M515-P519 WeakPolarHBondContact O-CD 3.42Å; M515-P519 WeakPolarHBondContact O-CG 3.36Å; P519-N523 VanDerWaalsContact O-CB 3.3Å; P519-N523 WeakPolarHBondContact O-CB 3.1Å; P519-N523 PolarHBondContact O-N 2.95Å; P519-N523 PolarHBondContact O-ND2 2.96Å
520	W	85.4	Confident	86.2	Confident	111 Å²	111	27.6 Å²	27.6	42%	0.42	14%	0.143	S	C	.	.	H	α-helix	trans	-74.6	-46.1	177.1	-64.1	99.4	0	0	0	112	P517 M518 N523 S524 A540 N543	P517-W520 PolarHBondContact O-N 3.3Å; M518-W520 PolarHBondContact O-N 3.43Å; W520-N523 PolarHBondContact O-N 3.39Å; W520-S524 PolarHBondContact O-N 3.29Å; W520-A540 HydrophobicContact CH2-CB 4.01Å; W520-A540 HydrophobicContact CZ3-CB 3.88Å; W520-N543 HydrophobicContact CZ2-CB 4.41Å
521	T	83	Confident	85.3	Confident	40 Å²	40	23.6 Å²	23.6	25%	0.245	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-49.6	178.5	-55.9	0	0	0	0	111.5	P517 M518 N523 S524 E525	P517-T521 PolarHBondContact O-N 3.41Å; P517-T521 VanDerWaalsContact O-N 3.11Å; P517-T521 PolarHBondContact O-OG1 2.9Å; M518-T521 PolarHBondContact O-N 2.76Å; T521-N523 PolarHBondContact O-N 3.06Å; T521-S524 PolarHBondContact O-N 2.89Å; T521-S524 VanDerWaalsContact O-N 3.09Å; T521-S524 PolarHBondContact O-OG 3.17Å; T521-E525 PolarHBondContact O-N 2.85Å
522	V	87.1	Confident	84.5	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.5	-42.8	-178.8	173.8	0	0	0	0	111	L323 R381 M518 S524 E525 I526 L585	L323-V522 HydrophobicContact CD1-CB 4.01Å; L323-V522 HydrophobicContact CD1-CG1 3.66Å; R381-V522 HydrophobicContact CB-CG2 4.12Å; R381-V522 HydrophobicContact CG-CG2 4.43Å; M518-V522 WeakPolarHBondContact O-CB 3.38Å; M518-V522 VanDerWaalsContact O-CG2 3.29Å; M518-V522 WeakPolarHBondContact O-CG2 3.47Å; M518-V522 PolarHBondContact O-N 2.91Å; V522-S524 PolarHBondContact O-N 3.12Å; V522-E525 PolarHBondContact O-N 3.41Å; V522-I526 HydrophobicContact CG1-CD1 4.44Å; V522-I526 HydrophobicContact CG1-CG2 3.53Å; V522-I526 WeakPolarHBondContact O-CG1 3.37Å; V522-I526 WeakPolarHBondContact O-CG2 3.48Å; V522-I526 PolarHBondContact O-N 3.26Å; V522-L585 HydrophobicContact CG1-CD1 3.92Å
523	N	85.8	Confident	83.6	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-30.8	176.2	-90.4	-60.2	0	0	0	113	G320 Q324 P519 W520 T521 E525 Y527 N536 S539	G320-N523 WeakPolarHBondContact CA-OD1 3.26Å; G320-N523 PolarHBondContact O-ND2 2.81Å; G320-N523 VanDerWaalsContact O-ND2 3.09Å; Q324-N523 WeakPolarHBondContact CG-ND2 3.23Å; P519-N523 VanDerWaalsContact O-CB 3.3Å; P519-N523 WeakPolarHBondContact O-CB 3.1Å; P519-N523 PolarHBondContact O-N 2.95Å; P519-N523 PolarHBondContact O-ND2 2.96Å; W520-N523 PolarHBondContact O-N 3.39Å; T521-N523 PolarHBondContact O-N 3.06Å; N523-E525 VanDerWaalsContact C-N 3.31Å; N523-E525 PolarHBondContact O-N 3.09Å; N523-Y527 HydrophobicContact CB-CE2 4.44Å; N523-Y527 WeakPolarHBondContact O-CD2 3.28Å; N523-Y527 VanDerWaalsContact O-CE2 3.3Å; N523-Y527 WeakPolarHBondContact O-CE2 3.04Å; N523-Y527 PolarHBondContact OD1-OH 2.98Å; N523-N536 WeakPolarHBondContact CB-OD1 3.43Å; N523-N536 PolarHBondContact O-ND2 2.97Å; N523-N536 PolarHBondContact O-OD1 3.25Å; N523-S539 VanDerWaalsContact OD1-CB 3.26Å; N523-S539 WeakPolarHBondContact OD1-CB 3.46Å; N523-S539 PolarHBondContact OD1-OG 3.41Å
524	S	81.1	Confident	83.1	Confident	57 Å²	57	31 Å²	31	40%	0.399	17%	0.169	S	C	.	.	H	α-helix	trans	-74.2	-21	175.4	76.4	0	0	0	0	113.9	W520 T521 V522 R532 N536	W520-S524 PolarHBondContact O-N 3.29Å; T521-S524 PolarHBondContact O-N 2.89Å; T521-S524 VanDerWaalsContact O-N 3.09Å; T521-S524 PolarHBondContact O-OG 3.17Å; V522-S524 PolarHBondContact O-N 3.12Å; S524-R532 PolarHBondContact O-NE 3.41Å; S524-N536 PolarHBondContact N-OD1 2.87Å
525	E	84.6	Confident	82.8	Confident	38 Å²	38	31 Å²	31	18%	0.178	17%	0.169	C	C	.	.	H	α-helix	trans	-98.9	-35.6	-174.4	-66.7	175.4	-179.2	0	0	113	R381 T521 V522 N523 Y527 T588 I596	R381-E525 IonicContact CZ-OE1 3.22Å; R381-E525 IonicContact NE-OE1 3.58Å; R381-E525 PolarHBondContact NE-OE1 3.14Å; R381-E525 IonicContact NE-OE2 3.32Å; R381-E525 IonicContact NH2-OE1 2.58Å; T521-E525 PolarHBondContact O-N 2.85Å; V522-E525 PolarHBondContact O-N 3.41Å; N523-E525 VanDerWaalsContact C-N 3.31Å; N523-E525 PolarHBondContact O-N 3.09Å; E525-Y527 PolarHBondContact O-N 2.65Å; E525-T588 VanDerWaalsContact OE2-CB 3.31Å; E525-T588 WeakPolarHBondContact OE2-CB 3.31Å; E525-T588 PolarHBondContact OE2-OG1 2.97Å; E525-I596 VanDerWaalsContact O-CD1 3.22Å; E525-I596 WeakPolarHBondContact O-CD1 3.37Å
526	I	86.1	Confident	82.4	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.18	C	C	.	.	S	Bend	trans	-76.5	-14.8	-167	61.9	179.2	0	0	0	116.3	A316 V522 T588 F600	A316-I526 VanDerWaalsContact O-CD1 3.31Å; A316-I526 WeakPolarHBondContact O-CD1 3.35Å; V522-I526 HydrophobicContact CG1-CD1 4.44Å; V522-I526 HydrophobicContact CG1-CG2 3.53Å; V522-I526 WeakPolarHBondContact O-CG1 3.37Å; V522-I526 WeakPolarHBondContact O-CG2 3.48Å; V522-I526 PolarHBondContact O-N 3.26Å; I526-T588 HydrophobicContact CG2-CG2 3.98Å; I526-F600 HydrophobicContact CB-CE2 4.02Å; I526-F600 HydrophobicContact CB-CZ 4.08Å; I526-F600 HydrophobicContact CG2-CE2 4.3Å; I526-F600 HydrophobicContact CG2-CZ 4.09Å
527	Y	82.8	Confident	82.2	Confident	3 Å²	3	34.9 Å²	34.9	1%	0.012	19%	0.192	C	C	.	.	S	Bend	trans	-99.8	140.4	-174.9	-59.7	-65	0	0	0	112.5	M307 A316 L317 N523 E525 R532 G535 S539	M307-Y527 HydrophobicContact CE-CD1 3.9Å; M307-Y527 HydrophobicContact CE-CE1 3.99Å; A316-Y527 HydrophobicContact CB-CD1 4Å; A316-Y527 HydrophobicContact CB-CE1 4Å; L317-Y527 HydrophobicContact CB-CE1 4.35Å; L317-Y527 HydrophobicContact CD1-CE1 4.31Å; N523-Y527 HydrophobicContact CB-CE2 4.44Å; N523-Y527 WeakPolarHBondContact O-CD2 3.28Å; N523-Y527 VanDerWaalsContact O-CE2 3.3Å; N523-Y527 WeakPolarHBondContact O-CE2 3.04Å; N523-Y527 PolarHBondContact OD1-OH 2.98Å; E525-Y527 PolarHBondContact O-N 2.65Å; Y527-R532 PolarHBondContact O-NE 2.99Å; Y527-R532 PolarHBondContact O-NH2 3.21Å; Y527-R532 VanDerWaalsContact O-NH2 3.08Å; Y527-G535 VanDerWaalsContact CE2-C 3.42Å; Y527-S539 PolarHBondContact OH-OG 3.39Å
528	P	79.9	Confident	82.3	Confident	15 Å²	15	35.9 Å²	35.9	10%	0.097	20%	0.199	C	C	.	.			trans	-64.5	156.7	170.5	28.7	-33.4	0	0	0	110.4	T313 W530 A531 R532	T313-P528 HydrophobicContact CG2-CG 3.62Å; P528-W530 VanDerWaalsContact C-N 3.34Å; P528-W530 HydrophobicContact CG-CZ2 4.25Å; P528-W530 PolarHBondContact O-N 3.22Å; P528-A531 HydrophobicContact CG-CB 3.85Å; P528-A531 CarbonylContact O-C 3.6Å; P528-A531 PolarHBondContact O-N 3.2Å; P528-R532 WeakPolarHBondContact O-CB 3.37Å; P528-R532 PolarHBondContact O-N 3.45Å
529	L	73.6	Confident	82.4	Confident	120 Å²	120	35.8 Å²	35.8	63%	0.628	20%	0.199	S	C	*	.	H	α-helix	trans	-52.2	-48.9	-170.4	-73.1	166.7	0	0	0	112.9	A531 R532 L593	L529-A531 PolarHBondContact O-N 2.92Å; L529-R532 VanDerWaalsContact CD2-NH1 3.3Å; L529-R532 PolarHBondContact O-N 3.11Å; L529-L593 HydrophobicContact CD2-CD1 4.45Å
530	W	75.9	Confident	82.2	Confident	45 Å²	45	36.7 Å²	36.7	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-22.6	179.7	67.6	-95.9	0	0	0	114.1	V303 R306 M307 Y310 T313 P528	V303-W530 HydrophobicContact CG1-CE3 4.06Å; V303-W530 HydrophobicContact CG1-CZ3 4.1Å; R306-W530 HydrophobicContact CB-CZ3 4.2Å; R306-W530 HydrophobicContact CG-CH2 3.9Å; R306-W530 HydrophobicContact CG-CZ3 3.86Å; M307-W530 HydrophobicContact CG-CH2 4.01Å; M307-W530 HydrophobicContact CG-CZ3 3.8Å; Y310-W530 HydrophobicContact CD1-CZ2 4.29Å; T313-W530 HydrophobicContact CG2-CH2 3.82Å; T313-W530 HydrophobicContact CG2-CZ2 3.52Å; P528-W530 VanDerWaalsContact C-N 3.34Å; P528-W530 HydrophobicContact CG-CZ2 4.25Å; P528-W530 PolarHBondContact O-N 3.22Å
531	A	76.6	Confident	82.4	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-107.8	-11.3	-175.9	0	0	0	0	0	113.6	M307 T313 P528 L529 S533 T534 G535	M307-A531 HydrophobicContact CE-CB 3.91Å; M307-A531 HydrophobicContact CG-CB 3.81Å; M307-A531 HydrophobicContact SD-CB 3.76Å; T313-A531 HydrophobicContact CG2-CB 4.26Å; P528-A531 HydrophobicContact CG-CB 3.85Å; P528-A531 CarbonylContact O-C 3.6Å; P528-A531 PolarHBondContact O-N 3.2Å; L529-A531 PolarHBondContact O-N 2.92Å; A531-S533 PolarHBondContact O-N 3.24Å; A531-T534 PolarHBondContact O-N 3.3Å; A531-G535 PolarHBondContact O-N 2.99Å
532	R	79.1	Confident	82.8	Confident	56 Å²	56	32.4 Å²	32.4	21%	0.211	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-44.1	-164.9	-178.1	176.4	-60.9	155.4	7.4	114.2	S524 Y527 P528 L529 N536 L593	S524-R532 PolarHBondContact O-NE 3.41Å; Y527-R532 PolarHBondContact O-NE 2.99Å; Y527-R532 PolarHBondContact O-NH2 3.21Å; Y527-R532 VanDerWaalsContact O-NH2 3.08Å; P528-R532 WeakPolarHBondContact O-CB 3.37Å; P528-R532 PolarHBondContact O-N 3.45Å; L529-R532 VanDerWaalsContact CD2-NH1 3.3Å; L529-R532 PolarHBondContact O-N 3.11Å; R532-N536 WeakPolarHBondContact CG-ND2 3.45Å; R532-N536 WeakPolarHBondContact O-CB 3.48Å; R532-N536 PolarHBondContact O-N 2.9Å; R532-N536 PolarHBondContact O-ND2 3.45Å; R532-L593 VanDerWaalsContact NH2-CD1 3.3Å
533	S	73.1	Confident	83	Confident	89 Å²	89	32.7 Å²	32.7	62%	0.622	19%	0.194	S	C	*	.	H	α-helix	trans	-62.8	-46.4	179.6	55.8	0	0	0	0	111.1	A531 A537	A531-S533 PolarHBondContact O-N 3.24Å; S533-A537 WeakPolarHBondContact O-CB 3.25Å; S533-A537 PolarHBondContact O-N 3.13Å
534	T	80.6	Confident	83.2	Confident	32 Å²	32	33.6 Å²	33.6	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-45.2	179.8	-59.1	0	0	0	0	111.3	V303 I304 M307 A531 A537 C538	V303-T534 HydrophobicContact CG1-CG2 4.49Å; I304-T534 HydrophobicContact CB-CG2 4.05Å; I304-T534 HydrophobicContact CD1-CG2 3.86Å; M307-T534 HydrophobicContact SD-CG2 3.84Å; A531-T534 PolarHBondContact O-N 3.3Å; T534-A537 PolarHBondContact O-N 2.81Å; T534-C538 PolarHBondContact O-N 2.67Å; T534-C538 PolarHBondContact O-SG 2.93Å; T534-C538 VanDerWaalsContact O-SG 3.38Å
535	G	83.9	Confident	83.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-48.1	177.1	0	0	0	0	0	112.9	Y527 A531 A537 C538 S539	Y527-G535 VanDerWaalsContact CE2-C 3.42Å; A531-G535 PolarHBondContact O-N 2.99Å; G535-A537 VanDerWaalsContact C-N 3.33Å; G535-A537 PolarHBondContact O-N 3.5Å; G535-C538 PolarHBondContact O-N 3.11Å; G535-S539 WeakPolarHBondContact O-CB 3.4Å; G535-S539 PolarHBondContact O-N 3.03Å; G535-S539 PolarHBondContact O-OG 3.43Å
536	N	82.4	Confident	84.1	Confident	45 Å²	45	36.6 Å²	36.6	24%	0.241	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-42.4	175	-81.5	-62.3	0	0	0	112.3	N523 S524 R532 S539 A540	N523-N536 WeakPolarHBondContact CB-OD1 3.43Å; N523-N536 PolarHBondContact O-ND2 2.97Å; N523-N536 PolarHBondContact O-OD1 3.25Å; S524-N536 PolarHBondContact N-OD1 2.87Å; R532-N536 WeakPolarHBondContact CG-ND2 3.45Å; R532-N536 WeakPolarHBondContact O-CB 3.48Å; R532-N536 PolarHBondContact O-N 2.9Å; R532-N536 PolarHBondContact O-ND2 3.45Å; N536-S539 PolarHBondContact O-N 3.49Å; N536-A540 VanDerWaalsContact O-CB 3.25Å; N536-A540 WeakPolarHBondContact O-CB 3.42Å; N536-A540 PolarHBondContact O-N 3.16Å
537	A	82.6	Confident	84.4	Confident	56 Å²	56	36.7 Å²	36.7	46%	0.463	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-42.7	178.5	0	0	0	0	0	112.2	S533 T534 G535 A540 G541	S533-A537 WeakPolarHBondContact O-CB 3.25Å; S533-A537 PolarHBondContact O-N 3.13Å; T534-A537 PolarHBondContact O-N 2.81Å; G535-A537 VanDerWaalsContact C-N 3.33Å; G535-A537 PolarHBondContact O-N 3.5Å; A537-A540 PolarHBondContact O-N 3.15Å; A537-G541 PolarHBondContact O-N 3.01Å
538	C	86.8	Confident	84.9	Confident	42 Å²	42	38.1 Å²	38.1	28%	0.284	22%	0.217	S	C	.	.	H	α-helix	trans	-63.8	-47.5	176	-71.3	0	0	0	0	112.4	I304 L317 T534 G535 A540 G541 I542	I304-C538 WeakPolarHBondContact CD1-SG 3.14Å; L317-C538 HydrophobicContact CD1-CB 3.87Å; T534-C538 PolarHBondContact O-N 2.67Å; T534-C538 PolarHBondContact O-SG 2.93Å; T534-C538 VanDerWaalsContact O-SG 3.38Å; G535-C538 PolarHBondContact O-N 3.11Å; C538-A540 VanDerWaalsContact C-N 3.35Å; C538-A540 PolarHBondContact O-N 3.49Å; C538-G541 PolarHBondContact O-N 3.14Å; C538-I542 PolarHBondContact O-N 3.19Å
539	S	89.9	Confident	85.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-42.8	177.7	-64.6	0	0	0	0	111.6	G320 C321 Q324 N523 Y527 G535 N536 I542 N543	G320-S539 VanDerWaalsContact C-OG 3.23Å; C321-S539 PolarHBondContact N-OG 3.18Å; Q324-S539 WeakPolarHBondContact CB-O 3.49Å; Q324-S539 WeakPolarHBondContact CG-O 2.99Å; N523-S539 VanDerWaalsContact OD1-CB 3.26Å; N523-S539 WeakPolarHBondContact OD1-CB 3.46Å; N523-S539 PolarHBondContact OD1-OG 3.41Å; Y527-S539 PolarHBondContact OH-OG 3.39Å; G535-S539 WeakPolarHBondContact O-CB 3.4Å; G535-S539 PolarHBondContact O-N 3.03Å; G535-S539 PolarHBondContact O-OG 3.43Å; N536-S539 PolarHBondContact O-N 3.49Å; S539-I542 PolarHBondContact O-N 3.41Å; S539-N543 PolarHBondContact O-N 2.86Å
540	A	86.2	Confident	86.5	Confident	19 Å²	19	36 Å²	36	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-39.4	174.3	0	0	0	0	0	112.3	W520 N536 A537 C538 I542 N543 W544	W520-A540 HydrophobicContact CH2-CB 4.01Å; W520-A540 HydrophobicContact CZ3-CB 3.88Å; N536-A540 VanDerWaalsContact O-CB 3.25Å; N536-A540 WeakPolarHBondContact O-CB 3.42Å; N536-A540 PolarHBondContact O-N 3.16Å; A537-A540 PolarHBondContact O-N 3.15Å; C538-A540 VanDerWaalsContact C-N 3.35Å; C538-A540 PolarHBondContact O-N 3.49Å; A540-I542 VanDerWaalsContact C-N 3.31Å; A540-I542 PolarHBondContact O-N 3.49Å; A540-N543 VanDerWaalsContact O-CB 3.26Å; A540-N543 WeakPolarHBondContact O-CB 3.01Å; A540-N543 PolarHBondContact O-N 3.19Å; A540-N543 VanDerWaalsContact O-N 3.17Å; A540-W544 PolarHBondContact O-N 2.85Å
541	G	88.3	Confident	87.1	Confident	13 Å²	13	33.8 Å²	33.8	13%	0.134	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-43.6	174.3	0	0	0	0	0	112.1	A537 C538 W544 I545	A537-G541 PolarHBondContact O-N 3.01Å; C538-G541 PolarHBondContact O-N 3.14Å; G541-W544 PolarHBondContact O-N 3.46Å; G541-I545 VanDerWaalsContact O-CG1 3.26Å; G541-I545 WeakPolarHBondContact O-CG1 3.35Å; G541-I545 PolarHBondContact O-N 3.39Å
542	I	92.3	Very high	87.9	Confident	49 Å²	49	37.1 Å²	37.1	25%	0.251	21%	0.213	S	C	.	.	H	α-helix	trans	-64.6	-41.1	174.8	-72.6	172.5	0	0	0	111.4	C321 M325 C538 S539 A540 W544 I545 F546	C321-I542 HydrophobicContact CB-CD1 3.39Å; C321-I542 WeakPolarHBondContact SG-CD1 3.2Å; M325-I542 HydrophobicContact CB-CG2 3.93Å; C538-I542 PolarHBondContact O-N 3.19Å; S539-I542 PolarHBondContact O-N 3.41Å; A540-I542 VanDerWaalsContact C-N 3.31Å; A540-I542 PolarHBondContact O-N 3.49Å; I542-W544 VanDerWaalsContact C-N 3.33Å; I542-W544 PolarHBondContact O-N 3.39Å; I542-I545 PolarHBondContact O-N 3.4Å; I542-F546 HydrophobicContact CG2-CD2 3.74Å; I542-F546 HydrophobicContact CG2-CE2 3.97Å; I542-F546 WeakPolarHBondContact O-CD2 3.35Å; I542-F546 PolarHBondContact O-N 2.86Å
543	N	91.5	Very high	88.6	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.027	22%	0.218	C	C	.	.	H	α-helix	trans	-53.2	-52.4	173.3	-170.8	-89.2	0	0	0	111	Q324 Q327 Q328 W520 S539 A540 I545 F546 N547	Q324-N543 HydrophobicContact CB-CB 4Å; Q324-N543 HydrophobicContact CG-CB 4.36Å; Q324-N543 PolarHBondContact OE1-ND2 2.98Å; Q327-N543 PolarHBondContact OE1-ND2 3.08Å; Q328-N543 WeakPolarHBondContact CG-O 3.46Å; Q328-N543 VanDerWaalsContact NE2-CG 3.3Å; Q328-N543 PolarHBondContact NE2-ND2 3.44Å; Q328-N543 PolarHBondContact NE2-OD1 2.88Å; W520-N543 HydrophobicContact CZ2-CB 4.41Å; S539-N543 PolarHBondContact O-N 2.86Å; A540-N543 VanDerWaalsContact O-CB 3.26Å; A540-N543 WeakPolarHBondContact O-CB 3.01Å; A540-N543 PolarHBondContact O-N 3.19Å; A540-N543 VanDerWaalsContact O-N 3.17Å; N543-I545 PolarHBondContact O-N 2.97Å; N543-F546 PolarHBondContact O-N 2.97Å; N543-N547 VanDerWaalsContact O-CB 3.26Å; N543-N547 WeakPolarHBondContact O-CB 3.22Å; N543-N547 PolarHBondContact O-N 3.34Å
544	W	89.4	Confident	89.5	Confident	21 Å²	21	32.6 Å²	32.6	8%	0.08	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-39.1	-178.4	-71.9	115.4	0	0	0	113.4	F85 V118 A121 A122 A540 G541 I542 N547 V548	F85-W544 HydrophobicContact CE2-CH2 4.06Å; F85-W544 HydrophobicContact CZ-CH2 4.04Å; V118-W544 HydrophobicContact CG1-CE3 3.85Å; V118-W544 HydrophobicContact CG1-CZ3 4Å; A121-W544 HydrophobicContact CB-CH2 4.33Å; A121-W544 HydrophobicContact CB-CZ3 4.21Å; A122-W544 HydrophobicContact CB-CB 3.59Å; A122-W544 HydrophobicContact CB-CD2 4.35Å; A122-W544 HydrophobicContact CB-CG 3.98Å; A540-W544 PolarHBondContact O-N 2.85Å; G541-W544 PolarHBondContact O-N 3.46Å; I542-W544 VanDerWaalsContact C-N 3.33Å; I542-W544 PolarHBondContact O-N 3.39Å; W544-N547 WeakPolarHBondContact O-CB 3.45Å; W544-N547 PolarHBondContact O-N 2.84Å; W544-V548 WeakPolarHBondContact O-CG2 3.49Å; W544-V548 PolarHBondContact O-N 3.38Å
545	I	91.8	Very high	90	Very high	111 Å²	111	31.4 Å²	31.4	57%	0.569	18%	0.181	S	C	*	.	H	α-helix	trans	-60.6	-49.4	177	-71.3	164.7	0	0	0	110.8	G541 I542 N543 N547 V548 L549	G541-I545 VanDerWaalsContact O-CG1 3.26Å; G541-I545 WeakPolarHBondContact O-CG1 3.35Å; G541-I545 PolarHBondContact O-N 3.39Å; I542-I545 PolarHBondContact O-N 3.4Å; N543-I545 PolarHBondContact O-N 2.97Å; I545-N547 VanDerWaalsContact C-N 3.32Å; I545-N547 PolarHBondContact O-N 3.42Å; I545-V548 PolarHBondContact O-N 2.98Å; I545-L549 WeakPolarHBondContact O-CB 3.33Å; I545-L549 PolarHBondContact O-N 3.28Å
546	F	94.3	Very high	90.3	Very high	47 Å²	47	34.3 Å²	34.3	21%	0.206	19%	0.194	C	C	.	.	H	α-helix	trans	-70.7	-30.2	179.9	-82.7	-87	0	0	0	112.5	M325 Q328 L329 I542 N543 L549 I550	M325-F546 HydrophobicContact CB-CD2 4.23Å; M325-F546 HydrophobicContact CB-CE2 4.21Å; M325-F546 HydrophobicContact CG-CD1 4.02Å; M325-F546 HydrophobicContact CG-CD2 3.85Å; M325-F546 HydrophobicContact CG-CE1 3.77Å; M325-F546 HydrophobicContact CG-CE2 3.59Å; M325-F546 HydrophobicContact CG-CG 4.05Å; M325-F546 HydrophobicContact CG-CZ 3.54Å; M325-F546 HydrophobicContact SD-CE1 4.13Å; M325-F546 HydrophobicContact SD-CE2 3.89Å; M325-F546 HydrophobicContact SD-CZ 3.54Å; M325-F546 VanDerWaalsContact SD-CZ 3.54Å; Q328-F546 HydrophobicContact CB-CB 3.65Å; Q328-F546 HydrophobicContact CG-CB 4.15Å; L329-F546 HydrophobicContact CD1-CD1 4.43Å; L329-F546 HydrophobicContact CD1-CE1 4.25Å; L329-F546 HydrophobicContact CD2-CD1 3.62Å; L329-F546 HydrophobicContact CD2-CE1 3.93Å; L329-F546 HydrophobicContact CG-CD1 3.92Å; L329-F546 HydrophobicContact CG-CE1 4.22Å; I542-F546 HydrophobicContact CG2-CD2 3.74Å; I542-F546 HydrophobicContact CG2-CE2 3.97Å; I542-F546 WeakPolarHBondContact O-CD2 3.35Å; I542-F546 PolarHBondContact O-N 2.86Å; N543-F546 PolarHBondContact O-N 2.97Å; F546-L549 HydrophobicContact CD1-CD2 4.04Å; F546-L549 HydrophobicContact CE1-CD2 4.16Å; F546-L549 PolarHBondContact O-N 2.94Å; F546-I550 WeakPolarHBondContact O-CB 3.24Å; F546-I550 WeakPolarHBondContact O-CG1 3.49Å; F546-I550 PolarHBondContact O-N 3.33Å
547	N	92	Very high	90.8	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-49	171.3	-172.3	-6.8	0	0	0	111.3	V118 Q328 N333 N543 W544 I545 S551	V118-N547 HydrophobicContact CG1-CB 3.99Å; V118-N547 VanDerWaalsContact CG1-CG 3.41Å; V118-N547 WeakPolarHBondContact CG1-ND2 3.43Å; Q328-N547 HydrophobicContact CG-CB 4.34Å; N333-N547 PolarHBondContact ND2-ND2 3.33Å; N333-N547 PolarHBondContact ND2-OD1 3.03Å; N543-N547 VanDerWaalsContact O-CB 3.26Å; N543-N547 WeakPolarHBondContact O-CB 3.22Å; N543-N547 PolarHBondContact O-N 3.34Å; W544-N547 WeakPolarHBondContact O-CB 3.45Å; W544-N547 PolarHBondContact O-N 2.84Å; I545-N547 VanDerWaalsContact C-N 3.32Å; I545-N547 PolarHBondContact O-N 3.42Å; N547-S551 VanDerWaalsContact O-CB 3.23Å; N547-S551 WeakPolarHBondContact O-CB 3.49Å; N547-S551 PolarHBondContact O-N 3.44Å; N547-S551 PolarHBondContact O-OG 3.33Å; N547-S551 PolarHBondContact OD1-OG 3.34Å
548	V	92.6	Very high	91.1	Very high	32 Å²	32	30.9 Å²	30.9	19%	0.194	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-47.2	176	171.7	0	0	0	0	110.9	V118 W544 I545 I550 S551 L552	V118-V548 HydrophobicContact CB-CG2 4.23Å; V118-V548 HydrophobicContact CG1-CG2 3.74Å; W544-V548 WeakPolarHBondContact O-CG2 3.49Å; W544-V548 PolarHBondContact O-N 3.38Å; I545-V548 PolarHBondContact O-N 2.98Å; V548-I550 PolarHBondContact O-N 3.14Å; V548-S551 PolarHBondContact O-N 3.39Å; V548-L552 HydrophobicContact CG1-CD1 3.68Å; V548-L552 HydrophobicContact CG1-CG 4.33Å; V548-L552 VanDerWaalsContact O-CB 3.29Å; V548-L552 WeakPolarHBondContact O-CB 3.36Å; V548-L552 WeakPolarHBondContact O-CG 3.32Å; V548-L552 PolarHBondContact O-N 3.49Å
549	L	93.8	Very high	91.2	Very high	82 Å²	82	31.2 Å²	31.2	43%	0.429	17%	0.167	S	C	.	.	H	α-helix	trans	-56.5	-52.1	-179.5	178.6	65	0	0	0	112	I545 F546 L552 T553	I545-L549 WeakPolarHBondContact O-CB 3.33Å; I545-L549 PolarHBondContact O-N 3.28Å; F546-L549 HydrophobicContact CD1-CD2 4.04Å; F546-L549 HydrophobicContact CE1-CD2 4.16Å; F546-L549 PolarHBondContact O-N 2.94Å; L549-L552 PolarHBondContact O-N 3.09Å; L549-T553 HydrophobicContact CD1-CG2 4.44Å; L549-T553 WeakPolarHBondContact O-CB 3.12Å; L549-T553 VanDerWaalsContact O-CG2 3.31Å; L549-T553 WeakPolarHBondContact O-CG2 3.36Å; L549-T553 PolarHBondContact O-N 3.18Å; L549-T553 PolarHBondContact O-OG1 2.87Å
550	I	93.3	Very high	91.1	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-39.8	-178.3	-70.1	-68	0	0	0	111.2	L329 T334 F546 V548 L552 T553 F554 Y570	L329-I550 HydrophobicContact CD2-CD1 3.91Å; L329-I550 HydrophobicContact CD2-CG1 4.19Å; T334-I550 WeakPolarHBondContact OG1-CG2 3.16Å; F546-I550 WeakPolarHBondContact O-CB 3.24Å; F546-I550 WeakPolarHBondContact O-CG1 3.49Å; F546-I550 PolarHBondContact O-N 3.33Å; V548-I550 PolarHBondContact O-N 3.14Å; I550-L552 VanDerWaalsContact C-N 3.32Å; I550-L552 PolarHBondContact O-N 2.99Å; I550-T553 PolarHBondContact O-N 3.13Å; I550-T553 PolarHBondContact O-OG1 2.95Å; I550-F554 PolarHBondContact O-N 3.27Å; I550-Y570 HydrophobicContact CD1-CE1 3.94Å
551	S	89.5	Confident	91.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-31	178.6	-58.4	0	0	0	0	113.5	Y337 Y338 N547 V548	Y337-S551 WeakPolarHBondContact CE2-OG 3.18Å; Y338-S551 PolarHBondContact OH-O 3.18Å; N547-S551 VanDerWaalsContact O-CB 3.23Å; N547-S551 WeakPolarHBondContact O-CB 3.49Å; N547-S551 PolarHBondContact O-N 3.44Å; N547-S551 PolarHBondContact O-OG 3.33Å; N547-S551 PolarHBondContact OD1-OG 3.34Å; V548-S551 PolarHBondContact O-N 3.39Å
552	L	91.9	Very high	91.5	Very high	69 Å²	69	44.2 Å²	44.2	36%	0.361	22%	0.218	S	C	.	.	H	α-helix	trans	-77.9	-17.6	176.6	-88.5	172.9	0	0	0	114.3	S115 V548 L549 I550	S115-L552 WeakPolarHBondContact OG-CD2 3.31Å; S115-L552 VanDerWaalsContact OG-CG 3.32Å; S115-L552 WeakPolarHBondContact OG-CG 3.41Å; V548-L552 HydrophobicContact CG1-CD1 3.68Å; V548-L552 HydrophobicContact CG1-CG 4.33Å; V548-L552 VanDerWaalsContact O-CB 3.29Å; V548-L552 WeakPolarHBondContact O-CB 3.36Å; V548-L552 WeakPolarHBondContact O-CG 3.32Å; V548-L552 PolarHBondContact O-N 3.49Å; L549-L552 PolarHBondContact O-N 3.09Å; I550-L552 VanDerWaalsContact C-N 3.32Å; I550-L552 PolarHBondContact O-N 2.99Å
553	T	93.4	Very high	91.4	Very high	49 Å²	49	42.9 Å²	42.9	30%	0.301	21%	0.21	S	C	.	.	H	α-helix	trans	-117.5	-10.5	-167.6	51.7	0	0	0	0	113.2	L549 I550 T557	L549-T553 HydrophobicContact CD1-CG2 4.44Å; L549-T553 WeakPolarHBondContact O-CB 3.12Å; L549-T553 VanDerWaalsContact O-CG2 3.31Å; L549-T553 WeakPolarHBondContact O-CG2 3.36Å; L549-T553 PolarHBondContact O-N 3.18Å; L549-T553 PolarHBondContact O-OG1 2.87Å; I550-T553 PolarHBondContact O-N 3.13Å; I550-T553 PolarHBondContact O-OG1 2.95Å; T553-T557 WeakPolarHBondContact O-CB 3.41Å; T553-T557 PolarHBondContact O-N 2.02Å; T553-T557 PolarHBondContact O-OG1 3.44Å
554	F	93.1	Very high	91.5	Very high	1 Å²	1	46 Å²	46	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-51.3	-170.3	170.1	-116.5	0	0	0	114.3	E111 T334 Y338 I342 M345 I550 T557 A558 F567 Y570	E111-F554 PolarHBondContact OE1-N 3.26Å; T334-F554 HydrophobicContact CG2-CB 3.87Å; T334-F554 HydrophobicContact CG2-CD1 3.48Å; T334-F554 VanDerWaalsContact CG2-CD1 3.48Å; T334-F554 HydrophobicContact CG2-CD2 3.26Å; T334-F554 HydrophobicContact CG2-CE1 3.73Å; T334-F554 HydrophobicContact CG2-CE2 3.53Å; T334-F554 HydrophobicContact CG2-CG 3.21Å; T334-F554 HydrophobicContact CG2-CZ 3.75Å; Y338-F554 AromaticContact CD2-CD1 3.49Å; Y338-F554 HydrophobicContact CD2-CD1 3.49Å; Y338-F554 VanDerWaalsContact CD2-CD1 3.49Å; Y338-F554 HydrophobicContact CD2-CE1 4.01Å; Y338-F554 HydrophobicContact CD2-CG 4.36Å; Y338-F554 HydrophobicContact CE2-CB 4.33Å; Y338-F554 AromaticContact CE2-CD1 3.84Å; Y338-F554 HydrophobicContact CE2-CD1 3.84Å; Y338-F554 AromaticContact CG-CD1 3.87Å; Y338-F554 HydrophobicContact CG-CD1 3.87Å; Y338-F554 AromaticContact CG-CE1 3.99Å; Y338-F554 HydrophobicContact CG-CE1 3.99Å; I342-F554 HydrophobicContact CD1-CE1 4.37Å; I342-F554 HydrophobicContact CD1-CZ 4.08Å; I342-F554 HydrophobicContact CG1-CE1 4.11Å; I342-F554 HydrophobicContact CG1-CZ 3.86Å; M345-F554 HydrophobicContact CE-CE1 4.5Å; I550-F554 PolarHBondContact O-N 3.27Å; F554-T557 PolarHBondContact O-N 2.99Å; F554-A558 WeakPolarHBondContact O-CB 3.34Å; F554-A558 PolarHBondContact O-N 3.12Å; F554-F567 HydrophobicContact CE2-CZ 4.26Å; F554-F567 HydrophobicContact CZ-CZ 4.25Å; F554-Y570 HydrophobicContact CD2-CE2 4.06Å; F554-Y570 WeakPolarHBondContact CD2-OH 3.47Å; F554-Y570 HydrophobicContact CE2-CE2 4.31Å
555	L	90.1	Very high	91.7	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-43.3	-176	-64.5	179	0	0	0	110.4	Q110 E111 Y338 M345 T557 A558 E559	Q110-L555 HydrophobicContact CB-CD1 3.7Å; Q110-L555 HydrophobicContact CG-CD1 4.44Å; E111-L555 HydrophobicContact CG-CB 4.1Å; E111-L555 HydrophobicContact CG-CD1 4.13Å; E111-L555 HydrophobicContact CG-CG 4.14Å; E111-L555 WeakPolarHBondContact OE1-CA 3.28Å; E111-L555 WeakPolarHBondContact OE1-CB 3.36Å; E111-L555 PolarHBondContact OE1-N 3.16Å; Y338-L555 HydrophobicContact CD1-CD2 4.43Å; Y338-L555 HydrophobicContact CE1-CD1 4.03Å; Y338-L555 HydrophobicContact CE1-CD2 4.43Å; Y338-L555 HydrophobicContact CE1-CG 4.19Å; M345-L555 HydrophobicContact CE-CD2 3.49Å; M345-L555 VanDerWaalsContact CE-CD2 3.49Å; L555-T557 VanDerWaalsContact C-N 3.33Å; L555-T557 PolarHBondContact O-N 3.08Å; L555-A558 WeakPolarHBondContact O-CB 3.49Å; L555-A558 PolarHBondContact O-N 3.3Å; L555-E559 WeakPolarHBondContact O-CG 3.34Å; L555-E559 PolarHBondContact O-N 3.27Å
556	H	91.6	Very high	91.8	Very high	61 Å²	61	40.4 Å²	40.4	28%	0.282	20%	0.198	S	C	.	.	H	α-helix	trans	-62.3	-40.7	173.3	-72.3	94.5	0	0	0	111.8	E111 A558 E559 Y560	E111-H556 VanDerWaalsContact CD-ND1 3.3Å; E111-H556 PolarHBondContact OE1-N 2.91Å; E111-H556 IonicContact OE1-ND1 3.99Å; E111-H556 PolarHBondContact OE1-ND1 2.86Å; E111-H556 IonicContact OE2-CE1 3.36Å; E111-H556 PolarHBondContact OE2-CE1 2.88Å; E111-H556 IonicContact OE2-CG 2.81Å; E111-H556 IonicContact OE2-ND1 3.82Å; E111-H556 PolarHBondContact OE2-ND1 3.35Å; H556-A558 VanDerWaalsContact C-N 3.26Å; H556-A558 PolarHBondContact O-N 3.26Å; H556-E559 IonicContact CD2-OE2 2.78Å; H556-E559 PolarHBondContact O-N 3.49Å; H556-Y560 HydrophobicContact CB-CD2 4.34Å; H556-Y560 HydrophobicContact CB-CE2 4.43Å; H556-Y560 WeakPolarHBondContact O-CD2 3.35Å; H556-Y560 PolarHBondContact O-N 3.28Å
557	T	92.1	Very high	91.8	Very high	28 Å²	28	38.3 Å²	38.3	17%	0.172	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-40	176.5	-58.9	0	0	0	0	110.9	T553 F554 L555 L561 A566 L569	T553-T557 WeakPolarHBondContact O-CB 3.41Å; T553-T557 PolarHBondContact O-N 2.02Å; T553-T557 PolarHBondContact O-OG1 3.44Å; F554-T557 PolarHBondContact O-N 2.99Å; L555-T557 VanDerWaalsContact C-N 3.33Å; L555-T557 PolarHBondContact O-N 3.08Å; T557-L561 HydrophobicContact CG2-CD1 3.79Å; T557-L561 HydrophobicContact CG2-CG 4.43Å; T557-L561 VanDerWaalsContact O-CB 3.31Å; T557-L561 WeakPolarHBondContact O-CB 3.46Å; T557-L561 PolarHBondContact O-N 2.9Å; T557-A566 HydrophobicContact CG2-CB 4.05Å; T557-L569 HydrophobicContact CG2-CD2 3.97Å
558	A	89.3	Confident	92	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-38.3	175	0	0	0	0	0	113.2	F554 L555 H556 T562 Y563 A566	F554-A558 WeakPolarHBondContact O-CB 3.34Å; F554-A558 PolarHBondContact O-N 3.12Å; L555-A558 WeakPolarHBondContact O-CB 3.49Å; L555-A558 PolarHBondContact O-N 3.3Å; H556-A558 VanDerWaalsContact C-N 3.26Å; H556-A558 PolarHBondContact O-N 3.26Å; A558-T562 CarbonylContact O-C 3.51Å; A558-T562 WeakPolarHBondContact O-CA 2.99Å; A558-T562 PolarHBondContact O-N 2.89Å; A558-T562 VanDerWaalsContact O-N 3.07Å; A558-Y563 HydrophobicContact CB-CD1 3.83Å; A558-Y563 HydrophobicContact CB-CE1 4.15Å; A558-A566 HydrophobicContact CB-CB 4.37Å
559	E	88.1	Confident	92.2	Very high	49 Å²	49	42.9 Å²	42.9	23%	0.229	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-46	175.2	-71.2	166.5	-176.2	0	0	111.6	S107 L555 H556	S107-E559 WeakPolarHBondContact CB-OE1 3.44Å; S107-E559 PolarHBondContact OG-OE1 2.8Å; L555-E559 WeakPolarHBondContact O-CG 3.34Å; L555-E559 PolarHBondContact O-N 3.27Å; H556-E559 IonicContact CD2-OE2 2.78Å; H556-E559 PolarHBondContact O-N 3.49Å
560	Y	89.3	Confident	92.3	Very high	193 Å²	193	39.1 Å²	39.1	76%	0.757	19%	0.189	S	C	*	.	H	α-helix	trans	-77.8	-41.5	-176.6	-77.9	-70.9	0	0	0	114.4	H556	H556-Y560 HydrophobicContact CB-CD2 4.34Å; H556-Y560 HydrophobicContact CB-CE2 4.43Å; H556-Y560 WeakPolarHBondContact O-CD2 3.35Å; H556-Y560 PolarHBondContact O-N 3.28Å
561	L	90.8	Very high	92.4	Very high	91 Å²	91	39.3 Å²	39.3	48%	0.476	19%	0.191	S	C	.	.	H	α-helix	trans	-97.2	-1.8	-177	-65.7	178.7	0	0	0	113.3	T557 G565 L569	T557-L561 HydrophobicContact CG2-CD1 3.79Å; T557-L561 HydrophobicContact CG2-CG 4.43Å; T557-L561 VanDerWaalsContact O-CB 3.31Å; T557-L561 WeakPolarHBondContact O-CB 3.46Å; T557-L561 PolarHBondContact O-N 2.9Å; L561-G565 WeakPolarHBondContact O-CA 3.27Å; L561-L569 HydrophobicContact CD1-CD2 4.18Å
562	T	91.4	Very high	92.8	Very high	22 Å²	22	42.4 Å²	42.4	14%	0.135	21%	0.212	C	C	.	.			trans	69.6	161.7	-163.4	78.3	0	0	0	0	113.8	L438 A558 Y564 G565 A566	L438-T562 HydrophobicContact CD1-CG2 3.8Å; A558-T562 CarbonylContact O-C 3.51Å; A558-T562 WeakPolarHBondContact O-CA 2.99Å; A558-T562 PolarHBondContact O-N 2.89Å; A558-T562 VanDerWaalsContact O-N 3.07Å; T562-Y564 HydrophobicContact CG2-CE1 4.1Å; T562-Y564 PolarHBondContact O-N 3.49Å; T562-Y564 WeakPolarHBondContact OG1-CD1 3.47Å; T562-Y564 WeakPolarHBondContact OG1-CD2 3.25Å; T562-Y564 WeakPolarHBondContact OG1-CE1 3.26Å; T562-Y564 VanDerWaalsContact OG1-CE2 3.24Å; T562-Y564 WeakPolarHBondContact OG1-CE2 3.4Å; T562-G565 PolarHBondContact O-N 3.44Å; T562-G565 PolarHBondContact OG1-N 3.44Å; T562-A566 PolarHBondContact O-N 3.31Å
563	Y	90.6	Very high	93	Very high	20 Å²	20	41.6 Å²	41.6	8%	0.078	21%	0.206	C	C	.	.	H	α-helix	trans	-56.4	-47.6	178.4	-56	-41.4	0	0	0	113	M345 F403 I437 L438 A558 A566 F567	M345-Y563 HydrophobicContact CB-CD2 4.33Å; M345-Y563 HydrophobicContact CB-CE1 4.41Å; M345-Y563 HydrophobicContact CB-CE2 4.18Å; M345-Y563 HydrophobicContact CE-CE1 4.21Å; M345-Y563 HydrophobicContact CG-CD1 4.37Å; M345-Y563 HydrophobicContact CG-CE1 3.92Å; M345-Y563 HydrophobicContact CG-CE2 4.37Å; M345-Y563 HydrophobicContact SD-CD1 3.78Å; M345-Y563 HydrophobicContact SD-CE1 3.63Å; F403-Y563 HydrophobicContact CD1-CG 4.46Å; I437-Y563 HydrophobicContact CD1-CE2 3.93Å; L438-Y563 HydrophobicContact CD2-CE1 4.16Å; L438-Y563 HydrophobicContact CD2-CE2 4.36Å; A558-Y563 HydrophobicContact CB-CD1 3.83Å; A558-Y563 HydrophobicContact CB-CE1 4.15Å; Y563-A566 PolarHBondContact O-N 2.96Å; Y563-F567 VanDerWaalsContact O-CD2 3.22Å; Y563-F567 WeakPolarHBondContact O-CD2 3.04Å; Y563-F567 PolarHBondContact O-N 2.69Å
564	Y	92.6	Very high	93.1	Very high	70 Å²	70	39.3 Å²	39.3	28%	0.275	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-36.4	178.3	58.4	-96	0	0	0	111.8	S400 L404 A407 T562 F567 F568	S400-Y564 WeakPolarHBondContact O-CB 3.36Å; L404-Y564 HydrophobicContact CB-CG 4.29Å; L404-Y564 HydrophobicContact CD1-CD1 4.28Å; L404-Y564 HydrophobicContact CD1-CD2 4.14Å; L404-Y564 HydrophobicContact CD1-CE1 4.34Å; L404-Y564 HydrophobicContact CD1-CE2 4.22Å; L404-Y564 HydrophobicContact CD1-CG 4.19Å; A407-Y564 HydrophobicContact CB-CD1 4.04Å; A407-Y564 HydrophobicContact CB-CE1 3.93Å; T562-Y564 HydrophobicContact CG2-CE1 4.1Å; T562-Y564 PolarHBondContact O-N 3.49Å; T562-Y564 WeakPolarHBondContact OG1-CD1 3.47Å; T562-Y564 WeakPolarHBondContact OG1-CD2 3.25Å; T562-Y564 WeakPolarHBondContact OG1-CE1 3.26Å; T562-Y564 VanDerWaalsContact OG1-CE2 3.24Å; T562-Y564 WeakPolarHBondContact OG1-CE2 3.4Å; Y564-F567 PolarHBondContact O-N 3.24Å; Y564-F568 HydrophobicContact CD2-CD2 4.38Å; Y564-F568 WeakPolarHBondContact O-CD2 3.42Å; Y564-F568 PolarHBondContact O-N 3.31Å
565	G	94.1	Very high	93.3	Very high	16 Å²	16	41.2 Å²	41.2	17%	0.165	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-39.6	177.7	0	0	0	0	0	112.8	L561 T562 F568 L569	L561-G565 WeakPolarHBondContact O-CA 3.27Å; T562-G565 PolarHBondContact O-N 3.44Å; T562-G565 PolarHBondContact OG1-N 3.44Å; G565-F568 PolarHBondContact O-N 3.48Å; G565-L569 PolarHBondContact O-N 2.99Å
566	A	94	Very high	93.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-43.9	174.7	0	0	0	0	0	112.4	T557 A558 T562 Y563 L569 Y570	T557-A566 HydrophobicContact CG2-CB 4.05Å; A558-A566 HydrophobicContact CB-CB 4.37Å; T562-A566 PolarHBondContact O-N 3.31Å; Y563-A566 PolarHBondContact O-N 2.96Å; A566-L569 WeakPolarHBondContact O-CB 3.48Å; A566-L569 PolarHBondContact O-N 3.3Å; A566-Y570 PolarHBondContact O-N 3.46Å; A566-Y570 VanDerWaalsContact O-N 3.17Å
567	F	94.8	Very high	93.8	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-73.5	-29.4	177.2	-71.4	-70.4	0	0	0	113.3	I342 L396 L399 S400 F403 F554 Y563 Y564 L569 Y570 T571	I342-F567 HydrophobicContact CD1-CZ 4.02Å; I342-F567 HydrophobicContact CG1-CZ 4.19Å; I342-F567 HydrophobicContact CG2-CE2 4.24Å; I342-F567 HydrophobicContact CG2-CZ 3.86Å; L396-F567 HydrophobicContact CD2-CD1 4.35Å; L399-F567 HydrophobicContact CD2-CD1 3.59Å; L399-F567 HydrophobicContact CD2-CD2 4.48Å; L399-F567 HydrophobicContact CD2-CE1 3.54Å; L399-F567 HydrophobicContact CD2-CE2 4.46Å; L399-F567 HydrophobicContact CD2-CG 4.09Å; L399-F567 HydrophobicContact CD2-CZ 4.01Å; L399-F567 HydrophobicContact CG-CD1 4.24Å; L399-F567 HydrophobicContact CG-CD2 4.41Å; L399-F567 HydrophobicContact CG-CE1 4.44Å; L399-F567 HydrophobicContact CG-CG 4.23Å; S400-F567 WeakPolarHBondContact OG-CB 3.46Å; S400-F567 PolarHBondContact OG-O 3.03Å; F403-F567 AromaticContact CD2-CD2 3.64Å; F403-F567 HydrophobicContact CD2-CD2 3.64Å; F403-F567 AromaticContact CD2-CE2 3.83Å; F403-F567 HydrophobicContact CD2-CE2 3.83Å; F403-F567 AromaticContact CE2-CD2 3.67Å; F403-F567 HydrophobicContact CE2-CD2 3.67Å; F403-F567 AromaticContact CE2-CE2 3.34Å; F403-F567 HydrophobicContact CE2-CE2 3.34Å; F403-F567 HydrophobicContact CE2-CZ 4.2Å; F403-F567 HydrophobicContact CZ-CE2 4Å; F554-F567 HydrophobicContact CE2-CZ 4.26Å; F554-F567 HydrophobicContact CZ-CZ 4.25Å; Y563-F567 VanDerWaalsContact O-CD2 3.22Å; Y563-F567 WeakPolarHBondContact O-CD2 3.04Å; Y563-F567 PolarHBondContact O-N 2.69Å; Y564-F567 PolarHBondContact O-N 3.24Å; F567-L569 VanDerWaalsContact C-N 3.32Å; F567-Y570 HydrophobicContact CD1-CD2 4.17Å; F567-Y570 HydrophobicContact CE1-CD2 4.48Å; F567-Y570 PolarHBondContact O-N 3.05Å; F567-T571 WeakPolarHBondContact O-CB 3.05Å; F567-T571 PolarHBondContact O-N 3.06Å; F567-T571 PolarHBondContact O-OG1 3.21Å
568	F	96.4	Very high	93.9	Very high	74 Å²	74	43.7 Å²	43.7	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-65.5	-34.3	168.9	-84.5	-59.5	0	0	0	112.3	S400 L401 Y564 G565 T571 S572	S400-F568 PolarHBondContact OG-N 2.93Å; L401-F568 HydrophobicContact CD2-CZ 4.18Å; Y564-F568 HydrophobicContact CD2-CD2 4.38Å; Y564-F568 WeakPolarHBondContact O-CD2 3.42Å; Y564-F568 PolarHBondContact O-N 3.31Å; G565-F568 PolarHBondContact O-N 3.48Å; F568-T571 WeakPolarHBondContact O-CB 3.45Å; F568-T571 PolarHBondContact O-N 2.95Å; F568-S572 PolarHBondContact O-N 3.23Å; F568-S572 PolarHBondContact O-OG 3.3Å
569	L	96.1	Very high	94.2	Very high	57 Å²	57	48.6 Å²	48.6	30%	0.298	25%	0.25	S	C	.	.	H	α-helix	trans	-62.7	-48	172.5	179.5	66.8	0	0	0	111	T557 L561 G565 A566 F567 T571 S572 F573	T557-L569 HydrophobicContact CG2-CD2 3.97Å; L561-L569 HydrophobicContact CD1-CD2 4.18Å; G565-L569 PolarHBondContact O-N 2.99Å; A566-L569 WeakPolarHBondContact O-CB 3.48Å; A566-L569 PolarHBondContact O-N 3.3Å; F567-L569 VanDerWaalsContact C-N 3.32Å; L569-T571 VanDerWaalsContact C-N 3.32Å; L569-T571 PolarHBondContact O-N 2.83Å; L569-S572 WeakPolarHBondContact O-CB 3.36Å; L569-S572 PolarHBondContact O-N 3.19Å; L569-S572 VanDerWaalsContact O-N 3.09Å; L569-F573 HydrophobicContact CD1-CE1 4.28Å; L569-F573 HydrophobicContact CD1-CE2 4.03Å; L569-F573 HydrophobicContact CD1-CZ 3.74Å; L569-F573 HydrophobicContact CD2-CE2 4.19Å; L569-F573 HydrophobicContact CD2-CZ 4.46Å; L569-F573 HydrophobicContact CG-CD2 4.41Å; L569-F573 HydrophobicContact CG-CE2 3.76Å; L569-F573 HydrophobicContact CG-CZ 4Å; L569-F573 PolarHBondContact O-N 3.17Å
570	Y	95.3	Very high	94.5	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-36.4	175.6	-66.1	-16.6	0	0	0	113	T334 I550 F554 A566 F567 S572 F573 A574	T334-Y570 HydrophobicContact CG2-CE2 4.11Å; T334-Y570 PolarHBondContact OG1-OH 2.02Å; I550-Y570 HydrophobicContact CD1-CE1 3.94Å; F554-Y570 HydrophobicContact CD2-CE2 4.06Å; F554-Y570 WeakPolarHBondContact CD2-OH 3.47Å; F554-Y570 HydrophobicContact CE2-CE2 4.31Å; A566-Y570 PolarHBondContact O-N 3.46Å; A566-Y570 VanDerWaalsContact O-N 3.17Å; F567-Y570 HydrophobicContact CD1-CD2 4.17Å; F567-Y570 HydrophobicContact CE1-CD2 4.48Å; F567-Y570 PolarHBondContact O-N 3.05Å; Y570-S572 VanDerWaalsContact C-N 3.27Å; Y570-S572 PolarHBondContact O-N 3.43Å; Y570-F573 HydrophobicContact CD1-CD2 4.21Å; Y570-F573 PolarHBondContact O-N 2.83Å; Y570-A574 WeakPolarHBondContact O-CB 3.48Å; Y570-A574 PolarHBondContact O-N 2.83Å
571	T	96.7	Very high	94.7	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.08	21%	0.21	C	C	.	.	H	α-helix	trans	-58.1	-43.1	171.7	-58.2	0	0	0	0	110.7	T393 L396 I397 F567 F568 L569 A574 A575	T393-T571 HydrophobicContact CG2-CG2 4.13Å; L396-T571 WeakPolarHBondContact CB-OG1 3.27Å; I397-T571 HydrophobicContact CD1-CG2 4.17Å; I397-T571 HydrophobicContact CG1-CG2 3.47Å; I397-T571 VanDerWaalsContact CG1-CG2 3.47Å; F567-T571 WeakPolarHBondContact O-CB 3.05Å; F567-T571 PolarHBondContact O-N 3.06Å; F567-T571 PolarHBondContact O-OG1 3.21Å; F568-T571 WeakPolarHBondContact O-CB 3.45Å; F568-T571 PolarHBondContact O-N 2.95Å; L569-T571 VanDerWaalsContact C-N 3.32Å; L569-T571 PolarHBondContact O-N 2.83Å; T571-A574 PolarHBondContact O-N 2.04Å; T571-A575 WeakPolarHBondContact O-CB 3.17Å; T571-A575 PolarHBondContact O-N 3.3Å
572	S	96.9	Very high	94.7	Very high	65 Å²	65	40.5 Å²	40.5	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-42.9	179.3	-54.3	0	0	0	0	111.4	F568 L569 Y570 A575 M576	F568-S572 PolarHBondContact O-N 3.23Å; F568-S572 PolarHBondContact O-OG 3.3Å; L569-S572 WeakPolarHBondContact O-CB 3.36Å; L569-S572 PolarHBondContact O-N 3.19Å; L569-S572 VanDerWaalsContact O-N 3.09Å; Y570-S572 VanDerWaalsContact C-N 3.27Å; Y570-S572 PolarHBondContact O-N 3.43Å; S572-A575 PolarHBondContact O-N 2.96Å; S572-M576 WeakPolarHBondContact O-CG 3.3Å; S572-M576 PolarHBondContact O-N 2.86Å
573	F	96.3	Very high	94.5	Very high	52 Å²	52	40.3 Å²	40.3	23%	0.228	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-39.9	174.3	-64.1	-34.7	0	0	0	113.1	L329 L569 Y570 M576 G577	L329-F573 HydrophobicContact CB-CB 3.9Å; L329-F573 HydrophobicContact CB-CD2 4.14Å; L329-F573 HydrophobicContact CB-CG 4.19Å; L329-F573 HydrophobicContact CD1-CG 4.46Å; L329-F573 HydrophobicContact CD2-CD2 4.13Å; L329-F573 HydrophobicContact CD2-CE2 4.25Å; L569-F573 HydrophobicContact CD1-CE1 4.28Å; L569-F573 HydrophobicContact CD1-CE2 4.03Å; L569-F573 HydrophobicContact CD1-CZ 3.74Å; L569-F573 HydrophobicContact CD2-CE2 4.19Å; L569-F573 HydrophobicContact CD2-CZ 4.46Å; L569-F573 HydrophobicContact CG-CD2 4.41Å; L569-F573 HydrophobicContact CG-CE2 3.76Å; L569-F573 HydrophobicContact CG-CZ 4Å; L569-F573 PolarHBondContact O-N 3.17Å; Y570-F573 HydrophobicContact CD1-CD2 4.21Å; Y570-F573 PolarHBondContact O-N 2.83Å; F573-M576 HydrophobicContact CD1-SD 4.35Å; F573-M576 PolarHBondContact O-N 2.91Å; F573-G577 PolarHBondContact O-N 3.5Å
574	A	96.1	Very high	94.4	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-41.6	175.6	0	0	0	0	0	111.5	L389 L396 Y570 T571 G577 L578	L389-A574 HydrophobicContact CD1-CB 4.19Å; L396-A574 HydrophobicContact CD1-CB 3.94Å; Y570-A574 WeakPolarHBondContact O-CB 3.48Å; Y570-A574 PolarHBondContact O-N 2.83Å; T571-A574 PolarHBondContact O-N 2.04Å; A574-G577 CarbonylContact O-C 3.53Å; A574-G577 PolarHBondContact O-N 3.36Å; A574-L578 PolarHBondContact O-N 3.45Å
575	A	96.6	Very high	94.3	Very high	41 Å²	41	36.8 Å²	36.8	34%	0.339	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-41.5	175.2	0	0	0	0	0	112.4	T393 T571 S572 G577 L578 V579	T393-A575 HydrophobicContact CG2-CB 4.22Å; T571-A575 WeakPolarHBondContact O-CB 3.17Å; T571-A575 PolarHBondContact O-N 3.3Å; S572-A575 PolarHBondContact O-N 2.96Å; A575-G577 VanDerWaalsContact C-N 3.32Å; A575-G577 PolarHBondContact O-N 3.27Å; A575-L578 WeakPolarHBondContact O-CB 3.4Å; A575-L578 PolarHBondContact O-N 3.49Å; A575-L578 VanDerWaalsContact O-N 3.17Å; A575-V579 PolarHBondContact O-N 3.26Å; A575-V579 VanDerWaalsContact O-N 3.12Å
576	M	96.4	Very high	94	Very high	109 Å²	109	37.1 Å²	37.1	54%	0.537	20%	0.201	S	C	.	.	H	α-helix	trans	-60.5	-43	171.3	-74.2	173.4	52.6	0	0	111.7	F326 S572 F573 L578 V579 F580	F326-M576 HydrophobicContact CE1-CB 3.92Å; F326-M576 HydrophobicContact CZ-CB 4.31Å; S572-M576 WeakPolarHBondContact O-CG 3.3Å; S572-M576 PolarHBondContact O-N 2.86Å; F573-M576 HydrophobicContact CD1-SD 4.35Å; F573-M576 PolarHBondContact O-N 2.91Å; M576-L578 VanDerWaalsContact C-N 3.26Å; M576-L578 PolarHBondContact O-N 3.33Å; M576-V579 PolarHBondContact O-N 3.45Å; M576-F580 PolarHBondContact O-N 3.31Å
577	G	95.4	Very high	93.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-36.6	174.2	0	0	0	0	0	112.2	F326 L389 F573 A574 A575 F580 V581	F326-G577 VanDerWaalsContact CG-CA 3.49Å; L389-G577 WeakPolarHBondContact CD2-O 3.42Å; F573-G577 PolarHBondContact O-N 3.5Å; A574-G577 CarbonylContact O-C 3.53Å; A574-G577 PolarHBondContact O-N 3.36Å; A575-G577 VanDerWaalsContact C-N 3.32Å; A575-G577 PolarHBondContact O-N 3.27Å; G577-F580 WeakPolarHBondContact O-CB 3.48Å; G577-F580 PolarHBondContact O-N 2.96Å; G577-V581 WeakPolarHBondContact O-CB 3.27Å; G577-V581 VanDerWaalsContact O-CG2 3.31Å; G577-V581 WeakPolarHBondContact O-CG2 3.45Å; G577-V581 PolarHBondContact O-N 3.46Å
578	L	95.3	Very high	93	Very high	38 Å²	38	39.7 Å²	39.7	20%	0.199	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-43.9	177.5	-170.5	67.1	0	0	0	111.5	F386 L389 A390 A574 A575 M576 F580 V581 Y582	F386-L578 HydrophobicContact CD2-CD1 3.56Å; F386-L578 HydrophobicContact CD2-CG 4.35Å; F386-L578 HydrophobicContact CE2-CD1 3.4Å; F386-L578 VanDerWaalsContact CE2-CD1 3.4Å; F386-L578 HydrophobicContact CE2-CG 3.78Å; F386-L578 HydrophobicContact CG-CD1 4.24Å; F386-L578 HydrophobicContact CZ-CD1 3.99Å; F386-L578 HydrophobicContact CZ-CG 4.36Å; L389-L578 HydrophobicContact CB-CD1 4.17Å; L389-L578 HydrophobicContact CD2-CB 4.4Å; L389-L578 HydrophobicContact CG-CB 4.38Å; L389-L578 HydrophobicContact CG-CD1 4.33Å; A390-L578 HydrophobicContact CB-CD1 3.85Å; A390-L578 HydrophobicContact CB-CD2 4.24Å; A574-L578 PolarHBondContact O-N 3.45Å; A575-L578 WeakPolarHBondContact O-CB 3.4Å; A575-L578 PolarHBondContact O-N 3.49Å; A575-L578 VanDerWaalsContact O-N 3.17Å; M576-L578 VanDerWaalsContact C-N 3.26Å; M576-L578 PolarHBondContact O-N 3.33Å; L578-F580 VanDerWaalsContact C-N 3.33Å; L578-V581 PolarHBondContact O-N 2.92Å; L578-Y582 WeakPolarHBondContact O-CB 3.37Å; L578-Y582 PolarHBondContact O-N 2.93Å
579	V	94.8	Very high	92.1	Very high	105 Å²	105	40.1 Å²	40.1	64%	0.636	22%	0.215	S	C	*	.	H	α-helix	trans	-62.6	-42.5	173.9	176.6	0	0	0	0	110.8	A575 M576 Y582 G583	A575-V579 PolarHBondContact O-N 3.26Å; A575-V579 VanDerWaalsContact O-N 3.12Å; M576-V579 PolarHBondContact O-N 3.45Å; V579-Y582 PolarHBondContact O-N 2.99Å; V579-G583 PolarHBondContact O-N 3.49Å
580	F	94.8	Very high	90.7	Very high	34 Å²	34	41.2 Å²	41.2	15%	0.149	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-48.3	176.8	175.6	-96.9	0	0	0	112.5	V318 F326 M576 G577 L578 Y582 G583 C584	V318-F580 HydrophobicContact CG1-CE2 4.48Å; F326-F580 HydrophobicContact CD2-CB 4.15Å; F326-F580 AromaticContact CD2-CD1 3.76Å; F326-F580 HydrophobicContact CD2-CD1 3.76Å; F326-F580 HydrophobicContact CD2-CE1 4.36Å; F326-F580 HydrophobicContact CD2-CG 4Å; F326-F580 HydrophobicContact CE2-CB 3.59Å; F326-F580 AromaticContact CE2-CD1 3.81Å; F326-F580 HydrophobicContact CE2-CD1 3.81Å; F326-F580 HydrophobicContact CE2-CD2 4.08Å; F326-F580 HydrophobicContact CE2-CE1 4.5Å; F326-F580 AromaticContact CE2-CG 3.55Å; F326-F580 HydrophobicContact CE2-CG 3.55Å; F326-F580 HydrophobicContact CZ-CB 4.24Å; M576-F580 PolarHBondContact O-N 3.31Å; G577-F580 WeakPolarHBondContact O-CB 3.48Å; G577-F580 PolarHBondContact O-N 2.96Å; L578-F580 VanDerWaalsContact C-N 3.33Å; F580-Y582 VanDerWaalsContact C-N 3.33Å; F580-Y582 PolarHBondContact O-N 3.25Å; F580-G583 PolarHBondContact O-N 3.45Å; F580-C584 HydrophobicContact CD2-CB 4.3Å; F580-C584 HydrophobicContact CE2-CB 4.18Å; F580-C584 WeakPolarHBondContact O-CB 3.45Å; F580-C584 PolarHBondContact O-N 2.71Å
581	V	92.8	Very high	89.8	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-40.5	178	170.2	0	0	0	0	110.6	L323 T385 F386 L389 G577 L578 L585	L323-V581 HydrophobicContact CD2-CG2 3.95Å; T385-V581 HydrophobicContact CG2-CG1 4.24Å; T385-V581 HydrophobicContact CG2-CG2 4.3Å; F386-V581 HydrophobicContact CB-CG1 3.98Å; F386-V581 HydrophobicContact CD2-CG1 4.27Å; L389-V581 HydrophobicContact CD2-CG2 3.97Å; G577-V581 WeakPolarHBondContact O-CB 3.27Å; G577-V581 VanDerWaalsContact O-CG2 3.31Å; G577-V581 WeakPolarHBondContact O-CG2 3.45Å; G577-V581 PolarHBondContact O-N 3.46Å; L578-V581 PolarHBondContact O-N 2.92Å; V581-L585 HydrophobicContact CG1-CB 4.21Å; V581-L585 HydrophobicContact CG1-CD2 3.81Å; V581-L585 VanDerWaalsContact O-CB 3.29Å; V581-L585 WeakPolarHBondContact O-CB 3.32Å; V581-L585 PolarHBondContact O-N 3.31Å
582	Y	91.4	Very high	88.7	Confident	128 Å²	128	52.2 Å²	52.2	50%	0.502	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-49.2	177.3	179.6	-104.9	0	0	0	112.4	R382 F386 L578 V579 F580	R382-Y582 PolarHBondContact NH2-O 3.34Å; F386-Y582 HydrophobicContact CE2-CD2 4.06Å; F386-Y582 HydrophobicContact CE2-CG 4.4Å; F386-Y582 HydrophobicContact CZ-CD2 4.42Å; L578-Y582 WeakPolarHBondContact O-CB 3.37Å; L578-Y582 PolarHBondContact O-N 2.93Å; V579-Y582 PolarHBondContact O-N 2.99Å; F580-Y582 VanDerWaalsContact C-N 3.33Å; F580-Y582 PolarHBondContact O-N 3.25Å
583	G	88.1	Confident	87.2	Confident	18 Å²	18	52.3 Å²	52.3	19%	0.186	28%	0.282	C	S	.	.	H	α-helix	trans	-81.7	-36.3	-174.3	0	0	0	0	0	114.7	V579 F580 C605	V579-G583 PolarHBondContact O-N 3.49Å; F580-G583 PolarHBondContact O-N 3.45Å; G583-C605 WeakPolarHBondContact O-CA 3.5Å; G583-C605 PolarHBondContact O-N 2.79Å
584	C	88.3	Confident	85.8	Confident	12 Å²	12	56.3 Å²	56.3	8%	0.081	30%	0.301	C	S	.	.	H	α-helix	trans	-118.4	-11.3	-161.5	-39.9	0	0	0	0	113.8	V319 F580 P586 C605	V319-C584 HydrophobicContact CG2-CB 4.44Å; V319-C584 WeakPolarHBondContact CG2-O 3.39Å; F580-C584 HydrophobicContact CD2-CB 4.3Å; F580-C584 HydrophobicContact CE2-CB 4.18Å; F580-C584 WeakPolarHBondContact O-CB 3.45Å; F580-C584 PolarHBondContact O-N 2.71Å; C584-P586 VanDerWaalsContact O-CD 3.26Å; C584-P586 WeakPolarHBondContact O-CD 3.49Å; C584-C605 WeakPolarHBondContact CB-SG 3.41Å; C584-C605 WeakPolarHBondContact SG-CB 3.45Å; C584-C605 CovalentContact SG-SG 2.08Å; C584-C605 PolarHBondContact SG-SG 2.69Å
585	L	89.7	Confident	84.6	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	32%	0.319	C	S	.	.			trans	-90.4	111.2	175.3	-177.9	62.5	0	0	0	111.5	V319 L323 R382 T385 V522 V581	V319-L585 HydrophobicContact CG1-CD1 3.96Å; L323-L585 HydrophobicContact CD1-CD1 3.95Å; L323-L585 HydrophobicContact CD2-CD2 4.35Å; R382-L585 HydrophobicContact CB-CD2 4.37Å; R382-L585 HydrophobicContact CB-CG 4.45Å; R382-L585 WeakPolarHBondContact CD-O 3.28Å; R382-L585 HydrophobicContact CG-CD2 4.32Å; R382-L585 HydrophobicContact CG-CG 4.28Å; R382-L585 WeakPolarHBondContact CG-O 3.46Å; R382-L585 PolarHBondContact NE-O 2.89Å; T385-L585 HydrophobicContact CG2-CD2 4.13Å; V522-L585 HydrophobicContact CG1-CD1 3.92Å; V581-L585 HydrophobicContact CG1-CB 4.21Å; V581-L585 HydrophobicContact CG1-CD2 3.81Å; V581-L585 VanDerWaalsContact O-CB 3.29Å; V581-L585 WeakPolarHBondContact O-CB 3.32Å; V581-L585 PolarHBondContact O-N 3.31Å
586	P	87.3	Confident	83.5	Confident	23 Å²	23	58.5 Å²	58.5	15%	0.149	30%	0.304	C	S	.	.			trans	-75.9	162.7	171.2	31.9	-35.3	0	0	0	112.1	C584 L599 F600	C584-P586 VanDerWaalsContact O-CD 3.26Å; C584-P586 WeakPolarHBondContact O-CD 3.49Å; P586-L599 HydrophobicContact CB-CB 4.45Å; P586-L599 HydrophobicContact CB-CD1 4.29Å; P586-F600 HydrophobicContact CG-CE1 4.09Å; P586-F600 HydrophobicContact CG-CZ 3.82Å
587	E	85.6	Confident	82.3	Confident	51 Å²	51	56 Å²	56	24%	0.238	29%	0.292	C	S	.	.			trans	-80.5	121.8	171.6	-176.5	63.4	-100.6	0	0	110.1	R381 R382 K589	R381-E587 PolarHBondContact N-OE1 3.46Å; R382-E587 HydrophobicContact CB-CB 4.21Å; R382-E587 WeakPolarHBondContact CB-OE2 3.23Å; R382-E587 PolarHBondContact N-OE1 3.33Å; R382-E587 PolarHBondContact N-OE2 3.02Å; E587-K589 HydrophobicContact CG-CB 4.12Å; E587-K589 WeakPolarHBondContact OE1-CB 3.4Å; E587-K589 PolarHBondContact OE1-N 3.44Å
588	T	82.5	Confident	81.4	Confident	5 Å²	5	59 Å²	59	3%	0.031	31%	0.312	C	S	.	.			trans	-97.4	-10.8	-179.7	61.2	0	0	0	0	112.9	E525 I526 G590 K591	E525-T588 VanDerWaalsContact OE2-CB 3.31Å; E525-T588 WeakPolarHBondContact OE2-CB 3.31Å; E525-T588 PolarHBondContact OE2-OG1 2.97Å; I526-T588 HydrophobicContact CG2-CG2 3.98Å; T588-G590 PolarHBondContact O-N 3.38Å; T588-K591 PolarHBondContact O-N 3.05Å
589	K	77.2	Confident	80.6	Confident	83 Å²	83	60.1 Å²	60.1	36%	0.361	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	121.2	-175.7	-173.4	-171.3	-170.7	175.5	0	111.9	E377 K378 E587 K591	E377-K589 WeakPolarHBondContact O-CE 3.34Å; E377-K589 PolarHBondContact O-NZ 3.11Å; K378-K589 PolarHBondContact O-NZ 3.27Å; E587-K589 HydrophobicContact CG-CB 4.12Å; E587-K589 WeakPolarHBondContact OE1-CB 3.4Å; E587-K589 PolarHBondContact OE1-N 3.44Å; K589-K591 PolarHBondContact O-N 3.18Å
590	G	67.6	Low	80	Confident	80 Å²	80	55.2 Å²	55.2	83%	0.825	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	9.6	169.6	0	0	0	0	0	115.2	T588	T588-G590 PolarHBondContact O-N 3.38Å
591	K	75.9	Confident	79.1	Confident	110 Å²	110	57.8 Å²	57.8	48%	0.478	30%	0.303	S	S	.	.			trans	-87.9	143	174.5	-63.9	-65.4	-175.5	175	0	110.5	T588 K589 I596	T588-K591 PolarHBondContact O-N 3.05Å; K589-K591 PolarHBondContact O-N 3.18Å; K591-I596 HydrophobicContact CB-CG1 4.12Å
592	K	74.5	Confident	78.2	Confident	137 Å²	137	63.5 Å²	63.5	60%	0.596	33%	0.334	S	S	*	.			trans	-74.5	155.7	171.7	-64.3	-177.6	178.8	174.5	0	110.3	E594 E595 I596	K592-E594 WeakPolarHBondContact CB-OE2 3.44Å; K592-E594 PolarHBondContact O-N 3.45Å; K592-E595 HydrophobicContact CB-CG 4.2Å; K592-E595 PolarHBondContact N-OE2 2.88Å; K592-E595 WeakPolarHBondContact O-CB 3.44Å; K592-E595 PolarHBondContact O-N 3.4Å; K592-I596 WeakPolarHBondContact O-CG1 3.34Å; K592-I596 PolarHBondContact O-N 3.43Å
593	L	64.1	Low	77.3	Confident	67 Å²	67	67.2 Å²	67.2	35%	0.351	35%	0.347	S	S	.	.	H	α-helix	trans	-59.3	-33.3	-177.2	-70.8	171.8	0	0	0	112.6	L529 R532 E595 I596	L529-L593 HydrophobicContact CD2-CD1 4.45Å; R532-L593 VanDerWaalsContact NH2-CD1 3.3Å; L593-E595 VanDerWaalsContact C-N 3.32Å; L593-I596 HydrophobicContact CD2-CD1 4.15Å; L593-I596 PolarHBondContact O-N 3.49Å
594	E	67.4	Low	76.4	Confident	137 Å²	137	68.6 Å²	68.6	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-71.9	-28.3	177.7	-53.5	79.8	-170.6	0	0	112	K592	K592-E594 WeakPolarHBondContact CB-OE2 3.44Å; K592-E594 PolarHBondContact O-N 3.45Å
595	E	71.4	Confident	75.3	Confident	82 Å²	82	71.1 Å²	71.1	38%	0.383	37%	0.367	S	S	.	.	H	α-helix	trans	-82.9	-14.2	177	-62	170.1	-176.7	0	0	112.4	K592 L593 S598	K592-E595 HydrophobicContact CB-CG 4.2Å; K592-E595 PolarHBondContact N-OE2 2.88Å; K592-E595 WeakPolarHBondContact O-CB 3.44Å; K592-E595 PolarHBondContact O-N 3.4Å; L593-E595 VanDerWaalsContact C-N 3.32Å; E595-S598 PolarHBondContact O-OG 3.24Å
596	I	73.3	Confident	73.8	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-75.4	-32.7	177.8	-69.9	173.7	0	0	0	110.7	E525 K591 K592 L593 S598 L599 F600	E525-I596 VanDerWaalsContact O-CD1 3.22Å; E525-I596 WeakPolarHBondContact O-CD1 3.37Å; K591-I596 HydrophobicContact CB-CG1 4.12Å; K592-I596 WeakPolarHBondContact O-CG1 3.34Å; K592-I596 PolarHBondContact O-N 3.43Å; L593-I596 HydrophobicContact CD2-CD1 4.15Å; L593-I596 PolarHBondContact O-N 3.49Å; I596-S598 VanDerWaalsContact C-N 3.28Å; I596-S598 PolarHBondContact O-N 2.99Å; I596-L599 HydrophobicContact CG1-CD1 4.46Å; I596-L599 WeakPolarHBondContact O-CB 3.2Å; I596-L599 PolarHBondContact O-N 2.96Å; I596-L599 VanDerWaalsContact O-N 3.16Å; I596-F600 HydrophobicContact CG2-CD2 4.44Å; I596-F600 HydrophobicContact CG2-CE2 4.01Å; I596-F600 VanDerWaalsContact O-CD2 3.3Å; I596-F600 WeakPolarHBondContact O-CD2 3.47Å
597	E	71.7	Confident	71.6	Confident	58 Å²	58	78.8 Å²	78.8	27%	0.271	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-38.6	177.9	-166.8	161.8	-154.1	0	0	111.2	Y310 L599 F600 D601	Y310-E597 WeakPolarHBondContact CE1-OE1 3.48Å; E597-L599 VanDerWaalsContact C-N 3.28Å; E597-L599 PolarHBondContact O-N 2.85Å; E597-F600 PolarHBondContact O-N 2.88Å; E597-D601 PolarHBondContact O-N 3.37Å
598	S	75.3	Confident	69.5	Low	62 Å²	62	79.4 Å²	79.4	43%	0.434	44%	0.437	S	S	.	.	H	α-helix	trans	-68.4	-23.1	177.2	69.9	0	0	0	0	113.8	E595 I596 F600 D601	E595-S598 PolarHBondContact O-OG 3.24Å; I596-S598 VanDerWaalsContact C-N 3.28Å; I596-S598 PolarHBondContact O-N 2.99Å; S598-F600 PolarHBondContact O-N 3.03Å; S598-D601 WeakPolarHBondContact CA-OD2 3.06Å; S598-D601 PolarHBondContact O-N 3.14Å
599	L	78.4	Confident	67.5	Low	62 Å²	62	82.6 Å²	82.6	33%	0.325	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-25.5	171.5	-63.7	171.8	0	0	0	112	P586 I596 E597	P586-L599 HydrophobicContact CB-CB 4.45Å; P586-L599 HydrophobicContact CB-CD1 4.29Å; I596-L599 HydrophobicContact CG1-CD1 4.46Å; I596-L599 WeakPolarHBondContact O-CB 3.2Å; I596-L599 PolarHBondContact O-N 2.96Å; I596-L599 VanDerWaalsContact O-N 3.16Å; E597-L599 VanDerWaalsContact C-N 3.28Å; E597-L599 PolarHBondContact O-N 2.85Å
600	F	82.6	Confident	65.6	Low	2 Å²	2	84 Å²	84	1%	0.009	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	1.4	-178.7	-64.2	-73.4	0	0	0	113.7	P312 R315 A316 V319 I526 P586 I596 E597 S598 N602 L604	P312-F600 HydrophobicContact CB-CB 3.94Å; R315-F600 HydrophobicContact CB-CB 4.34Å; R315-F600 HydrophobicContact CB-CD1 3.97Å; R315-F600 WeakPolarHBondContact CD-O 3.4Å; R315-F600 PolarHBondContact NH1-O 3.24Å; A316-F600 HydrophobicContact CB-CD1 4.31Å; A316-F600 HydrophobicContact CB-CD2 4.01Å; A316-F600 HydrophobicContact CB-CE1 4.23Å; A316-F600 HydrophobicContact CB-CE2 3.93Å; A316-F600 HydrophobicContact CB-CG 4.2Å; A316-F600 HydrophobicContact CB-CZ 4.03Å; V319-F600 HydrophobicContact CB-CE1 4.44Å; V319-F600 HydrophobicContact CG2-CE1 4.03Å; I526-F600 HydrophobicContact CB-CE2 4.02Å; I526-F600 HydrophobicContact CB-CZ 4.08Å; I526-F600 HydrophobicContact CG2-CE2 4.3Å; I526-F600 HydrophobicContact CG2-CZ 4.09Å; P586-F600 HydrophobicContact CG-CE1 4.09Å; P586-F600 HydrophobicContact CG-CZ 3.82Å; I596-F600 HydrophobicContact CG2-CD2 4.44Å; I596-F600 HydrophobicContact CG2-CE2 4.01Å; I596-F600 VanDerWaalsContact O-CD2 3.3Å; I596-F600 WeakPolarHBondContact O-CD2 3.47Å; E597-F600 PolarHBondContact O-N 2.88Å; S598-F600 PolarHBondContact O-N 3.03Å; F600-N602 VanDerWaalsContact C-N 3.31Å; F600-L604 HydrophobicContact CD1-CD2 4.05Å; F600-L604 HydrophobicContact CE1-CD2 4.17Å
601	D	77.1	Confident	64.4	Low	87 Å²	87	86.6 Å²	86.6	47%	0.465	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-31.2	174.3	-78.7	-22.5	0	0	0	112.3	P312 R315 E597 S598	P312-D601 VanDerWaalsContact CG-OD1 3.26Å; P312-D601 WeakPolarHBondContact CG-OD1 3.26Å; R315-D601 PolarHBondContact NH1-O 3.17Å; E597-D601 PolarHBondContact O-N 3.37Å; S598-D601 WeakPolarHBondContact CA-OD2 3.06Å; S598-D601 PolarHBondContact O-N 3.14Å
602	N	73.8	Confident	62.6	Low	122 Å²	122	86.3 Å²	86.3	65%	0.652	49%	0.487	S	S	*	.	S	Bend	trans	-86.9	157.8	176.3	-69.8	-32.2	0	0	0	112.6	R315 F600 L604	R315-N602 VanDerWaalsContact CZ-O 3.25Å; R315-N602 VanDerWaalsContact NH1-C 3.26Å; R315-N602 PolarHBondContact NH1-O 3.48Å; F600-N602 VanDerWaalsContact C-N 3.31Å; N602-L604 PolarHBondContact O-N 2.78Å
603	R	71.4	Confident	61.1	Low	206 Å²	206	84.8 Å²	84.8	78%	0.777	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-61.2	129.7	178.9	-78.1	-175.8	175.1	-173.8	-1.2	110.3
604	L	68.8	Low	59.9	Low	46 Å²	46	90.7 Å²	90.7	24%	0.241	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	151.9	171.2	-71.1	174.4	0	0	0	111.1	R315 V319 F600 N602	R315-L604 HydrophobicContact CB-CD1 3.52Å; R315-L604 HydrophobicContact CB-CD2 4.39Å; R315-L604 HydrophobicContact CB-CG 3.83Å; R315-L604 HydrophobicContact CG-CD1 3.67Å; R315-L604 HydrophobicContact CG-CG 3.82Å; V319-L604 HydrophobicContact CG2-CD1 4.04Å; V319-L604 HydrophobicContact CG2-CD2 3.92Å; F600-L604 HydrophobicContact CD1-CD2 4.05Å; F600-L604 HydrophobicContact CE1-CD2 4.17Å; N602-L604 PolarHBondContact O-N 2.78Å
605	C	65.1	Low	58.4	Low	66 Å²	66	87.2 Å²	87.2	45%	0.446	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	35.8	169.2	-30.9	0	0	0	0	114.7	G583 C584 C607	G583-C605 WeakPolarHBondContact O-CA 3.5Å; G583-C605 PolarHBondContact O-N 2.79Å; C584-C605 WeakPolarHBondContact CB-SG 3.41Å; C584-C605 WeakPolarHBondContact SG-CB 3.45Å; C584-C605 CovalentContact SG-SG 2.08Å; C584-C605 PolarHBondContact SG-SG 2.69Å; C605-C607 PolarHBondContact O-N 2.98Å; C605-C607 VanDerWaalsContact O-N 3.1Å
606	T	57.9	Low	56.7	Low	88 Å²	88	92.8 Å²	92.8	54%	0.54	53%	0.529	S	S	.	.			trans	-76.5	86.2	163.6	46.2	0	0	0	0	109.9	G608	T606-G608 PolarHBondContact O-N 3.48Å
607	C	42.3	Very low	54.9	Low	98 Å²	98	103.3 Å²	103.3	66%	0.662	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	111.4	168	-68.6	0	0	0	0	109.3	C605	C605-C607 PolarHBondContact O-N 2.98Å; C605-C607 VanDerWaalsContact O-N 3.1Å
608	G	41.2	Very low	53.5	Low	65 Å²	65	106.9 Å²	106.9	67%	0.67	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.7	8.8	171	0	0	0	0	0	117.4	T606 T610	T606-G608 PolarHBondContact O-N 3.48Å; G608-T610 VanDerWaalsContact C-N 3.31Å; G608-T610 PolarHBondContact O-N 3.22Å; G608-T610 VanDerWaalsContact O-N 3.14Å
609	A	41.2	Very low	51.2	Low	71 Å²	71	111.9 Å²	111.9	59%	0.587	61%	0.606	S	S	*	*			trans	-76.9	93.8	154.5	0	0	0	0	0	106.7
610	T	36.6	Very low	49.3	Very low	114 Å²	114	118.9 Å²	118.9	70%	0.699	63%	0.63	S	S	*	*			trans	-46.8	142.8	157.2	29.9	0	0	0	0	108.1	G608 S612	G608-T610 VanDerWaalsContact C-N 3.31Å; G608-T610 PolarHBondContact O-N 3.22Å; G608-T610 VanDerWaalsContact O-N 3.14Å; T610-S612 PolarHBondContact O-N 2.89Å; T610-S612 PolarHBondContact O-OG 2.93Å
611	D	43.3	Very low	46.9	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	66%	0.662	S	S	*	*			trans	-59.7	68.5	167.3	-79.7	-43.7	0	0	0	109.5	D613	D611-D613 PolarHBondContact O-N 3.47Å
612	S	36.3	Very low	44.8	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	14	171	51.9	0	0	0	0	111.7	T610	T610-S612 PolarHBondContact O-N 2.89Å; T610-S612 PolarHBondContact O-OG 2.93Å
613	D	43	Very low	43	Very low	104 Å²	104	132 Å²	132	56%	0.556	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	17.3	172.9	-116.8	-1.1	0	0	0	112.9	D611 G615	D611-D613 PolarHBondContact O-N 3.47Å; D613-G615 PolarHBondContact O-N 3.21Å
614	E	40.7	Very low	41.2	Very low	192 Å²	192	131.1 Å²	131.1	90%	0.897	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	3.4	163.3	-94.6	-166	163.9	0	0	113.8
615	G	35.4	Very low	39.4	Very low	64 Å²	64	131.9 Å²	131.9	66%	0.66	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	-4.7	-174.9	0	0	0	0	0	117.6	D613 Y617	D613-G615 PolarHBondContact O-N 3.21Å; G615-Y617 PolarHBondContact O-N 3.1Å
616	R	35.3	Very low	37.9	Very low	198 Å²	198	133 Å²	133	75%	0.747	72%	0.716	S	S	*	*			trans	-91.9	77.4	177.1	-84.7	-177.3	173.3	168	-1.4	111.4	I618	R616-I618 PolarHBondContact O-N 3.28Å
617	Y	34.6	Very low	37	Very low	227 Å²	227	136.4 Å²	136.4	89%	0.89	73%	0.73	S	S	*	*			trans	-62.2	102.8	152.1	-85.4	-92.3	0	0	0	107.6	G615 E619	G615-Y617 PolarHBondContact O-N 3.1Å; Y617-E619 VanDerWaalsContact C-N 3.32Å; Y617-E619 PolarHBondContact O-N 3.31Å
618	I	42.3	Very low	36.5	Very low	132 Å²	132	141.3 Å²	141.3	68%	0.677	74%	0.736	S	S	*	*			trans	-71.4	99	162.5	-61.1	175.5	0	0	0	105.6	R616 Y620	R616-I618 PolarHBondContact O-N 3.28Å; I618-Y620 PolarHBondContact O-N 3.06Å
619	E	28	Very low	36	Very low	167 Å²	167	146.6 Å²	146.6	78%	0.78	74%	0.743	S	S	*	*			trans	-65.4	103.7	170.5	-166.7	173.2	-158.8	0	0	107.6	Y617 I621	Y617-E619 VanDerWaalsContact C-N 3.32Å; Y617-E619 PolarHBondContact O-N 3.31Å; E619-I621 VanDerWaalsContact C-N 3.27Å; E619-I621 PolarHBondContact O-N 3.46Å
620	Y	37.9	Very low	35.5	Very low	210 Å²	210	150.9 Å²	150.9	82%	0.824	76%	0.755	S	S	*	*			trans	-65.2	95.3	166.1	-76	-89.7	0	0	0	107.4	I618 R622	I618-Y620 PolarHBondContact O-N 3.06Å; Y620-R622 VanDerWaalsContact C-N 3.27Å; Y620-R622 PolarHBondContact O-N 3.26Å
621	I	33.4	Very low	35.3	Very low	135 Å²	135	150.2 Å²	150.2	69%	0.692	76%	0.755	S	S	*	*			trans	-64.5	98.6	164.2	-60.1	175.3	0	0	0	105.8	E619 V623	E619-I621 VanDerWaalsContact C-N 3.27Å; E619-I621 PolarHBondContact O-N 3.46Å; I621-V623 HydrophobicContact CG2-CG2 4.13Å; I621-V623 PolarHBondContact O-N 2.89Å
622	R	33.1	Very low	34.9	Very low	227 Å²	227	151.1 Å²	151.1	86%	0.857	76%	0.76	S	S	*	*			trans	-66.9	89.4	165.5	-166.7	-177.8	-150.2	174.5	6.6	106.4	Y620 K624	Y620-R622 VanDerWaalsContact C-N 3.27Å; Y620-R622 PolarHBondContact O-N 3.26Å; R622-K624 VanDerWaalsContact C-N 3.3Å; R622-K624 PolarHBondContact O-N 3.1Å
623	V	34.3	Very low	35	Very low	123 Å²	123	152.7 Å²	152.7	75%	0.745	76%	0.76	S	S	*	*			trans	-60.2	102	164.9	-176.9	0	0	0	0	105.3	I621 G625	I621-V623 HydrophobicContact CG2-CG2 4.13Å; I621-V623 PolarHBondContact O-N 2.89Å; V623-G625 PolarHBondContact O-N 3.41Å
624	K	35	Very low	34.4	Very low	188 Å²	188	155.4 Å²	155.4	82%	0.817	78%	0.775	S	S	*	*			trans	-61.4	96.9	165	-86	-176	175.4	179.3	0	105.3	R622 S626	R622-K624 VanDerWaalsContact C-N 3.3Å; R622-K624 PolarHBondContact O-N 3.1Å; K624-S626 VanDerWaalsContact C-N 3.32Å; K624-S626 PolarHBondContact O-N 2.96Å
625	G	31.2	Very low	34.2	Very low	63 Å²	63	151 Å²	151	65%	0.649	77%	0.771	S	S	*	*			trans	-55.5	104.3	160.4	0	0	0	0	0	106.6	V623 N627	V623-G625 PolarHBondContact O-N 3.41Å; G625-N627 PolarHBondContact O-N 3.4Å; G625-N627 VanDerWaalsContact O-N 3.15Å
626	S	33.8	Very low	34.2	Very low	90 Å²	90	152.3 Å²	152.3	63%	0.629	77%	0.77	S	S	*	*			trans	-65.2	109.7	165.4	-166.4	0	0	0	0	105.4	K624 Y628	K624-S626 VanDerWaalsContact C-N 3.32Å; K624-S626 PolarHBondContact O-N 2.96Å; S626-Y628 PolarHBondContact O-N 2.96Å
627	N	37.3	Very low	34.1	Very low	158 Å²	158	150 Å²	150	85%	0.845	77%	0.773	S	S	*	*			trans	-66.3	82.3	165	-82.1	-18.7	0	0	0	107.3	G625 H629	G625-N627 PolarHBondContact O-N 3.4Å; G625-N627 VanDerWaalsContact O-N 3.15Å; N627-H629 PolarHBondContact O-N 2.95Å
628	Y	31.9	Very low	34.2	Very low	201 Å²	201	145.1 Å²	145.1	79%	0.788	77%	0.766	S	S	*	*			trans	-79.4	104.5	157	-104.8	-90	0	0	0	106.7	S626 L630	S626-Y628 PolarHBondContact O-N 2.96Å; Y628-L630 PolarHBondContact O-N 3.45Å; Y628-L630 VanDerWaalsContact O-N 3.14Å
629	H	32.3	Very low	33.8	Very low	177 Å²	177	151.3 Å²	151.3	82%	0.819	79%	0.792	S	S	*	*			trans	-56.9	111.1	155.7	-103.8	-88.8	0	0	0	107.1	N627 S631	N627-H629 PolarHBondContact O-N 2.95Å; H629-S631 PolarHBondContact O-N 3.17Å; H629-S631 VanDerWaalsContact O-N 3.09Å
630	L	30.5	Very low	34.1	Very low	160 Å²	160	150.5 Å²	150.5	84%	0.838	79%	0.793	S	S	*	*			trans	-64.4	106.1	156.9	-94.7	114.3	0	0	0	106.4	Y628	Y628-L630 PolarHBondContact O-N 3.45Å; Y628-L630 VanDerWaalsContact O-N 3.14Å
631	S	31.3	Very low	33.9	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	79%	0.791	S	S	*	*			trans	-73.1	118	158.4	-178.5	0	0	0	0	106.5	H629 N633	H629-S631 PolarHBondContact O-N 3.17Å; H629-S631 VanDerWaalsContact O-N 3.09Å; S631-N633 VanDerWaalsContact C-N 3.33Å; S631-N633 PolarHBondContact O-N 2.77Å
632	D	36	Very low	33.9	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	80%	0.797	S	S	*	*	S	Bend	trans	-58.9	99.9	159.3	-81.3	-35.6	0	0	0	107.8
633	N	38.4	Very low	34	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	79%	0.793	S	S	*	*			trans	169.9	101.6	151.1	-89.4	-17.8	0	0	0	107	S631	S631-N633 VanDerWaalsContact C-N 3.33Å; S631-N633 PolarHBondContact O-N 2.77Å
634	D	30	Very low	33.9	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	80%	0.796	S	S	*	*				-177.3	93	127.2	-86.4	-19.7	0	0	0	107.9
635	A	36.7	Very low	33.9	Very low	100 Å²	100	141.8 Å²	141.8	83%	0.826	80%	0.795	S	S	*	*			trans	-73.9	117.4	152	0	0	0	0	0	107.3
636	S	34.1	Very low	34.1	Very low	91 Å²	91	147.4 Å²	147.4	64%	0.636	81%	0.805	S	S	*	*			trans	170.9	118.8	140.6	53.5	0	0	0	0	110.6
637	D	33.2	Very low	34.1	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	82%	0.819	S	S	*	*				59.9	121.9	128.8	-51.1	-26.6	0	0	0	120.8
638	V	36.6	Very low	33.8	Very low	124 Å²	124	151.3 Å²	151.3	75%	0.752	82%	0.817	S	S	*	*				141.1	110.8	113.7	-177.6	0	0	0	0	110.9
639	E	34.8	Very low	34	Very low	262 Å²	262	146.8 Å²	146.8	100%	1.224	82%	0.819	S	S	*	*			trans	56.2	0	151.9	-63.6	-177.7	157	0	0	121.9

Retrieved 639 of 639 residues in 935.4 ms (Link to these results)

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