A0A087X322_POEFO Loading...

Catenin delta 2

AlphaFold DB , UniProt , Accession A0A087X322, Species POEFO (Poecilia formosa, Amazon molly), Gene CTNND2, Length 768 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	29	Very low	26	Very low	235 Å²	235	138.9 Å²	138.9	100%	1.158	85%	0.847	S	S	*	*				0	95.3	0	-58.7	-50	178.1	0	0	106.4
2	S	25.8	Very low	25.7	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	84%	0.835	S	S	*	*				79.2	130	97.3	-150.2	0	0	0	0	110.6
3	S	30.1	Very low	25.7	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	84%	0.837	S	S	*	*			cis	-171	159	6.2	17.9	0	0	0	0	111.5
4	G	27.2	Very low	25.9	Very low	66 Å²	66	139.4 Å²	139.4	68%	0.68	84%	0.836	S	S	*	*			trans	90.5	99.9	142.9	0	0	0	0	0	116.7
5	I	27.1	Very low	26.1	Very low	182 Å²	182	146.5 Å²	146.5	93%	0.933	84%	0.843	S	S	*	*				61.5	111.9	78.8	-58.6	171.6	0	0	0	113.5
6	G	23.7	Very low	26.2	Very low	81 Å²	81	146.3 Å²	146.3	84%	0.835	84%	0.836	S	S	*	*			trans	-160.6	120.6	164.8	0	0	0	0	0	109.4
7	S	23.4	Very low	26.4	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	84%	0.836	S	S	*	*			trans	-121.4	130.7	-173.7	173	0	0	0	0	110.1
8	Y	23.8	Very low	26.6	Very low	236 Å²	236	140.3 Å²	140.3	93%	0.925	83%	0.829	S	S	*	*			trans	177.9	147.5	161.7	-80.7	-59	0	0	0	106.7
9	A	24.2	Very low	26.7	Very low	89 Å²	89	140.4 Å²	140.4	74%	0.736	82%	0.82	S	S	*	*			cis	-154.3	159.7	-14.8	0	0	0	0	0	108.7
10	T	27.4	Very low	26.9	Very low	140 Å²	140	140.5 Å²	140.5	86%	0.859	81%	0.812	S	S	*	*			trans	-75.9	129.9	179.5	48.3	0	0	0	0	113
11	L	23.8	Very low	27.2	Very low	171 Å²	171	137.4 Å²	137.4	90%	0.895	80%	0.803	S	S	*	*			trans	-131.6	129.7	162.8	-73.8	175.9	0	0	0	111.2
12	S	23.2	Very low	27.2	Very low	100 Å²	100	129.6 Å²	129.6	70%	0.699	77%	0.771	S	S	*	*			trans	-92.5	127.9	-176.2	57.2	0	0	0	0	112.6	K14	S12-K14 PolarHBondContact O-N 3.14Å
13	P	25	Very low	27.3	Very low	134 Å²	134	127.2 Å²	127.2	87%	0.87	75%	0.75	S	S	*	*			trans	-82.2	64.4	173	32.1	-32	0	0	0	112.2
14	K	28.5	Very low	27.6	Very low	190 Å²	190	128.9 Å²	128.9	83%	0.826	75%	0.746	S	S	*	*			trans	-106.6	74.4	164.1	-85.4	-169.9	174.9	-179.6	0	110.2	S12	S12-K14 PolarHBondContact O-N 3.14Å
15	R	29.7	Very low	27.9	Very low	246 Å²	246	134.5 Å²	134.5	93%	0.928	75%	0.748	S	S	*	*	S	Bend	trans	173.6	58.1	159.3	-99	161.6	-171.1	-154.2	4	113.3
16	L	27.3	Very low	28	Very low	142 Å²	142	131 Å²	131	74%	0.743	73%	0.725	S	S	*	*	S	Bend	trans	-142	-18.4	169.3	-114.3	147.2	0	0	0	114.7	A18	L16-A18 VanDerWaalsContact C-N 3.32Å; L16-A18 PolarHBondContact O-N 3.39Å
17	A	30.1	Very low	28.4	Very low	101 Å²	101	131.6 Å²	131.6	84%	0.835	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-1.1	179.6	0	0	0	0	0	115.8
18	A	29.9	Very low	28.9	Very low	85 Å²	85	129.5 Å²	129.5	70%	0.702	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-10.6	-172.1	0	0	0	0	0	115.1	L16	L16-A18 VanDerWaalsContact C-N 3.32Å; L16-A18 PolarHBondContact O-N 3.39Å
19	H	28.1	Very low	29.3	Very low	142 Å²	142	124.9 Å²	124.9	66%	0.657	68%	0.68	S	S	*	*	S	Bend	trans	-100.1	-24.3	-173.4	-85.4	-80.4	0	0	0	115.1
20	H	30.4	Very low	29.7	Very low	141 Å²	141	126.8 Å²	126.8	65%	0.653	67%	0.674	S	S	*	*	H	α-helix	trans	-84.7	-14.5	-170.9	-71	-70.6	0	0	0	116.3
21	A	32.7	Very low	30.1	Very low	77 Å²	77	125.8 Å²	125.8	64%	0.636	66%	0.663	S	S	*	*	H	α-helix	trans	-81.2	-22.6	-178.9	0	0	0	0	0	114.2
22	S	29.6	Very low	30.8	Very low	70 Å²	70	125.2 Å²	125.2	49%	0.49	65%	0.65	S	S	.	*	H	α-helix	trans	-83.5	-36.5	-177.7	-166.9	0	0	0	0	112.1	Y25	S22-Y25 PolarHBondContact O-N 3.19Å
23	D	29.1	Very low	31.3	Very low	63 Å²	63	122.6 Å²	122.6	34%	0.337	64%	0.635	S	S	.	*	H	α-helix	trans	-80.4	-22.8	-170.3	-62.4	-31.2	0	0	0	113.3	Y25 K26 I27	D23-Y25 VanDerWaalsContact C-N 3.29Å; D23-Y25 PolarHBondContact O-N 3.11Å; D23-K26 PolarHBondContact O-N 3.1Å; D23-K26 VanDerWaalsContact O-N 3.11Å; D23-K26 IonicContact OD1-NZ 2.67Å; D23-K26 PolarHBondContact OD1-NZ 3.3Å; D23-I27 WeakPolarHBondContact O-CD1 3.19Å; D23-I27 WeakPolarHBondContact O-CG1 3.4Å; D23-I27 PolarHBondContact O-N 3.47Å
24	Q	35.8	Very low	31.7	Very low	146 Å²	146	121.4 Å²	121.4	68%	0.682	63%	0.625	S	S	*	*	H	α-helix	trans	-62.7	-31.6	172.6	-87.1	-175	-16.1	0	0	113.5	S28	Q24-S28 PolarHBondContact O-OG 2.95Å
25	Y	32.6	Very low	31.9	Very low	184 Å²	184	116.5 Å²	116.5	72%	0.722	62%	0.62	S	S	*	*	H	α-helix	trans	-78.1	-27.2	173.7	-81.3	-84.5	0	0	0	112.7	S22 D23 S28 H29	S22-Y25 PolarHBondContact O-N 3.19Å; D23-Y25 VanDerWaalsContact C-N 3.29Å; D23-Y25 PolarHBondContact O-N 3.11Å; Y25-S28 PolarHBondContact O-OG 2.89Å; Y25-H29 PolarHBondContact O-N 2.78Å
26	K	29.4	Very low	32	Very low	108 Å²	108	109.3 Å²	109.3	47%	0.47	60%	0.603	S	S	.	*	H	α-helix	trans	-74.3	-40.2	175.1	-65.8	-179.1	-167	153.9	0	112.8	D23 S28 H29 E30	D23-K26 PolarHBondContact O-N 3.1Å; D23-K26 VanDerWaalsContact O-N 3.11Å; D23-K26 IonicContact OD1-NZ 2.67Å; D23-K26 PolarHBondContact OD1-NZ 3.3Å; K26-S28 VanDerWaalsContact C-N 3.28Å; K26-S28 PolarHBondContact O-N 3.4Å; K26-H29 CarbonylContact O-C 3.52Å; K26-H29 WeakPolarHBondContact O-CA 3.3Å; K26-H29 WeakPolarHBondContact O-CB 3.48Å; K26-H29 PolarHBondContact O-N 3.11Å; K26-E30 PolarHBondContact O-N 3.08Å
27	I	32.3	Very low	32.1	Very low	94 Å²	94	111 Å²	111	48%	0.482	61%	0.612	S	S	.	*	H	α-helix	trans	-59.2	-41.1	179.2	-70.6	157.6	0	0	0	110.9	D23 H29 E30 L31	D23-I27 WeakPolarHBondContact O-CD1 3.19Å; D23-I27 WeakPolarHBondContact O-CG1 3.4Å; D23-I27 PolarHBondContact O-N 3.47Å; I27-H29 PolarHBondContact O-N 3.3Å; I27-E30 PolarHBondContact O-N 2.79Å; I27-L31 HydrophobicContact CG2-CD1 4.23Å; I27-L31 PolarHBondContact O-N 3.48Å
28	S	34.3	Very low	32.1	Very low	61 Å²	61	114.4 Å²	114.4	43%	0.427	61%	0.611	S	S	.	*	H	α-helix	trans	-65.5	-23.8	171.4	42.7	0	0	0	0	114.2	Q24 Y25 K26 Y32	Q24-S28 PolarHBondContact O-OG 2.95Å; Y25-S28 PolarHBondContact O-OG 2.89Å; K26-S28 VanDerWaalsContact C-N 3.28Å; K26-S28 PolarHBondContact O-N 3.4Å; S28-Y32 WeakPolarHBondContact O-CD2 3.46Å
29	H	33.1	Very low	32.2	Very low	138 Å²	138	119.8 Å²	119.8	64%	0.639	61%	0.613	S	S	*	*	H	α-helix	trans	-85.1	-35.2	177.3	-162.7	-72.5	0	0	0	112.3	Y25 K26 I27 Y32 A33	Y25-H29 PolarHBondContact O-N 2.78Å; K26-H29 CarbonylContact O-C 3.52Å; K26-H29 WeakPolarHBondContact O-CA 3.3Å; K26-H29 WeakPolarHBondContact O-CB 3.48Å; K26-H29 PolarHBondContact O-N 3.11Å; I27-H29 PolarHBondContact O-N 3.3Å; H29-Y32 PolarHBondContact O-N 3.49Å; H29-A33 VanDerWaalsContact O-CB 3.29Å; H29-A33 WeakPolarHBondContact O-CB 3.39Å; H29-A33 PolarHBondContact O-N 2.02Å
30	E	31.6	Very low	32.2	Very low	130 Å²	130	119.4 Å²	119.4	61%	0.607	62%	0.623	S	S	*	*	H	α-helix	trans	-71.4	-37.3	177.3	-72.7	-177.2	153.6	0	0	112.4	K26 I27 Y32 A33 T34	K26-E30 PolarHBondContact O-N 3.08Å; I27-E30 PolarHBondContact O-N 2.79Å; E30-Y32 VanDerWaalsContact C-N 3.33Å; E30-A33 PolarHBondContact O-N 2.93Å; E30-T34 PolarHBondContact O-N 3.35Å; E30-T34 VanDerWaalsContact O-N 3.15Å; E30-T34 PolarHBondContact O-OG1 2.66Å
31	L	34.9	Very low	32.1	Very low	119 Å²	119	116.4 Å²	116.4	62%	0.623	63%	0.63	S	S	*	*	H	α-helix	trans	-67.9	-31	172.9	-77.7	165	0	0	0	112.8	I27 T34	I27-L31 HydrophobicContact CG2-CD1 4.23Å; I27-L31 PolarHBondContact O-N 3.48Å; L31-T34 PolarHBondContact O-OG1 3.26Å
32	Y	40.1	Very low	31.8	Very low	158 Å²	158	118.2 Å²	118.2	62%	0.62	64%	0.638	S	S	*	*	H	α-helix	trans	-78.2	-39.5	173.6	-96.3	-95	0	0	0	112.4	S28 H29 E30 T34 A35 T36	S28-Y32 WeakPolarHBondContact O-CD2 3.46Å; H29-Y32 PolarHBondContact O-N 3.49Å; E30-Y32 VanDerWaalsContact C-N 3.33Å; Y32-T34 PolarHBondContact O-N 3.15Å; Y32-A35 PolarHBondContact O-N 3.08Å; Y32-T36 PolarHBondContact O-N 2.72Å
33	A	33.4	Very low	31.9	Very low	46 Å²	46	123.8 Å²	123.8	38%	0.38	66%	0.662	S	S	.	*	H	α-helix	trans	-66.2	-21.8	177.7	0	0	0	0	0	113.7	H29 E30	H29-A33 VanDerWaalsContact O-CB 3.29Å; H29-A33 WeakPolarHBondContact O-CB 3.39Å; H29-A33 PolarHBondContact O-N 2.02Å; E30-A33 PolarHBondContact O-N 2.93Å
34	T	32.9	Very low	31.9	Very low	109 Å²	109	125.1 Å²	125.1	67%	0.669	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-12.9	175	46.4	0	0	0	0	114.1	E30 L31 Y32	E30-T34 PolarHBondContact O-N 3.35Å; E30-T34 VanDerWaalsContact O-N 3.15Å; E30-T34 PolarHBondContact O-OG1 2.66Å; L31-T34 PolarHBondContact O-OG1 3.26Å; Y32-T34 PolarHBondContact O-N 3.15Å
35	A	32.2	Very low	31.6	Very low	86 Å²	86	121.7 Å²	121.7	71%	0.711	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-16.9	176.4	0	0	0	0	0	113.9	Y32	Y32-A35 PolarHBondContact O-N 3.08Å
36	T	32	Very low	31.3	Very low	95 Å²	95	118.9 Å²	118.9	58%	0.583	69%	0.692	S	S	*	*	S	Bend	trans	-90.2	128.8	172.6	49.8	0	0	0	0	111.6	Y32 Q38	Y32-T36 PolarHBondContact O-N 2.72Å; T36-Q38 PolarHBondContact O-N 3.49Å; T36-Q38 VanDerWaalsContact O-N 3.1Å
37	L	30.1	Very low	31.5	Very low	179 Å²	179	126 Å²	126	94%	0.937	72%	0.716	S	S	*	*			trans	-46	112.3	177.5	-78.1	160.9	0	0	0	113	R39	L37-R39 PolarHBondContact O-N 3.45Å
38	Q	30.2	Very low	31.2	Very low	172 Å²	172	125.1 Å²	125.1	80%	0.804	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.1	124.2	169.5	-72.4	-173.8	-9.7	0	0	110.3	T36	T36-Q38 PolarHBondContact O-N 3.49Å; T36-Q38 VanDerWaalsContact O-N 3.1Å
39	R	31	Very low	30.9	Very low	198 Å²	198	127.9 Å²	127.9	75%	0.747	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.4	128.1	167.3	-99.5	-178.6	170.1	174.5	-3.4	109.7	L37	L37-R39 PolarHBondContact O-N 3.45Å
40	P	27.8	Very low	30.4	Very low	133 Å²	133	132.9 Å²	132.9	86%	0.864	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-78	124.1	174.8	30.5	-32.5	0	0	0	110.8
41	G	29.3	Very low	30.1	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	77%	0.771	S	S	*	*			trans	135.9	81.8	164.2	0	0	0	0	0	116.5
42	S	27.2	Very low	29.7	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	78%	0.778	S	S	*	*			trans	-169.4	99.4	135.4	-170.7	0	0	0	0	110.5
43	L	30.2	Very low	28.9	Very low	188 Å²	188	132.1 Å²	132.1	98%	0.984	79%	0.787	S	S	*	*			trans	-95.4	101.3	164.4	-90.2	167	0	0	0	108.3
44	A	30.5	Very low	28.5	Very low	90 Å²	90	138.6 Å²	138.6	74%	0.744	81%	0.809	S	S	*	*			trans	-152.8	102	164.9	0	0	0	0	0	109.7
45	G	29.4	Very low	28.1	Very low	75 Å²	75	138.6 Å²	138.6	77%	0.773	81%	0.814	S	S	*	*			trans	-84.8	137.3	170.8	0	0	0	0	0	110.4
46	S	26.5	Very low	27.7	Very low	124 Å²	124	143.9 Å²	143.9	87%	0.867	82%	0.824	S	S	*	*			trans	-158.7	132.2	155.4	-84.9	0	0	0	0	111.9
47	R	31.7	Very low	27.3	Very low	258 Å²	258	148.1 Å²	148.1	97%	0.974	84%	0.837	S	S	*	*			trans	-71	138.6	165.9	-74.6	173.3	161.6	-176.7	-6	108.6
48	G	26.4	Very low	26.9	Very low	76 Å²	76	144.4 Å²	144.4	78%	0.784	83%	0.832	S	S	*	*			trans	-162.3	102	171.7	0	0	0	0	0	111.1
49	S	27.8	Very low	26.6	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	84%	0.837	S	S	*	*			trans	-75.2	133.2	172.1	-51.1	0	0	0	0	110
50	Y	24.1	Very low	26.4	Very low	243 Å²	243	145.7 Å²	145.7	95%	0.953	84%	0.842	S	S	*	*			trans	-149.2	152.5	152.9	-112.6	-79.4	0	0	0	111.6
51	S	23.7	Very low	26.2	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	84%	0.84	S	S	*	*			trans	-123.9	129.8	-172.3	177.8	0	0	0	0	111.2
52	S	26.4	Very low	25.9	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	85%	0.846	S	S	*	*			trans	-171.2	113.1	151.6	43.4	0	0	0	0	107.2
53	Q	24.4	Very low	25.8	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	84%	0.841	S	S	*	*				50.7	90.6	87.8	-70	-165.5	-5.7	0	0	114.2
54	H	24.6	Very low	25.5	Very low	181 Å²	181	143.6 Å²	143.6	84%	0.838	83%	0.827	S	S	*	*				-161.8	127.1	129	-109.6	-74.5	0	0	0	111.5
55	S	24.7	Very low	25.1	Very low	109 Å²	109	145.6 Å²	145.6	76%	0.762	83%	0.832	S	S	*	*			trans	39.9	96	156.2	27.6	0	0	0	0	119.3
56	Q	23.8	Very low	25.1	Very low	197 Å²	197	149.5 Å²	149.5	92%	0.921	83%	0.83	S	S	*	*			trans	-90.2	116.7	157.5	-79.2	-167.1	-18.5	0	0	111.1
57	E	23.2	Very low	25.2	Very low	185 Å²	185	151.9 Å²	151.9	86%	0.864	83%	0.827	S	S	*	*			trans	-79.1	136.8	155.5	-71.4	-178.9	126.8	0	0	109.4	L59	E57-L59 PolarHBondContact O-N 3.29Å
58	A	22.9	Very low	25	Very low	101 Å²	101	145.5 Å²	145.5	84%	0.835	81%	0.808	S	S	*	*			trans	-77.4	91.1	-171.2	0	0	0	0	0	112.4	R60	A58-R60 PolarHBondContact O-N 2.91Å
59	L	23.8	Very low	25	Very low	173 Å²	173	147.8 Å²	147.8	91%	0.906	80%	0.801	S	S	*	*			trans	-61.2	104.9	166.8	-83.3	162.5	0	0	0	110.5	E57	E57-L59 PolarHBondContact O-N 3.29Å
60	R	25.9	Very low	24.9	Very low	223 Å²	223	147.1 Å²	147.1	84%	0.842	79%	0.788	S	S	*	*			trans	-64.1	141.4	165.5	-75.2	-175.3	171.6	-175.1	-1.5	109.7	A58 L62	A58-R60 PolarHBondContact O-N 2.91Å; R60-L62 PolarHBondContact O-N 3Å; R60-L62 VanDerWaalsContact O-N 3.15Å
61	P	23.7	Very low	25	Very low	129 Å²	129	141.1 Å²	141.1	84%	0.838	78%	0.779	S	S	*	*			trans	-60.5	118	162.8	-17.9	30.9	0	0	0	109.2	G63	P61-G63 PolarHBondContact O-N 3.38Å
62	L	24	Very low	25.2	Very low	177 Å²	177	143.4 Å²	143.4	93%	0.927	78%	0.781	S	S	*	*			trans	-70.6	100.4	169.4	-81.4	163.7	0	0	0	108.2	R60	R60-L62 PolarHBondContact O-N 3Å; R60-L62 VanDerWaalsContact O-N 3.15Å
63	G	23.3	Very low	25.2	Very low	67 Å²	67	146.1 Å²	146.1	69%	0.691	78%	0.776	S	S	*	*			trans	-61.9	145.3	173.3	0	0	0	0	0	111.7	P61	P61-G63 PolarHBondContact O-N 3.38Å
64	S	23.8	Very low	25.2	Very low	98 Å²	98	144.4 Å²	144.4	69%	0.685	77%	0.768	S	S	*	*			trans	-50.6	140.8	177.6	-53.3	0	0	0	0	112.5	E66	S64-E66 PolarHBondContact O-N 3.38Å
65	P	23.7	Very low	25.1	Very low	132 Å²	132	144.9 Å²	144.9	86%	0.857	77%	0.77	S	S	*	*			trans	-77.3	65.8	171.9	33.5	-35.1	0	0	0	111.1
66	E	28.5	Very low	25.1	Very low	156 Å²	156	148.7 Å²	148.7	73%	0.729	77%	0.768	S	S	*	*			trans	-94.6	89.4	171.1	-73.8	-165.5	137.6	0	0	110.7	S64	S64-E66 PolarHBondContact O-N 3.38Å
67	H	29.5	Very low	25.2	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.806	76%	0.757	S	S	*	*			trans	-144	135.4	168.2	-87.9	-34.8	0	0	0	115
68	H	27.5	Very low	25.3	Very low	124 Å²	124	146.3 Å²	146.3	57%	0.574	76%	0.757	S	S	*	*			trans	57.5	97.9	150.8	-76.8	-91.3	0	0	0	118.9	D70	H68-D70 IonicContact CE1-OD1 3.68Å; H68-D70 IonicContact CG-OD1 2.79Å; H68-D70 IonicContact ND1-OD1 3.63Å; H68-D70 PolarHBondContact ND1-OD1 3Å
69	I	26.3	Very low	25.5	Very low	124 Å²	124	149.8 Å²	149.8	64%	0.636	76%	0.755	S	S	*	*			trans	-92	114.4	133.6	-60.5	174.5	0	0	0	105.7
70	D	24.4	Very low	25.5	Very low	105 Å²	105	149 Å²	149	56%	0.561	75%	0.752	S	S	*	*			trans	-77.7	147.1	174.4	-67.5	-42	0	0	0	111	H68 I72	H68-D70 IonicContact CE1-OD1 3.68Å; H68-D70 IonicContact CG-OD1 2.79Å; H68-D70 IonicContact ND1-OD1 3.63Å; H68-D70 PolarHBondContact ND1-OD1 3Å; D70-I72 PolarHBondContact O-N 2.88Å
71	P	27.2	Very low	25.6	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	76%	0.755	S	S	*	*			trans	-70.2	113.4	175.8	28.2	-33	0	0	0	110.5	Y73	P71-Y73 PolarHBondContact O-N 3.35Å; P71-Y73 VanDerWaalsContact O-N 3.12Å
72	I	27.4	Very low	25.8	Very low	153 Å²	153	145.4 Å²	145.4	79%	0.785	75%	0.749	S	S	*	*			trans	-62.5	113	177.8	-60.8	172.7	0	0	0	110.4	D70	D70-I72 PolarHBondContact O-N 2.88Å
73	Y	27.5	Very low	25.9	Very low	167 Å²	167	143.2 Å²	143.2	66%	0.655	75%	0.746	S	S	*	*			trans	-144.8	122.4	158.8	-109.5	-74	0	0	0	112.3	P71 Y436	P71-Y73 PolarHBondContact O-N 3.35Å; P71-Y73 VanDerWaalsContact O-N 3.12Å; Y73-Y436 AromaticContact CE2-CE2 3.88Å; Y73-Y436 HydrophobicContact CE2-CE2 3.88Å; Y73-Y436 AromaticContact CE2-CZ 3.96Å; Y73-Y436 WeakPolarHBondContact CE2-OH 3.16Å; Y73-Y436 PolarHBondContact OH-OH 3.43Å
74	E	23	Very low	26	Very low	141 Å²	141	148.9 Å²	148.9	66%	0.659	76%	0.756	S	S	*	*			trans	58.1	94.7	169.5	-55.3	-152.1	133.1	0	0	118.9	R76	E74-R76 IonicContact OE1-CZ 3.02Å; E74-R76 IonicContact OE1-NH1 2.68Å; E74-R76 PolarHBondContact OE1-NH1 2.97Å; E74-R76 IonicContact OE1-NH2 2.76Å; E74-R76 IonicContact OE2-NH1 2.71Å
75	E	22.4	Very low	26.2	Very low	190 Å²	190	155.3 Å²	155.3	89%	0.888	77%	0.765	S	S	*	*			trans	-111	104.2	135.6	-167.9	172.4	-143.8	0	0	108.7
76	R	25.5	Very low	26.2	Very low	190 Å²	190	154.9 Å²	154.9	72%	0.717	77%	0.765	S	S	*	*			trans	-88.8	118.4	162	-84.4	-165.5	-174.4	89.2	4.8	108.1	E74 Y78	E74-R76 IonicContact OE1-CZ 3.02Å; E74-R76 IonicContact OE1-NH1 2.68Å; E74-R76 PolarHBondContact OE1-NH1 2.97Å; E74-R76 IonicContact OE1-NH2 2.76Å; E74-R76 IonicContact OE2-NH1 2.71Å; R76-Y78 PolarHBondContact O-N 2.95Å
77	V	26.3	Very low	26	Very low	113 Å²	113	154.5 Å²	154.5	69%	0.685	77%	0.768	S	S	*	*			trans	-53	131.2	175	177.1	0	0	0	0	111.8	H79	V77-H79 HydrophobicContact CG1-CB 4.36Å
78	Y	24.5	Very low	25.8	Very low	218 Å²	218	151.6 Å²	151.6	86%	0.855	77%	0.767	S	S	*	*			trans	-123.9	101	149.8	-84.9	-77.7	0	0	0	109.3	R76	R76-Y78 PolarHBondContact O-N 2.95Å
79	H	27.2	Very low	25.8	Very low	174 Å²	174	153.8 Å²	153.8	81%	0.806	78%	0.778	S	S	*	*			trans	-115	121.8	160	-99	76.7	0	0	0	108.1	V77 K81	V77-H79 HydrophobicContact CG1-CB 4.36Å; H79-K81 PolarHBondContact O-N 3.48Å
80	N	24.1	Very low	25.9	Very low	158 Å²	158	152.8 Å²	152.8	85%	0.845	78%	0.781	S	S	*	*			trans	-69.2	114.7	174.2	-81.6	-22.1	0	0	0	110.6
81	K	27.9	Very low	26	Very low	206 Å²	206	157.5 Å²	157.5	90%	0.896	80%	0.8	S	S	*	*			trans	-140.4	136.8	149	-73.9	-163.7	175.4	179.6	0	109.6	H79	H79-K81 PolarHBondContact O-N 3.48Å
82	G	27.6	Very low	25.9	Very low	69 Å²	69	155.4 Å²	155.4	71%	0.711	80%	0.8	S	S	*	*			trans	-74.6	169.7	-175.2	0	0	0	0	0	114.1
83	P	27.1	Very low	26.7	Very low	132 Å²	132	153.7 Å²	153.7	86%	0.857	80%	0.799	S	S	*	*			trans	-83.5	133.5	-172.7	32.9	-33.6	0	0	0	112.4
84	M	25.3	Very low	26.7	Very low	185 Å²	185	152.8 Å²	152.8	91%	0.911	81%	0.805	S	S	*	*			trans	-122.9	132.1	157.3	-83.9	-68.2	-80.3	0	0	109.1
85	R	27.7	Very low	27	Very low	233 Å²	233	153 Å²	153	88%	0.879	82%	0.816	S	S	*	*			trans	-69.2	135.7	-175.3	-72.6	170.3	163	165.3	-8.2	110.8
86	S	23	Very low	27.1	Very low	123 Å²	123	147.4 Å²	147.4	86%	0.86	81%	0.809	S	S	*	*			trans	-89.8	129.8	156.7	-177.9	0	0	0	0	108.6
87	L	24.3	Very low	28.4	Very low	148 Å²	148	143.3 Å²	143.3	78%	0.775	81%	0.807	S	S	*	*			trans	-123.7	126.3	174.8	-111.9	158.4	0	0	0	107.7
88	S	25.2	Very low	28.5	Very low	113 Å²	113	147.4 Å²	147.4	79%	0.79	81%	0.812	S	S	*	*			trans	-99.4	123.3	177.3	176	0	0	0	0	109.7
89	Q	27.9	Very low	28.9	Very low	171 Å²	171	147.2 Å²	147.2	80%	0.799	81%	0.81	S	S	*	*			trans	-145.7	120.1	162.5	-80.8	-174.4	-24.6	0	0	105.8
90	S	27.4	Very low	29	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	80%	0.801	S	S	*	*				75.4	125.9	59.7	77.8	0	0	0	0	113.4
91	Q	27.5	Very low	29.3	Very low	205 Å²	205	143.6 Å²	143.6	96%	0.958	80%	0.796	S	S	*	*			trans	-69	152.2	-173.5	-60.8	165.3	-13.1	0	0	113.5
92	G	26	Very low	29.4	Very low	73 Å²	73	140.3 Å²	140.3	75%	0.753	79%	0.794	S	S	*	*			trans	174.4	146.4	169.1	0	0	0	0	0	112.8
93	P	42.6	Very low	29.5	Very low	117 Å²	117	141 Å²	141	76%	0.76	79%	0.792	S	S	*	*			trans	-110.8	171.2	-160.5	41.6	-35.9	0	0	0	117.6
94	D	27.2	Very low	30.1	Very low	148 Å²	148	141 Å²	141	79%	0.791	79%	0.792	S	S	*	*			trans	59.5	120.6	153.7	-68.4	-29.5	0	0	0	123.1
95	T	29.7	Very low	30.4	Very low	146 Å²	146	137.6 Å²	137.6	90%	0.896	79%	0.787	S	S	*	*				156.7	138.4	118.4	43.1	0	0	0	0	111.9
96	G	25.4	Very low	30.8	Very low	72 Å²	72	131.9 Å²	131.9	74%	0.742	78%	0.783	S	S	*	*			trans	-97.5	-150.7	179	0	0	0	0	0	113.5
97	P	52.7	Low	31.8	Very low	103 Å²	103	132.2 Å²	132.2	67%	0.669	78%	0.782	S	S	*	*			cis	-139.4	173	0.2	34.3	-12.5	0	0	0	116.6
98	Y	28.5	Very low	32.1	Very low	199 Å²	199	128.7 Å²	128.7	78%	0.78	78%	0.782	S	S	*	*				149.4	113.6	129	-85.2	-65.8	0	0	0	116.4
99	R	32	Very low	32.6	Very low	215 Å²	215	130 Å²	130	81%	0.811	78%	0.784	S	S	*	*			trans	54.3	143.8	146.1	-69.7	-173.8	164.3	172.2	-3.9	120.8
100	N	29.7	Very low	32.5	Very low	118 Å²	118	129.2 Å²	129.2	63%	0.631	79%	0.786	S	S	*	*			cis	-160.2	148.3	0.4	-122.5	7.7	0	0	0	111.1
101	N	30.1	Very low	32.5	Very low	137 Å²	137	128.6 Å²	128.6	73%	0.733	78%	0.782	S	S	*	*			trans	30.6	139.5	153.1	-54.3	-3.7	0	0	0	120.7
102	T	29.9	Very low	32.5	Very low	138 Å²	138	125.4 Å²	125.4	85%	0.847	78%	0.776	S	S	*	*			cis	-162.4	149.6	36.9	-38.5	0	0	0	0	111.6
103	A	30.1	Very low	33.3	Very low	83 Å²	83	126.8 Å²	126.8	69%	0.686	77%	0.772	S	S	*	*			trans	-140.2	168.7	163.4	0	0	0	0	0	108.7
104	P	41	Very low	32.6	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	78%	0.776	S	S	*	*				-149.5	-172.7	84.8	39.4	-19.6	0	0	0	115.7
105	S	29.9	Very low	32.7	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	77%	0.769	S	S	*	*			trans	-107	-175	-161.9	-46.7	0	0	0	0	115.4
106	S	36.3	Very low	32.6	Very low	113 Å²	113	131.7 Å²	131.7	79%	0.79	77%	0.765	S	S	*	*			trans	-51.8	163.5	178.1	-31.9	0	0	0	0	117.7
107	P	45	Very low	32.8	Very low	129 Å²	129	134.5 Å²	134.5	84%	0.838	77%	0.768	S	S	*	*			trans	-109.3	167	143.7	36.6	-26.5	0	0	0	111.2
108	G	29.5	Very low	31.6	Very low	75 Å²	75	133 Å²	133	77%	0.773	77%	0.771	S	S	*	*			cis	123.9	119.9	8	0	0	0	0	0	110.5
109	V	35.7	Very low	31.8	Very low	140 Å²	140	128.4 Å²	128.4	85%	0.848	77%	0.768	S	S	*	*			trans	-90.6	143.7	178.9	-74.4	0	0	0	0	111.7
110	D	25.3	Very low	31.8	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	77%	0.771	S	S	*	*			trans	-174.9	-168.4	134.6	-121.9	-44.2	0	0	0	115.1
111	S	28.2	Very low	31.8	Very low	89 Å²	89	124.7 Å²	124.7	62%	0.622	77%	0.774	S	S	*	*			trans	-119.1	141.5	-141.8	-54.6	0	0	0	0	119.1
112	T	28.8	Very low	31.9	Very low	138 Å²	138	125.3 Å²	125.3	85%	0.847	78%	0.783	S	S	*	*			trans	62	176	153.4	66.2	0	0	0	0	119.6
113	P	42.8	Very low	31.9	Very low	102 Å²	102	121.6 Å²	121.6	66%	0.662	77%	0.772	S	S	*	*			cis	-142.2	-174	2.3	46.1	-27.4	0	0	0	118.9
114	L	26.5	Very low	31.9	Very low	161 Å²	161	125.1 Å²	125.1	84%	0.843	79%	0.785	S	S	*	*			trans	70.3	151.1	159.6	-66.5	167.3	0	0	0	119.7
115	Q	29.5	Very low	31.4	Very low	138 Å²	138	122.3 Å²	122.3	65%	0.645	78%	0.78	S	S	*	*			cis	-150.6	158.2	14	-93.2	-151.9	33	0	0	114.7
116	R	28.1	Very low	31.3	Very low	215 Å²	215	121.6 Å²	121.6	81%	0.811	78%	0.775	S	S	*	*			trans	60	150.5	149.3	-88.5	-174.7	-136.2	-129.7	-4.5	120.9
117	T	28.6	Very low	30.9	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	78%	0.779	S	S	*	*			cis	-136.2	161.9	10.5	48.8	0	0	0	0	113.7
118	G	28.4	Very low	29.9	Very low	72 Å²	72	126.2 Å²	126.2	74%	0.742	78%	0.777	S	S	*	*			trans	-72.8	-159.3	-174.5	0	0	0	0	0	118.5
119	S	32.1	Very low	29.8	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	79%	0.786	S	S	*	*			cis	-174.5	168.6	-4.8	37.8	0	0	0	0	110.8
120	H	33.1	Very low	29.2	Very low	187 Å²	187	131.8 Å²	131.8	87%	0.866	78%	0.784	S	S	*	*			trans	101.8	113.7	-177.8	-59.5	-66.6	0	0	0	112.5
121	G	30	Very low	29.3	Very low	67 Å²	67	127.7 Å²	127.7	69%	0.691	78%	0.779	S	S	*	*			cis	84	113.2	19.5	0	0	0	0	0	109.2
122	T	31.4	Very low	29.3	Very low	151 Å²	151	129.6 Å²	129.6	93%	0.926	79%	0.787	S	S	*	*			cis	-151.9	164.8	42.6	48.2	0	0	0	0	111.2
123	G	29.7	Very low	29.4	Very low	60 Å²	60	129.3 Å²	129.3	62%	0.619	78%	0.78	S	S	*	*			cis	159.1	147.1	-3	0	0	0	0	0	111.2
124	T	31	Very low	28.8	Very low	156 Å²	156	130.2 Å²	130.2	96%	0.957	78%	0.779	S	S	*	*			trans	56.9	140.6	162.5	57.4	0	0	0	0	119.8
125	G	28.6	Very low	28.9	Very low	73 Å²	73	132.3 Å²	132.3	75%	0.753	78%	0.778	S	S	*	*			cis	-176.2	-170.8	3.1	0	0	0	0	0	111.9
126	S	28	Very low	28.8	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	77%	0.774	S	S	*	*			trans	-55.8	169.2	176.9	-127.1	0	0	0	0	113.2
127	Y	28.1	Very low	28.7	Very low	224 Å²	224	125.2 Å²	125.2	88%	0.878	78%	0.775	S	S	*	*				-167.2	176.3	52.8	11.4	-107.1	0	0	0	113.1
128	S	25.6	Very low	28.9	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	78%	0.777	S	S	*	*			trans	-88.9	175.4	-165.8	-38.9	0	0	0	0	117.7
129	R	25.8	Very low	28.8	Very low	254 Å²	254	125.2 Å²	125.2	96%	0.958	77%	0.772	S	S	*	*			trans	81.9	140.5	158.6	-151.5	-179.6	-164.5	173.5	3.4	114.8
130	G	24.1	Very low	29.3	Very low	78 Å²	78	126.6 Å²	126.6	80%	0.804	78%	0.779	S	S	*	*			cis	152.6	142.9	-8	0	0	0	0	0	111.6
131	G	26.1	Very low	29	Very low	69 Å²	69	120.9 Å²	120.9	71%	0.711	77%	0.77	S	S	*	*			trans	113.5	111.1	160	0	0	0	0	0	120.9
132	T	29.4	Very low	29	Very low	129 Å²	129	128 Å²	128	79%	0.791	78%	0.778	S	S	*	*				53	125.4	128.1	54.5	0	0	0	0	125.5
133	N	30.2	Very low	28.9	Very low	133 Å²	133	126.5 Å²	126.5	71%	0.711	77%	0.769	S	S	*	*				89.1	130.4	128.1	-72.5	15.5	0	0	0	124.8
134	N	30.9	Very low	28.8	Very low	120 Å²	120	128.6 Å²	128.6	64%	0.642	77%	0.774	S	S	*	*			trans	72.8	155.4	140.2	-66.3	-1.1	0	0	0	119.8
135	Y	28.4	Very low	28.9	Very low	206 Å²	206	126.1 Å²	126.1	81%	0.808	76%	0.763	S	S	*	*			cis	-158.8	155.3	1.5	-126.9	-52.7	0	0	0	111.9
136	A	27.5	Very low	29.1	Very low	70 Å²	70	127.3 Å²	127.3	58%	0.579	77%	0.766	S	S	*	*			trans	67.4	133.8	136.9	0	0	0	0	0	126.2
137	T	25.9	Very low	29.3	Very low	134 Å²	134	126.5 Å²	126.5	82%	0.822	77%	0.773	S	S	*	*			trans	69.8	151.4	144.4	54.6	0	0	0	0	119.6
138	V	31.9	Very low	29.5	Very low	138 Å²	138	119.6 Å²	119.6	84%	0.836	77%	0.77	S	S	*	*			cis	-149.1	160.3	29.3	-146.4	0	0	0	0	112.7
139	G	26.2	Very low	29.9	Very low	63 Å²	63	118.5 Å²	118.5	65%	0.649	78%	0.777	S	S	*	*			trans	-87.7	-172.2	160.9	0	0	0	0	0	112.7
140	P	43	Very low	30.5	Very low	133 Å²	133	110.5 Å²	110.5	86%	0.864	77%	0.773	S	S	*	*				-149.8	179.2	53.3	41.4	-21.5	0	0	0	118
141	G	26.5	Very low	30.7	Very low	66 Å²	66	109.9 Å²	109.9	68%	0.68	77%	0.767	S	S	*	*			trans	62.2	136.9	135.6	0	0	0	0	0	120.3
142	Y	31.2	Very low	31	Very low	216 Å²	216	114.5 Å²	114.5	85%	0.847	78%	0.776	S	S	*	*			cis	-145.2	130.5	29.2	-76.6	-99.9	0	0	0	109.6
143	T	28	Very low	31.3	Very low	120 Å²	120	114.3 Å²	114.3	74%	0.736	77%	0.774	S	S	*	*				43.2	124.1	97.6	66.2	0	0	0	0	115.2
144	S	29.5	Very low	31.5	Very low	104 Å²	104	118.9 Å²	118.9	73%	0.727	78%	0.783	S	S	*	*			cis	-155.9	132	48.7	-76	0	0	0	0	112.4
145	S	31.9	Very low	31.6	Very low	105 Å²	105	116.4 Å²	116.4	73%	0.734	79%	0.786	S	S	*	*				54.2	107.9	98.1	80.4	0	0	0	0	115.5
146	A	32.8	Very low	32.1	Very low	98 Å²	98	112.5 Å²	112.5	81%	0.81	79%	0.789	S	S	*	*				103.4	131.9	86.4	0	0	0	0	0	109.3
147	G	31.7	Very low	32.2	Very low	83 Å²	83	116.4 Å²	116.4	86%	0.856	80%	0.8	S	S	*	*				80.4	125.3	67.9	0	0	0	0	0	109.2
148	G	32.4	Very low	33.3	Very low	79 Å²	79	113.8 Å²	113.8	81%	0.814	79%	0.785	S	S	*	*			cis	154.3	143.9	3.7	0	0	0	0	0	109.6
149	G	34.2	Very low	33.3	Very low	90 Å²	90	117.5 Å²	117.5	93%	0.928	79%	0.786	S	S	*	*			trans	72.9	170.4	172.1	0	0	0	0	0	117.5
150	G	38.5	Very low	33.6	Very low	86 Å²	86	121.3 Å²	121.3	89%	0.887	80%	0.796	S	S	*	*			trans	123.8	147	165.1	0	0	0	0	0	115.9
151	G	28.4	Very low	33	Very low	66 Å²	66	118.9 Å²	118.9	68%	0.68	79%	0.787	S	S	*	*			trans	103.3	76.7	175.6	0	0	0	0	0	113.3
152	D	33.1	Very low	33.1	Very low	166 Å²	166	123.2 Å²	123.2	89%	0.888	80%	0.795	S	S	*	*	S	Bend		-61.5	143.4	52.8	-73.8	-53.8	0	0	0	117.9
153	V	35.3	Very low	33.7	Very low	125 Å²	125	116.9 Å²	116.9	76%	0.758	78%	0.78	S	S	*	*	S	Bend	trans	78.1	81.7	-176.5	-166.3	0	0	0	0	115.1
154	Y	34.2	Very low	33.8	Very low	228 Å²	228	120.7 Å²	120.7	89%	0.894	78%	0.782	S	S	*	*			trans	72.4	110.5	155.4	-75.1	-94.6	0	0	0	122.1
155	G	34	Very low	33.7	Very low	69 Å²	69	126 Å²	126	71%	0.711	79%	0.786	S	S	*	*				128.1	83	125.6	0	0	0	0	0	121.5
156	S	37	Very low	33.6	Very low	123 Å²	123	125.5 Å²	125.5	86%	0.86	78%	0.779	S	S	*	*			trans	57.3	107.2	133.4	-44	0	0	0	0	123.8
157	D	31.2	Very low	33.3	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	78%	0.777	S	S	*	*				47.7	164.1	123.3	-107.7	17.6	0	0	0	123.7
158	P	48	Very low	33	Very low	79 Å²	79	132.1 Å²	132.1	51%	0.513	78%	0.775	S	S	.	*			cis	-142	174.3	-39.9	34	-13.5	0	0	0	117
159	Y	32.2	Very low	32.7	Very low	216 Å²	216	138.1 Å²	138.1	85%	0.847	78%	0.775	S	S	*	*			trans	70.2	161.2	157.4	-57.1	-44.4	0	0	0	119.4
160	V	33.1	Very low	32.4	Very low	142 Å²	142	139.6 Å²	139.6	86%	0.861	77%	0.769	S	S	*	*			cis	-151.5	-163.4	-8.9	116.2	0	0	0	0	112
161	A	30	Very low	32.7	Very low	83 Å²	83	140.6 Å²	140.6	69%	0.686	76%	0.76	S	S	*	*			trans	-115.8	161.7	-162.2	0	0	0	0	0	119.5
162	D	27.6	Very low	32.7	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	76%	0.761	S	S	*	*			trans	55.4	-175.4	142.6	-128.6	6.8	0	0	0	119.7
163	P	45.5	Very low	32.6	Very low	82 Å²	82	140.6 Å²	140.6	53%	0.532	76%	0.757	S	S	.	*			cis	-137.7	-170.5	-20.8	20.6	6.7	0	0	0	116.7
164	Y	28.1	Very low	32.6	Very low	201 Å²	201	141.2 Å²	141.2	79%	0.788	76%	0.761	S	S	*	*			trans	86.4	124.2	161.9	-63.4	-78.3	0	0	0	119.8
165	R	28.9	Very low	32.4	Very low	215 Å²	215	139.1 Å²	139.1	81%	0.811	76%	0.759	S	S	*	*				71.1	129.7	66.6	-141.6	-160.8	-164.8	-165.7	7.7	111.8
166	T	29.3	Very low	32	Very low	95 Å²	95	141.5 Å²	141.5	58%	0.583	77%	0.765	S	S	*	*				177.1	138	58	-47.4	0	0	0	0	112.1
167	L	27.4	Very low	32.2	Very low	147 Å²	147	140.5 Å²	140.5	77%	0.77	76%	0.755	S	S	*	*			trans	41.4	173.5	149.9	-55.2	169.5	0	0	0	120.6
168	Q	25.6	Very low	32.2	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.804	76%	0.758	S	S	*	*			cis	-157.5	169.4	14.7	-153.7	136.4	-24.8	0	0	114.2
169	Y	24.9	Very low	31.5	Very low	206 Å²	206	145.5 Å²	145.5	81%	0.808	77%	0.771	S	S	*	*			trans	-100.5	154.3	179.8	-169.3	-92.5	0	0	0	111.3
170	C	27.7	Very low	31.7	Very low	121 Å²	121	145.1 Å²	145.1	82%	0.818	77%	0.774	S	S	*	*			trans	178.9	164.6	144.8	-101.7	0	0	0	0	116.2
171	P	44.7	Very low	31.8	Very low	107 Å²	107	144.3 Å²	144.3	70%	0.695	78%	0.775	S	S	*	*			trans	-124.8	178.6	-159.7	44.8	-32.3	0	0	0	117
172	S	28.1	Very low	31.9	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	78%	0.777	S	S	*	*			trans	-174	133.6	163.3	175	0	0	0	0	107.9
173	V	32.4	Very low	32.5	Very low	131 Å²	131	142.4 Å²	142.4	79%	0.794	78%	0.777	S	S	*	*			cis	76.9	91.4	27	-165.1	0	0	0	0	115.7
174	V	34.6	Very low	32	Very low	138 Å²	138	143.3 Å²	143.3	84%	0.836	79%	0.791	S	S	*	*			trans	-138	123.5	165.6	-169.5	0	0	0	0	109.9
175	E	30.7	Very low	32.4	Very low	184 Å²	184	142 Å²	142	86%	0.86	80%	0.797	S	S	*	*			trans	-86.3	156.4	171	-67.5	-179.7	116.3	0	0	111.7
176	S	25.3	Very low	32.7	Very low	119 Å²	119	137 Å²	137	83%	0.832	79%	0.792	S	S	*	*			trans	-155.2	132.6	149.9	-168.9	0	0	0	0	111.2
177	P	41.7	Very low	33.4	Very low	102 Å²	102	138.7 Å²	138.7	66%	0.662	81%	0.805	S	S	*	*			trans	-100.2	155.6	-176.2	37.9	-33.9	0	0	0	113.2
178	Y	31.1	Very low	33.8	Very low	224 Å²	224	140 Å²	140	88%	0.878	81%	0.807	S	S	*	*				167.9	126.9	129.5	-110.2	-87	0	0	0	112.7
179	S	33	Very low	34.2	Very low	113 Å²	113	135 Å²	135	79%	0.79	80%	0.801	S	S	*	*			trans	138.4	120.9	133.2	-64.3	0	0	0	0	115.2
180	K	35.5	Very low	35	Very low	207 Å²	207	130.9 Å²	130.9	90%	0.9	80%	0.803	S	S	*	*			trans	-90.9	130	166.2	-83	176.1	170.5	175	0	110.4
181	S	35.7	Very low	35.4	Very low	125 Å²	125	133.1 Å²	133.1	87%	0.874	81%	0.806	S	S	*	*			trans	-177.7	135.2	136.8	23.5	0	0	0	0	110.4
182	G	32.8	Very low	35	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	82%	0.818	S	S	*	*			trans	-85	-177.9	173.6	0	0	0	0	0	112.5
183	P	39.7	Very low	35.4	Very low	130 Å²	130	142.9 Å²	142.9	84%	0.844	82%	0.822	S	S	*	*				-143.6	162.6	70.9	36.3	-18.6	0	0	0	118
184	A	33.9	Very low	35.7	Very low	101 Å²	101	141.8 Å²	141.8	84%	0.835	82%	0.82	S	S	*	*			trans	13.4	129.1	161.1	0	0	0	0	0	122.6
185	L	36.6	Very low	36.2	Very low	172 Å²	172	140.9 Å²	140.9	90%	0.901	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-82.3	148.7	166	-66.9	163.8	0	0	0	112.9
186	P	36.7	Very low	36.7	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-89.1	160.1	144.8	34.3	-27.6	0	0	0	111.3
187	P	42.6	Very low	37.8	Very low	132 Å²	132	136.4 Å²	136.4	86%	0.857	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-79.8	153.3	-163.8	30.8	-36.1	0	0	0	115.8
188	E	36.4	Very low	37.9	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68	146.2	178.5	-69.7	-175.5	139.9	0	0	113.9	R193	E188-R193 IonicContact OE1-NH2 2.67Å
189	G	34.5	Very low	38.6	Very low	66 Å²	66	129.4 Å²	129.4	68%	0.68	77%	0.77	S	S	*	*			trans	-129.1	92.1	163.9	0	0	0	0	0	111
190	S	42.6	Very low	39.3	Very low	120 Å²	120	130.5 Å²	130.5	84%	0.839	77%	0.766	S	S	*	*			trans	38.8	84.8	162	62.5	0	0	0	0	118.4
191	L	34.9	Very low	39.8	Very low	168 Å²	168	129.7 Å²	129.7	88%	0.88	77%	0.765	S	S	*	*			trans	-119	125	152	-75.4	171.8	0	0	0	108.7	R193	L191-R193 PolarHBondContact O-N 3.29Å; L191-R193 VanDerWaalsContact O-N 3.14Å
192	Q	36.2	Very low	40.3	Very low	201 Å²	201	130.3 Å²	130.3	94%	0.939	75%	0.752	S	S	*	*			trans	-67.7	110.5	177.8	-74.2	178.9	-30.5	0	0	109.9
193	R	37.7	Very low	40.8	Very low	213 Å²	213	129.9 Å²	129.9	80%	0.804	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-68.2	135.4	171.8	-72.9	-173.2	-175.3	-172.9	4.2	110.3	E188 L191	E188-R193 IonicContact OE1-NH2 2.67Å; L191-R193 PolarHBondContact O-N 3.29Å; L191-R193 VanDerWaalsContact O-N 3.14Å
194	S	37.4	Very low	41.4	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-58.3	142.3	157.1	-44.8	0	0	0	0	109.4	S196	S194-S196 PolarHBondContact O-N 3.34Å
195	P	44.9	Very low	42.3	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.9	131.5	-179.1	25.7	-32.9	0	0	0	110.6
196	S	42.1	Very low	43	Very low	68 Å²	68	132.4 Å²	132.4	48%	0.476	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-75.2	159.8	-178.5	73.9	0	0	0	0	112.3	S194 D198 S199	S194-S196 PolarHBondContact O-N 3.34Å; S196-D198 PolarHBondContact O-N 3.02Å; S196-D198 VanDerWaalsContact O-N 3.08Å; S196-D198 PolarHBondContact OG-OD2 2.96Å; S196-S199 WeakPolarHBondContact O-CB 3.04Å; S196-S199 PolarHBondContact O-N 3.27Å; S196-S199 VanDerWaalsContact O-N 3.1Å; S196-S199 PolarHBondContact O-OG 3.46Å
197	I	47.5	Very low	43.8	Very low	141 Å²	141	134.9 Å²	134.9	72%	0.723	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-61.9	-16.8	-177.9	-132.5	163.5	0	0	0	113.1	S199 I200	I197-S199 PolarHBondContact O-N 3.04Å; I197-I200 HydrophobicContact CG1-CD1 3.92Å; I197-I200 WeakPolarHBondContact O-CB 3.49Å; I197-I200 WeakPolarHBondContact O-CG1 3.48Å; I197-I200 PolarHBondContact O-N 3.03Å
198	D	44.2	Very low	44.7	Very low	122 Å²	122	130.3 Å²	130.3	65%	0.652	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-67	-12.7	174.9	-48.5	-61.3	0	0	0	113.5	S196 I200	S196-D198 PolarHBondContact O-N 3.02Å; S196-D198 VanDerWaalsContact O-N 3.08Å; S196-D198 PolarHBondContact OG-OD2 2.96Å; D198-I200 PolarHBondContact O-N 3.06Å
199	S	46.7	Very low	46.1	Very low	56 Å²	56	132.4 Å²	132.4	39%	0.392	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-65.9	-13.7	175.5	-49.5	0	0	0	0	113.2	S196 I197	S196-S199 WeakPolarHBondContact O-CB 3.04Å; S196-S199 PolarHBondContact O-N 3.27Å; S196-S199 VanDerWaalsContact O-N 3.1Å; S196-S199 PolarHBondContact O-OG 3.46Å; I197-S199 PolarHBondContact O-N 3.04Å
200	I	47.1	Very low	48.7	Very low	136 Å²	136	137.2 Å²	137.2	70%	0.697	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-81.1	-12.9	-171.8	-62.7	174.1	0	0	0	113	I197 D198	I197-I200 HydrophobicContact CG1-CD1 3.92Å; I197-I200 WeakPolarHBondContact O-CB 3.49Å; I197-I200 WeakPolarHBondContact O-CG1 3.48Å; I197-I200 PolarHBondContact O-N 3.03Å; D198-I200 PolarHBondContact O-N 3.06Å
201	Q	45.4	Very low	50.6	Low	190 Å²	190	137.1 Å²	137.1	89%	0.888	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-103.5	3	-177.4	-70.6	-173.2	-3.7	0	0	115.5
202	K	47	Very low	53.3	Low	139 Å²	139	130.7 Å²	130.7	60%	0.604	65%	0.646	S	S	*	*	S	Bend	trans	-92.2	152.2	175.1	-74.3	-167.6	172	-167.6	0	112.3	P204	K202-P204 WeakPolarHBondContact O-CD 3.34Å
203	D	43.6	Very low	56	Low	62 Å²	62	126.7 Å²	126.7	33%	0.332	63%	0.627	S	S	.	*			trans	-58.2	124	-177.7	-168.6	-39	0	0	0	110.5	R205 E206	D203-R205 PolarHBondContact O-N 3.04Å; D203-R205 WeakPolarHBondContact OD1-CB 3.41Å; D203-R205 VanDerWaalsContact OD1-CG 3.31Å; D203-R205 WeakPolarHBondContact OD1-CG 3.34Å; D203-R205 IonicContact OD1-CZ 2.72Å; D203-R205 PolarHBondContact OD1-N 3.17Å; D203-R205 IonicContact OD1-NE 2.92Å; D203-R205 PolarHBondContact OD1-NE 3.35Å; D203-R205 IonicContact OD1-NH2 3.23Å; D203-R205 IonicContact OD2-CZ 3.23Å; D203-R205 VanDerWaalsContact OD2-CZ 3.29Å; D203-R205 IonicContact OD2-NE 3.15Å; D203-R205 PolarHBondContact OD2-NE 2.97Å; D203-R205 VanDerWaalsContact OD2-NE 3.1Å; D203-R205 IonicContact OD2-NH2 3.72Å; D203-R205 PolarHBondContact OD2-NH2 3.18Å; D203-E206 PolarHBondContact O-N 3.26Å
204	P	50.7	Low	58.7	Low	113 Å²	113	117.5 Å²	117.5	73%	0.734	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-15.9	177.5	-27.4	35.5	0	0	0	114.6	K202	K202-P204 WeakPolarHBondContact O-CD 3.34Å
205	R	54	Low	61.6	Low	195 Å²	195	115.6 Å²	115.6	74%	0.736	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-19.8	177.8	-62.9	172.7	-74.2	-169.4	1.2	114	D203	D203-R205 PolarHBondContact O-N 3.04Å; D203-R205 WeakPolarHBondContact OD1-CB 3.41Å; D203-R205 VanDerWaalsContact OD1-CG 3.31Å; D203-R205 WeakPolarHBondContact OD1-CG 3.34Å; D203-R205 IonicContact OD1-CZ 2.72Å; D203-R205 PolarHBondContact OD1-N 3.17Å; D203-R205 IonicContact OD1-NE 2.92Å; D203-R205 PolarHBondContact OD1-NE 3.35Å; D203-R205 IonicContact OD1-NH2 3.23Å; D203-R205 IonicContact OD2-CZ 3.23Å; D203-R205 VanDerWaalsContact OD2-CZ 3.29Å; D203-R205 IonicContact OD2-NE 3.15Å; D203-R205 PolarHBondContact OD2-NE 2.97Å; D203-R205 VanDerWaalsContact OD2-NE 3.1Å; D203-R205 IonicContact OD2-NH2 3.72Å; D203-R205 PolarHBondContact OD2-NH2 3.18Å
206	E	50.7	Low	64	Low	148 Å²	148	112.9 Å²	112.9	69%	0.692	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-20.1	174.3	-69.6	-168.4	154.1	0	0	113.1	D203	D203-E206 PolarHBondContact O-N 3.26Å
207	F	53.8	Low	66.7	Low	162 Å²	162	109.7 Å²	109.7	71%	0.711	53%	0.534	S	S	*	.	S	Bend	trans	-93.2	-7	172.9	-92	-89	0	0	0	113.8	W209	F207-W209 PolarHBondContact O-N 3.45Å
208	G	61	Low	69.1	Low	35 Å²	35	103.4 Å²	103.4	36%	0.361	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	116.3	-165.1	0	0	0	0	0	114
209	W	67.1	Low	71.6	Confident	218 Å²	218	104.3 Å²	104.3	83%	0.826	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	55.7	165.3	-38.8	99.2	0	0	0	116.2	F207	F207-W209 PolarHBondContact O-N 3.45Å
210	R	87.4	Confident	74	Confident	168 Å²	168	104.9 Å²	104.9	63%	0.634	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-80.5	130.7	150.1	172.7	173.5	174.9	-134.3	-11.4	108.8	E216	R210-E216 IonicContact CZ-OE1 3.14Å; R210-E216 IonicContact NH1-OE1 2.71Å; R210-E216 PolarHBondContact NH1-OE1 3.31Å; R210-E216 IonicContact NH1-OE2 3.53Å; R210-E216 IonicContact NH2-OE1 3.25Å; R210-E216 PolarHBondContact NH2-OE1 2.86Å; R210-E216 IonicContact NH2-OE2 3.53Å
211	D	83.6	Confident	76.5	Confident	117 Å²	117	98.5 Å²	98.5	63%	0.626	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-68.1	124	165.2	-81.1	-58.6	0	0	0	109.9	Y235	D211-Y235 PolarHBondContact OD1-OH 3.34Å
212	P	90.8	Very high	79	Confident	34 Å²	34	95.9 Å²	95.9	22%	0.221	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-71.7	138.7	176.2	29.6	-34.7	0	0	0	110.8	E216 V217 M220 Y235	P212-E216 HydrophobicContact CB-CB 4.31Å; P212-V217 HydrophobicContact CB-CG2 3.75Å; P212-V217 HydrophobicContact CG-CG2 3.5Å; P212-M220 HydrophobicContact CB-CE 4.22Å; P212-Y235 HydrophobicContact CG-CD1 4.49Å; P212-Y235 HydrophobicContact CG-CE1 3.98Å
213	E	93.1	Very high	81.4	Confident	116 Å²	116	92.7 Å²	92.7	54%	0.542	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-64.5	150.1	174.4	-67.1	-65.4	157.4	0	0	110.9	P215 E216 V217	E213-P215 VanDerWaalsContact C-CD 3.41Å; E213-P215 VanDerWaalsContact C-N 3.33Å; E213-P215 VanDerWaalsContact O-N 3.16Å; E213-E216 HydrophobicContact CB-CG 4.12Å; E213-E216 WeakPolarHBondContact O-CA 3.46Å; E213-E216 VanDerWaalsContact O-CB 3.29Å; E213-E216 WeakPolarHBondContact O-CB 3.49Å; E213-E216 PolarHBondContact O-N 2.92Å; E213-V217 PolarHBondContact O-N 3.49Å; E213-V217 VanDerWaalsContact O-N 3.13Å
214	L	94.9	Very high	83.9	Confident	21 Å²	21	97.1 Å²	97.1	11%	0.11	46%	0.46	C	S	.	.	H	α-helix	trans	-51.8	-40.8	-176.1	-175.7	61.2	0	0	0	114.7	V217 I218 L236 L239 I246 E249 I250	L214-V217 PolarHBondContact O-N 3.2Å; L214-I218 HydrophobicContact CD1-CD1 4.28Å; L214-I218 HydrophobicContact CD1-CG1 4.47Å; L214-I218 HydrophobicContact CG-CD1 4.11Å; L214-I218 WeakPolarHBondContact O-CG1 3.36Å; L214-I218 PolarHBondContact O-N 3.18Å; L214-I218 VanDerWaalsContact O-N 3.08Å; L214-L236 HydrophobicContact CD1-CD2 3.53Å; L214-L239 HydrophobicContact CD1-CD1 4.04Å; L214-I246 HydrophobicContact CD2-CD1 4.35Å; L214-E249 HydrophobicContact CD2-CB 3.96Å; L214-E249 HydrophobicContact CD2-CG 3.59Å; L214-I250 HydrophobicContact CD1-CD1 4.21Å; L214-I250 HydrophobicContact CD1-CG1 3.79Å; L214-I250 HydrophobicContact CD2-CG1 4.15Å; L214-I250 HydrophobicContact CG-CG1 4.38Å
215	P	97	Very high	86.1	Confident	66 Å²	66	96.9 Å²	96.9	43%	0.429	45%	0.448	S	S	.	.	H	α-helix	trans	-64.2	-36.3	173.8	-18.3	31.4	0	0	0	113.5	E213 I218 Q219 Q253	E213-P215 VanDerWaalsContact C-CD 3.41Å; E213-P215 VanDerWaalsContact C-N 3.33Å; E213-P215 VanDerWaalsContact O-N 3.16Å; P215-I218 PolarHBondContact O-N 2.67Å; P215-Q219 PolarHBondContact O-N 3.36Å; P215-Q253 VanDerWaalsContact CA-OE1 3.27Å
216	E	96.7	Very high	88.2	Confident	63 Å²	63	88.8 Å²	88.8	29%	0.294	42%	0.42	S	S	.	.	H	α-helix	trans	-62.4	-45.4	177.1	-59.2	178.1	-153.5	0	0	109.7	R210 P212 E213 I218 Q219 M220	R210-E216 IonicContact CZ-OE1 3.14Å; R210-E216 IonicContact NH1-OE1 2.71Å; R210-E216 PolarHBondContact NH1-OE1 3.31Å; R210-E216 IonicContact NH1-OE2 3.53Å; R210-E216 IonicContact NH2-OE1 3.25Å; R210-E216 PolarHBondContact NH2-OE1 2.86Å; R210-E216 IonicContact NH2-OE2 3.53Å; P212-E216 HydrophobicContact CB-CB 4.31Å; E213-E216 HydrophobicContact CB-CG 4.12Å; E213-E216 WeakPolarHBondContact O-CA 3.46Å; E213-E216 VanDerWaalsContact O-CB 3.29Å; E213-E216 WeakPolarHBondContact O-CB 3.49Å; E213-E216 PolarHBondContact O-N 2.92Å; E216-I218 PolarHBondContact O-N 3.11Å; E216-Q219 PolarHBondContact O-N 3.33Å; E216-M220 HydrophobicContact CB-CE 4.32Å; E216-M220 VanDerWaalsContact O-CG 3.3Å; E216-M220 WeakPolarHBondContact O-CG 3.3Å; E216-M220 PolarHBondContact O-N 2.86Å
217	V	97.6	Very high	90.4	Very high	1 Å²	1	84.9 Å²	84.9	1%	0.006	41%	0.409	C	S	.	.	H	α-helix	trans	-63.8	-41.6	177.8	-173.3	0	0	0	0	112	P212 E213 L214 Q219 M220 L221 A232 Y235 L236	P212-V217 HydrophobicContact CB-CG2 3.75Å; P212-V217 HydrophobicContact CG-CG2 3.5Å; E213-V217 PolarHBondContact O-N 3.49Å; E213-V217 VanDerWaalsContact O-N 3.13Å; L214-V217 PolarHBondContact O-N 3.2Å; V217-Q219 VanDerWaalsContact C-N 3.3Å; V217-Q219 PolarHBondContact O-N 3.13Å; V217-M220 WeakPolarHBondContact O-CB 3.42Å; V217-M220 PolarHBondContact O-N 2.67Å; V217-L221 PolarHBondContact O-N 3.47Å; V217-A232 HydrophobicContact CG1-CB 4.09Å; V217-Y235 HydrophobicContact CB-CD1 4.46Å; V217-Y235 HydrophobicContact CG1-CD1 3.97Å; V217-Y235 HydrophobicContact CG2-CD1 3.69Å; V217-Y235 HydrophobicContact CG2-CE1 3.85Å; V217-L236 HydrophobicContact CB-CD2 4.15Å; V217-L236 HydrophobicContact CG1-CD1 4.43Å; V217-L236 HydrophobicContact CG1-CD2 3.66Å; V217-L236 HydrophobicContact CG1-CG 3.69Å
218	I	97.9	Very high	92.5	Very high	9 Å²	9	79.2 Å²	79.2	5%	0.046	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-39.3	177.7	-69.9	172.8	0	0	0	110.4	L214 P215 E216 L221 L236 I250 Q253 L258	L214-I218 HydrophobicContact CD1-CD1 4.28Å; L214-I218 HydrophobicContact CD1-CG1 4.47Å; L214-I218 HydrophobicContact CG-CD1 4.11Å; L214-I218 WeakPolarHBondContact O-CG1 3.36Å; L214-I218 PolarHBondContact O-N 3.18Å; L214-I218 VanDerWaalsContact O-N 3.08Å; P215-I218 PolarHBondContact O-N 2.67Å; E216-I218 PolarHBondContact O-N 3.11Å; I218-L221 WeakPolarHBondContact O-CB 3.43Å; I218-L221 WeakPolarHBondContact O-CG 3.3Å; I218-L221 PolarHBondContact O-N 2.98Å; I218-L236 HydrophobicContact CG1-CD1 4.28Å; I218-L236 HydrophobicContact CG1-CD2 4.28Å; I218-I250 HydrophobicContact CD1-CB 4.42Å; I218-I250 HydrophobicContact CD1-CG1 4.19Å; I218-I250 HydrophobicContact CD1-CG2 4.44Å; I218-Q253 HydrophobicContact CD1-CB 3.74Å; I218-Q253 HydrophobicContact CD1-CG 4.46Å; I218-L258 HydrophobicContact CG2-CD1 3.84Å; I218-L258 WeakPolarHBondContact O-CD1 3.4Å
219	Q	97.6	Very high	94.3	Very high	142 Å²	142	78.7 Å²	78.7	66%	0.664	38%	0.376	S	S	*	.	H	α-helix	trans	-65.6	-36.6	173.8	-169.6	177.6	7.3	0	0	112.5	P215 E216 V217 L221 Q222	P215-Q219 PolarHBondContact O-N 3.36Å; E216-Q219 PolarHBondContact O-N 3.33Å; V217-Q219 VanDerWaalsContact C-N 3.3Å; V217-Q219 PolarHBondContact O-N 3.13Å; Q219-L221 PolarHBondContact O-N 2.88Å; Q219-Q222 PolarHBondContact O-N 3.22Å
220	M	98.1	Very high	95.8	Very high	68 Å²	68	68.5 Å²	68.5	34%	0.335	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-19.8	177.3	-71.3	173.9	-164.2	0	0	113.9	P212 E216 V217 Q222 H223 V228 A232	P212-M220 HydrophobicContact CB-CE 4.22Å; E216-M220 HydrophobicContact CB-CE 4.32Å; E216-M220 VanDerWaalsContact O-CG 3.3Å; E216-M220 WeakPolarHBondContact O-CG 3.3Å; E216-M220 PolarHBondContact O-N 2.86Å; V217-M220 WeakPolarHBondContact O-CB 3.42Å; V217-M220 PolarHBondContact O-N 2.67Å; M220-Q222 PolarHBondContact O-N 3.22Å; M220-H223 VanDerWaalsContact O-CB 3.25Å; M220-H223 WeakPolarHBondContact O-CB 3.43Å; M220-H223 PolarHBondContact O-N 3.49Å; M220-H223 VanDerWaalsContact O-N 3.11Å; M220-V228 HydrophobicContact CB-CG1 4.05Å; M220-V228 HydrophobicContact CG-CG1 4.31Å; M220-A232 HydrophobicContact CB-CB 3.66Å
221	L	98.2	Very high	96.2	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.01	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.1	171.5	-61.8	175.9	0	0	0	112.9	V217 I218 Q219 Q229 A232 A233 L236 L258 L259 L262	V217-L221 PolarHBondContact O-N 3.47Å; I218-L221 WeakPolarHBondContact O-CB 3.43Å; I218-L221 WeakPolarHBondContact O-CG 3.3Å; I218-L221 PolarHBondContact O-N 2.98Å; Q219-L221 PolarHBondContact O-N 2.88Å; L221-Q229 WeakPolarHBondContact O-CG 3.37Å; L221-Q229 PolarHBondContact O-NE2 2.91Å; L221-A232 HydrophobicContact CD2-CB 3.94Å; L221-A233 HydrophobicContact CD2-CB 3.93Å; L221-L236 HydrophobicContact CD1-CD1 3.8Å; L221-L236 HydrophobicContact CD2-CD1 4.21Å; L221-L236 HydrophobicContact CG-CD1 4.27Å; L221-L258 HydrophobicContact CB-CB 4.17Å; L221-L258 HydrophobicContact CB-CD1 4.4Å; L221-L258 HydrophobicContact CD1-CB 3.75Å; L221-L258 HydrophobicContact CD1-CD1 4.29Å; L221-L259 HydrophobicContact CD1-CD2 3.99Å; L221-L259 HydrophobicContact CD1-CG 3.91Å; L221-L259 HydrophobicContact CD2-CD2 3.84Å; L221-L262 HydrophobicContact CB-CD1 4.34Å; L221-L262 HydrophobicContact CD2-CD1 3.97Å
222	Q	97.8	Very high	96.9	Very high	135 Å²	135	60.3 Å²	60.3	63%	0.631	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	7	179	-59.6	-176.3	-62.9	0	0	113.1	Q219 M220 L258	Q219-Q222 PolarHBondContact O-N 3.22Å; M220-Q222 PolarHBondContact O-N 3.22Å; Q222-L258 HydrophobicContact CG-CD1 4.07Å; Q222-L258 HydrophobicContact CG-CD2 3.81Å; Q222-L258 HydrophobicContact CG-CG 4.5Å
223	H	97.8	Very high	97.3	Very high	72 Å²	72	58.7 Å²	58.7	33%	0.333	30%	0.297	S	S	.	.			trans	-66.5	143	-176.9	-159.5	-83.4	0	0	0	112.4	M220 F225 V228 Q229	M220-H223 VanDerWaalsContact O-CB 3.25Å; M220-H223 WeakPolarHBondContact O-CB 3.43Å; M220-H223 PolarHBondContact O-N 3.49Å; M220-H223 VanDerWaalsContact O-N 3.11Å; H223-F225 AromaticContact CE1-CD2 3.3Å; H223-F225 WeakPolarHBondContact CE1-CD2 3.25Å; H223-F225 AromaticContact CE1-CE2 3.86Å; H223-F225 AromaticContact ND1-CD2 3.59Å; H223-F225 AromaticContact ND1-CG 3.88Å; H223-F225 PolarHBondContact ND1-N 3.29Å; H223-F225 PolarHBondContact O-N 3.33Å; H223-V228 HydrophobicContact CB-CB 3.89Å; H223-V228 HydrophobicContact CB-CG1 3.59Å; H223-Q229 HydrophobicContact CB-CG 4.45Å; H223-Q229 WeakPolarHBondContact O-CG 3.39Å; H223-Q229 PolarHBondContact O-NE2 2.9Å
224	Q	96.4	Very high	97.5	Very high	154 Å²	154	54.9 Å²	54.9	72%	0.72	29%	0.285	S	S	*	.	S	Bend	trans	-61.9	-8.4	179.7	67.5	178.3	6.8	0	0	115.7
225	F	97.3	Very high	97.7	Very high	109 Å²	109	57 Å²	57	48%	0.478	29%	0.292	S	S	.	.	S	Bend	trans	-111.3	116.2	-176.9	-65.5	-43.4	0	0	0	109.6	H223 S227 V228 Q229	H223-F225 AromaticContact CE1-CD2 3.3Å; H223-F225 WeakPolarHBondContact CE1-CD2 3.25Å; H223-F225 AromaticContact CE1-CE2 3.86Å; H223-F225 AromaticContact ND1-CD2 3.59Å; H223-F225 AromaticContact ND1-CG 3.88Å; H223-F225 PolarHBondContact ND1-N 3.29Å; H223-F225 PolarHBondContact O-N 3.33Å; F225-S227 PolarHBondContact O-N 3.4Å; F225-S227 VanDerWaalsContact O-N 3.12Å; F225-V228 HydrophobicContact CB-CB 4.4Å; F225-V228 HydrophobicContact CB-CG2 3.99Å; F225-V228 HydrophobicContact CD2-CG2 4.49Å; F225-V228 WeakPolarHBondContact O-CB 3.46Å; F225-V228 PolarHBondContact O-N 3.35Å; F225-Q229 PolarHBondContact O-N 3.38Å
226	P	97.3	Very high	97.7	Very high	25 Å²	25	53.8 Å²	53.8	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-55.2	-31.3	-178.9	-31.8	38.4	0	0	0	114.9	Q229 S230 M267 V270	P226-Q229 PolarHBondContact O-N 3.41Å; P226-S230 VanDerWaalsContact O-CB 3.28Å; P226-S230 WeakPolarHBondContact O-CB 3.46Å; P226-S230 PolarHBondContact O-N 2.87Å; P226-M267 HydrophobicContact CB-CE 4.22Å; P226-M267 HydrophobicContact CB-SD 3.42Å; P226-M267 WeakPolarHBondContact CB-SD 3.41Å; P226-M267 HydrophobicContact CG-SD 3.62Å; P226-V270 HydrophobicContact CB-CG2 3.93Å; P226-V270 WeakPolarHBondContact O-CG2 3.16Å
227	S	97.4	Very high	97.7	Very high	66 Å²	66	52.5 Å²	52.5	46%	0.462	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-37.8	174.2	51.6	0	0	0	0	112.4	F225 N231	F225-S227 PolarHBondContact O-N 3.4Å; F225-S227 VanDerWaalsContact O-N 3.12Å; S227-N231 WeakPolarHBondContact O-CB 3.28Å; S227-N231 PolarHBondContact O-N 3.37Å; S227-N231 PolarHBondContact O-ND2 3.2Å
228	V	97.8	Very high	97.7	Very high	42 Å²	42	59 Å²	59	26%	0.255	30%	0.296	S	S	.	.	H	α-helix	trans	-69.4	-43	175.4	178.4	0	0	0	0	110.2	M220 H223 F225 S230 N231 A232	M220-V228 HydrophobicContact CB-CG1 4.05Å; M220-V228 HydrophobicContact CG-CG1 4.31Å; H223-V228 HydrophobicContact CB-CB 3.89Å; H223-V228 HydrophobicContact CB-CG1 3.59Å; F225-V228 HydrophobicContact CB-CB 4.4Å; F225-V228 HydrophobicContact CB-CG2 3.99Å; F225-V228 HydrophobicContact CD2-CG2 4.49Å; F225-V228 WeakPolarHBondContact O-CB 3.46Å; F225-V228 PolarHBondContact O-N 3.35Å; V228-S230 PolarHBondContact O-N 3Å; V228-N231 PolarHBondContact O-N 3.04Å; V228-A232 VanDerWaalsContact O-CB 3.26Å; V228-A232 WeakPolarHBondContact O-CB 3.39Å; V228-A232 PolarHBondContact O-N 3.12Å
229	Q	98.3	Very high	97.5	Very high	24 Å²	24	60.9 Å²	60.9	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-43.5	176.9	-55.6	-179.3	-68.1	0	0	112	L221 H223 F225 P226 A233 L262	L221-Q229 WeakPolarHBondContact O-CG 3.37Å; L221-Q229 PolarHBondContact O-NE2 2.91Å; H223-Q229 HydrophobicContact CB-CG 4.45Å; H223-Q229 WeakPolarHBondContact O-CG 3.39Å; H223-Q229 PolarHBondContact O-NE2 2.9Å; F225-Q229 PolarHBondContact O-N 3.38Å; P226-Q229 PolarHBondContact O-N 3.41Å; Q229-A233 WeakPolarHBondContact O-CB 3.37Å; Q229-A233 PolarHBondContact O-N 3.05Å; Q229-L262 HydrophobicContact CB-CD2 4.39Å
230	S	98	Very high	97.3	Very high	4 Å²	4	54.1 Å²	54.1	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-50.5	176.5	-177.4	0	0	0	0	111.5	P226 V228 A232 A233 A234 E269 S273	P226-S230 VanDerWaalsContact O-CB 3.28Å; P226-S230 WeakPolarHBondContact O-CB 3.46Å; P226-S230 PolarHBondContact O-N 2.87Å; V228-S230 PolarHBondContact O-N 3Å; S230-A232 PolarHBondContact O-N 2.85Å; S230-A233 PolarHBondContact O-N 3.14Å; S230-A234 WeakPolarHBondContact O-CB 3.48Å; S230-A234 PolarHBondContact O-N 3.13Å; S230-E269 WeakPolarHBondContact CB-OE1 3.39Å; S230-E269 PolarHBondContact OG-OE1 3.26Å; S230-S273 VanDerWaalsContact O-CB 3.3Å; S230-S273 WeakPolarHBondContact O-CB 3.39Å; S230-S273 PolarHBondContact O-OG 2.89Å; S230-S273 PolarHBondContact OG-OG 3.25Å
231	N	97.8	Very high	96.9	Very high	108 Å²	108	58.6 Å²	58.6	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-63.6	-40.4	178.3	-79.2	-66.3	0	0	0	112.3	S227 V228 A234 Y235	S227-N231 WeakPolarHBondContact O-CB 3.28Å; S227-N231 PolarHBondContact O-N 3.37Å; S227-N231 PolarHBondContact O-ND2 3.2Å; V228-N231 PolarHBondContact O-N 3.04Å; N231-A234 PolarHBondContact O-N 3.15Å; N231-Y235 WeakPolarHBondContact O-CB 3.16Å; N231-Y235 PolarHBondContact O-N 3.34Å
232	A	98.3	Very high	96.3	Very high	5 Å²	5	61.7 Å²	61.7	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-45.3	175.3	0	0	0	0	0	111.7	V217 M220 L221 V228 S230 Y235 L236	V217-A232 HydrophobicContact CG1-CB 4.09Å; M220-A232 HydrophobicContact CB-CB 3.66Å; L221-A232 HydrophobicContact CD2-CB 3.94Å; V228-A232 VanDerWaalsContact O-CB 3.26Å; V228-A232 WeakPolarHBondContact O-CB 3.39Å; V228-A232 PolarHBondContact O-N 3.12Å; S230-A232 PolarHBondContact O-N 2.85Å; A232-Y235 PolarHBondContact O-N 2.91Å; A232-L236 WeakPolarHBondContact O-CG 3.39Å; A232-L236 PolarHBondContact O-N 3.5Å
233	A	98.5	Very high	96.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-40.7	175.4	0	0	0	0	0	112.3	L221 Q229 S230 L236 Q237 L259 A277	L221-A233 HydrophobicContact CD2-CB 3.93Å; Q229-A233 WeakPolarHBondContact O-CB 3.37Å; Q229-A233 PolarHBondContact O-N 3.05Å; S230-A233 PolarHBondContact O-N 3.14Å; A233-L236 PolarHBondContact O-N 2.94Å; A233-Q237 WeakPolarHBondContact O-CB 3.19Å; A233-Q237 PolarHBondContact O-N 3.22Å; A233-L259 HydrophobicContact CB-CD2 3.86Å; A233-A277 WeakPolarHBondContact O-CB 3.19Å
234	A	98	Very high	96.1	Very high	36 Å²	36	58.5 Å²	58.5	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-64.7	-37.8	175.1	0	0	0	0	0	112.6	S230 N231 Q237 H238	S230-A234 WeakPolarHBondContact O-CB 3.48Å; S230-A234 PolarHBondContact O-N 3.13Å; N231-A234 PolarHBondContact O-N 3.15Å; A234-Q237 WeakPolarHBondContact O-CB 3.28Å; A234-Q237 PolarHBondContact O-N 3.22Å; A234-H238 PolarHBondContact O-N 3.48Å
235	Y	97.6	Very high	96.1	Very high	65 Å²	65	59.6 Å²	59.6	26%	0.255	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-44.9	173.8	-166.2	-99.4	0	0	0	111.2	D211 P212 V217 N231 A232 Q237 H238 L239	D211-Y235 PolarHBondContact OD1-OH 3.34Å; P212-Y235 HydrophobicContact CG-CD1 4.49Å; P212-Y235 HydrophobicContact CG-CE1 3.98Å; V217-Y235 HydrophobicContact CB-CD1 4.46Å; V217-Y235 HydrophobicContact CG1-CD1 3.97Å; V217-Y235 HydrophobicContact CG2-CD1 3.69Å; V217-Y235 HydrophobicContact CG2-CE1 3.85Å; N231-Y235 WeakPolarHBondContact O-CB 3.16Å; N231-Y235 PolarHBondContact O-N 3.34Å; A232-Y235 PolarHBondContact O-N 2.91Å; Y235-Q237 VanDerWaalsContact C-N 3.3Å; Y235-Q237 PolarHBondContact O-N 2.84Å; Y235-H238 WeakPolarHBondContact O-CB 3.34Å; Y235-H238 PolarHBondContact O-N 2.92Å; Y235-H238 VanDerWaalsContact O-N 3.15Å; Y235-L239 HydrophobicContact CD1-CD1 3.75Å; Y235-L239 HydrophobicContact CD1-CG 4.02Å; Y235-L239 HydrophobicContact CE1-CD1 3.58Å; Y235-L239 HydrophobicContact CE1-CD2 4.21Å; Y235-L239 HydrophobicContact CE1-CG 3.95Å; Y235-L239 WeakPolarHBondContact O-CG 3.45Å; Y235-L239 PolarHBondContact O-N 3.32Å
236	L	97.9	Very high	96.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-37.6	172.4	-66.4	-179.2	0	0	0	112.5	L214 V217 I218 L221 A232 A233 H238 L239 C240 I250 L259	L214-L236 HydrophobicContact CD1-CD2 3.53Å; V217-L236 HydrophobicContact CB-CD2 4.15Å; V217-L236 HydrophobicContact CG1-CD1 4.43Å; V217-L236 HydrophobicContact CG1-CD2 3.66Å; V217-L236 HydrophobicContact CG1-CG 3.69Å; I218-L236 HydrophobicContact CG1-CD1 4.28Å; I218-L236 HydrophobicContact CG1-CD2 4.28Å; L221-L236 HydrophobicContact CD1-CD1 3.8Å; L221-L236 HydrophobicContact CD2-CD1 4.21Å; L221-L236 HydrophobicContact CG-CD1 4.27Å; A232-L236 WeakPolarHBondContact O-CG 3.39Å; A232-L236 PolarHBondContact O-N 3.5Å; A233-L236 PolarHBondContact O-N 2.94Å; L236-H238 VanDerWaalsContact C-N 3.32Å; L236-H238 PolarHBondContact O-N 3.06Å; L236-L239 PolarHBondContact O-N 3.22Å; L236-C240 WeakPolarHBondContact O-CB 3.22Å; L236-C240 PolarHBondContact O-N 3.15Å; L236-C240 PolarHBondContact O-SG 3.23Å; L236-I250 HydrophobicContact CD2-CD1 3.95Å; L236-I250 HydrophobicContact CD2-CG1 4.23Å; L236-L259 HydrophobicContact CD1-CD1 4.34Å
237	Q	97.3	Very high	96.1	Very high	36 Å²	36	55.7 Å²	55.7	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-44.1	174.3	-179.4	-177.7	9	0	0	111.6	A233 A234 Y235 A277 N280	A233-Q237 WeakPolarHBondContact O-CB 3.19Å; A233-Q237 PolarHBondContact O-N 3.22Å; A234-Q237 WeakPolarHBondContact O-CB 3.28Å; A234-Q237 PolarHBondContact O-N 3.22Å; Y235-Q237 VanDerWaalsContact C-N 3.3Å; Y235-Q237 PolarHBondContact O-N 2.84Å; Q237-A277 HydrophobicContact CB-CB 4.12Å; Q237-N280 WeakPolarHBondContact CG-ND2 3.48Å; Q237-N280 PolarHBondContact O-ND2 2.94Å
238	H	95.9	Very high	96.1	Very high	137 Å²	137	54.2 Å²	54.2	63%	0.634	29%	0.29	S	S	*	.	H	α-helix	trans	-64.1	-52.2	175.7	177	72.1	0	0	0	111.6	A234 Y235 L236 C240 F241	A234-H238 PolarHBondContact O-N 3.48Å; Y235-H238 WeakPolarHBondContact O-CB 3.34Å; Y235-H238 PolarHBondContact O-N 2.92Å; Y235-H238 VanDerWaalsContact O-N 3.15Å; L236-H238 VanDerWaalsContact C-N 3.32Å; L236-H238 PolarHBondContact O-N 3.06Å; H238-C240 PolarHBondContact O-N 3.45Å; H238-F241 VanDerWaalsContact O-CB 3.25Å; H238-F241 WeakPolarHBondContact O-CB 3.36Å; H238-F241 PolarHBondContact O-N 3.27Å
239	L	94	Very high	96.1	Very high	48 Å²	48	54.3 Å²	54.3	25%	0.251	29%	0.287	S	S	.	.	H	α-helix	trans	-59.8	-29.3	179.3	-66	-176	0	0	0	113.3	L214 Y235 L236 F241 I246	L214-L239 HydrophobicContact CD1-CD1 4.04Å; Y235-L239 HydrophobicContact CD1-CD1 3.75Å; Y235-L239 HydrophobicContact CD1-CG 4.02Å; Y235-L239 HydrophobicContact CE1-CD1 3.58Å; Y235-L239 HydrophobicContact CE1-CD2 4.21Å; Y235-L239 HydrophobicContact CE1-CG 3.95Å; Y235-L239 WeakPolarHBondContact O-CG 3.45Å; Y235-L239 PolarHBondContact O-N 3.32Å; L236-L239 PolarHBondContact O-N 3.22Å; L239-F241 VanDerWaalsContact C-N 3.25Å; L239-F241 PolarHBondContact O-N 2.96Å; L239-I246 HydrophobicContact CB-CG2 3.96Å
240	C	92.8	Very high	96.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-4.3	174.9	-70.2	0	0	0	0	114.4	L236 H238 G242 K247 I250 N280 L281	L236-C240 WeakPolarHBondContact O-CB 3.22Å; L236-C240 PolarHBondContact O-N 3.15Å; L236-C240 PolarHBondContact O-SG 3.23Å; H238-C240 PolarHBondContact O-N 3.45Å; C240-G242 PolarHBondContact O-N 3.42Å; C240-G242 VanDerWaalsContact O-N 3.17Å; C240-K247 HydrophobicContact CB-CG 4.03Å; C240-K247 WeakPolarHBondContact O-CE 3.48Å; C240-I250 WeakPolarHBondContact SG-CD1 3.39Å; C240-N280 HydrophobicContact CB-CB 3.72Å; C240-L281 WeakPolarHBondContact SG-CD2 3.5Å
241	F	91.3	Very high	96.2	Very high	163 Å²	163	56.4 Å²	56.4	72%	0.715	29%	0.294	S	S	*	.	S	Bend	trans	-77	106.7	-176.4	-168.9	-96.7	0	0	0	111.1	H238 L239 D243	H238-F241 VanDerWaalsContact O-CB 3.25Å; H238-F241 WeakPolarHBondContact O-CB 3.36Å; H238-F241 PolarHBondContact O-N 3.27Å; L239-F241 VanDerWaalsContact C-N 3.25Å; L239-F241 PolarHBondContact O-N 2.96Å; F241-D243 VanDerWaalsContact C-N 3.25Å; F241-D243 PolarHBondContact O-N 3.06Å
242	G	85.3	Confident	96.2	Very high	66 Å²	66	60.2 Å²	60.2	68%	0.68	30%	0.3	S	S	*	.	S	Bend	trans	82.5	-25.5	178.8	0	0	0	0	0	115.7	C240	C240-G242 PolarHBondContact O-N 3.42Å; C240-G242 VanDerWaalsContact O-N 3.17Å
243	D	93.8	Very high	96.2	Very high	65 Å²	65	63.1 Å²	63.1	35%	0.348	31%	0.313	S	S	.	.			trans	-88.9	114.9	-178.2	-164.7	-44.9	0	0	0	112.7	F241 K245 I246 K247	F241-D243 VanDerWaalsContact C-N 3.25Å; F241-D243 PolarHBondContact O-N 3.06Å; D243-K245 VanDerWaalsContact OD1-CA 3.32Å; D243-K245 WeakPolarHBondContact OD1-CA 3.28Å; D243-K245 VanDerWaalsContact OD1-CB 3.29Å; D243-K245 WeakPolarHBondContact OD1-CB 3.43Å; D243-K245 PolarHBondContact OD1-N 3.3Å; D243-I246 HydrophobicContact CB-CB 4.16Å; D243-I246 HydrophobicContact CB-CG1 4.08Å; D243-I246 PolarHBondContact OD1-N 2.68Å; D243-K247 WeakPolarHBondContact O-CD 3.46Å; D243-K247 WeakPolarHBondContact O-CE 3.42Å; D243-K247 WeakPolarHBondContact O-CG 3.42Å
244	N	96.3	Very high	96.2	Very high	76 Å²	76	64.8 Å²	64.8	41%	0.406	33%	0.33	S	S	.	.	H	α-helix	trans	-83.2	-21.5	176.3	-64	-43.1	0	0	0	113.9	A248 N287	N244-A248 WeakPolarHBondContact O-CB 3.41Å; N244-A248 PolarHBondContact O-N 2.76Å; N244-A248 VanDerWaalsContact O-N 3.1Å; N244-N287 PolarHBondContact OD1-ND2 3.2Å
245	K	96.9	Very high	96.2	Very high	177 Å²	177	63.1 Å²	63.1	77%	0.77	32%	0.316	S	S	*	.	H	α-helix	trans	-70.6	-47.3	176.1	-61.4	178.6	-180	176.3	0	110.1	D243 K247 A248 E249	D243-K245 VanDerWaalsContact OD1-CA 3.32Å; D243-K245 WeakPolarHBondContact OD1-CA 3.28Å; D243-K245 VanDerWaalsContact OD1-CB 3.29Å; D243-K245 WeakPolarHBondContact OD1-CB 3.43Å; D243-K245 PolarHBondContact OD1-N 3.3Å; K245-K247 VanDerWaalsContact C-N 3.33Å; K245-K247 PolarHBondContact O-N 2.7Å; K245-A248 PolarHBondContact O-N 3.09Å; K245-E249 WeakPolarHBondContact O-CB 3.25Å; K245-E249 PolarHBondContact O-N 2.71Å
246	I	96.9	Very high	96.3	Very high	47 Å²	47	60.1 Å²	60.1	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-44.2	176.1	-66.8	-65.6	0	0	0	111	L214 L239 D243 A248 E249 I250	L214-I246 HydrophobicContact CD2-CD1 4.35Å; L239-I246 HydrophobicContact CB-CG2 3.96Å; D243-I246 HydrophobicContact CB-CB 4.16Å; D243-I246 HydrophobicContact CB-CG1 4.08Å; D243-I246 PolarHBondContact OD1-N 2.68Å; I246-A248 VanDerWaalsContact C-N 3.34Å; I246-A248 PolarHBondContact O-N 3.16Å; I246-E249 PolarHBondContact O-N 2.76Å; I246-E249 VanDerWaalsContact O-N 3.15Å; I246-I250 HydrophobicContact CG2-CD1 3.76Å; I246-I250 HydrophobicContact CG2-CG1 4.42Å; I246-I250 WeakPolarHBondContact O-CG1 3.5Å; I246-I250 PolarHBondContact O-N 2.7Å
247	K	98.2	Very high	96.3	Very high	5 Å²	5	63.4 Å²	63.4	2%	0.022	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-43.7	174.9	-68.5	174.9	-166.5	-167.6	0	112.9	C240 D243 K245 E249 R251 N280 L281 Y283 N287	C240-K247 HydrophobicContact CB-CG 4.03Å; C240-K247 WeakPolarHBondContact O-CE 3.48Å; D243-K247 WeakPolarHBondContact O-CD 3.46Å; D243-K247 WeakPolarHBondContact O-CE 3.42Å; D243-K247 WeakPolarHBondContact O-CG 3.42Å; K245-K247 VanDerWaalsContact C-N 3.33Å; K245-K247 PolarHBondContact O-N 2.7Å; K247-E249 VanDerWaalsContact C-N 3.31Å; K247-R251 PolarHBondContact O-N 2.93Å; K247-N280 WeakPolarHBondContact CE-O 3.39Å; K247-N280 PolarHBondContact NZ-O 3.05Å; K247-L281 HydrophobicContact CB-CD2 4.12Å; K247-L281 HydrophobicContact CG-CD2 4.17Å; K247-Y283 PolarHBondContact NZ-O 3.38Å; K247-N287 WeakPolarHBondContact CD-ND2 3.44Å
248	A	98	Very high	96.4	Very high	35 Å²	35	63 Å²	63	29%	0.289	32%	0.319	S	S	.	.	H	α-helix	trans	-66.3	-34.6	176.9	0	0	0	0	0	112	N244 K245 I246 R251 R252	N244-A248 WeakPolarHBondContact O-CB 3.41Å; N244-A248 PolarHBondContact O-N 2.76Å; N244-A248 VanDerWaalsContact O-N 3.1Å; K245-A248 PolarHBondContact O-N 3.09Å; I246-A248 VanDerWaalsContact C-N 3.34Å; I246-A248 PolarHBondContact O-N 3.16Å; A248-R251 WeakPolarHBondContact O-CB 3.38Å; A248-R251 PolarHBondContact O-N 3.32Å; A248-R252 PolarHBondContact O-N 3.02Å
249	E	98	Very high	96.5	Very high	43 Å²	43	56.4 Å²	56.4	20%	0.201	29%	0.288	C	S	.	.	H	α-helix	trans	-71.2	-42.8	177.9	-172.5	55.7	-151.8	0	0	112.5	L214 K245 I246 K247 R251 R252 Q253	L214-E249 HydrophobicContact CD2-CB 3.96Å; L214-E249 HydrophobicContact CD2-CG 3.59Å; K245-E249 WeakPolarHBondContact O-CB 3.25Å; K245-E249 PolarHBondContact O-N 2.71Å; I246-E249 PolarHBondContact O-N 2.76Å; I246-E249 VanDerWaalsContact O-N 3.15Å; K247-E249 VanDerWaalsContact C-N 3.31Å; E249-R251 VanDerWaalsContact C-N 3.26Å; E249-R251 PolarHBondContact O-N 3.31Å; E249-R252 VanDerWaalsContact CD-NE 3.35Å; E249-R252 VanDerWaalsContact CD-NH2 3.26Å; E249-R252 WeakPolarHBondContact O-CA 3.47Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 2.97Å; E249-R252 IonicContact OE1-CZ 3.58Å; E249-R252 IonicContact OE1-NE 3.09Å; E249-R252 PolarHBondContact OE1-NE 3.48Å; E249-R252 VanDerWaalsContact OE1-NE 3.16Å; E249-R252 IonicContact OE1-NH2 2.67Å; E249-R252 PolarHBondContact OE1-NH2 2.89Å; E249-R252 IonicContact OE2-CZ 3.55Å; E249-R252 VanDerWaalsContact OE2-CZ 3.23Å; E249-R252 IonicContact OE2-NE 2.86Å; E249-R252 PolarHBondContact OE2-NE 3.22Å; E249-R252 IonicContact OE2-NH2 3.81Å; E249-R252 PolarHBondContact OE2-NH2 2.87Å; E249-R252 VanDerWaalsContact OE2-NH2 3.09Å; E249-Q253 PolarHBondContact O-N 3.08Å; E249-Q253 WeakPolarHBondContact OE1-CG 3.35Å; E249-Q253 PolarHBondContact OE1-NE2 3.13Å
250	I	98.4	Very high	96.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.8	-40.9	172.9	-69.5	161.2	0	0	0	110.9	L214 I218 L236 C240 I246 G254 G255 L281	L214-I250 HydrophobicContact CD1-CD1 4.21Å; L214-I250 HydrophobicContact CD1-CG1 3.79Å; L214-I250 HydrophobicContact CD2-CG1 4.15Å; L214-I250 HydrophobicContact CG-CG1 4.38Å; I218-I250 HydrophobicContact CD1-CB 4.42Å; I218-I250 HydrophobicContact CD1-CG1 4.19Å; I218-I250 HydrophobicContact CD1-CG2 4.44Å; L236-I250 HydrophobicContact CD2-CD1 3.95Å; L236-I250 HydrophobicContact CD2-CG1 4.23Å; C240-I250 WeakPolarHBondContact SG-CD1 3.39Å; I246-I250 HydrophobicContact CG2-CD1 3.76Å; I246-I250 HydrophobicContact CG2-CG1 4.42Å; I246-I250 WeakPolarHBondContact O-CG1 3.5Å; I246-I250 PolarHBondContact O-N 2.7Å; I250-G254 PolarHBondContact O-N 2.76Å; I250-G255 PolarHBondContact O-N 3.12Å; I250-L281 HydrophobicContact CB-CD2 3.93Å; I250-L281 HydrophobicContact CD1-CD2 4Å; I250-L281 HydrophobicContact CG2-CD1 4.14Å; I250-L281 HydrophobicContact CG2-CD2 3.81Å
251	R	98.4	Very high	97	Very high	73 Å²	73	58.5 Å²	58.5	28%	0.275	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-48.5	171.3	177.6	-172.1	57.4	127.8	-9.6	111.5	K247 A248 E249 Q253 G254 I256 E289 N290 T293	K247-R251 PolarHBondContact O-N 2.93Å; A248-R251 WeakPolarHBondContact O-CB 3.38Å; A248-R251 PolarHBondContact O-N 3.32Å; E249-R251 VanDerWaalsContact C-N 3.26Å; E249-R251 PolarHBondContact O-N 3.31Å; R251-Q253 PolarHBondContact O-N 3.4Å; R251-G254 PolarHBondContact O-N 3.44Å; R251-I256 HydrophobicContact CB-CD1 3.75Å; R251-I256 HydrophobicContact CB-CG1 4.39Å; R251-I256 HydrophobicContact CG-CD1 3.97Å; R251-E289 IonicContact CZ-OE2 3.18Å; R251-E289 IonicContact NH1-OE2 2.87Å; R251-E289 PolarHBondContact NH1-OE2 3.19Å; R251-E289 IonicContact NH2-OE2 3.63Å; R251-E289 PolarHBondContact NH2-OE2 3.46Å; R251-N290 VanDerWaalsContact CD-OD1 3.22Å; R251-N290 WeakPolarHBondContact CD-OD1 3.22Å; R251-N290 PolarHBondContact NE-OD1 2.93Å; R251-T293 VanDerWaalsContact CD-OG1 3.25Å; R251-T293 WeakPolarHBondContact CD-OG1 3.36Å; R251-T293 HydrophobicContact CG-CG2 4.09Å
252	R	98.3	Very high	97.3	Very high	188 Å²	188	51.2 Å²	51.2	71%	0.709	27%	0.269	S	S	*	.	H	α-helix	trans	-58.7	-36.5	-178.1	-171.1	175.8	73.6	132.3	3.4	112.2	A248 E249 G254	A248-R252 PolarHBondContact O-N 3.02Å; E249-R252 VanDerWaalsContact CD-NE 3.35Å; E249-R252 VanDerWaalsContact CD-NH2 3.26Å; E249-R252 WeakPolarHBondContact O-CA 3.47Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 2.97Å; E249-R252 IonicContact OE1-CZ 3.58Å; E249-R252 IonicContact OE1-NE 3.09Å; E249-R252 PolarHBondContact OE1-NE 3.48Å; E249-R252 VanDerWaalsContact OE1-NE 3.16Å; E249-R252 IonicContact OE1-NH2 2.67Å; E249-R252 PolarHBondContact OE1-NH2 2.89Å; E249-R252 IonicContact OE2-CZ 3.55Å; E249-R252 VanDerWaalsContact OE2-CZ 3.23Å; E249-R252 IonicContact OE2-NE 2.86Å; E249-R252 PolarHBondContact OE2-NE 3.22Å; E249-R252 IonicContact OE2-NH2 3.81Å; E249-R252 PolarHBondContact OE2-NH2 2.87Å; E249-R252 VanDerWaalsContact OE2-NH2 3.09Å; R252-G254 VanDerWaalsContact C-N 3.3Å; R252-G254 PolarHBondContact O-N 3.34Å
253	Q	98.1	Very high	98	Very high	65 Å²	65	48.2 Å²	48.2	30%	0.304	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	9.3	177.1	-62	-173.9	31.9	0	0	113.9	P215 I218 E249 R251 G255	P215-Q253 VanDerWaalsContact CA-OE1 3.27Å; I218-Q253 HydrophobicContact CD1-CB 3.74Å; I218-Q253 HydrophobicContact CD1-CG 4.46Å; E249-Q253 PolarHBondContact O-N 3.08Å; E249-Q253 WeakPolarHBondContact OE1-CG 3.35Å; E249-Q253 PolarHBondContact OE1-NE2 3.13Å; R251-Q253 PolarHBondContact O-N 3.4Å; Q253-G255 VanDerWaalsContact C-N 3.27Å; Q253-G255 PolarHBondContact O-N 3Å
254	G	98.2	Very high	98.1	Very high	36 Å²	36	48.8 Å²	48.8	37%	0.371	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.6	176.1	0	0	0	0	0	115.6	I250 R251 R252 I256 Q257	I250-G254 PolarHBondContact O-N 2.76Å; R251-G254 PolarHBondContact O-N 3.44Å; R252-G254 VanDerWaalsContact C-N 3.3Å; R252-G254 PolarHBondContact O-N 3.34Å; G254-I256 PolarHBondContact O-N 2.88Å; G254-Q257 PolarHBondContact O-N 3.32Å
255	G	98.6	Very high	98.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-21.5	-176.1	0	0	0	0	0	114.8	I250 Q253 L258 L259	I250-G255 PolarHBondContact O-N 3.12Å; Q253-G255 VanDerWaalsContact C-N 3.27Å; Q253-G255 PolarHBondContact O-N 3Å; G255-L258 PolarHBondContact O-N 3.16Å; G255-L259 WeakPolarHBondContact O-CG 3.29Å; G255-L259 PolarHBondContact O-N 3.36Å
256	I	98.8	Very high	98.1	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-39.5	172	-65.7	-177.1	0	0	0	111.7	R251 G254 V260 L281 N290 T293 L294	R251-I256 HydrophobicContact CB-CD1 3.75Å; R251-I256 HydrophobicContact CB-CG1 4.39Å; R251-I256 HydrophobicContact CG-CD1 3.97Å; G254-I256 PolarHBondContact O-N 2.88Å; I256-V260 WeakPolarHBondContact O-CG2 3.45Å; I256-V260 PolarHBondContact O-N 3.45Å; I256-L281 HydrophobicContact CG1-CD1 4.37Å; I256-N290 HydrophobicContact CD1-CB 3.88Å; I256-T293 HydrophobicContact CB-CG2 4.4Å; I256-T293 HydrophobicContact CD1-CG2 4.3Å; I256-T293 HydrophobicContact CG2-CG2 4.31Å; I256-L294 HydrophobicContact CG2-CB 3.93Å
257	Q	98.7	Very high	98.1	Very high	69 Å²	69	50.4 Å²	50.4	32%	0.322	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-48.4	177.7	-176.5	64.1	62.4	0	0	110.1	G254 L259 V260 D261 C297	G254-Q257 PolarHBondContact O-N 3.32Å; Q257-L259 VanDerWaalsContact C-N 3.32Å; Q257-L259 PolarHBondContact O-N 2.96Å; Q257-V260 CarbonylContact O-C 3.58Å; Q257-V260 WeakPolarHBondContact O-CA 3.35Å; Q257-V260 WeakPolarHBondContact O-CB 3.43Å; Q257-V260 PolarHBondContact O-N 3.38Å; Q257-D261 PolarHBondContact NE2-OD1 3.45Å; Q257-D261 PolarHBondContact O-N 3.3Å; Q257-C297 PolarHBondContact NE2-O 2.78Å; Q257-C297 VanDerWaalsContact OE1-CA 3.32Å; Q257-C297 PolarHBondContact OE1-SG 3.48Å
258	L	98.8	Very high	98	Very high	27 Å²	27	52.9 Å²	52.9	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-42.7	179.9	-57.2	-178.2	0	0	0	111.9	I218 L221 Q222 G255 V260 D261 L262	I218-L258 HydrophobicContact CG2-CD1 3.84Å; I218-L258 WeakPolarHBondContact O-CD1 3.4Å; L221-L258 HydrophobicContact CB-CB 4.17Å; L221-L258 HydrophobicContact CB-CD1 4.4Å; L221-L258 HydrophobicContact CD1-CB 3.75Å; L221-L258 HydrophobicContact CD1-CD1 4.29Å; Q222-L258 HydrophobicContact CG-CD1 4.07Å; Q222-L258 HydrophobicContact CG-CD2 3.81Å; Q222-L258 HydrophobicContact CG-CG 4.5Å; G255-L258 PolarHBondContact O-N 3.16Å; L258-V260 VanDerWaalsContact C-N 3.32Å; L258-V260 PolarHBondContact O-N 3.01Å; L258-D261 PolarHBondContact O-N 2.99Å; L258-L262 WeakPolarHBondContact O-CG 3.49Å; L258-L262 PolarHBondContact O-N 3.36Å; L258-L262 VanDerWaalsContact O-N 3.13Å
259	L	98.8	Very high	98	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.3	-30	175	-71.1	170.6	0	0	0	113.4	L221 A233 L236 G255 Q257 L262 A274 A277 L278 L281	L221-L259 HydrophobicContact CD1-CD2 3.99Å; L221-L259 HydrophobicContact CD1-CG 3.91Å; L221-L259 HydrophobicContact CD2-CD2 3.84Å; A233-L259 HydrophobicContact CB-CD2 3.86Å; L236-L259 HydrophobicContact CD1-CD1 4.34Å; G255-L259 WeakPolarHBondContact O-CG 3.29Å; G255-L259 PolarHBondContact O-N 3.36Å; Q257-L259 VanDerWaalsContact C-N 3.32Å; Q257-L259 PolarHBondContact O-N 2.96Å; L259-L262 HydrophobicContact CD2-CD1 4.48Å; L259-A274 HydrophobicContact CD2-CB 4.43Å; L259-A277 HydrophobicContact CD1-CB 3.84Å; L259-A277 HydrophobicContact CD2-CB 3.94Å; L259-L278 HydrophobicContact CB-CD1 4.46Å; L259-L278 HydrophobicContact CB-CD2 3.62Å; L259-L278 HydrophobicContact CB-CG 3.94Å; L259-L278 HydrophobicContact CD1-CD2 4.23Å; L259-L281 HydrophobicContact CD1-CD1 3.36Å
260	V	98.8	Very high	98	Very high	6 Å²	6	53.3 Å²	53.3	4%	0.036	25%	0.252	C	S	.	.	H	α-helix	trans	-71.6	-40.3	172.2	166.3	0	0	0	0	111.1	I256 Q257 L258 L262 L263 L278 L294 C297 A302	I256-V260 WeakPolarHBondContact O-CG2 3.45Å; I256-V260 PolarHBondContact O-N 3.45Å; Q257-V260 CarbonylContact O-C 3.58Å; Q257-V260 WeakPolarHBondContact O-CA 3.35Å; Q257-V260 WeakPolarHBondContact O-CB 3.43Å; Q257-V260 PolarHBondContact O-N 3.38Å; L258-V260 VanDerWaalsContact C-N 3.32Å; L258-V260 PolarHBondContact O-N 3.01Å; V260-L262 VanDerWaalsContact C-N 3.28Å; V260-L262 PolarHBondContact O-N 3.43Å; V260-L263 WeakPolarHBondContact O-CB 3.33Å; V260-L263 WeakPolarHBondContact O-CG 3.28Å; V260-L263 PolarHBondContact O-N 3Å; V260-L278 HydrophobicContact CG2-CD1 4.34Å; V260-L278 HydrophobicContact CG2-CD2 4.36Å; V260-L294 HydrophobicContact CG2-CG 4.16Å; V260-C297 HydrophobicContact CB-CB 4.42Å; V260-C297 HydrophobicContact CG1-CB 4.45Å; V260-C297 HydrophobicContact CG2-CB 4.24Å; V260-A302 HydrophobicContact CG1-CB 4.18Å
261	D	98.4	Very high	98	Very high	85 Å²	85	54.8 Å²	54.8	46%	0.455	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-36.1	178.2	-58.3	-24	0	0	0	111.4	Q257 L258 L263 D264	Q257-D261 PolarHBondContact NE2-OD1 3.45Å; Q257-D261 PolarHBondContact O-N 3.3Å; L258-D261 PolarHBondContact O-N 2.99Å; D261-L263 PolarHBondContact O-N 3.32Å; D261-L263 VanDerWaalsContact O-N 3.15Å; D261-D264 PolarHBondContact O-N 3.47Å
262	L	98.6	Very high	98	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.058	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-63.8	-13.5	174	-68.6	179.9	0	0	0	114.2	L221 Q229 L258 L259 V260 D264 H265 V270 H271 A274	L221-L262 HydrophobicContact CB-CD1 4.34Å; L221-L262 HydrophobicContact CD2-CD1 3.97Å; Q229-L262 HydrophobicContact CB-CD2 4.39Å; L258-L262 WeakPolarHBondContact O-CG 3.49Å; L258-L262 PolarHBondContact O-N 3.36Å; L258-L262 VanDerWaalsContact O-N 3.13Å; L259-L262 HydrophobicContact CD2-CD1 4.48Å; V260-L262 VanDerWaalsContact C-N 3.28Å; V260-L262 PolarHBondContact O-N 3.43Å; L262-D264 VanDerWaalsContact C-N 3.31Å; L262-D264 PolarHBondContact O-N 3.43Å; L262-H265 WeakPolarHBondContact O-CB 3.43Å; L262-H265 PolarHBondContact O-N 2.96Å; L262-V270 HydrophobicContact CB-CG1 4.02Å; L262-V270 HydrophobicContact CD1-CG1 4.28Å; L262-V270 HydrophobicContact CD2-CG1 3.89Å; L262-V270 HydrophobicContact CG-CG1 4.28Å; L262-H271 PolarHBondContact O-CD2 2.88Å; L262-A274 HydrophobicContact CB-CB 3.89Å; L262-A274 HydrophobicContact CD1-CB 4.45Å
263	L	98.3	Very high	98	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-72	-22.6	175.8	-59	179.2	0	0	0	113.4	V260 D261 H271 A274 C275 L278 A302 L303 L306	V260-L263 WeakPolarHBondContact O-CB 3.33Å; V260-L263 WeakPolarHBondContact O-CG 3.28Å; V260-L263 PolarHBondContact O-N 3Å; D261-L263 PolarHBondContact O-N 3.32Å; D261-L263 VanDerWaalsContact O-N 3.15Å; L263-H271 PolarHBondContact O-NE2 3.11Å; L263-A274 HydrophobicContact CD2-CB 4.34Å; L263-C275 WeakPolarHBondContact CD2-SG 3.31Å; L263-L278 HydrophobicContact CD1-CD1 3.85Å; L263-L278 HydrophobicContact CD2-CD1 4.05Å; L263-L278 HydrophobicContact CG-CD1 4.16Å; L263-A302 HydrophobicContact CB-CB 4.22Å; L263-A302 HydrophobicContact CD1-CB 3.85Å; L263-L303 HydrophobicContact CD1-CD2 3.89Å; L263-L303 HydrophobicContact CD1-CG 3.95Å; L263-L306 HydrophobicContact CD2-CD2 4.07Å
264	D	96.7	Very high	98	Very high	78 Å²	78	43.2 Å²	43.2	42%	0.417	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-96	12.3	173.1	-72.9	-63.8	0	0	0	112.4	D261 L262 H271 R305	D261-D264 PolarHBondContact O-N 3.47Å; L262-D264 VanDerWaalsContact C-N 3.31Å; L262-D264 PolarHBondContact O-N 3.43Å; D264-H271 VanDerWaalsContact C-NE2 3.29Å; D264-R305 IonicContact OD1-CZ 3.91Å; D264-R305 IonicContact OD1-NE 3.76Å; D264-R305 PolarHBondContact OD1-NE 2.64Å; D264-R305 VanDerWaalsContact OD1-NE 3.08Å; D264-R305 IonicContact OD1-NH2 2.66Å; D264-R305 IonicContact OD2-CZ 3.86Å; D264-R305 IonicContact OD2-NE 3.1Å; D264-R305 PolarHBondContact OD2-NE 3.49Å; D264-R305 IonicContact OD2-NH2 3.48Å; D264-R305 PolarHBondContact OD2-NH2 3.22Å
265	H	97.2	Very high	98	Very high	42 Å²	42	41.5 Å²	41.5	19%	0.194	20%	0.197	C	C	.	.			trans	-63.7	170.2	174	-169.3	-111.7	0	0	0	112.3	L262 M267 V270 H271	L262-H265 WeakPolarHBondContact O-CB 3.43Å; L262-H265 PolarHBondContact O-N 2.96Å; H265-M267 PolarHBondContact ND1-N 3.4Å; H265-V270 HydrophobicContact CB-CB 4.48Å; H265-V270 HydrophobicContact CB-CG1 4.02Å; H265-V270 WeakPolarHBondContact ND1-CB 3.48Å; H265-H271 WeakPolarHBondContact CA-NE2 3.49Å; H265-H271 PolarHBondContact N-NE2 2.85Å; H265-H271 PolarHBondContact O-CE1 3.43Å; H265-H271 PolarHBondContact O-NE2 2.84Å
266	R	95.4	Very high	98	Very high	217 Å²	217	41.5 Å²	41.5	82%	0.819	20%	0.197	S	C	*	.	S	Bend	trans	-96.6	-5.4	-177.6	68.1	-177.3	174.9	-174.7	-2.1	115.6
267	M	96.9	Very high	98	Very high	75 Å²	75	41.4 Å²	41.4	37%	0.369	20%	0.196	S	C	.	.			trans	-118.7	126.8	-175.5	-66.5	179.8	61.5	0	0	112.1	P226 H265 E269 V270 H271	P226-M267 HydrophobicContact CB-CE 4.22Å; P226-M267 HydrophobicContact CB-SD 3.42Å; P226-M267 WeakPolarHBondContact CB-SD 3.41Å; P226-M267 HydrophobicContact CG-SD 3.62Å; H265-M267 PolarHBondContact ND1-N 3.4Å; M267-E269 PolarHBondContact O-N 3.42Å; M267-V270 HydrophobicContact CB-CG2 4.38Å; M267-V270 PolarHBondContact O-N 3.16Å; M267-V270 VanDerWaalsContact O-N 3.15Å; M267-H271 PolarHBondContact O-N 3.22Å
268	S	96.8	Very high	98	Very high	56 Å²	56	38.1 Å²	38.1	39%	0.392	18%	0.181	S	C	.	.	H	α-helix	trans	-57.1	-30.9	178.9	-51.9	0	0	0	0	114.2	H271 R272 I315	S268-H271 PolarHBondContact O-N 3.28Å; S268-R272 WeakPolarHBondContact O-CB 3.31Å; S268-R272 PolarHBondContact O-N 3.47Å; S268-R272 PolarHBondContact O-NH1 2.97Å; S268-I315 WeakPolarHBondContact O-CD1 3.26Å
269	E	97.2	Very high	98	Very high	88 Å²	88	41.3 Å²	41.3	41%	0.411	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-48.6	176.4	-161.6	-156.4	132.9	0	0	111.2	S230 M267 H271 R272 S273	S230-E269 WeakPolarHBondContact CB-OE1 3.39Å; S230-E269 PolarHBondContact OG-OE1 3.26Å; M267-E269 PolarHBondContact O-N 3.42Å; E269-H271 VanDerWaalsContact C-N 3.32Å; E269-H271 PolarHBondContact O-N 2.89Å; E269-R272 WeakPolarHBondContact O-CB 3.43Å; E269-R272 PolarHBondContact O-N 2.87Å; E269-S273 PolarHBondContact O-N 3.43Å; E269-S273 PolarHBondContact O-OG 2.93Å
270	V	98.3	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-40.2	176.8	176.4	0	0	0	0	111	P226 L262 H265 M267 R272 A274	P226-V270 HydrophobicContact CB-CG2 3.93Å; P226-V270 WeakPolarHBondContact O-CG2 3.16Å; L262-V270 HydrophobicContact CB-CG1 4.02Å; L262-V270 HydrophobicContact CD1-CG1 4.28Å; L262-V270 HydrophobicContact CD2-CG1 3.89Å; L262-V270 HydrophobicContact CG-CG1 4.28Å; H265-V270 HydrophobicContact CB-CB 4.48Å; H265-V270 HydrophobicContact CB-CG1 4.02Å; H265-V270 WeakPolarHBondContact ND1-CB 3.48Å; M267-V270 HydrophobicContact CB-CG2 4.38Å; M267-V270 PolarHBondContact O-N 3.16Å; M267-V270 VanDerWaalsContact O-N 3.15Å; V270-R272 PolarHBondContact O-N 3.47Å; V270-A274 WeakPolarHBondContact O-CB 3.48Å; V270-A274 PolarHBondContact O-N 3.45Å
271	H	98.3	Very high	98	Very high	30 Å²	30	42.4 Å²	42.4	14%	0.139	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-44.5	174.6	-63.4	153.6	0	0	0	112.6	L262 L263 D264 H265 M267 S268 E269 C275 L306 I315	L262-H271 PolarHBondContact O-CD2 2.88Å; L263-H271 PolarHBondContact O-NE2 3.11Å; D264-H271 VanDerWaalsContact C-NE2 3.29Å; H265-H271 WeakPolarHBondContact CA-NE2 3.49Å; H265-H271 PolarHBondContact N-NE2 2.85Å; H265-H271 PolarHBondContact O-CE1 3.43Å; H265-H271 PolarHBondContact O-NE2 2.84Å; M267-H271 PolarHBondContact O-N 3.22Å; S268-H271 PolarHBondContact O-N 3.28Å; E269-H271 VanDerWaalsContact C-N 3.32Å; E269-H271 PolarHBondContact O-N 2.89Å; H271-C275 VanDerWaalsContact O-CB 3.24Å; H271-C275 WeakPolarHBondContact O-CB 3.24Å; H271-C275 PolarHBondContact O-N 3.48Å; H271-C275 PolarHBondContact O-SG 2.62Å; H271-L306 HydrophobicContact CB-CD2 4.19Å; H271-I315 HydrophobicContact CB-CD1 3.82Å; H271-I315 HydrophobicContact CB-CG1 4.43Å; H271-I315 HydrophobicContact CB-CG2 4.33Å
272	R	98.4	Very high	98	Very high	71 Å²	71	38.4 Å²	38.4	27%	0.268	18%	0.175	S	C	.	.	H	α-helix	trans	-62.8	-51.1	179.3	177.2	-172.7	-80.5	83	-1.8	110.8	S268 E269 V270 C275 G276 D312 E314 I315 L318	S268-R272 WeakPolarHBondContact O-CB 3.31Å; S268-R272 PolarHBondContact O-N 3.47Å; S268-R272 PolarHBondContact O-NH1 2.97Å; E269-R272 WeakPolarHBondContact O-CB 3.43Å; E269-R272 PolarHBondContact O-N 2.87Å; V270-R272 PolarHBondContact O-N 3.47Å; R272-C275 PolarHBondContact O-N 3.01Å; R272-G276 PolarHBondContact O-N 2.77Å; R272-D312 IonicContact CZ-OD2 3.58Å; R272-D312 IonicContact NH1-OD2 2.8Å; R272-D312 PolarHBondContact NH1-OD2 2.99Å; R272-D312 IonicContact NH2-OD1 2.74Å; R272-D312 PolarHBondContact NH2-OD1 3.37Å; R272-D312 IonicContact NH2-OD2 3.99Å; R272-D312 PolarHBondContact NH2-OD2 3.38Å; R272-E314 IonicContact CZ-OE2 2.74Å; R272-E314 IonicContact NE-OE2 3.71Å; R272-E314 PolarHBondContact NE-OE2 3.45Å; R272-E314 IonicContact NH2-OE2 3.63Å; R272-E314 PolarHBondContact NH2-OE2 3.34Å; R272-I315 HydrophobicContact CB-CG1 4.32Å; R272-L318 HydrophobicContact CB-CD1 4.36Å; R272-L318 HydrophobicContact CG-CD1 3.88Å; R272-L318 WeakPolarHBondContact O-CD1 3.28Å
273	S	98.5	Very high	97.9	Very high	13 Å²	13	44.8 Å²	44.8	9%	0.091	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-44	178.3	-55.1	0	0	0	0	112.1	S230 E269 G276 A277	S230-S273 VanDerWaalsContact O-CB 3.3Å; S230-S273 WeakPolarHBondContact O-CB 3.39Å; S230-S273 PolarHBondContact O-OG 2.89Å; S230-S273 PolarHBondContact OG-OG 3.25Å; E269-S273 PolarHBondContact O-N 3.43Å; E269-S273 PolarHBondContact O-OG 2.93Å; S273-G276 PolarHBondContact O-N 3.44Å; S273-A277 PolarHBondContact O-N 3.21Å
274	A	98.8	Very high	97.7	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-46.3	177.4	0	0	0	0	0	112.6	L259 L262 L263 V270 G276 A277 L278	L259-A274 HydrophobicContact CD2-CB 4.43Å; L262-A274 HydrophobicContact CB-CB 3.89Å; L262-A274 HydrophobicContact CD1-CB 4.45Å; L263-A274 HydrophobicContact CD2-CB 4.34Å; V270-A274 WeakPolarHBondContact O-CB 3.48Å; V270-A274 PolarHBondContact O-N 3.45Å; A274-G276 VanDerWaalsContact C-N 3.31Å; A274-G276 PolarHBondContact O-N 3.02Å; A274-A277 PolarHBondContact O-N 3.21Å; A274-L278 WeakPolarHBondContact O-CB 3.3Å; A274-L278 VanDerWaalsContact O-CG 3.31Å; A274-L278 WeakPolarHBondContact O-CG 3.43Å; A274-L278 PolarHBondContact O-N 2.94Å
275	C	98.6	Very high	97.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-36.5	176.1	-66.9	0	0	0	0	111.9	L263 H271 R272 R279 L318	L263-C275 WeakPolarHBondContact CD2-SG 3.31Å; H271-C275 VanDerWaalsContact O-CB 3.24Å; H271-C275 WeakPolarHBondContact O-CB 3.24Å; H271-C275 PolarHBondContact O-N 3.48Å; H271-C275 PolarHBondContact O-SG 2.62Å; R272-C275 PolarHBondContact O-N 3.01Å; C275-R279 VanDerWaalsContact O-CB 3.27Å; C275-R279 WeakPolarHBondContact O-CB 3.13Å; C275-R279 PolarHBondContact O-N 2.94Å; C275-L318 HydrophobicContact CB-CB 3.68Å; C275-L318 HydrophobicContact CB-CD1 4.27Å
276	G	98.4	Very high	97.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-50.3	173.4	0	0	0	0	0	112.3	R272 S273 A274 R279 N280	R272-G276 PolarHBondContact O-N 2.77Å; S273-G276 PolarHBondContact O-N 3.44Å; A274-G276 VanDerWaalsContact C-N 3.31Å; A274-G276 PolarHBondContact O-N 3.02Å; G276-R279 PolarHBondContact O-N 3.22Å; G276-N280 PolarHBondContact O-N 3.25Å
277	A	98.7	Very high	97.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-50.4	175.8	0	0	0	0	0	112.1	A233 Q237 L259 S273 A274 R279 N280 L281	A233-A277 WeakPolarHBondContact O-CB 3.19Å; Q237-A277 HydrophobicContact CB-CB 4.12Å; L259-A277 HydrophobicContact CD1-CB 3.84Å; L259-A277 HydrophobicContact CD2-CB 3.94Å; S273-A277 PolarHBondContact O-N 3.21Å; A274-A277 PolarHBondContact O-N 3.21Å; A277-R279 VanDerWaalsContact C-N 3.31Å; A277-R279 PolarHBondContact O-N 2.86Å; A277-N280 PolarHBondContact O-N 3.35Å; A277-L281 WeakPolarHBondContact O-CB 3.39Å; A277-L281 WeakPolarHBondContact O-CG 3.36Å; A277-L281 PolarHBondContact O-N 3.25Å
278	L	98.8	Very high	97.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.5	-43.1	177.6	-70	175.6	0	0	0	111.7	L259 V260 L263 A274 N280 L281 V282 L294 V322	L259-L278 HydrophobicContact CB-CD1 4.46Å; L259-L278 HydrophobicContact CB-CD2 3.62Å; L259-L278 HydrophobicContact CB-CG 3.94Å; L259-L278 HydrophobicContact CD1-CD2 4.23Å; V260-L278 HydrophobicContact CG2-CD1 4.34Å; V260-L278 HydrophobicContact CG2-CD2 4.36Å; L263-L278 HydrophobicContact CD1-CD1 3.85Å; L263-L278 HydrophobicContact CD2-CD1 4.05Å; L263-L278 HydrophobicContact CG-CD1 4.16Å; A274-L278 WeakPolarHBondContact O-CB 3.3Å; A274-L278 VanDerWaalsContact O-CG 3.31Å; A274-L278 WeakPolarHBondContact O-CG 3.43Å; A274-L278 PolarHBondContact O-N 2.94Å; L278-N280 VanDerWaalsContact C-N 3.32Å; L278-N280 PolarHBondContact O-N 3.45Å; L278-L281 HydrophobicContact CD2-CD1 4.41Å; L278-L281 PolarHBondContact O-N 3.02Å; L278-V282 WeakPolarHBondContact O-CG2 3.47Å; L278-V282 PolarHBondContact O-N 3.48Å; L278-L294 HydrophobicContact CB-CD1 4.35Å; L278-L294 HydrophobicContact CD1-CD1 4.49Å; L278-L294 HydrophobicContact CD2-CD1 3.92Å; L278-L294 HydrophobicContact CG-CD1 4.48Å; L278-V322 HydrophobicContact CB-CG2 4.27Å
279	R	98.4	Very high	97.5	Very high	94 Å²	94	43.7 Å²	43.7	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-58.2	-43.4	179.2	-173	-179.7	175.5	-146.4	-0.5	111.7	C275 G276 A277 Y283 V322 N325	C275-R279 VanDerWaalsContact O-CB 3.27Å; C275-R279 WeakPolarHBondContact O-CB 3.13Å; C275-R279 PolarHBondContact O-N 2.94Å; G276-R279 PolarHBondContact O-N 3.22Å; A277-R279 VanDerWaalsContact C-N 3.31Å; A277-R279 PolarHBondContact O-N 2.86Å; R279-Y283 PolarHBondContact O-N 3.45Å; R279-V322 HydrophobicContact CB-CG2 3.8Å; R279-V322 HydrophobicContact CG-CG2 4.5Å; R279-N325 PolarHBondContact O-ND2 3.1Å
280	N	98.4	Very high	97.6	Very high	29 Å²	29	39.6 Å²	39.6	16%	0.155	20%	0.196	C	C	.	.	H	α-helix	trans	-71.6	-41.9	177.6	-74.3	2.7	0	0	0	112	Q237 C240 K247 G276 A277 L278 V282 Y283	Q237-N280 WeakPolarHBondContact CG-ND2 3.48Å; Q237-N280 PolarHBondContact O-ND2 2.94Å; C240-N280 HydrophobicContact CB-CB 3.72Å; K247-N280 WeakPolarHBondContact CE-O 3.39Å; K247-N280 PolarHBondContact NZ-O 3.05Å; G276-N280 PolarHBondContact O-N 3.25Å; A277-N280 PolarHBondContact O-N 3.35Å; L278-N280 VanDerWaalsContact C-N 3.32Å; L278-N280 PolarHBondContact O-N 3.45Å; N280-V282 VanDerWaalsContact C-N 3.3Å; N280-V282 PolarHBondContact O-N 3.06Å; N280-Y283 PolarHBondContact O-N 2.94Å
281	L	98.3	Very high	97.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-38.9	177.8	-81.5	163	0	0	0	113.4	C240 K247 I250 I256 L259 A277 L278 N290	C240-L281 WeakPolarHBondContact SG-CD2 3.5Å; K247-L281 HydrophobicContact CB-CD2 4.12Å; K247-L281 HydrophobicContact CG-CD2 4.17Å; I250-L281 HydrophobicContact CB-CD2 3.93Å; I250-L281 HydrophobicContact CD1-CD2 4Å; I250-L281 HydrophobicContact CG2-CD1 4.14Å; I250-L281 HydrophobicContact CG2-CD2 3.81Å; I256-L281 HydrophobicContact CG1-CD1 4.37Å; L259-L281 HydrophobicContact CD1-CD1 3.36Å; A277-L281 WeakPolarHBondContact O-CB 3.39Å; A277-L281 WeakPolarHBondContact O-CG 3.36Å; A277-L281 PolarHBondContact O-N 3.25Å; L278-L281 HydrophobicContact CD2-CD1 4.41Å; L278-L281 PolarHBondContact O-N 3.02Å; L281-N290 PolarHBondContact O-ND2 2.79Å
282	V	98.3	Very high	97.6	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	3.6	-178.7	-54.3	0	0	0	0	114.2	L278 N280 K291 L294 V322 N325 L326	L278-V282 WeakPolarHBondContact O-CG2 3.47Å; L278-V282 PolarHBondContact O-N 3.48Å; N280-V282 VanDerWaalsContact C-N 3.3Å; N280-V282 PolarHBondContact O-N 3.06Å; V282-K291 HydrophobicContact CB-CG 3.9Å; V282-K291 HydrophobicContact CG1-CG 4.38Å; V282-K291 WeakPolarHBondContact O-CE 3.36Å; V282-L294 HydrophobicContact CG1-CB 4.41Å; V282-L294 HydrophobicContact CG1-CD1 3.71Å; V282-V322 HydrophobicContact CG2-CG1 4.08Å; V282-N325 HydrophobicContact CG2-CB 3.69Å; V282-L326 HydrophobicContact CB-CD2 4.2Å; V282-L326 HydrophobicContact CG1-CD2 4.06Å; V282-L326 HydrophobicContact CG2-CD2 4.27Å; V282-L326 HydrophobicContact CG2-CG 4.37Å
283	Y	97.5	Very high	97.7	Very high	144 Å²	144	39.1 Å²	39.1	57%	0.565	20%	0.203	S	C	*	.			trans	-77.2	133.6	178.6	-177	-101	0	0	0	112.5	K247 R279 N280 N287	K247-Y283 PolarHBondContact NZ-O 3.38Å; R279-Y283 PolarHBondContact O-N 3.45Å; N280-Y283 PolarHBondContact O-N 2.94Å; Y283-N287 PolarHBondContact O-ND2 3.18Å
284	G	94.3	Very high	97.7	Very high	28 Å²	28	38.6 Å²	38.6	29%	0.289	20%	0.199	S	C	.	.	S	Bend	trans	93.4	157	177.4	0	0	0	0	0	114.5	N287 K291	G284-N287 PolarHBondContact O-N 2.81Å; G284-K291 WeakPolarHBondContact O-CE 3.39Å; G284-K291 PolarHBondContact O-NZ 3.36Å
285	K	91.8	Very high	97.7	Very high	170 Å²	170	42.4 Å²	42.4	74%	0.739	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-72.1	-29.1	-178.6	-170.6	173.4	-176.8	174.1	0	113.4	N287 D288	K285-N287 PolarHBondContact O-N 3.17Å; K285-N287 VanDerWaalsContact O-N 3.15Å; K285-D288 PolarHBondContact O-N 3.01Å
286	A	94.4	Very high	97.7	Very high	81 Å²	81	47.4 Å²	47.4	67%	0.669	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-65.3	-13.2	175.6	0	0	0	0	0	113.8
287	N	96.8	Very high	97.7	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.027	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-107.8	23.8	-176	-61.4	-61.7	0	0	0	112.7	N244 K247 Y283 G284 K285 E289 N290 K291	N244-N287 PolarHBondContact OD1-ND2 3.2Å; K247-N287 WeakPolarHBondContact CD-ND2 3.44Å; Y283-N287 PolarHBondContact O-ND2 3.18Å; G284-N287 PolarHBondContact O-N 2.81Å; K285-N287 PolarHBondContact O-N 3.17Å; K285-N287 VanDerWaalsContact O-N 3.15Å; N287-E289 PolarHBondContact O-N 3.29Å; N287-N290 HydrophobicContact CB-CB 4.32Å; N287-N290 WeakPolarHBondContact O-CA 3.4Å; N287-N290 WeakPolarHBondContact O-CB 3.4Å; N287-N290 PolarHBondContact O-N 3.47Å; N287-N290 PolarHBondContact OD1-ND2 2.96Å; N287-K291 PolarHBondContact O-N 3.41Å; N287-K291 VanDerWaalsContact O-N 3.1Å
288	D	97.8	Very high	97.7	Very high	46 Å²	46	50 Å²	50	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-32.4	177.2	-83.4	16.6	0	0	0	112.6	K285 N290 K291 V292 C329	K285-D288 PolarHBondContact O-N 3.01Å; D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 PolarHBondContact O-N 2.88Å; D288-K291 WeakPolarHBondContact O-CB 3.24Å; D288-K291 PolarHBondContact O-N 3.4Å; D288-K291 WeakPolarHBondContact OD1-CD 3.36Å; D288-K291 WeakPolarHBondContact OD1-CE 3.46Å; D288-K291 IonicContact OD1-NZ 2.65Å; D288-K291 PolarHBondContact OD1-NZ 3.22Å; D288-V292 WeakPolarHBondContact O-CG2 3.16Å; D288-V292 PolarHBondContact O-N 3.44Å; D288-C329 VanDerWaalsContact CG-SG 3.59Å; D288-C329 PolarHBondContact OD2-SG 3.49Å
289	E	98.3	Very high	97.7	Very high	118 Å²	118	50 Å²	50	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-63.1	-34.4	171.4	-68.2	-175.7	-151.4	0	0	112.8	R251 N287 T293	R251-E289 IonicContact CZ-OE2 3.18Å; R251-E289 IonicContact NH1-OE2 2.87Å; R251-E289 PolarHBondContact NH1-OE2 3.19Å; R251-E289 IonicContact NH2-OE2 3.63Å; R251-E289 PolarHBondContact NH2-OE2 3.46Å; N287-E289 PolarHBondContact O-N 3.29Å; E289-T293 WeakPolarHBondContact O-CB 3.27Å; E289-T293 PolarHBondContact O-N 3.45Å; E289-T293 PolarHBondContact O-OG1 3.24Å
290	N	98.6	Very high	97.7	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.011	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-39.2	174.3	-60.2	-7.9	0	0	0	111	R251 I256 L281 N287 D288 T293 L294	R251-N290 VanDerWaalsContact CD-OD1 3.22Å; R251-N290 WeakPolarHBondContact CD-OD1 3.22Å; R251-N290 PolarHBondContact NE-OD1 2.93Å; I256-N290 HydrophobicContact CD1-CB 3.88Å; L281-N290 PolarHBondContact O-ND2 2.79Å; N287-N290 HydrophobicContact CB-CB 4.32Å; N287-N290 WeakPolarHBondContact O-CA 3.4Å; N287-N290 WeakPolarHBondContact O-CB 3.4Å; N287-N290 PolarHBondContact O-N 3.47Å; N287-N290 PolarHBondContact OD1-ND2 2.96Å; D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 PolarHBondContact O-N 2.88Å; N290-T293 PolarHBondContact O-N 3.05Å; N290-L294 WeakPolarHBondContact O-CB 3.44Å; N290-L294 PolarHBondContact O-N 3.08Å
291	K	98.8	Very high	97.7	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-50.3	174.4	-63.5	173.7	-167.6	161.2	0	110.7	V282 G284 N287 D288 T293 L294 K295 N325 L326 S328 C329 L332	V282-K291 HydrophobicContact CB-CG 3.9Å; V282-K291 HydrophobicContact CG1-CG 4.38Å; V282-K291 WeakPolarHBondContact O-CE 3.36Å; G284-K291 WeakPolarHBondContact O-CE 3.39Å; G284-K291 PolarHBondContact O-NZ 3.36Å; N287-K291 PolarHBondContact O-N 3.41Å; N287-K291 VanDerWaalsContact O-N 3.1Å; D288-K291 WeakPolarHBondContact O-CB 3.24Å; D288-K291 PolarHBondContact O-N 3.4Å; D288-K291 WeakPolarHBondContact OD1-CD 3.36Å; D288-K291 WeakPolarHBondContact OD1-CE 3.46Å; D288-K291 IonicContact OD1-NZ 2.65Å; D288-K291 PolarHBondContact OD1-NZ 3.22Å; K291-T293 VanDerWaalsContact C-N 3.33Å; K291-T293 PolarHBondContact O-N 2.84Å; K291-L294 PolarHBondContact O-N 3.37Å; K291-K295 PolarHBondContact O-N 3.44Å; K291-N325 WeakPolarHBondContact CE-O 3.29Å; K291-L326 HydrophobicContact CB-CD2 3.86Å; K291-L326 HydrophobicContact CG-CD2 4.02Å; K291-S328 PolarHBondContact NZ-OG 3.5Å; K291-C329 HydrophobicContact CD-CB 3.65Å; K291-L332 HydrophobicContact CB-CD1 4.34Å; K291-L332 HydrophobicContact CB-CD2 3.83Å
292	V	98.8	Very high	97.7	Very high	53 Å²	53	46.2 Å²	46.2	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-41.7	176.9	172.2	0	0	0	0	111.2	D288 K295 N296 L332	D288-V292 WeakPolarHBondContact O-CG2 3.16Å; D288-V292 PolarHBondContact O-N 3.44Å; V292-K295 PolarHBondContact O-N 2.78Å; V292-N296 VanDerWaalsContact O-CG 3.3Å; V292-N296 PolarHBondContact O-N 3.23Å; V292-N296 PolarHBondContact O-ND2 3.09Å; V292-L332 HydrophobicContact CG2-CD1 3.76Å
293	T	98.8	Very high	97.7	Very high	37 Å²	37	46.2 Å²	46.2	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-49.4	176.9	-54.9	0	0	0	0	111.3	R251 I256 E289 N290 K291 K295 N296 C297	R251-T293 VanDerWaalsContact CD-OG1 3.25Å; R251-T293 WeakPolarHBondContact CD-OG1 3.36Å; R251-T293 HydrophobicContact CG-CG2 4.09Å; I256-T293 HydrophobicContact CB-CG2 4.4Å; I256-T293 HydrophobicContact CD1-CG2 4.3Å; I256-T293 HydrophobicContact CG2-CG2 4.31Å; E289-T293 WeakPolarHBondContact O-CB 3.27Å; E289-T293 PolarHBondContact O-N 3.45Å; E289-T293 PolarHBondContact O-OG1 3.24Å; N290-T293 PolarHBondContact O-N 3.05Å; K291-T293 VanDerWaalsContact C-N 3.33Å; K291-T293 PolarHBondContact O-N 2.84Å; T293-K295 VanDerWaalsContact C-N 3.28Å; T293-K295 PolarHBondContact O-N 3.34Å; T293-N296 CarbonylContact O-C 3.58Å; T293-N296 WeakPolarHBondContact O-CA 3.48Å; T293-N296 PolarHBondContact O-N 3.02Å; T293-C297 PolarHBondContact O-N 3.35Å; T293-C297 PolarHBondContact O-SG 2.84Å
294	L	98.8	Very high	97.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-55.5	-43.5	176.2	-176.9	159.7	0	0	0	111.6	I256 V260 L278 V282 N290 K291 N296 C297 G299 L303 V322 L326	I256-L294 HydrophobicContact CG2-CB 3.93Å; V260-L294 HydrophobicContact CG2-CG 4.16Å; L278-L294 HydrophobicContact CB-CD1 4.35Å; L278-L294 HydrophobicContact CD1-CD1 4.49Å; L278-L294 HydrophobicContact CD2-CD1 3.92Å; L278-L294 HydrophobicContact CG-CD1 4.48Å; V282-L294 HydrophobicContact CG1-CB 4.41Å; V282-L294 HydrophobicContact CG1-CD1 3.71Å; N290-L294 WeakPolarHBondContact O-CB 3.44Å; N290-L294 PolarHBondContact O-N 3.08Å; K291-L294 PolarHBondContact O-N 3.37Å; L294-N296 VanDerWaalsContact C-N 3.34Å; L294-N296 PolarHBondContact O-N 2.86Å; L294-C297 PolarHBondContact O-N 3.27Å; L294-G299 WeakPolarHBondContact O-CA 3.44Å; L294-G299 PolarHBondContact O-N 3.17Å; L294-L303 HydrophobicContact CD2-CD1 4.31Å; L294-V322 HydrophobicContact CD1-CG1 4.16Å; L294-L326 HydrophobicContact CB-CD2 4.5Å; L294-L326 HydrophobicContact CD1-CD2 4.31Å; L294-L326 HydrophobicContact CD2-CD1 3.7Å; L294-L326 HydrophobicContact CD2-CD2 4.04Å
295	K	98.6	Very high	97.9	Very high	81 Å²	81	42.3 Å²	42.3	35%	0.352	23%	0.229	S	C	.	.	H	α-helix	trans	-62.7	-38.4	175.1	173.7	-91.6	145.7	-170.6	0	112.2	K291 V292 T293 G298 I300 L332 P335	K291-K295 PolarHBondContact O-N 3.44Å; V292-K295 PolarHBondContact O-N 2.78Å; T293-K295 VanDerWaalsContact C-N 3.28Å; T293-K295 PolarHBondContact O-N 3.34Å; K295-G298 PolarHBondContact O-N 3.48Å; K295-I300 HydrophobicContact CB-CD1 3.92Å; K295-I300 HydrophobicContact CG-CD1 3.79Å; K295-L332 HydrophobicContact CB-CD2 4.12Å; K295-L332 HydrophobicContact CB-CG 4.23Å; K295-L332 HydrophobicContact CG-CG 4.48Å; K295-P335 HydrophobicContact CG-CB 4.49Å
296	N	98.5	Very high	98.2	Very high	105 Å²	105	34.4 Å²	34.4	56%	0.561	20%	0.195	S	C	*	.	H	α-helix	trans	-73.3	-29.9	178.3	-70.6	-19	0	0	0	112.8	V292 T293 L294 G298	V292-N296 VanDerWaalsContact O-CG 3.3Å; V292-N296 PolarHBondContact O-N 3.23Å; V292-N296 PolarHBondContact O-ND2 3.09Å; T293-N296 CarbonylContact O-C 3.58Å; T293-N296 WeakPolarHBondContact O-CA 3.48Å; T293-N296 PolarHBondContact O-N 3.02Å; L294-N296 VanDerWaalsContact C-N 3.34Å; L294-N296 PolarHBondContact O-N 2.86Å; N296-G298 PolarHBondContact O-N 2.73Å
297	C	98.4	Very high	98.4	Very high	25 Å²	25	30.5 Å²	30.5	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	1.5	170	-65.1	0	0	0	0	114.2	Q257 V260 T293 L294 G299	Q257-C297 PolarHBondContact NE2-O 2.78Å; Q257-C297 VanDerWaalsContact OE1-CA 3.32Å; Q257-C297 PolarHBondContact OE1-SG 3.48Å; V260-C297 HydrophobicContact CB-CB 4.42Å; V260-C297 HydrophobicContact CG1-CB 4.45Å; V260-C297 HydrophobicContact CG2-CB 4.24Å; T293-C297 PolarHBondContact O-N 3.35Å; T293-C297 PolarHBondContact O-SG 2.84Å; L294-C297 PolarHBondContact O-N 3.27Å; C297-G299 VanDerWaalsContact C-N 3.32Å
298	G	98.5	Very high	98.4	Very high	29 Å²	29	37.5 Å²	37.5	30%	0.299	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	14.9	-175.2	0	0	0	0	0	114.4	K295 N296 I300 P301 A302	K295-G298 PolarHBondContact O-N 3.48Å; N296-G298 PolarHBondContact O-N 2.73Å; G298-I300 PolarHBondContact O-N 3.43Å; G298-P301 VanDerWaalsContact O-CD 3.3Å; G298-P301 WeakPolarHBondContact O-CD 3.38Å; G298-A302 PolarHBondContact O-N 2.89Å; G298-A302 VanDerWaalsContact O-N 3.11Å
299	G	98.7	Very high	98.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-30.1	-172.6	0	0	0	0	0	114.9	L294 C297 A302 L303	L294-G299 WeakPolarHBondContact O-CA 3.44Å; L294-G299 PolarHBondContact O-N 3.17Å; C297-G299 VanDerWaalsContact C-N 3.32Å; G299-A302 PolarHBondContact O-N 3.31Å; G299-L303 WeakPolarHBondContact O-CB 3.48Å; G299-L303 WeakPolarHBondContact O-CD1 3.47Å; G299-L303 WeakPolarHBondContact O-CG 3.2Å; G299-L303 PolarHBondContact O-N 2.93Å
300	I	98.7	Very high	98.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-54.9	174.7	-66.2	168.1	0	0	0	110.4	K295 G298 A302 L303 V304 L323 L326 L332 P335 I336 D339	K295-I300 HydrophobicContact CB-CD1 3.92Å; K295-I300 HydrophobicContact CG-CD1 3.79Å; G298-I300 PolarHBondContact O-N 3.43Å; I300-A302 VanDerWaalsContact C-N 3.28Å; I300-A302 PolarHBondContact O-N 3.2Å; I300-L303 PolarHBondContact O-N 3.45Å; I300-V304 HydrophobicContact CG2-CG2 4.49Å; I300-V304 WeakPolarHBondContact O-CB 3.34Å; I300-V304 VanDerWaalsContact O-CG2 3.28Å; I300-V304 WeakPolarHBondContact O-CG2 3.48Å; I300-V304 PolarHBondContact O-N 3.23Å; I300-L323 HydrophobicContact CG2-CD2 4.43Å; I300-L326 HydrophobicContact CG1-CD1 3.94Å; I300-L332 HydrophobicContact CD1-CD2 4.35Å; I300-P335 HydrophobicContact CD1-CB 4.19Å; I300-I336 HydrophobicContact CD1-CG1 3.84Å; I300-D339 HydrophobicContact CG2-CB 3.71Å
301	P	98.6	Very high	97.7	Very high	42 Å²	42	41.5 Å²	41.5	27%	0.273	22%	0.224	S	C	.	.	H	α-helix	trans	-52.7	-39.7	170.3	-31.2	34.8	0	0	0	114.8	G298 V304 R305 D339	G298-P301 VanDerWaalsContact O-CD 3.3Å; G298-P301 WeakPolarHBondContact O-CD 3.38Å; P301-V304 PolarHBondContact O-N 3.4Å; P301-R305 WeakPolarHBondContact O-CG 3.26Å; P301-R305 PolarHBondContact O-N 2.98Å; P301-D339 WeakPolarHBondContact CD-OD2 3.33Å
302	A	98.7	Very high	97.5	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-48.7	178.9	0	0	0	0	0	112.5	V260 L263 G298 G299 I300 V304 R305 L306	V260-A302 HydrophobicContact CG1-CB 4.18Å; L263-A302 HydrophobicContact CB-CB 4.22Å; L263-A302 HydrophobicContact CD1-CB 3.85Å; G298-A302 PolarHBondContact O-N 2.89Å; G298-A302 VanDerWaalsContact O-N 3.11Å; G299-A302 PolarHBondContact O-N 3.31Å; I300-A302 VanDerWaalsContact C-N 3.28Å; I300-A302 PolarHBondContact O-N 3.2Å; A302-V304 VanDerWaalsContact C-N 3.28Å; A302-V304 PolarHBondContact O-N 3.15Å; A302-R305 WeakPolarHBondContact O-CB 3.4Å; A302-R305 PolarHBondContact O-N 3.26Å; A302-R305 VanDerWaalsContact O-N 3.13Å; A302-L306 PolarHBondContact O-N 3.44Å
303	L	98.8	Very high	97.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.9	-43.2	172.9	-71.4	164.9	0	0	0	111.4	L263 L294 G299 I300 L306 L307 V319 V322 L323 L326	L263-L303 HydrophobicContact CD1-CD2 3.89Å; L263-L303 HydrophobicContact CD1-CG 3.95Å; L294-L303 HydrophobicContact CD2-CD1 4.31Å; G299-L303 WeakPolarHBondContact O-CB 3.48Å; G299-L303 WeakPolarHBondContact O-CD1 3.47Å; G299-L303 WeakPolarHBondContact O-CG 3.2Å; G299-L303 PolarHBondContact O-N 2.93Å; I300-L303 PolarHBondContact O-N 3.45Å; L303-L306 PolarHBondContact O-N 3.47Å; L303-L307 WeakPolarHBondContact O-CB 3.44Å; L303-L307 PolarHBondContact O-N 2.97Å; L303-V319 HydrophobicContact CB-CG1 4.04Å; L303-V319 HydrophobicContact CD2-CB 4.4Å; L303-V319 HydrophobicContact CD2-CG1 4.09Å; L303-V319 HydrophobicContact CD2-CG2 4.12Å; L303-V319 WeakPolarHBondContact O-CG1 3.46Å; L303-V322 HydrophobicContact CD1-CB 4.03Å; L303-V322 HydrophobicContact CD1-CG1 3.53Å; L303-V322 HydrophobicContact CD2-CB 4.14Å; L303-V322 HydrophobicContact CD2-CG1 4.27Å; L303-V322 HydrophobicContact CD2-CG2 4.29Å; L303-L323 HydrophobicContact CB-CD2 4.36Å; L303-L323 HydrophobicContact CD1-CD2 4.17Å; L303-L323 HydrophobicContact CD1-CG 4.46Å; L303-L326 HydrophobicContact CD1-CD1 3.97Å
304	V	98.4	Very high	97.1	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-30.9	178.3	173.3	0	0	0	0	112.8	I300 P301 A302 R308 D339 A340 V343	I300-V304 HydrophobicContact CG2-CG2 4.49Å; I300-V304 WeakPolarHBondContact O-CB 3.34Å; I300-V304 VanDerWaalsContact O-CG2 3.28Å; I300-V304 WeakPolarHBondContact O-CG2 3.48Å; I300-V304 PolarHBondContact O-N 3.23Å; P301-V304 PolarHBondContact O-N 3.4Å; A302-V304 VanDerWaalsContact C-N 3.28Å; A302-V304 PolarHBondContact O-N 3.15Å; V304-R308 PolarHBondContact O-N 3.41Å; V304-R308 PolarHBondContact O-NE 3.1Å; V304-R308 VanDerWaalsContact O-NE 3.15Å; V304-D339 WeakPolarHBondContact CG1-O 3.4Å; V304-A340 HydrophobicContact CG2-CB 3.57Å; V304-V343 HydrophobicContact CG1-CB 3.87Å; V304-V343 HydrophobicContact CG1-CG1 4.01Å; V304-V343 HydrophobicContact CG1-CG2 3.61Å
305	R	98.1	Very high	97.1	Very high	88 Å²	88	47.9 Å²	47.9	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-66.8	-47.6	169.5	-76.9	-168.8	-60.5	-85.1	7.7	110.8	D264 P301 A302 R308 K309	D264-R305 IonicContact OD1-CZ 3.91Å; D264-R305 IonicContact OD1-NE 3.76Å; D264-R305 PolarHBondContact OD1-NE 2.64Å; D264-R305 VanDerWaalsContact OD1-NE 3.08Å; D264-R305 IonicContact OD1-NH2 2.66Å; D264-R305 IonicContact OD2-CZ 3.86Å; D264-R305 IonicContact OD2-NE 3.1Å; D264-R305 PolarHBondContact OD2-NE 3.49Å; D264-R305 IonicContact OD2-NH2 3.48Å; D264-R305 PolarHBondContact OD2-NH2 3.22Å; P301-R305 WeakPolarHBondContact O-CG 3.26Å; P301-R305 PolarHBondContact O-N 2.98Å; A302-R305 WeakPolarHBondContact O-CB 3.4Å; A302-R305 PolarHBondContact O-N 3.26Å; A302-R305 VanDerWaalsContact O-N 3.13Å; R305-R308 PolarHBondContact O-N 3.39Å; R305-K309 WeakPolarHBondContact O-CG 3.21Å; R305-K309 PolarHBondContact O-N 3.1Å
306	L	98.3	Very high	97	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-45.4	-179.3	-178.5	56.5	0	0	0	111.4	L263 H271 A302 L303 R308 K309 T310 I315 V319	L263-L306 HydrophobicContact CD2-CD2 4.07Å; H271-L306 HydrophobicContact CB-CD2 4.19Å; A302-L306 PolarHBondContact O-N 3.44Å; L303-L306 PolarHBondContact O-N 3.47Å; L306-R308 PolarHBondContact O-N 2.67Å; L306-K309 PolarHBondContact O-N 3.34Å; L306-T310 HydrophobicContact CD1-CG2 4.41Å; L306-T310 HydrophobicContact CG-CG2 4.5Å; L306-T310 VanDerWaalsContact O-CG2 3.28Å; L306-T310 WeakPolarHBondContact O-CG2 3.38Å; L306-T310 PolarHBondContact O-N 3.06Å; L306-I315 HydrophobicContact CD1-CG2 4.3Å; L306-I315 HydrophobicContact CD2-CG2 3.9Å; L306-I315 HydrophobicContact CG-CG2 4.03Å; L306-V319 HydrophobicContact CD2-CG2 3.76Å; L306-V319 HydrophobicContact CG-CG2 4.13Å
307	L	97.8	Very high	97	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-32.7	177.5	-174.2	57.6	0	0	0	113.8	L303 R316 V319 T320 V343 L344 V348	L303-L307 WeakPolarHBondContact O-CB 3.44Å; L303-L307 PolarHBondContact O-N 2.97Å; L307-R316 HydrophobicContact CD1-CB 4.15Å; L307-R316 HydrophobicContact CD1-CG 4.07Å; L307-R316 PolarHBondContact O-NH1 3.1Å; L307-V319 HydrophobicContact CB-CG1 3.94Å; L307-V319 HydrophobicContact CD1-CG1 4.5Å; L307-T320 HydrophobicContact CD1-CG2 4.27Å; L307-T320 HydrophobicContact CD2-CG2 4.28Å; L307-V343 HydrophobicContact CD2-CG1 4.17Å; L307-V343 HydrophobicContact CG-CG1 4.41Å; L307-L344 HydrophobicContact CD2-CD2 3.93Å; L307-V348 HydrophobicContact CD1-CG2 4.16Å; L307-V348 HydrophobicContact CD2-CG2 4.14Å; L307-V348 HydrophobicContact CG-CG2 4.49Å
308	R	96	Very high	97	Very high	151 Å²	151	43.2 Å²	43.2	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-77.3	-31	175.9	-77.5	-177.4	-80.9	178.6	-7.2	113.5	V304 R305 L306 V343	V304-R308 PolarHBondContact O-N 3.41Å; V304-R308 PolarHBondContact O-NE 3.1Å; V304-R308 VanDerWaalsContact O-NE 3.15Å; R305-R308 PolarHBondContact O-N 3.39Å; L306-R308 PolarHBondContact O-N 2.67Å; R308-V343 HydrophobicContact CG-CG1 3.55Å; R308-V343 HydrophobicContact CG-CG2 4.14Å
309	K	94.8	Very high	97	Very high	160 Å²	160	41.9 Å²	41.9	70%	0.696	21%	0.213	S	C	*	.	H	α-helix	trans	-87.8	-33	-175.7	-72.5	179	177.7	178.4	0	113.4	R305 L306	R305-K309 WeakPolarHBondContact O-CG 3.21Å; R305-K309 PolarHBondContact O-N 3.1Å; L306-K309 PolarHBondContact O-N 3.34Å
310	T	94.9	Very high	97	Very high	20 Å²	20	41.9 Å²	41.9	12%	0.123	21%	0.213	C	C	.	.			trans	-93.6	132.8	-170.2	-166.1	0	0	0	0	113.7	L306 D312 I315 R316	L306-T310 HydrophobicContact CD1-CG2 4.41Å; L306-T310 HydrophobicContact CG-CG2 4.5Å; L306-T310 VanDerWaalsContact O-CG2 3.28Å; L306-T310 WeakPolarHBondContact O-CG2 3.38Å; L306-T310 PolarHBondContact O-N 3.06Å; T310-D312 WeakPolarHBondContact OG1-CB 3.4Å; T310-D312 PolarHBondContact OG1-N 3.09Å; T310-I315 HydrophobicContact CG2-CB 4.15Å; T310-I315 HydrophobicContact CG2-CG2 3.8Å; T310-R316 HydrophobicContact CG2-CG 3.79Å; T310-R316 WeakPolarHBondContact O-CD 3.34Å; T310-R316 PolarHBondContact O-NH1 3.35Å
311	G	91.6	Very high	97	Very high	70 Å²	70	41.9 Å²	41.9	72%	0.722	21%	0.214	S	C	*	.			trans	-91.8	-9.5	167	0	0	0	0	0	113.9	V313	G311-V313 PolarHBondContact O-N 2.96Å
312	D	94.8	Very high	97	Very high	43 Å²	43	39.9 Å²	39.9	23%	0.23	20%	0.201	C	C	.	.			trans	-67.4	116.1	178.9	-178.9	-36.8	0	0	0	109.9	R272 T310 E314 I315 R316	R272-D312 IonicContact CZ-OD2 3.58Å; R272-D312 IonicContact NH1-OD2 2.8Å; R272-D312 PolarHBondContact NH1-OD2 2.99Å; R272-D312 IonicContact NH2-OD1 2.74Å; R272-D312 PolarHBondContact NH2-OD1 3.37Å; R272-D312 IonicContact NH2-OD2 3.99Å; R272-D312 PolarHBondContact NH2-OD2 3.38Å; T310-D312 WeakPolarHBondContact OG1-CB 3.4Å; T310-D312 PolarHBondContact OG1-N 3.09Å; D312-E314 PolarHBondContact O-N 3.43Å; D312-E314 WeakPolarHBondContact OD1-CB 2.97Å; D312-E314 PolarHBondContact OD1-N 2.86Å; D312-I315 HydrophobicContact CB-CB 4.19Å; D312-I315 HydrophobicContact CB-CD1 3.83Å; D312-I315 HydrophobicContact CB-CG1 4.04Å; D312-I315 PolarHBondContact O-N 3.47Å; D312-I315 PolarHBondContact OD1-N 2.96Å; D312-R316 WeakPolarHBondContact O-CD 3.47Å; D312-R316 WeakPolarHBondContact O-CG 3.46Å; D312-R316 PolarHBondContact O-N 2.76Å; D312-R316 VanDerWaalsContact O-N 3.08Å
313	V	93.4	Very high	97	Very high	76 Å²	76	39.9 Å²	39.9	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-62.3	-41	-174.9	-179.4	0	0	0	0	111.5	G311 I315 R316 E317 V374	G311-V313 PolarHBondContact O-N 2.96Å; V313-I315 PolarHBondContact O-N 2.7Å; V313-R316 CarbonylContact O-C 3.52Å; V313-R316 WeakPolarHBondContact O-CB 3.44Å; V313-R316 PolarHBondContact O-N 3.42Å; V313-R316 VanDerWaalsContact O-N 3.12Å; V313-E317 HydrophobicContact CG1-CG 4.45Å; V313-E317 WeakPolarHBondContact O-CG 3.41Å; V313-E317 PolarHBondContact O-N 2.89Å; V313-V374 HydrophobicContact CG1-CG2 4.15Å
314	E	95.8	Very high	97	Very high	107 Å²	107	42.9 Å²	42.9	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-66.3	-39.9	-178.5	-59.7	179.9	170.1	0	0	111.3	R272 D312 R316 E317 L318	R272-E314 IonicContact CZ-OE2 2.74Å; R272-E314 IonicContact NE-OE2 3.71Å; R272-E314 PolarHBondContact NE-OE2 3.45Å; R272-E314 IonicContact NH2-OE2 3.63Å; R272-E314 PolarHBondContact NH2-OE2 3.34Å; D312-E314 PolarHBondContact O-N 3.43Å; D312-E314 WeakPolarHBondContact OD1-CB 2.97Å; D312-E314 PolarHBondContact OD1-N 2.86Å; E314-R316 VanDerWaalsContact C-N 3.32Å; E314-R316 PolarHBondContact O-N 2.99Å; E314-E317 PolarHBondContact O-N 3.08Å; E314-L318 VanDerWaalsContact O-CG 3.32Å; E314-L318 WeakPolarHBondContact O-CG 3.49Å; E314-L318 PolarHBondContact O-N 3.35Å
315	I	97.6	Very high	97	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-40.9	173.8	-61.4	175	0	0	0	110.1	S268 H271 R272 L306 T310 D312 V313 E317 L318 V319	S268-I315 WeakPolarHBondContact O-CD1 3.26Å; H271-I315 HydrophobicContact CB-CD1 3.82Å; H271-I315 HydrophobicContact CB-CG1 4.43Å; H271-I315 HydrophobicContact CB-CG2 4.33Å; R272-I315 HydrophobicContact CB-CG1 4.32Å; L306-I315 HydrophobicContact CD1-CG2 4.3Å; L306-I315 HydrophobicContact CD2-CG2 3.9Å; L306-I315 HydrophobicContact CG-CG2 4.03Å; T310-I315 HydrophobicContact CG2-CB 4.15Å; T310-I315 HydrophobicContact CG2-CG2 3.8Å; D312-I315 HydrophobicContact CB-CB 4.19Å; D312-I315 HydrophobicContact CB-CD1 3.83Å; D312-I315 HydrophobicContact CB-CG1 4.04Å; D312-I315 PolarHBondContact O-N 3.47Å; D312-I315 PolarHBondContact OD1-N 2.96Å; V313-I315 PolarHBondContact O-N 2.7Å; I315-E317 VanDerWaalsContact C-N 3.35Å; I315-E317 PolarHBondContact O-N 2.9Å; I315-L318 PolarHBondContact O-N 3.25Å; I315-V319 HydrophobicContact CG2-CG2 4.11Å; I315-V319 WeakPolarHBondContact O-CB 3.39Å; I315-V319 VanDerWaalsContact O-CG2 3.24Å; I315-V319 WeakPolarHBondContact O-CG2 3.34Å; I315-V319 PolarHBondContact O-N 3.22Å
316	R	97.6	Very high	97	Very high	25 Å²	25	39.7 Å²	39.7	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-38.7	177.2	-63.8	164.3	64	78.1	6.6	111.7	L307 T310 D312 V313 E314 T320 S347 H352 V374	L307-R316 HydrophobicContact CD1-CB 4.15Å; L307-R316 HydrophobicContact CD1-CG 4.07Å; L307-R316 PolarHBondContact O-NH1 3.1Å; T310-R316 HydrophobicContact CG2-CG 3.79Å; T310-R316 WeakPolarHBondContact O-CD 3.34Å; T310-R316 PolarHBondContact O-NH1 3.35Å; D312-R316 WeakPolarHBondContact O-CD 3.47Å; D312-R316 WeakPolarHBondContact O-CG 3.46Å; D312-R316 PolarHBondContact O-N 2.76Å; D312-R316 VanDerWaalsContact O-N 3.08Å; V313-R316 CarbonylContact O-C 3.52Å; V313-R316 WeakPolarHBondContact O-CB 3.44Å; V313-R316 PolarHBondContact O-N 3.42Å; V313-R316 VanDerWaalsContact O-N 3.12Å; E314-R316 VanDerWaalsContact C-N 3.32Å; E314-R316 PolarHBondContact O-N 2.99Å; R316-T320 WeakPolarHBondContact O-CB 3.33Å; R316-T320 WeakPolarHBondContact O-CG2 3.43Å; R316-T320 PolarHBondContact O-N 3.24Å; R316-T320 PolarHBondContact O-OG1 2.94Å; R316-S347 PolarHBondContact NH2-O 3.47Å; R316-H352 PolarHBondContact NH2-NE2 2.63Å; R316-V374 HydrophobicContact CB-CG1 4.07Å; R316-V374 HydrophobicContact CB-CG2 4.13Å
317	E	97.3	Very high	97.1	Very high	65 Å²	65	39.5 Å²	39.5	30%	0.304	20%	0.2	S	C	.	.	H	α-helix	trans	-63.2	-47.4	173.1	-73	-172.9	-171.4	0	0	112	V313 E314 I315 T320 G321 Q373 V374 N377	V313-E317 HydrophobicContact CG1-CG 4.45Å; V313-E317 WeakPolarHBondContact O-CG 3.41Å; V313-E317 PolarHBondContact O-N 2.89Å; E314-E317 PolarHBondContact O-N 3.08Å; I315-E317 VanDerWaalsContact C-N 3.35Å; I315-E317 PolarHBondContact O-N 2.9Å; E317-T320 PolarHBondContact O-OG1 3.33Å; E317-T320 VanDerWaalsContact O-OG1 3.07Å; E317-G321 PolarHBondContact O-N 3.3Å; E317-Q373 HydrophobicContact CG-CB 4.18Å; E317-Q373 HydrophobicContact CG-CG 4.48Å; E317-V374 HydrophobicContact CB-CG2 4.43Å; E317-V374 HydrophobicContact CG-CB 4.44Å; E317-V374 HydrophobicContact CG-CG2 3.41Å; E317-V374 VanDerWaalsContact CG-CG2 3.41Å; E317-N377 PolarHBondContact O-ND2 3.36Å
318	L	98.4	Very high	97	Very high	24 Å²	24	42.1 Å²	42.1	13%	0.126	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-50.1	177.2	-70.3	170.3	0	0	0	111.2	R272 C275 E314 I315 T320 G321 V322	R272-L318 HydrophobicContact CB-CD1 4.36Å; R272-L318 HydrophobicContact CG-CD1 3.88Å; R272-L318 WeakPolarHBondContact O-CD1 3.28Å; C275-L318 HydrophobicContact CB-CB 3.68Å; C275-L318 HydrophobicContact CB-CD1 4.27Å; E314-L318 VanDerWaalsContact O-CG 3.32Å; E314-L318 WeakPolarHBondContact O-CG 3.49Å; E314-L318 PolarHBondContact O-N 3.35Å; I315-L318 PolarHBondContact O-N 3.25Å; L318-T320 PolarHBondContact O-N 3.37Å; L318-G321 CarbonylContact O-C 3.58Å; L318-G321 WeakPolarHBondContact O-CA 3.36Å; L318-G321 PolarHBondContact O-N 2.94Å; L318-G321 VanDerWaalsContact O-N 3.09Å; L318-V322 WeakPolarHBondContact O-CG2 3.4Å; L318-V322 PolarHBondContact O-N 3.06Å
319	V	98.7	Very high	97.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60	-47.9	-179.8	168.8	0	0	0	0	111.9	L303 L306 L307 I315 G321 V322 L323	L303-V319 HydrophobicContact CB-CG1 4.04Å; L303-V319 HydrophobicContact CD2-CB 4.4Å; L303-V319 HydrophobicContact CD2-CG1 4.09Å; L303-V319 HydrophobicContact CD2-CG2 4.12Å; L303-V319 WeakPolarHBondContact O-CG1 3.46Å; L306-V319 HydrophobicContact CD2-CG2 3.76Å; L306-V319 HydrophobicContact CG-CG2 4.13Å; L307-V319 HydrophobicContact CB-CG1 3.94Å; L307-V319 HydrophobicContact CD1-CG1 4.5Å; I315-V319 HydrophobicContact CG2-CG2 4.11Å; I315-V319 WeakPolarHBondContact O-CB 3.39Å; I315-V319 VanDerWaalsContact O-CG2 3.24Å; I315-V319 WeakPolarHBondContact O-CG2 3.34Å; I315-V319 PolarHBondContact O-N 3.22Å; V319-G321 VanDerWaalsContact C-N 3.27Å; V319-G321 PolarHBondContact O-N 2.87Å; V319-V322 PolarHBondContact O-N 2.89Å; V319-L323 HydrophobicContact CG1-CD1 4.38Å; V319-L323 WeakPolarHBondContact O-CG 3.45Å; V319-L323 PolarHBondContact O-N 3.15Å
320	T	98.6	Very high	97.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-32.9	175.2	52.7	0	0	0	0	111.9	L307 R316 E317 L318 L323 W324 L344 V348 V374 N377 A378	L307-T320 HydrophobicContact CD1-CG2 4.27Å; L307-T320 HydrophobicContact CD2-CG2 4.28Å; R316-T320 WeakPolarHBondContact O-CB 3.33Å; R316-T320 WeakPolarHBondContact O-CG2 3.43Å; R316-T320 PolarHBondContact O-N 3.24Å; R316-T320 PolarHBondContact O-OG1 2.94Å; E317-T320 PolarHBondContact O-OG1 3.33Å; E317-T320 VanDerWaalsContact O-OG1 3.07Å; L318-T320 PolarHBondContact O-N 3.37Å; T320-L323 PolarHBondContact O-N 2.86Å; T320-W324 WeakPolarHBondContact O-CB 3.46Å; T320-W324 PolarHBondContact O-N 2.9Å; T320-L344 HydrophobicContact CG2-CD2 4.18Å; T320-V348 HydrophobicContact CG2-CG2 4.29Å; T320-V374 HydrophobicContact CG2-CG1 3.89Å; T320-N377 VanDerWaalsContact OG1-CB 3.3Å; T320-N377 WeakPolarHBondContact OG1-CB 3.28Å; T320-N377 PolarHBondContact OG1-ND2 3Å; T320-A378 HydrophobicContact CG2-CB 4.37Å
321	G	98.6	Very high	97.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-38.8	172.6	0	0	0	0	0	113.7	E317 L318 V319 N325 N377	E317-G321 PolarHBondContact O-N 3.3Å; L318-G321 CarbonylContact O-C 3.58Å; L318-G321 WeakPolarHBondContact O-CA 3.36Å; L318-G321 PolarHBondContact O-N 2.94Å; L318-G321 VanDerWaalsContact O-N 3.09Å; V319-G321 VanDerWaalsContact C-N 3.27Å; V319-G321 PolarHBondContact O-N 2.87Å; G321-N325 PolarHBondContact O-N 3.35Å; G321-N377 PolarHBondContact N-ND2 3.37Å
322	V	98.8	Very high	97.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-49.3	171.6	-176.3	0	0	0	0	109.9	L278 R279 V282 L294 L303 L318 V319 W324 N325 L326	L278-V322 HydrophobicContact CB-CG2 4.27Å; R279-V322 HydrophobicContact CB-CG2 3.8Å; R279-V322 HydrophobicContact CG-CG2 4.5Å; V282-V322 HydrophobicContact CG2-CG1 4.08Å; L294-V322 HydrophobicContact CD1-CG1 4.16Å; L303-V322 HydrophobicContact CD1-CB 4.03Å; L303-V322 HydrophobicContact CD1-CG1 3.53Å; L303-V322 HydrophobicContact CD2-CB 4.14Å; L303-V322 HydrophobicContact CD2-CG1 4.27Å; L303-V322 HydrophobicContact CD2-CG2 4.29Å; L318-V322 WeakPolarHBondContact O-CG2 3.4Å; L318-V322 PolarHBondContact O-N 3.06Å; V319-V322 PolarHBondContact O-N 2.89Å; V322-W324 VanDerWaalsContact C-N 3.31Å; V322-W324 PolarHBondContact O-N 2.9Å; V322-N325 PolarHBondContact O-N 3.33Å; V322-N325 VanDerWaalsContact O-N 3.15Å; V322-L326 HydrophobicContact CG1-CD1 3.94Å; V322-L326 HydrophobicContact CG1-CG 4.23Å; V322-L326 VanDerWaalsContact O-CG 3.29Å; V322-L326 WeakPolarHBondContact O-CG 3.29Å; V322-L326 PolarHBondContact O-N 2.89Å
323	L	98.9	Very high	97.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-39.9	178.4	-69.1	170.6	0	0	0	112.3	I300 L303 V319 T320 L326 S327 L344 C381	I300-L323 HydrophobicContact CG2-CD2 4.43Å; L303-L323 HydrophobicContact CB-CD2 4.36Å; L303-L323 HydrophobicContact CD1-CD2 4.17Å; L303-L323 HydrophobicContact CD1-CG 4.46Å; V319-L323 HydrophobicContact CG1-CD1 4.38Å; V319-L323 WeakPolarHBondContact O-CG 3.45Å; V319-L323 PolarHBondContact O-N 3.15Å; T320-L323 PolarHBondContact O-N 2.86Å; L323-L326 HydrophobicContact CD2-CD1 4.42Å; L323-L326 PolarHBondContact O-N 3.05Å; L323-S327 WeakPolarHBondContact O-CB 3.34Å; L323-S327 PolarHBondContact O-N 2.83Å; L323-S327 PolarHBondContact O-OG 3.1Å; L323-L344 HydrophobicContact CD1-CD2 4.06Å; L323-C381 PolarHBondContact O-SG 3.17Å
324	W	98.7	Very high	98.1	Very high	63 Å²	63	29.5 Å²	29.5	24%	0.239	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-45.8	174.5	-173.2	15.7	0	0	0	111.7	T320 V322 L326 S327 N377 G380 C381	T320-W324 WeakPolarHBondContact O-CB 3.46Å; T320-W324 PolarHBondContact O-N 2.9Å; V322-W324 VanDerWaalsContact C-N 3.31Å; V322-W324 PolarHBondContact O-N 2.9Å; W324-L326 VanDerWaalsContact C-N 3.35Å; W324-L326 PolarHBondContact O-N 3.5Å; W324-S327 PolarHBondContact O-N 3.32Å; W324-S327 PolarHBondContact O-OG 2.81Å; W324-N377 HydrophobicContact CE3-CB 4.22Å; W324-N377 WeakPolarHBondContact CZ3-OD1 3.43Å; W324-G380 PolarHBondContact NE1-O 2.88Å; W324-C381 HydrophobicContact CB-CB 4.24Å
325	N	98.6	Very high	98.2	Very high	24 Å²	24	25.5 Å²	25.5	13%	0.128	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-41.4	175.1	-72.8	-9	0	0	0	112.1	R279 V282 K291 G321 V322 S328	R279-N325 PolarHBondContact O-ND2 3.1Å; V282-N325 HydrophobicContact CG2-CB 3.69Å; K291-N325 WeakPolarHBondContact CE-O 3.29Å; G321-N325 PolarHBondContact O-N 3.35Å; V322-N325 PolarHBondContact O-N 3.33Å; V322-N325 VanDerWaalsContact O-N 3.15Å; N325-S328 PolarHBondContact O-N 2.87Å; N325-S328 PolarHBondContact O-OG 2.67Å
326	L	98.8	Very high	98.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-43.3	177.5	-68.8	170.7	0	0	0	112.4	V282 K291 L294 I300 L303 V322 L323 W324 S328 C329 L332 I336	V282-L326 HydrophobicContact CB-CD2 4.2Å; V282-L326 HydrophobicContact CG1-CD2 4.06Å; V282-L326 HydrophobicContact CG2-CD2 4.27Å; V282-L326 HydrophobicContact CG2-CG 4.37Å; K291-L326 HydrophobicContact CB-CD2 3.86Å; K291-L326 HydrophobicContact CG-CD2 4.02Å; L294-L326 HydrophobicContact CB-CD2 4.5Å; L294-L326 HydrophobicContact CD1-CD2 4.31Å; L294-L326 HydrophobicContact CD2-CD1 3.7Å; L294-L326 HydrophobicContact CD2-CD2 4.04Å; I300-L326 HydrophobicContact CG1-CD1 3.94Å; L303-L326 HydrophobicContact CD1-CD1 3.97Å; V322-L326 HydrophobicContact CG1-CD1 3.94Å; V322-L326 HydrophobicContact CG1-CG 4.23Å; V322-L326 VanDerWaalsContact O-CG 3.29Å; V322-L326 WeakPolarHBondContact O-CG 3.29Å; V322-L326 PolarHBondContact O-N 2.89Å; L323-L326 HydrophobicContact CD2-CD1 4.42Å; L323-L326 PolarHBondContact O-N 3.05Å; W324-L326 VanDerWaalsContact C-N 3.35Å; W324-L326 PolarHBondContact O-N 3.5Å; L326-S328 PolarHBondContact O-N 3.21Å; L326-S328 VanDerWaalsContact O-N 3.08Å; L326-C329 PolarHBondContact O-N 3.31Å; L326-C329 VanDerWaalsContact O-N 3.1Å; L326-L332 HydrophobicContact CB-CD2 3.91Å; L326-L332 HydrophobicContact CD2-CD2 3.63Å; L326-L332 HydrophobicContact CG-CD2 4.31Å; L326-I336 HydrophobicContact CB-CD1 3.87Å
327	S	98.6	Very high	98.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-14.2	-177.6	66.5	0	0	0	0	115.1	L323 W324 C329 K333 I336 N384	L323-S327 WeakPolarHBondContact O-CB 3.34Å; L323-S327 PolarHBondContact O-N 2.83Å; L323-S327 PolarHBondContact O-OG 3.1Å; W324-S327 PolarHBondContact O-N 3.32Å; W324-S327 PolarHBondContact O-OG 2.81Å; S327-C329 PolarHBondContact O-N 3.41Å; S327-K333 WeakPolarHBondContact O-CE 3.22Å; S327-K333 WeakPolarHBondContact O-CG 3.42Å; S327-I336 VanDerWaalsContact CA-CD1 3.49Å; S327-N384 WeakPolarHBondContact O-CB 3.49Å; S327-N384 WeakPolarHBondContact OG-CB 3.46Å; S327-N384 PolarHBondContact OG-ND2 3.18Å
328	S	97.6	Very high	98.3	Very high	55 Å²	55	27.3 Å²	27.3	39%	0.385	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18	173.2	67.9	0	0	0	0	113.9	K291 N325 L326	K291-S328 PolarHBondContact NZ-OG 3.5Å; N325-S328 PolarHBondContact O-N 2.87Å; N325-S328 PolarHBondContact O-OG 2.67Å; L326-S328 PolarHBondContact O-N 3.21Å; L326-S328 VanDerWaalsContact O-N 3.08Å
329	C	97.9	Very high	98.3	Very high	9 Å²	9	29.6 Å²	29.6	6%	0.061	17%	0.165	C	C	.	.	S	Bend	trans	-95.1	124.2	177.3	-176	0	0	0	0	110.8	D288 K291 L326 S327 A331 L332 K333	D288-C329 VanDerWaalsContact CG-SG 3.59Å; D288-C329 PolarHBondContact OD2-SG 3.49Å; K291-C329 HydrophobicContact CD-CB 3.65Å; L326-C329 PolarHBondContact O-N 3.31Å; L326-C329 VanDerWaalsContact O-N 3.1Å; S327-C329 PolarHBondContact O-N 3.41Å; C329-A331 VanDerWaalsContact C-N 3.3Å; C329-A331 PolarHBondContact O-N 3.13Å; C329-L332 HydrophobicContact CB-CD1 4.13Å; C329-L332 PolarHBondContact O-N 3.48Å; C329-K333 PolarHBondContact O-N 2.97Å
330	D	96.7	Very high	98.3	Very high	117 Å²	117	29.6 Å²	29.6	63%	0.626	17%	0.165	S	C	*	.	H	α-helix	trans	-57.2	-39.9	-174.7	-71.2	-47.8	0	0	0	113.3	L332 K333	D330-L332 PolarHBondContact O-N 3.2Å; D330-L332 VanDerWaalsContact O-N 3.12Å; D330-K333 PolarHBondContact O-N 3.03Å; D330-K333 WeakPolarHBondContact OD1-CE 3.38Å; D330-K333 IonicContact OD1-NZ 3.77Å; D330-K333 PolarHBondContact OD1-NZ 3.46Å
331	A	97.1	Very high	98.3	Very high	72 Å²	72	30 Å²	30	60%	0.595	17%	0.167	S	C	*	.	H	α-helix	trans	-62.2	-19.2	178.4	0	0	0	0	0	113.9	C329	C329-A331 VanDerWaalsContact C-N 3.3Å; C329-A331 PolarHBondContact O-N 3.13Å
332	L	98.5	Very high	98.2	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-101.1	-12.4	-179	-81.5	74.4	0	0	0	113.7	K291 V292 K295 I300 L326 C329 D330 M334 P335 I336	K291-L332 HydrophobicContact CB-CD1 4.34Å; K291-L332 HydrophobicContact CB-CD2 3.83Å; V292-L332 HydrophobicContact CG2-CD1 3.76Å; K295-L332 HydrophobicContact CB-CD2 4.12Å; K295-L332 HydrophobicContact CB-CG 4.23Å; K295-L332 HydrophobicContact CG-CG 4.48Å; I300-L332 HydrophobicContact CD1-CD2 4.35Å; L326-L332 HydrophobicContact CB-CD2 3.91Å; L326-L332 HydrophobicContact CD2-CD2 3.63Å; L326-L332 HydrophobicContact CG-CD2 4.31Å; C329-L332 HydrophobicContact CB-CD1 4.13Å; C329-L332 PolarHBondContact O-N 3.48Å; D330-L332 PolarHBondContact O-N 3.2Å; D330-L332 VanDerWaalsContact O-N 3.12Å; L332-M334 PolarHBondContact O-N 2.94Å; L332-P335 WeakPolarHBondContact O-CD 3.34Å; L332-I336 HydrophobicContact CB-CD1 4.21Å; L332-I336 VanDerWaalsContact O-CG1 3.28Å; L332-I336 WeakPolarHBondContact O-CG1 3.5Å; L332-I336 PolarHBondContact O-N 3.41Å
333	K	98.4	Very high	98.2	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-43.9	-175	-67	178.1	179.2	169.8	0	112.5	S327 C329 D330 I336 I337 N384 V385 S387 A388	S327-K333 WeakPolarHBondContact O-CE 3.22Å; S327-K333 WeakPolarHBondContact O-CG 3.42Å; C329-K333 PolarHBondContact O-N 2.97Å; D330-K333 PolarHBondContact O-N 3.03Å; D330-K333 WeakPolarHBondContact OD1-CE 3.38Å; D330-K333 IonicContact OD1-NZ 3.77Å; D330-K333 PolarHBondContact OD1-NZ 3.46Å; K333-I336 PolarHBondContact O-N 3.48Å; K333-I337 WeakPolarHBondContact O-CG1 3.46Å; K333-I337 PolarHBondContact O-N 3.42Å; K333-N384 WeakPolarHBondContact CE-O 3.31Å; K333-V385 HydrophobicContact CB-CB 4.28Å; K333-V385 HydrophobicContact CB-CG1 4.06Å; K333-V385 HydrophobicContact CG-CG1 4.21Å; K333-S387 PolarHBondContact NZ-OG 3.38Å; K333-A388 HydrophobicContact CB-CB 3.56Å; K333-A388 HydrophobicContact CD-CB 3.85Å; K333-A388 HydrophobicContact CG-CB 4.32Å
334	M	98.2	Very high	98.2	Very high	49 Å²	49	33.4 Å²	33.4	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-69	-45.1	177.6	-74.9	-54.5	-52.5	0	0	113.9	L332 I336 I337 Q338 A388 E391 A392	L332-M334 PolarHBondContact O-N 2.94Å; M334-I336 VanDerWaalsContact C-N 3.3Å; M334-I336 PolarHBondContact O-N 2.72Å; M334-I337 HydrophobicContact CE-CG2 4.24Å; M334-I337 WeakPolarHBondContact O-CB 3.5Å; M334-I337 PolarHBondContact O-N 3.35Å; M334-I337 VanDerWaalsContact O-N 3.16Å; M334-Q338 WeakPolarHBondContact O-CG 3.49Å; M334-Q338 PolarHBondContact O-N 2.9Å; M334-A388 HydrophobicContact SD-CB 4.46Å; M334-E391 HydrophobicContact CE-CB 4.27Å; M334-E391 HydrophobicContact CE-CG 3.59Å; M334-E391 HydrophobicContact SD-CB 4.4Å; M334-E391 HydrophobicContact SD-CG 4.35Å; M334-A392 HydrophobicContact SD-CB 3.91Å
335	P	98.4	Very high	98.1	Very high	23 Å²	23	30.4 Å²	30.4	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-52.3	-43.2	168.3	-31.3	35.1	0	0	0	114	K295 I300 L332 Q338 D339	K295-P335 HydrophobicContact CG-CB 4.49Å; I300-P335 HydrophobicContact CD1-CB 4.19Å; L332-P335 WeakPolarHBondContact O-CD 3.34Å; P335-Q338 PolarHBondContact O-N 3.15Å; P335-D339 PolarHBondContact O-N 2.84Å
336	I	98.8	Very high	97.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-38	177.6	-67.1	167.5	0	0	0	111.5	I300 L326 S327 L332 K333 M334 Q338 A340 L341 V385	I300-I336 HydrophobicContact CD1-CG1 3.84Å; L326-I336 HydrophobicContact CB-CD1 3.87Å; S327-I336 VanDerWaalsContact CA-CD1 3.49Å; L332-I336 HydrophobicContact CB-CD1 4.21Å; L332-I336 VanDerWaalsContact O-CG1 3.28Å; L332-I336 WeakPolarHBondContact O-CG1 3.5Å; L332-I336 PolarHBondContact O-N 3.41Å; K333-I336 PolarHBondContact O-N 3.48Å; M334-I336 VanDerWaalsContact C-N 3.3Å; M334-I336 PolarHBondContact O-N 2.72Å; I336-Q338 VanDerWaalsContact C-N 3.32Å; I336-Q338 PolarHBondContact O-N 3.25Å; I336-A340 HydrophobicContact CG2-CB 4.11Å; I336-A340 WeakPolarHBondContact O-CA 3Å; I336-A340 VanDerWaalsContact O-CB 3.28Å; I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.43Å; I336-L341 PolarHBondContact O-N 3.04Å; I336-V385 HydrophobicContact CB-CG1 4.01Å; I336-V385 HydrophobicContact CG2-CG1 3.79Å
337	I	98.6	Very high	97.7	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-41.2	172	-73.8	-74.9	0	0	0	111.4	K333 M334 L341 V385 A392 R395 M396	K333-I337 WeakPolarHBondContact O-CG1 3.46Å; K333-I337 PolarHBondContact O-N 3.42Å; M334-I337 HydrophobicContact CE-CG2 4.24Å; M334-I337 WeakPolarHBondContact O-CB 3.5Å; M334-I337 PolarHBondContact O-N 3.35Å; M334-I337 VanDerWaalsContact O-N 3.16Å; I337-L341 HydrophobicContact CD1-CD2 4.18Å; I337-L341 HydrophobicContact CG2-CD2 4.34Å; I337-L341 WeakPolarHBondContact O-CB 3.35Å; I337-V385 HydrophobicContact CD1-CB 3.92Å; I337-V385 HydrophobicContact CD1-CG2 3.5Å; I337-V385 VanDerWaalsContact CD1-CG2 3.5Å; I337-V385 HydrophobicContact CG1-CB 3.85Å; I337-V385 HydrophobicContact CG1-CG2 3.96Å; I337-A392 HydrophobicContact CD1-CB 4.18Å; I337-A392 HydrophobicContact CG1-CB 4.03Å; I337-R395 HydrophobicContact CG2-CB 3.94Å; I337-R395 HydrophobicContact CG2-CG 4.34Å; I337-M396 HydrophobicContact CD1-CG 3.61Å; I337-M396 HydrophobicContact CD1-SD 3.76Å
338	Q	97.8	Very high	97.5	Very high	123 Å²	123	35.3 Å²	35.3	58%	0.575	21%	0.21	S	C	*	.	H	α-helix	trans	-71.4	-48.4	-178.5	-72.4	169.1	-36.6	0	0	112.1	M334 P335 I336	M334-Q338 WeakPolarHBondContact O-CG 3.49Å; M334-Q338 PolarHBondContact O-N 2.9Å; P335-Q338 PolarHBondContact O-N 3.15Å; I336-Q338 VanDerWaalsContact C-N 3.32Å; I336-Q338 PolarHBondContact O-N 3.25Å
339	D	97.8	Very high	97.4	Very high	72 Å²	72	32.7 Å²	32.7	39%	0.385	19%	0.192	S	C	.	.	H	α-helix	trans	-89.7	-34.1	-171.2	-67.7	-22	0	0	0	113.6	I300 P301 V304 P335	I300-D339 HydrophobicContact CG2-CB 3.71Å; P301-D339 WeakPolarHBondContact CD-OD2 3.33Å; V304-D339 WeakPolarHBondContact CG1-O 3.4Å; P335-D339 PolarHBondContact O-N 2.84Å
340	A	98.5	Very high	97.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-22.5	-165	0	0	0	0	0	115.2	V304 I336 A342 V343 L344	V304-A340 HydrophobicContact CG2-CB 3.57Å; I336-A340 HydrophobicContact CG2-CB 4.11Å; I336-A340 WeakPolarHBondContact O-CA 3Å; I336-A340 VanDerWaalsContact O-CB 3.28Å; I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.43Å; A340-A342 PolarHBondContact O-N 2.89Å; A340-V343 PolarHBondContact O-N 3.05Å; A340-V343 VanDerWaalsContact O-N 3.17Å; A340-L344 HydrophobicContact CB-CD1 4.07Å; A340-L344 HydrophobicContact CB-CG 4.36Å; A340-L344 WeakPolarHBondContact O-CB 3.4Å; A340-L344 WeakPolarHBondContact O-CG 3.46Å; A340-L344 PolarHBondContact O-N 3.09Å
341	L	98.6	Very high	96.8	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.052	19%	0.185	C	C	.	.	H	α-helix	trans	-53.9	-53	-172.6	174.5	59.8	0	0	0	113.4	I336 I337 V343 L344 T345 L382 R395 M396 C399 L402	I336-L341 PolarHBondContact O-N 3.04Å; I337-L341 HydrophobicContact CD1-CD2 4.18Å; I337-L341 HydrophobicContact CG2-CD2 4.34Å; I337-L341 WeakPolarHBondContact O-CB 3.35Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 2.72Å; L341-L344 PolarHBondContact O-N 3.49Å; L341-T345 WeakPolarHBondContact O-CB 3.34Å; L341-T345 PolarHBondContact O-N 3.39Å; L341-T345 PolarHBondContact O-OG1 3.47Å; L341-L382 HydrophobicContact CD1-CD2 3.7Å; L341-R395 HydrophobicContact CD2-CB 4.08Å; L341-M396 HydrophobicContact CD1-CG 3.85Å; L341-M396 HydrophobicContact CD2-CG 3.9Å; L341-C399 HydrophobicContact CD2-CB 4.2Å; L341-C399 HydrophobicContact CG-CB 4.28Å; L341-L402 HydrophobicContact CD1-CD2 3.95Å
342	A	97.9	Very high	96.3	Very high	55 Å²	55	29.6 Å²	29.6	46%	0.455	17%	0.167	S	C	.	.	H	α-helix	trans	-65.1	-35.6	-178.7	0	0	0	0	0	112.2	A340 N346	A340-A342 PolarHBondContact O-N 2.89Å; A342-N346 VanDerWaalsContact O-CB 3.29Å; A342-N346 WeakPolarHBondContact O-CB 3.48Å; A342-N346 VanDerWaalsContact O-CG 3.3Å; A342-N346 PolarHBondContact O-N 3.41Å; A342-N346 PolarHBondContact O-ND2 3.38Å
343	V	97.9	Very high	95.7	Very high	16 Å²	16	29.5 Å²	29.5	10%	0.097	17%	0.166	C	C	.	.	H	α-helix	trans	-75.5	-42.5	179.5	175	0	0	0	0	111.8	V304 L307 R308 A340 L341 T345 S347	V304-V343 HydrophobicContact CG1-CB 3.87Å; V304-V343 HydrophobicContact CG1-CG1 4.01Å; V304-V343 HydrophobicContact CG1-CG2 3.61Å; L307-V343 HydrophobicContact CD2-CG1 4.17Å; L307-V343 HydrophobicContact CG-CG1 4.41Å; R308-V343 HydrophobicContact CG-CG1 3.55Å; R308-V343 HydrophobicContact CG-CG2 4.14Å; A340-V343 PolarHBondContact O-N 3.05Å; A340-V343 VanDerWaalsContact O-N 3.17Å; L341-V343 VanDerWaalsContact C-N 3.32Å; L341-V343 PolarHBondContact O-N 2.72Å; V343-T345 VanDerWaalsContact C-N 3.26Å; V343-T345 PolarHBondContact O-N 2.93Å; V343-S347 WeakPolarHBondContact O-CA 3.41Å; V343-S347 WeakPolarHBondContact O-CB 3.42Å; V343-S347 PolarHBondContact O-N 2.89Å; V343-S347 PolarHBondContact O-OG 2.87Å
344	L	98.3	Very high	94.6	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-42.8	172.2	-72.4	171.4	0	0	0	110	L307 T320 L323 A340 L341 V348 I349 A378 C381 L382	L307-L344 HydrophobicContact CD2-CD2 3.93Å; T320-L344 HydrophobicContact CG2-CD2 4.18Å; L323-L344 HydrophobicContact CD1-CD2 4.06Å; A340-L344 HydrophobicContact CB-CD1 4.07Å; A340-L344 HydrophobicContact CB-CG 4.36Å; A340-L344 WeakPolarHBondContact O-CB 3.4Å; A340-L344 WeakPolarHBondContact O-CG 3.46Å; A340-L344 PolarHBondContact O-N 3.09Å; L341-L344 PolarHBondContact O-N 3.49Å; L344-V348 CarbonylContact O-C 3.57Å; L344-V348 WeakPolarHBondContact O-CA 3.27Å; L344-V348 VanDerWaalsContact O-CB 3.27Å; L344-V348 WeakPolarHBondContact O-CB 3.44Å; L344-V348 PolarHBondContact O-N 3.32Å; L344-I349 WeakPolarHBondContact O-CG1 3.31Å; L344-I349 PolarHBondContact O-N 3.39Å; L344-A378 HydrophobicContact CD2-CB 4.03Å; L344-C381 HydrophobicContact CD1-CB 4.42Å; L344-L382 HydrophobicContact CB-CD2 4.47Å; L344-L382 HydrophobicContact CD1-CD2 4.01Å; L344-L382 HydrophobicContact CD1-CG 4.46Å
345	T	97.3	Very high	93.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-64.7	-59	178	-54.6	0	0	0	0	111.8	L341 V343 I349 I350 C399 L402	L341-T345 WeakPolarHBondContact O-CB 3.34Å; L341-T345 PolarHBondContact O-N 3.39Å; L341-T345 PolarHBondContact O-OG1 3.47Å; V343-T345 VanDerWaalsContact C-N 3.26Å; V343-T345 PolarHBondContact O-N 2.93Å; T345-I349 PolarHBondContact O-N 2.71Å; T345-I350 HydrophobicContact CG2-CD1 3.91Å; T345-I350 HydrophobicContact CG2-CG1 4.13Å; T345-I350 PolarHBondContact O-N 3.25Å; T345-C399 PolarHBondContact OG1-SG 3.26Å; T345-L402 HydrophobicContact CG2-CB 3.81Å; T345-L402 HydrophobicContact CG2-CD1 4.22Å
346	N	95	Very high	92	Very high	91 Å²	91	38.2 Å²	38.2	49%	0.487	21%	0.206	S	C	.	.	I	π-helix	trans	-78.7	-26.3	-170.4	-63.4	-21.2	0	0	0	113.9	A342 P351	A342-N346 VanDerWaalsContact O-CB 3.29Å; A342-N346 WeakPolarHBondContact O-CB 3.48Å; A342-N346 VanDerWaalsContact O-CG 3.3Å; A342-N346 PolarHBondContact O-N 3.41Å; A342-N346 PolarHBondContact O-ND2 3.38Å; N346-P351 WeakPolarHBondContact O-CD 3.41Å; N346-P351 VanDerWaalsContact O-CG 3.26Å; N346-P351 WeakPolarHBondContact O-CG 3.37Å
347	S	93.9	Very high	90.1	Very high	35 Å²	35	40.8 Å²	40.8	25%	0.245	22%	0.224	C	C	.	.	I	π-helix	trans	-104.8	-9.9	-179.3	-50.5	0	0	0	0	113.9	R316 V343	R316-S347 PolarHBondContact NH2-O 3.47Å; V343-S347 WeakPolarHBondContact O-CA 3.41Å; V343-S347 WeakPolarHBondContact O-CB 3.42Å; V343-S347 PolarHBondContact O-N 2.89Å; V343-S347 PolarHBondContact O-OG 2.87Å
348	V	94.6	Very high	87.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-129.6	-64.1	175.2	-174	0	0	0	0	112.4	L307 T320 L344 I350 P351 H352 V374 A378	L307-V348 HydrophobicContact CD1-CG2 4.16Å; L307-V348 HydrophobicContact CD2-CG2 4.14Å; L307-V348 HydrophobicContact CG-CG2 4.49Å; T320-V348 HydrophobicContact CG2-CG2 4.29Å; L344-V348 CarbonylContact O-C 3.57Å; L344-V348 WeakPolarHBondContact O-CA 3.27Å; L344-V348 VanDerWaalsContact O-CB 3.27Å; L344-V348 WeakPolarHBondContact O-CB 3.44Å; L344-V348 PolarHBondContact O-N 3.32Å; V348-I350 PolarHBondContact O-N 2.86Å; V348-P351 WeakPolarHBondContact O-CD 3.3Å; V348-H352 WeakPolarHBondContact O-CB 3.33Å; V348-H352 PolarHBondContact O-CD2 3.07Å; V348-H352 VanDerWaalsContact O-CD2 3.23Å; V348-H352 PolarHBondContact O-N 3.33Å; V348-V374 HydrophobicContact CG1-CB 4.48Å; V348-V374 HydrophobicContact CG1-CG1 3.72Å; V348-V374 HydrophobicContact CG2-CG1 4.1Å; V348-A378 HydrophobicContact CB-CB 4.13Å; V348-A378 HydrophobicContact CG1-CB 3.66Å
349	I	95.2	Very high	85.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.262	C	S	.	.	I	π-helix	trans	-60.9	-51.1	-169.6	-53	-55.1	0	0	0	111.3	L344 T345 S353 L375 A378 T379 L382 L402 A405 L406	L344-I349 WeakPolarHBondContact O-CG1 3.31Å; L344-I349 PolarHBondContact O-N 3.39Å; T345-I349 PolarHBondContact O-N 2.71Å; I349-S353 WeakPolarHBondContact O-CB 3.3Å; I349-S353 PolarHBondContact O-N 2.98Å; I349-S353 PolarHBondContact O-OG 3.33Å; I349-S353 VanDerWaalsContact O-OG 3.05Å; I349-L375 HydrophobicContact CD1-CD1 3.78Å; I349-A378 HydrophobicContact CD1-CB 3.72Å; I349-T379 HydrophobicContact CD1-CG2 3.79Å; I349-L382 HydrophobicContact CD1-CD1 4.12Å; I349-L382 HydrophobicContact CG1-CD1 3.79Å; I349-L402 HydrophobicContact CG1-CD1 4.37Å; I349-L402 HydrophobicContact CG2-CD1 4.24Å; I349-A405 HydrophobicContact CG2-CB 3.86Å; I349-L406 HydrophobicContact CG2-CD2 4.32Å
350	I	92.8	Very high	83.7	Confident	24 Å²	24	44.6 Å²	44.6	12%	0.123	28%	0.279	C	S	.	.	H	α-helix	trans	-65.6	-54.7	-179.6	-63.3	171.2	0	0	0	110.9	T345 V348 H352 S353 N354 W355 D356 A405	T345-I350 HydrophobicContact CG2-CD1 3.91Å; T345-I350 HydrophobicContact CG2-CG1 4.13Å; T345-I350 PolarHBondContact O-N 3.25Å; V348-I350 PolarHBondContact O-N 2.86Å; I350-H352 VanDerWaalsContact C-N 3.34Å; I350-H352 PolarHBondContact O-N 2.92Å; I350-S353 PolarHBondContact O-N 3.48Å; I350-S353 VanDerWaalsContact O-N 3.14Å; I350-S353 PolarHBondContact O-OG 3.48Å; I350-N354 PolarHBondContact O-N 3.24Å; I350-W355 HydrophobicContact CD1-CZ3 4.44Å; I350-W355 HydrophobicContact CG1-CE3 4.4Å; I350-W355 HydrophobicContact CG2-CE3 4.36Å; I350-D356 HydrophobicContact CG2-CB 3.99Å; I350-A405 HydrophobicContact CG1-CB 4.13Å
351	P	89.4	Confident	81.6	Confident	63 Å²	63	49.7 Å²	49.7	41%	0.409	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-36.1	-178.4	-23.9	34.9	0	0	0	114	N346 V348 N354	N346-P351 WeakPolarHBondContact O-CD 3.41Å; N346-P351 VanDerWaalsContact O-CG 3.26Å; N346-P351 WeakPolarHBondContact O-CG 3.37Å; V348-P351 WeakPolarHBondContact O-CD 3.3Å; P351-N354 PolarHBondContact O-OD1 3.12Å
352	H	87.2	Confident	79.6	Confident	46 Å²	46	53.1 Å²	53.1	21%	0.213	32%	0.321	C	S	.	.	H	α-helix	trans	-82.2	-20.9	178	-68.8	-115	0	0	0	112.3	R316 V348 I350 L369 S372 L375	R316-H352 PolarHBondContact NH2-NE2 2.63Å; V348-H352 WeakPolarHBondContact O-CB 3.33Å; V348-H352 PolarHBondContact O-CD2 3.07Å; V348-H352 VanDerWaalsContact O-CD2 3.23Å; V348-H352 PolarHBondContact O-N 3.33Å; I350-H352 VanDerWaalsContact C-N 3.34Å; I350-H352 PolarHBondContact O-N 2.92Å; H352-L369 WeakPolarHBondContact O-CD2 3.16Å; H352-L369 WeakPolarHBondContact O-CG 3.38Å; H352-S372 PolarHBondContact ND1-OG 2.93Å; H352-L375 HydrophobicContact CB-CB 4.04Å; H352-L375 HydrophobicContact CB-CD1 4.18Å; H352-L375 HydrophobicContact CB-CD2 4.22Å; H352-L375 HydrophobicContact CB-CG 4.37Å
353	S	84.3	Confident	77.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-74.3	-24	171.5	70.6	0	0	0	0	113.6	I349 I350 W355 A405 Y408	I349-S353 WeakPolarHBondContact O-CB 3.3Å; I349-S353 PolarHBondContact O-N 2.98Å; I349-S353 PolarHBondContact O-OG 3.33Å; I349-S353 VanDerWaalsContact O-OG 3.05Å; I350-S353 PolarHBondContact O-N 3.48Å; I350-S353 VanDerWaalsContact O-N 3.14Å; I350-S353 PolarHBondContact O-OG 3.48Å; S353-W355 PolarHBondContact O-N 3.18Å; S353-W355 WeakPolarHBondContact OG-CB 3.32Å; S353-W355 PolarHBondContact OG-N 3.09Å; S353-A405 WeakPolarHBondContact OG-CB 3.34Å; S353-Y408 WeakPolarHBondContact O-CD1 3.37Å; S353-Y408 WeakPolarHBondContact O-CE1 3.44Å
354	N	76.1	Confident	75.3	Confident	32 Å²	32	60.1 Å²	60.1	17%	0.171	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	19	-169.2	-60.4	-60.7	0	0	0	114.9	I350 P351 D356 S357	I350-N354 PolarHBondContact O-N 3.24Å; P351-N354 PolarHBondContact O-OD1 3.12Å; N354-D356 VanDerWaalsContact C-N 3.32Å; N354-D356 PolarHBondContact O-N 2.85Å; N354-S357 PolarHBondContact O-N 3.12Å
355	W	76	Confident	73.4	Confident	93 Å²	93	63 Å²	63	35%	0.352	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-37.4	-180	167.5	57.1	0	0	0	113.1	I350 S353 S357 D404 A405 Y408	I350-W355 HydrophobicContact CD1-CZ3 4.44Å; I350-W355 HydrophobicContact CG1-CE3 4.4Å; I350-W355 HydrophobicContact CG2-CE3 4.36Å; S353-W355 PolarHBondContact O-N 3.18Å; S353-W355 WeakPolarHBondContact OG-CB 3.32Å; S353-W355 PolarHBondContact OG-N 3.09Å; W355-S357 VanDerWaalsContact C-N 3.29Å; W355-S357 PolarHBondContact O-N 3.46Å; W355-D404 HydrophobicContact CD2-CB 3.68Å; W355-D404 HydrophobicContact CE3-CB 4.03Å; W355-D404 HydrophobicContact CG-CB 4.41Å; W355-D404 HydrophobicContact CH2-CB 3.59Å; W355-D404 HydrophobicContact CZ2-CB 3.17Å; W355-D404 WeakPolarHBondContact CZ2-OD1 3.49Å; W355-D404 HydrophobicContact CZ3-CB 4.01Å; W355-A405 HydrophobicContact CB-CB 4.36Å; W355-A405 HydrophobicContact CE3-CB 4.3Å; W355-Y408 HydrophobicContact CB-CD1 4.01Å; W355-Y408 HydrophobicContact CB-CG 4.03Å; W355-Y408 HydrophobicContact CG-CG 4.47Å
356	D	66.1	Low	71.3	Confident	135 Å²	135	66.8 Å²	66.8	72%	0.722	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	20.7	-178.2	-162.8	30.8	0	0	0	113.3	I350 N354	I350-D356 HydrophobicContact CG2-CB 3.99Å; N354-D356 VanDerWaalsContact C-N 3.32Å; N354-D356 PolarHBondContact O-N 2.85Å
357	S	58.3	Low	69.3	Low	56 Å²	56	68 Å²	68	39%	0.392	38%	0.383	S	S	.	.	S	Bend	trans	-115.2	128.8	-175.1	-71.8	0	0	0	0	113.2	N354 W355	N354-S357 PolarHBondContact O-N 3.12Å; W355-S357 VanDerWaalsContact C-N 3.29Å; W355-S357 PolarHBondContact O-N 3.46Å
358	S	52.6	Low	67.6	Low	98 Å²	98	73.4 Å²	73.4	69%	0.685	40%	0.404	S	S	*	.			trans	-50.6	146.5	-178.5	-59.6	0	0	0	0	113.8	G360 R365	S358-G360 PolarHBondContact O-N 3.18Å; S358-R365 PolarHBondContact O-NH1 3.08Å; S358-R365 PolarHBondContact O-NH2 2.99Å
359	P	54.5	Low	66	Low	108 Å²	108	74 Å²	74	70%	0.701	41%	0.407	S	S	*	.	S	Bend	trans	-67.7	-0.7	-159.1	-23.5	35.3	0	0	0	118.1	H361	P359-H361 PolarHBondContact O-N 3.25Å
360	G	53.7	Low	64.3	Low	73 Å²	73	76.7 Å²	76.7	75%	0.753	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	8.3	-160.2	0	0	0	0	0	119	S358	S358-G360 PolarHBondContact O-N 3.18Å
361	H	53.1	Low	63	Low	107 Å²	107	81 Å²	81	50%	0.495	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	43.4	-174.5	-138.3	-80.6	0	0	0	113.9	P359 D363 D364 R365	P359-H361 PolarHBondContact O-N 3.25Å; H361-D363 PolarHBondContact O-N 2.71Å; H361-D364 IonicContact CE1-OD2 3.16Å; H361-D364 PolarHBondContact CE1-OD2 2.73Å; H361-D364 VanDerWaalsContact CE1-OD2 3.23Å; H361-D364 IonicContact ND1-OD2 3.88Å; H361-R365 WeakPolarHBondContact O-CD 3.35Å; H361-R365 WeakPolarHBondContact O-CG 3.5Å; H361-R365 PolarHBondContact O-NE 2.94Å
362	L	57.8	Low	62.8	Low	81 Å²	81	78.7 Å²	78.7	42%	0.424	43%	0.433	S	S	.	.	H	α-helix	trans	-63.8	-29.2	-165	-76.1	158.8	0	0	0	116.3	K366	L362-K366 PolarHBondContact O-N 3.19Å
363	D	53.5	Low	63.1	Low	112 Å²	112	79 Å²	79	60%	0.599	43%	0.434	S	S	*	.	H	α-helix	trans	-84.5	-45.9	-168.8	-69	-39.2	0	0	0	114.4	H361 R365 K366	H361-D363 PolarHBondContact O-N 2.71Å; D363-R365 PolarHBondContact O-N 2.9Å; D363-K366 PolarHBondContact O-N 3.05Å; D363-K366 IonicContact OD1-NZ 2.64Å; D363-K366 PolarHBondContact OD1-NZ 3.24Å
364	D	51.3	Low	63.7	Low	107 Å²	107	79 Å²	79	57%	0.572	43%	0.434	S	S	*	.	H	α-helix	trans	-61.1	-28.6	170.6	-76.8	-26.8	0	0	0	112.4	H361 K366	H361-D364 IonicContact CE1-OD2 3.16Å; H361-D364 PolarHBondContact CE1-OD2 2.73Å; H361-D364 VanDerWaalsContact CE1-OD2 3.23Å; H361-D364 IonicContact ND1-OD2 3.88Å; D364-K366 PolarHBondContact O-N 2.77Å
365	R	58.3	Low	64.6	Low	61 Å²	61	77.5 Å²	77.5	23%	0.23	43%	0.426	C	S	.	.	H	α-helix	trans	-69.1	-30.8	-179.9	-72.6	174.4	-170	170.7	4.3	113	S358 H361 D363 L369	S358-R365 PolarHBondContact O-NH1 3.08Å; S358-R365 PolarHBondContact O-NH2 2.99Å; H361-R365 WeakPolarHBondContact O-CD 3.35Å; H361-R365 WeakPolarHBondContact O-CG 3.5Å; H361-R365 PolarHBondContact O-NE 2.94Å; D363-R365 PolarHBondContact O-N 2.9Å; R365-L369 PolarHBondContact O-N 3.05Å
366	K	54.4	Low	65.6	Low	79 Å²	79	77.4 Å²	77.4	34%	0.343	43%	0.426	S	S	.	.	H	α-helix	trans	-62	-51.1	175.5	-74.8	167.9	-171.8	159.3	0	110.5	L362 D363 D364 H368 L369 H370	L362-K366 PolarHBondContact O-N 3.19Å; D363-K366 PolarHBondContact O-N 3.05Å; D363-K366 IonicContact OD1-NZ 2.64Å; D363-K366 PolarHBondContact OD1-NZ 3.24Å; D364-K366 PolarHBondContact O-N 2.77Å; K366-H368 VanDerWaalsContact C-N 3.3Å; K366-H368 PolarHBondContact O-N 2.75Å; K366-L369 VanDerWaalsContact O-CB 3.26Å; K366-L369 WeakPolarHBondContact O-CB 3.48Å; K366-L369 PolarHBondContact O-N 3.46Å; K366-L369 VanDerWaalsContact O-N 3.08Å; K366-H370 VanDerWaalsContact C-CD2 3.44Å; K366-H370 PolarHBondContact O-CD2 3.3Å; K366-H370 PolarHBondContact O-N 2.89Å; K366-H370 VanDerWaalsContact O-N 3.08Å; K366-H370 PolarHBondContact O-ND1 3.32Å; K366-H370 PolarHBondContact O-NE2 3.02Å
367	L	53	Low	67.1	Low	118 Å²	118	71.1 Å²	71.1	62%	0.618	39%	0.392	S	S	*	.	H	α-helix	trans	-53.5	-41.2	178.5	-85.2	149	0	0	0	113.9	T371	L367-T371 PolarHBondContact O-N 2.85Å; L367-T371 PolarHBondContact O-OG1 2.87Å
368	H	58.3	Low	69	Low	147 Å²	147	68.4 Å²	68.4	68%	0.681	37%	0.373	S	S	*	.	H	α-helix	trans	-70.2	-33.8	-179.6	-133	86.1	0	0	0	113	K366	K366-H368 VanDerWaalsContact C-N 3.3Å; K366-H368 PolarHBondContact O-N 2.75Å
369	L	61	Low	71.2	Confident	12 Å²	12	63.8 Å²	63.8	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-67.2	-43.5	175.3	-105.1	146.5	0	0	0	112.7	H352 R365 K366 T371 S372 L375 V409 I412	H352-L369 WeakPolarHBondContact O-CD2 3.16Å; H352-L369 WeakPolarHBondContact O-CG 3.38Å; R365-L369 PolarHBondContact O-N 3.05Å; K366-L369 VanDerWaalsContact O-CB 3.26Å; K366-L369 WeakPolarHBondContact O-CB 3.48Å; K366-L369 PolarHBondContact O-N 3.46Å; K366-L369 VanDerWaalsContact O-N 3.08Å; L369-T371 VanDerWaalsContact C-N 3.32Å; L369-T371 PolarHBondContact O-N 3.23Å; L369-S372 PolarHBondContact O-N 2.81Å; L369-L375 HydrophobicContact CD2-CD2 3.64Å; L369-V409 HydrophobicContact CD2-CG2 4.07Å; L369-I412 HydrophobicContact CD1-CD1 3.4Å; L369-I412 HydrophobicContact CD2-CD1 4.18Å; L369-I412 HydrophobicContact CG-CD1 4.33Å
370	H	58.6	Low	73.3	Confident	58 Å²	58	58.6 Å²	58.6	27%	0.269	31%	0.307	S	S	.	.	H	α-helix	trans	-67.2	-33.1	-173.7	-57.5	-25.4	0	0	0	112.6	K366 E418	K366-H370 VanDerWaalsContact C-CD2 3.44Å; K366-H370 PolarHBondContact O-CD2 3.3Å; K366-H370 PolarHBondContact O-N 2.89Å; K366-H370 VanDerWaalsContact O-N 3.08Å; K366-H370 PolarHBondContact O-ND1 3.32Å; K366-H370 PolarHBondContact O-NE2 3.02Å; H370-E418 HydrophobicContact CB-CG 3.94Å; H370-E418 VanDerWaalsContact CG-CG 3.5Å
371	T	64.6	Low	75.4	Confident	116 Å²	116	55.1 Å²	55.1	71%	0.712	27%	0.272	S	S	*	.	H	α-helix	trans	-93.7	-8	-178	-45.3	0	0	0	0	113.6	L367 L369 Q373	L367-T371 PolarHBondContact O-N 2.85Å; L367-T371 PolarHBondContact O-OG1 2.87Å; L369-T371 VanDerWaalsContact C-N 3.32Å; L369-T371 PolarHBondContact O-N 3.23Å; T371-Q373 PolarHBondContact O-N 2.85Å
372	S	86.6	Confident	77.6	Confident	13 Å²	13	50.1 Å²	50.1	9%	0.091	25%	0.248	C	C	.	.			trans	-71.6	96.3	-171	-177.1	0	0	0	0	113.7	H352 L369 V374 L375 R376	H352-S372 PolarHBondContact ND1-OG 2.93Å; L369-S372 PolarHBondContact O-N 2.81Å; S372-V374 PolarHBondContact O-N 2.97Å; S372-L375 PolarHBondContact O-N 2.72Å; S372-L375 WeakPolarHBondContact OG-CB 3.45Å; S372-L375 PolarHBondContact OG-N 3.47Å; S372-R376 PolarHBondContact O-N 3.4Å
373	Q	93.5	Very high	79.5	Confident	53 Å²	53	49 Å²	49	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-27.9	173.2	-173.8	63.2	43.7	0	0	111.7	E317 T371 R376 N377	E317-Q373 HydrophobicContact CG-CB 4.18Å; E317-Q373 HydrophobicContact CG-CG 4.48Å; T371-Q373 PolarHBondContact O-N 2.85Å; Q373-R376 PolarHBondContact O-N 3.22Å; Q373-N377 PolarHBondContact NE2-OD1 2.8Å; Q373-N377 WeakPolarHBondContact O-CB 3.36Å; Q373-N377 PolarHBondContact O-N 3.1Å; Q373-N377 PolarHBondContact O-ND2 2.87Å; Q373-N377 PolarHBondContact O-OD1 3.35Å
374	V	95.6	Very high	81.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-48.6	171.6	-167.7	0	0	0	0	110.7	V313 R316 E317 T320 V348 S372 N377 A378	V313-V374 HydrophobicContact CG1-CG2 4.15Å; R316-V374 HydrophobicContact CB-CG1 4.07Å; R316-V374 HydrophobicContact CB-CG2 4.13Å; E317-V374 HydrophobicContact CB-CG2 4.43Å; E317-V374 HydrophobicContact CG-CB 4.44Å; E317-V374 HydrophobicContact CG-CG2 3.41Å; E317-V374 VanDerWaalsContact CG-CG2 3.41Å; T320-V374 HydrophobicContact CG2-CG1 3.89Å; V348-V374 HydrophobicContact CG1-CB 4.48Å; V348-V374 HydrophobicContact CG1-CG1 3.72Å; V348-V374 HydrophobicContact CG2-CG1 4.1Å; S372-V374 PolarHBondContact O-N 2.97Å; V374-N377 PolarHBondContact O-N 3.36Å; V374-A378 WeakPolarHBondContact O-CB 3.43Å; V374-A378 PolarHBondContact O-N 3.15Å
375	L	95.6	Very high	83.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-42	177.7	179.4	62.6	0	0	0	111.5	I349 H352 L369 S372 N377 A378 T379 T423	I349-L375 HydrophobicContact CD1-CD1 3.78Å; H352-L375 HydrophobicContact CB-CB 4.04Å; H352-L375 HydrophobicContact CB-CD1 4.18Å; H352-L375 HydrophobicContact CB-CD2 4.22Å; H352-L375 HydrophobicContact CB-CG 4.37Å; L369-L375 HydrophobicContact CD2-CD2 3.64Å; S372-L375 PolarHBondContact O-N 2.72Å; S372-L375 WeakPolarHBondContact OG-CB 3.45Å; S372-L375 PolarHBondContact OG-N 3.47Å; L375-N377 PolarHBondContact O-N 3.33Å; L375-A378 PolarHBondContact O-N 3.43Å; L375-T379 HydrophobicContact CD1-CG2 3.98Å; L375-T379 HydrophobicContact CG-CG2 4.39Å; L375-T379 WeakPolarHBondContact O-CB 3.48Å; L375-T379 WeakPolarHBondContact O-CG2 3.34Å; L375-T379 PolarHBondContact O-N 2.71Å; L375-T379 PolarHBondContact O-OG1 2.99Å; L375-T423 HydrophobicContact CD2-CG2 3.94Å; L375-T423 HydrophobicContact CG-CG2 3.94Å
376	R	96.4	Very high	85.8	Confident	92 Å²	92	36.9 Å²	36.9	35%	0.347	18%	0.178	S	C	.	.	H	α-helix	trans	-59.8	-43.9	175.6	-176.6	-180	172.3	-171.7	7.3	112.2	S372 Q373 T379 G380 K422 N426	S372-R376 PolarHBondContact O-N 3.4Å; Q373-R376 PolarHBondContact O-N 3.22Å; R376-T379 PolarHBondContact O-OG1 3.46Å; R376-T379 VanDerWaalsContact O-OG1 3.06Å; R376-G380 PolarHBondContact O-N 2.88Å; R376-K422 HydrophobicContact CG-CB 4.44Å; R376-N426 PolarHBondContact O-ND2 3.2Å
377	N	98.2	Very high	87.8	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-67	-45.5	177.1	-70.5	-13.3	0	0	0	111.6	E317 T320 G321 W324 Q373 V374 L375 G380 C381	E317-N377 PolarHBondContact O-ND2 3.36Å; T320-N377 VanDerWaalsContact OG1-CB 3.3Å; T320-N377 WeakPolarHBondContact OG1-CB 3.28Å; T320-N377 PolarHBondContact OG1-ND2 3Å; G321-N377 PolarHBondContact N-ND2 3.37Å; W324-N377 HydrophobicContact CE3-CB 4.22Å; W324-N377 WeakPolarHBondContact CZ3-OD1 3.43Å; Q373-N377 PolarHBondContact NE2-OD1 2.8Å; Q373-N377 WeakPolarHBondContact O-CB 3.36Å; Q373-N377 PolarHBondContact O-N 3.1Å; Q373-N377 PolarHBondContact O-ND2 2.87Å; Q373-N377 PolarHBondContact O-OD1 3.35Å; V374-N377 PolarHBondContact O-N 3.36Å; L375-N377 PolarHBondContact O-N 3.33Å; N377-G380 PolarHBondContact O-N 2.79Å; N377-C381 PolarHBondContact O-N 3.21Å
378	A	98.4	Very high	89.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-45.2	179.8	0	0	0	0	0	112.1	T320 L344 V348 I349 V374 L375 G380 C381 L382	T320-A378 HydrophobicContact CG2-CB 4.37Å; L344-A378 HydrophobicContact CD2-CB 4.03Å; V348-A378 HydrophobicContact CB-CB 4.13Å; V348-A378 HydrophobicContact CG1-CB 3.66Å; I349-A378 HydrophobicContact CD1-CB 3.72Å; V374-A378 WeakPolarHBondContact O-CB 3.43Å; V374-A378 PolarHBondContact O-N 3.15Å; L375-A378 PolarHBondContact O-N 3.43Å; A378-G380 VanDerWaalsContact C-N 3.33Å; A378-G380 PolarHBondContact O-N 2.82Å; A378-C381 WeakPolarHBondContact O-CB 3.45Å; A378-C381 PolarHBondContact O-N 2.92Å; A378-L382 WeakPolarHBondContact O-CG 3.17Å; A378-L382 PolarHBondContact O-N 3.18Å
379	T	98.3	Very high	91.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-36.5	173.6	55.1	0	0	0	0	111.9	I349 L375 R376 L382 R383 L406 T423 N426	I349-T379 HydrophobicContact CD1-CG2 3.79Å; L375-T379 HydrophobicContact CD1-CG2 3.98Å; L375-T379 HydrophobicContact CG-CG2 4.39Å; L375-T379 WeakPolarHBondContact O-CB 3.48Å; L375-T379 WeakPolarHBondContact O-CG2 3.34Å; L375-T379 PolarHBondContact O-N 2.71Å; L375-T379 PolarHBondContact O-OG1 2.99Å; R376-T379 PolarHBondContact O-OG1 3.46Å; R376-T379 VanDerWaalsContact O-OG1 3.06Å; T379-L382 PolarHBondContact O-N 2.93Å; T379-R383 WeakPolarHBondContact O-CB 3.22Å; T379-R383 PolarHBondContact O-N 2.85Å; T379-L406 HydrophobicContact CG2-CD2 4.25Å; T379-T423 HydrophobicContact CG2-CG2 4.37Å; T379-N426 PolarHBondContact OG1-ND2 2.72Å
380	G	98.5	Very high	93	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-41.1	172.9	0	0	0	0	0	113	W324 R376 N377 A378 N384 N426	W324-G380 PolarHBondContact NE1-O 2.88Å; R376-G380 PolarHBondContact O-N 2.88Å; N377-G380 PolarHBondContact O-N 2.79Å; A378-G380 VanDerWaalsContact C-N 3.33Å; A378-G380 PolarHBondContact O-N 2.82Å; G380-N384 PolarHBondContact O-N 2.94Å; G380-N426 WeakPolarHBondContact CA-ND2 3.28Å; G380-N426 PolarHBondContact N-ND2 3.3Å; G380-N426 VanDerWaalsContact N-ND2 3.19Å
381	C	98.8	Very high	94.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-50.6	173.1	-174.9	0	0	0	0	111.6	L323 W324 L344 N377 A378 R383 N384 V385	L323-C381 PolarHBondContact O-SG 3.17Å; W324-C381 HydrophobicContact CB-CB 4.24Å; L344-C381 HydrophobicContact CD1-CB 4.42Å; N377-C381 PolarHBondContact O-N 3.21Å; A378-C381 WeakPolarHBondContact O-CB 3.45Å; A378-C381 PolarHBondContact O-N 2.92Å; C381-R383 VanDerWaalsContact C-N 3.34Å; C381-R383 PolarHBondContact O-N 3.4Å; C381-N384 PolarHBondContact O-N 2.92Å; C381-V385 PolarHBondContact O-N 3Å; C381-V385 VanDerWaalsContact O-N 3.13Å
382	L	98.8	Very high	96.4	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-36.9	179.8	-67.6	-173.9	0	0	0	112.7	L341 L344 I349 A378 T379 V385 S386 M396 L402 I430	L341-L382 HydrophobicContact CD1-CD2 3.7Å; L344-L382 HydrophobicContact CB-CD2 4.47Å; L344-L382 HydrophobicContact CD1-CD2 4.01Å; L344-L382 HydrophobicContact CD1-CG 4.46Å; I349-L382 HydrophobicContact CD1-CD1 4.12Å; I349-L382 HydrophobicContact CG1-CD1 3.79Å; A378-L382 WeakPolarHBondContact O-CG 3.17Å; A378-L382 PolarHBondContact O-N 3.18Å; T379-L382 PolarHBondContact O-N 2.93Å; L382-V385 HydrophobicContact CD2-CG2 4.28Å; L382-V385 WeakPolarHBondContact O-CG2 3.42Å; L382-V385 PolarHBondContact O-N 3.35Å; L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 2.68Å; L382-M396 HydrophobicContact CB-CE 4.01Å; L382-M396 HydrophobicContact CD2-CE 4.39Å; L382-L402 HydrophobicContact CD1-CD1 3.74Å; L382-I430 HydrophobicContact CB-CD1 3.77Å; L382-I430 HydrophobicContact CB-CG1 4.39Å
383	R	98.6	Very high	96.9	Very high	57 Å²	57	23.5 Å²	23.5	22%	0.215	12%	0.121	C	C	.	.	H	α-helix	trans	-56.7	-51.2	171.9	177.5	-173.2	-177.9	175.5	4.8	111.3	T379 C381 V385 S386 E425 N426 C429 I430	T379-R383 WeakPolarHBondContact O-CB 3.22Å; T379-R383 PolarHBondContact O-N 2.85Å; C381-R383 VanDerWaalsContact C-N 3.34Å; C381-R383 PolarHBondContact O-N 3.4Å; R383-V385 PolarHBondContact O-N 3.1Å; R383-S386 PolarHBondContact O-N 3.23Å; R383-S386 PolarHBondContact O-OG 3.43Å; R383-E425 IonicContact CZ-OE1 3.5Å; R383-E425 VanDerWaalsContact CZ-OE1 3.23Å; R383-E425 IonicContact NH1-OE1 3.62Å; R383-E425 PolarHBondContact NH1-OE1 2.63Å; R383-E425 IonicContact NH2-OE1 3.44Å; R383-E425 PolarHBondContact NH2-OE1 3.36Å; R383-N426 VanDerWaalsContact CD-OD1 3.26Å; R383-N426 WeakPolarHBondContact CD-OD1 3.47Å; R383-N426 PolarHBondContact NH1-OD1 2.89Å; R383-C429 HydrophobicContact CG-CB 3.76Å; R383-C429 VanDerWaalsContact CZ-SG 3.57Å; R383-C429 PolarHBondContact NH2-SG 3.47Å; R383-C429 VanDerWaalsContact NH2-SG 3.4Å; R383-I430 HydrophobicContact CB-CG1 3.97Å
384	N	98.4	Very high	97	Very high	26 Å²	26	24.4 Å²	24.4	14%	0.139	12%	0.122	C	C	.	.	H	α-helix	trans	-60.1	-47.9	-179.1	-74.8	-11	0	0	0	111.7	S327 K333 G380 C381 S386 S387	S327-N384 WeakPolarHBondContact O-CB 3.49Å; S327-N384 WeakPolarHBondContact OG-CB 3.46Å; S327-N384 PolarHBondContact OG-ND2 3.18Å; K333-N384 WeakPolarHBondContact CE-O 3.31Å; G380-N384 PolarHBondContact O-N 2.94Å; C381-N384 PolarHBondContact O-N 2.92Å; N384-S386 PolarHBondContact O-N 3.34Å; N384-S387 PolarHBondContact O-N 2.86Å; N384-S387 PolarHBondContact O-OG 3.42Å
385	V	98.6	Very high	97.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-72.3	-26.9	-177.4	-57.2	0	0	0	0	113.9	K333 I336 I337 C381 L382 R383 S387 A388 M396	K333-V385 HydrophobicContact CB-CB 4.28Å; K333-V385 HydrophobicContact CB-CG1 4.06Å; K333-V385 HydrophobicContact CG-CG1 4.21Å; I336-V385 HydrophobicContact CB-CG1 4.01Å; I336-V385 HydrophobicContact CG2-CG1 3.79Å; I337-V385 HydrophobicContact CD1-CB 3.92Å; I337-V385 HydrophobicContact CD1-CG2 3.5Å; I337-V385 VanDerWaalsContact CD1-CG2 3.5Å; I337-V385 HydrophobicContact CG1-CB 3.85Å; I337-V385 HydrophobicContact CG1-CG2 3.96Å; C381-V385 PolarHBondContact O-N 3Å; C381-V385 VanDerWaalsContact O-N 3.13Å; L382-V385 HydrophobicContact CD2-CG2 4.28Å; L382-V385 WeakPolarHBondContact O-CG2 3.42Å; L382-V385 PolarHBondContact O-N 3.35Å; R383-V385 PolarHBondContact O-N 3.1Å; V385-S387 PolarHBondContact O-N 2.88Å; V385-A388 VanDerWaalsContact O-CB 3.28Å; V385-A388 WeakPolarHBondContact O-CB 3.2Å; V385-A388 PolarHBondContact O-N 3.47Å; V385-M396 HydrophobicContact CG2-SD 4.2Å
386	S	98.2	Very high	97.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.3	174.9	72.9	0	0	0	0	114.3	L382 R383 N384 M396 N433	L382-S386 WeakPolarHBondContact O-CB 3.43Å; L382-S386 PolarHBondContact O-N 2.68Å; R383-S386 PolarHBondContact O-N 3.23Å; R383-S386 PolarHBondContact O-OG 3.43Å; N384-S386 PolarHBondContact O-N 3.34Å; S386-M396 VanDerWaalsContact CA-SD 3.59Å; S386-M396 VanDerWaalsContact CB-SD 3.59Å; S386-N433 PolarHBondContact OG-ND2 3.24Å
387	S	96.3	Very high	97.2	Very high	38 Å²	38	24.7 Å²	24.7	27%	0.266	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.6	174.6	69.7	0	0	0	0	114.7	K333 N384 V385 G389	K333-S387 PolarHBondContact NZ-OG 3.38Å; N384-S387 PolarHBondContact O-N 2.86Å; N384-S387 PolarHBondContact O-OG 3.42Å; V385-S387 PolarHBondContact O-N 2.88Å; S387-G389 PolarHBondContact O-N 2.69Å
388	A	92.9	Very high	97	Very high	32 Å²	32	30.5 Å²	30.5	26%	0.264	15%	0.15	S	C	.	.	S	Bend	trans	-76.2	30.7	-169.9	0	0	0	0	0	115.8	K333 M334 V385 A392	K333-A388 HydrophobicContact CB-CB 3.56Å; K333-A388 HydrophobicContact CD-CB 3.85Å; K333-A388 HydrophobicContact CG-CB 4.32Å; M334-A388 HydrophobicContact SD-CB 4.46Å; V385-A388 VanDerWaalsContact O-CB 3.28Å; V385-A388 WeakPolarHBondContact O-CB 3.2Å; V385-A388 PolarHBondContact O-N 3.47Å; A388-A392 HydrophobicContact CB-CB 3.84Å
389	G	94	Very high	96.9	Very high	28 Å²	28	31.4 Å²	31.4	29%	0.289	16%	0.156	S	C	.	.			trans	87.4	-170.1	178.2	0	0	0	0	0	114.8	S387 E391 R393	S387-G389 PolarHBondContact O-N 2.69Å; G389-E391 PolarHBondContact O-N 3.36Å; G389-R393 VanDerWaalsContact C-NH1 3.29Å; G389-R393 PolarHBondContact O-N 3.38Å; G389-R393 PolarHBondContact O-NH1 3.48Å
390	E	95.1	Very high	96.7	Very high	74 Å²	74	38.1 Å²	38.1	35%	0.346	19%	0.192	S	C	.	.	H	α-helix	trans	-62	-43	-172.5	-178.1	-179	132.5	0	0	112.7	A392 R393 R394 R437 E441	E390-A392 PolarHBondContact O-N 3.05Å; E390-R393 PolarHBondContact O-N 2.88Å; E390-R394 PolarHBondContact O-N 2.92Å; E390-R394 IonicContact OE1-CZ 2.67Å; E390-R394 IonicContact OE1-NH2 3.23Å; E390-R394 PolarHBondContact OE1-NH2 3.19Å; E390-R437 IonicContact OE2-NH1 2.73Å; E390-E441 HydrophobicContact CG-CB 4.41Å; E390-E441 HydrophobicContact CG-CG 3.88Å
391	E	95.5	Very high	96.5	Very high	69 Å²	69	38.6 Å²	38.6	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-60.7	-43.3	-176.5	-173.1	64.6	-160.7	0	0	112.7	M334 G389 R394 R395	M334-E391 HydrophobicContact CE-CB 4.27Å; M334-E391 HydrophobicContact CE-CG 3.59Å; M334-E391 HydrophobicContact SD-CB 4.4Å; M334-E391 HydrophobicContact SD-CG 4.35Å; G389-E391 PolarHBondContact O-N 3.36Å; E391-R394 PolarHBondContact O-N 2.86Å; E391-R394 IonicContact OE1-NH1 3.48Å; E391-R394 IonicContact OE2-CZ 3.76Å; E391-R394 IonicContact OE2-NH1 2.89Å; E391-R394 PolarHBondContact OE2-NH1 3.09Å; E391-R394 IonicContact OE2-NH2 3.76Å; E391-R395 VanDerWaalsContact CG-NH1 3.33Å; E391-R395 PolarHBondContact O-N 2.84Å; E391-R395 VanDerWaalsContact O-N 3.16Å; E391-R395 IonicContact OE1-CZ 3.48Å; E391-R395 IonicContact OE1-NH1 2.81Å; E391-R395 PolarHBondContact OE1-NH1 3.46Å; E391-R395 IonicContact OE1-NH2 3.08Å; E391-R395 PolarHBondContact OE1-NH2 2.94Å
392	A	97.1	Very high	96.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.6	-44.5	175.7	0	0	0	0	0	111.6	M334 I337 A388 E390 R394 R395 M396	M334-A392 HydrophobicContact SD-CB 3.91Å; I337-A392 HydrophobicContact CD1-CB 4.18Å; I337-A392 HydrophobicContact CG1-CB 4.03Å; A388-A392 HydrophobicContact CB-CB 3.84Å; E390-A392 PolarHBondContact O-N 3.05Å; A392-R394 VanDerWaalsContact C-N 3.3Å; A392-R394 PolarHBondContact O-N 2.91Å; A392-R395 PolarHBondContact O-N 3.37Å; A392-M396 WeakPolarHBondContact O-CB 3.06Å; A392-M396 VanDerWaalsContact O-CG 3.31Å; A392-M396 WeakPolarHBondContact O-CG 3.31Å; A392-M396 PolarHBondContact O-N 2.98Å
393	R	97.5	Very high	96.3	Very high	22 Å²	22	38.7 Å²	38.7	8%	0.083	20%	0.197	C	C	.	.	H	α-helix	trans	-60.3	-39.3	175	-71.8	-171.9	-64.9	-84.3	6	112.1	G389 E390 M396 R397 N433 L434 E441	G389-R393 VanDerWaalsContact C-NH1 3.29Å; G389-R393 PolarHBondContact O-N 3.38Å; G389-R393 PolarHBondContact O-NH1 3.48Å; E390-R393 PolarHBondContact O-N 2.88Å; R393-M396 PolarHBondContact O-N 3.36Å; R393-R397 WeakPolarHBondContact O-CB 3.32Å; R393-R397 VanDerWaalsContact O-CG 3.3Å; R393-R397 WeakPolarHBondContact O-CG 3.48Å; R393-R397 PolarHBondContact O-N 3.06Å; R393-R397 PolarHBondContact O-NE 3.46Å; R393-N433 WeakPolarHBondContact CD-O 3.5Å; R393-L434 HydrophobicContact CB-CD2 4.37Å; R393-L434 HydrophobicContact CG-CD2 4.49Å; R393-E441 IonicContact CZ-OE1 3.47Å; R393-E441 IonicContact CZ-OE2 2.75Å; R393-E441 IonicContact NE-OE1 2.74Å; R393-E441 IonicContact NE-OE2 3.67Å; R393-E441 PolarHBondContact NE-OE2 3.15Å; R393-E441 IonicContact NH2-OE1 3.09Å; R393-E441 PolarHBondContact NH2-OE1 3.24Å; R393-E441 IonicContact NH2-OE2 2.7Å
394	R	96	Very high	96.1	Very high	71 Å²	71	36.4 Å²	36.4	27%	0.268	19%	0.189	S	C	.	.	H	α-helix	trans	-62.3	-55.8	178.6	-153.6	-171.6	-53.5	106.9	5.7	110.6	E390 E391 A392 M396 R397 E398	E390-R394 PolarHBondContact O-N 2.92Å; E390-R394 IonicContact OE1-CZ 2.67Å; E390-R394 IonicContact OE1-NH2 3.23Å; E390-R394 PolarHBondContact OE1-NH2 3.19Å; E391-R394 PolarHBondContact O-N 2.86Å; E391-R394 IonicContact OE1-NH1 3.48Å; E391-R394 IonicContact OE2-CZ 3.76Å; E391-R394 IonicContact OE2-NH1 2.89Å; E391-R394 PolarHBondContact OE2-NH1 3.09Å; E391-R394 IonicContact OE2-NH2 3.76Å; A392-R394 VanDerWaalsContact C-N 3.3Å; A392-R394 PolarHBondContact O-N 2.91Å; R394-M396 VanDerWaalsContact C-N 3.29Å; R394-M396 PolarHBondContact O-N 3.27Å; R394-R397 PolarHBondContact O-N 2.78Å; R394-E398 WeakPolarHBondContact CG-OE1 3.49Å; R394-E398 WeakPolarHBondContact O-CB 3.21Å; R394-E398 WeakPolarHBondContact O-CG 3.48Å; R394-E398 PolarHBondContact O-N 2.99Å
395	R	97	Very high	95.9	Very high	86 Å²	86	35.1 Å²	35.1	33%	0.325	18%	0.183	S	C	.	.	H	α-helix	trans	-58.1	-37	176.6	-75.8	-162.8	-179.2	74.6	18.7	113.8	I337 L341 E391 A392 E398 C399	I337-R395 HydrophobicContact CG2-CB 3.94Å; I337-R395 HydrophobicContact CG2-CG 4.34Å; L341-R395 HydrophobicContact CD2-CB 4.08Å; E391-R395 VanDerWaalsContact CG-NH1 3.33Å; E391-R395 PolarHBondContact O-N 2.84Å; E391-R395 VanDerWaalsContact O-N 3.16Å; E391-R395 IonicContact OE1-CZ 3.48Å; E391-R395 IonicContact OE1-NH1 2.81Å; E391-R395 PolarHBondContact OE1-NH1 3.46Å; E391-R395 IonicContact OE1-NH2 3.08Å; E391-R395 PolarHBondContact OE1-NH2 2.94Å; A392-R395 PolarHBondContact O-N 3.37Å; R395-E398 CarbonylContact O-C 3.58Å; R395-E398 PolarHBondContact O-N 2.88Å; R395-C399 WeakPolarHBondContact O-CB 3.29Å; R395-C399 PolarHBondContact O-N 3.38Å
396	M	97.9	Very high	95.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.5	-33.4	176.6	-72	-176.6	75.1	0	0	113.1	I337 L341 L382 V385 S386 A392 R393 R394 E398 C399 L402 I430 L434	I337-M396 HydrophobicContact CD1-CG 3.61Å; I337-M396 HydrophobicContact CD1-SD 3.76Å; L341-M396 HydrophobicContact CD1-CG 3.85Å; L341-M396 HydrophobicContact CD2-CG 3.9Å; L382-M396 HydrophobicContact CB-CE 4.01Å; L382-M396 HydrophobicContact CD2-CE 4.39Å; V385-M396 HydrophobicContact CG2-SD 4.2Å; S386-M396 VanDerWaalsContact CA-SD 3.59Å; S386-M396 VanDerWaalsContact CB-SD 3.59Å; A392-M396 WeakPolarHBondContact O-CB 3.06Å; A392-M396 VanDerWaalsContact O-CG 3.31Å; A392-M396 WeakPolarHBondContact O-CG 3.31Å; A392-M396 PolarHBondContact O-N 2.98Å; R393-M396 PolarHBondContact O-N 3.36Å; R394-M396 VanDerWaalsContact C-N 3.29Å; R394-M396 PolarHBondContact O-N 3.27Å; M396-E398 VanDerWaalsContact C-N 3.35Å; M396-C399 PolarHBondContact O-N 2.89Å; M396-L402 HydrophobicContact CB-CD2 4.2Å; M396-L402 HydrophobicContact CE-CD2 3.96Å; M396-L402 HydrophobicContact CG-CD2 4.45Å; M396-I430 HydrophobicContact CE-CG2 3.77Å; M396-L434 HydrophobicContact CB-CD1 4.49Å; M396-L434 HydrophobicContact CB-CD2 3.42Å; M396-L434 VanDerWaalsContact CB-CD2 3.42Å; M396-L434 HydrophobicContact CG-CD2 4.48Å; M396-L434 HydrophobicContact SD-CD2 4.42Å
397	R	96.1	Very high	95.7	Very high	13 Å²	13	35.3 Å²	35.3	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-70.7	-32.1	172.6	-77.9	-176.2	-64.3	-123	1.1	112.4	R393 R394 C399 L434 E441 V500 L503	R393-R397 WeakPolarHBondContact O-CB 3.32Å; R393-R397 VanDerWaalsContact O-CG 3.3Å; R393-R397 WeakPolarHBondContact O-CG 3.48Å; R393-R397 PolarHBondContact O-N 3.06Å; R393-R397 PolarHBondContact O-NE 3.46Å; R394-R397 PolarHBondContact O-N 2.78Å; R397-C399 VanDerWaalsContact C-N 3.33Å; R397-L434 HydrophobicContact CG-CB 4.19Å; R397-L434 HydrophobicContact CG-CD2 4Å; R397-L434 PolarHBondContact NH1-O 3.43Å; R397-E441 IonicContact CZ-OE2 2.67Å; R397-E441 IonicContact NH1-OE2 3.69Å; R397-E441 PolarHBondContact NH1-OE2 3.43Å; R397-E441 VanDerWaalsContact NH2-CB 3.28Å; R397-E441 IonicContact NH2-OE2 2.6Å; R397-E441 PolarHBondContact NH2-OE2 3.38Å; R397-V500 HydrophobicContact CB-CG2 3.7Å; R397-V500 HydrophobicContact CG-CG2 3.92Å; R397-L503 HydrophobicContact CG-CD1 3.89Å
398	E	94.9	Very high	95.5	Very high	124 Å²	124	35.9 Å²	35.9	58%	0.579	18%	0.18	S	C	*	.	S	Bend	trans	-84.8	-2.9	176.6	-67.2	162.8	169.4	0	0	113.2	R394 R395 M396 D400	R394-E398 WeakPolarHBondContact CG-OE1 3.49Å; R394-E398 WeakPolarHBondContact O-CB 3.21Å; R394-E398 WeakPolarHBondContact O-CG 3.48Å; R394-E398 PolarHBondContact O-N 2.99Å; R395-E398 CarbonylContact O-C 3.58Å; R395-E398 PolarHBondContact O-N 2.88Å; M396-E398 VanDerWaalsContact C-N 3.35Å; E398-D400 PolarHBondContact O-N 3.42Å
399	C	96.8	Very high	95.6	Very high	18 Å²	18	34.6 Å²	34.6	12%	0.122	17%	0.169	C	C	.	.	S	Bend	trans	-82.6	105.9	177.4	-169.7	0	0	0	0	109.9	L341 T345 R395 M396 R397 G401 L402	L341-C399 HydrophobicContact CD2-CB 4.2Å; L341-C399 HydrophobicContact CG-CB 4.28Å; T345-C399 PolarHBondContact OG1-SG 3.26Å; R395-C399 WeakPolarHBondContact O-CB 3.29Å; R395-C399 PolarHBondContact O-N 3.38Å; M396-C399 PolarHBondContact O-N 2.89Å; R397-C399 VanDerWaalsContact C-N 3.33Å; C399-G401 PolarHBondContact O-N 3.47Å; C399-L402 HydrophobicContact CB-CB 4.16Å; C399-L402 HydrophobicContact CB-CD2 4.24Å; C399-L402 WeakPolarHBondContact O-CB 3.15Å; C399-L402 PolarHBondContact O-N 3.46Å
400	D	94.6	Very high	95.6	Very high	142 Å²	142	33.3 Å²	33.3	76%	0.759	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	135.7	-178.8	-67.4	-41.2	0	0	0	112.6	E398 L402	E398-D400 PolarHBondContact O-N 3.42Å; D400-L402 PolarHBondContact O-N 3.16Å
401	G	93.6	Very high	95.5	Very high	10 Å²	10	34 Å²	34	10%	0.103	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	-9.7	178.4	0	0	0	0	0	116.8	C399 A405	C399-G401 PolarHBondContact O-N 3.47Å; G401-A405 WeakPolarHBondContact O-CB 2.83Å; G401-A405 PolarHBondContact O-N 3.5Å
402	L	97.3	Very high	95.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-47	-179.6	179.1	58.6	0	0	0	111.8	L341 T345 I349 L382 M396 C399 D400 L406	L341-L402 HydrophobicContact CD1-CD2 3.95Å; T345-L402 HydrophobicContact CG2-CB 3.81Å; T345-L402 HydrophobicContact CG2-CD1 4.22Å; I349-L402 HydrophobicContact CG1-CD1 4.37Å; I349-L402 HydrophobicContact CG2-CD1 4.24Å; L382-L402 HydrophobicContact CD1-CD1 3.74Å; M396-L402 HydrophobicContact CB-CD2 4.2Å; M396-L402 HydrophobicContact CE-CD2 3.96Å; M396-L402 HydrophobicContact CG-CD2 4.45Å; C399-L402 HydrophobicContact CB-CB 4.16Å; C399-L402 HydrophobicContact CB-CD2 4.24Å; C399-L402 WeakPolarHBondContact O-CB 3.15Å; C399-L402 PolarHBondContact O-N 3.46Å; D400-L402 PolarHBondContact O-N 3.16Å; L402-L406 HydrophobicContact CD1-CD1 3.77Å; L402-L406 HydrophobicContact CD1-CG 4Å; L402-L406 HydrophobicContact CG-CD1 3.93Å; L402-L406 WeakPolarHBondContact O-CB 3.25Å; L402-L406 WeakPolarHBondContact O-CD1 3.22Å; L402-L406 WeakPolarHBondContact O-CG 3.16Å; L402-L406 PolarHBondContact O-N 3.24Å; L402-L406 VanDerWaalsContact O-N 3.12Å
403	T	96.1	Very high	94.9	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-65.6	-44.3	-177.3	-63.6	0	0	0	0	111.1	L407 L431 G499 M502 L503	T403-L407 HydrophobicContact CG2-CD1 3.99Å; T403-L407 WeakPolarHBondContact O-CB 3.44Å; T403-L407 WeakPolarHBondContact O-CG 3.28Å; T403-L407 PolarHBondContact O-N 3.31Å; T403-L431 HydrophobicContact CG2-CD2 4.26Å; T403-G499 VanDerWaalsContact CG2-O 3.28Å; T403-G499 WeakPolarHBondContact CG2-O 3.32Å; T403-M502 HydrophobicContact CG2-CB 4.31Å; T403-L503 HydrophobicContact CG2-CD2 3.76Å; T403-L503 HydrophobicContact CG2-CG 3.89Å
404	D	93.6	Very high	94.7	Very high	9 Å²	9	33.5 Å²	33.5	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-48.2	-179.1	-44.1	-108.8	0	0	0	111.2	W355 L406 L407 Y408 G499 M502	W355-D404 HydrophobicContact CD2-CB 3.68Å; W355-D404 HydrophobicContact CE3-CB 4.03Å; W355-D404 HydrophobicContact CG-CB 4.41Å; W355-D404 HydrophobicContact CH2-CB 3.59Å; W355-D404 HydrophobicContact CZ2-CB 3.17Å; W355-D404 WeakPolarHBondContact CZ2-OD1 3.49Å; W355-D404 HydrophobicContact CZ3-CB 4.01Å; D404-L406 PolarHBondContact O-N 3.05Å; D404-L407 PolarHBondContact O-N 3.36Å; D404-Y408 WeakPolarHBondContact O-CB 3.45Å; D404-Y408 PolarHBondContact O-N 2.84Å; D404-G499 PolarHBondContact OD1-N 3.47Å; D404-G499 WeakPolarHBondContact OD2-CA 3.33Å; D404-G499 PolarHBondContact OD2-N 2.82Å; D404-M502 HydrophobicContact CB-SD 4.29Å
405	A	95.6	Very high	94.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-41	179.2	0	0	0	0	0	112.5	I349 I350 S353 W355 G401 Y408 V409	I349-A405 HydrophobicContact CG2-CB 3.86Å; I350-A405 HydrophobicContact CG1-CB 4.13Å; S353-A405 WeakPolarHBondContact OG-CB 3.34Å; W355-A405 HydrophobicContact CB-CB 4.36Å; W355-A405 HydrophobicContact CE3-CB 4.3Å; G401-A405 WeakPolarHBondContact O-CB 2.83Å; G401-A405 PolarHBondContact O-N 3.5Å; A405-Y408 PolarHBondContact O-N 3.41Å; A405-V409 WeakPolarHBondContact O-CG2 3.4Å; A405-V409 PolarHBondContact O-N 3.05Å
406	L	96.9	Very high	93.8	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-39.6	175.4	-68.5	172	0	0	0	112.2	I349 T379 L402 D404 I410 C427 I430 L431	I349-L406 HydrophobicContact CG2-CD2 4.32Å; T379-L406 HydrophobicContact CG2-CD2 4.25Å; L402-L406 HydrophobicContact CD1-CD1 3.77Å; L402-L406 HydrophobicContact CD1-CG 4Å; L402-L406 HydrophobicContact CG-CD1 3.93Å; L402-L406 WeakPolarHBondContact O-CB 3.25Å; L402-L406 WeakPolarHBondContact O-CD1 3.22Å; L402-L406 WeakPolarHBondContact O-CG 3.16Å; L402-L406 PolarHBondContact O-N 3.24Å; L402-L406 VanDerWaalsContact O-N 3.12Å; D404-L406 PolarHBondContact O-N 3.05Å; L406-I410 WeakPolarHBondContact O-CG1 3.44Å; L406-I410 PolarHBondContact O-N 3Å; L406-C427 HydrophobicContact CD2-CB 4.14Å; L406-C427 WeakPolarHBondContact CD2-SG 3.47Å; L406-I430 HydrophobicContact CD1-CB 4.09Å; L406-I430 HydrophobicContact CD1-CD1 4.17Å; L406-I430 HydrophobicContact CD1-CG2 3.55Å; L406-I430 HydrophobicContact CD2-CD1 3.93Å; L406-L431 HydrophobicContact CB-CD1 4.37Å; L406-L431 HydrophobicContact CB-CD2 4.23Å; L406-L431 HydrophobicContact CB-CG 4.33Å; L406-L431 HydrophobicContact CD1-CD2 4.37Å
407	L	94.7	Very high	93.2	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-70	-37.7	175.5	-79.9	169.8	0	0	0	112.2	T403 D404 I410 Q411 L431 M502 I508	T403-L407 HydrophobicContact CG2-CD1 3.99Å; T403-L407 WeakPolarHBondContact O-CB 3.44Å; T403-L407 WeakPolarHBondContact O-CG 3.28Å; T403-L407 PolarHBondContact O-N 3.31Å; D404-L407 PolarHBondContact O-N 3.36Å; L407-I410 PolarHBondContact O-N 3.25Å; L407-Q411 VanDerWaalsContact O-CG 3.26Å; L407-Q411 WeakPolarHBondContact O-CG 3.24Å; L407-Q411 PolarHBondContact O-N 3.16Å; L407-L431 HydrophobicContact CD2-CD1 3.59Å; L407-L431 HydrophobicContact CG-CD1 3.83Å; L407-L431 HydrophobicContact CG-CD2 4.31Å; L407-M502 HydrophobicContact CB-CE 4.43Å; L407-M502 HydrophobicContact CD1-CB 3.52Å; L407-M502 HydrophobicContact CD1-CE 3.81Å; L407-M502 HydrophobicContact CD1-CG 4.31Å; L407-M502 HydrophobicContact CD1-SD 3.86Å; L407-I508 HydrophobicContact CD1-CD1 4.25Å; L407-I508 HydrophobicContact CD2-CD1 3.99Å; L407-I508 HydrophobicContact CD2-CG1 3.91Å
408	Y	93.3	Very high	92.7	Very high	50 Å²	50	37.8 Å²	37.8	20%	0.196	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-45.4	175.7	-173.9	-101.1	0	0	0	111.3	S353 W355 D404 A405 I410 Q411 I412	S353-Y408 WeakPolarHBondContact O-CD1 3.37Å; S353-Y408 WeakPolarHBondContact O-CE1 3.44Å; W355-Y408 HydrophobicContact CB-CD1 4.01Å; W355-Y408 HydrophobicContact CB-CG 4.03Å; W355-Y408 HydrophobicContact CG-CG 4.47Å; D404-Y408 WeakPolarHBondContact O-CB 3.45Å; D404-Y408 PolarHBondContact O-N 2.84Å; A405-Y408 PolarHBondContact O-N 3.41Å; Y408-I410 VanDerWaalsContact C-N 3.27Å; Y408-I410 PolarHBondContact O-N 3.2Å; Y408-Q411 PolarHBondContact O-N 3Å; Y408-Q411 VanDerWaalsContact O-N 3.1Å; Y408-I412 HydrophobicContact CD1-CD1 4.19Å; Y408-I412 HydrophobicContact CD1-CG2 4.25Å; Y408-I412 HydrophobicContact CD2-CG2 4.43Å; Y408-I412 HydrophobicContact CE1-CD1 4.02Å; Y408-I412 HydrophobicContact CE1-CG2 3.82Å; Y408-I412 HydrophobicContact CE2-CG2 4.01Å; Y408-I412 WeakPolarHBondContact O-CG1 3.07Å; Y408-I412 PolarHBondContact O-N 3.25Å
409	V	93.4	Very high	92.6	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.024	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-38.9	173.6	169	0	0	0	0	112.1	L369 A405 I412 S413 T423	L369-V409 HydrophobicContact CD2-CG2 4.07Å; A405-V409 WeakPolarHBondContact O-CG2 3.4Å; A405-V409 PolarHBondContact O-N 3.05Å; V409-I412 WeakPolarHBondContact O-CG1 3.36Å; V409-S413 PolarHBondContact O-OG 3.23Å; V409-T423 HydrophobicContact CG1-CG2 4.08Å
410	I	94.8	Very high	92.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-66.9	-48.9	173.9	-70.2	165.9	0	0	0	110.6	L406 L407 Y408 I412 S413 L414 C427 V428 L431 P511 L515	L406-I410 WeakPolarHBondContact O-CG1 3.44Å; L406-I410 PolarHBondContact O-N 3Å; L407-I410 PolarHBondContact O-N 3.25Å; Y408-I410 VanDerWaalsContact C-N 3.27Å; Y408-I410 PolarHBondContact O-N 3.2Å; I410-I412 PolarHBondContact O-N 3.37Å; I410-S413 PolarHBondContact O-N 2.93Å; I410-S413 VanDerWaalsContact O-N 3.13Å; I410-L414 HydrophobicContact CG2-CD2 4.29Å; I410-L414 WeakPolarHBondContact O-CG 3.49Å; I410-L414 PolarHBondContact O-N 2.86Å; I410-C427 HydrophobicContact CD1-CB 3.97Å; I410-C427 HydrophobicContact CG1-CB 3.93Å; I410-V428 HydrophobicContact CD1-CG2 3.63Å; I410-V428 HydrophobicContact CG1-CG2 4.08Å; I410-L431 HydrophobicContact CD1-CD1 3.47Å; I410-L431 VanDerWaalsContact CD1-CD1 3.47Å; I410-P511 HydrophobicContact CG2-CB 4.32Å; I410-L515 HydrophobicContact CG2-CD1 3.7Å; I410-L515 HydrophobicContact CG2-CD2 4.37Å; I410-L515 HydrophobicContact CG2-CG 4.3Å
411	Q	92.6	Very high	92.4	Very high	90 Å²	90	28.3 Å²	28.3	42%	0.421	18%	0.175	S	C	.	.	H	α-helix	trans	-60	-41.8	-174.8	-75.1	170.3	8.8	0	0	113.3	L407 Y408 S413 L414 P511	L407-Q411 VanDerWaalsContact O-CG 3.26Å; L407-Q411 WeakPolarHBondContact O-CG 3.24Å; L407-Q411 PolarHBondContact O-N 3.16Å; Y408-Q411 PolarHBondContact O-N 3Å; Y408-Q411 VanDerWaalsContact O-N 3.1Å; Q411-S413 VanDerWaalsContact C-N 3.27Å; Q411-S413 PolarHBondContact O-N 3.46Å; Q411-L414 PolarHBondContact O-N 3.19Å; Q411-P511 HydrophobicContact CG-CG 4.33Å
412	I	90.1	Very high	92.5	Very high	33 Å²	33	30.9 Å²	30.9	17%	0.169	18%	0.183	C	C	.	.	H	α-helix	trans	-74.6	-16.2	179.1	66.8	-173.4	0	0	0	113.8	L369 Y408 V409 I410	L369-I412 HydrophobicContact CD1-CD1 3.4Å; L369-I412 HydrophobicContact CD2-CD1 4.18Å; L369-I412 HydrophobicContact CG-CD1 4.33Å; Y408-I412 HydrophobicContact CD1-CD1 4.19Å; Y408-I412 HydrophobicContact CD1-CG2 4.25Å; Y408-I412 HydrophobicContact CD2-CG2 4.43Å; Y408-I412 HydrophobicContact CE1-CD1 4.02Å; Y408-I412 HydrophobicContact CE1-CG2 3.82Å; Y408-I412 HydrophobicContact CE2-CG2 4.01Å; Y408-I412 WeakPolarHBondContact O-CG1 3.07Å; Y408-I412 PolarHBondContact O-N 3.25Å; V409-I412 WeakPolarHBondContact O-CG1 3.36Å; I410-I412 PolarHBondContact O-N 3.37Å
413	S	91	Very high	92.4	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-91.2	-8.4	175	-73.3	0	0	0	0	113.6	V409 I410 Q411 S416 I419	V409-S413 PolarHBondContact O-OG 3.23Å; I410-S413 PolarHBondContact O-N 2.93Å; I410-S413 VanDerWaalsContact O-N 3.13Å; Q411-S413 VanDerWaalsContact C-N 3.27Å; Q411-S413 PolarHBondContact O-N 3.46Å; S413-S416 PolarHBondContact O-N 2.79Å; S413-S416 PolarHBondContact O-OG 3.4Å; S413-I419 WeakPolarHBondContact O-CB 3.34Å
414	L	91.7	Very high	92.4	Very high	42 Å²	42	31.5 Å²	31.5	22%	0.22	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	135.6	173.8	-55.8	-177.8	0	0	0	109.9	I410 Q411 S416 I419 P511 T514 L515	I410-L414 HydrophobicContact CG2-CD2 4.29Å; I410-L414 WeakPolarHBondContact O-CG 3.49Å; I410-L414 PolarHBondContact O-N 2.86Å; Q411-L414 PolarHBondContact O-N 3.19Å; L414-S416 PolarHBondContact O-N 3.23Å; L414-I419 HydrophobicContact CD2-CD1 4.27Å; L414-I419 HydrophobicContact CD2-CG1 4.45Å; L414-P511 HydrophobicContact CD1-CB 4.25Å; L414-T514 HydrophobicContact CB-CG2 4.09Å; L414-T514 HydrophobicContact CD1-CG2 4.11Å; L414-T514 HydrophobicContact CD2-CG2 3.95Å; L414-T514 HydrophobicContact CG-CG2 4.25Å; L414-L515 HydrophobicContact CD2-CD2 3.67Å; L414-L515 HydrophobicContact CD2-CG 3.88Å
415	G	87.2	Confident	92.6	Very high	69 Å²	69	31.2 Å²	31.2	71%	0.711	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	13.4	-174.4	0	0	0	0	0	115.8	E518	G415-E518 PolarHBondContact N-OE2 2.94Å; G415-E518 VanDerWaalsContact N-OE2 3.12Å
416	S	87.8	Confident	92.8	Very high	36 Å²	36	31.2 Å²	31.2	25%	0.252	19%	0.185	S	C	.	.	S	Bend	trans	-112.6	168.6	173.4	91	0	0	0	0	112.1	S413 L414 E418	S413-S416 PolarHBondContact O-N 2.79Å; S413-S416 PolarHBondContact O-OG 3.4Å; L414-S416 PolarHBondContact O-N 3.23Å; S416-E418 PolarHBondContact O-N 3.04Å; S416-E418 VanDerWaalsContact O-N 3.15Å; S416-E418 PolarHBondContact OG-N 3.26Å
417	S	85.9	Confident	92.8	Very high	102 Å²	102	31.2 Å²	31.2	71%	0.713	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-62.1	-17	174.3	55	0	0	0	0	113.7
418	E	85	Confident	93	Very high	53 Å²	53	31 Å²	31	25%	0.248	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-95.4	6	-169.7	-57.8	-54.7	130.2	0	0	113.6	H370 S416 D420 S421 V424	H370-E418 HydrophobicContact CB-CG 3.94Å; H370-E418 VanDerWaalsContact CG-CG 3.5Å; S416-E418 PolarHBondContact O-N 3.04Å; S416-E418 VanDerWaalsContact O-N 3.15Å; S416-E418 PolarHBondContact OG-N 3.26Å; E418-D420 PolarHBondContact O-N 2.99Å; E418-S421 WeakPolarHBondContact O-CB 3.37Å; E418-S421 PolarHBondContact O-N 2.85Å; E418-S421 PolarHBondContact O-OG 3.38Å; E418-V424 WeakPolarHBondContact O-CG2 3.49Å
419	I	92.4	Very high	93.2	Very high	11 Å²	11	29 Å²	29	6%	0.056	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-60.4	-27.4	177.7	-151.8	-175.1	0	0	0	112.5	S413 L414 V424 L515 E518 C519	S413-I419 WeakPolarHBondContact O-CB 3.34Å; L414-I419 HydrophobicContact CD2-CD1 4.27Å; L414-I419 HydrophobicContact CD2-CG1 4.45Å; I419-V424 WeakPolarHBondContact O-CG1 3.43Å; I419-L515 HydrophobicContact CD1-CD2 4.08Å; I419-L515 HydrophobicContact CG1-CD2 3.69Å; I419-E518 HydrophobicContact CD1-CB 3.45Å; I419-E518 VanDerWaalsContact CD1-CB 3.45Å; I419-C519 PolarHBondContact O-SG 3.45Å
420	D	93.4	Very high	93.5	Very high	48 Å²	48	28.9 Å²	28.9	26%	0.257	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-95.3	2.6	176.5	-77	-34.3	0	0	0	114	E418 C519 S520 N521	E418-D420 PolarHBondContact O-N 2.99Å; D420-C519 WeakPolarHBondContact OD1-CA 3.15Å; D420-C519 WeakPolarHBondContact OD1-CB 3.48Å; D420-S520 VanDerWaalsContact CG-N 3.33Å; D420-S520 PolarHBondContact OD1-N 3.14Å; D420-S520 WeakPolarHBondContact OD2-CB 3.33Å; D420-S520 PolarHBondContact OD2-N 2.65Å; D420-S520 PolarHBondContact OD2-OG 3.23Å; D420-N521 HydrophobicContact CB-CB 4.11Å; D420-N521 PolarHBondContact O-ND2 2.79Å; D420-N521 WeakPolarHBondContact OD1-CB 3.43Å; D420-N521 PolarHBondContact OD1-N 2.77Å
421	S	94.4	Very high	93.7	Very high	26 Å²	26	28.8 Å²	28.8	18%	0.182	18%	0.176	C	C	.	.	S	Bend	trans	-61.9	149.8	-177.9	69.5	0	0	0	0	112.7	E418 T423 V424 E425	E418-S421 WeakPolarHBondContact O-CB 3.37Å; E418-S421 PolarHBondContact O-N 2.85Å; E418-S421 PolarHBondContact O-OG 3.38Å; S421-T423 PolarHBondContact O-N 3.41Å; S421-T423 VanDerWaalsContact O-N 3.15Å; S421-V424 PolarHBondContact O-N 3.24Å; S421-V424 VanDerWaalsContact O-N 3.1Å; S421-V424 WeakPolarHBondContact OG-CG2 3.5Å; S421-V424 PolarHBondContact OG-N 3.31Å; S421-E425 PolarHBondContact O-N 3.23Å
422	K	95.1	Very high	94	Very high	64 Å²	64	27.2 Å²	27.2	28%	0.278	17%	0.166	S	C	.	.	H	α-helix	trans	-62.2	-24.8	178.6	-161.9	57.7	164.1	-171	0	112.6	R376 E425 N426	R376-K422 HydrophobicContact CG-CB 4.44Å; K422-E425 HydrophobicContact CD-CB 4.4Å; K422-E425 WeakPolarHBondContact CD-OE2 3.27Å; K422-E425 WeakPolarHBondContact CE-OE1 3.02Å; K422-E425 WeakPolarHBondContact CE-OE2 3.46Å; K422-E425 IonicContact NZ-OE1 3.34Å; K422-E425 PolarHBondContact NZ-OE1 3.13Å; K422-E425 IonicContact NZ-OE2 2.78Å; K422-E425 PolarHBondContact NZ-OE2 2.8Å; K422-N426 WeakPolarHBondContact O-CB 3.47Å; K422-N426 PolarHBondContact O-N 3.2Å; K422-N426 PolarHBondContact O-ND2 2.92Å
423	T	95.7	Very high	94.3	Very high	14 Å²	14	27.4 Å²	27.4	9%	0.086	17%	0.168	C	C	.	.	H	α-helix	trans	-68.3	-47.3	174.5	-54.8	0	0	0	0	110.9	L375 T379 V409 S421 N426 C427	L375-T423 HydrophobicContact CD2-CG2 3.94Å; L375-T423 HydrophobicContact CG-CG2 3.94Å; T379-T423 HydrophobicContact CG2-CG2 4.37Å; V409-T423 HydrophobicContact CG1-CG2 4.08Å; S421-T423 PolarHBondContact O-N 3.41Å; S421-T423 VanDerWaalsContact O-N 3.15Å; T423-N426 PolarHBondContact O-N 3.21Å; T423-C427 PolarHBondContact O-N 3.4Å; T423-C427 PolarHBondContact O-SG 2.92Å
424	V	96.6	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-46.1	174.6	172.4	0	0	0	0	110.7	E418 I419 S421 N426 C427 V428 L515 T524	E418-V424 WeakPolarHBondContact O-CG2 3.49Å; I419-V424 WeakPolarHBondContact O-CG1 3.43Å; S421-V424 PolarHBondContact O-N 3.24Å; S421-V424 VanDerWaalsContact O-N 3.1Å; S421-V424 WeakPolarHBondContact OG-CG2 3.5Å; S421-V424 PolarHBondContact OG-N 3.31Å; V424-N426 VanDerWaalsContact C-N 3.3Å; V424-N426 PolarHBondContact O-N 2.88Å; V424-C427 PolarHBondContact O-N 2.67Å; V424-V428 HydrophobicContact CG1-CG2 4.18Å; V424-V428 VanDerWaalsContact O-CG2 3.31Å; V424-V428 WeakPolarHBondContact O-CG2 3.34Å; V424-V428 PolarHBondContact O-N 3.42Å; V424-L515 HydrophobicContact CG1-CD2 3.97Å; V424-T524 HydrophobicContact CG1-CG2 4.18Å
425	E	97.7	Very high	94.9	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.014	16%	0.156	C	C	.	.	H	α-helix	trans	-55	-45.4	175.4	-169.7	-159.1	120.4	0	0	111.8	R383 S421 K422 C429 N521 D523 T524	R383-E425 IonicContact CZ-OE1 3.5Å; R383-E425 VanDerWaalsContact CZ-OE1 3.23Å; R383-E425 IonicContact NH1-OE1 3.62Å; R383-E425 PolarHBondContact NH1-OE1 2.63Å; R383-E425 IonicContact NH2-OE1 3.44Å; R383-E425 PolarHBondContact NH2-OE1 3.36Å; S421-E425 PolarHBondContact O-N 3.23Å; K422-E425 HydrophobicContact CD-CB 4.4Å; K422-E425 WeakPolarHBondContact CD-OE2 3.27Å; K422-E425 WeakPolarHBondContact CE-OE1 3.02Å; K422-E425 WeakPolarHBondContact CE-OE2 3.46Å; K422-E425 IonicContact NZ-OE1 3.34Å; K422-E425 PolarHBondContact NZ-OE1 3.13Å; K422-E425 IonicContact NZ-OE2 2.78Å; K422-E425 PolarHBondContact NZ-OE2 2.8Å; E425-C429 WeakPolarHBondContact O-CB 3.49Å; E425-C429 PolarHBondContact O-N 2.77Å; E425-C429 PolarHBondContact O-SG 2.77Å; E425-N521 PolarHBondContact OE2-ND2 3.12Å; E425-D523 HydrophobicContact CG-CB 3.8Å; E425-T524 WeakPolarHBondContact CB-OG1 3.34Å
426	N	98.2	Very high	95.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.3	-72.3	-23.3	0	0	0	112.1	R376 T379 G380 R383 K422 T423 V424 C429 I430	R376-N426 PolarHBondContact O-ND2 3.2Å; T379-N426 PolarHBondContact OG1-ND2 2.72Å; G380-N426 WeakPolarHBondContact CA-ND2 3.28Å; G380-N426 PolarHBondContact N-ND2 3.3Å; G380-N426 VanDerWaalsContact N-ND2 3.19Å; R383-N426 VanDerWaalsContact CD-OD1 3.26Å; R383-N426 WeakPolarHBondContact CD-OD1 3.47Å; R383-N426 PolarHBondContact NH1-OD1 2.89Å; K422-N426 WeakPolarHBondContact O-CB 3.47Å; K422-N426 PolarHBondContact O-N 3.2Å; K422-N426 PolarHBondContact O-ND2 2.92Å; T423-N426 PolarHBondContact O-N 3.21Å; V424-N426 VanDerWaalsContact C-N 3.3Å; V424-N426 PolarHBondContact O-N 2.88Å; N426-C429 PolarHBondContact O-N 2.77Å; N426-I430 VanDerWaalsContact O-CG1 3.28Å; N426-I430 WeakPolarHBondContact O-CG1 3.47Å; N426-I430 PolarHBondContact O-N 3.38Å
427	C	98.3	Very high	95.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.6	-48.7	177.6	-67.8	0	0	0	0	111.7	L406 I410 T423 V424 C429 I430 L431	L406-C427 HydrophobicContact CD2-CB 4.14Å; L406-C427 WeakPolarHBondContact CD2-SG 3.47Å; I410-C427 HydrophobicContact CD1-CB 3.97Å; I410-C427 HydrophobicContact CG1-CB 3.93Å; T423-C427 PolarHBondContact O-N 3.4Å; T423-C427 PolarHBondContact O-SG 2.92Å; V424-C427 PolarHBondContact O-N 2.67Å; C427-C429 VanDerWaalsContact C-N 3.35Å; C427-C429 PolarHBondContact O-N 3.13Å; C427-I430 PolarHBondContact O-N 3.36Å; C427-L431 WeakPolarHBondContact O-CG 3.35Å; C427-L431 PolarHBondContact O-N 2.96Å
428	V	98.5	Very high	95.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.3	-42.9	177	175.7	0	0	0	0	110.9	I410 V424 I430 L431 R432 L515 T524 A528	I410-V428 HydrophobicContact CD1-CG2 3.63Å; I410-V428 HydrophobicContact CG1-CG2 4.08Å; V424-V428 HydrophobicContact CG1-CG2 4.18Å; V424-V428 VanDerWaalsContact O-CG2 3.31Å; V424-V428 WeakPolarHBondContact O-CG2 3.34Å; V424-V428 PolarHBondContact O-N 3.42Å; V428-I430 PolarHBondContact O-N 3.45Å; V428-L431 PolarHBondContact O-N 3.16Å; V428-R432 VanDerWaalsContact O-CB 3.25Å; V428-R432 WeakPolarHBondContact O-CB 3.32Å; V428-R432 PolarHBondContact O-N 3.03Å; V428-L515 HydrophobicContact CG2-CD1 3.56Å; V428-T524 HydrophobicContact CG2-CG2 4.27Å; V428-A528 HydrophobicContact CG1-CB 4.11Å; V428-A528 VanDerWaalsContact CG1-N 3.3Å
429	C	98.4	Very high	96	Very high	9 Å²	9	22.9 Å²	22.9	6%	0.061	11%	0.111	C	C	.	.	H	α-helix	trans	-62.2	-41.2	175.8	-71.7	0	0	0	0	113	R383 E425 N426 C427 N433	R383-C429 HydrophobicContact CG-CB 3.76Å; R383-C429 VanDerWaalsContact CZ-SG 3.57Å; R383-C429 PolarHBondContact NH2-SG 3.47Å; R383-C429 VanDerWaalsContact NH2-SG 3.4Å; E425-C429 WeakPolarHBondContact O-CB 3.49Å; E425-C429 PolarHBondContact O-N 2.77Å; E425-C429 PolarHBondContact O-SG 2.77Å; N426-C429 PolarHBondContact O-N 2.77Å; C427-C429 VanDerWaalsContact C-N 3.35Å; C427-C429 PolarHBondContact O-N 3.13Å; C429-N433 VanDerWaalsContact O-CG 3.3Å; C429-N433 PolarHBondContact O-N 3.11Å; C429-N433 VanDerWaalsContact O-N 3.09Å
430	I	98.8	Very high	95.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-52.5	175.4	-66.2	158.2	0	0	0	109.6	L382 R383 M396 L406 N426 C427 V428 R432 N433 L434	L382-I430 HydrophobicContact CB-CD1 3.77Å; L382-I430 HydrophobicContact CB-CG1 4.39Å; R383-I430 HydrophobicContact CB-CG1 3.97Å; M396-I430 HydrophobicContact CE-CG2 3.77Å; L406-I430 HydrophobicContact CD1-CB 4.09Å; L406-I430 HydrophobicContact CD1-CD1 4.17Å; L406-I430 HydrophobicContact CD1-CG2 3.55Å; L406-I430 HydrophobicContact CD2-CD1 3.93Å; N426-I430 VanDerWaalsContact O-CG1 3.28Å; N426-I430 WeakPolarHBondContact O-CG1 3.47Å; N426-I430 PolarHBondContact O-N 3.38Å; C427-I430 PolarHBondContact O-N 3.36Å; V428-I430 PolarHBondContact O-N 3.45Å; I430-R432 VanDerWaalsContact C-N 3.33Å; I430-R432 PolarHBondContact O-N 2.95Å; I430-N433 CarbonylContact O-C 3.59Å; I430-N433 WeakPolarHBondContact O-CA 3.17Å; I430-N433 WeakPolarHBondContact O-CB 3.25Å; I430-N433 PolarHBondContact O-N 3.45Å; I430-L434 HydrophobicContact CG2-CD1 3.75Å; I430-L434 HydrophobicContact CG2-CG 4.12Å; I430-L434 WeakPolarHBondContact O-CG 3.15Å; I430-L434 PolarHBondContact O-N 3Å
431	L	98.6	Very high	95.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.6	-36	-177.3	-64.3	169.8	0	0	0	112.3	T403 L406 L407 I410 C427 V428 N433 L434 S435 L503 Y512	T403-L431 HydrophobicContact CG2-CD2 4.26Å; L406-L431 HydrophobicContact CB-CD1 4.37Å; L406-L431 HydrophobicContact CB-CD2 4.23Å; L406-L431 HydrophobicContact CB-CG 4.33Å; L406-L431 HydrophobicContact CD1-CD2 4.37Å; L407-L431 HydrophobicContact CD2-CD1 3.59Å; L407-L431 HydrophobicContact CG-CD1 3.83Å; L407-L431 HydrophobicContact CG-CD2 4.31Å; I410-L431 HydrophobicContact CD1-CD1 3.47Å; I410-L431 VanDerWaalsContact CD1-CD1 3.47Å; C427-L431 WeakPolarHBondContact O-CG 3.35Å; C427-L431 PolarHBondContact O-N 2.96Å; V428-L431 PolarHBondContact O-N 3.16Å; L431-N433 VanDerWaalsContact C-N 3.32Å; L431-N433 PolarHBondContact O-N 3.28Å; L431-L434 PolarHBondContact O-N 3.26Å; L431-S435 VanDerWaalsContact O-CB 3.24Å; L431-S435 WeakPolarHBondContact O-CB 3.21Å; L431-S435 PolarHBondContact O-N 3.27Å; L431-S435 PolarHBondContact O-OG 3.47Å; L431-L503 HydrophobicContact CD2-CD2 3.69Å; L431-Y512 WeakPolarHBondContact CB-OH 3.48Å
432	R	98.4	Very high	94.6	Very high	56 Å²	56	23 Å²	23	21%	0.211	12%	0.118	C	C	.	.	H	α-helix	trans	-56.9	-44.2	170.2	178.4	-93.2	-169.8	104.6	9.5	111.6	V428 I430 Y436 E526 G527 A531 N534	V428-R432 VanDerWaalsContact O-CB 3.25Å; V428-R432 WeakPolarHBondContact O-CB 3.32Å; V428-R432 PolarHBondContact O-N 3.03Å; I430-R432 VanDerWaalsContact C-N 3.33Å; I430-R432 PolarHBondContact O-N 2.95Å; R432-Y436 PolarHBondContact O-N 2.9Å; R432-E526 IonicContact CZ-OE1 3.76Å; R432-E526 IonicContact NH1-OE1 2.76Å; R432-E526 PolarHBondContact NH1-OE1 3.39Å; R432-E526 IonicContact NH2-OE1 3.5Å; R432-E526 PolarHBondContact NH2-OE1 2.87Å; R432-G527 WeakPolarHBondContact CG-O 3.21Å; R432-A531 HydrophobicContact CB-CB 4.08Å; R432-A531 HydrophobicContact CG-CB 4.45Å; R432-N534 PolarHBondContact O-ND2 3.35Å
433	N	98.3	Very high	93.1	Very high	37 Å²	37	24 Å²	24	20%	0.198	13%	0.133	C	C	.	.	H	α-helix	trans	-70.5	-43.5	177	-70.3	-12.6	0	0	0	111.9	S386 R393 C429 I430 L431 S435 Y436	S386-N433 PolarHBondContact OG-ND2 3.24Å; R393-N433 WeakPolarHBondContact CD-O 3.5Å; C429-N433 VanDerWaalsContact O-CG 3.3Å; C429-N433 PolarHBondContact O-N 3.11Å; C429-N433 VanDerWaalsContact O-N 3.09Å; I430-N433 CarbonylContact O-C 3.59Å; I430-N433 WeakPolarHBondContact O-CA 3.17Å; I430-N433 WeakPolarHBondContact O-CB 3.25Å; I430-N433 PolarHBondContact O-N 3.45Å; L431-N433 VanDerWaalsContact C-N 3.32Å; L431-N433 PolarHBondContact O-N 3.28Å; N433-S435 VanDerWaalsContact C-N 3.26Å; N433-S435 PolarHBondContact O-N 2.94Å; N433-Y436 VanDerWaalsContact O-CB 3.22Å; N433-Y436 WeakPolarHBondContact O-CB 3.17Å; N433-Y436 PolarHBondContact O-N 3.33Å; N433-Y436 VanDerWaalsContact O-N 3.1Å
434	L	98	Very high	91.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-30.5	177.4	-63.7	175.9	0	0	0	112.8	R393 M396 R397 I430 L431 Y436 L503	R393-L434 HydrophobicContact CB-CD2 4.37Å; R393-L434 HydrophobicContact CG-CD2 4.49Å; M396-L434 HydrophobicContact CB-CD1 4.49Å; M396-L434 HydrophobicContact CB-CD2 3.42Å; M396-L434 VanDerWaalsContact CB-CD2 3.42Å; M396-L434 HydrophobicContact CG-CD2 4.48Å; M396-L434 HydrophobicContact SD-CD2 4.42Å; R397-L434 HydrophobicContact CG-CB 4.19Å; R397-L434 HydrophobicContact CG-CD2 4Å; R397-L434 PolarHBondContact NH1-O 3.43Å; I430-L434 HydrophobicContact CG2-CD1 3.75Å; I430-L434 HydrophobicContact CG2-CG 4.12Å; I430-L434 WeakPolarHBondContact O-CG 3.15Å; I430-L434 PolarHBondContact O-N 3Å; L431-L434 PolarHBondContact O-N 3.26Å; L434-Y436 VanDerWaalsContact C-N 3.26Å; L434-Y436 PolarHBondContact O-N 3.18Å; L434-L503 HydrophobicContact CB-CD1 3.92Å; L434-L503 HydrophobicContact CB-CD2 4.49Å
435	S	97.1	Very high	88.8	Confident	1 Å²	1	29 Å²	29	1%	0.007	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.4	174.4	-59.1	0	0	0	0	114	L431 N433 L438	L431-S435 VanDerWaalsContact O-CB 3.24Å; L431-S435 WeakPolarHBondContact O-CB 3.21Å; L431-S435 PolarHBondContact O-N 3.27Å; L431-S435 PolarHBondContact O-OG 3.47Å; N433-S435 VanDerWaalsContact C-N 3.26Å; N433-S435 PolarHBondContact O-N 2.94Å; S435-L438 WeakPolarHBondContact O-CB 3.26Å
436	Y	96.8	Very high	86.3	Confident	52 Å²	52	36.2 Å²	36.2	20%	0.204	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	131.8	-179.6	176.9	-100	0	0	0	111.7	Y73 R432 N433 L434 L438	Y73-Y436 AromaticContact CE2-CE2 3.88Å; Y73-Y436 HydrophobicContact CE2-CE2 3.88Å; Y73-Y436 AromaticContact CE2-CZ 3.96Å; Y73-Y436 WeakPolarHBondContact CE2-OH 3.16Å; Y73-Y436 PolarHBondContact OH-OH 3.43Å; R432-Y436 PolarHBondContact O-N 2.9Å; N433-Y436 VanDerWaalsContact O-CB 3.22Å; N433-Y436 WeakPolarHBondContact O-CB 3.17Å; N433-Y436 PolarHBondContact O-N 3.33Å; N433-Y436 VanDerWaalsContact O-N 3.1Å; L434-Y436 VanDerWaalsContact C-N 3.26Å; L434-Y436 PolarHBondContact O-N 3.18Å; Y436-L438 PolarHBondContact O-N 3.28Å
437	R	92.9	Very high	83.5	Confident	117 Å²	117	41.3 Å²	41.3	44%	0.442	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	23.8	-177.9	-71	-176.5	72.5	-139.2	3.7	114.9	E390 A439 A440 E441	E390-R437 IonicContact OE2-NH1 2.73Å; R437-A439 VanDerWaalsContact C-N 3.26Å; R437-A439 PolarHBondContact O-N 3.29Å; R437-A439 VanDerWaalsContact O-N 3.1Å; R437-A440 WeakPolarHBondContact O-CA 3.39Å; R437-A440 PolarHBondContact O-N 2.79Å; R437-E441 HydrophobicContact CB-CG 3.93Å; R437-E441 WeakPolarHBondContact CB-OE1 3.15Å; R437-E441 IonicContact NH1-OE1 3.35Å; R437-E441 PolarHBondContact NH1-OE1 3.19Å; R437-E441 WeakPolarHBondContact O-CG 3.36Å; R437-E441 PolarHBondContact O-N 3.1Å
438	L	90.4	Very high	80.7	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-49.3	-41.8	-175.9	-166.9	62.6	0	0	0	113.7	S435 Y436 A440 E441 T442 L503 W504 L535 W540	S435-L438 WeakPolarHBondContact O-CB 3.26Å; Y436-L438 PolarHBondContact O-N 3.28Å; L438-A440 VanDerWaalsContact C-N 3.28Å; L438-A440 PolarHBondContact O-N 3.15Å; L438-E441 PolarHBondContact O-N 3.06Å; L438-T442 HydrophobicContact CD1-CG2 3.82Å; L438-T442 HydrophobicContact CG-CG2 4.46Å; L438-T442 WeakPolarHBondContact O-CB 3.31Å; L438-T442 WeakPolarHBondContact O-CG2 3.37Å; L438-T442 PolarHBondContact O-N 3.14Å; L438-T442 PolarHBondContact O-OG1 2.91Å; L438-L503 HydrophobicContact CD1-CB 4.45Å; L438-L503 HydrophobicContact CD1-CD1 4.1Å; L438-L503 HydrophobicContact CD2-CB 3.83Å; L438-W504 HydrophobicContact CD1-CE3 3.92Å; L438-W504 HydrophobicContact CD1-CZ3 4.1Å; L438-W504 HydrophobicContact CD2-CB 3.9Å; L438-W504 HydrophobicContact CD2-CE3 3.83Å; L438-W504 HydrophobicContact CG-CE3 3.8Å; L438-W504 HydrophobicContact CG-CZ3 4.39Å; L438-L535 HydrophobicContact CD2-CD2 3.65Å; L438-W540 HydrophobicContact CD2-CZ3 4.33Å; L438-W540 HydrophobicContact CG-CH2 4.36Å; L438-W540 HydrophobicContact CG-CZ3 4.3Å
439	A	87.1	Confident	77.7	Confident	36 Å²	36	47.4 Å²	47.4	30%	0.298	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-21	177.1	0	0	0	0	0	115.2	R437 G445 W540	R437-A439 VanDerWaalsContact C-N 3.26Å; R437-A439 PolarHBondContact O-N 3.29Å; R437-A439 VanDerWaalsContact O-N 3.1Å; A439-G445 VanDerWaalsContact O-CA 3.31Å; A439-G445 WeakPolarHBondContact O-CA 3.34Å; A439-W540 HydrophobicContact CB-CB 3.77Å; A439-W540 HydrophobicContact CB-CD2 3.45Å; A439-W540 VanDerWaalsContact CB-CD2 3.45Å; A439-W540 HydrophobicContact CB-CE3 3.57Å; A439-W540 HydrophobicContact CB-CG 3.6Å; A439-W540 HydrophobicContact CB-CZ3 4.22Å
440	A	87.9	Confident	74.5	Confident	58 Å²	58	52.3 Å²	52.3	48%	0.479	31%	0.307	S	S	.	.	H	α-helix	trans	-104.2	-22.2	-179.6	0	0	0	0	0	112.9	R437 L438	R437-A440 WeakPolarHBondContact O-CA 3.39Å; R437-A440 PolarHBondContact O-N 2.79Å; L438-A440 VanDerWaalsContact C-N 3.28Å; L438-A440 PolarHBondContact O-N 3.15Å
441	E	87.1	Confident	71.4	Confident	14 Å²	14	60 Å²	60	7%	0.065	34%	0.343	C	S	.	.	H	α-helix	trans	-106.2	6.4	-172.7	-59.7	179.6	179.7	0	0	113.7	E390 R393 R397 R437 L438	E390-E441 HydrophobicContact CG-CB 4.41Å; E390-E441 HydrophobicContact CG-CG 3.88Å; R393-E441 IonicContact CZ-OE1 3.47Å; R393-E441 IonicContact CZ-OE2 2.75Å; R393-E441 IonicContact NE-OE1 2.74Å; R393-E441 IonicContact NE-OE2 3.67Å; R393-E441 PolarHBondContact NE-OE2 3.15Å; R393-E441 IonicContact NH2-OE1 3.09Å; R393-E441 PolarHBondContact NH2-OE1 3.24Å; R393-E441 IonicContact NH2-OE2 2.7Å; R397-E441 IonicContact CZ-OE2 2.67Å; R397-E441 IonicContact NH1-OE2 3.69Å; R397-E441 PolarHBondContact NH1-OE2 3.43Å; R397-E441 VanDerWaalsContact NH2-CB 3.28Å; R397-E441 IonicContact NH2-OE2 2.6Å; R397-E441 PolarHBondContact NH2-OE2 3.38Å; R437-E441 HydrophobicContact CB-CG 3.93Å; R437-E441 WeakPolarHBondContact CB-OE1 3.15Å; R437-E441 IonicContact NH1-OE1 3.35Å; R437-E441 PolarHBondContact NH1-OE1 3.19Å; R437-E441 WeakPolarHBondContact O-CG 3.36Å; R437-E441 PolarHBondContact O-N 3.1Å; L438-E441 PolarHBondContact O-N 3.06Å
442	T	77.3	Confident	68.7	Low	17 Å²	17	67.6 Å²	67.6	10%	0.104	38%	0.378	C	S	.	.	S	Bend	trans	-122	146.3	178.8	60.1	0	0	0	0	111.3	L438 H444 G445 W504	L438-T442 HydrophobicContact CD1-CG2 3.82Å; L438-T442 HydrophobicContact CG-CG2 4.46Å; L438-T442 WeakPolarHBondContact O-CB 3.31Å; L438-T442 WeakPolarHBondContact O-CG2 3.37Å; L438-T442 PolarHBondContact O-N 3.14Å; L438-T442 PolarHBondContact O-OG1 2.91Å; T442-H444 VanDerWaalsContact C-N 3.26Å; T442-H444 PolarHBondContact O-N 2.81Å; T442-G445 WeakPolarHBondContact O-CA 3.47Å; T442-G445 PolarHBondContact O-N 3.19Å; T442-W504 HydrophobicContact CG2-CZ3 4.01Å
443	S	62.3	Low	65.7	Low	85 Å²	85	70.5 Å²	70.5	59%	0.594	40%	0.398	S	S	*	.	H	α-helix	trans	-57.9	-36.8	-176.2	-38.7	0	0	0	0	112.9	G445 Q446 Q447	S443-G445 PolarHBondContact O-N 2.93Å; S443-Q446 PolarHBondContact O-N 3.36Å; S443-Q447 PolarHBondContact O-N 3.15Å
444	H	54.2	Low	62.5	Low	94 Å²	94	74.9 Å²	74.9	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-21.2	173.9	-58.6	-56.1	0	0	0	113.8	T442 Q446 G448 W504	T442-H444 VanDerWaalsContact C-N 3.26Å; T442-H444 PolarHBondContact O-N 2.81Å; H444-Q446 VanDerWaalsContact C-N 3.34Å; H444-G448 PolarHBondContact O-N 3.13Å; H444-W504 AromaticContact CD2-CH2 3.67Å; H444-W504 AromaticContact CD2-CZ2 3.56Å
445	G	49.5	Very low	59.4	Low	25 Å²	25	78.3 Å²	78.3	26%	0.258	46%	0.456	S	S	.	.	H	α-helix	trans	-70.7	-27	170	0	0	0	0	0	113.6	A439 T442 S443	A439-G445 VanDerWaalsContact O-CA 3.31Å; A439-G445 WeakPolarHBondContact O-CA 3.34Å; T442-G445 WeakPolarHBondContact O-CA 3.47Å; T442-G445 PolarHBondContact O-N 3.19Å; S443-G445 PolarHBondContact O-N 2.93Å
446	Q	44	Very low	56.5	Low	153 Å²	153	84 Å²	84	72%	0.715	49%	0.486	S	S	*	.	H	α-helix	trans	-91.8	-43	176.9	-63.9	-158.3	-18.4	0	0	112.6	S443 H444 G448 G449 L450	S443-Q446 PolarHBondContact O-N 3.36Å; H444-Q446 VanDerWaalsContact C-N 3.34Å; Q446-G448 PolarHBondContact O-N 3.1Å; Q446-G449 PolarHBondContact O-N 2.9Å; Q446-L450 PolarHBondContact O-N 2.79Å
447	Q	40.7	Very low	53.5	Low	108 Å²	108	89.2 Å²	89.2	51%	0.505	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-37.3	178.2	-86.9	158.1	-37.4	0	0	112.9	S443 G449 L450 E451	S443-Q447 PolarHBondContact O-N 3.15Å; Q447-G449 PolarHBondContact O-N 3.19Å; Q447-L450 PolarHBondContact O-N 3.18Å; Q447-E451 PolarHBondContact O-N 3.07Å
448	G	38.5	Very low	50.6	Low	72 Å²	72	88.5 Å²	88.5	74%	0.742	53%	0.528	S	S	*	.	H	α-helix	trans	-66.4	4.7	175.1	0	0	0	0	0	115.9	H444 Q446	H444-G448 PolarHBondContact O-N 3.13Å; Q446-G448 PolarHBondContact O-N 3.1Å
449	G	35.3	Very low	47.6	Very low	55 Å²	55	95.7 Å²	95.7	57%	0.567	57%	0.567	S	S	*	*	H	α-helix	trans	-127.8	-6	173	0	0	0	0	0	115.3	Q446 Q447	Q446-G449 PolarHBondContact O-N 2.9Å; Q447-G449 PolarHBondContact O-N 3.19Å
450	L	32.3	Very low	45.1	Very low	113 Å²	113	98.6 Å²	98.6	59%	0.592	59%	0.591	S	S	*	*	H	α-helix	trans	-108.5	-32.4	-174.9	-165.8	63.1	0	0	0	113.6	Q446 Q447 E452 L453 D454	Q446-L450 PolarHBondContact O-N 2.79Å; Q447-L450 PolarHBondContact O-N 3.18Å; L450-E452 PolarHBondContact O-N 3.25Å; L450-E452 VanDerWaalsContact O-N 3.14Å; L450-L453 PolarHBondContact O-N 3.25Å; L450-D454 PolarHBondContact O-N 2.97Å
451	E	33.3	Very low	42.3	Very low	161 Å²	161	103.8 Å²	103.8	75%	0.752	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-15.8	176.3	-68	-176.9	168	0	0	113.5	Q447	Q447-E451 PolarHBondContact O-N 3.07Å
452	E	42.2	Very low	39.6	Very low	160 Å²	160	106.9 Å²	106.9	75%	0.748	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-7.7	173.7	-101.9	-168.8	154.6	0	0	114.5	L450	L450-E452 PolarHBondContact O-N 3.25Å; L450-E452 VanDerWaalsContact O-N 3.14Å
453	L	35.7	Very low	37.2	Very low	117 Å²	117	112.6 Å²	112.6	61%	0.613	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-30.8	-173.7	-166.2	60.6	0	0	0	114.7	L450	L450-L453 PolarHBondContact O-N 3.25Å
454	D	29.7	Very low	35.7	Very low	129 Å²	129	118 Å²	118	69%	0.69	70%	0.701	S	S	*	*	S	Bend	trans	-77.1	-25.5	-171.3	-153.4	44.2	0	0	0	113.8	L450 L456	L450-D454 PolarHBondContact O-N 2.97Å; D454-L456 PolarHBondContact O-N 3.49Å
455	G	32.8	Very low	34.4	Very low	72 Å²	72	117 Å²	117	74%	0.742	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	27.4	176.9	0	0	0	0	0	115.7
456	L	37.2	Very low	33.4	Very low	120 Å²	120	125.1 Å²	125.1	63%	0.628	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	-3	-174.2	-71.4	176.9	0	0	0	115.5	D454	D454-L456 PolarHBondContact O-N 3.49Å
457	L	34.1	Very low	32.8	Very low	161 Å²	161	122.9 Å²	122.9	84%	0.843	75%	0.749	S	S	*	*	S	Bend	trans	-129	-0.6	-174	-70.3	176.9	0	0	0	117.2
458	C	30.3	Very low	32.6	Very low	103 Å²	103	123.4 Å²	123.4	70%	0.696	76%	0.764	S	S	*	*			trans	-130.6	135.2	168.7	-54.1	0	0	0	0	108.1
459	D	27.3	Very low	32.2	Very low	157 Å²	157	123.5 Å²	123.5	84%	0.84	77%	0.765	S	S	*	*			cis	-131.1	152.2	9.3	-74.7	-55.5	0	0	0	112.8
460	A	35.1	Very low	32.1	Very low	96 Å²	96	126.8 Å²	126.8	79%	0.793	78%	0.778	S	S	*	*			trans	-118.9	85.6	164.4	0	0	0	0	0	110
461	N	30	Very low	32.2	Very low	168 Å²	168	133.9 Å²	133.9	90%	0.898	80%	0.797	S	S	*	*			trans	-173.3	141.6	148.7	-95	-21.3	0	0	0	108.9
462	G	30.9	Very low	32.2	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	80%	0.797	S	S	*	*			trans	-103.4	173.2	-166.3	0	0	0	0	0	115.3
463	C	26.6	Very low	32.1	Very low	138 Å²	138	132.7 Å²	132.7	93%	0.932	81%	0.808	S	S	*	*			trans	-151.9	155.8	145	-148.7	0	0	0	0	109.3
464	E	29.2	Very low	32.1	Very low	199 Å²	199	136.6 Å²	136.6	93%	0.93	82%	0.82	S	S	*	*			trans	-83.8	167.3	-166.5	-55.6	-171.5	129	0	0	114.6
465	G	27.4	Very low	32.5	Very low	73 Å²	73	140.4 Å²	140.4	75%	0.753	83%	0.83	S	S	*	*			trans	172.5	59.4	178.3	0	0	0	0	0	116.3
466	E	29.9	Very low	32.6	Very low	194 Å²	194	146.7 Å²	146.7	91%	0.907	84%	0.837	S	S	*	*			trans	33.5	117.2	151.8	-55.7	-172.3	122.2	0	0	122
467	S	30.4	Very low	32.5	Very low	107 Å²	107	150.2 Å²	150.2	75%	0.748	85%	0.847	S	S	*	*				147.8	124.7	107.9	-165.7	0	0	0	0	114.8
468	S	35.5	Very low	32.5	Very low	118 Å²	118	151.5 Å²	151.5	83%	0.825	85%	0.846	S	S	*	*			trans	40	127.9	142.1	-43.2	0	0	0	0	120.9
469	G	31.2	Very low	32.8	Very low	74 Å²	74	154.4 Å²	154.4	76%	0.763	85%	0.847	S	S	*	*			cis	172.7	176.3	1.3	0	0	0	0	0	112.6
470	C	33.2	Very low	33.2	Very low	124 Å²	124	149.6 Å²	149.6	84%	0.838	84%	0.835	S	S	*	*			trans	52.3	91.3	165	-75.3	0	0	0	0	122.1
471	W	34.6	Very low	33.6	Very low	262 Å²	262	148.9 Å²	148.9	99%	0.992	83%	0.829	S	S	*	*				56.2	93.4	124.8	-74	52.4	0	0	0	119.8
472	G	34.1	Very low	34.4	Very low	74 Å²	74	147.9 Å²	147.9	76%	0.763	82%	0.819	S	S	*	*			trans	-173.4	74.9	164	0	0	0	0	0	113.7	K474	G472-K474 VanDerWaalsContact C-N 3.27Å; G472-K474 PolarHBondContact O-N 2.91Å
473	K	39.3	Very low	35.8	Very low	223 Å²	223	153.1 Å²	153.1	97%	0.97	82%	0.823	S	S	*	*			trans	-69.6	71.8	-179.2	-77.1	-177.8	177.2	172.7	0	113.3
474	K	35.1	Very low	37.9	Very low	198 Å²	198	148.6 Å²	148.6	86%	0.861	79%	0.786	S	S	*	*			trans	-79.1	114.3	153.1	-88.6	-176.3	178.6	173.7	0	108.4	G472 K476	G472-K474 VanDerWaalsContact C-N 3.27Å; G472-K474 PolarHBondContact O-N 2.91Å; K474-K476 VanDerWaalsContact C-N 3.28Å; K474-K476 PolarHBondContact O-N 3.1Å
475	K	38.7	Very low	40	Very low	210 Å²	210	143.7 Å²	143.7	91%	0.913	77%	0.766	S	S	*	*			trans	-65.2	86.6	175.7	-155.5	176.4	-169.7	178.6	0	108.6	K477	K475-K477 PolarHBondContact O-N 3.25Å
476	K	35.6	Very low	41.8	Very low	203 Å²	203	140.4 Å²	140.4	88%	0.883	73%	0.732	S	S	*	*			trans	-61.5	98.2	178	-170.3	174.3	-177.1	178.6	0	107.5	K474 K478	K474-K476 VanDerWaalsContact C-N 3.28Å; K474-K476 PolarHBondContact O-N 3.1Å; K476-K478 PolarHBondContact O-N 3.32Å
477	K	33.6	Very low	43.6	Very low	194 Å²	194	135.7 Å²	135.7	84%	0.843	72%	0.716	S	S	*	*			trans	-52.6	109.1	173.2	-177.3	178.9	-179.8	-177.3	0	106.3	K475 K479	K475-K477 PolarHBondContact O-N 3.25Å; K477-K479 PolarHBondContact O-N 3.44Å
478	K	34.6	Very low	45.5	Very low	188 Å²	188	133 Å²	133	82%	0.817	70%	0.697	S	S	*	*			trans	-51.2	113.8	172.6	-166	175.6	-176.4	-178.2	0	104.9	K476 G480	K476-K478 PolarHBondContact O-N 3.32Å; K478-G480 VanDerWaalsContact C-N 3.34Å; K478-G480 PolarHBondContact O-N 3.33Å
479	K	37.5	Very low	47.4	Very low	164 Å²	164	132.2 Å²	132.2	71%	0.713	69%	0.689	S	S	*	*			trans	-61	105.5	173.2	-91.3	-161.6	176.1	-163.2	0	104.5	K477 E482	K477-K479 PolarHBondContact O-N 3.44Å; K479-E482 VanDerWaalsContact CE-OE1 3.25Å; K479-E482 WeakPolarHBondContact CE-OE1 3.48Å; K479-E482 IonicContact NZ-OE1 2.77Å; K479-E482 PolarHBondContact NZ-OE1 3.34Å
480	G	34.5	Very low	49.6	Very low	57 Å²	57	131.1 Å²	131.1	59%	0.588	66%	0.664	S	S	*	*			trans	-58.6	148.4	159.4	0	0	0	0	0	107.3	K478 E482	K478-G480 VanDerWaalsContact C-N 3.34Å; K478-G480 PolarHBondContact O-N 3.33Å; G480-E482 PolarHBondContact O-N 3.43Å; G480-E482 VanDerWaalsContact O-N 3.16Å
481	A	43.5	Very low	51.4	Low	81 Å²	81	128 Å²	128	67%	0.669	64%	0.642	S	S	*	*			trans	-47.8	126.6	177.2	0	0	0	0	0	109.1	Q483	A481-Q483 PolarHBondContact O-N 3.49Å
482	E	48.2	Very low	52.7	Low	146 Å²	146	123.1 Å²	123.1	68%	0.682	64%	0.636	S	S	*	*			trans	-66.8	101.6	-174.9	-77.1	175.8	179.7	0	0	108.5	K479 G480 W484	K479-E482 VanDerWaalsContact CE-OE1 3.25Å; K479-E482 WeakPolarHBondContact CE-OE1 3.48Å; K479-E482 IonicContact NZ-OE1 2.77Å; K479-E482 PolarHBondContact NZ-OE1 3.34Å; G480-E482 PolarHBondContact O-N 3.43Å; G480-E482 VanDerWaalsContact O-N 3.16Å; E482-W484 PolarHBondContact O-N 3.08Å
483	Q	59.2	Low	54.2	Low	189 Å²	189	122.9 Å²	122.9	88%	0.883	62%	0.619	S	S	*	*			trans	-57	112.7	171.8	-178	177.2	26.1	0	0	107.2	A481 D485	A481-Q483 PolarHBondContact O-N 3.49Å; Q483-D485 PolarHBondContact O-N 2.74Å; Q483-D485 VanDerWaalsContact O-N 3.13Å
484	W	71.8	Confident	55.4	Low	43 Å²	43	117.7 Å²	117.7	16%	0.163	62%	0.618	C	S	.	*			trans	-51.1	121.4	-175.7	-178.9	79.7	0	0	0	110.2	E482 G486 S488 P489 F490 V544 Y545 A548	E482-W484 PolarHBondContact O-N 3.08Å; W484-G486 VanDerWaalsContact CH2-C 3.49Å; W484-G486 WeakPolarHBondContact CH2-O 3.25Å; W484-G486 PolarHBondContact O-N 2.89Å; W484-S488 VanDerWaalsContact CZ2-O 3.23Å; W484-S488 WeakPolarHBondContact CZ2-O 3.46Å; W484-S488 PolarHBondContact NE1-O 3.19Å; W484-P489 PolarHBondContact NE1-O 3.5Å; W484-F490 HydrophobicContact CH2-CD1 4.13Å; W484-F490 AromaticContact CH2-CE1 3.59Å; W484-F490 HydrophobicContact CH2-CE1 3.59Å; W484-F490 HydrophobicContact CH2-CZ 4.45Å; W484-F490 AromaticContact CZ2-CD1 3.79Å; W484-F490 HydrophobicContact CZ2-CD1 3.79Å; W484-F490 AromaticContact CZ2-CE1 3.67Å; W484-F490 HydrophobicContact CZ2-CE1 3.67Å; W484-V544 HydrophobicContact CE3-CG1 4.28Å; W484-V544 HydrophobicContact CZ3-CG1 4.33Å; W484-Y545 HydrophobicContact CB-CE1 3.86Å; W484-Y545 AromaticContact CD2-CD1 3.89Å; W484-Y545 HydrophobicContact CD2-CD1 3.89Å; W484-Y545 AromaticContact CD2-CE1 3.43Å; W484-Y545 HydrophobicContact CD2-CE1 3.43Å; W484-Y545 VanDerWaalsContact CD2-CE1 3.43Å; W484-Y545 AromaticContact CE3-CD1 3.57Å; W484-Y545 HydrophobicContact CE3-CD1 3.57Å; W484-Y545 AromaticContact CE3-CE1 3.5Å; W484-Y545 HydrophobicContact CE3-CE1 3.5Å; W484-Y545 AromaticContact CG-CE1 3.6Å; W484-Y545 HydrophobicContact CG-CE1 3.6Å; W484-Y545 HydrophobicContact CH2-CD1 4.23Å; W484-Y545 AromaticContact CZ3-CD1 3.73Å; W484-Y545 HydrophobicContact CZ3-CD1 3.73Å; W484-Y545 HydrophobicContact CZ3-CE1 4.14Å; W484-A548 HydrophobicContact CH2-CB 3.48Å; W484-A548 VanDerWaalsContact CH2-CB 3.48Å; W484-A548 HydrophobicContact CZ3-CB 3.67Å
485	D	71.5	Confident	57.3	Low	96 Å²	96	114.8 Å²	114.8	51%	0.513	61%	0.608	S	S	.	*			trans	-61.2	-5.8	-170.5	67.2	-2.6	0	0	0	114.9	Q483 V487 S488	Q483-D485 PolarHBondContact O-N 2.74Å; Q483-D485 VanDerWaalsContact O-N 3.13Å; D485-V487 VanDerWaalsContact C-N 3.33Å; D485-V487 PolarHBondContact OD1-N 3.08Å; D485-S488 VanDerWaalsContact CG-OG 3.24Å; D485-S488 WeakPolarHBondContact OD1-CB 3.35Å; D485-S488 PolarHBondContact OD1-N 3.23Å; D485-S488 PolarHBondContact OD1-OG 3.39Å; D485-S488 PolarHBondContact OD2-N 3.39Å; D485-S488 PolarHBondContact OD2-OG 3.49Å
486	G	67	Low	59.4	Low	4 Å²	4	109.1 Å²	109.1	4%	0.041	59%	0.592	C	S	.	*	S	Bend	trans	89.3	-10.9	-177.7	0	0	0	0	0	114.9	W484 R551 R586	W484-G486 VanDerWaalsContact CH2-C 3.49Å; W484-G486 WeakPolarHBondContact CH2-O 3.25Å; W484-G486 PolarHBondContact O-N 2.89Å; G486-R551 PolarHBondContact O-NH2 3.01Å; G486-R586 VanDerWaalsContact O-CZ 3.31Å; G486-R586 PolarHBondContact O-NH1 3.28Å; G486-R586 PolarHBondContact O-NH2 2.58Å
487	V	66.8	Low	61.9	Low	95 Å²	95	100.5 Å²	100.5	58%	0.576	56%	0.557	S	S	*	*	S	Bend	trans	-122.6	-43.6	-164.5	-177.1	0	0	0	0	111.4	D485 K552 R586	D485-V487 VanDerWaalsContact C-N 3.33Å; D485-V487 PolarHBondContact OD1-N 3.08Å; V487-K552 PolarHBondContact O-NZ 3.34Å; V487-R586 VanDerWaalsContact CG2-NH1 3.28Å
488	S	70.9	Confident	64.5	Low	49 Å²	49	97.3 Å²	97.3	34%	0.343	54%	0.543	S	S	.	.	S	Bend	trans	-45.7	161.8	177.7	-76.4	0	0	0	0	113	W484 D485 K552	W484-S488 VanDerWaalsContact CZ2-O 3.23Å; W484-S488 WeakPolarHBondContact CZ2-O 3.46Å; W484-S488 PolarHBondContact NE1-O 3.19Å; D485-S488 VanDerWaalsContact CG-OG 3.24Å; D485-S488 WeakPolarHBondContact OD1-CB 3.35Å; D485-S488 PolarHBondContact OD1-N 3.23Å; D485-S488 PolarHBondContact OD1-OG 3.39Å; D485-S488 PolarHBondContact OD2-N 3.39Å; D485-S488 PolarHBondContact OD2-OG 3.49Å; S488-K552 PolarHBondContact O-NZ 3.06Å
489	P	73.8	Confident	67.1	Low	102 Å²	102	89.3 Å²	89.3	66%	0.662	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-49.2	151.9	166.9	-26.3	36	0	0	0	111.2	W484	W484-P489 PolarHBondContact NE1-O 3.5Å
490	F	77.9	Confident	69.6	Low	51 Å²	51	83.5 Å²	83.5	22%	0.224	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-65.9	150.6	166.3	-59.9	-63.6	0	0	0	108	W484 D492 P506 Y545 A549 K552	W484-F490 HydrophobicContact CH2-CD1 4.13Å; W484-F490 AromaticContact CH2-CE1 3.59Å; W484-F490 HydrophobicContact CH2-CE1 3.59Å; W484-F490 HydrophobicContact CH2-CZ 4.45Å; W484-F490 AromaticContact CZ2-CD1 3.79Å; W484-F490 HydrophobicContact CZ2-CD1 3.79Å; W484-F490 AromaticContact CZ2-CE1 3.67Å; W484-F490 HydrophobicContact CZ2-CE1 3.67Å; F490-D492 PolarHBondContact O-N 3.22Å; F490-D492 VanDerWaalsContact O-N 3.13Å; F490-P506 HydrophobicContact CD1-CG 4.07Å; F490-P506 HydrophobicContact CD2-CB 4.13Å; F490-P506 HydrophobicContact CD2-CG 4.33Å; F490-P506 HydrophobicContact CE1-CB 4.5Å; F490-P506 HydrophobicContact CE1-CG 4.24Å; F490-P506 HydrophobicContact CE2-CB 4.01Å; F490-P506 HydrophobicContact CE2-CG 4.48Å; F490-P506 HydrophobicContact CG-CB 4.43Å; F490-P506 HydrophobicContact CG-CG 4.12Å; F490-P506 HydrophobicContact CZ-CB 4.21Å; F490-P506 HydrophobicContact CZ-CG 4.45Å; F490-Y545 HydrophobicContact CD1-CD1 4.22Å; F490-Y545 HydrophobicContact CD1-CD2 4.36Å; F490-Y545 AromaticContact CD1-CG 3.96Å; F490-Y545 HydrophobicContact CD1-CG 3.96Å; F490-Y545 HydrophobicContact CE1-CD1 4.41Å; F490-Y545 HydrophobicContact CE1-CG 4.22Å; F490-A549 HydrophobicContact CE2-CB 4.29Å; F490-A549 HydrophobicContact CZ-CB 3.81Å; F490-K552 HydrophobicContact CE2-CD 4.39Å; F490-K552 HydrophobicContact CZ-CD 4.26Å
491	P	70.4	Confident	72.3	Confident	59 Å²	59	85.1 Å²	85.1	38%	0.383	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-60.3	120.2	178.1	-19.2	31.1	0	0	0	109.6	T493 Y545	P491-T493 PolarHBondContact O-N 3.24Å; P491-Y545 HydrophobicContact CG-CE2 3.94Å; P491-Y545 VanDerWaalsContact CG-OH 3.27Å; P491-Y545 WeakPolarHBondContact CG-OH 3.43Å
492	D	63.1	Low	74.7	Confident	160 Å²	160	82.8 Å²	82.8	86%	0.856	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-64.4	119.4	175.4	-67.5	-41.8	0	0	0	109	F490	F490-D492 PolarHBondContact O-N 3.22Å; F490-D492 VanDerWaalsContact O-N 3.13Å
493	T	64.6	Low	76.9	Confident	69 Å²	69	75.8 Å²	75.8	42%	0.423	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-83.1	135.6	166.7	51.2	0	0	0	0	108.4	P491 E495	P491-T493 PolarHBondContact O-N 3.24Å; T493-E495 VanDerWaalsContact CB-O 3.31Å; T493-E495 WeakPolarHBondContact CB-O 3.41Å; T493-E495 PolarHBondContact O-N 2.75Å; T493-E495 VanDerWaalsContact O-N 3.1Å; T493-E495 PolarHBondContact OG1-O 2.6Å
494	A	65.8	Low	78.4	Confident	114 Å²	114	67.4 Å²	67.4	94%	0.942	39%	0.388	S	S	*	.	S	Bend	trans	-60.4	-22.4	-178.8	0	0	0	0	0	113.2
495	E	75.2	Confident	79.4	Confident	137 Å²	137	66.6 Å²	66.6	64%	0.64	39%	0.386	S	S	*	.	S	Bend	trans	-119.2	149.3	170.8	-64.6	-171.1	-168.7	0	0	110.8	T493	T493-E495 VanDerWaalsContact CB-O 3.31Å; T493-E495 WeakPolarHBondContact CB-O 3.41Å; T493-E495 PolarHBondContact O-N 2.75Å; T493-E495 VanDerWaalsContact O-N 3.1Å; T493-E495 PolarHBondContact OG1-O 2.6Å
496	P	82.1	Confident	80.4	Confident	90 Å²	90	62.5 Å²	62.5	58%	0.584	37%	0.365	S	S	*	.			trans	-65.9	147.2	171	29.2	-35	0	0	0	110.8	K498	P496-K498 PolarHBondContact O-N 2.87Å
497	P	87.1	Confident	81.7	Confident	23 Å²	23	66.3 Å²	66.3	15%	0.149	39%	0.387	C	S	.	.			trans	-63.5	134.9	179.8	30.2	-39.1	0	0	0	111.1	Q501 M502 H505	P497-Q501 HydrophobicContact CB-CB 4.23Å; P497-M502 HydrophobicContact CB-CG 4.34Å; P497-M502 WeakPolarHBondContact O-CG 3.31Å; P497-H505 HydrophobicContact CB-CB 3.91Å; P497-H505 HydrophobicContact CG-CB 3.99Å
498	K	88.4	Confident	83	Confident	126 Å²	126	62 Å²	62	55%	0.548	36%	0.361	S	S	.	.			trans	-132.2	161	176.7	-62.8	175.1	-172.1	167.7	0	110.5	P496 Q501	P496-K498 PolarHBondContact O-N 2.87Å; K498-Q501 WeakPolarHBondContact O-CB 3.21Å; K498-Q501 PolarHBondContact O-N 3.04Å
499	G	89.4	Confident	84.3	Confident	21 Å²	21	59.7 Å²	59.7	22%	0.216	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	56.6	-140.3	177.5	0	0	0	0	0	112.3	T403 D404 Q501 M502	T403-G499 VanDerWaalsContact CG2-O 3.28Å; T403-G499 WeakPolarHBondContact CG2-O 3.32Å; D404-G499 PolarHBondContact OD1-N 3.47Å; D404-G499 WeakPolarHBondContact OD2-CA 3.33Å; D404-G499 PolarHBondContact OD2-N 2.82Å; G499-Q501 PolarHBondContact O-N 2.74Å; G499-M502 WeakPolarHBondContact O-CB 3.49Å; G499-M502 WeakPolarHBondContact O-CG 3.5Å; G499-M502 PolarHBondContact O-N 2.74Å; G499-M502 VanDerWaalsContact O-N 3.08Å
500	V	91.1	Very high	85.4	Confident	42 Å²	42	60.9 Å²	60.9	26%	0.255	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-54.1	-27.4	178.5	71.7	0	0	0	0	113.8	R397 M502 L503 W504	R397-V500 HydrophobicContact CB-CG2 3.7Å; R397-V500 HydrophobicContact CG-CG2 3.92Å; V500-M502 PolarHBondContact O-N 3.14Å; V500-L503 HydrophobicContact CG2-CD1 4.02Å; V500-L503 WeakPolarHBondContact O-CB 3.3Å; V500-L503 PolarHBondContact O-N 3.47Å; V500-L503 VanDerWaalsContact O-N 3.09Å; V500-W504 HydrophobicContact CB-CH2 4.4Å; V500-W504 HydrophobicContact CB-CZ3 4.44Å; V500-W504 HydrophobicContact CG1-CH2 3.78Å; V500-W504 HydrophobicContact CG1-CZ3 4.3Å; V500-W504 HydrophobicContact CG2-CH2 4.04Å; V500-W504 HydrophobicContact CG2-CZ3 3.68Å; V500-W504 WeakPolarHBondContact O-CZ3 3.27Å
501	Q	91.3	Very high	86.3	Confident	91 Å²	91	59 Å²	59	43%	0.425	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-63.5	-29	-179.2	-54.3	-175.6	9	0	0	112.6	P497 K498 G499 L503 W504 H505	P497-Q501 HydrophobicContact CB-CB 4.23Å; K498-Q501 WeakPolarHBondContact O-CB 3.21Å; K498-Q501 PolarHBondContact O-N 3.04Å; G499-Q501 PolarHBondContact O-N 2.74Å; Q501-L503 PolarHBondContact O-N 2.74Å; Q501-W504 HydrophobicContact CB-CZ2 4.12Å; Q501-W504 HydrophobicContact CG-CZ2 3.96Å; Q501-W504 PolarHBondContact O-N 3.48Å; Q501-H505 WeakPolarHBondContact O-CB 3.46Å; Q501-H505 PolarHBondContact O-N 3.46Å
502	M	92.4	Very high	87.7	Confident	31 Å²	31	56.2 Å²	56.2	15%	0.153	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-60.9	-29.7	177.2	-58.7	-178.5	82.7	0	0	112	T403 D404 L407 P497 G499 V500 W504 H505 I508	T403-M502 HydrophobicContact CG2-CB 4.31Å; D404-M502 HydrophobicContact CB-SD 4.29Å; L407-M502 HydrophobicContact CB-CE 4.43Å; L407-M502 HydrophobicContact CD1-CB 3.52Å; L407-M502 HydrophobicContact CD1-CE 3.81Å; L407-M502 HydrophobicContact CD1-CG 4.31Å; L407-M502 HydrophobicContact CD1-SD 3.86Å; P497-M502 HydrophobicContact CB-CG 4.34Å; P497-M502 WeakPolarHBondContact O-CG 3.31Å; G499-M502 WeakPolarHBondContact O-CB 3.49Å; G499-M502 WeakPolarHBondContact O-CG 3.5Å; G499-M502 PolarHBondContact O-N 2.74Å; G499-M502 VanDerWaalsContact O-N 3.08Å; V500-M502 PolarHBondContact O-N 3.14Å; M502-W504 VanDerWaalsContact C-N 3.29Å; M502-W504 PolarHBondContact O-N 2.87Å; M502-H505 PolarHBondContact O-N 3.15Å; M502-I508 WeakPolarHBondContact O-CB 3.45Å; M502-I508 WeakPolarHBondContact O-CD1 3.22Å
503	L	94.3	Very high	89.3	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-60.6	-36.1	-178.2	-64.1	178.6	0	0	0	112.9	R397 T403 L431 L434 L438 V500 Q501 L535	R397-L503 HydrophobicContact CG-CD1 3.89Å; T403-L503 HydrophobicContact CG2-CD2 3.76Å; T403-L503 HydrophobicContact CG2-CG 3.89Å; L431-L503 HydrophobicContact CD2-CD2 3.69Å; L434-L503 HydrophobicContact CB-CD1 3.92Å; L434-L503 HydrophobicContact CB-CD2 4.49Å; L438-L503 HydrophobicContact CD1-CB 4.45Å; L438-L503 HydrophobicContact CD1-CD1 4.1Å; L438-L503 HydrophobicContact CD2-CB 3.83Å; V500-L503 HydrophobicContact CG2-CD1 4.02Å; V500-L503 WeakPolarHBondContact O-CB 3.3Å; V500-L503 PolarHBondContact O-N 3.47Å; V500-L503 VanDerWaalsContact O-N 3.09Å; Q501-L503 PolarHBondContact O-N 2.74Å; L503-L535 WeakPolarHBondContact O-CD1 3.34Å; L503-L535 WeakPolarHBondContact O-CD2 3.45Å
504	W	91.5	Very high	90.9	Very high	12 Å²	12	46.9 Å²	46.9	5%	0.045	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-7.3	-178.1	57.9	72.9	0	0	0	114.2	L438 T442 H444 V500 Q501 M502 W540 W542	L438-W504 HydrophobicContact CD1-CE3 3.92Å; L438-W504 HydrophobicContact CD1-CZ3 4.1Å; L438-W504 HydrophobicContact CD2-CB 3.9Å; L438-W504 HydrophobicContact CD2-CE3 3.83Å; L438-W504 HydrophobicContact CG-CE3 3.8Å; L438-W504 HydrophobicContact CG-CZ3 4.39Å; T442-W504 HydrophobicContact CG2-CZ3 4.01Å; H444-W504 AromaticContact CD2-CH2 3.67Å; H444-W504 AromaticContact CD2-CZ2 3.56Å; V500-W504 HydrophobicContact CB-CH2 4.4Å; V500-W504 HydrophobicContact CB-CZ3 4.44Å; V500-W504 HydrophobicContact CG1-CH2 3.78Å; V500-W504 HydrophobicContact CG1-CZ3 4.3Å; V500-W504 HydrophobicContact CG2-CH2 4.04Å; V500-W504 HydrophobicContact CG2-CZ3 3.68Å; V500-W504 WeakPolarHBondContact O-CZ3 3.27Å; Q501-W504 HydrophobicContact CB-CZ2 4.12Å; Q501-W504 HydrophobicContact CG-CZ2 3.96Å; Q501-W504 PolarHBondContact O-N 3.48Å; M502-W504 VanDerWaalsContact C-N 3.29Å; M502-W504 PolarHBondContact O-N 2.87Å; W504-W540 HydrophobicContact CB-CH2 3.76Å; W504-W540 HydrophobicContact CB-CZ3 3.67Å; W504-W540 AromaticContact CD2-CH2 3.87Å; W504-W540 HydrophobicContact CD2-CH2 3.87Å; W504-W540 HydrophobicContact CE3-CH2 4.01Å; W504-W540 AromaticContact CG-CH2 3.79Å; W504-W540 HydrophobicContact CG-CH2 3.79Å; W504-W540 HydrophobicContact CG-CZ3 4.23Å; W504-W542 HydrophobicContact CB-CB 3.99Å; W504-W542 HydrophobicContact CB-CG 4.15Å; W504-W542 AromaticContact CD1-CD1 3.83Å; W504-W542 AromaticContact CD1-CD2 3.55Å; W504-W542 AromaticContact CD1-CE2 3.62Å; W504-W542 AromaticContact CD1-CG 3.71Å; W504-W542 AromaticContact CD1-NE1 3.76Å; W504-W542 HydrophobicContact CG-CD2 4.4Å; W504-W542 HydrophobicContact CG-CG 4.15Å; W504-W542 AromaticContact NE1-CE2 3.91Å; W504-W542 AromaticContact NE1-NE1 3.93Å
505	H	92.8	Very high	92.5	Very high	27 Å²	27	41.5 Å²	41.5	13%	0.125	22%	0.218	C	C	.	.	S	Bend	trans	-74.2	138.4	-179.3	-167.6	-95.8	0	0	0	111.9	P497 Q501 M502 T507 I508 W542	P497-H505 HydrophobicContact CB-CB 3.91Å; P497-H505 HydrophobicContact CG-CB 3.99Å; Q501-H505 WeakPolarHBondContact O-CB 3.46Å; Q501-H505 PolarHBondContact O-N 3.46Å; M502-H505 PolarHBondContact O-N 3.15Å; H505-T507 PolarHBondContact ND1-N 3.12Å; H505-T507 PolarHBondContact ND1-OG1 3.33Å; H505-T507 PolarHBondContact O-N 3.1Å; H505-I508 VanDerWaalsContact O-CG2 3.27Å; H505-I508 WeakPolarHBondContact O-CG2 3.46Å; H505-I508 PolarHBondContact O-N 3.29Å; H505-W542 AromaticContact CD2-CZ3 3.86Å
506	P	93.5	Very high	93.6	Very high	10 Å²	10	35.1 Å²	35.1	7%	0.065	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-52.9	-25.6	-177.3	-33.1	39.7	0	0	0	116.6	F490 I508 V509 A549	F490-P506 HydrophobicContact CD1-CG 4.07Å; F490-P506 HydrophobicContact CD2-CB 4.13Å; F490-P506 HydrophobicContact CD2-CG 4.33Å; F490-P506 HydrophobicContact CE1-CB 4.5Å; F490-P506 HydrophobicContact CE1-CG 4.24Å; F490-P506 HydrophobicContact CE2-CB 4.01Å; F490-P506 HydrophobicContact CE2-CG 4.48Å; F490-P506 HydrophobicContact CG-CB 4.43Å; F490-P506 HydrophobicContact CG-CG 4.12Å; F490-P506 HydrophobicContact CZ-CB 4.21Å; F490-P506 HydrophobicContact CZ-CG 4.45Å; P506-I508 PolarHBondContact O-N 2.82Å; P506-V509 WeakPolarHBondContact O-CB 3.36Å; P506-V509 WeakPolarHBondContact O-CG2 3.47Å; P506-V509 PolarHBondContact O-N 3.38Å; P506-A549 HydrophobicContact CB-CB 4.06Å
507	T	92.3	Very high	94.3	Very high	83 Å²	83	34.2 Å²	34.2	51%	0.509	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-62.6	-23.4	178	49.1	0	0	0	0	113.8	H505 V509 P511	H505-T507 PolarHBondContact ND1-N 3.12Å; H505-T507 PolarHBondContact ND1-OG1 3.33Å; H505-T507 PolarHBondContact O-N 3.1Å; T507-V509 PolarHBondContact O-N 3.09Å; T507-P511 VanDerWaalsContact O-CD 3.26Å; T507-P511 WeakPolarHBondContact O-CD 3.26Å
508	I	95.6	Very high	94.7	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.026	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-67	-19.1	177.1	-154.7	174.6	0	0	0	113	L407 M502 H505 P506 K510 P511 Y512 L535 I546	L407-I508 HydrophobicContact CD1-CD1 4.25Å; L407-I508 HydrophobicContact CD2-CD1 3.99Å; L407-I508 HydrophobicContact CD2-CG1 3.91Å; M502-I508 WeakPolarHBondContact O-CB 3.45Å; M502-I508 WeakPolarHBondContact O-CD1 3.22Å; H505-I508 VanDerWaalsContact O-CG2 3.27Å; H505-I508 WeakPolarHBondContact O-CG2 3.46Å; H505-I508 PolarHBondContact O-N 3.29Å; P506-I508 PolarHBondContact O-N 2.82Å; I508-K510 PolarHBondContact O-N 2.84Å; I508-P511 WeakPolarHBondContact O-CD 3.26Å; I508-Y512 HydrophobicContact CB-CE2 4.44Å; I508-Y512 HydrophobicContact CD1-CE2 3.67Å; I508-Y512 HydrophobicContact CG1-CD2 4.16Å; I508-Y512 HydrophobicContact CG1-CE2 3.56Å; I508-Y512 HydrophobicContact CG2-CE2 4.22Å; I508-Y512 WeakPolarHBondContact O-CD2 3.33Å; I508-L535 HydrophobicContact CG2-CD1 3.81Å; I508-I546 HydrophobicContact CG2-CD1 4Å
509	V	97.6	Very high	95.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-42.1	-179.1	170.8	0	0	0	0	111.8	P506 T507 Y512 L513 L532 I546 A549 V550 E553	P506-V509 WeakPolarHBondContact O-CB 3.36Å; P506-V509 WeakPolarHBondContact O-CG2 3.47Å; P506-V509 PolarHBondContact O-N 3.38Å; T507-V509 PolarHBondContact O-N 3.09Å; V509-Y512 PolarHBondContact O-N 3.3Å; V509-L513 HydrophobicContact CG1-CD1 3.59Å; V509-L513 HydrophobicContact CG1-CG 3.94Å; V509-L513 WeakPolarHBondContact O-CG 3.23Å; V509-L513 PolarHBondContact O-N 2.87Å; V509-L532 HydrophobicContact CG2-CD2 4.26Å; V509-I546 HydrophobicContact CG2-CD1 3.66Å; V509-I546 HydrophobicContact CG2-CG2 4.11Å; V509-A549 HydrophobicContact CB-CB 4.34Å; V509-A549 HydrophobicContact CG1-CB 4.49Å; V509-A549 HydrophobicContact CG2-CB 3.99Å; V509-V550 HydrophobicContact CB-CG2 4.47Å; V509-V550 HydrophobicContact CG1-CB 4.32Å; V509-V550 HydrophobicContact CG1-CG2 3.52Å; V509-V550 HydrophobicContact CG2-CG2 4.08Å; V509-E553 HydrophobicContact CG1-CG 4.4Å
510	K	96.7	Very high	95.4	Very high	127 Å²	127	36 Å²	36	55%	0.552	20%	0.198	S	C	*	.	H	α-helix	trans	-62.8	-50.3	-174.5	178.7	173.9	178.9	179	0	112.4	I508 Y512 L513 T514	I508-K510 PolarHBondContact O-N 2.84Å; K510-Y512 VanDerWaalsContact C-N 3.34Å; K510-Y512 PolarHBondContact O-N 3.48Å; K510-L513 PolarHBondContact O-N 2.93Å; K510-L513 VanDerWaalsContact O-N 3.15Å; K510-T514 PolarHBondContact O-N 3.49Å; K510-T514 PolarHBondContact O-OG1 3.4Å
511	P	97.5	Very high	95.6	Very high	12 Å²	12	35.2 Å²	35.2	8%	0.078	19%	0.193	C	C	.	.	H	α-helix	trans	-53	-45.3	172.5	-28.9	35.6	0	0	0	114.1	I410 Q411 L414 T507 I508 L513 T514 L515	I410-P511 HydrophobicContact CG2-CB 4.32Å; Q411-P511 HydrophobicContact CG-CG 4.33Å; L414-P511 HydrophobicContact CD1-CB 4.25Å; T507-P511 VanDerWaalsContact O-CD 3.26Å; T507-P511 WeakPolarHBondContact O-CD 3.26Å; I508-P511 WeakPolarHBondContact O-CD 3.26Å; P511-L513 PolarHBondContact O-N 3.4Å; P511-T514 PolarHBondContact O-N 2.81Å; P511-L515 WeakPolarHBondContact O-CG 3.41Å; P511-L515 PolarHBondContact O-N 2.99Å
512	Y	98.6	Very high	95.9	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-65	-38.7	177.6	-68.3	-48.2	0	0	0	112.8	L431 I508 V509 K510 L515 L516 A528 A531 L532 L535	L431-Y512 WeakPolarHBondContact CB-OH 3.48Å; I508-Y512 HydrophobicContact CB-CE2 4.44Å; I508-Y512 HydrophobicContact CD1-CE2 3.67Å; I508-Y512 HydrophobicContact CG1-CD2 4.16Å; I508-Y512 HydrophobicContact CG1-CE2 3.56Å; I508-Y512 HydrophobicContact CG2-CE2 4.22Å; I508-Y512 WeakPolarHBondContact O-CD2 3.33Å; V509-Y512 PolarHBondContact O-N 3.3Å; K510-Y512 VanDerWaalsContact C-N 3.34Å; K510-Y512 PolarHBondContact O-N 3.48Å; Y512-L515 HydrophobicContact CD1-CD1 4.34Å; Y512-L515 PolarHBondContact O-N 2.91Å; Y512-L516 WeakPolarHBondContact O-CB 3.46Å; Y512-L516 WeakPolarHBondContact O-CD1 3.49Å; Y512-L516 WeakPolarHBondContact O-CG 3.34Å; Y512-L516 PolarHBondContact O-N 3.31Å; Y512-A528 HydrophobicContact CD1-CB 4.05Å; Y512-A531 HydrophobicContact CD1-CB 4.27Å; Y512-A531 HydrophobicContact CD2-CB 4.3Å; Y512-A531 HydrophobicContact CE1-CB 3.75Å; Y512-A531 HydrophobicContact CE2-CB 3.76Å; Y512-A531 VanDerWaalsContact CZ-CB 3.46Å; Y512-L532 HydrophobicContact CD2-CD2 3.91Å; Y512-L532 HydrophobicContact CD2-CG 4.32Å; Y512-L532 HydrophobicContact CG-CD2 4.43Å; Y512-L532 HydrophobicContact CG-CG 4.47Å; Y512-L535 HydrophobicContact CE2-CD1 4.13Å
513	L	98.4	Very high	96.1	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-37.8	176.9	-69.8	-179.5	0	0	0	112.3	V509 K510 P511 L516 S517 L532 E553 I558	V509-L513 HydrophobicContact CG1-CD1 3.59Å; V509-L513 HydrophobicContact CG1-CG 3.94Å; V509-L513 WeakPolarHBondContact O-CG 3.23Å; V509-L513 PolarHBondContact O-N 2.87Å; K510-L513 PolarHBondContact O-N 2.93Å; K510-L513 VanDerWaalsContact O-N 3.15Å; P511-L513 PolarHBondContact O-N 3.4Å; L513-L516 HydrophobicContact CD2-CD1 4.33Å; L513-L516 PolarHBondContact O-N 3.35Å; L513-S517 PolarHBondContact O-N 3.33Å; L513-S517 VanDerWaalsContact O-N 3.07Å; L513-S517 PolarHBondContact O-OG 3.2Å; L513-L532 HydrophobicContact CD2-CD1 3.87Å; L513-E553 HydrophobicContact CD1-CB 3.53Å; L513-E553 HydrophobicContact CD1-CG 4.5Å; L513-I558 HydrophobicContact CB-CD1 4.23Å
514	T	98	Very high	96.3	Very high	26 Å²	26	33.7 Å²	33.7	16%	0.16	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-46.6	174	-59.1	0	0	0	0	111.5	L414 K510 P511 L516 S517 E518	L414-T514 HydrophobicContact CB-CG2 4.09Å; L414-T514 HydrophobicContact CD1-CG2 4.11Å; L414-T514 HydrophobicContact CD2-CG2 3.95Å; L414-T514 HydrophobicContact CG-CG2 4.25Å; K510-T514 PolarHBondContact O-N 3.49Å; K510-T514 PolarHBondContact O-OG1 3.4Å; P511-T514 PolarHBondContact O-N 2.81Å; T514-L516 VanDerWaalsContact C-N 3.28Å; T514-L516 PolarHBondContact O-N 2.83Å; T514-S517 PolarHBondContact O-N 3.45Å; T514-S517 VanDerWaalsContact O-N 3.11Å; T514-S517 PolarHBondContact O-OG 3.05Å; T514-E518 VanDerWaalsContact CG2-CD 3.42Å; T514-E518 HydrophobicContact CG2-CG 4.26Å; T514-E518 WeakPolarHBondContact CG2-OE1 3.29Å; T514-E518 WeakPolarHBondContact CG2-OE2 3.05Å; T514-E518 WeakPolarHBondContact O-CB 3.3Å; T514-E518 PolarHBondContact O-N 3.33Å
515	L	98.3	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.4	-43.4	172.3	-66.6	167.7	0	0	0	111.5	I410 L414 I419 V424 V428 P511 Y512 S517 E518 C519 T524 A528	I410-L515 HydrophobicContact CG2-CD1 3.7Å; I410-L515 HydrophobicContact CG2-CD2 4.37Å; I410-L515 HydrophobicContact CG2-CG 4.3Å; L414-L515 HydrophobicContact CD2-CD2 3.67Å; L414-L515 HydrophobicContact CD2-CG 3.88Å; I419-L515 HydrophobicContact CD1-CD2 4.08Å; I419-L515 HydrophobicContact CG1-CD2 3.69Å; V424-L515 HydrophobicContact CG1-CD2 3.97Å; V428-L515 HydrophobicContact CG2-CD1 3.56Å; P511-L515 WeakPolarHBondContact O-CG 3.41Å; P511-L515 PolarHBondContact O-N 2.99Å; Y512-L515 HydrophobicContact CD1-CD1 4.34Å; Y512-L515 PolarHBondContact O-N 2.91Å; L515-S517 PolarHBondContact O-N 3.34Å; L515-E518 PolarHBondContact O-N 3.49Å; L515-C519 VanDerWaalsContact CD2-SG 3.57Å; L515-C519 WeakPolarHBondContact O-CB 3.47Å; L515-C519 PolarHBondContact O-N 2.86Å; L515-C519 PolarHBondContact O-SG 3.11Å; L515-C519 VanDerWaalsContact O-SG 3.33Å; L515-T524 HydrophobicContact CD2-CG2 4.4Å; L515-A528 HydrophobicContact CB-CB 4.34Å
516	L	98.3	Very high	96.9	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-67.6	-18.4	179.6	-72	166.4	0	0	0	114.2	Y512 L513 T514 L525 A528 A529 L532 I558 L559 L562	Y512-L516 WeakPolarHBondContact O-CB 3.46Å; Y512-L516 WeakPolarHBondContact O-CD1 3.49Å; Y512-L516 WeakPolarHBondContact O-CG 3.34Å; Y512-L516 PolarHBondContact O-N 3.31Å; L513-L516 HydrophobicContact CD2-CD1 4.33Å; L513-L516 PolarHBondContact O-N 3.35Å; T514-L516 VanDerWaalsContact C-N 3.28Å; T514-L516 PolarHBondContact O-N 2.83Å; L516-L525 HydrophobicContact CD2-CD2 4.17Å; L516-L525 WeakPolarHBondContact CD2-O 3.29Å; L516-A528 HydrophobicContact CD1-CB 4.31Å; L516-A528 HydrophobicContact CD2-CB 3.94Å; L516-A528 HydrophobicContact CG-CB 3.84Å; L516-A529 HydrophobicContact CD2-CB 4.01Å; L516-L532 HydrophobicContact CD1-CD1 3.63Å; L516-I558 HydrophobicContact CB-CG2 3.83Å; L516-L559 HydrophobicContact CD1-CD2 4.14Å; L516-L562 HydrophobicContact CB-CD1 3.94Å; L516-L562 HydrophobicContact CD2-CD1 3.43Å; L516-L562 VanDerWaalsContact CD2-CD1 3.43Å; L516-L562 HydrophobicContact CG-CD1 4.2Å
517	S	97.4	Very high	97.1	Very high	70 Å²	70	33.2 Å²	33.2	49%	0.49	19%	0.188	S	C	.	.	H	α-helix	trans	-101.7	-23.9	175.2	54.8	0	0	0	0	114.9	L513 T514 L515	L513-S517 PolarHBondContact O-N 3.33Å; L513-S517 VanDerWaalsContact O-N 3.07Å; L513-S517 PolarHBondContact O-OG 3.2Å; T514-S517 PolarHBondContact O-N 3.45Å; T514-S517 VanDerWaalsContact O-N 3.11Å; T514-S517 PolarHBondContact O-OG 3.05Å; L515-S517 PolarHBondContact O-N 3.34Å
518	E	96	Very high	97.5	Very high	97 Å²	97	29.2 Å²	29.2	45%	0.453	16%	0.164	S	C	.	.	H	α-helix	trans	-111.4	-26.8	-171.5	-68.1	177.2	-166.6	0	0	114	G415 I419 T514 L515	G415-E518 PolarHBondContact N-OE2 2.94Å; G415-E518 VanDerWaalsContact N-OE2 3.12Å; I419-E518 HydrophobicContact CD1-CB 3.45Å; I419-E518 VanDerWaalsContact CD1-CB 3.45Å; T514-E518 VanDerWaalsContact CG2-CD 3.42Å; T514-E518 HydrophobicContact CG2-CG 4.26Å; T514-E518 WeakPolarHBondContact CG2-OE1 3.29Å; T514-E518 WeakPolarHBondContact CG2-OE2 3.05Å; T514-E518 WeakPolarHBondContact O-CB 3.3Å; T514-E518 PolarHBondContact O-N 3.33Å; L515-E518 PolarHBondContact O-N 3.49Å
519	C	95.6	Very high	97.6	Very high	15 Å²	15	29 Å²	29	10%	0.101	16%	0.163	C	C	.	.			trans	-73.2	145.3	179.3	-67.2	0	0	0	0	113	I419 D420 L515 T524 L525	I419-C519 PolarHBondContact O-SG 3.45Å; D420-C519 WeakPolarHBondContact OD1-CA 3.15Å; D420-C519 WeakPolarHBondContact OD1-CB 3.48Å; L515-C519 VanDerWaalsContact CD2-SG 3.57Å; L515-C519 WeakPolarHBondContact O-CB 3.47Å; L515-C519 PolarHBondContact O-N 2.86Å; L515-C519 PolarHBondContact O-SG 3.11Å; L515-C519 VanDerWaalsContact O-SG 3.33Å; C519-T524 HydrophobicContact CB-CG2 4.42Å; C519-L525 HydrophobicContact CB-CD2 3.92Å; C519-L525 HydrophobicContact CB-CG 4.24Å
520	S	95.3	Very high	97.6	Very high	95 Å²	95	29 Å²	29	66%	0.664	16%	0.163	S	C	*	.			trans	-102.8	-18	165.5	76	0	0	0	0	113.5	D420 P522	D420-S520 VanDerWaalsContact CG-N 3.33Å; D420-S520 PolarHBondContact OD1-N 3.14Å; D420-S520 WeakPolarHBondContact OD2-CB 3.33Å; D420-S520 PolarHBondContact OD2-N 2.65Å; D420-S520 PolarHBondContact OD2-OG 3.23Å; S520-P522 WeakPolarHBondContact O-CD 3.11Å
521	N	96.4	Very high	97.7	Very high	27 Å²	27	23 Å²	23	14%	0.144	14%	0.136	C	C	.	.			trans	-70	115.2	179.5	180	-12.3	0	0	0	110.9	D420 E425 D523 T524 L525	D420-N521 HydrophobicContact CB-CB 4.11Å; D420-N521 PolarHBondContact O-ND2 2.79Å; D420-N521 WeakPolarHBondContact OD1-CB 3.43Å; D420-N521 PolarHBondContact OD1-N 2.77Å; E425-N521 PolarHBondContact OE2-ND2 3.12Å; N521-D523 VanDerWaalsContact C-N 3.33Å; N521-D523 PolarHBondContact O-N 2.9Å; N521-D523 PolarHBondContact OD1-N 3.47Å; N521-T524 PolarHBondContact ND2-OG1 3.21Å; N521-T524 PolarHBondContact O-N 2.92Å; N521-L525 WeakPolarHBondContact O-CG 3.4Å; N521-L525 PolarHBondContact O-N 3.33Å
522	P	97.1	Very high	97.8	Very high	46 Å²	46	22.4 Å²	22.4	30%	0.299	13%	0.133	S	C	.	.	H	α-helix	trans	-66.9	-28.5	-176.1	27.3	-35.2	0	0	0	114.2	S520 L525 E526 N567 V570	S520-P522 WeakPolarHBondContact O-CD 3.11Å; P522-L525 PolarHBondContact O-N 2.99Å; P522-E526 WeakPolarHBondContact O-CB 3.38Å; P522-E526 PolarHBondContact O-N 3.49Å; P522-N567 WeakPolarHBondContact CB-ND2 3.43Å; P522-V570 HydrophobicContact CB-CG2 4.04Å; P522-V570 VanDerWaalsContact O-CG2 3.3Å; P522-V570 WeakPolarHBondContact O-CG2 3.49Å
523	D	97.4	Very high	97.8	Very high	43 Å²	43	24.4 Å²	24.4	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-73.1	-32.9	177.2	-70.6	-40.7	0	0	0	110.6	E425 N521 G527 K569	E425-D523 HydrophobicContact CG-CB 3.8Å; N521-D523 VanDerWaalsContact C-N 3.33Å; N521-D523 PolarHBondContact O-N 2.9Å; N521-D523 PolarHBondContact OD1-N 3.47Å; D523-G527 PolarHBondContact O-N 3.06Å; D523-K569 IonicContact OD1-NZ 2.85Å; D523-K569 PolarHBondContact OD1-NZ 2.96Å
524	T	98.3	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.3	-43.7	171.2	-56.5	0	0	0	0	111.1	V424 E425 V428 L515 C519 N521 G527 A528	V424-T524 HydrophobicContact CG1-CG2 4.18Å; E425-T524 WeakPolarHBondContact CB-OG1 3.34Å; V428-T524 HydrophobicContact CG2-CG2 4.27Å; L515-T524 HydrophobicContact CD2-CG2 4.4Å; C519-T524 HydrophobicContact CB-CG2 4.42Å; N521-T524 PolarHBondContact ND2-OG1 3.21Å; N521-T524 PolarHBondContact O-N 2.92Å; T524-G527 PolarHBondContact O-N 3.48Å; T524-A528 WeakPolarHBondContact O-CB 3.4Å; T524-A528 PolarHBondContact O-N 2.74Å
525	L	98.6	Very high	97.7	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-44.4	175.7	-66.7	174.1	0	0	0	112.1	L516 C519 N521 P522 A528 A529 L562 I565 V570	L516-L525 HydrophobicContact CD2-CD2 4.17Å; L516-L525 WeakPolarHBondContact CD2-O 3.29Å; C519-L525 HydrophobicContact CB-CD2 3.92Å; C519-L525 HydrophobicContact CB-CG 4.24Å; N521-L525 WeakPolarHBondContact O-CG 3.4Å; N521-L525 PolarHBondContact O-N 3.33Å; P522-L525 PolarHBondContact O-N 2.99Å; L525-A528 PolarHBondContact O-N 3.01Å; L525-A529 WeakPolarHBondContact O-CB 3.15Å; L525-A529 PolarHBondContact O-N 3Å; L525-L562 HydrophobicContact CD1-CD2 4.35Å; L525-L562 HydrophobicContact CD2-CD2 4.31Å; L525-I565 HydrophobicContact CD1-CD1 4.21Å; L525-V570 HydrophobicContact CB-CG1 4.19Å; L525-V570 HydrophobicContact CB-CG2 3.95Å
526	E	98.4	Very high	97.7	Very high	33 Å²	33	24.4 Å²	24.4	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-61.3	-44.6	173.7	-171.7	-124	131.5	0	0	111.2	R432 P522 G530 K569 V570 A573	R432-E526 IonicContact CZ-OE1 3.76Å; R432-E526 IonicContact NH1-OE1 2.76Å; R432-E526 PolarHBondContact NH1-OE1 3.39Å; R432-E526 IonicContact NH2-OE1 3.5Å; R432-E526 PolarHBondContact NH2-OE1 2.87Å; P522-E526 WeakPolarHBondContact O-CB 3.38Å; P522-E526 PolarHBondContact O-N 3.49Å; E526-G530 WeakPolarHBondContact O-CA 3.39Å; E526-G530 PolarHBondContact O-N 2.76Å; E526-K569 HydrophobicContact CG-CB 4.19Å; E526-V570 HydrophobicContact CB-CG2 4.41Å; E526-A573 HydrophobicContact CG-CB 4.04Å
527	G	98.4	Very high	97.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-47.8	177.5	0	0	0	0	0	112.9	R432 D523 T524 G530 A531	R432-G527 WeakPolarHBondContact CG-O 3.21Å; D523-G527 PolarHBondContact O-N 3.06Å; T524-G527 PolarHBondContact O-N 3.48Å; G527-G530 PolarHBondContact O-N 3.49Å; G527-A531 WeakPolarHBondContact O-CB 3.44Å; G527-A531 PolarHBondContact O-N 3.29Å
528	A	98.8	Very high	97.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-69.2	-42.8	-179	0	0	0	0	0	112.1	V428 Y512 L515 L516 T524 L525 G530 A531 L532	V428-A528 HydrophobicContact CG1-CB 4.11Å; V428-A528 VanDerWaalsContact CG1-N 3.3Å; Y512-A528 HydrophobicContact CD1-CB 4.05Å; L515-A528 HydrophobicContact CB-CB 4.34Å; L516-A528 HydrophobicContact CD1-CB 4.31Å; L516-A528 HydrophobicContact CD2-CB 3.94Å; L516-A528 HydrophobicContact CG-CB 3.84Å; T524-A528 WeakPolarHBondContact O-CB 3.4Å; T524-A528 PolarHBondContact O-N 2.74Å; L525-A528 PolarHBondContact O-N 3.01Å; A528-G530 VanDerWaalsContact C-N 3.34Å; A528-G530 PolarHBondContact O-N 2.94Å; A528-A531 PolarHBondContact O-N 3.02Å; A528-L532 PolarHBondContact O-N 2.84Å; A528-L532 VanDerWaalsContact O-N 3.09Å
529	A	98.8	Very high	97	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-40.5	173.9	0	0	0	0	0	111.4	L516 L525 L532 Q533 A573 V574	L516-A529 HydrophobicContact CD2-CB 4.01Å; L525-A529 WeakPolarHBondContact O-CB 3.15Å; L525-A529 PolarHBondContact O-N 3Å; A529-L532 PolarHBondContact O-N 2.93Å; A529-Q533 WeakPolarHBondContact O-CB 3.15Å; A529-Q533 PolarHBondContact O-N 3.29Å; A529-A573 HydrophobicContact CB-CB 3.95Å; A529-V574 HydrophobicContact CB-CG2 3.8Å
530	G	98.5	Very high	96.9	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-33.2	175.2	0	0	0	0	0	113.7	E526 G527 A528 Q533 N534	E526-G530 WeakPolarHBondContact O-CA 3.39Å; E526-G530 PolarHBondContact O-N 2.76Å; G527-G530 PolarHBondContact O-N 3.49Å; A528-G530 VanDerWaalsContact C-N 3.34Å; A528-G530 PolarHBondContact O-N 2.94Å; G530-Q533 WeakPolarHBondContact O-CB 3.4Å; G530-N534 WeakPolarHBondContact O-CB 3.45Å; G530-N534 VanDerWaalsContact O-CG 3.3Å; G530-N534 PolarHBondContact O-N 3.48Å
531	A	98.7	Very high	96.7	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.5	-49.8	172.2	0	0	0	0	0	110.9	R432 Y512 G527 A528 Q533 N534 L535	R432-A531 HydrophobicContact CB-CB 4.08Å; R432-A531 HydrophobicContact CG-CB 4.45Å; Y512-A531 HydrophobicContact CD1-CB 4.27Å; Y512-A531 HydrophobicContact CD2-CB 4.3Å; Y512-A531 HydrophobicContact CE1-CB 3.75Å; Y512-A531 HydrophobicContact CE2-CB 3.76Å; Y512-A531 VanDerWaalsContact CZ-CB 3.46Å; G527-A531 WeakPolarHBondContact O-CB 3.44Å; G527-A531 PolarHBondContact O-N 3.29Å; A528-A531 PolarHBondContact O-N 3.02Å; A531-Q533 VanDerWaalsContact C-N 3.31Å; A531-Q533 PolarHBondContact O-N 3.16Å; A531-N534 PolarHBondContact O-N 3.15Å; A531-N534 VanDerWaalsContact O-N 3.16Å; A531-L535 WeakPolarHBondContact O-CG 3.4Å; A531-L535 PolarHBondContact O-N 3.37Å
532	L	98.6	Very high	96.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-38.2	175.3	-68.6	-179.2	0	0	0	112.5	V509 Y512 L513 L516 A528 A529 A536 V550 M581	V509-L532 HydrophobicContact CG2-CD2 4.26Å; Y512-L532 HydrophobicContact CD2-CD2 3.91Å; Y512-L532 HydrophobicContact CD2-CG 4.32Å; Y512-L532 HydrophobicContact CG-CD2 4.43Å; Y512-L532 HydrophobicContact CG-CG 4.47Å; L513-L532 HydrophobicContact CD2-CD1 3.87Å; L516-L532 HydrophobicContact CD1-CD1 3.63Å; A528-L532 PolarHBondContact O-N 2.84Å; A528-L532 VanDerWaalsContact O-N 3.09Å; A529-L532 PolarHBondContact O-N 2.93Å; L532-A536 WeakPolarHBondContact O-CB 3.38Å; L532-A536 PolarHBondContact O-N 3.04Å; L532-V550 HydrophobicContact CD2-CG2 4.12Å; L532-M581 HydrophobicContact CB-CE 4.06Å
533	Q	98.2	Very high	96.4	Very high	43 Å²	43	27.1 Å²	27.1	20%	0.201	16%	0.155	C	C	.	.	H	α-helix	trans	-56.3	-50.9	171.7	172.7	-168.2	-20.5	0	0	111.4	A529 G530 A531 A537 T576 A577 N580	A529-Q533 WeakPolarHBondContact O-CB 3.15Å; A529-Q533 PolarHBondContact O-N 3.29Å; G530-Q533 WeakPolarHBondContact O-CB 3.4Å; A531-Q533 VanDerWaalsContact C-N 3.31Å; A531-Q533 PolarHBondContact O-N 3.16Å; Q533-A537 PolarHBondContact O-N 2.95Å; Q533-T576 HydrophobicContact CG-CG2 3.92Å; Q533-T576 VanDerWaalsContact NE2-CG2 3.3Å; Q533-A577 HydrophobicContact CB-CB 4.06Å; Q533-N580 PolarHBondContact O-ND2 3Å
534	N	98.3	Very high	96.2	Very high	27 Å²	27	27.2 Å²	27.2	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-46	-179.1	-77.6	-16.1	0	0	0	111.7	R432 G530 A531 A537	R432-N534 PolarHBondContact O-ND2 3.35Å; G530-N534 WeakPolarHBondContact O-CB 3.45Å; G530-N534 VanDerWaalsContact O-CG 3.3Å; G530-N534 PolarHBondContact O-N 3.48Å; A531-N534 PolarHBondContact O-N 3.15Å; A531-N534 VanDerWaalsContact O-N 3.16Å; N534-A537 WeakPolarHBondContact O-CB 3.26Å; N534-A537 PolarHBondContact O-N 3.19Å
535	L	97.4	Very high	96	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.031	16%	0.16	C	C	.	.	H	α-helix	trans	-69.3	-34.4	-178.4	-65	176.1	0	0	0	113.1	L438 L503 I508 Y512 A531 A537 S543 I546	L438-L535 HydrophobicContact CD2-CD2 3.65Å; L503-L535 WeakPolarHBondContact O-CD1 3.34Å; L503-L535 WeakPolarHBondContact O-CD2 3.45Å; I508-L535 HydrophobicContact CG2-CD1 3.81Å; Y512-L535 HydrophobicContact CE2-CD1 4.13Å; A531-L535 WeakPolarHBondContact O-CG 3.4Å; A531-L535 PolarHBondContact O-N 3.37Å; L535-A537 VanDerWaalsContact C-N 3.26Å; L535-A537 PolarHBondContact O-N 3.31Å; L535-S543 VanDerWaalsContact O-CA 3.31Å; L535-S543 WeakPolarHBondContact O-CA 3.45Å; L535-S543 WeakPolarHBondContact O-CB 3.15Å; L535-S543 PolarHBondContact O-OG 3.4Å; L535-I546 HydrophobicContact CB-CG1 4.24Å; L535-I546 HydrophobicContact CB-CG2 3.95Å; L535-I546 HydrophobicContact CD1-CD1 4.39Å
536	A	97.3	Very high	96	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-2.4	178	0	0	0	0	0	114.6	L532 R547 N580 M581	L532-A536 WeakPolarHBondContact O-CB 3.38Å; L532-A536 PolarHBondContact O-N 3.04Å; A536-R547 HydrophobicContact CB-CG 3.75Å; A536-R547 PolarHBondContact O-NH1 3.1Å; A536-N580 HydrophobicContact CB-CB 3.9Å; A536-M581 HydrophobicContact CB-CE 3.56Å; A536-M581 HydrophobicContact CB-SD 3.9Å
537	A	95.4	Very high	95.9	Very high	39 Å²	39	26.5 Å²	26.5	32%	0.322	15%	0.153	S	C	.	.			trans	-73.9	141	-174.5	0	0	0	0	0	113.5	Q533 N534 L535 S543	Q533-A537 PolarHBondContact O-N 2.95Å; N534-A537 WeakPolarHBondContact O-CB 3.26Å; N534-A537 PolarHBondContact O-N 3.19Å; L535-A537 VanDerWaalsContact C-N 3.26Å; L535-A537 PolarHBondContact O-N 3.31Å; A537-S543 WeakPolarHBondContact O-CB 3.48Å; A537-S543 PolarHBondContact O-OG 3.13Å; A537-S543 VanDerWaalsContact O-OG 3.13Å
538	G	91.4	Very high	95.8	Very high	45 Å²	45	26.5 Å²	26.5	46%	0.464	15%	0.153	S	C	.	.	S	Bend	trans	71.7	-163	170.6	0	0	0	0	0	115.7	R547	G538-R547 PolarHBondContact O-NH1 3.29Å; G538-R547 PolarHBondContact O-NH2 3.29Å
539	S	91.4	Very high	95.7	Very high	115 Å²	115	26.7 Å²	26.7	80%	0.804	16%	0.155	S	C	*	.	S	Bend	trans	-106.7	9.7	-171.5	54.4	0	0	0	0	114.6
540	W	91.9	Very high	95.7	Very high	42 Å²	42	26.7 Å²	26.7	16%	0.159	16%	0.155	C	C	.	.			trans	-62.7	145	179.3	-170.4	47.8	0	0	0	111.5	L438 A439 W504 W542 S543 V544	L438-W540 HydrophobicContact CD2-CZ3 4.33Å; L438-W540 HydrophobicContact CG-CH2 4.36Å; L438-W540 HydrophobicContact CG-CZ3 4.3Å; A439-W540 HydrophobicContact CB-CB 3.77Å; A439-W540 HydrophobicContact CB-CD2 3.45Å; A439-W540 VanDerWaalsContact CB-CD2 3.45Å; A439-W540 HydrophobicContact CB-CE3 3.57Å; A439-W540 HydrophobicContact CB-CG 3.6Å; A439-W540 HydrophobicContact CB-CZ3 4.22Å; W504-W540 HydrophobicContact CB-CH2 3.76Å; W504-W540 HydrophobicContact CB-CZ3 3.67Å; W504-W540 AromaticContact CD2-CH2 3.87Å; W504-W540 HydrophobicContact CD2-CH2 3.87Å; W504-W540 HydrophobicContact CE3-CH2 4.01Å; W504-W540 AromaticContact CG-CH2 3.79Å; W504-W540 HydrophobicContact CG-CH2 3.79Å; W504-W540 HydrophobicContact CG-CZ3 4.23Å; W540-W542 VanDerWaalsContact C-N 3.31Å; W540-W542 HydrophobicContact CD2-CB 4.19Å; W540-W542 AromaticContact CE2-CD1 3.64Å; W540-W542 HydrophobicContact CE3-CB 3.77Å; W540-W542 HydrophobicContact CE3-CG 4.44Å; W540-W542 HydrophobicContact CH2-CB 4.32Å; W540-W542 AromaticContact CH2-CD1 3.72Å; W540-W542 HydrophobicContact CH2-CG 4.3Å; W540-W542 AromaticContact CZ2-CD1 3.48Å; W540-W542 VanDerWaalsContact CZ2-CD1 3.48Å; W540-W542 HydrophobicContact CZ2-CG 4.42Å; W540-W542 HydrophobicContact CZ3-CB 3.84Å; W540-W542 HydrophobicContact CZ3-CG 4.31Å; W540-W542 PolarHBondContact O-N 2.77Å; W540-S543 WeakPolarHBondContact O-CA 3.34Å; W540-S543 WeakPolarHBondContact O-CB 3.43Å; W540-S543 PolarHBondContact O-N 3.4Å; W540-V544 PolarHBondContact O-N 3.34Å
541	K	90.7	Very high	95.6	Very high	116 Å²	116	28.8 Å²	28.8	50%	0.504	16%	0.163	S	C	.	.	H	α-helix	trans	-51.3	-48.2	-176	-178.9	-178.3	177.1	-176.2	0	112.1	S543 V544 Y545	K541-S543 PolarHBondContact O-N 3.25Å; K541-V544 WeakPolarHBondContact O-CB 3.41Å; K541-V544 PolarHBondContact O-N 3.49Å; K541-Y545 HydrophobicContact CD-CE2 4.38Å; K541-Y545 WeakPolarHBondContact CE-OH 3.5Å; K541-Y545 HydrophobicContact CG-CE1 4.45Å; K541-Y545 HydrophobicContact CG-CE2 3.97Å; K541-Y545 PolarHBondContact O-N 3.03Å; K541-Y545 VanDerWaalsContact O-N 3.16Å
542	W	92.4	Very high	95.4	Very high	50 Å²	50	33 Å²	33	19%	0.189	18%	0.181	C	C	.	.	H	α-helix	trans	-67.3	-35.9	179.1	-61.6	106.3	0	0	0	112.7	W504 H505 W540 V544 Y545 I546	W504-W542 HydrophobicContact CB-CB 3.99Å; W504-W542 HydrophobicContact CB-CG 4.15Å; W504-W542 AromaticContact CD1-CD1 3.83Å; W504-W542 AromaticContact CD1-CD2 3.55Å; W504-W542 AromaticContact CD1-CE2 3.62Å; W504-W542 AromaticContact CD1-CG 3.71Å; W504-W542 AromaticContact CD1-NE1 3.76Å; W504-W542 HydrophobicContact CG-CD2 4.4Å; W504-W542 HydrophobicContact CG-CG 4.15Å; W504-W542 AromaticContact NE1-CE2 3.91Å; W504-W542 AromaticContact NE1-NE1 3.93Å; H505-W542 AromaticContact CD2-CZ3 3.86Å; W540-W542 VanDerWaalsContact C-N 3.31Å; W540-W542 HydrophobicContact CD2-CB 4.19Å; W540-W542 AromaticContact CE2-CD1 3.64Å; W540-W542 HydrophobicContact CE3-CB 3.77Å; W540-W542 HydrophobicContact CE3-CG 4.44Å; W540-W542 HydrophobicContact CH2-CB 4.32Å; W540-W542 AromaticContact CH2-CD1 3.72Å; W540-W542 HydrophobicContact CH2-CG 4.3Å; W540-W542 AromaticContact CZ2-CD1 3.48Å; W540-W542 VanDerWaalsContact CZ2-CD1 3.48Å; W540-W542 HydrophobicContact CZ2-CG 4.42Å; W540-W542 HydrophobicContact CZ3-CB 3.84Å; W540-W542 HydrophobicContact CZ3-CG 4.31Å; W540-W542 PolarHBondContact O-N 2.77Å; W542-V544 VanDerWaalsContact C-N 3.3Å; W542-V544 PolarHBondContact O-N 3.44Å; W542-Y545 HydrophobicContact CD2-CD2 4.45Å; W542-Y545 AromaticContact CE3-CD2 3.76Å; W542-Y545 HydrophobicContact CE3-CD2 3.76Å; W542-Y545 HydrophobicContact CE3-CE2 4.41Å; W542-Y545 AromaticContact CZ3-CD2 3.99Å; W542-Y545 HydrophobicContact CZ3-CD2 3.99Å; W542-Y545 HydrophobicContact CZ3-CE2 4.38Å; W542-Y545 CarbonylContact O-C 3.59Å; W542-Y545 WeakPolarHBondContact O-CA 3.47Å; W542-Y545 WeakPolarHBondContact O-CB 3.42Å; W542-Y545 PolarHBondContact O-N 3.47Å; W542-I546 VanDerWaalsContact O-CG1 3.3Å; W542-I546 WeakPolarHBondContact O-CG1 2.96Å; W542-I546 PolarHBondContact O-N 2.86Å
543	S	95.2	Very high	95.3	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-33.5	173.6	-56.1	0	0	0	0	112.8	L535 A537 W540 K541 R547	L535-S543 VanDerWaalsContact O-CA 3.31Å; L535-S543 WeakPolarHBondContact O-CA 3.45Å; L535-S543 WeakPolarHBondContact O-CB 3.15Å; L535-S543 PolarHBondContact O-OG 3.4Å; A537-S543 WeakPolarHBondContact O-CB 3.48Å; A537-S543 PolarHBondContact O-OG 3.13Å; A537-S543 VanDerWaalsContact O-OG 3.13Å; W540-S543 WeakPolarHBondContact O-CA 3.34Å; W540-S543 WeakPolarHBondContact O-CB 3.43Å; W540-S543 PolarHBondContact O-N 3.4Å; K541-S543 PolarHBondContact O-N 3.25Å; S543-R547 WeakPolarHBondContact O-CG 3.26Å; S543-R547 PolarHBondContact O-N 2.77Å; S543-R547 VanDerWaalsContact O-N 3.14Å
544	V	94	Very high	95.2	Very high	46 Å²	46	43.3 Å²	43.3	28%	0.279	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-45.2	169.6	-179.1	0	0	0	0	110.6	W484 W540 K541 W542 R547 A548	W484-V544 HydrophobicContact CE3-CG1 4.28Å; W484-V544 HydrophobicContact CZ3-CG1 4.33Å; W540-V544 PolarHBondContact O-N 3.34Å; K541-V544 WeakPolarHBondContact O-CB 3.41Å; K541-V544 PolarHBondContact O-N 3.49Å; W542-V544 VanDerWaalsContact C-N 3.3Å; W542-V544 PolarHBondContact O-N 3.44Å; V544-R547 PolarHBondContact O-N 3.28Å; V544-A548 PolarHBondContact O-N 2.81Å; V544-A548 VanDerWaalsContact O-N 3.15Å
545	Y	94.8	Very high	95.2	Very high	10 Å²	10	42 Å²	42	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-42.8	179.1	-63.1	-14.8	0	0	0	112.6	W484 F490 P491 K541 W542 R547 A548 A549	W484-Y545 HydrophobicContact CB-CE1 3.86Å; W484-Y545 AromaticContact CD2-CD1 3.89Å; W484-Y545 HydrophobicContact CD2-CD1 3.89Å; W484-Y545 AromaticContact CD2-CE1 3.43Å; W484-Y545 HydrophobicContact CD2-CE1 3.43Å; W484-Y545 VanDerWaalsContact CD2-CE1 3.43Å; W484-Y545 AromaticContact CE3-CD1 3.57Å; W484-Y545 HydrophobicContact CE3-CD1 3.57Å; W484-Y545 AromaticContact CE3-CE1 3.5Å; W484-Y545 HydrophobicContact CE3-CE1 3.5Å; W484-Y545 AromaticContact CG-CE1 3.6Å; W484-Y545 HydrophobicContact CG-CE1 3.6Å; W484-Y545 HydrophobicContact CH2-CD1 4.23Å; W484-Y545 AromaticContact CZ3-CD1 3.73Å; W484-Y545 HydrophobicContact CZ3-CD1 3.73Å; W484-Y545 HydrophobicContact CZ3-CE1 4.14Å; F490-Y545 HydrophobicContact CD1-CD1 4.22Å; F490-Y545 HydrophobicContact CD1-CD2 4.36Å; F490-Y545 AromaticContact CD1-CG 3.96Å; F490-Y545 HydrophobicContact CD1-CG 3.96Å; F490-Y545 HydrophobicContact CE1-CD1 4.41Å; F490-Y545 HydrophobicContact CE1-CG 4.22Å; P491-Y545 HydrophobicContact CG-CE2 3.94Å; P491-Y545 VanDerWaalsContact CG-OH 3.27Å; P491-Y545 WeakPolarHBondContact CG-OH 3.43Å; K541-Y545 HydrophobicContact CD-CE2 4.38Å; K541-Y545 WeakPolarHBondContact CE-OH 3.5Å; K541-Y545 HydrophobicContact CG-CE1 4.45Å; K541-Y545 HydrophobicContact CG-CE2 3.97Å; K541-Y545 PolarHBondContact O-N 3.03Å; K541-Y545 VanDerWaalsContact O-N 3.16Å; W542-Y545 HydrophobicContact CD2-CD2 4.45Å; W542-Y545 AromaticContact CE3-CD2 3.76Å; W542-Y545 HydrophobicContact CE3-CD2 3.76Å; W542-Y545 HydrophobicContact CE3-CE2 4.41Å; W542-Y545 AromaticContact CZ3-CD2 3.99Å; W542-Y545 HydrophobicContact CZ3-CD2 3.99Å; W542-Y545 HydrophobicContact CZ3-CE2 4.38Å; W542-Y545 CarbonylContact O-C 3.59Å; W542-Y545 WeakPolarHBondContact O-CA 3.47Å; W542-Y545 WeakPolarHBondContact O-CB 3.42Å; W542-Y545 PolarHBondContact O-N 3.47Å; Y545-R547 PolarHBondContact O-N 2.96Å; Y545-A548 PolarHBondContact O-N 3.47Å; Y545-A549 WeakPolarHBondContact O-CB 3.39Å; Y545-A549 PolarHBondContact O-N 2.94Å
546	I	96.9	Very high	95.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-47.2	175.1	-67.9	-72.9	0	0	0	110.9	I508 V509 L535 W542 A548 A549 V550	I508-I546 HydrophobicContact CG2-CD1 4Å; V509-I546 HydrophobicContact CG2-CD1 3.66Å; V509-I546 HydrophobicContact CG2-CG2 4.11Å; L535-I546 HydrophobicContact CB-CG1 4.24Å; L535-I546 HydrophobicContact CB-CG2 3.95Å; L535-I546 HydrophobicContact CD1-CD1 4.39Å; W542-I546 VanDerWaalsContact O-CG1 3.3Å; W542-I546 WeakPolarHBondContact O-CG1 2.96Å; W542-I546 PolarHBondContact O-N 2.86Å; I546-A548 VanDerWaalsContact C-N 3.28Å; I546-A548 PolarHBondContact O-N 3.18Å; I546-A549 PolarHBondContact O-N 3Å; I546-V550 WeakPolarHBondContact O-CG2 3.29Å; I546-V550 PolarHBondContact O-N 3.45Å
547	R	97.6	Very high	95.2	Very high	13 Å²	13	46.4 Å²	46.4	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-36.3	177.2	-72.3	-172	-58.6	-100.7	6.7	112.9	A536 G538 S543 V544 Y545 N580 M581 D584 N587	A536-R547 HydrophobicContact CB-CG 3.75Å; A536-R547 PolarHBondContact O-NH1 3.1Å; G538-R547 PolarHBondContact O-NH1 3.29Å; G538-R547 PolarHBondContact O-NH2 3.29Å; S543-R547 WeakPolarHBondContact O-CG 3.26Å; S543-R547 PolarHBondContact O-N 2.77Å; S543-R547 VanDerWaalsContact O-N 3.14Å; V544-R547 PolarHBondContact O-N 3.28Å; Y545-R547 PolarHBondContact O-N 2.96Å; R547-N580 WeakPolarHBondContact CD-O 3.49Å; R547-M581 HydrophobicContact CB-SD 4.33Å; R547-M581 HydrophobicContact CG-SD 3.91Å; R547-D584 HydrophobicContact CB-CB 4.27Å; R547-N587 PolarHBondContact O-ND2 2.58Å
548	A	96.4	Very high	95.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-76.5	-35.4	176.5	0	0	0	0	0	112.7	W484 V544 Y545 I546 R551 K552	W484-A548 HydrophobicContact CH2-CB 3.48Å; W484-A548 VanDerWaalsContact CH2-CB 3.48Å; W484-A548 HydrophobicContact CZ3-CB 3.67Å; V544-A548 PolarHBondContact O-N 2.81Å; V544-A548 VanDerWaalsContact O-N 3.15Å; Y545-A548 PolarHBondContact O-N 3.47Å; I546-A548 VanDerWaalsContact C-N 3.28Å; I546-A548 PolarHBondContact O-N 3.18Å; A548-R551 PolarHBondContact O-N 3.47Å; A548-K552 WeakPolarHBondContact O-CG 3.5Å; A548-K552 PolarHBondContact O-N 2.85Å
549	A	96.7	Very high	95.7	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.033	22%	0.22	C	C	.	.	H	α-helix	trans	-63.9	-46.6	174.8	0	0	0	0	0	111.3	F490 P506 V509 Y545 I546 R551 K552 E553	F490-A549 HydrophobicContact CE2-CB 4.29Å; F490-A549 HydrophobicContact CZ-CB 3.81Å; P506-A549 HydrophobicContact CB-CB 4.06Å; V509-A549 HydrophobicContact CB-CB 4.34Å; V509-A549 HydrophobicContact CG1-CB 4.49Å; V509-A549 HydrophobicContact CG2-CB 3.99Å; Y545-A549 WeakPolarHBondContact O-CB 3.39Å; Y545-A549 PolarHBondContact O-N 2.94Å; I546-A549 PolarHBondContact O-N 3Å; A549-R551 PolarHBondContact O-N 2.69Å; A549-R551 VanDerWaalsContact O-N 3.16Å; A549-K552 PolarHBondContact O-N 3.06Å; A549-E553 WeakPolarHBondContact O-CB 3.38Å; A549-E553 WeakPolarHBondContact O-CG 3.5Å; A549-E553 PolarHBondContact O-N 3.31Å
550	V	98	Very high	96	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.6	-34.5	174.5	169.4	0	0	0	0	112	V509 L532 I546 G555 L556 L559 M581	V509-V550 HydrophobicContact CB-CG2 4.47Å; V509-V550 HydrophobicContact CG1-CB 4.32Å; V509-V550 HydrophobicContact CG1-CG2 3.52Å; V509-V550 HydrophobicContact CG2-CG2 4.08Å; L532-V550 HydrophobicContact CD2-CG2 4.12Å; I546-V550 WeakPolarHBondContact O-CG2 3.29Å; I546-V550 PolarHBondContact O-N 3.45Å; V550-G555 WeakPolarHBondContact O-CA 3.35Å; V550-G555 PolarHBondContact O-N 3.28Å; V550-L556 HydrophobicContact CG1-CD2 4.32Å; V550-L559 HydrophobicContact CG1-CD1 4.38Å; V550-M581 HydrophobicContact CB-CE 4.26Å; V550-M581 HydrophobicContact CB-SD 3.98Å; V550-M581 HydrophobicContact CG1-CE 4.15Å; V550-M581 HydrophobicContact CG1-CG 4.48Å; V550-M581 HydrophobicContact CG1-SD 3.94Å; V550-M581 HydrophobicContact CG2-CE 3.76Å; V550-M581 HydrophobicContact CG2-SD 4.1Å
551	R	96.2	Very high	96.3	Very high	43 Å²	43	43.5 Å²	43.5	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-74.3	-44.6	173.3	-174	-176.2	54.9	-109.1	-6.4	112.8	G486 A548 A549 E553 K554 L556 D584 N587 L590	G486-R551 PolarHBondContact O-NH2 3.01Å; A548-R551 PolarHBondContact O-N 3.47Å; A549-R551 PolarHBondContact O-N 2.69Å; A549-R551 VanDerWaalsContact O-N 3.16Å; R551-E553 VanDerWaalsContact C-N 3.33Å; R551-E553 PolarHBondContact O-N 2.81Å; R551-K554 PolarHBondContact O-N 3.2Å; R551-K554 VanDerWaalsContact O-N 3.16Å; R551-L556 HydrophobicContact CB-CD1 4.47Å; R551-L556 HydrophobicContact CG-CD1 4.31Å; R551-D584 IonicContact CZ-OD2 3.12Å; R551-D584 IonicContact NH1-OD1 3.18Å; R551-D584 PolarHBondContact NH1-OD1 3.37Å; R551-D584 IonicContact NH1-OD2 3.37Å; R551-D584 PolarHBondContact NH1-OD2 3.24Å; R551-D584 IonicContact NH2-OD2 3.6Å; R551-N587 VanDerWaalsContact CB-OD1 3.31Å; R551-N587 WeakPolarHBondContact CB-OD1 3.38Å; R551-N587 VanDerWaalsContact CD-OD1 3.26Å; R551-N587 WeakPolarHBondContact CD-OD1 3.37Å; R551-N587 PolarHBondContact NH1-OD1 2.84Å; R551-L590 HydrophobicContact CG-CD1 3.83Å
552	K	94.8	Very high	96.6	Very high	90 Å²	90	38.5 Å²	38.5	39%	0.391	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-41.3	178.8	-74.8	-178.1	175.5	-174.3	0	111.3	V487 S488 F490 A548 A549 K554	V487-K552 PolarHBondContact O-NZ 3.34Å; S488-K552 PolarHBondContact O-NZ 3.06Å; F490-K552 HydrophobicContact CE2-CD 4.39Å; F490-K552 HydrophobicContact CZ-CD 4.26Å; A548-K552 WeakPolarHBondContact O-CG 3.5Å; A548-K552 PolarHBondContact O-N 2.85Å; A549-K552 PolarHBondContact O-N 3.06Å; K552-K554 PolarHBondContact O-N 2.91Å
553	E	95.8	Very high	96.8	Very high	93 Å²	93	36.1 Å²	36.1	44%	0.435	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	12	176.1	-62.5	-60.7	137.1	0	0	114.2	V509 L513 A549 R551 G555	V509-E553 HydrophobicContact CG1-CG 4.4Å; L513-E553 HydrophobicContact CD1-CB 3.53Å; L513-E553 HydrophobicContact CD1-CG 4.5Å; A549-E553 WeakPolarHBondContact O-CB 3.38Å; A549-E553 WeakPolarHBondContact O-CG 3.5Å; A549-E553 PolarHBondContact O-N 3.31Å; R551-E553 VanDerWaalsContact C-N 3.33Å; R551-E553 PolarHBondContact O-N 2.81Å; E553-G555 PolarHBondContact O-N 3.05Å; E553-G555 VanDerWaalsContact O-N 3.12Å
554	K	96.4	Very high	96.8	Very high	166 Å²	166	42.9 Å²	42.9	72%	0.722	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	27.4	-179	-54.9	176.8	-177.7	172.8	0	114.9	R551 K552 L556 P557	R551-K554 PolarHBondContact O-N 3.2Å; R551-K554 VanDerWaalsContact O-N 3.16Å; K552-K554 PolarHBondContact O-N 2.91Å; K554-L556 VanDerWaalsContact C-N 3.32Å; K554-L556 PolarHBondContact O-N 2.65Å; K554-P557 VanDerWaalsContact O-CD 3.27Å; K554-P557 WeakPolarHBondContact O-CD 3.42Å
555	G	97.9	Very high	96.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-71.1	-18.6	-179.5	0	0	0	0	0	115.5	V550 E553 I558 L559	V550-G555 WeakPolarHBondContact O-CA 3.35Å; V550-G555 PolarHBondContact O-N 3.28Å; E553-G555 PolarHBondContact O-N 3.05Å; E553-G555 VanDerWaalsContact O-N 3.12Å; G555-I558 PolarHBondContact O-N 3.07Å; G555-L559 WeakPolarHBondContact O-CG 3.48Å; G555-L559 PolarHBondContact O-N 2.64Å
556	L	98.2	Very high	96.6	Very high	12 Å²	12	49.2 Å²	49.2	6%	0.063	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-50.3	177.4	-66	178.8	0	0	0	112.3	V550 R551 K554 I558 L559 V560 L578 M581 N587 L590 I591	V550-L556 HydrophobicContact CG1-CD2 4.32Å; R551-L556 HydrophobicContact CB-CD1 4.47Å; R551-L556 HydrophobicContact CG-CD1 4.31Å; K554-L556 VanDerWaalsContact C-N 3.32Å; K554-L556 PolarHBondContact O-N 2.65Å; L556-I558 VanDerWaalsContact C-N 3.33Å; L556-I558 PolarHBondContact O-N 3.15Å; L556-L559 PolarHBondContact O-N 3.08Å; L556-V560 WeakPolarHBondContact O-CG2 3.41Å; L556-V560 PolarHBondContact O-N 2.87Å; L556-L578 HydrophobicContact CD2-CD2 4.33Å; L556-M581 HydrophobicContact CD2-CB 4.16Å; L556-M581 HydrophobicContact CD2-CG 4.29Å; L556-N587 HydrophobicContact CD1-CB 4.35Å; L556-L590 HydrophobicContact CD1-CB 4.02Å; L556-L590 HydrophobicContact CD1-CD1 4.07Å; L556-I591 HydrophobicContact CD1-CG1 4.37Å; L556-I591 HydrophobicContact CD2-CD1 4.07Å; L556-I591 HydrophobicContact CD2-CG1 4.07Å
557	P	97.9	Very high	96.6	Very high	85 Å²	85	51.1 Å²	51.1	55%	0.552	24%	0.243	S	C	*	.	H	α-helix	trans	-48	-47.2	168	-32.4	32.6	0	0	0	115.2	K554 L559 V560 E561	K554-P557 VanDerWaalsContact O-CD 3.27Å; K554-P557 WeakPolarHBondContact O-CD 3.42Å; P557-L559 PolarHBondContact O-N 3.45Å; P557-V560 PolarHBondContact O-N 3.22Å; P557-V560 VanDerWaalsContact O-N 3.11Å; P557-E561 PolarHBondContact O-N 3.46Å
558	I	98.3	Very high	96.5	Very high	38 Å²	38	52.8 Å²	52.8	20%	0.195	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-48.7	-179.2	-56.2	174.3	0	0	0	110.1	L513 L516 G555 L556 V560 E561 L562	L513-I558 HydrophobicContact CB-CD1 4.23Å; L516-I558 HydrophobicContact CB-CG2 3.83Å; G555-I558 PolarHBondContact O-N 3.07Å; L556-I558 VanDerWaalsContact C-N 3.33Å; L556-I558 PolarHBondContact O-N 3.15Å; I558-V560 VanDerWaalsContact C-N 3.3Å; I558-V560 PolarHBondContact O-N 3.31Å; I558-E561 PolarHBondContact O-N 3.34Å; I558-L562 WeakPolarHBondContact O-CG 3.2Å; I558-L562 PolarHBondContact O-N 3.4Å; I558-L562 VanDerWaalsContact O-N 3.1Å
559	L	98.4	Very high	96.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-37.4	175.6	-67.8	173.8	0	0	0	112.4	L516 V550 G555 L556 P557 L563 V574 L578 M581	L516-L559 HydrophobicContact CD1-CD2 4.14Å; V550-L559 HydrophobicContact CG1-CD1 4.38Å; G555-L559 WeakPolarHBondContact O-CG 3.48Å; G555-L559 PolarHBondContact O-N 2.64Å; L556-L559 PolarHBondContact O-N 3.08Å; P557-L559 PolarHBondContact O-N 3.45Å; L559-L563 PolarHBondContact O-N 3.23Å; L559-V574 HydrophobicContact CB-CG1 4.29Å; L559-V574 HydrophobicContact CD2-CG1 4.44Å; L559-V574 HydrophobicContact CD2-CG2 4.38Å; L559-V574 WeakPolarHBondContact O-CG1 3.45Å; L559-L578 HydrophobicContact CB-CD2 3.86Å; L559-L578 HydrophobicContact CB-CG 4.15Å; L559-L578 HydrophobicContact CD1-CD2 4.11Å; L559-M581 HydrophobicContact CD1-CG 4.39Å
560	V	97.8	Very high	96.5	Very high	12 Å²	12	57.6 Å²	57.6	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-69.3	-35.8	177.4	174.3	0	0	0	0	112	L556 P557 I558 L563 A595 D598	L556-V560 WeakPolarHBondContact O-CG2 3.41Å; L556-V560 PolarHBondContact O-N 2.87Å; P557-V560 PolarHBondContact O-N 3.22Å; P557-V560 VanDerWaalsContact O-N 3.11Å; I558-V560 VanDerWaalsContact C-N 3.3Å; I558-V560 PolarHBondContact O-N 3.31Å; V560-L563 WeakPolarHBondContact O-CB 3.28Å; V560-L563 PolarHBondContact O-N 3.13Å; V560-A595 HydrophobicContact CG1-CB 4.36Å; V560-A595 HydrophobicContact CG2-CB 3.4Å; V560-A595 VanDerWaalsContact CG2-CB 3.4Å; V560-D598 HydrophobicContact CG1-CB 4.22Å
561	E	97.1	Very high	96.5	Very high	130 Å²	130	57.6 Å²	57.6	61%	0.607	27%	0.273	S	S	*	.	H	α-helix	trans	-66.1	-41	176.4	-173.3	162.7	-175.5	0	0	111.9	P557 I558 L563 R564	P557-E561 PolarHBondContact O-N 3.46Å; I558-E561 PolarHBondContact O-N 3.34Å; E561-L563 PolarHBondContact O-N 3.44Å; E561-R564 VanDerWaalsContact O-CB 3.26Å; E561-R564 WeakPolarHBondContact O-CB 3.3Å; E561-R564 WeakPolarHBondContact O-CG 3.42Å; E561-R564 PolarHBondContact O-N 3.37Å
562	L	97.4	Very high	96.6	Very high	11 Å²	11	57 Å²	57	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-22.8	176.3	-66.7	176.1	0	0	0	114	L516 L525 I558 R564 I565 V570 V574	L516-L562 HydrophobicContact CB-CD1 3.94Å; L516-L562 HydrophobicContact CD2-CD1 3.43Å; L516-L562 VanDerWaalsContact CD2-CD1 3.43Å; L516-L562 HydrophobicContact CG-CD1 4.2Å; L525-L562 HydrophobicContact CD1-CD2 4.35Å; L525-L562 HydrophobicContact CD2-CD2 4.31Å; I558-L562 WeakPolarHBondContact O-CG 3.2Å; I558-L562 PolarHBondContact O-N 3.4Å; I558-L562 VanDerWaalsContact O-N 3.1Å; L562-R564 PolarHBondContact O-N 3.22Å; L562-R564 VanDerWaalsContact O-N 3.09Å; L562-I565 HydrophobicContact CD2-CD1 3.46Å; L562-I565 VanDerWaalsContact CD2-CD1 3.46Å; L562-I565 HydrophobicContact CD2-CG1 4.43Å; L562-I565 PolarHBondContact O-N 2.82Å; L562-V570 HydrophobicContact CB-CG1 4.49Å; L562-V574 HydrophobicContact CB-CG1 4.33Å; L562-V574 HydrophobicContact CB-CG2 3.86Å; L562-V574 HydrophobicContact CD1-CG2 4.01Å
563	L	96.8	Very high	96.8	Very high	1 Å²	1	53 Å²	53	1%	0.005	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.6	169.9	-66.5	174.8	0	0	0	113	L559 V560 E561 V571 V574 A575 L578 D598 L599 R602	L559-L563 PolarHBondContact O-N 3.23Å; V560-L563 WeakPolarHBondContact O-CB 3.28Å; V560-L563 PolarHBondContact O-N 3.13Å; E561-L563 PolarHBondContact O-N 3.44Å; L563-V571 HydrophobicContact CD2-CG1 4.18Å; L563-V574 HydrophobicContact CD2-CB 4.36Å; L563-V574 HydrophobicContact CD2-CG1 3.67Å; L563-V574 HydrophobicContact CG-CG1 3.89Å; L563-A575 HydrophobicContact CD2-CB 4.41Å; L563-L578 HydrophobicContact CD1-CD1 3.76Å; L563-L578 HydrophobicContact CD2-CD1 4.38Å; L563-L578 HydrophobicContact CG-CD1 4.19Å; L563-D598 HydrophobicContact CD1-CB 4.28Å; L563-L599 HydrophobicContact CD1-CD2 3.68Å; L563-L599 HydrophobicContact CD1-CG 3.85Å; L563-L599 HydrophobicContact CD2-CD2 4.18Å; L563-R602 WeakPolarHBondContact O-CD 3.44Å; L563-R602 WeakPolarHBondContact O-CG 3.43Å; L563-R602 PolarHBondContact O-NH1 3.27Å
564	R	94.7	Very high	96.9	Very high	145 Å²	145	48.5 Å²	48.5	55%	0.547	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-12.6	179.2	-57.3	179.8	178.6	147.1	9.6	113.9	E561 L562 D598	E561-R564 VanDerWaalsContact O-CB 3.26Å; E561-R564 WeakPolarHBondContact O-CB 3.3Å; E561-R564 WeakPolarHBondContact O-CG 3.42Å; E561-R564 PolarHBondContact O-N 3.37Å; L562-R564 PolarHBondContact O-N 3.22Å; L562-R564 VanDerWaalsContact O-N 3.09Å; R564-D598 IonicContact CZ-OD1 3.72Å; R564-D598 IonicContact NE-OD1 3.94Å; R564-D598 PolarHBondContact NE-OD1 3.09Å; R564-D598 IonicContact NH2-OD1 2.71Å; R564-D598 PolarHBondContact NH2-OD1 2.77Å; R564-D598 IonicContact NH2-OD2 2.73Å; R564-D598 PolarHBondContact NH2-OD2 3.47Å
565	I	93.6	Very high	97	Very high	66 Å²	66	40.6 Å²	40.6	34%	0.338	20%	0.204	S	C	.	.	S	Bend	trans	-71.5	140.9	-178.5	-64.1	-174.2	0	0	0	110.9	L525 L562 N567 R602	L525-I565 HydrophobicContact CD1-CD1 4.21Å; L562-I565 HydrophobicContact CD2-CD1 3.46Å; L562-I565 VanDerWaalsContact CD2-CD1 3.46Å; L562-I565 HydrophobicContact CD2-CG1 4.43Å; L562-I565 PolarHBondContact O-N 2.82Å; I565-N567 HydrophobicContact CG2-CB 4.01Å; I565-N567 PolarHBondContact O-N 2.93Å; I565-R602 PolarHBondContact O-NH1 3.49Å; I565-R602 PolarHBondContact O-NH2 3.33Å
566	D	92.9	Very high	97	Very high	124 Å²	124	41.7 Å²	41.7	66%	0.663	21%	0.21	S	C	*	.	S	Bend	trans	-79	59.5	174.7	-164.3	20	0	0	0	111.9
567	N	95.4	Very high	97.1	Very high	41 Å²	41	41.1 Å²	41.1	22%	0.219	21%	0.207	C	C	.	.			trans	-140.2	113	172.6	-170.5	-66.4	0	0	0	110.6	P522 I565 K569 V570 V571	P522-N567 WeakPolarHBondContact CB-ND2 3.43Å; I565-N567 HydrophobicContact CG2-CB 4.01Å; I565-N567 PolarHBondContact O-N 2.93Å; N567-K569 PolarHBondContact O-N 3.08Å; N567-K569 WeakPolarHBondContact OD1-CB 3.25Å; N567-K569 PolarHBondContact OD1-N 3.34Å; N567-K569 VanDerWaalsContact OD1-N 3.13Å; N567-V570 HydrophobicContact CB-CB 4.14Å; N567-V570 HydrophobicContact CB-CG2 4.04Å; N567-V570 PolarHBondContact O-N 3.37Å; N567-V570 PolarHBondContact OD1-N 3.44Å; N567-V570 VanDerWaalsContact OD1-N 3.13Å; N567-V571 VanDerWaalsContact O-CG2 3.27Å; N567-V571 WeakPolarHBondContact O-CG2 3.12Å; N567-V571 PolarHBondContact O-N 2.8Å; N567-V571 VanDerWaalsContact O-N 3.08Å
568	D	95.3	Very high	97.1	Very high	48 Å²	48	37 Å²	37	26%	0.257	18%	0.181	S	C	.	.	H	α-helix	trans	-59.8	-42.8	-175.7	-172.8	63	0	0	0	112.8	V571 C572 M630 S631 T634	D568-V571 PolarHBondContact O-N 2.69Å; D568-C572 WeakPolarHBondContact O-CB 3.33Å; D568-C572 PolarHBondContact O-N 2.73Å; D568-M630 HydrophobicContact CB-CE 4.4Å; D568-M630 WeakPolarHBondContact OD1-CA 3.38Å; D568-S631 PolarHBondContact OD1-N 2.97Å; D568-S631 PolarHBondContact OD1-OG 3.44Å; D568-S631 WeakPolarHBondContact OD2-CB 3.31Å; D568-S631 PolarHBondContact OD2-OG 3.44Å; D568-T634 PolarHBondContact O-OG1 2.89Å; D568-T634 VanDerWaalsContact OD1-CB 3.23Å; D568-T634 WeakPolarHBondContact OD1-CB 3.3Å; D568-T634 PolarHBondContact OD1-OG1 2.97Å; D568-T634 PolarHBondContact OD2-OG1 3.27Å
569	K	96.4	Very high	97.1	Very high	104 Å²	104	40 Å²	40	45%	0.452	19%	0.19	S	C	.	.	H	α-helix	trans	-64.3	-47.9	179.3	-65.2	-175.4	-179.3	179.4	0	112	D523 E526 N567 V571 C572 A573	D523-K569 IonicContact OD1-NZ 2.85Å; D523-K569 PolarHBondContact OD1-NZ 2.96Å; E526-K569 HydrophobicContact CG-CB 4.19Å; N567-K569 PolarHBondContact O-N 3.08Å; N567-K569 WeakPolarHBondContact OD1-CB 3.25Å; N567-K569 PolarHBondContact OD1-N 3.34Å; N567-K569 VanDerWaalsContact OD1-N 3.13Å; K569-V571 VanDerWaalsContact C-N 3.33Å; K569-V571 PolarHBondContact O-N 3.36Å; K569-C572 PolarHBondContact O-N 3.28Å; K569-A573 PolarHBondContact O-N 3.05Å
570	V	97.9	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-46.9	178.5	176	0	0	0	0	109.9	P522 L525 E526 L562 N567 C572 A573 V574	P522-V570 HydrophobicContact CB-CG2 4.04Å; P522-V570 VanDerWaalsContact O-CG2 3.3Å; P522-V570 WeakPolarHBondContact O-CG2 3.49Å; L525-V570 HydrophobicContact CB-CG1 4.19Å; L525-V570 HydrophobicContact CB-CG2 3.95Å; E526-V570 HydrophobicContact CB-CG2 4.41Å; L562-V570 HydrophobicContact CB-CG1 4.49Å; N567-V570 HydrophobicContact CB-CB 4.14Å; N567-V570 HydrophobicContact CB-CG2 4.04Å; N567-V570 PolarHBondContact O-N 3.37Å; N567-V570 PolarHBondContact OD1-N 3.44Å; N567-V570 VanDerWaalsContact OD1-N 3.13Å; V570-C572 VanDerWaalsContact C-N 3.35Å; V570-C572 PolarHBondContact O-N 3.29Å; V570-A573 PolarHBondContact O-N 3.41Å; V570-V574 HydrophobicContact CG1-CG2 4.14Å; V570-V574 VanDerWaalsContact O-CB 3.28Å; V570-V574 WeakPolarHBondContact O-CB 2.87Å; V570-V574 WeakPolarHBondContact O-CG2 3.28Å; V570-V574 PolarHBondContact O-N 2.87Å
571	V	97.9	Very high	97.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-38.1	179.4	174.1	0	0	0	0	111.9	L563 N567 D568 K569 A575 R602 T634 I638	L563-V571 HydrophobicContact CD2-CG1 4.18Å; N567-V571 VanDerWaalsContact O-CG2 3.27Å; N567-V571 WeakPolarHBondContact O-CG2 3.12Å; N567-V571 PolarHBondContact O-N 2.8Å; N567-V571 VanDerWaalsContact O-N 3.08Å; D568-V571 PolarHBondContact O-N 2.69Å; K569-V571 VanDerWaalsContact C-N 3.33Å; K569-V571 PolarHBondContact O-N 3.36Å; V571-A575 WeakPolarHBondContact O-CB 3.44Å; V571-A575 PolarHBondContact O-N 2.87Å; V571-R602 HydrophobicContact CG1-CG 4.4Å; V571-T634 HydrophobicContact CB-CG2 4.3Å; V571-T634 HydrophobicContact CG1-CG2 3.82Å; V571-I638 HydrophobicContact CG1-CD1 4.42Å
572	C	98	Very high	97.2	Very high	30 Å²	30	34.4 Å²	34.4	20%	0.203	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-47.6	174.5	-171.4	0	0	0	0	112.6	D568 K569 V570 T576 T634	D568-C572 WeakPolarHBondContact O-CB 3.33Å; D568-C572 PolarHBondContact O-N 2.73Å; K569-C572 PolarHBondContact O-N 3.28Å; V570-C572 VanDerWaalsContact C-N 3.35Å; V570-C572 PolarHBondContact O-N 3.29Å; C572-T576 WeakPolarHBondContact O-CB 3.32Å; C572-T576 PolarHBondContact O-N 2.97Å; C572-T576 PolarHBondContact O-OG1 3.47Å; C572-T634 HydrophobicContact CB-CG2 4.43Å; C572-T634 WeakPolarHBondContact CB-OG1 3.48Å
573	A	98.4	Very high	97.1	Very high	6 Å²	6	37.2 Å²	37.2	5%	0.05	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-46.3	177.2	0	0	0	0	0	111.4	E526 A529 K569 V570 T576 A577	E526-A573 HydrophobicContact CG-CB 4.04Å; A529-A573 HydrophobicContact CB-CB 3.95Å; K569-A573 PolarHBondContact O-N 3.05Å; V570-A573 PolarHBondContact O-N 3.41Å; A573-T576 PolarHBondContact O-N 3.43Å; A573-A577 WeakPolarHBondContact O-CB 3.4Å; A573-A577 PolarHBondContact O-N 3.13Å
574	V	98.6	Very high	97.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-44.2	178.6	167.9	0	0	0	0	112.2	A529 L559 L562 L563 V570 T576 A577 L578	A529-V574 HydrophobicContact CB-CG2 3.8Å; L559-V574 HydrophobicContact CB-CG1 4.29Å; L559-V574 HydrophobicContact CD2-CG1 4.44Å; L559-V574 HydrophobicContact CD2-CG2 4.38Å; L559-V574 WeakPolarHBondContact O-CG1 3.45Å; L562-V574 HydrophobicContact CB-CG1 4.33Å; L562-V574 HydrophobicContact CB-CG2 3.86Å; L562-V574 HydrophobicContact CD1-CG2 4.01Å; L563-V574 HydrophobicContact CD2-CB 4.36Å; L563-V574 HydrophobicContact CD2-CG1 3.67Å; L563-V574 HydrophobicContact CG-CG1 3.89Å; V570-V574 HydrophobicContact CG1-CG2 4.14Å; V570-V574 VanDerWaalsContact O-CB 3.28Å; V570-V574 WeakPolarHBondContact O-CB 2.87Å; V570-V574 WeakPolarHBondContact O-CG2 3.28Å; V570-V574 PolarHBondContact O-N 2.87Å; V574-T576 VanDerWaalsContact C-N 3.29Å; V574-T576 PolarHBondContact O-N 3.27Å; V574-A577 PolarHBondContact O-N 3.42Å; V574-L578 HydrophobicContact CG1-CD1 4.14Å; V574-L578 WeakPolarHBondContact O-CB 3.37Å; V574-L578 WeakPolarHBondContact O-CG 3.32Å; V574-L578 PolarHBondContact O-N 3.22Å
575	A	98.6	Very high	97.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-40.2	175.2	0	0	0	0	0	111.4	L563 V571 L578 R579 A637 I638 A641	L563-A575 HydrophobicContact CD2-CB 4.41Å; V571-A575 WeakPolarHBondContact O-CB 3.44Å; V571-A575 PolarHBondContact O-N 2.87Å; A575-L578 PolarHBondContact O-N 3.32Å; A575-R579 PolarHBondContact O-N 2.86Å; A575-A637 HydrophobicContact CB-CB 4.13Å; A575-I638 HydrophobicContact CB-CG1 4.01Å; A575-A641 WeakPolarHBondContact O-CB 3.37Å
576	T	98.6	Very high	97.2	Very high	22 Å²	22	36.6 Å²	36.6	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-73.4	-33.2	177.9	-47.1	0	0	0	0	112.4	Q533 C572 A573 V574 R579 N580 A637	Q533-T576 HydrophobicContact CG-CG2 3.92Å; Q533-T576 VanDerWaalsContact NE2-CG2 3.3Å; C572-T576 WeakPolarHBondContact O-CB 3.32Å; C572-T576 PolarHBondContact O-N 2.97Å; C572-T576 PolarHBondContact O-OG1 3.47Å; A573-T576 PolarHBondContact O-N 3.43Å; V574-T576 VanDerWaalsContact C-N 3.29Å; V574-T576 PolarHBondContact O-N 3.27Å; T576-R579 WeakPolarHBondContact O-CB 3.5Å; T576-N580 PolarHBondContact O-N 2.86Å; T576-N580 VanDerWaalsContact O-N 3.14Å; T576-A637 WeakPolarHBondContact OG1-CB 3.49Å
577	A	98.7	Very high	97.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-50.2	169.3	0	0	0	0	0	110.8	Q533 A573 V574 R579 N580 M581	Q533-A577 HydrophobicContact CB-CB 4.06Å; A573-A577 WeakPolarHBondContact O-CB 3.4Å; A573-A577 PolarHBondContact O-N 3.13Å; V574-A577 PolarHBondContact O-N 3.42Å; A577-R579 VanDerWaalsContact C-N 3.32Å; A577-R579 PolarHBondContact O-N 2.97Å; A577-N580 CarbonylContact O-C 3.32Å; A577-N580 PolarHBondContact O-N 2.89Å; A577-M581 WeakPolarHBondContact O-CG 3.26Å; A577-M581 PolarHBondContact O-N 3.34Å
578	L	98.7	Very high	97.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.9	-40.1	177.3	-74.8	170.3	0	0	0	112.6	L556 L559 L563 V574 A575 N580 M581 A582 I591	L556-L578 HydrophobicContact CD2-CD2 4.33Å; L559-L578 HydrophobicContact CB-CD2 3.86Å; L559-L578 HydrophobicContact CB-CG 4.15Å; L559-L578 HydrophobicContact CD1-CD2 4.11Å; L563-L578 HydrophobicContact CD1-CD1 3.76Å; L563-L578 HydrophobicContact CD2-CD1 4.38Å; L563-L578 HydrophobicContact CG-CD1 4.19Å; V574-L578 HydrophobicContact CG1-CD1 4.14Å; V574-L578 WeakPolarHBondContact O-CB 3.37Å; V574-L578 WeakPolarHBondContact O-CG 3.32Å; V574-L578 PolarHBondContact O-N 3.22Å; A575-L578 PolarHBondContact O-N 3.32Å; L578-N580 VanDerWaalsContact C-N 3.35Å; L578-N580 PolarHBondContact O-N 3.47Å; L578-M581 PolarHBondContact O-N 3.41Å; L578-A582 WeakPolarHBondContact O-CB 3.31Å; L578-A582 PolarHBondContact O-N 3.08Å; L578-I591 HydrophobicContact CD2-CD1 4.18Å; L578-I591 HydrophobicContact CD2-CG1 4.21Å
579	R	98.6	Very high	97.5	Very high	100 Å²	100	32.2 Å²	32.2	38%	0.377	15%	0.153	S	C	.	.	H	α-helix	trans	-54.6	-49.1	170.6	179.9	-170.6	166.4	-165.2	-9.1	111.6	A575 T576 A577 A582 A641 E644	A575-R579 PolarHBondContact O-N 2.86Å; T576-R579 WeakPolarHBondContact O-CB 3.5Å; A577-R579 VanDerWaalsContact C-N 3.32Å; A577-R579 PolarHBondContact O-N 2.97Å; R579-A582 PolarHBondContact O-N 3.13Å; R579-A641 HydrophobicContact CB-CB 3.98Å; R579-E644 HydrophobicContact CG-CB 4.01Å; R579-E644 HydrophobicContact CG-CG 4.46Å
580	N	98.5	Very high	97.5	Very high	24 Å²	24	30.3 Å²	30.3	13%	0.128	15%	0.147	C	C	.	.	H	α-helix	trans	-69.1	-38	179.3	-72.4	-2.5	0	0	0	111.6	Q533 A536 R547 T576 A577 L578 A582 L583	Q533-N580 PolarHBondContact O-ND2 3Å; A536-N580 HydrophobicContact CB-CB 3.9Å; R547-N580 WeakPolarHBondContact CD-O 3.49Å; T576-N580 PolarHBondContact O-N 2.86Å; T576-N580 VanDerWaalsContact O-N 3.14Å; A577-N580 CarbonylContact O-C 3.32Å; A577-N580 PolarHBondContact O-N 2.89Å; L578-N580 VanDerWaalsContact C-N 3.35Å; L578-N580 PolarHBondContact O-N 3.47Å; N580-A582 VanDerWaalsContact C-N 3.26Å; N580-A582 PolarHBondContact O-N 3.06Å; N580-L583 VanDerWaalsContact O-CB 3.29Å; N580-L583 WeakPolarHBondContact O-CB 3.45Å; N580-L583 VanDerWaalsContact O-CG 3.3Å; N580-L583 WeakPolarHBondContact O-CG 3.18Å; N580-L583 PolarHBondContact O-N 2.87Å; N580-L583 VanDerWaalsContact O-N 3.1Å
581	M	98.3	Very high	97.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.2	-37.2	174.2	-65.1	-55	159.3	0	0	112.2	L532 A536 R547 V550 L556 L559 A577 L578 L583 D584 N587 I591	L532-M581 HydrophobicContact CB-CE 4.06Å; A536-M581 HydrophobicContact CB-CE 3.56Å; A536-M581 HydrophobicContact CB-SD 3.9Å; R547-M581 HydrophobicContact CB-SD 4.33Å; R547-M581 HydrophobicContact CG-SD 3.91Å; V550-M581 HydrophobicContact CB-CE 4.26Å; V550-M581 HydrophobicContact CB-SD 3.98Å; V550-M581 HydrophobicContact CG1-CE 4.15Å; V550-M581 HydrophobicContact CG1-CG 4.48Å; V550-M581 HydrophobicContact CG1-SD 3.94Å; V550-M581 HydrophobicContact CG2-CE 3.76Å; V550-M581 HydrophobicContact CG2-SD 4.1Å; L556-M581 HydrophobicContact CD2-CB 4.16Å; L556-M581 HydrophobicContact CD2-CG 4.29Å; L559-M581 HydrophobicContact CD1-CG 4.39Å; A577-M581 WeakPolarHBondContact O-CG 3.26Å; A577-M581 PolarHBondContact O-N 3.34Å; L578-M581 PolarHBondContact O-N 3.41Å; M581-L583 PolarHBondContact O-N 3.23Å; M581-L583 VanDerWaalsContact O-N 3.12Å; M581-D584 PolarHBondContact O-N 3.05Å; M581-D584 VanDerWaalsContact O-N 3.15Å; M581-N587 WeakPolarHBondContact O-CB 3.39Å; M581-N587 PolarHBondContact O-ND2 2.8Å; M581-N587 VanDerWaalsContact O-ND2 3.13Å; M581-I591 HydrophobicContact CB-CD1 3.96Å
582	A	98.1	Very high	97.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-4.2	177.5	0	0	0	0	0	114.5	L578 R579 N580 D584 K588 I591 E644 V645	L578-A582 WeakPolarHBondContact O-CB 3.31Å; L578-A582 PolarHBondContact O-N 3.08Å; R579-A582 PolarHBondContact O-N 3.13Å; N580-A582 VanDerWaalsContact C-N 3.26Å; N580-A582 PolarHBondContact O-N 3.06Å; A582-D584 PolarHBondContact O-N 3.12Å; A582-K588 HydrophobicContact CB-CB 4.37Å; A582-K588 WeakPolarHBondContact O-CE 3.36Å; A582-I591 HydrophobicContact CB-CD1 4.07Å; A582-E644 HydrophobicContact CB-CG 4.05Å; A582-V645 HydrophobicContact CB-CG2 3.94Å
583	L	96.4	Very high	97.2	Very high	70 Å²	70	36.3 Å²	36.3	37%	0.366	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.4	168.2	-61.5	174.2	0	0	0	112.8	N580 M581 E644	N580-L583 VanDerWaalsContact O-CB 3.29Å; N580-L583 WeakPolarHBondContact O-CB 3.45Å; N580-L583 VanDerWaalsContact O-CG 3.3Å; N580-L583 WeakPolarHBondContact O-CG 3.18Å; N580-L583 PolarHBondContact O-N 2.87Å; N580-L583 VanDerWaalsContact O-N 3.1Å; M581-L583 PolarHBondContact O-N 3.23Å; M581-L583 VanDerWaalsContact O-N 3.12Å; L583-E644 HydrophobicContact CD2-CG 4.38Å
584	D	95.6	Very high	97	Very high	15 Å²	15	42.5 Å²	42.5	8%	0.08	19%	0.194	C	C	.	.	S	Bend	trans	-85.3	125.6	162.9	-179.6	-33.8	0	0	0	109	R547 R551 M581 A582 R586 N587 K588	R547-D584 HydrophobicContact CB-CB 4.27Å; R551-D584 IonicContact CZ-OD2 3.12Å; R551-D584 IonicContact NH1-OD1 3.18Å; R551-D584 PolarHBondContact NH1-OD1 3.37Å; R551-D584 IonicContact NH1-OD2 3.37Å; R551-D584 PolarHBondContact NH1-OD2 3.24Å; R551-D584 IonicContact NH2-OD2 3.6Å; M581-D584 PolarHBondContact O-N 3.05Å; M581-D584 VanDerWaalsContact O-N 3.15Å; A582-D584 PolarHBondContact O-N 3.12Å; D584-R586 VanDerWaalsContact C-N 3.25Å; D584-R586 PolarHBondContact O-N 2.97Å; D584-R586 IonicContact OD1-CZ 2.8Å; D584-R586 PolarHBondContact OD1-N 3.46Å; D584-R586 IonicContact OD1-NE 3.31Å; D584-R586 PolarHBondContact OD1-NE 2.74Å; D584-R586 VanDerWaalsContact OD1-NE 3.12Å; D584-R586 IonicContact OD1-NH2 3.5Å; D584-R586 IonicContact OD2-CZ 2.81Å; D584-R586 IonicContact OD2-NE 2.69Å; D584-R586 IonicContact OD2-NH2 3.8Å; D584-R586 PolarHBondContact OD2-NH2 3.35Å; D584-N587 HydrophobicContact CB-CB 4.1Å; D584-N587 WeakPolarHBondContact O-CB 3.34Å; D584-N587 PolarHBondContact O-N 3.03Å; D584-N587 VanDerWaalsContact O-N 3.08Å; D584-K588 PolarHBondContact O-N 3.23Å
585	I	94.8	Very high	97	Very high	118 Å²	118	42.5 Å²	42.5	61%	0.605	19%	0.194	S	C	*	.	H	α-helix	trans	-56.1	-37.9	-176.6	-61.5	171.8	0	0	0	112.1	K588 E589	I585-K588 VanDerWaalsContact O-CB 3.28Å; I585-K588 WeakPolarHBondContact O-CB 3.46Å; I585-K588 PolarHBondContact O-N 3.16Å; I585-E589 WeakPolarHBondContact O-CG 3.36Å; I585-E589 PolarHBondContact O-N 3.33Å
586	R	95.2	Very high	96.9	Very high	66 Å²	66	42.7 Å²	42.7	25%	0.249	20%	0.195	C	C	.	.	H	α-helix	trans	-77.1	-30.8	-178.7	-59.9	158	-61.6	167.9	4.4	111.5	G486 V487 D584 L590	G486-R586 VanDerWaalsContact O-CZ 3.31Å; G486-R586 PolarHBondContact O-NH1 3.28Å; G486-R586 PolarHBondContact O-NH2 2.58Å; V487-R586 VanDerWaalsContact CG2-NH1 3.28Å; D584-R586 VanDerWaalsContact C-N 3.25Å; D584-R586 PolarHBondContact O-N 2.97Å; D584-R586 IonicContact OD1-CZ 2.8Å; D584-R586 PolarHBondContact OD1-N 3.46Å; D584-R586 IonicContact OD1-NE 3.31Å; D584-R586 PolarHBondContact OD1-NE 2.74Å; D584-R586 VanDerWaalsContact OD1-NE 3.12Å; D584-R586 IonicContact OD1-NH2 3.5Å; D584-R586 IonicContact OD2-CZ 2.81Å; D584-R586 IonicContact OD2-NE 2.69Å; D584-R586 IonicContact OD2-NH2 3.8Å; D584-R586 PolarHBondContact OD2-NH2 3.35Å; R586-L590 VanDerWaalsContact O-CG 3.3Å; R586-L590 WeakPolarHBondContact O-CG 3.37Å; R586-L590 PolarHBondContact O-N 3.28Å
587	N	97.4	Very high	96.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-42.3	167.5	-71.8	-1.8	0	0	0	110.1	R547 R551 L556 M581 D584 E589 L590 I591	R547-N587 PolarHBondContact O-ND2 2.58Å; R551-N587 VanDerWaalsContact CB-OD1 3.31Å; R551-N587 WeakPolarHBondContact CB-OD1 3.38Å; R551-N587 VanDerWaalsContact CD-OD1 3.26Å; R551-N587 WeakPolarHBondContact CD-OD1 3.37Å; R551-N587 PolarHBondContact NH1-OD1 2.84Å; L556-N587 HydrophobicContact CD1-CB 4.35Å; M581-N587 WeakPolarHBondContact O-CB 3.39Å; M581-N587 PolarHBondContact O-ND2 2.8Å; M581-N587 VanDerWaalsContact O-ND2 3.13Å; D584-N587 HydrophobicContact CB-CB 4.1Å; D584-N587 WeakPolarHBondContact O-CB 3.34Å; D584-N587 PolarHBondContact O-N 3.03Å; D584-N587 VanDerWaalsContact O-N 3.08Å; N587-E589 VanDerWaalsContact C-N 3.32Å; N587-E589 PolarHBondContact O-N 3.49Å; N587-L590 PolarHBondContact O-N 2.8Å; N587-I591 HydrophobicContact CB-CD1 4.18Å; N587-I591 VanDerWaalsContact O-CB 3.32Å; N587-I591 WeakPolarHBondContact O-CB 3.42Å; N587-I591 WeakPolarHBondContact O-CD1 3.33Å; N587-I591 WeakPolarHBondContact O-CG1 3.35Å; N587-I591 PolarHBondContact O-N 3.12Å
588	K	96.9	Very high	96.7	Very high	20 Å²	20	50.4 Å²	50.4	9%	0.087	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-44.4	178	-172	173.2	-62.1	-147.2	0	112	A582 D584 I585 G592 E644 V645 T647 N649 N652	A582-K588 HydrophobicContact CB-CB 4.37Å; A582-K588 WeakPolarHBondContact O-CE 3.36Å; D584-K588 PolarHBondContact O-N 3.23Å; I585-K588 VanDerWaalsContact O-CB 3.28Å; I585-K588 WeakPolarHBondContact O-CB 3.46Å; I585-K588 PolarHBondContact O-N 3.16Å; K588-G592 PolarHBondContact O-N 3.25Å; K588-E644 VanDerWaalsContact CE-O 3.29Å; K588-E644 WeakPolarHBondContact CE-O 3.36Å; K588-E644 PolarHBondContact NZ-O 3.09Å; K588-E644 IonicContact NZ-OE1 3.74Å; K588-E644 PolarHBondContact NZ-OE1 3.37Å; K588-V645 WeakPolarHBondContact CD-O 3.3Å; K588-V645 VanDerWaalsContact CG-O 3.31Å; K588-V645 WeakPolarHBondContact CG-O 3.43Å; K588-T647 PolarHBondContact NZ-O 3.35Å; K588-N649 HydrophobicContact CD-CB 4.17Å; K588-N652 PolarHBondContact O-ND2 3.12Å
589	E	96.2	Very high	96.6	Very high	102 Å²	102	50.5 Å²	50.5	48%	0.477	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-49	174.7	-70.7	165.4	-173.5	0	0	112.5	I585 N587 G592 K593	I585-E589 WeakPolarHBondContact O-CG 3.36Å; I585-E589 PolarHBondContact O-N 3.33Å; N587-E589 VanDerWaalsContact C-N 3.32Å; N587-E589 PolarHBondContact O-N 3.49Å; E589-G592 PolarHBondContact O-N 2.91Å; E589-K593 PolarHBondContact O-N 3.15Å
590	L	96.7	Very high	96.5	Very high	64 Å²	64	46 Å²	46	34%	0.335	21%	0.206	S	C	.	.	H	α-helix	trans	-64.8	-43.2	179.4	-67	171.6	0	0	0	112.3	R551 L556 R586 N587 G592 K593 Y594	R551-L590 HydrophobicContact CG-CD1 3.83Å; L556-L590 HydrophobicContact CD1-CB 4.02Å; L556-L590 HydrophobicContact CD1-CD1 4.07Å; R586-L590 VanDerWaalsContact O-CG 3.3Å; R586-L590 WeakPolarHBondContact O-CG 3.37Å; R586-L590 PolarHBondContact O-N 3.28Å; N587-L590 PolarHBondContact O-N 2.8Å; L590-G592 VanDerWaalsContact C-N 3.34Å; L590-G592 PolarHBondContact O-N 2.98Å; L590-K593 PolarHBondContact O-N 3.17Å; L590-Y594 HydrophobicContact CB-CD2 4.42Å; L590-Y594 HydrophobicContact CD2-CD2 4.32Å; L590-Y594 HydrophobicContact CD2-CE2 3.85Å; L590-Y594 WeakPolarHBondContact O-CB 3.5Å; L590-Y594 WeakPolarHBondContact O-CD2 3.1Å; L590-Y594 PolarHBondContact O-N 3.44Å
591	I	97.5	Very high	96.3	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-42.3	177	-66.1	165.4	0	0	0	109.8	L556 L578 M581 A582 N587 K593 Y594 A595 M596 V645	L556-I591 HydrophobicContact CD1-CG1 4.37Å; L556-I591 HydrophobicContact CD2-CD1 4.07Å; L556-I591 HydrophobicContact CD2-CG1 4.07Å; L578-I591 HydrophobicContact CD2-CD1 4.18Å; L578-I591 HydrophobicContact CD2-CG1 4.21Å; M581-I591 HydrophobicContact CB-CD1 3.96Å; A582-I591 HydrophobicContact CB-CD1 4.07Å; N587-I591 HydrophobicContact CB-CD1 4.18Å; N587-I591 VanDerWaalsContact O-CB 3.32Å; N587-I591 WeakPolarHBondContact O-CB 3.42Å; N587-I591 WeakPolarHBondContact O-CD1 3.33Å; N587-I591 WeakPolarHBondContact O-CG1 3.35Å; N587-I591 PolarHBondContact O-N 3.12Å; I591-K593 VanDerWaalsContact C-N 3.3Å; I591-K593 PolarHBondContact O-N 3.12Å; I591-Y594 PolarHBondContact O-N 3.07Å; I591-A595 HydrophobicContact CB-CB 4.47Å; I591-A595 HydrophobicContact CG2-CB 3.71Å; I591-A595 WeakPolarHBondContact O-CA 3.32Å; I591-A595 WeakPolarHBondContact O-CB 3.3Å; I591-A595 PolarHBondContact O-N 3.11Å; I591-M596 PolarHBondContact O-N 3.19Å; I591-V645 HydrophobicContact CB-CG2 4.33Å; I591-V645 HydrophobicContact CG2-CG1 4.37Å; I591-V645 HydrophobicContact CG2-CG2 3.51Å
592	G	96.2	Very high	96.1	Very high	2 Å²	2	53 Å²	53	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-36	174.7	0	0	0	0	0	113.8	K588 E589 L590 M596 N652	K588-G592 PolarHBondContact O-N 3.25Å; E589-G592 PolarHBondContact O-N 2.91Å; L590-G592 VanDerWaalsContact C-N 3.34Å; L590-G592 PolarHBondContact O-N 2.98Å; G592-M596 VanDerWaalsContact O-CB 3.27Å; G592-M596 WeakPolarHBondContact O-CB 3.43Å; G592-N652 WeakPolarHBondContact CA-OD1 3.35Å
593	K	94.4	Very high	95.8	Very high	150 Å²	150	53.2 Å²	53.2	65%	0.652	24%	0.237	S	C	*	.	H	α-helix	trans	-76.9	-37.1	178	-172.5	173.9	178.3	-171.1	0	114.1	E589 L590 I591	E589-K593 PolarHBondContact O-N 3.15Å; L590-K593 PolarHBondContact O-N 3.17Å; I591-K593 VanDerWaalsContact C-N 3.3Å; I591-K593 PolarHBondContact O-N 3.12Å
594	Y	94.2	Very high	95.3	Very high	137 Å²	137	52 Å²	52	54%	0.537	23%	0.234	S	C	.	.	H	α-helix	trans	-114.5	-23.9	-167.7	-61.1	-67.1	0	0	0	115.2	L590 I591	L590-Y594 HydrophobicContact CB-CD2 4.42Å; L590-Y594 HydrophobicContact CD2-CD2 4.32Å; L590-Y594 HydrophobicContact CD2-CE2 3.85Å; L590-Y594 WeakPolarHBondContact O-CB 3.5Å; L590-Y594 WeakPolarHBondContact O-CD2 3.1Å; L590-Y594 PolarHBondContact O-N 3.44Å; I591-Y594 PolarHBondContact O-N 3.07Å
595	A	96.6	Very high	94.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-19.6	-176.5	0	0	0	0	0	114.4	V560 I591 R597 D598 L599	V560-A595 HydrophobicContact CG1-CB 4.36Å; V560-A595 HydrophobicContact CG2-CB 3.4Å; V560-A595 VanDerWaalsContact CG2-CB 3.4Å; I591-A595 HydrophobicContact CB-CB 4.47Å; I591-A595 HydrophobicContact CG2-CB 3.71Å; I591-A595 WeakPolarHBondContact O-CA 3.32Å; I591-A595 WeakPolarHBondContact O-CB 3.3Å; I591-A595 PolarHBondContact O-N 3.11Å; A595-R597 PolarHBondContact O-N 2.82Å; A595-D598 PolarHBondContact O-N 3.05Å; A595-D598 VanDerWaalsContact O-N 3.13Å; A595-L599 HydrophobicContact CB-CD1 4.22Å; A595-L599 PolarHBondContact O-N 2.89Å
596	M	97.3	Very high	92.1	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-55.1	-48	-168.3	-175.2	65.9	71.5	0	0	113	I591 G592 D598 I600 L642 V645 I646 N652 A655 L656	I591-M596 PolarHBondContact O-N 3.19Å; G592-M596 VanDerWaalsContact O-CB 3.27Å; G592-M596 WeakPolarHBondContact O-CB 3.43Å; M596-D598 PolarHBondContact O-N 2.79Å; M596-I600 HydrophobicContact CG-CD1 3.81Å; M596-I600 WeakPolarHBondContact O-CB 3.45Å; M596-I600 WeakPolarHBondContact O-CD1 3.17Å; M596-I600 VanDerWaalsContact O-CG1 3.27Å; M596-I600 WeakPolarHBondContact O-CG1 3.15Å; M596-I600 PolarHBondContact O-N 3.15Å; M596-I600 HydrophobicContact SD-CD1 3.94Å; M596-L642 HydrophobicContact SD-CD2 3.55Å; M596-L642 VanDerWaalsContact SD-CD2 3.55Å; M596-V645 HydrophobicContact CE-CG1 3.72Å; M596-I646 HydrophobicContact CE-CG2 4.26Å; M596-N652 HydrophobicContact CE-CB 4.33Å; M596-N652 VanDerWaalsContact CE-O 3.27Å; M596-N652 WeakPolarHBondContact CE-O 3.41Å; M596-A655 HydrophobicContact CE-CB 4.46Å; M596-A655 HydrophobicContact CG-CB 4.32Å; M596-L656 HydrophobicContact CE-CB 4.02Å; M596-L656 HydrophobicContact CG-CB 4.41Å; M596-L656 HydrophobicContact SD-CB 3.59Å; M596-L656 VanDerWaalsContact SD-CB 3.59Å; M596-L656 HydrophobicContact SD-CD1 4.24Å; M596-L656 HydrophobicContact SD-CG 3.81Å
597	R	96.5	Very high	89.4	Confident	169 Å²	169	54 Å²	54	64%	0.638	28%	0.276	S	S	*	.	H	α-helix	trans	-61.6	-44	178.6	-175.9	-176	65.1	173.7	0	111.9	A595 I600 H601	A595-R597 PolarHBondContact O-N 2.82Å; R597-I600 PolarHBondContact O-N 2.95Å; R597-H601 WeakPolarHBondContact O-CB 3.49Å; R597-H601 PolarHBondContact O-N 2.95Å
598	D	96.9	Very high	86.5	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.08	32%	0.315	C	S	.	.	H	α-helix	trans	-69.5	-40.9	-177.2	-65.1	-101.4	0	0	0	111.5	V560 L563 R564 A595 M596 H601 R602	V560-D598 HydrophobicContact CG1-CB 4.22Å; L563-D598 HydrophobicContact CD1-CB 4.28Å; R564-D598 IonicContact CZ-OD1 3.72Å; R564-D598 IonicContact NE-OD1 3.94Å; R564-D598 PolarHBondContact NE-OD1 3.09Å; R564-D598 IonicContact NH2-OD1 2.71Å; R564-D598 PolarHBondContact NH2-OD1 2.77Å; R564-D598 IonicContact NH2-OD2 2.73Å; R564-D598 PolarHBondContact NH2-OD2 3.47Å; A595-D598 PolarHBondContact O-N 3.05Å; A595-D598 VanDerWaalsContact O-N 3.13Å; M596-D598 PolarHBondContact O-N 2.79Å; D598-H601 PolarHBondContact O-N 3.08Å; D598-R602 PolarHBondContact O-N 3.04Å
599	L	97.1	Very high	83.5	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-58.6	-47	170.1	-72.7	168.8	0	0	0	111.9	L563 A595 H601 R602 L603 I638 A641 L642	L563-L599 HydrophobicContact CD1-CD2 3.68Å; L563-L599 HydrophobicContact CD1-CG 3.85Å; L563-L599 HydrophobicContact CD2-CD2 4.18Å; A595-L599 HydrophobicContact CB-CD1 4.22Å; A595-L599 PolarHBondContact O-N 2.89Å; L599-H601 VanDerWaalsContact C-N 3.33Å; L599-H601 PolarHBondContact O-N 2.73Å; L599-R602 PolarHBondContact O-N 3.44Å; L599-L603 PolarHBondContact O-N 2.98Å; L599-I638 HydrophobicContact CB-CG2 4.35Å; L599-I638 HydrophobicContact CD2-CG2 4.35Å; L599-I638 VanDerWaalsContact O-CG2 3.31Å; L599-I638 WeakPolarHBondContact O-CG2 3.27Å; L599-A641 HydrophobicContact CD2-CB 4.38Å; L599-L642 HydrophobicContact CB-CD2 3.86Å; L599-L642 HydrophobicContact CB-CG 4.3Å; L599-L642 HydrophobicContact CD1-CD2 4.07Å
600	I	96.5	Very high	80.5	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	36%	0.364	C	S	.	.	H	α-helix	trans	-68.1	-33.9	178.2	-68.4	161.4	0	0	0	111.4	M596 R597 R602 L603 L642 L656 S659 K664	M596-I600 HydrophobicContact CG-CD1 3.81Å; M596-I600 WeakPolarHBondContact O-CB 3.45Å; M596-I600 WeakPolarHBondContact O-CD1 3.17Å; M596-I600 VanDerWaalsContact O-CG1 3.27Å; M596-I600 WeakPolarHBondContact O-CG1 3.15Å; M596-I600 PolarHBondContact O-N 3.15Å; M596-I600 HydrophobicContact SD-CD1 3.94Å; R597-I600 PolarHBondContact O-N 2.95Å; I600-R602 VanDerWaalsContact C-N 3.29Å; I600-R602 PolarHBondContact O-N 3.44Å; I600-L603 WeakPolarHBondContact O-CB 3.31Å; I600-L603 PolarHBondContact O-N 2.87Å; I600-L642 HydrophobicContact CG1-CD1 4.37Å; I600-L642 HydrophobicContact CG1-CD2 4.16Å; I600-L656 HydrophobicContact CD1-CD2 4.42Å; I600-L656 HydrophobicContact CD1-CG 4.05Å; I600-S659 VanDerWaalsContact CD1-CB 3.41Å; I600-K664 HydrophobicContact CG2-CD 4.15Å; I600-K664 WeakPolarHBondContact O-CD 3.47Å; I600-K664 WeakPolarHBondContact O-CE 3.27Å; I600-K664 PolarHBondContact O-NZ 3.35Å
601	H	94.3	Very high	77.6	Confident	141 Å²	141	68.7 Å²	68.7	65%	0.653	39%	0.386	S	S	*	.	H	α-helix	trans	-61	-40.6	176.6	-170.7	78	0	0	0	111.1	R597 D598 L599 L603 K664	R597-H601 WeakPolarHBondContact O-CB 3.49Å; R597-H601 PolarHBondContact O-N 2.95Å; D598-H601 PolarHBondContact O-N 3.08Å; L599-H601 VanDerWaalsContact C-N 3.33Å; L599-H601 PolarHBondContact O-N 2.73Å; H601-L603 VanDerWaalsContact C-N 3.34Å; H601-L603 PolarHBondContact O-N 3.36Å; H601-K664 PolarHBondContact O-NZ 3.31Å
602	R	92.9	Very high	74.5	Confident	32 Å²	32	75.8 Å²	75.8	12%	0.121	42%	0.424	C	S	.	.	H	α-helix	trans	-72.5	-14.9	176.9	-62.7	-56.7	-70.5	-124.6	10.3	115.5	L563 I565 V571 D598 L599 I600 M630 I638	L563-R602 WeakPolarHBondContact O-CD 3.44Å; L563-R602 WeakPolarHBondContact O-CG 3.43Å; L563-R602 PolarHBondContact O-NH1 3.27Å; I565-R602 PolarHBondContact O-NH1 3.49Å; I565-R602 PolarHBondContact O-NH2 3.33Å; V571-R602 HydrophobicContact CG1-CG 4.4Å; D598-R602 PolarHBondContact O-N 3.04Å; L599-R602 PolarHBondContact O-N 3.44Å; I600-R602 VanDerWaalsContact C-N 3.29Å; I600-R602 PolarHBondContact O-N 3.44Å; R602-M630 PolarHBondContact NH2-SD 3.44Å; R602-I638 HydrophobicContact CB-CD1 3.61Å
603	L	92.3	Very high	71.8	Confident	3 Å²	3	84 Å²	84	2%	0.016	47%	0.468	C	S	.	.	S	Bend	trans	-67.3	140.4	168.3	-69.8	-179.9	0	0	0	110.6	L599 I600 H601 G605 V635 I638 L642 K664 L665 I668	L599-L603 PolarHBondContact O-N 2.98Å; I600-L603 WeakPolarHBondContact O-CB 3.31Å; I600-L603 PolarHBondContact O-N 2.87Å; H601-L603 VanDerWaalsContact C-N 3.34Å; H601-L603 PolarHBondContact O-N 3.36Å; L603-G605 PolarHBondContact O-N 3.2Å; L603-V635 HydrophobicContact CD2-CG1 4.13Å; L603-I638 HydrophobicContact CD2-CB 4.06Å; L603-I638 HydrophobicContact CD2-CG2 3.55Å; L603-I638 HydrophobicContact CG-CG2 3.85Å; L603-L642 HydrophobicContact CD1-CD1 3.73Å; L603-L642 HydrophobicContact CG-CD1 4.35Å; L603-K664 HydrophobicContact CB-CB 4.43Å; L603-K664 HydrophobicContact CB-CD 3.87Å; L603-K664 HydrophobicContact CD1-CB 4.46Å; L603-K664 PolarHBondContact O-NZ 3.2Å; L603-L665 HydrophobicContact CD1-CD2 3.82Å; L603-L665 HydrophobicContact CD1-CG 4.1Å; L603-I668 HydrophobicContact CB-CD1 4.28Å; L603-I668 HydrophobicContact CD1-CD1 4.45Å; L603-I668 HydrophobicContact CD2-CD1 4.03Å; L603-I668 HydrophobicContact CG-CD1 4.5Å
604	P	86.6	Confident	69	Low	46 Å²	46	81.2 Å²	81.2	30%	0.299	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-57	128.5	174.3	24	-33.7	0	0	0	110.5	V635 I668	P604-V635 HydrophobicContact CG-CG1 4.42Å; P604-V635 HydrophobicContact CG-CG2 4.4Å; P604-I668 HydrophobicContact CG-CD1 3.84Å; P604-I668 HydrophobicContact CG-CG1 3.91Å
605	G	70.1	Confident	66.6	Low	42 Å²	42	81.7 Å²	81.7	43%	0.433	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-95.4	156.7	177.1	0	0	0	0	0	111.9	L603 S607	L603-G605 PolarHBondContact O-N 3.2Å; G605-S607 PolarHBondContact O-N 3.13Å
606	S	52.4	Low	63.6	Low	93 Å²	93	86.5 Å²	86.5	65%	0.65	52%	0.515	S	S	*	.			trans	-85.3	22.4	176.7	-62.8	0	0	0	0	113.7
607	S	37.8	Very low	60.9	Low	106 Å²	106	95.1 Å²	95.1	74%	0.741	56%	0.559	S	S	*	*			trans	-92.3	128.4	-174.8	-52.8	0	0	0	0	111.8	G605	G605-S607 PolarHBondContact O-N 3.13Å
608	S	36.4	Very low	57.9	Low	117 Å²	117	89.9 Å²	89.9	82%	0.818	56%	0.558	S	S	*	*	S	Bend	trans	71.9	54.5	168.3	-51.9	0	0	0	0	117.4
609	S	34	Very low	54.9	Low	122 Å²	122	95.6 Å²	95.6	85%	0.853	59%	0.593	S	S	*	*			trans	-134.1	61.5	147	-71.7	0	0	0	0	109.9
610	S	34.4	Very low	52.1	Low	105 Å²	105	101.1 Å²	101.1	73%	0.734	63%	0.632	S	S	*	*	S	Bend	trans	-139.3	118.2	173	-65.7	0	0	0	0	109
611	N	34.9	Very low	48.9	Very low	150 Å²	150	104.1 Å²	104.1	80%	0.802	66%	0.664	S	S	*	*			trans	52.2	105.4	160.1	-57.8	-6.8	0	0	0	118.8
612	N	33.2	Very low	46.3	Very low	152 Å²	152	105.7 Å²	105.7	81%	0.813	68%	0.677	S	S	*	*				-148.4	84.9	120.7	-103	-24.1	0	0	0	109.6	T614	N612-T614 PolarHBondContact O-N 3.42Å; N612-T614 VanDerWaalsContact O-N 3.15Å; N612-T614 PolarHBondContact OD1-OG1 3.43Å
613	N	39.7	Very low	43.5	Very low	174 Å²	174	110.9 Å²	110.9	93%	0.93	71%	0.713	S	S	*	*			trans	-82.7	72.8	161.8	-163.2	29	0	0	0	107.3
614	T	34.4	Very low	40.7	Very low	91 Å²	91	114 Å²	114	56%	0.558	75%	0.746	S	S	*	*			trans	-129.2	111.3	-177.6	-52.6	0	0	0	0	109.2	N612 S616	N612-T614 PolarHBondContact O-N 3.42Å; N612-T614 VanDerWaalsContact O-N 3.15Å; N612-T614 PolarHBondContact OD1-OG1 3.43Å; T614-S616 PolarHBondContact O-N 2.98Å
615	T	44.3	Very low	38	Very low	147 Å²	147	118.1 Å²	118.1	90%	0.902	77%	0.77	S	S	*	*			trans	-68.5	106.9	170.5	44.4	0	0	0	0	110.4
616	S	34.1	Very low	36.6	Very low	102 Å²	102	122 Å²	122	71%	0.713	79%	0.788	S	S	*	*			trans	-146.9	120.1	165.3	59.3	0	0	0	0	111.5	T614	T614-S616 PolarHBondContact O-N 2.98Å
617	I	39.6	Very low	36.3	Very low	184 Å²	184	122.6 Å²	122.6	94%	0.944	79%	0.792	S	S	*	*			trans	-70	133.4	171	-66.7	160.7	0	0	0	108.7
618	G	33.3	Very low	37.3	Very low	60 Å²	60	126.3 Å²	126.3	62%	0.619	80%	0.795	S	S	*	*			trans	157.6	97.5	171	0	0	0	0	0	117.1
619	T	33.7	Very low	39.1	Very low	135 Å²	135	125 Å²	125	83%	0.828	79%	0.791	S	S	*	*			trans	38.8	117.6	138.1	-16	0	0	0	0	122.2
620	S	39.8	Very low	41.4	Very low	116 Å²	116	121.3 Å²	121.3	81%	0.811	76%	0.761	S	S	*	*			trans	50.1	113.2	145	64.1	0	0	0	0	121.1
621	G	29.5	Very low	44.2	Very low	69 Å²	69	118.2 Å²	118.2	71%	0.711	74%	0.739	S	S	*	*			trans	176.6	78.2	165.7	0	0	0	0	0	115.8	T623	G621-T623 PolarHBondContact O-N 3.23Å
622	N	37.9	Very low	47	Very low	173 Å²	173	113.5 Å²	113.5	93%	0.925	71%	0.714	S	S	*	*			trans	26.4	79.8	156.1	-136.4	40.7	0	0	0	117.9	G624	N622-G624 PolarHBondContact O-N 3.22Å
623	T	35.4	Very low	49.9	Very low	141 Å²	141	110.4 Å²	110.4	87%	0.865	70%	0.698	S	S	*	*			trans	-79.7	113	170.5	42	0	0	0	0	111.1	G621	G621-T623 PolarHBondContact O-N 3.23Å
624	G	33.1	Very low	52.6	Low	69 Å²	69	102.1 Å²	102.1	71%	0.711	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60.2	139.8	170.6	0	0	0	0	0	111.2	N622	N622-G624 PolarHBondContact O-N 3.22Å
625	T	29.3	Very low	55.5	Low	132 Å²	132	97.9 Å²	97.9	81%	0.81	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-54.8	129.7	175.7	42.3	0	0	0	0	110.6	S627	T625-S627 PolarHBondContact O-N 3.46Å
626	P	40.8	Very low	58.1	Low	124 Å²	124	91.6 Å²	91.6	81%	0.805	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-62.3	127.5	178.6	25.5	-33.3	0	0	0	109.8	K628	P626-K628 PolarHBondContact O-N 3.33Å
627	S	47.5	Very low	61.1	Low	106 Å²	106	87.1 Å²	87.1	74%	0.741	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-53.8	125.4	175.4	-47.7	0	0	0	0	109.5	T625 A629	T625-S627 PolarHBondContact O-N 3.46Å; S627-A629 PolarHBondContact O-N 3.27Å
628	K	57.5	Low	63.9	Low	183 Å²	183	78.4 Å²	78.4	80%	0.796	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-58.7	125.1	178.3	-173.7	179.1	179.3	-177.6	0	108.4	P626 M630	P626-K628 PolarHBondContact O-N 3.33Å; K628-M630 PolarHBondContact O-N 3.15Å
629	A	73.7	Confident	67	Low	90 Å²	90	75.5 Å²	75.5	74%	0.744	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-56.1	132	179.4	0	0	0	0	0	110	S627	S627-A629 PolarHBondContact O-N 3.27Å
630	M	83.8	Confident	70.1	Confident	44 Å²	44	70.7 Å²	70.7	22%	0.217	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-58.9	145.8	176.3	-63.2	-71.5	95.2	0	0	110	D568 R602 K628 T634 V635	D568-M630 HydrophobicContact CB-CE 4.4Å; D568-M630 WeakPolarHBondContact OD1-CA 3.38Å; R602-M630 PolarHBondContact NH2-SD 3.44Å; K628-M630 PolarHBondContact O-N 3.15Å; M630-T634 HydrophobicContact CB-CG2 4.44Å; M630-T634 HydrophobicContact SD-CG2 4.26Å; M630-V635 HydrophobicContact CB-CG2 4.22Å
631	S	92.1	Very high	72.9	Confident	40 Å²	40	65.2 Å²	65.2	28%	0.28	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-69.5	154.2	178.3	66.4	0	0	0	0	111.9	D568 D633 T634 V635	D568-S631 PolarHBondContact OD1-N 2.97Å; D568-S631 PolarHBondContact OD1-OG 3.44Å; D568-S631 WeakPolarHBondContact OD2-CB 3.31Å; D568-S631 PolarHBondContact OD2-OG 3.44Å; S631-D633 PolarHBondContact O-N 3.05Å; S631-T634 WeakPolarHBondContact O-CB 3.37Å; S631-T634 PolarHBondContact O-N 2.9Å; S631-T634 PolarHBondContact OG-N 3.4Å; S631-T634 PolarHBondContact OG-OG1 2.97Å; S631-T634 VanDerWaalsContact OG-OG1 3.05Å; S631-V635 WeakPolarHBondContact O-CG2 3.23Å; S631-V635 PolarHBondContact O-N 2.66Å
632	D	93.4	Very high	76.2	Confident	52 Å²	52	61.9 Å²	61.9	28%	0.278	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-27.1	175.3	-94.1	13.6	0	0	0	112.6	T636 H676 S677 V680	D632-T636 VanDerWaalsContact O-CB 3.26Å; D632-T636 WeakPolarHBondContact O-CB 3.4Å; D632-T636 PolarHBondContact O-N 2.95Å; D632-T636 PolarHBondContact O-OG1 3.24Å; D632-H676 IonicContact OD1-ND1 2.77Å; D632-S677 WeakPolarHBondContact OD2-CA 3.38Å; D632-S677 WeakPolarHBondContact OD2-CB 3.49Å; D632-S677 PolarHBondContact OD2-N 3.49Å; D632-S677 PolarHBondContact OD2-OG 2.75Å; D632-V680 HydrophobicContact CB-CG2 3.62Å; D632-V680 WeakPolarHBondContact O-CG2 3.19Å
633	D	95	Very high	79.1	Confident	87 Å²	87	55.6 Å²	55.6	47%	0.465	35%	0.348	S	S	.	.	H	α-helix	trans	-69.8	-44.4	172.5	-77.4	-38.4	0	0	0	112	S631 T636 A637 K679	S631-D633 PolarHBondContact O-N 3.05Å; D633-T636 PolarHBondContact O-N 3.02Å; D633-A637 WeakPolarHBondContact O-CB 3.48Å; D633-A637 PolarHBondContact O-N 3.49Å; D633-K679 IonicContact OD1-NZ 3.91Å; D633-K679 PolarHBondContact OD1-NZ 3.49Å
634	T	96.6	Very high	82.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-46.4	173.5	-57.7	0	0	0	0	111.7	D568 V571 C572 M630 S631 T636 A637 I638	D568-T634 PolarHBondContact O-OG1 2.89Å; D568-T634 VanDerWaalsContact OD1-CB 3.23Å; D568-T634 WeakPolarHBondContact OD1-CB 3.3Å; D568-T634 PolarHBondContact OD1-OG1 2.97Å; D568-T634 PolarHBondContact OD2-OG1 3.27Å; V571-T634 HydrophobicContact CB-CG2 4.3Å; V571-T634 HydrophobicContact CG1-CG2 3.82Å; C572-T634 HydrophobicContact CB-CG2 4.43Å; C572-T634 WeakPolarHBondContact CB-OG1 3.48Å; M630-T634 HydrophobicContact CB-CG2 4.44Å; M630-T634 HydrophobicContact SD-CG2 4.26Å; S631-T634 WeakPolarHBondContact O-CB 3.37Å; S631-T634 PolarHBondContact O-N 2.9Å; S631-T634 PolarHBondContact OG-N 3.4Å; S631-T634 PolarHBondContact OG-OG1 2.97Å; S631-T634 VanDerWaalsContact OG-OG1 3.05Å; T634-T636 VanDerWaalsContact C-N 3.32Å; T634-T636 PolarHBondContact O-N 2.94Å; T634-A637 PolarHBondContact O-N 3.25Å; T634-I638 HydrophobicContact CG2-CD1 3.95Å; T634-I638 WeakPolarHBondContact O-CD1 3.44Å; T634-I638 VanDerWaalsContact O-CG1 3.3Å; T634-I638 WeakPolarHBondContact O-CG1 3.21Å; T634-I638 PolarHBondContact O-N 3.27Å
635	V	96.3	Very high	85.2	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-40.9	177.2	-177.7	0	0	0	0	110.7	L603 P604 M630 S631 I638 C639 I668 V680	L603-V635 HydrophobicContact CD2-CG1 4.13Å; P604-V635 HydrophobicContact CG-CG1 4.42Å; P604-V635 HydrophobicContact CG-CG2 4.4Å; M630-V635 HydrophobicContact CB-CG2 4.22Å; S631-V635 WeakPolarHBondContact O-CG2 3.23Å; S631-V635 PolarHBondContact O-N 2.66Å; V635-I638 PolarHBondContact O-N 3.26Å; V635-C639 PolarHBondContact O-N 3.43Å; V635-C639 PolarHBondContact O-SG 3Å; V635-I668 HydrophobicContact CG1-CD1 4.26Å; V635-V680 HydrophobicContact CB-CG1 4.32Å; V635-V680 HydrophobicContact CB-CG2 4.2Å; V635-V680 HydrophobicContact CG1-CG1 3.66Å; V635-V680 HydrophobicContact CG1-CG2 4.4Å
636	T	97.2	Very high	88.4	Confident	14 Å²	14	41.2 Å²	41.2	9%	0.086	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-45	173.9	-60	0	0	0	0	111.6	D632 D633 T634 I638 C639 C640 K679 V680 A683	D632-T636 VanDerWaalsContact O-CB 3.26Å; D632-T636 WeakPolarHBondContact O-CB 3.4Å; D632-T636 PolarHBondContact O-N 2.95Å; D632-T636 PolarHBondContact O-OG1 3.24Å; D633-T636 PolarHBondContact O-N 3.02Å; T634-T636 VanDerWaalsContact C-N 3.32Å; T634-T636 PolarHBondContact O-N 2.94Å; T636-I638 PolarHBondContact O-N 2.97Å; T636-C639 PolarHBondContact O-N 3.02Å; T636-C640 WeakPolarHBondContact O-CB 3.31Å; T636-C640 PolarHBondContact O-N 2.61Å; T636-C640 PolarHBondContact O-SG 2.91Å; T636-K679 HydrophobicContact CG2-CD 4.45Å; T636-K679 HydrophobicContact CG2-CG 4.07Å; T636-V680 WeakPolarHBondContact OG1-CG2 3.5Å; T636-A683 HydrophobicContact CG2-CB 4.12Å
637	A	98.1	Very high	91.1	Very high	9 Å²	9	36.8 Å²	36.8	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-45	178.9	0	0	0	0	0	111.7	A575 T576 D633 T634 C640 A641	A575-A637 HydrophobicContact CB-CB 4.13Å; T576-A637 WeakPolarHBondContact OG1-CB 3.49Å; D633-A637 WeakPolarHBondContact O-CB 3.48Å; D633-A637 PolarHBondContact O-N 3.49Å; T634-A637 PolarHBondContact O-N 3.25Å; A637-C640 PolarHBondContact O-N 2.83Å; A637-A641 WeakPolarHBondContact O-CB 3.24Å; A637-A641 PolarHBondContact O-N 3.08Å
638	I	98.3	Very high	93.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-47.7	175.4	-64.2	160.2	0	0	0	110.8	V571 A575 L599 R602 L603 T634 V635 T636 C640 A641 L642	V571-I638 HydrophobicContact CG1-CD1 4.42Å; A575-I638 HydrophobicContact CB-CG1 4.01Å; L599-I638 HydrophobicContact CB-CG2 4.35Å; L599-I638 HydrophobicContact CD2-CG2 4.35Å; L599-I638 VanDerWaalsContact O-CG2 3.31Å; L599-I638 WeakPolarHBondContact O-CG2 3.27Å; R602-I638 HydrophobicContact CB-CD1 3.61Å; L603-I638 HydrophobicContact CD2-CB 4.06Å; L603-I638 HydrophobicContact CD2-CG2 3.55Å; L603-I638 HydrophobicContact CG-CG2 3.85Å; T634-I638 HydrophobicContact CG2-CD1 3.95Å; T634-I638 WeakPolarHBondContact O-CD1 3.44Å; T634-I638 VanDerWaalsContact O-CG1 3.3Å; T634-I638 WeakPolarHBondContact O-CG1 3.21Å; T634-I638 PolarHBondContact O-N 3.27Å; V635-I638 PolarHBondContact O-N 3.26Å; T636-I638 PolarHBondContact O-N 2.97Å; I638-C640 VanDerWaalsContact C-N 3.33Å; I638-C640 PolarHBondContact O-N 3.29Å; I638-A641 PolarHBondContact O-N 2.9Å; I638-L642 HydrophobicContact CG2-CD1 4.03Å; I638-L642 HydrophobicContact CG2-CG 4.44Å; I638-L642 WeakPolarHBondContact O-CG 3.46Å; I638-L642 PolarHBondContact O-N 3.26Å
639	C	98.3	Very high	95.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-40.3	176	-74.1	0	0	0	0	112.4	V635 T636 H643 A683 V687	V635-C639 PolarHBondContact O-N 3.43Å; V635-C639 PolarHBondContact O-SG 3Å; T636-C639 PolarHBondContact O-N 3.02Å; C639-H643 WeakPolarHBondContact O-CB 3.14Å; C639-H643 PolarHBondContact O-N 2.94Å; C639-A683 HydrophobicContact CB-CB 3.65Å; C639-V687 HydrophobicContact CB-CG2 4.33Å; C639-V687 WeakPolarHBondContact O-CG2 3.44Å
640	C	98.4	Very high	96.3	Very high	34 Å²	34	32.2 Å²	32.2	23%	0.23	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-35.2	176.1	-69.4	0	0	0	0	112.7	T636 A637 I638 E644	T636-C640 WeakPolarHBondContact O-CB 3.31Å; T636-C640 PolarHBondContact O-N 2.61Å; T636-C640 PolarHBondContact O-SG 2.91Å; A637-C640 PolarHBondContact O-N 2.83Å; I638-C640 VanDerWaalsContact C-N 3.33Å; I638-C640 PolarHBondContact O-N 3.29Å; C640-E644 PolarHBondContact O-N 3.18Å; C640-E644 VanDerWaalsContact O-N 3.08Å
641	A	98.6	Very high	97	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-49.8	172.7	0	0	0	0	0	111.3	A575 R579 L599 A637 I638 H643 E644 V645	A575-A641 WeakPolarHBondContact O-CB 3.37Å; R579-A641 HydrophobicContact CB-CB 3.98Å; L599-A641 HydrophobicContact CD2-CB 4.38Å; A637-A641 WeakPolarHBondContact O-CB 3.24Å; A637-A641 PolarHBondContact O-N 3.08Å; I638-A641 PolarHBondContact O-N 2.9Å; A641-H643 VanDerWaalsContact C-N 3.33Å; A641-H643 PolarHBondContact O-N 2.84Å; A641-E644 PolarHBondContact O-N 3.34Å; A641-V645 WeakPolarHBondContact O-CB 2.99Å; A641-V645 VanDerWaalsContact O-CG2 3.24Å; A641-V645 WeakPolarHBondContact O-CG2 3.29Å; A641-V645 PolarHBondContact O-N 3.22Å
642	L	98.6	Very high	97.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.7	-46	174.8	-71.6	170.5	0	0	0	111.5	M596 L599 I600 L603 I638 E644 V645 I646 L656 V687	M596-L642 HydrophobicContact SD-CD2 3.55Å; M596-L642 VanDerWaalsContact SD-CD2 3.55Å; L599-L642 HydrophobicContact CB-CD2 3.86Å; L599-L642 HydrophobicContact CB-CG 4.3Å; L599-L642 HydrophobicContact CD1-CD2 4.07Å; I600-L642 HydrophobicContact CG1-CD1 4.37Å; I600-L642 HydrophobicContact CG1-CD2 4.16Å; L603-L642 HydrophobicContact CD1-CD1 3.73Å; L603-L642 HydrophobicContact CG-CD1 4.35Å; I638-L642 HydrophobicContact CG2-CD1 4.03Å; I638-L642 HydrophobicContact CG2-CG 4.44Å; I638-L642 WeakPolarHBondContact O-CG 3.46Å; I638-L642 PolarHBondContact O-N 3.26Å; L642-E644 PolarHBondContact O-N 3.22Å; L642-V645 PolarHBondContact O-N 2.8Å; L642-I646 WeakPolarHBondContact O-CG1 3.19Å; L642-I646 PolarHBondContact O-N 3.37Å; L642-L656 HydrophobicContact CB-CD1 4.32Å; L642-L656 HydrophobicContact CD2-CD1 4.22Å; L642-V687 HydrophobicContact CB-CG1 4.41Å; L642-V687 HydrophobicContact CB-CG2 4.31Å
643	H	98.5	Very high	97.4	Very high	40 Å²	40	31.4 Å²	31.4	19%	0.185	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-48.3	176.9	-179.7	-97.2	0	0	0	112	C639 A641 I646 T647 Q686 V687 S690	C639-H643 WeakPolarHBondContact O-CB 3.14Å; C639-H643 PolarHBondContact O-N 2.94Å; A641-H643 VanDerWaalsContact C-N 3.33Å; A641-H643 PolarHBondContact O-N 2.84Å; H643-I646 WeakPolarHBondContact O-CG1 3.42Å; H643-I646 PolarHBondContact O-N 2.98Å; H643-T647 PolarHBondContact CE1-OG1 3.48Å; H643-T647 VanDerWaalsContact O-CB 3.31Å; H643-T647 WeakPolarHBondContact O-CB 3.32Å; H643-T647 PolarHBondContact O-N 3.49Å; H643-T647 PolarHBondContact O-OG1 3Å; H643-Q686 PolarHBondContact CD2-O 3.21Å; H643-Q686 PolarHBondContact NE2-NE2 3.45Å; H643-V687 HydrophobicContact CB-CG2 3.93Å; H643-S690 PolarHBondContact CD2-OG 3.27Å; H643-S690 PolarHBondContact NE2-OG 3.28Å
644	E	98.4	Very high	97.5	Very high	40 Å²	40	30.7 Å²	30.7	19%	0.187	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-43.6	178.9	-171.6	54.1	-124.8	0	0	111.1	R579 A582 L583 K588 C640 A641 L642 I646 T647	R579-E644 HydrophobicContact CG-CB 4.01Å; R579-E644 HydrophobicContact CG-CG 4.46Å; A582-E644 HydrophobicContact CB-CG 4.05Å; L583-E644 HydrophobicContact CD2-CG 4.38Å; K588-E644 VanDerWaalsContact CE-O 3.29Å; K588-E644 WeakPolarHBondContact CE-O 3.36Å; K588-E644 PolarHBondContact NZ-O 3.09Å; K588-E644 IonicContact NZ-OE1 3.74Å; K588-E644 PolarHBondContact NZ-OE1 3.37Å; C640-E644 PolarHBondContact O-N 3.18Å; C640-E644 VanDerWaalsContact O-N 3.08Å; A641-E644 PolarHBondContact O-N 3.34Å; L642-E644 PolarHBondContact O-N 3.22Å; E644-I646 VanDerWaalsContact C-N 3.32Å; E644-I646 PolarHBondContact O-N 3.1Å; E644-T647 PolarHBondContact O-N 2.8Å; E644-T647 VanDerWaalsContact O-N 3.08Å
645	V	98.2	Very high	97.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-39	179.7	171.2	0	0	0	0	112.3	A582 K588 I591 M596 A641 L642 N652	A582-V645 HydrophobicContact CB-CG2 3.94Å; K588-V645 WeakPolarHBondContact CD-O 3.3Å; K588-V645 VanDerWaalsContact CG-O 3.31Å; K588-V645 WeakPolarHBondContact CG-O 3.43Å; I591-V645 HydrophobicContact CB-CG2 4.33Å; I591-V645 HydrophobicContact CG2-CG1 4.37Å; I591-V645 HydrophobicContact CG2-CG2 3.51Å; M596-V645 HydrophobicContact CE-CG1 3.72Å; A641-V645 WeakPolarHBondContact O-CB 2.99Å; A641-V645 VanDerWaalsContact O-CG2 3.24Å; A641-V645 WeakPolarHBondContact O-CG2 3.29Å; A641-V645 PolarHBondContact O-N 3.22Å; L642-V645 PolarHBondContact O-N 2.8Å; V645-N652 HydrophobicContact CG1-CB 4.2Å; V645-N652 WeakPolarHBondContact O-CB 3.27Å; V645-N652 PolarHBondContact O-ND2 3.22Å
646	I	98.1	Very high	97.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-85	-12.3	176	72	168.7	0	0	0	114.1	M596 L642 H643 E644 K648 N649 N652 A653 L656 V687 M691 Y694	M596-I646 HydrophobicContact CE-CG2 4.26Å; L642-I646 WeakPolarHBondContact O-CG1 3.19Å; L642-I646 PolarHBondContact O-N 3.37Å; H643-I646 WeakPolarHBondContact O-CG1 3.42Å; H643-I646 PolarHBondContact O-N 2.98Å; E644-I646 VanDerWaalsContact C-N 3.32Å; E644-I646 PolarHBondContact O-N 3.1Å; I646-K648 PolarHBondContact O-N 3.31Å; I646-N649 PolarHBondContact O-N 3.04Å; I646-N652 HydrophobicContact CG2-CB 4.39Å; I646-A653 HydrophobicContact CB-CB 4.17Å; I646-A653 HydrophobicContact CG2-CB 4.35Å; I646-L656 HydrophobicContact CD1-CD1 4.4Å; I646-L656 HydrophobicContact CG2-CB 4.25Å; I646-L656 HydrophobicContact CG2-CD1 3.65Å; I646-V687 HydrophobicContact CD1-CG1 3.77Å; I646-M691 HydrophobicContact CD1-CG 3.5Å; I646-Y694 PolarHBondContact O-OH 3.03Å
647	T	96.9	Very high	97.6	Very high	31 Å²	31	33.5 Å²	33.5	19%	0.19	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	119.9	-174.8	-73.6	0	0	0	0	110.8	K588 H643 E644 N649	K588-T647 PolarHBondContact NZ-O 3.35Å; H643-T647 PolarHBondContact CE1-OG1 3.48Å; H643-T647 VanDerWaalsContact O-CB 3.31Å; H643-T647 WeakPolarHBondContact O-CB 3.32Å; H643-T647 PolarHBondContact O-N 3.49Å; H643-T647 PolarHBondContact O-OG1 3Å; E644-T647 PolarHBondContact O-N 2.8Å; E644-T647 VanDerWaalsContact O-N 3.08Å; T647-N649 PolarHBondContact O-N 3.11Å
648	K	94.6	Very high	97.5	Very high	197 Å²	197	37.6 Å²	37.6	86%	0.857	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	23.2	-173.2	-55	179.1	-178.5	-179.4	0	114.5	I646 Y694	I646-K648 PolarHBondContact O-N 3.31Å; K648-Y694 WeakPolarHBondContact CA-OH 3.44Å; K648-Y694 PolarHBondContact N-OH 3.44Å
649	N	96.9	Very high	97.4	Very high	25 Å²	25	39.8 Å²	39.8	13%	0.134	20%	0.199	C	C	.	.			trans	-135.5	105.8	173.6	-171.4	-43.2	0	0	0	110.5	K588 I646 T647 E651 N652 A653 Y694	K588-N649 HydrophobicContact CD-CB 4.17Å; I646-N649 PolarHBondContact O-N 3.04Å; T647-N649 PolarHBondContact O-N 3.11Å; N649-E651 PolarHBondContact OD1-N 3.37Å; N649-N652 HydrophobicContact CB-CB 4.08Å; N649-N652 VanDerWaalsContact CG-CG 3.44Å; N649-N652 WeakPolarHBondContact OD1-CB 3.22Å; N649-N652 PolarHBondContact OD1-N 3.29Å; N649-A653 PolarHBondContact O-N 3.2Å; N649-Y694 PolarHBondContact N-OH 3.39Å
650	M	96.6	Very high	97.2	Very high	61 Å²	61	41.6 Å²	41.6	30%	0.3	22%	0.218	S	C	.	.	H	α-helix	trans	-73.7	-36.6	-176.2	-173.9	172.5	67.5	0	0	113	N652 A653 K654 Y694 D696 L697	M650-N652 VanDerWaalsContact C-N 3.27Å; M650-N652 PolarHBondContact O-N 2.92Å; M650-A653 WeakPolarHBondContact O-CB 3.46Å; M650-A653 PolarHBondContact O-N 2.82Å; M650-A653 VanDerWaalsContact O-N 3.14Å; M650-K654 PolarHBondContact O-N 2.87Å; M650-Y694 HydrophobicContact CB-CD1 3.8Å; M650-Y694 HydrophobicContact CB-CE1 3.9Å; M650-Y694 HydrophobicContact CB-CG 4.41Å; M650-Y694 HydrophobicContact CG-CD1 3.86Å; M650-Y694 HydrophobicContact CG-CE1 4.46Å; M650-Y694 HydrophobicContact CG-CG 4.1Å; M650-Y694 HydrophobicContact SD-CD1 4.28Å; M650-D696 HydrophobicContact SD-CB 3.95Å; M650-L697 HydrophobicContact CG-CD1 3.74Å; M650-L697 HydrophobicContact CG-CD2 4.06Å; M650-L697 HydrophobicContact CG-CG 3.79Å; M650-L697 HydrophobicContact SD-CD2 4.38Å; M650-L697 HydrophobicContact SD-CG 4.14Å
651	E	96.9	Very high	97.1	Very high	111 Å²	111	40 Å²	40	52%	0.519	21%	0.207	S	C	.	.	H	α-helix	trans	-64.5	-35.5	176.8	-66.8	-56.3	145.6	0	0	111	N649 K654 A655	N649-E651 PolarHBondContact OD1-N 3.37Å; E651-K654 WeakPolarHBondContact O-CB 3.28Å; E651-K654 PolarHBondContact O-N 3.05Å; E651-K654 IonicContact OE2-NZ 3.38Å; E651-K654 PolarHBondContact OE2-NZ 2.89Å; E651-A655 WeakPolarHBondContact O-CB 3.42Å; E651-A655 PolarHBondContact O-N 3.16Å
652	N	97.8	Very high	97	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.043	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-38.2	172.1	-72.2	0.4	0	0	0	112.5	K588 G592 M596 V645 I646 N649 M650 K654 A655 L656	K588-N652 PolarHBondContact O-ND2 3.12Å; G592-N652 WeakPolarHBondContact CA-OD1 3.35Å; M596-N652 HydrophobicContact CE-CB 4.33Å; M596-N652 VanDerWaalsContact CE-O 3.27Å; M596-N652 WeakPolarHBondContact CE-O 3.41Å; V645-N652 HydrophobicContact CG1-CB 4.2Å; V645-N652 WeakPolarHBondContact O-CB 3.27Å; V645-N652 PolarHBondContact O-ND2 3.22Å; I646-N652 HydrophobicContact CG2-CB 4.39Å; N649-N652 HydrophobicContact CB-CB 4.08Å; N649-N652 VanDerWaalsContact CG-CG 3.44Å; N649-N652 WeakPolarHBondContact OD1-CB 3.22Å; N649-N652 PolarHBondContact OD1-N 3.29Å; M650-N652 VanDerWaalsContact C-N 3.27Å; M650-N652 PolarHBondContact O-N 2.92Å; N652-K654 VanDerWaalsContact C-N 3.29Å; N652-K654 PolarHBondContact O-N 3.27Å; N652-A655 PolarHBondContact O-N 2.7Å; N652-L656 PolarHBondContact O-N 3.23Å
653	A	97.8	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-36.1	173.6	0	0	0	0	0	112.1	I646 N649 M650 R657 M691 Y694 L697	I646-A653 HydrophobicContact CB-CB 4.17Å; I646-A653 HydrophobicContact CG2-CB 4.35Å; N649-A653 PolarHBondContact O-N 3.2Å; M650-A653 WeakPolarHBondContact O-CB 3.46Å; M650-A653 PolarHBondContact O-N 2.82Å; M650-A653 VanDerWaalsContact O-N 3.14Å; A653-R657 PolarHBondContact O-N 2.86Å; A653-M691 WeakPolarHBondContact O-CE 3.45Å; A653-Y694 HydrophobicContact CB-CD2 3.66Å; A653-Y694 HydrophobicContact CB-CE2 3.62Å; A653-L697 HydrophobicContact CB-CD1 3.72Å
654	K	96.9	Very high	96.5	Very high	71 Å²	71	46.1 Å²	46.1	31%	0.309	24%	0.235	S	C	.	.	H	α-helix	trans	-68.8	-43.3	171.7	179.9	-178.8	159	-156.9	0	112.1	M650 E651 N652 L656 R657 D658 L697	M650-K654 PolarHBondContact O-N 2.87Å; E651-K654 WeakPolarHBondContact O-CB 3.28Å; E651-K654 PolarHBondContact O-N 3.05Å; E651-K654 IonicContact OE2-NZ 3.38Å; E651-K654 PolarHBondContact OE2-NZ 2.89Å; N652-K654 VanDerWaalsContact C-N 3.29Å; N652-K654 PolarHBondContact O-N 3.27Å; K654-L656 VanDerWaalsContact C-N 3.26Å; K654-L656 PolarHBondContact O-N 2.99Å; K654-R657 VanDerWaalsContact O-CB 3.31Å; K654-R657 WeakPolarHBondContact O-CB 3.42Å; K654-R657 PolarHBondContact O-N 3.48Å; K654-R657 VanDerWaalsContact O-N 3.15Å; K654-D658 WeakPolarHBondContact O-CB 3.41Å; K654-D658 PolarHBondContact O-N 2.79Å; K654-L697 HydrophobicContact CB-CD1 4.34Å; K654-L697 HydrophobicContact CB-CD2 4.05Å; K654-L697 HydrophobicContact CD-CD2 4.46Å; K654-L697 HydrophobicContact CG-CD2 4.47Å
655	A	97.6	Very high	96.4	Very high	26 Å²	26	44.2 Å²	44.2	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-34.4	174.5	0	0	0	0	0	112.8	M596 E651 N652 D658 S659	M596-A655 HydrophobicContact CE-CB 4.46Å; M596-A655 HydrophobicContact CG-CB 4.32Å; E651-A655 WeakPolarHBondContact O-CB 3.42Å; E651-A655 PolarHBondContact O-N 3.16Å; N652-A655 PolarHBondContact O-N 2.7Å; A655-D658 PolarHBondContact O-N 2.96Å; A655-S659 VanDerWaalsContact O-CB 3.29Å; A655-S659 WeakPolarHBondContact O-CB 3.49Å; A655-S659 PolarHBondContact O-N 3.47Å; A655-S659 PolarHBondContact O-OG 3.37Å
656	L	97.9	Very high	96.2	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-48.1	173.6	-165.5	164.8	0	0	0	111.1	M596 I600 L642 I646 N652 K654 S659 G661 L665 V687 M691	M596-L656 HydrophobicContact CE-CB 4.02Å; M596-L656 HydrophobicContact CG-CB 4.41Å; M596-L656 HydrophobicContact SD-CB 3.59Å; M596-L656 VanDerWaalsContact SD-CB 3.59Å; M596-L656 HydrophobicContact SD-CD1 4.24Å; M596-L656 HydrophobicContact SD-CG 3.81Å; I600-L656 HydrophobicContact CD1-CD2 4.42Å; I600-L656 HydrophobicContact CD1-CG 4.05Å; L642-L656 HydrophobicContact CB-CD1 4.32Å; L642-L656 HydrophobicContact CD2-CD1 4.22Å; I646-L656 HydrophobicContact CD1-CD1 4.4Å; I646-L656 HydrophobicContact CG2-CB 4.25Å; I646-L656 HydrophobicContact CG2-CD1 3.65Å; N652-L656 PolarHBondContact O-N 3.23Å; K654-L656 VanDerWaalsContact C-N 3.26Å; K654-L656 PolarHBondContact O-N 2.99Å; L656-S659 PolarHBondContact O-N 3.41Å; L656-G661 PolarHBondContact O-N 3.33Å; L656-L665 HydrophobicContact CD1-CD1 4.45Å; L656-L665 HydrophobicContact CD2-CD1 3.92Å; L656-V687 HydrophobicContact CD1-CG1 3.78Å; L656-M691 HydrophobicContact CB-CE 4.43Å; L656-M691 HydrophobicContact CD1-SD 4.23Å; L656-M691 HydrophobicContact CD2-CE 3.94Å; L656-M691 HydrophobicContact CD2-SD 3.71Å; L656-M691 HydrophobicContact CG-SD 4.47Å
657	R	96.7	Very high	95.9	Very high	50 Å²	50	46.4 Å²	46.4	19%	0.189	25%	0.245	C	C	.	.	H	α-helix	trans	-54.6	-54.3	172.1	168.6	-158.3	173.5	-100.2	-7.4	110.9	A653 K654 S659 G660 I662 M691 Y701 D704	A653-R657 PolarHBondContact O-N 2.86Å; K654-R657 VanDerWaalsContact O-CB 3.31Å; K654-R657 WeakPolarHBondContact O-CB 3.42Å; K654-R657 PolarHBondContact O-N 3.48Å; K654-R657 VanDerWaalsContact O-N 3.15Å; R657-S659 PolarHBondContact O-N 3.3Å; R657-G660 PolarHBondContact O-N 3.01Å; R657-I662 HydrophobicContact CB-CD1 3.73Å; R657-I662 HydrophobicContact CB-CG1 4.47Å; R657-I662 HydrophobicContact CG-CD1 3.79Å; R657-M691 HydrophobicContact CB-CE 4.3Å; R657-Y701 HydrophobicContact CB-CE1 4.3Å; R657-Y701 HydrophobicContact CG-CD1 4.48Å; R657-Y701 HydrophobicContact CG-CE1 4.41Å; R657-D704 IonicContact CZ-OD1 3.21Å; R657-D704 IonicContact CZ-OD2 3.52Å; R657-D704 IonicContact NE-OD1 2.68Å; R657-D704 IonicContact NE-OD2 3.29Å; R657-D704 PolarHBondContact NE-OD2 3.39Å; R657-D704 IonicContact NH2-OD1 2.97Å; R657-D704 PolarHBondContact NH2-OD1 3.27Å; R657-D704 IonicContact NH2-OD2 2.7Å; R657-D704 PolarHBondContact NH2-OD2 2.99Å
658	D	95.8	Very high	95.7	Very high	94 Å²	94	45 Å²	45	50%	0.503	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-24.3	-173.3	-62.5	-7.5	0	0	0	112	K654 A655 G660	K654-D658 WeakPolarHBondContact O-CB 3.41Å; K654-D658 PolarHBondContact O-N 2.79Å; A655-D658 PolarHBondContact O-N 2.96Å; D658-G660 VanDerWaalsContact C-N 3.33Å
659	S	95.8	Very high	95.5	Very high	46 Å²	46	36.7 Å²	36.7	32%	0.322	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	8	173.6	-57.4	0	0	0	0	114.2	I600 A655 L656 R657 G661	I600-S659 VanDerWaalsContact CD1-CB 3.41Å; A655-S659 VanDerWaalsContact O-CB 3.29Å; A655-S659 WeakPolarHBondContact O-CB 3.49Å; A655-S659 PolarHBondContact O-N 3.47Å; A655-S659 PolarHBondContact O-OG 3.37Å; L656-S659 PolarHBondContact O-N 3.41Å; R657-S659 PolarHBondContact O-N 3.3Å; S659-G661 VanDerWaalsContact C-N 3.34Å; S659-G661 PolarHBondContact O-N 3.45Å
660	G	94.5	Very high	95.1	Very high	38 Å²	38	41.3 Å²	41.3	39%	0.392	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	12.1	178.8	0	0	0	0	0	115.4	R657 D658 I662	R657-G660 PolarHBondContact O-N 3.01Å; D658-G660 VanDerWaalsContact C-N 3.33Å; G660-I662 VanDerWaalsContact C-N 3.3Å; G660-I662 PolarHBondContact O-N 3.14Å
661	G	96	Very high	94.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.5	-23.9	-172.2	0	0	0	0	0	115	L656 S659 E663 L665	L656-G661 PolarHBondContact O-N 3.33Å; S659-G661 VanDerWaalsContact C-N 3.34Å; S659-G661 PolarHBondContact O-N 3.45Å; G661-E663 PolarHBondContact O-N 3.19Å; G661-L665 WeakPolarHBondContact O-CB 3.48Å; G661-L665 WeakPolarHBondContact O-CD1 3.36Å; G661-L665 WeakPolarHBondContact O-CG 3.27Å; G661-L665 PolarHBondContact O-N 3.25Å
662	I	95.8	Very high	93.2	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-48	179.8	-64.9	169.3	0	0	0	111	R657 G660 L665 I666 L688 M691 Y701 Y706 F711	R657-I662 HydrophobicContact CB-CD1 3.73Å; R657-I662 HydrophobicContact CB-CG1 4.47Å; R657-I662 HydrophobicContact CG-CD1 3.79Å; G660-I662 VanDerWaalsContact C-N 3.3Å; G660-I662 PolarHBondContact O-N 3.14Å; I662-L665 PolarHBondContact O-N 3.38Å; I662-I666 HydrophobicContact CG2-CD1 3.54Å; I662-I666 HydrophobicContact CG2-CG1 4.31Å; I662-I666 VanDerWaalsContact O-CG1 3.25Å; I662-I666 WeakPolarHBondContact O-CG1 3.35Å; I662-I666 PolarHBondContact O-N 3.49Å; I662-L688 HydrophobicContact CG2-CD2 4.42Å; I662-M691 HydrophobicContact CD1-CE 3.78Å; I662-M691 HydrophobicContact CG1-CE 3.57Å; I662-M691 HydrophobicContact CG1-SD 4.03Å; I662-Y701 HydrophobicContact CD1-CD1 3.91Å; I662-Y701 HydrophobicContact CD1-CE1 3.98Å; I662-Y706 HydrophobicContact CB-CE2 4.17Å; I662-Y706 HydrophobicContact CD1-CD2 4.32Å; I662-Y706 HydrophobicContact CD1-CE2 4.3Å; I662-Y706 HydrophobicContact CG2-CD1 3.97Å; I662-Y706 HydrophobicContact CG2-CD2 3.95Å; I662-Y706 HydrophobicContact CG2-CE1 3.73Å; I662-Y706 HydrophobicContact CG2-CE2 3.73Å; I662-Y706 HydrophobicContact CG2-CG 4.08Å; I662-F711 HydrophobicContact CD1-CE1 4.19Å; I662-F711 HydrophobicContact CD1-CZ 4.04Å; I662-F711 HydrophobicContact CG1-CE1 4.24Å; I662-F711 HydrophobicContact CG1-CZ 4.5Å; I662-F711 HydrophobicContact CG2-CE1 4.14Å; I662-F711 HydrophobicContact CG2-CZ 4.09Å
663	E	94.2	Very high	91.5	Very high	123 Å²	123	45.6 Å²	45.6	58%	0.575	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-49.3	-177.7	-172	-174	168.8	0	0	111.5	G661 L665 I666 G667	G661-E663 PolarHBondContact O-N 3.19Å; E663-L665 PolarHBondContact O-N 3.46Å; E663-I666 PolarHBondContact O-N 3.42Å; E663-G667 PolarHBondContact O-N 3.43Å
664	K	94.3	Very high	89.9	Confident	43 Å²	43	53.5 Å²	53.5	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.8	-69.7	-161.8	176.1	-166.8	0	112	I600 H601 L603 I666 G667 I668	I600-K664 HydrophobicContact CG2-CD 4.15Å; I600-K664 WeakPolarHBondContact O-CD 3.47Å; I600-K664 WeakPolarHBondContact O-CE 3.27Å; I600-K664 PolarHBondContact O-NZ 3.35Å; H601-K664 PolarHBondContact O-NZ 3.31Å; L603-K664 HydrophobicContact CB-CB 4.43Å; L603-K664 HydrophobicContact CB-CD 3.87Å; L603-K664 HydrophobicContact CD1-CB 4.46Å; L603-K664 PolarHBondContact O-NZ 3.2Å; K664-I666 VanDerWaalsContact C-N 3.33Å; K664-I666 PolarHBondContact O-N 3.35Å; K664-G667 PolarHBondContact O-N 3.22Å; K664-I668 WeakPolarHBondContact O-CG1 3.18Å; K664-I668 PolarHBondContact O-N 3.18Å
665	L	95.5	Very high	89.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-36.8	179.4	-71.1	166.7	0	0	0	112.2	L603 L656 G661 I662 E663 I668 A669 A684 V687 L688	L603-L665 HydrophobicContact CD1-CD2 3.82Å; L603-L665 HydrophobicContact CD1-CG 4.1Å; L656-L665 HydrophobicContact CD1-CD1 4.45Å; L656-L665 HydrophobicContact CD2-CD1 3.92Å; G661-L665 WeakPolarHBondContact O-CB 3.48Å; G661-L665 WeakPolarHBondContact O-CD1 3.36Å; G661-L665 WeakPolarHBondContact O-CG 3.27Å; G661-L665 PolarHBondContact O-N 3.25Å; I662-L665 PolarHBondContact O-N 3.38Å; E663-L665 PolarHBondContact O-N 3.46Å; L665-I668 PolarHBondContact O-N 3.43Å; L665-A669 WeakPolarHBondContact O-CB 3.46Å; L665-A669 PolarHBondContact O-N 3.14Å; L665-A684 HydrophobicContact CD2-CB 3.98Å; L665-V687 HydrophobicContact CD1-CB 4.01Å; L665-V687 HydrophobicContact CD1-CG1 3.53Å; L665-V687 HydrophobicContact CD2-CB 4.29Å; L665-V687 HydrophobicContact CD2-CG2 4.35Å; L665-L688 HydrophobicContact CB-CD1 4.09Å; L665-L688 HydrophobicContact CB-CD2 3.92Å; L665-L688 HydrophobicContact CB-CG 3.89Å; L665-L688 HydrophobicContact CD1-CD2 4.48Å
666	I	93.6	Very high	88.5	Confident	18 Å²	18	58.3 Å²	58.3	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-44.2	173.4	-68.7	163.7	0	0	0	110.5	I662 E663 K664 I668 A669 R670 L688 Y706 H710	I662-I666 HydrophobicContact CG2-CD1 3.54Å; I662-I666 HydrophobicContact CG2-CG1 4.31Å; I662-I666 VanDerWaalsContact O-CG1 3.25Å; I662-I666 WeakPolarHBondContact O-CG1 3.35Å; I662-I666 PolarHBondContact O-N 3.49Å; E663-I666 PolarHBondContact O-N 3.42Å; K664-I666 VanDerWaalsContact C-N 3.33Å; K664-I666 PolarHBondContact O-N 3.35Å; I666-I668 VanDerWaalsContact C-N 3.29Å; I666-I668 PolarHBondContact O-N 3.41Å; I666-A669 PolarHBondContact O-N 3.15Å; I666-R670 HydrophobicContact CG2-CG 4.19Å; I666-R670 WeakPolarHBondContact O-CB 3.46Å; I666-R670 WeakPolarHBondContact O-CG 3.19Å; I666-R670 PolarHBondContact O-N 2.94Å; I666-L688 HydrophobicContact CG1-CD1 4.08Å; I666-L688 HydrophobicContact CG1-CD2 4.13Å; I666-Y706 HydrophobicContact CD1-CD1 3.71Å; I666-Y706 HydrophobicContact CD1-CE1 3.52Å; I666-H710 HydrophobicContact CD1-CB 3.73Å; I666-H710 HydrophobicContact CG1-CB 4.33Å
667	G	91.7	Very high	88.2	Confident	30 Å²	30	60.4 Å²	60.4	31%	0.309	33%	0.331	S	S	.	.	H	α-helix	trans	-57.5	-41.6	176.7	0	0	0	0	0	112.7	E663 K664 S671	E663-G667 PolarHBondContact O-N 3.43Å; K664-G667 PolarHBondContact O-N 3.22Å; G667-S671 PolarHBondContact O-N 3.31Å
668	I	91.9	Very high	87.8	Confident	2 Å²	2	62 Å²	62	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-68.3	-52.4	174.2	-63.1	164.2	0	0	0	110.8	L603 P604 V635 K664 L665 I666 R670 S671 V680 A684	L603-I668 HydrophobicContact CB-CD1 4.28Å; L603-I668 HydrophobicContact CD1-CD1 4.45Å; L603-I668 HydrophobicContact CD2-CD1 4.03Å; L603-I668 HydrophobicContact CG-CD1 4.5Å; P604-I668 HydrophobicContact CG-CD1 3.84Å; P604-I668 HydrophobicContact CG-CG1 3.91Å; V635-I668 HydrophobicContact CG1-CD1 4.26Å; K664-I668 WeakPolarHBondContact O-CG1 3.18Å; K664-I668 PolarHBondContact O-N 3.18Å; L665-I668 PolarHBondContact O-N 3.43Å; I666-I668 VanDerWaalsContact C-N 3.29Å; I666-I668 PolarHBondContact O-N 3.41Å; I668-R670 VanDerWaalsContact C-N 3.26Å; I668-R670 PolarHBondContact O-N 3.41Å; I668-S671 VanDerWaalsContact O-CB 3.29Å; I668-S671 WeakPolarHBondContact O-CB 3.4Å; I668-S671 PolarHBondContact O-N 3.46Å; I668-S671 VanDerWaalsContact O-N 3.12Å; I668-S671 PolarHBondContact O-OG 3.02Å; I668-V680 HydrophobicContact CG2-CG1 3.42Å; I668-V680 VanDerWaalsContact CG2-CG1 3.42Å; I668-A684 HydrophobicContact CB-CB 3.97Å; I668-A684 HydrophobicContact CG2-CB 3.62Å
669	A	91.3	Very high	87.7	Confident	21 Å²	21	62.8 Å²	62.8	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-67.1	-22.9	-174.9	0	0	0	0	0	114.1	L665 I666 A684 L688	L665-A669 WeakPolarHBondContact O-CB 3.46Å; L665-A669 PolarHBondContact O-N 3.14Å; I666-A669 PolarHBondContact O-N 3.15Å; A669-A684 HydrophobicContact CB-CB 4.23Å; A669-L688 HydrophobicContact CB-CD1 3.91Å
670	R	88.2	Confident	87.6	Confident	123 Å²	123	60.6 Å²	60.6	46%	0.464	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	9.1	175.1	-62.6	-175.3	174.4	179.7	-5.8	113.4	I666 I668 H709 H710	I666-R670 HydrophobicContact CG2-CG 4.19Å; I666-R670 WeakPolarHBondContact O-CB 3.46Å; I666-R670 WeakPolarHBondContact O-CG 3.19Å; I666-R670 PolarHBondContact O-N 2.94Å; I668-R670 VanDerWaalsContact C-N 3.26Å; I668-R670 PolarHBondContact O-N 3.41Å; R670-H709 PolarHBondContact NH2-CD2 2.97Å; R670-H709 PolarHBondContact NH2-NE2 2.91Å; R670-H709 VanDerWaalsContact NH2-NE2 3.12Å; R670-H709 PolarHBondContact NH2-O 2.71Å; R670-H710 PolarHBondContact NH1-CD2 3.14Å; R670-H710 PolarHBondContact NH2-CD2 2.96Å
671	S	82.9	Confident	87.5	Confident	26 Å²	26	60.3 Å²	60.3	18%	0.182	33%	0.329	C	S	.	.			trans	-60.4	139	176.4	62.2	0	0	0	0	110.9	G667 I668	G667-S671 PolarHBondContact O-N 3.31Å; I668-S671 VanDerWaalsContact O-CB 3.29Å; I668-S671 WeakPolarHBondContact O-CB 3.4Å; I668-S671 PolarHBondContact O-N 3.46Å; I668-S671 VanDerWaalsContact O-N 3.12Å; I668-S671 PolarHBondContact O-OG 3.02Å
672	K	71.1	Confident	87.4	Confident	175 Å²	175	68 Å²	68	76%	0.761	36%	0.362	S	S	*	.			trans	-71.7	146.7	170.1	-63.8	-175.8	-179.9	-178	0	108.3	D674 K675	K672-D674 PolarHBondContact O-N 3.37Å; K672-K675 PolarHBondContact O-N 2.94Å
673	G	62.4	Low	87.4	Confident	69 Å²	69	68.4 Å²	68.4	71%	0.711	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-7.1	-159.7	0	0	0	0	0	118.3
674	D	63.8	Low	87.5	Confident	165 Å²	165	62.5 Å²	62.5	88%	0.882	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-10.4	177.9	-43.3	-56.1	0	0	0	113.4	K672	K672-D674 PolarHBondContact O-N 3.37Å
675	K	80.2	Confident	87.5	Confident	161 Å²	161	61.9 Å²	61.9	70%	0.7	34%	0.339	S	S	*	.	S	Bend	trans	-96.6	-33.3	-175.8	-72.4	-167	174.4	-168.1	0	115.2	K672	K672-K675 PolarHBondContact O-N 2.94Å
676	H	85.4	Confident	87.6	Confident	37 Å²	37	66 Å²	66	17%	0.171	36%	0.359	C	S	.	.	S	Bend	trans	-148.5	143.4	-178.9	-66.7	-52.3	0	0	0	109.7	D632 V680 V681	D632-H676 IonicContact OD1-ND1 2.77Å; H676-V680 HydrophobicContact CB-CB 4.15Å; H676-V680 HydrophobicContact CB-CG1 3.85Å; H676-V681 HydrophobicContact CB-CG2 4.26Å
677	S	90.3	Very high	87.8	Confident	44 Å²	44	65.1 Å²	65.1	31%	0.308	35%	0.354	S	S	.	.			trans	-64.8	158.3	174.5	63.5	0	0	0	0	112.8	D632 K679 V680 V681	D632-S677 WeakPolarHBondContact OD2-CA 3.38Å; D632-S677 WeakPolarHBondContact OD2-CB 3.49Å; D632-S677 PolarHBondContact OD2-N 3.49Å; D632-S677 PolarHBondContact OD2-OG 2.75Å; S677-K679 PolarHBondContact O-N 3.27Å; S677-K679 VanDerWaalsContact O-N 3.09Å; S677-V680 PolarHBondContact O-N 3.29Å; S677-V680 VanDerWaalsContact O-N 3.08Å; S677-V681 WeakPolarHBondContact O-CG2 3.49Å; S677-V681 PolarHBondContact O-N 2.74Å
678	A	90.1	Very high	88.1	Confident	83 Å²	83	63.8 Å²	63.8	69%	0.686	34%	0.34	S	S	*	.	H	α-helix	trans	-55.4	-27.8	173.7	0	0	0	0	0	113.3	K682	A678-K682 WeakPolarHBondContact O-CB 3.33Å; A678-K682 PolarHBondContact O-N 3.38Å
679	K	92.1	Very high	88.2	Confident	112 Å²	112	65.8 Å²	65.8	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-63.5	-50.4	175.3	-176.7	-176.8	178.7	178.6	0	111.1	D633 T636 S677 K682 A683	D633-K679 IonicContact OD1-NZ 3.91Å; D633-K679 PolarHBondContact OD1-NZ 3.49Å; T636-K679 HydrophobicContact CG2-CD 4.45Å; T636-K679 HydrophobicContact CG2-CG 4.07Å; S677-K679 PolarHBondContact O-N 3.27Å; S677-K679 VanDerWaalsContact O-N 3.09Å; K679-K682 PolarHBondContact O-N 3.21Å; K679-A683 WeakPolarHBondContact O-CB 3.26Å; K679-A683 PolarHBondContact O-N 3.03Å
680	V	93.4	Very high	88.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-48.6	176.7	167.5	0	0	0	0	111.3	D632 V635 T636 I668 H676 S677 K682 A683 A684	D632-V680 HydrophobicContact CB-CG2 3.62Å; D632-V680 WeakPolarHBondContact O-CG2 3.19Å; V635-V680 HydrophobicContact CB-CG1 4.32Å; V635-V680 HydrophobicContact CB-CG2 4.2Å; V635-V680 HydrophobicContact CG1-CG1 3.66Å; V635-V680 HydrophobicContact CG1-CG2 4.4Å; T636-V680 WeakPolarHBondContact OG1-CG2 3.5Å; I668-V680 HydrophobicContact CG2-CG1 3.42Å; I668-V680 VanDerWaalsContact CG2-CG1 3.42Å; H676-V680 HydrophobicContact CB-CB 4.15Å; H676-V680 HydrophobicContact CB-CG1 3.85Å; S677-V680 PolarHBondContact O-N 3.29Å; S677-V680 VanDerWaalsContact O-N 3.08Å; V680-K682 VanDerWaalsContact C-N 3.31Å; V680-K682 PolarHBondContact O-N 3.45Å; V680-A683 PolarHBondContact O-N 2.83Å; V680-A683 VanDerWaalsContact O-N 3.15Å; V680-A684 PolarHBondContact O-N 3.35Å
681	V	93.4	Very high	88.9	Confident	32 Å²	32	59.4 Å²	59.4	19%	0.194	33%	0.327	C	S	.	.	H	α-helix	trans	-57.6	-43.4	178.4	171.9	0	0	0	0	111.4	H676 S677 S685	H676-V681 HydrophobicContact CB-CG2 4.26Å; S677-V681 WeakPolarHBondContact O-CG2 3.49Å; S677-V681 PolarHBondContact O-N 2.74Å; V681-S685 VanDerWaalsContact O-CB 3.3Å; V681-S685 WeakPolarHBondContact O-CB 3.25Å; V681-S685 PolarHBondContact O-N 3.35Å; V681-S685 PolarHBondContact O-OG 3.12Å
682	K	93.2	Very high	89.5	Confident	160 Å²	160	59.2 Å²	59.2	70%	0.696	32%	0.323	S	S	*	.	H	α-helix	trans	-65	-42.8	176.2	-176.8	176.7	-178.9	177.5	0	111.9	A678 K679 V680 S685 Q686	A678-K682 WeakPolarHBondContact O-CB 3.33Å; A678-K682 PolarHBondContact O-N 3.38Å; K679-K682 PolarHBondContact O-N 3.21Å; V680-K682 VanDerWaalsContact C-N 3.31Å; V680-K682 PolarHBondContact O-N 3.45Å; K682-S685 PolarHBondContact O-N 2.92Å; K682-Q686 WeakPolarHBondContact O-CB 3.38Å; K682-Q686 PolarHBondContact O-N 3.41Å
683	A	95.8	Very high	90.7	Very high	12 Å²	12	57 Å²	57	10%	0.099	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-45.8	178.4	0	0	0	0	0	111.9	T636 C639 K679 V680 Q686 V687	T636-A683 HydrophobicContact CG2-CB 4.12Å; C639-A683 HydrophobicContact CB-CB 3.65Å; K679-A683 WeakPolarHBondContact O-CB 3.26Å; K679-A683 PolarHBondContact O-N 3.03Å; V680-A683 PolarHBondContact O-N 2.83Å; V680-A683 VanDerWaalsContact O-N 3.15Å; A683-Q686 PolarHBondContact O-N 3.01Å; A683-V687 PolarHBondContact O-N 2.98Å
684	A	96.2	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-43.8	175.8	0	0	0	0	0	112.3	L665 I668 A669 V680 Q686 V687 L688	L665-A684 HydrophobicContact CD2-CB 3.98Å; I668-A684 HydrophobicContact CB-CB 3.97Å; I668-A684 HydrophobicContact CG2-CB 3.62Å; A669-A684 HydrophobicContact CB-CB 4.23Å; V680-A684 PolarHBondContact O-N 3.35Å; A684-Q686 VanDerWaalsContact C-N 3.26Å; A684-Q686 PolarHBondContact O-N 2.83Å; A684-V687 PolarHBondContact O-N 3.26Å; A684-L688 PolarHBondContact O-N 2.91Å; A684-L688 VanDerWaalsContact O-N 3.15Å
685	S	95.6	Very high	93.9	Very high	29 Å²	29	57 Å²	57	20%	0.203	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-35.1	175.3	-59.7	0	0	0	0	112.6	V681 K682 L688 S689	V681-S685 VanDerWaalsContact O-CB 3.3Å; V681-S685 WeakPolarHBondContact O-CB 3.25Å; V681-S685 PolarHBondContact O-N 3.35Å; V681-S685 PolarHBondContact O-OG 3.12Å; K682-S685 PolarHBondContact O-N 2.92Å; S685-L688 PolarHBondContact O-N 2.87Å; S685-S689 WeakPolarHBondContact O-CB 3.4Å; S685-S689 PolarHBondContact O-N 3.06Å
686	Q	96.4	Very high	94.6	Very high	87 Å²	87	54.9 Å²	54.9	41%	0.407	28%	0.278	S	S	.	.	H	α-helix	trans	-69.2	-38.4	178	-177.1	56.7	45.6	0	0	112.1	H643 K682 A683 A684 S690	H643-Q686 PolarHBondContact CD2-O 3.21Å; H643-Q686 PolarHBondContact NE2-NE2 3.45Å; K682-Q686 WeakPolarHBondContact O-CB 3.38Å; K682-Q686 PolarHBondContact O-N 3.41Å; A683-Q686 PolarHBondContact O-N 3.01Å; A684-Q686 VanDerWaalsContact C-N 3.26Å; A684-Q686 PolarHBondContact O-N 2.83Å; Q686-S690 PolarHBondContact O-N 3.33Å; Q686-S690 VanDerWaalsContact O-N 3.13Å; Q686-S690 PolarHBondContact O-OG 3.28Å
687	V	97.9	Very high	95.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.7	-52.4	171.6	-176	0	0	0	0	110.1	C639 L642 H643 I646 L656 L665 A683 A684 S689 S690 M691	C639-V687 HydrophobicContact CB-CG2 4.33Å; C639-V687 WeakPolarHBondContact O-CG2 3.44Å; L642-V687 HydrophobicContact CB-CG1 4.41Å; L642-V687 HydrophobicContact CB-CG2 4.31Å; H643-V687 HydrophobicContact CB-CG2 3.93Å; I646-V687 HydrophobicContact CD1-CG1 3.77Å; L656-V687 HydrophobicContact CD1-CG1 3.78Å; L665-V687 HydrophobicContact CD1-CB 4.01Å; L665-V687 HydrophobicContact CD1-CG1 3.53Å; L665-V687 HydrophobicContact CD2-CB 4.29Å; L665-V687 HydrophobicContact CD2-CG2 4.35Å; A683-V687 PolarHBondContact O-N 2.98Å; A684-V687 PolarHBondContact O-N 3.26Å; V687-S689 PolarHBondContact O-N 3.43Å; V687-S690 PolarHBondContact O-N 3.03Å; V687-M691 WeakPolarHBondContact O-CG 3.32Å; V687-M691 PolarHBondContact O-N 2.93Å
688	L	97.6	Very high	95.4	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-44.6	-179.8	-73.7	171.1	0	0	0	112.7	I662 L665 I666 A669 A684 S685 S690 M691 W692 F711	I662-L688 HydrophobicContact CG2-CD2 4.42Å; L665-L688 HydrophobicContact CB-CD1 4.09Å; L665-L688 HydrophobicContact CB-CD2 3.92Å; L665-L688 HydrophobicContact CB-CG 3.89Å; L665-L688 HydrophobicContact CD1-CD2 4.48Å; I666-L688 HydrophobicContact CG1-CD1 4.08Å; I666-L688 HydrophobicContact CG1-CD2 4.13Å; A669-L688 HydrophobicContact CB-CD1 3.91Å; A684-L688 PolarHBondContact O-N 2.91Å; A684-L688 VanDerWaalsContact O-N 3.15Å; S685-L688 PolarHBondContact O-N 2.87Å; L688-S690 VanDerWaalsContact C-N 3.35Å; L688-S690 PolarHBondContact O-N 3.49Å; L688-M691 WeakPolarHBondContact O-CB 3.43Å; L688-M691 PolarHBondContact O-N 3.17Å; L688-W692 PolarHBondContact O-N 3.41Å; L688-W692 VanDerWaalsContact O-N 3.14Å; L688-F711 CarbonylContact C-O 3.52Å; L688-F711 HydrophobicContact CB-CB 4.45Å; L688-F711 HydrophobicContact CB-CD1 4.28Å; L688-F711 HydrophobicContact CD2-CD1 3.81Å; L688-F711 HydrophobicContact CD2-CE1 4.18Å; L688-F711 WeakPolarHBondContact O-CD1 3.5Å
689	S	96	Very high	95.6	Very high	43 Å²	43	54.9 Å²	54.9	30%	0.301	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-45	176.3	-177.2	0	0	0	0	111.9	S685 V687 M691 W692 Q693 F711	S685-S689 WeakPolarHBondContact O-CB 3.4Å; S685-S689 PolarHBondContact O-N 3.06Å; V687-S689 PolarHBondContact O-N 3.43Å; S689-M691 PolarHBondContact O-N 3.2Å; S689-W692 PolarHBondContact O-N 2.94Å; S689-Q693 PolarHBondContact O-N 3.46Å; S689-F711 PolarHBondContact N-O 3.41Å
690	S	96.4	Very high	95.8	Very high	11 Å²	11	52.1 Å²	52.1	8%	0.077	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-35.6	176.1	-70	0	0	0	0	112.7	H643 Q686 V687 L688 W692 Q693	H643-S690 PolarHBondContact CD2-OG 3.27Å; H643-S690 PolarHBondContact NE2-OG 3.28Å; Q686-S690 PolarHBondContact O-N 3.33Å; Q686-S690 VanDerWaalsContact O-N 3.13Å; Q686-S690 PolarHBondContact O-OG 3.28Å; V687-S690 PolarHBondContact O-N 3.03Å; L688-S690 VanDerWaalsContact C-N 3.35Å; L688-S690 PolarHBondContact O-N 3.49Å; S690-W692 VanDerWaalsContact C-N 3.34Å; S690-W692 PolarHBondContact O-N 3.2Å; S690-Q693 PolarHBondContact O-N 3.13Å
691	M	97.4	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-39.4	173.2	-68.7	-175.1	76.9	0	0	112.8	I646 A653 L656 R657 I662 V687 L688 S689 Q693 Y694 Y701 F711	I646-M691 HydrophobicContact CD1-CG 3.5Å; A653-M691 WeakPolarHBondContact O-CE 3.45Å; L656-M691 HydrophobicContact CB-CE 4.43Å; L656-M691 HydrophobicContact CD1-SD 4.23Å; L656-M691 HydrophobicContact CD2-CE 3.94Å; L656-M691 HydrophobicContact CD2-SD 3.71Å; L656-M691 HydrophobicContact CG-SD 4.47Å; R657-M691 HydrophobicContact CB-CE 4.3Å; I662-M691 HydrophobicContact CD1-CE 3.78Å; I662-M691 HydrophobicContact CG1-CE 3.57Å; I662-M691 HydrophobicContact CG1-SD 4.03Å; V687-M691 WeakPolarHBondContact O-CG 3.32Å; V687-M691 PolarHBondContact O-N 2.93Å; L688-M691 WeakPolarHBondContact O-CB 3.43Å; L688-M691 PolarHBondContact O-N 3.17Å; S689-M691 PolarHBondContact O-N 3.2Å; M691-Q693 VanDerWaalsContact C-N 3.26Å; M691-Q693 PolarHBondContact O-N 3.3Å; M691-Y694 PolarHBondContact O-N 3.21Å; M691-Y701 HydrophobicContact CE-CE1 4.01Å; M691-Y701 WeakPolarHBondContact O-CE2 3.31Å; M691-Y701 PolarHBondContact O-OH 3.31Å; M691-F711 HydrophobicContact CB-CD1 4.06Å; M691-F711 HydrophobicContact CB-CE1 4.03Å; M691-F711 HydrophobicContact SD-CE1 4.34Å
692	W	95.8	Very high	96	Very high	22 Å²	22	57.4 Å²	57.4	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-72	-17.2	-179	-166.8	-107.4	0	0	0	114	L688 S689 S690 Y694 R698 Y701 Q708 F711 V712	L688-W692 PolarHBondContact O-N 3.41Å; L688-W692 VanDerWaalsContact O-N 3.14Å; S689-W692 PolarHBondContact O-N 2.94Å; S690-W692 VanDerWaalsContact C-N 3.34Å; S690-W692 PolarHBondContact O-N 3.2Å; W692-Y694 VanDerWaalsContact C-N 3.29Å; W692-Y694 PolarHBondContact O-N 2.94Å; W692-R698 HydrophobicContact CD2-CG 4.47Å; W692-R698 HydrophobicContact CE3-CG 4.33Å; W692-R698 HydrophobicContact CH2-CG 4.27Å; W692-R698 HydrophobicContact CZ2-CG 4.39Å; W692-R698 HydrophobicContact CZ3-CG 4.25Å; W692-R698 VanDerWaalsContact O-CZ 3.3Å; W692-R698 PolarHBondContact O-NE 2.79Å; W692-R698 PolarHBondContact O-NH2 3.04Å; W692-Y701 AromaticContact CE3-CD2 3.94Å; W692-Y701 HydrophobicContact CE3-CD2 3.94Å; W692-Y701 HydrophobicContact CE3-CE2 4.48Å; W692-Y701 HydrophobicContact CZ3-CD2 4.03Å; W692-Q708 HydrophobicContact CH2-CB 4.06Å; W692-Q708 HydrophobicContact CZ2-CB 3.46Å; W692-Q708 VanDerWaalsContact CZ2-CB 3.46Å; W692-Q708 HydrophobicContact CZ2-CG 4.02Å; W692-F711 HydrophobicContact CB-CB 3.7Å; W692-F711 HydrophobicContact CB-CG 4.15Å; W692-F711 HydrophobicContact CD2-CB 4.26Å; W692-F711 HydrophobicContact CD2-CD2 4.15Å; W692-F711 HydrophobicContact CD2-CG 4.37Å; W692-F711 HydrophobicContact CE3-CB 4.13Å; W692-F711 AromaticContact CE3-CD2 3.23Å; W692-F711 HydrophobicContact CE3-CD2 3.23Å; W692-F711 AromaticContact CE3-CE2 3.64Å; W692-F711 HydrophobicContact CE3-CE2 3.64Å; W692-F711 AromaticContact CE3-CG 3.76Å; W692-F711 HydrophobicContact CE3-CG 3.76Å; W692-F711 HydrophobicContact CE3-CZ 4.46Å; W692-F711 HydrophobicContact CG-CB 4.11Å; W692-F711 AromaticContact CZ3-CD2 3.64Å; W692-F711 HydrophobicContact CZ3-CD2 3.64Å; W692-F711 AromaticContact CZ3-CE2 3.74Å; W692-F711 HydrophobicContact CZ3-CE2 3.74Å; W692-V712 HydrophobicContact CG-CG2 4.48Å
693	Q	95.6	Very high	96.1	Very high	127 Å²	127	58.2 Å²	58.2	59%	0.593	28%	0.279	S	S	*	.	H	α-helix	trans	-67.8	-29.8	176.6	-68.1	173.7	39.5	0	0	112.1	S689 S690 M691 R695	S689-Q693 PolarHBondContact O-N 3.46Å; S690-Q693 PolarHBondContact O-N 3.13Å; M691-Q693 VanDerWaalsContact C-N 3.26Å; M691-Q693 PolarHBondContact O-N 3.3Å; Q693-R695 PolarHBondContact O-N 3.15Å
694	Y	96.6	Very high	96	Very high	42 Å²	42	60.8 Å²	60.8	17%	0.165	29%	0.29	C	S	.	.			trans	-69.1	100.9	172.9	-62.2	-66.3	0	0	0	110.8	I646 K648 N649 M650 A653 M691 W692 D696 L697	I646-Y694 PolarHBondContact O-OH 3.03Å; K648-Y694 WeakPolarHBondContact CA-OH 3.44Å; K648-Y694 PolarHBondContact N-OH 3.44Å; N649-Y694 PolarHBondContact N-OH 3.39Å; M650-Y694 HydrophobicContact CB-CD1 3.8Å; M650-Y694 HydrophobicContact CB-CE1 3.9Å; M650-Y694 HydrophobicContact CB-CG 4.41Å; M650-Y694 HydrophobicContact CG-CD1 3.86Å; M650-Y694 HydrophobicContact CG-CE1 4.46Å; M650-Y694 HydrophobicContact CG-CG 4.1Å; M650-Y694 HydrophobicContact SD-CD1 4.28Å; A653-Y694 HydrophobicContact CB-CD2 3.66Å; A653-Y694 HydrophobicContact CB-CE2 3.62Å; M691-Y694 PolarHBondContact O-N 3.21Å; W692-Y694 VanDerWaalsContact C-N 3.29Å; W692-Y694 PolarHBondContact O-N 2.94Å; Y694-D696 VanDerWaalsContact C-N 3.28Å; Y694-D696 PolarHBondContact O-N 2.79Å; Y694-L697 HydrophobicContact CD2-CD1 4.34Å; Y694-L697 HydrophobicContact CG-CD1 4.28Å; Y694-L697 PolarHBondContact O-N 3.29Å
695	R	95.6	Very high	95.9	Very high	192 Å²	192	63.5 Å²	63.5	73%	0.725	32%	0.318	S	S	*	.	S	Bend	trans	-60.4	-39.8	-178	-66.1	-175.6	178.3	-166.8	-0.5	111.9	Q693 L697 R698	Q693-R695 PolarHBondContact O-N 3.15Å; R695-L697 VanDerWaalsContact C-N 3.32Å; R695-L697 PolarHBondContact O-N 3.04Å; R695-R698 WeakPolarHBondContact O-CB 3.27Å; R695-R698 WeakPolarHBondContact O-CG 3.48Å; R695-R698 PolarHBondContact O-N 2.81Å
696	D	96.3	Very high	95.9	Very high	117 Å²	117	64.3 Å²	64.3	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.5	-172.1	-46	-42.4	0	0	0	112.5	M650 Y694 R698 S699	M650-D696 HydrophobicContact SD-CB 3.95Å; Y694-D696 VanDerWaalsContact C-N 3.28Å; Y694-D696 PolarHBondContact O-N 2.79Å; D696-R698 VanDerWaalsContact C-N 3.33Å; D696-S699 PolarHBondContact O-OG 2.77Å
697	L	96.2	Very high	95.7	Very high	8 Å²	8	62.7 Å²	62.7	4%	0.042	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.9	175.5	-59.1	-177.2	0	0	0	113.4	M650 A653 K654 Y694 R695 S699 L700 Y701	M650-L697 HydrophobicContact CG-CD1 3.74Å; M650-L697 HydrophobicContact CG-CD2 4.06Å; M650-L697 HydrophobicContact CG-CG 3.79Å; M650-L697 HydrophobicContact SD-CD2 4.38Å; M650-L697 HydrophobicContact SD-CG 4.14Å; A653-L697 HydrophobicContact CB-CD1 3.72Å; K654-L697 HydrophobicContact CB-CD1 4.34Å; K654-L697 HydrophobicContact CB-CD2 4.05Å; K654-L697 HydrophobicContact CD-CD2 4.46Å; K654-L697 HydrophobicContact CG-CD2 4.47Å; Y694-L697 HydrophobicContact CD2-CD1 4.34Å; Y694-L697 HydrophobicContact CG-CD1 4.28Å; Y694-L697 PolarHBondContact O-N 3.29Å; R695-L697 VanDerWaalsContact C-N 3.32Å; R695-L697 PolarHBondContact O-N 3.04Å; L697-S699 VanDerWaalsContact C-N 3.28Å; L697-S699 PolarHBondContact O-N 2.85Å; L697-L700 HydrophobicContact CD2-CD1 3.96Å; L697-L700 WeakPolarHBondContact O-CB 3.34Å; L697-L700 PolarHBondContact O-N 3.49Å; L697-L700 VanDerWaalsContact O-N 3.13Å; L697-Y701 HydrophobicContact CB-CD2 4.45Å; L697-Y701 HydrophobicContact CB-CE1 3.96Å; L697-Y701 HydrophobicContact CB-CE2 3.77Å; L697-Y701 VanDerWaalsContact CB-CZ 3.49Å; L697-Y701 VanDerWaalsContact CD1-OH 3.28Å; L697-Y701 WeakPolarHBondContact CD1-OH 3.34Å; L697-Y701 WeakPolarHBondContact O-CD2 3.29Å; L697-Y701 VanDerWaalsContact O-CG 3.28Å; L697-Y701 PolarHBondContact O-N 3.3Å
698	R	95.4	Very high	95.4	Very high	78 Å²	78	68 Å²	68	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-28.3	-176.2	-64.6	175.6	-177.7	177	-2	113.6	W692 R695 D696 K702	W692-R698 HydrophobicContact CD2-CG 4.47Å; W692-R698 HydrophobicContact CE3-CG 4.33Å; W692-R698 HydrophobicContact CH2-CG 4.27Å; W692-R698 HydrophobicContact CZ2-CG 4.39Å; W692-R698 HydrophobicContact CZ3-CG 4.25Å; W692-R698 VanDerWaalsContact O-CZ 3.3Å; W692-R698 PolarHBondContact O-NE 2.79Å; W692-R698 PolarHBondContact O-NH2 3.04Å; R695-R698 WeakPolarHBondContact O-CB 3.27Å; R695-R698 WeakPolarHBondContact O-CG 3.48Å; R695-R698 PolarHBondContact O-N 2.81Å; D696-R698 VanDerWaalsContact C-N 3.33Å; R698-K702 WeakPolarHBondContact O-CB 3.42Å; R698-K702 VanDerWaalsContact O-CG 3.3Å; R698-K702 WeakPolarHBondContact O-CG 3.45Å; R698-K702 PolarHBondContact O-N 3.31Å; R698-K702 VanDerWaalsContact O-N 3.08Å
699	S	95.5	Very high	95	Very high	78 Å²	78	72.8 Å²	72.8	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-66.4	-43.2	173.2	53.7	0	0	0	0	110.9	D696 L697 K702 K703	D696-S699 PolarHBondContact O-OG 2.77Å; L697-S699 VanDerWaalsContact C-N 3.28Å; L697-S699 PolarHBondContact O-N 2.85Å; S699-K702 PolarHBondContact O-N 3.31Å; S699-K703 PolarHBondContact O-N 2.77Å
700	L	94.9	Very high	94.8	Very high	55 Å²	55	72.4 Å²	72.4	29%	0.288	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-47.7	175.1	-59.9	176.1	0	0	0	111.2	L697 K702 K703 D704	L697-L700 HydrophobicContact CD2-CD1 3.96Å; L697-L700 WeakPolarHBondContact O-CB 3.34Å; L697-L700 PolarHBondContact O-N 3.49Å; L697-L700 VanDerWaalsContact O-N 3.13Å; L700-K702 VanDerWaalsContact C-N 3.3Å; L700-K702 PolarHBondContact O-N 3.5Å; L700-K703 WeakPolarHBondContact O-CA 3.3Å; L700-K703 WeakPolarHBondContact O-CB 3.47Å; L700-K703 PolarHBondContact O-N 2.73Å; L700-D704 VanDerWaalsContact O-CG 3.26Å; L700-D704 PolarHBondContact O-N 2.96Å; L700-D704 VanDerWaalsContact O-N 3.1Å
701	Y	96.1	Very high	94.5	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-57.6	-42.3	176.7	-57.2	-28.9	0	0	0	112.3	R657 I662 M691 W692 L697 D704 G705 Y706 F711	R657-Y701 HydrophobicContact CB-CE1 4.3Å; R657-Y701 HydrophobicContact CG-CD1 4.48Å; R657-Y701 HydrophobicContact CG-CE1 4.41Å; I662-Y701 HydrophobicContact CD1-CD1 3.91Å; I662-Y701 HydrophobicContact CD1-CE1 3.98Å; M691-Y701 HydrophobicContact CE-CE1 4.01Å; M691-Y701 WeakPolarHBondContact O-CE2 3.31Å; M691-Y701 PolarHBondContact O-OH 3.31Å; W692-Y701 AromaticContact CE3-CD2 3.94Å; W692-Y701 HydrophobicContact CE3-CD2 3.94Å; W692-Y701 HydrophobicContact CE3-CE2 4.48Å; W692-Y701 HydrophobicContact CZ3-CD2 4.03Å; L697-Y701 HydrophobicContact CB-CD2 4.45Å; L697-Y701 HydrophobicContact CB-CE1 3.96Å; L697-Y701 HydrophobicContact CB-CE2 3.77Å; L697-Y701 VanDerWaalsContact CB-CZ 3.49Å; L697-Y701 VanDerWaalsContact CD1-OH 3.28Å; L697-Y701 WeakPolarHBondContact CD1-OH 3.34Å; L697-Y701 WeakPolarHBondContact O-CD2 3.29Å; L697-Y701 VanDerWaalsContact O-CG 3.28Å; L697-Y701 PolarHBondContact O-N 3.3Å; Y701-D704 PolarHBondContact O-N 2.8Å; Y701-G705 PolarHBondContact O-N 3.13Å; Y701-Y706 CarbonylContact C-O 3.6Å; Y701-Y706 VanDerWaalsContact C-O 3.32Å; Y701-Y706 WeakPolarHBondContact O-CA 3.47Å; Y701-Y706 WeakPolarHBondContact O-CB 3.46Å; Y701-Y706 PolarHBondContact O-N 2.84Å; Y701-F711 AromaticContact CD1-CZ 3.97Å; Y701-F711 HydrophobicContact CD1-CZ 3.97Å; Y701-F711 HydrophobicContact CD2-CE1 4.29Å; Y701-F711 AromaticContact CD2-CE2 3.96Å; Y701-F711 HydrophobicContact CD2-CE2 3.96Å; Y701-F711 AromaticContact CD2-CZ 3.66Å; Y701-F711 HydrophobicContact CD2-CZ 3.66Å; Y701-F711 HydrophobicContact CE1-CZ 4.37Å; Y701-F711 HydrophobicContact CE2-CE1 4.28Å; Y701-F711 HydrophobicContact CE2-CZ 4.1Å; Y701-F711 HydrophobicContact CG-CE1 4.49Å; Y701-F711 HydrophobicContact CG-CE2 4.03Å; Y701-F711 AromaticContact CG-CZ 3.6Å; Y701-F711 HydrophobicContact CG-CZ 3.6Å
702	K	94.9	Very high	93.7	Very high	142 Å²	142	75.2 Å²	75.2	62%	0.617	37%	0.372	S	S	*	.	H	α-helix	trans	-64.6	-37.2	175.1	-76.1	177.4	179.8	-173	0	112.7	R698 S699 L700 D704 G705 Y706	R698-K702 WeakPolarHBondContact O-CB 3.42Å; R698-K702 VanDerWaalsContact O-CG 3.3Å; R698-K702 WeakPolarHBondContact O-CG 3.45Å; R698-K702 PolarHBondContact O-N 3.31Å; R698-K702 VanDerWaalsContact O-N 3.08Å; S699-K702 PolarHBondContact O-N 3.31Å; L700-K702 VanDerWaalsContact C-N 3.3Å; L700-K702 PolarHBondContact O-N 3.5Å; K702-D704 PolarHBondContact O-N 3.48Å; K702-G705 PolarHBondContact O-N 3.08Å; K702-Y706 WeakPolarHBondContact CA-O 3.43Å; K702-Y706 PolarHBondContact N-O 3.04Å
703	K	95.1	Very high	92.2	Very high	178 Å²	178	76.4 Å²	76.4	77%	0.774	39%	0.391	S	S	*	.	H	α-helix	trans	-61.5	-33.1	175.2	-171.4	-178	179.4	-177.5	0	111.7	S699 L700 G705	S699-K703 PolarHBondContact O-N 2.77Å; L700-K703 WeakPolarHBondContact O-CA 3.3Å; L700-K703 WeakPolarHBondContact O-CB 3.47Å; L700-K703 PolarHBondContact O-N 2.73Å; K703-G705 VanDerWaalsContact C-N 3.25Å; K703-G705 PolarHBondContact O-N 3.36Å
704	D	94	Very high	90	Very high	65 Å²	65	75.1 Å²	75.1	35%	0.348	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	8	175.9	-47.6	-31.5	0	0	0	113.3	R657 L700 Y701 K702 Y706	R657-D704 IonicContact CZ-OD1 3.21Å; R657-D704 IonicContact CZ-OD2 3.52Å; R657-D704 IonicContact NE-OD1 2.68Å; R657-D704 IonicContact NE-OD2 3.29Å; R657-D704 PolarHBondContact NE-OD2 3.39Å; R657-D704 IonicContact NH2-OD1 2.97Å; R657-D704 PolarHBondContact NH2-OD1 3.27Å; R657-D704 IonicContact NH2-OD2 2.7Å; R657-D704 PolarHBondContact NH2-OD2 2.99Å; L700-D704 VanDerWaalsContact O-CG 3.26Å; L700-D704 PolarHBondContact O-N 2.96Å; L700-D704 VanDerWaalsContact O-N 3.1Å; Y701-D704 PolarHBondContact O-N 2.8Å; K702-D704 PolarHBondContact O-N 3.48Å; D704-Y706 HydrophobicContact CB-CD2 3.73Å; D704-Y706 HydrophobicContact CB-CE2 3.84Å
705	G	94.7	Very high	87.5	Confident	57 Å²	57	77.7 Å²	77.7	59%	0.588	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	0.2	-178.7	0	0	0	0	0	115.5	Y701 K702 K703	Y701-G705 PolarHBondContact O-N 3.13Å; K702-G705 PolarHBondContact O-N 3.08Å; K703-G705 VanDerWaalsContact C-N 3.25Å; K703-G705 PolarHBondContact O-N 3.36Å
706	Y	94.9	Very high	84.9	Confident	47 Å²	47	72.9 Å²	72.9	18%	0.184	42%	0.422	C	S	.	.			trans	-90.8	123.6	-178.9	-54.2	-71	0	0	0	113.7	I662 I666 Y701 K702 D704 H710 F711	I662-Y706 HydrophobicContact CB-CE2 4.17Å; I662-Y706 HydrophobicContact CD1-CD2 4.32Å; I662-Y706 HydrophobicContact CD1-CE2 4.3Å; I662-Y706 HydrophobicContact CG2-CD1 3.97Å; I662-Y706 HydrophobicContact CG2-CD2 3.95Å; I662-Y706 HydrophobicContact CG2-CE1 3.73Å; I662-Y706 HydrophobicContact CG2-CE2 3.73Å; I662-Y706 HydrophobicContact CG2-CG 4.08Å; I666-Y706 HydrophobicContact CD1-CD1 3.71Å; I666-Y706 HydrophobicContact CD1-CE1 3.52Å; Y701-Y706 CarbonylContact C-O 3.6Å; Y701-Y706 VanDerWaalsContact C-O 3.32Å; Y701-Y706 WeakPolarHBondContact O-CA 3.47Å; Y701-Y706 WeakPolarHBondContact O-CB 3.46Å; Y701-Y706 PolarHBondContact O-N 2.84Å; K702-Y706 WeakPolarHBondContact CA-O 3.43Å; K702-Y706 PolarHBondContact N-O 3.04Å; D704-Y706 HydrophobicContact CB-CD2 3.73Å; D704-Y706 HydrophobicContact CB-CE2 3.84Å; Y706-H710 WeakPolarHBondContact CA-ND1 3.41Å; Y706-H710 HydrophobicContact CD1-CB 4.26Å; Y706-H710 AromaticContact CD1-CG 3.93Å; Y706-H710 AromaticContact CD1-ND1 3.75Å; Y706-F711 HydrophobicContact CG-CE2 4.44Å
707	S	92.4	Very high	82.2	Confident	53 Å²	53	70.6 Å²	70.6	37%	0.371	41%	0.412	S	S	.	.			trans	-109.2	176.7	167.1	70.3	0	0	0	0	113.1	H709 H710	S707-H709 PolarHBondContact O-N 3.23Å; S707-H709 PolarHBondContact OG-CE1 3.19Å; S707-H709 PolarHBondContact OG-ND1 2.68Å; S707-H710 PolarHBondContact N-ND1 3.02Å; S707-H710 WeakPolarHBondContact O-CB 3.33Å; S707-H710 PolarHBondContact O-N 3.32Å
708	Q	91.8	Very high	79.6	Confident	110 Å²	110	77.3 Å²	77.3	51%	0.514	45%	0.447	S	S	.	.	H	α-helix	trans	-49.5	-38.6	-171.6	-176.9	163.9	-24.2	0	0	114.8	W692 H710 F711 V712	W692-Q708 HydrophobicContact CH2-CB 4.06Å; W692-Q708 HydrophobicContact CZ2-CB 3.46Å; W692-Q708 VanDerWaalsContact CZ2-CB 3.46Å; W692-Q708 HydrophobicContact CZ2-CG 4.02Å; Q708-H710 PolarHBondContact O-N 3.44Å; Q708-H710 VanDerWaalsContact O-N 3.16Å; Q708-F711 PolarHBondContact O-N 3.42Å; Q708-V712 HydrophobicContact CG-CB 4.26Å; Q708-V712 HydrophobicContact CG-CG2 3.85Å; Q708-V712 PolarHBondContact O-N 3.43Å
709	H	90	Very high	76.8	Confident	103 Å²	103	82.1 Å²	82.1	48%	0.477	47%	0.473	S	S	.	.	H	α-helix	trans	-66.5	-13.4	-177.6	85.6	-67.6	0	0	0	114	R670 S707	R670-H709 PolarHBondContact NH2-CD2 2.97Å; R670-H709 PolarHBondContact NH2-NE2 2.91Å; R670-H709 VanDerWaalsContact NH2-NE2 3.12Å; R670-H709 PolarHBondContact NH2-O 2.71Å; S707-H709 PolarHBondContact O-N 3.23Å; S707-H709 PolarHBondContact OG-CE1 3.19Å; S707-H709 PolarHBondContact OG-ND1 2.68Å
710	H	91.2	Very high	73.9	Confident	36 Å²	36	86.7 Å²	86.7	17%	0.167	48%	0.478	C	S	.	.	H	α-helix	trans	-78.3	-33.8	169.7	-68.2	123.7	0	0	0	112.4	I666 R670 Y706 S707 Q708	I666-H710 HydrophobicContact CD1-CB 3.73Å; I666-H710 HydrophobicContact CG1-CB 4.33Å; R670-H710 PolarHBondContact NH1-CD2 3.14Å; R670-H710 PolarHBondContact NH2-CD2 2.96Å; Y706-H710 WeakPolarHBondContact CA-ND1 3.41Å; Y706-H710 HydrophobicContact CD1-CB 4.26Å; Y706-H710 AromaticContact CD1-CG 3.93Å; Y706-H710 AromaticContact CD1-ND1 3.75Å; S707-H710 PolarHBondContact N-ND1 3.02Å; S707-H710 WeakPolarHBondContact O-CB 3.33Å; S707-H710 PolarHBondContact O-N 3.32Å; Q708-H710 PolarHBondContact O-N 3.44Å; Q708-H710 VanDerWaalsContact O-N 3.16Å
711	F	90.3	Very high	70.9	Confident	2 Å²	2	90 Å²	90	1%	0.009	50%	0.496	C	S	.	.	H	α-helix	trans	-97.8	-25.5	-174.6	-62.5	-91.4	0	0	0	113.8	I662 L688 S689 M691 W692 Y701 Y706 Q708	I662-F711 HydrophobicContact CD1-CE1 4.19Å; I662-F711 HydrophobicContact CD1-CZ 4.04Å; I662-F711 HydrophobicContact CG1-CE1 4.24Å; I662-F711 HydrophobicContact CG1-CZ 4.5Å; I662-F711 HydrophobicContact CG2-CE1 4.14Å; I662-F711 HydrophobicContact CG2-CZ 4.09Å; L688-F711 CarbonylContact C-O 3.52Å; L688-F711 HydrophobicContact CB-CB 4.45Å; L688-F711 HydrophobicContact CB-CD1 4.28Å; L688-F711 HydrophobicContact CD2-CD1 3.81Å; L688-F711 HydrophobicContact CD2-CE1 4.18Å; L688-F711 WeakPolarHBondContact O-CD1 3.5Å; S689-F711 PolarHBondContact N-O 3.41Å; M691-F711 HydrophobicContact CB-CD1 4.06Å; M691-F711 HydrophobicContact CB-CE1 4.03Å; M691-F711 HydrophobicContact SD-CE1 4.34Å; W692-F711 HydrophobicContact CB-CB 3.7Å; W692-F711 HydrophobicContact CB-CG 4.15Å; W692-F711 HydrophobicContact CD2-CB 4.26Å; W692-F711 HydrophobicContact CD2-CD2 4.15Å; W692-F711 HydrophobicContact CD2-CG 4.37Å; W692-F711 HydrophobicContact CE3-CB 4.13Å; W692-F711 AromaticContact CE3-CD2 3.23Å; W692-F711 HydrophobicContact CE3-CD2 3.23Å; W692-F711 AromaticContact CE3-CE2 3.64Å; W692-F711 HydrophobicContact CE3-CE2 3.64Å; W692-F711 AromaticContact CE3-CG 3.76Å; W692-F711 HydrophobicContact CE3-CG 3.76Å; W692-F711 HydrophobicContact CE3-CZ 4.46Å; W692-F711 HydrophobicContact CG-CB 4.11Å; W692-F711 AromaticContact CZ3-CD2 3.64Å; W692-F711 HydrophobicContact CZ3-CD2 3.64Å; W692-F711 AromaticContact CZ3-CE2 3.74Å; W692-F711 HydrophobicContact CZ3-CE2 3.74Å; Y701-F711 AromaticContact CD1-CZ 3.97Å; Y701-F711 HydrophobicContact CD1-CZ 3.97Å; Y701-F711 HydrophobicContact CD2-CE1 4.29Å; Y701-F711 AromaticContact CD2-CE2 3.96Å; Y701-F711 HydrophobicContact CD2-CE2 3.96Å; Y701-F711 AromaticContact CD2-CZ 3.66Å; Y701-F711 HydrophobicContact CD2-CZ 3.66Å; Y701-F711 HydrophobicContact CE1-CZ 4.37Å; Y701-F711 HydrophobicContact CE2-CE1 4.28Å; Y701-F711 HydrophobicContact CE2-CZ 4.1Å; Y701-F711 HydrophobicContact CG-CE1 4.49Å; Y701-F711 HydrophobicContact CG-CE2 4.03Å; Y701-F711 AromaticContact CG-CZ 3.6Å; Y701-F711 HydrophobicContact CG-CZ 3.6Å; Y706-F711 HydrophobicContact CG-CE2 4.44Å; Q708-F711 PolarHBondContact O-N 3.42Å
712	V	79.6	Confident	68.1	Low	67 Å²	67	101.2 Å²	101.2	41%	0.406	54%	0.538	S	S	.	.	S	Bend	trans	-111.5	87	179.9	-173.8	0	0	0	0	108.1	W692 Q708	W692-V712 HydrophobicContact CG-CG2 4.48Å; Q708-V712 HydrophobicContact CG-CB 4.26Å; Q708-V712 HydrophobicContact CG-CG2 3.85Å; Q708-V712 PolarHBondContact O-N 3.43Å
713	G	64.6	Low	65	Low	47 Å²	47	102.5 Å²	102.5	49%	0.485	55%	0.547	S	S	.	.			trans	-73.3	148.8	174.5	0	0	0	0	0	112.5	A715	G713-A715 PolarHBondContact O-N 3.06Å
714	S	50.6	Low	62	Low	100 Å²	100	104 Å²	104	70%	0.699	55%	0.547	S	S	*	.			trans	-73.5	57	-176.9	-54.5	0	0	0	0	114	S716 T717	S714-S716 PolarHBondContact O-N 3.39Å; S714-T717 PolarHBondContact O-OG1 3.1Å
715	A	44.5	Very low	59.1	Low	96 Å²	96	106.8 Å²	106.8	79%	0.793	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	38.1	-179.8	0	0	0	0	0	114.2	G713	G713-A715 PolarHBondContact O-N 3.06Å
716	S	40.8	Very low	56.1	Low	91 Å²	91	114.7 Å²	114.7	64%	0.636	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	1.2	-176.7	-171.7	0	0	0	0	113.8	S714 R720	S714-S716 PolarHBondContact O-N 3.39Å; S716-R720 PolarHBondContact O-NH2 3.39Å
717	T	38.8	Very low	52.9	Low	69 Å²	69	118.5 Å²	118.5	42%	0.423	62%	0.616	S	S	.	*	S	Bend	trans	-124.7	-15.6	-175	48.8	0	0	0	0	116.1	S714 E719 R720	S714-T717 PolarHBondContact O-OG1 3.1Å; T717-E719 PolarHBondContact O-N 3.31Å; T717-R720 PolarHBondContact O-N 3.15Å
718	I	41.1	Very low	50	Low	150 Å²	150	120.8 Å²	120.8	77%	0.769	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-25.2	-175.6	-77.1	173.9	0	0	0	113.8
719	E	36.1	Very low	47	Very low	179 Å²	179	121.8 Å²	121.8	84%	0.836	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-17.8	172.8	-70.6	-178	149.1	0	0	113.9	T717	T717-E719 PolarHBondContact O-N 3.31Å
720	R	34.8	Very low	44.2	Very low	174 Å²	174	128.4 Å²	128.4	66%	0.657	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-23.6	-171	-123.2	-173.6	-68	175.4	-0.2	114.6	S716 T717	S716-R720 PolarHBondContact O-NH2 3.39Å; T717-R720 PolarHBondContact O-N 3.15Å
721	D	31.9	Very low	41.2	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-0.6	179.3	-83.2	-30.6	0	0	0	114.3
722	R	36.9	Very low	38.6	Very low	234 Å²	234	138.6 Å²	138.6	88%	0.883	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	0.2	173.9	-133.9	175.5	-174.4	-178.3	1.1	114.1
723	Q	31.6	Very low	36.1	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.794	76%	0.758	S	S	*	*			trans	-130	67.2	178.6	-71.9	178.6	-16.1	0	0	111.3
724	R	31.5	Very low	34.3	Very low	208 Å²	208	144.6 Å²	144.6	79%	0.785	77%	0.771	S	S	*	*			trans	-118.2	109.8	158.4	-73.5	-168.9	-174.2	-132.4	4.5	109.6
725	P	32.9	Very low	33.3	Very low	124 Å²	124	145.4 Å²	145.4	81%	0.805	78%	0.777	S	S	*	*			trans	-63.6	149.6	165.6	-18.4	32.1	0	0	0	110.8	S727	P725-S727 PolarHBondContact O-N 3.23Å
726	Y	31	Very low	33.1	Very low	224 Å²	224	146 Å²	146	88%	0.878	77%	0.773	S	S	*	*			trans	-54.7	132.6	166.9	-104.6	-105.7	0	0	0	111
727	S	28.4	Very low	32.4	Very low	126 Å²	126	148.5 Å²	148.5	88%	0.881	78%	0.784	S	S	*	*			trans	-161.9	101.8	152.1	-84.8	0	0	0	0	110.7	P725	P725-S727 PolarHBondContact O-N 3.23Å
728	S	30.4	Very low	32	Very low	102 Å²	102	156 Å²	156	71%	0.713	80%	0.804	S	S	*	*			trans	-86.3	124.7	163.7	50.5	0	0	0	0	110
729	S	30.1	Very low	31.4	Very low	130 Å²	130	155.7 Å²	155.7	91%	0.909	81%	0.81	S	S	*	*			trans	-167.4	146.6	150.7	-86	0	0	0	0	111.4
730	R	30.3	Very low	30.9	Very low	242 Å²	242	152.7 Å²	152.7	91%	0.913	81%	0.808	S	S	*	*			trans	-91	142.1	178.5	-64.1	170	169.6	179.6	-4.3	110.7
731	T	29.6	Very low	31.2	Very low	139 Å²	139	149.6 Å²	149.6	85%	0.853	81%	0.811	S	S	*	*			trans	-168.5	142.5	134.2	37.4	0	0	0	0	110.2
732	P	35.2	Very low	30.9	Very low	114 Å²	114	150.6 Å²	150.6	74%	0.74	82%	0.816	S	S	*	*			trans	-102.2	168	179	38.7	-33.9	0	0	0	114.6
733	S	26.1	Very low	30.5	Very low	115 Å²	115	144.8 Å²	144.8	80%	0.804	80%	0.803	S	S	*	*			trans	72.9	154.8	171.4	82.4	0	0	0	0	115.8
734	V	28.3	Very low	30.4	Very low	125 Å²	125	147.2 Å²	147.2	76%	0.758	81%	0.805	S	S	*	*			cis	-138.6	152.1	9.1	178.4	0	0	0	0	109.6
735	S	29.9	Very low	30.1	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	81%	0.805	S	S	*	*			trans	-106.7	137	162.7	-59.5	0	0	0	0	110.9
736	P	38.3	Very low	29.8	Very low	108 Å²	108	140.3 Å²	140.3	70%	0.701	80%	0.802	S	S	*	*				-144	128.2	127.3	32.1	-14.5	0	0	0	113.2
737	V	27.6	Very low	29.6	Very low	143 Å²	143	139.5 Å²	139.5	87%	0.867	81%	0.807	S	S	*	*				107.7	148	90.1	165.4	0	0	0	0	111.7
738	R	30.3	Very low	29.5	Very low	226 Å²	226	141.6 Å²	141.6	85%	0.853	80%	0.802	S	S	*	*			trans	-70.7	149	-171.4	-62.1	166	161.4	-163.2	-5.1	114.8
739	T	27.6	Very low	29.5	Very low	144 Å²	144	142.5 Å²	142.5	88%	0.883	80%	0.8	S	S	*	*			trans	-150.5	127.1	134.4	43.1	0	0	0	0	111.8
740	S	25.9	Very low	29.3	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	80%	0.797	S	S	*	*			trans	-101	171.2	157.8	-59.8	0	0	0	0	107.5
741	P	40.6	Very low	29.1	Very low	109 Å²	109	140.4 Å²	140.4	71%	0.708	79%	0.794	S	S	*	*			cis	-150.5	179.4	29.3	43.6	-22.7	0	0	0	119.1
742	N	27.2	Very low	28.9	Very low	146 Å²	146	145.3 Å²	145.3	78%	0.781	80%	0.797	S	S	*	*			trans	62.2	150.6	157.5	-76.3	-4	0	0	0	118.1
743	N	28.4	Very low	28.5	Very low	113 Å²	113	146.5 Å²	146.5	60%	0.604	80%	0.802	S	S	*	*			cis	-160.2	144	10.3	-140.9	-10	0	0	0	109.8
744	R	28.1	Very low	28.5	Very low	221 Å²	221	146.7 Å²	146.7	83%	0.834	80%	0.802	S	S	*	*			trans	52.1	155	152.2	-67.9	172.2	-174.4	-171.1	-0.7	119.2
745	S	26	Very low	28.4	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	81%	0.805	S	S	*	*			cis	-178	140.6	-19	49.5	0	0	0	0	106.6
746	G	26	Very low	28.1	Very low	72 Å²	72	154.4 Å²	154.4	74%	0.742	81%	0.81	S	S	*	*			trans	137.6	126.7	162.4	0	0	0	0	0	117.1
747	E	26.4	Very low	27.5	Very low	208 Å²	208	156.5 Å²	156.5	97%	0.972	82%	0.82	S	S	*	*			trans	76	112.5	149	-53.4	-163.8	154.9	0	0	120.6
748	E	27.8	Very low	27.4	Very low	169 Å²	169	154.4 Å²	154.4	79%	0.79	82%	0.819	S	S	*	*			trans	-100.5	152.5	176.2	-112	-167.6	126.3	0	0	110.8
749	N	28.9	Very low	27.2	Very low	122 Å²	122	148.9 Å²	148.9	65%	0.652	82%	0.815	S	S	*	*			trans	60.2	112.1	142.5	-61.7	-34.7	0	0	0	121.1
750	I	26.2	Very low	27.1	Very low	168 Å²	168	150.4 Å²	150.4	86%	0.862	81%	0.811	S	S	*	*				-130.7	106.7	127.2	-60.5	-178.2	0	0	0	108.9
751	L	25.9	Very low	27.2	Very low	160 Å²	160	149.5 Å²	149.5	84%	0.838	81%	0.805	S	S	*	*				169.8	110.4	114.5	-152.9	77.1	0	0	0	110.9
752	R	27	Very low	26.6	Very low	242 Å²	242	149.6 Å²	149.6	91%	0.913	81%	0.808	S	S	*	*			trans	-140.5	120.2	166	-94.9	-169.3	177.8	176.9	4	110.1
753	T	26.7	Very low	26.5	Very low	139 Å²	139	150.8 Å²	150.8	85%	0.853	81%	0.814	S	S	*	*			trans	-173.9	133.2	163.1	-75	0	0	0	0	104.5
754	C	25.2	Very low	26.5	Very low	119 Å²	119	154.4 Å²	154.4	80%	0.804	82%	0.824	S	S	*	*			cis	-150	-164.5	19.6	-149.3	0	0	0	0	113.3
755	I	25.7	Very low	26.4	Very low	159 Å²	159	153.8 Å²	153.8	82%	0.815	83%	0.828	S	S	*	*			trans	85	74.7	172.2	-42.4	179.9	0	0	0	115.9
756	R	25	Very low	26.5	Very low	245 Å²	245	154.7 Å²	154.7	93%	0.925	82%	0.823	S	S	*	*			trans	-147.2	117.4	140.5	-95	-171.9	179.2	173.2	0.5	109.7
757	T	25.9	Very low	26.5	Very low	151 Å²	151	162.9 Å²	162.9	93%	0.926	83%	0.831	S	S	*	*			trans	-133.7	98.8	160.3	46.2	0	0	0	0	109
758	A	24.6	Very low	26.7	Very low	100 Å²	100	162.6 Å²	162.6	83%	0.826	84%	0.843	S	S	*	*			trans	-126.3	141.8	159.6	0	0	0	0	0	107.1
759	S	25.5	Very low	26.7	Very low	110 Å²	110	162.3 Å²	162.3	77%	0.769	85%	0.846	S	S	*	*			trans	-56.1	140.1	-169.7	-37.5	0	0	0	0	114
760	H	26.8	Very low	26.6	Very low	176 Å²	176	164.4 Å²	164.4	82%	0.815	86%	0.856	S	S	*	*				-171.3	153.1	102.6	-111.6	-93.2	0	0	0	113.1
761	S	27	Very low	26.6	Very low	97 Å²	97	164.2 Å²	164.2	68%	0.678	86%	0.856	S	S	*	*			trans	-81.8	143.6	179.3	44.2	0	0	0	0	113.3
762	S	27.7	Very low	26.6	Very low	111 Å²	111	164.4 Å²	164.4	78%	0.776	86%	0.857	S	S	*	*				179.5	138.3	126	-81.6	0	0	0	0	114.4
763	L	26.7	Very low	26.6	Very low	171 Å²	171	159.6 Å²	159.6	90%	0.895	85%	0.853	S	S	*	*			trans	62.8	95.3	150.9	-67.1	164.1	0	0	0	119.7
764	F	27.1	Very low	26.6	Very low	188 Å²	188	160.9 Å²	160.9	83%	0.825	85%	0.853	S	S	*	*			trans	-87.6	139.7	152.6	-119.7	-89.1	0	0	0	110.7	L766	F764-L766 HydrophobicContact CD1-CD1 3.77Å; F764-L766 HydrophobicContact CD1-CG 4.46Å; F764-L766 HydrophobicContact CE1-CD1 4Å; F764-L766 HydrophobicContact CE1-CG 4.41Å
765	K	26.8	Very low	26.7	Very low	209 Å²	209	163.9 Å²	163.9	91%	0.909	86%	0.857	S	S	*	*			trans	-152.7	117.8	150.1	-134.7	179.2	-175.3	-176.1	0	109.9
766	L	28.1	Very low	26.8	Very low	133 Å²	133	164.3 Å²	164.3	70%	0.696	86%	0.86	S	S	*	*			trans	-73.5	149.2	-178.8	-76.1	91.1	0	0	0	112.9	F764	F764-L766 HydrophobicContact CD1-CD1 3.77Å; F764-L766 HydrophobicContact CD1-CG 4.46Å; F764-L766 HydrophobicContact CE1-CD1 4Å; F764-L766 HydrophobicContact CE1-CG 4.41Å
767	R	26.2	Very low	26.9	Very low	244 Å²	244	157.6 Å²	157.6	92%	0.921	86%	0.855	S	S	*	*			trans	-172.8	137.3	132.2	-99	171	-176.9	-172.1	-1	105.8
768	V	30.8	Very low	27	Very low	201 Å²	201	158.2 Å²	158.2	100%	1.218	85%	0.848	S	S	*	*			cis	-121.4	0	7.9	172.6	0	0	0	0	109.2

Retrieved 768 of 768 residues in 183.6 ms (Link to these results)

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