A0A087YD40_POEFO Loading...

Mitochondrial import receptor subunit TOM70

AlphaFold DB , UniProt , Accession A0A087YD40, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 578 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	28.7	Very low	25.1	Very low	244 Å²	244	148.9 Å²	148.9	100%	1.202	87%	0.874	S	S	*	*				0	129.1	0	-75.4	-177.8	-176.6	0	0	107.8
2	A	29.2	Very low	24.9	Very low	102 Å²	102	142.4 Å²	142.4	84%	0.843	86%	0.862	S	S	*	*			trans	49.7	91.1	171.9	0	0	0	0	0	118.2
3	A	23.2	Very low	25	Very low	104 Å²	104	141.8 Å²	141.8	86%	0.86	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-80	123.6	158.2	0	0	0	0	0	109.5
4	S	26.2	Very low	24.8	Very low	121 Å²	121	136.3 Å²	136.3	85%	0.846	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-71	122.8	175.9	-44.5	0	0	0	0	110.1
5	K	24.7	Very low	24.7	Very low	191 Å²	191	136.9 Å²	136.9	83%	0.83	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-72.2	143.6	173.5	-73.7	179.9	174.8	-177.6	0	110.6
6	P	24.1	Very low	24.7	Very low	124 Å²	124	132.6 Å²	132.6	81%	0.805	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-72.8	138	170.4	29.8	-31.7	0	0	0	110.6
7	V	25.2	Very low	25	Very low	140 Å²	140	138.1 Å²	138.1	85%	0.848	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.5	177.6	175.6	0	0	0	0	108.7
8	E	22.3	Very low	25.3	Very low	170 Å²	170	135.7 Å²	135.7	79%	0.794	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.1	136.3	171.1	-73.4	178.5	165.4	0	0	110.5	Q10	E8-Q10 PolarHBondContact O-N 3.22Å
9	P	24.5	Very low	25.3	Very low	125 Å²	125	132.6 Å²	132.6	81%	0.812	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.3	124.4	174.9	27.2	-30.5	0	0	0	110.4
10	Q	23	Very low	25.3	Very low	192 Å²	192	127.8 Å²	127.8	90%	0.897	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-60.1	134.2	175.1	-68	-173.2	-12.4	0	0	111	E8 G12	E8-Q10 PolarHBondContact O-N 3.22Å; Q10-G12 PolarHBondContact O-N 2.87Å
11	S	24.7	Very low	25.2	Very low	125 Å²	125	123.7 Å²	123.7	87%	0.874	73%	0.727	S	S	*	*			trans	-67.3	96.3	177.5	43.8	0	0	0	0	111.5
12	G	23.5	Very low	25	Very low	71 Å²	71	116.7 Å²	116.7	73%	0.732	69%	0.694	S	S	*	*			trans	-66.7	132.4	162.7	0	0	0	0	0	110.5	Q10 G14	Q10-G12 PolarHBondContact O-N 2.87Å; G12-G14 PolarHBondContact O-N 2.65Å
13	S	26.1	Very low	24.8	Very low	135 Å²	135	114 Å²	114	94%	0.944	67%	0.665	S	S	*	*			trans	-70	67.4	176.2	56.6	0	0	0	0	111.9
14	G	22.4	Very low	24.8	Very low	64 Å²	64	113.3 Å²	113.3	66%	0.66	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-98.1	147.8	173.9	0	0	0	0	0	112	G12	G12-G14 PolarHBondContact O-N 2.65Å
15	L	23.4	Very low	24.7	Very low	146 Å²	146	109.4 Å²	109.4	76%	0.764	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-56.9	145	172	-74.7	158.7	0	0	0	110.9
16	P	24.4	Very low	24.5	Very low	68 Å²	68	101.5 Å²	101.5	44%	0.442	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-68.2	134.3	-175.1	26	-32.5	0	0	0	112.9	W18 Q19	P16-W18 PolarHBondContact O-N 2.88Å; P16-Q19 PolarHBondContact O-N 3.41Å; P16-Q19 VanDerWaalsContact O-N 3.14Å
17	R	30.1	Very low	24.7	Very low	226 Å²	226	96.9 Å²	96.9	85%	0.853	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-54.9	-11.9	-169.7	-67.2	178.2	174	173.2	-4.2	117.9	Q19	R17-Q19 VanDerWaalsContact C-N 3.32Å
18	W	29.7	Very low	24.6	Very low	95 Å²	95	95.6 Å²	95.6	36%	0.36	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-81.3	-12.6	177.1	64.9	-89	0	0	0	113.2	P16 L20 L30	P16-W18 PolarHBondContact O-N 2.88Å; W18-L20 VanDerWaalsContact C-N 3.28Å; W18-L20 PolarHBondContact O-N 3.09Å; W18-L30 HydrophobicContact CH2-CD1 3.79Å; W18-L30 HydrophobicContact CZ3-CD1 4.01Å
19	Q	26.2	Very low	24.7	Very low	76 Å²	76	88.3 Å²	88.3	36%	0.355	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-78.2	-8.7	174.8	-67.2	-177.3	-39.9	0	0	113.6	P16 R17	P16-Q19 PolarHBondContact O-N 3.41Å; P16-Q19 VanDerWaalsContact O-N 3.14Å; R17-Q19 VanDerWaalsContact C-N 3.32Å
20	L	24.7	Very low	24.7	Very low	36 Å²	36	86.5 Å²	86.5	19%	0.188	51%	0.506	C	S	.	.	S	Bend	trans	-98.9	-12.4	-177.3	-75.3	161.3	0	0	0	113.9	W18 L22 L23 L383 D385 R417	W18-L20 VanDerWaalsContact C-N 3.28Å; W18-L20 PolarHBondContact O-N 3.09Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.28Å; L20-L23 HydrophobicContact CD2-CD1 4.06Å; L20-L383 VanDerWaalsContact O-CD2 3.25Å; L20-L383 WeakPolarHBondContact O-CD2 3.31Å; L20-D385 HydrophobicContact CD1-CB 4.42Å; L20-R417 VanDerWaalsContact CD2-NH2 3.33Å
21	A	23.3	Very low	24.7	Very low	42 Å²	42	78.4 Å²	78.4	35%	0.347	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	11.7	-173	0	0	0	0	0	115.2
22	L	24.1	Very low	24.8	Very low	98 Å²	98	75.3 Å²	75.3	51%	0.513	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	17	178.6	-72.5	167.7	0	0	0	113.1	L20 V24	L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.28Å; L22-V24 VanDerWaalsContact C-N 3.25Å; L22-V24 PolarHBondContact O-N 3.47Å; L22-V24 VanDerWaalsContact O-N 3.07Å
23	L	25.1	Very low	24.8	Very low	45 Å²	45	74.5 Å²	74.5	24%	0.236	44%	0.442	C	S	.	.			trans	-83.1	33.1	-171.1	-94.5	167.4	0	0	0	115.7	L20 L383 F413	L20-L23 HydrophobicContact CD2-CD1 4.06Å; L23-L383 HydrophobicContact CB-CD2 3.82Å; L23-F413 HydrophobicContact CD2-CE1 4.12Å; L23-F413 HydrophobicContact CD2-CZ 4Å
24	V	24.1	Very low	24.9	Very low	90 Å²	90	70.8 Å²	70.8	55%	0.545	42%	0.419	S	S	.	.	S	Bend	trans	-130.8	92	157.4	-174.8	0	0	0	0	106.7	L22	L22-V24 VanDerWaalsContact C-N 3.25Å; L22-V24 PolarHBondContact O-N 3.47Å; L22-V24 VanDerWaalsContact O-N 3.07Å
25	G	22.8	Very low	25	Very low	38 Å²	38	72 Å²	72	39%	0.392	41%	0.414	S	S	.	.	S	Bend	trans	95.3	42.1	170.4	0	0	0	0	0	118
26	A	21.9	Very low	25.3	Very low	26 Å²	26	71.1 Å²	71.1	22%	0.215	40%	0.401	C	S	.	.			trans	-179.9	99.3	163	0	0	0	0	0	114.1	I28 F516	A26-I28 PolarHBondContact O-N 2.84Å; A26-F516 HydrophobicContact CB-CD1 3.89Å; A26-F516 HydrophobicContact CB-CD2 3.33Å; A26-F516 HydrophobicContact CB-CE1 3.87Å; A26-F516 HydrophobicContact CB-CE2 3.32Å; A26-F516 HydrophobicContact CB-CG 3.63Å; A26-F516 HydrophobicContact CB-CZ 3.59Å
27	P	27.8	Very low	25.5	Very low	26 Å²	26	72.5 Å²	72.5	17%	0.169	40%	0.4	C	S	.	.			trans	-80.8	118.1	168.8	21.2	-8.6	0	0	0	111.7	Q454 H485 L488	P27-Q454 HydrophobicContact CG-CG 4.11Å; P27-H485 WeakPolarHBondContact CD-CE1 3.26Å; P27-H485 WeakPolarHBondContact CD-ND1 3.4Å; P27-L488 VanDerWaalsContact O-CD1 3.31Å; P27-L488 WeakPolarHBondContact O-CD1 3.34Å
28	I	23.5	Very low	25.2	Very low	113 Å²	113	71.2 Å²	71.2	58%	0.579	40%	0.396	S	S	*	.				57.1	96	129.5	-47.5	169.8	0	0	0	117	A26	A26-I28 PolarHBondContact O-N 2.84Å
29	V	23.9	Very low	25.1	Very low	17 Å²	17	72.3 Å²	72.3	10%	0.103	41%	0.408	C	S	.	.	S	Bend	trans	-111.8	-2.5	157.1	-154.5	0	0	0	0	113.2	G31 L488 T520 T523	V29-G31 PolarHBondContact O-N 3.2Å; V29-L488 HydrophobicContact CG1-CD2 4.3Å; V29-L488 HydrophobicContact CG2-CD1 4.04Å; V29-L488 HydrophobicContact CG2-CD2 3.85Å; V29-T520 HydrophobicContact CG2-CG2 4Å; V29-T523 HydrophobicContact CB-CG2 4.09Å; V29-T523 HydrophobicContact CG1-CG2 3.35Å
30	L	24.2	Very low	25.1	Very low	88 Å²	88	77.9 Å²	77.9	46%	0.461	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-6.1	177.5	-64.6	170.5	0	0	0	113.8	W18	W18-L30 HydrophobicContact CH2-CD1 3.79Å; W18-L30 HydrophobicContact CZ3-CD1 4.01Å
31	G	23.1	Very low	25.4	Very low	22 Å²	22	82.7 Å²	82.7	23%	0.227	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-22.6	-176	0	0	0	0	0	116.3	V29 G33 A34 V35	V29-G31 PolarHBondContact O-N 3.2Å; G31-G33 PolarHBondContact O-N 3.19Å; G31-A34 PolarHBondContact O-N 2.72Å; G31-V35 VanDerWaalsContact O-CG2 3.31Å; G31-V35 WeakPolarHBondContact O-CG2 3.29Å; G31-V35 PolarHBondContact O-N 3.33Å
32	V	25.9	Very low	25.6	Very low	59 Å²	59	89.3 Å²	89.3	36%	0.358	47%	0.473	S	S	.	.	H	α-helix	trans	-68.3	-35.5	-169	-178.2	0	0	0	0	112	Y36	V32-Y36 WeakPolarHBondContact O-CB 3.39Å; V32-Y36 PolarHBondContact O-N 3.43Å
33	G	25	Very low	25.9	Very low	55 Å²	55	90.4 Å²	90.4	57%	0.567	48%	0.484	S	S	*	.	H	α-helix	trans	-69.8	-35.6	176	0	0	0	0	0	114.1	G31	G31-G33 PolarHBondContact O-N 3.19Å
34	A	26.6	Very low	26	Very low	57 Å²	57	98 Å²	98	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-78	-37.6	-179	0	0	0	0	0	112.3	G31 W38	G31-A34 PolarHBondContact O-N 2.72Å; A34-W38 PolarHBondContact O-N 3.06Å
35	V	26.1	Very low	26.2	Very low	89 Å²	89	102.5 Å²	102.5	54%	0.539	53%	0.53	S	S	.	.	H	α-helix	trans	-70.2	-36.4	179.3	173.9	0	0	0	0	111.6	G31 F37 W38 N39	G31-V35 VanDerWaalsContact O-CG2 3.31Å; G31-V35 WeakPolarHBondContact O-CG2 3.29Å; G31-V35 PolarHBondContact O-N 3.33Å; V35-F37 PolarHBondContact O-N 3.35Å; V35-W38 PolarHBondContact O-N 3.36Å; V35-N39 PolarHBondContact O-N 3.4Å
36	Y	28.7	Very low	26.4	Very low	128 Å²	128	106.8 Å²	106.8	50%	0.502	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-37.9	177	-172.2	-97.4	0	0	0	112.8	V32	V32-Y36 WeakPolarHBondContact O-CB 3.39Å; V32-Y36 PolarHBondContact O-N 3.43Å
37	F	28	Very low	26.7	Very low	96 Å²	96	115.5 Å²	115.5	42%	0.421	58%	0.584	S	S	.	*	H	α-helix	trans	-76	-30.8	179	-130.5	-88.2	0	0	0	113	V35 A188	V35-F37 PolarHBondContact O-N 3.35Å; F37-A188 HydrophobicContact CZ-CB 4.27Å
38	W	25.3	Very low	26.7	Very low	200 Å²	200	117.9 Å²	117.9	76%	0.758	61%	0.613	S	S	*	*	H	α-helix	trans	-74	-37	-178.6	-144.4	-41.7	0	0	0	112.6	A34 V35 R40 N41	A34-W38 PolarHBondContact O-N 3.06Å; V35-W38 PolarHBondContact O-N 3.36Å; W38-R40 VanDerWaalsContact C-N 3.34Å; W38-R40 PolarHBondContact O-N 2.67Å; W38-N41 PolarHBondContact O-N 3.49Å
39	N	25.9	Very low	27.1	Very low	118 Å²	118	119.7 Å²	119.7	63%	0.631	63%	0.63	S	S	*	*	H	α-helix	trans	-73	-20.8	-178	-92.8	-8.7	0	0	0	114.3	V35 N41	V35-N39 PolarHBondContact O-N 3.4Å; N39-N41 VanDerWaalsContact C-N 3.34Å; N39-N41 PolarHBondContact O-N 3.37Å
40	R	27.9	Very low	27.2	Very low	193 Å²	193	122.2 Å²	122.2	73%	0.728	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-77.2	-17.4	178.3	-164.4	172.7	173	163.1	-1.1	113.8	W38	W38-R40 VanDerWaalsContact C-N 3.34Å; W38-R40 PolarHBondContact O-N 2.67Å
41	N	29.3	Very low	27.3	Very low	137 Å²	137	126.5 Å²	126.5	73%	0.733	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-91.9	3.1	-177.2	-89.8	-2.4	0	0	0	114.9	W38 N39	W38-N41 PolarHBondContact O-N 3.49Å; N39-N41 VanDerWaalsContact C-N 3.34Å; N39-N41 PolarHBondContact O-N 3.37Å
42	K	27.6	Very low	27.4	Very low	180 Å²	180	137.3 Å²	137.3	78%	0.783	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-87.2	1.6	179.1	-95.6	-173.7	177.5	178.1	0	115.9
43	T	30.6	Very low	27.5	Very low	122 Å²	122	143.4 Å²	143.4	75%	0.748	73%	0.732	S	S	*	*			trans	-122.9	70.7	176.3	54	0	0	0	0	112.5
44	K	27.6	Very low	27.5	Very low	205 Å²	205	146.7 Å²	146.7	89%	0.891	74%	0.741	S	S	*	*			trans	-148.5	111.5	148.1	-73.9	-163.8	178.8	171.4	0	110.1
45	E	27.9	Very low	27.6	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	76%	0.76	S	S	*	*			trans	-61.5	155	166.9	-81.5	-170.6	157	0	0	112.3
46	P	27.3	Very low	27.6	Very low	128 Å²	128	155.4 Å²	155.4	83%	0.831	78%	0.778	S	S	*	*			trans	-80.1	128	-173.5	32.8	-32.3	0	0	0	111
47	K	29.4	Very low	27.6	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	79%	0.79	S	S	*	*			trans	-107.6	110.1	167.7	-81	-171.2	176.4	-178.5	0	111.1
48	G	27.2	Very low	27.6	Very low	75 Å²	75	154 Å²	154	77%	0.773	81%	0.811	S	S	*	*			trans	58.1	103.7	131.2	0	0	0	0	0	118.5	G50	G48-G50 PolarHBondContact O-N 3.08Å
49	T	30.8	Very low	27.7	Very low	151 Å²	151	149.1 Å²	149.1	93%	0.926	81%	0.813	S	S	*	*			trans	-56.8	112.3	162.3	46.5	0	0	0	0	111.3
50	G	25.9	Very low	27.8	Very low	70 Å²	70	149 Å²	149	72%	0.722	82%	0.822	S	S	*	*			trans	-120.7	95.8	170.2	0	0	0	0	0	110.1	G48 R52	G48-G50 PolarHBondContact O-N 3.08Å; G50-R52 PolarHBondContact O-N 3.32Å
51	E	27	Very low	28.1	Very low	178 Å²	178	145.5 Å²	145.5	83%	0.832	82%	0.824	S	S	*	*			trans	-57.7	124.4	169.6	-69.2	178.3	148.2	0	0	110.3
52	R	26.3	Very low	28.1	Very low	249 Å²	249	146 Å²	146	94%	0.94	83%	0.831	S	S	*	*			trans	-107.1	105	164.3	-102.8	-178.5	177.1	174.7	-0.6	109.4	G50	G50-R52 PolarHBondContact O-N 3.32Å
53	K	26.8	Very low	28.2	Very low	187 Å²	187	146.4 Å²	146.4	81%	0.813	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.4	170.1	-66.1	177.1	176.8	179.7	0	110.3
54	T	25.8	Very low	28.3	Very low	124 Å²	124	144.1 Å²	144.1	76%	0.761	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-70.6	136.9	163.3	41.6	0	0	0	0	109.8	E56	T54-E56 PolarHBondContact O-N 3.35Å
55	P	28.2	Very low	29	Very low	131 Å²	131	143.2 Å²	143.2	85%	0.851	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-79.1	119.9	169.6	10.1	4.4	0	0	0	109.9
56	E	26.8	Very low	29.4	Very low	198 Å²	198	141.1 Å²	141.1	93%	0.925	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-66	123.7	161	-72.7	175.6	148.2	0	0	109.1	T54	T54-E56 PolarHBondContact O-N 3.35Å
57	G	28.2	Very low	29.9	Very low	74 Å²	74	138.2 Å²	138.2	76%	0.763	82%	0.824	S	S	*	*			trans	-118.2	110.6	171.1	0	0	0	0	0	109.3
58	S	28	Very low	30.3	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	81%	0.813	S	S	*	*			trans	-42.1	133.4	179.5	50.9	0	0	0	0	115.9
59	A	27.4	Very low	30.8	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	81%	0.808	S	S	*	*			trans	-87	139.7	162.8	0	0	0	0	0	111
60	S	27.1	Very low	31.3	Very low	117 Å²	117	136 Å²	136	82%	0.818	80%	0.799	S	S	*	*			trans	-150.5	150.9	152.4	-80.2	0	0	0	0	109.4
61	P	35	Very low	32.3	Very low	119 Å²	119	135.5 Å²	135.5	77%	0.773	79%	0.785	S	S	*	*			trans	-95.7	146.7	-145.9	35.8	-32.3	0	0	0	112.6
62	V	30.2	Very low	33.1	Very low	146 Å²	146	132 Å²	132	89%	0.885	77%	0.771	S	S	*	*			trans	-119.7	109.3	162.6	178.5	0	0	0	0	108
63	Q	29.8	Very low	34	Very low	190 Å²	190	129.7 Å²	129.7	89%	0.888	76%	0.763	S	S	*	*			trans	-70.4	148	158.3	-75.3	176.6	-23.6	0	0	109.1
64	G	30.8	Very low	35.2	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	76%	0.755	S	S	*	*			trans	141.6	103.3	160	0	0	0	0	0	113.2
65	Q	42.2	Very low	36.4	Very low	186 Å²	186	126.9 Å²	126.9	87%	0.869	74%	0.744	S	S	*	*			trans	-33.9	127.2	166.2	-71.7	159.1	-28.5	0	0	113.9
66	D	36.9	Very low	37.6	Very low	140 Å²	140	128 Å²	128	75%	0.749	74%	0.738	S	S	*	*			trans	173	70.8	141.9	-88.4	-20.6	0	0	0	109.5
67	G	37.8	Very low	39.3	Very low	68 Å²	68	126 Å²	126	70%	0.701	73%	0.733	S	S	*	*			trans	-100.1	-8.4	-171.7	0	0	0	0	0	116.3
68	A	38.5	Very low	41.6	Very low	82 Å²	82	125.3 Å²	125.3	68%	0.678	71%	0.711	S	S	*	*	S	Bend	trans	-99.3	-22.1	-168.7	0	0	0	0	0	114.7
69	T	38	Very low	44.4	Very low	110 Å²	110	121.8 Å²	121.8	68%	0.675	69%	0.686	S	S	*	*	S	Bend	trans	-104.7	-12.6	-174.8	33.8	0	0	0	0	114.2
70	R	39.9	Very low	47.4	Very low	195 Å²	195	120.6 Å²	120.6	74%	0.736	67%	0.67	S	S	*	*	S	Bend	trans	-83.9	-33.4	175.1	-110.8	177.8	177.6	167.2	-1.4	113.6	N72 R73	R70-N72 VanDerWaalsContact C-N 3.34Å; R70-N72 PolarHBondContact O-N 2.93Å; R70-R73 PolarHBondContact O-N 3.26Å
71	S	46.7	Very low	50.4	Low	60 Å²	60	117 Å²	117	42%	0.42	64%	0.642	S	S	.	*	H	α-helix	trans	-68.4	-30.8	-176.1	76.8	0	0	0	0	113.6
72	N	45.3	Very low	53.1	Low	104 Å²	104	115.3 Å²	115.3	56%	0.556	63%	0.626	S	S	*	*	H	α-helix	trans	-76.6	-25.9	-179.4	-78.4	6.4	0	0	0	113.6	R70	R70-N72 VanDerWaalsContact C-N 3.34Å; R70-N72 PolarHBondContact O-N 2.93Å
73	R	44.8	Very low	56	Low	202 Å²	202	113 Å²	113	76%	0.762	60%	0.601	S	S	*	*	H	α-helix	trans	-79.9	-24.6	178.4	-79.3	-174.4	177.2	179.2	0.5	113.2	R70	R70-R73 PolarHBondContact O-N 3.26Å
74	E	51	Low	59.1	Low	137 Å²	137	103.9 Å²	103.9	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-76.4	-33.6	176.5	-72.4	176.4	177.2	0	0	111.7	E76 N77 M78	E74-E76 PolarHBondContact O-N 3.32Å; E74-N77 PolarHBondContact O-N 3.44Å; E74-M78 VanDerWaalsContact O-CG 3.26Å; E74-M78 WeakPolarHBondContact O-CG 3.3Å
75	E	51.4	Low	62.1	Low	114 Å²	114	102.9 Å²	102.9	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-31.3	176.9	-75.1	-176.6	166.8	0	0	113.7	N77 M78 R83	E75-N77 VanDerWaalsContact C-N 3.3Å; E75-N77 PolarHBondContact O-N 2.92Å; E75-M78 HydrophobicContact CG-CE 4.27Å; E75-R83 PolarHBondContact O-NE 3.22Å; E75-R83 VanDerWaalsContact O-NE 3.11Å; E75-R83 PolarHBondContact O-NH2 3.21Å
76	E	53.7	Low	64.6	Low	155 Å²	155	96.2 Å²	96.2	72%	0.724	51%	0.511	S	S	*	.	H	α-helix	trans	-68.4	-25.1	-179.5	-78.2	-178.8	164	0	0	113.4	E74 R83	E74-E76 PolarHBondContact O-N 3.32Å; E76-R83 PolarHBondContact O-NH2 2.71Å
77	N	61.7	Low	67.4	Low	155 Å²	155	89.7 Å²	89.7	83%	0.829	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	5.3	-176.7	-131.1	8.3	0	0	0	114.1	E74 E75	E74-N77 PolarHBondContact O-N 3.44Å; E75-N77 VanDerWaalsContact C-N 3.3Å; E75-N77 PolarHBondContact O-N 2.92Å
78	M	77.1	Confident	70.2	Confident	61 Å²	61	88.1 Å²	88.1	30%	0.3	45%	0.451	S	S	.	.			trans	-80.2	140.1	179.3	-71.4	-145.7	-70.5	0	0	112.5	E74 E75 D82 R83 A86	E74-M78 VanDerWaalsContact O-CG 3.26Å; E74-M78 WeakPolarHBondContact O-CG 3.3Å; E75-M78 HydrophobicContact CG-CE 4.27Å; M78-D82 HydrophobicContact CB-CB 4.09Å; M78-D82 HydrophobicContact CG-CB 4.45Å; M78-D82 HydrophobicContact SD-CB 3.97Å; M78-R83 HydrophobicContact CB-CG 3.81Å; M78-R83 HydrophobicContact CE-CG 4.16Å; M78-R83 PolarHBondContact O-NE 2.97Å; M78-A86 HydrophobicContact CE-CB 4.29Å
79	S	88.2	Confident	73	Confident	46 Å²	46	87.7 Å²	87.7	32%	0.322	44%	0.437	S	S	.	.			trans	-63.3	156.5	172.6	78.4	0	0	0	0	111	L81 D82 R83	S79-L81 PolarHBondContact O-N 3.12Å; S79-D82 WeakPolarHBondContact CB-OD2 3.36Å; S79-D82 PolarHBondContact N-OD2 3.01Å; S79-D82 PolarHBondContact O-N 3.3Å; S79-D82 PolarHBondContact OG-N 3.46Å; S79-D82 VanDerWaalsContact OG-N 3.15Å; S79-D82 PolarHBondContact OG-OD2 2.97Å; S79-R83 PolarHBondContact O-N 2.94Å
80	P	89.1	Confident	75.8	Confident	72 Å²	72	87.3 Å²	87.3	47%	0.468	43%	0.426	S	S	.	.	H	α-helix	trans	-53.8	-36.3	175.4	-27.5	35.5	0	0	0	113.2	A84 P115	P80-A84 WeakPolarHBondContact O-CB 3.31Å; P80-A84 PolarHBondContact O-N 2.96Å; P80-P115 HydrophobicContact CB-CG 4.08Å
81	L	90.6	Very high	78.6	Confident	42 Å²	42	78 Å²	78	22%	0.22	39%	0.391	C	S	.	.	H	α-helix	trans	-67.5	-42.8	176.1	-177.1	64.9	0	0	0	112.1	S79 R83 A84 Q85 H118 D121	S79-L81 PolarHBondContact O-N 3.12Å; L81-R83 VanDerWaalsContact C-N 3.32Å; L81-R83 PolarHBondContact O-N 2.8Å; L81-A84 WeakPolarHBondContact O-CB 3.46Å; L81-A84 PolarHBondContact O-N 3.45Å; L81-Q85 WeakPolarHBondContact O-CB 3.49Å; L81-Q85 PolarHBondContact O-N 3.02Å; L81-H118 HydrophobicContact CD1-CB 4.22Å; L81-D121 HydrophobicContact CD1-CB 4.23Å
82	D	91.4	Very high	81	Confident	83 Å²	83	77.4 Å²	77.4	44%	0.444	38%	0.383	S	S	.	.	H	α-helix	trans	-64.4	-39.1	178	-63.3	-45.2	0	0	0	111.4	M78 S79 Q85 A86	M78-D82 HydrophobicContact CB-CB 4.09Å; M78-D82 HydrophobicContact CG-CB 4.45Å; M78-D82 HydrophobicContact SD-CB 3.97Å; S79-D82 WeakPolarHBondContact CB-OD2 3.36Å; S79-D82 PolarHBondContact N-OD2 3.01Å; S79-D82 PolarHBondContact O-N 3.3Å; S79-D82 PolarHBondContact OG-N 3.46Å; S79-D82 VanDerWaalsContact OG-N 3.15Å; S79-D82 PolarHBondContact OG-OD2 2.97Å; D82-Q85 PolarHBondContact O-N 3.35Å; D82-A86 WeakPolarHBondContact O-CB 3.4Å; D82-A86 PolarHBondContact O-N 2.96Å
83	R	92.1	Very high	83.5	Confident	97 Å²	97	80 Å²	80	37%	0.366	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-45.3	173.1	-66.6	-178.9	178.7	162	5.4	111.6	E75 E76 M78 S79 L81 Q85 A86 A87 L113	E75-R83 PolarHBondContact O-NE 3.22Å; E75-R83 VanDerWaalsContact O-NE 3.11Å; E75-R83 PolarHBondContact O-NH2 3.21Å; E76-R83 PolarHBondContact O-NH2 2.71Å; M78-R83 HydrophobicContact CB-CG 3.81Å; M78-R83 HydrophobicContact CE-CG 4.16Å; M78-R83 PolarHBondContact O-NE 2.97Å; S79-R83 PolarHBondContact O-N 2.94Å; L81-R83 VanDerWaalsContact C-N 3.32Å; L81-R83 PolarHBondContact O-N 2.8Å; R83-Q85 VanDerWaalsContact C-N 3.27Å; R83-Q85 PolarHBondContact O-N 3.37Å; R83-A86 PolarHBondContact O-N 2.97Å; R83-A87 PolarHBondContact O-N 2.61Å; R83-L113 HydrophobicContact CB-CD1 4.07Å
84	A	94.2	Very high	86.1	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.6	-40.3	174.2	0	0	0	0	0	111.7	P80 L81 A87 K88 A110 L113 C114 F125	P80-A84 WeakPolarHBondContact O-CB 3.31Å; P80-A84 PolarHBondContact O-N 2.96Å; L81-A84 WeakPolarHBondContact O-CB 3.46Å; L81-A84 PolarHBondContact O-N 3.45Å; A84-A87 PolarHBondContact O-N 3.18Å; A84-K88 PolarHBondContact O-N 2.86Å; A84-A110 WeakPolarHBondContact CB-O 3.37Å; A84-A110 WeakPolarHBondContact O-CB 3.49Å; A84-L113 HydrophobicContact CB-CB 3.91Å; A84-C114 HydrophobicContact CB-CB 4.13Å; A84-F125 HydrophobicContact CB-CE2 3.8Å; A84-F125 HydrophobicContact CB-CZ 4.24Å
85	Q	94.1	Very high	88.3	Confident	51 Å²	51	70 Å²	70	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-68.2	-38.8	178.5	-169.9	44.8	94.2	0	0	111.7	L81 D82 R83 K88 N89	L81-Q85 WeakPolarHBondContact O-CB 3.49Å; L81-Q85 PolarHBondContact O-N 3.02Å; D82-Q85 PolarHBondContact O-N 3.35Å; R83-Q85 VanDerWaalsContact C-N 3.27Å; R83-Q85 PolarHBondContact O-N 3.37Å; Q85-K88 PolarHBondContact O-N 3.25Å; Q85-N89 PolarHBondContact NE2-OD1 3.12Å; Q85-N89 VanDerWaalsContact O-CG 3.29Å; Q85-N89 PolarHBondContact O-N 3.09Å; Q85-N89 PolarHBondContact O-ND2 3.24Å
86	A	94.4	Very high	90.5	Very high	46 Å²	46	73.4 Å²	73.4	38%	0.38	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-45.8	172	0	0	0	0	0	111.5	M78 D82 R83 K88 N89 K90	M78-A86 HydrophobicContact CE-CB 4.29Å; D82-A86 WeakPolarHBondContact O-CB 3.4Å; D82-A86 PolarHBondContact O-N 2.96Å; R83-A86 PolarHBondContact O-N 2.97Å; A86-K88 PolarHBondContact O-N 2.89Å; A86-N89 PolarHBondContact O-N 3.33Å; A86-N89 VanDerWaalsContact O-N 3.14Å; A86-K90 PolarHBondContact O-N 3.17Å
87	A	95.6	Very high	92.5	Very high	4 Å²	4	68.9 Å²	68.9	3%	0.033	35%	0.351	C	S	.	.	H	α-helix	trans	-60.1	-43.9	176.2	0	0	0	0	0	112	R83 A84 N89 K90 G91 E109 A110	R83-A87 PolarHBondContact O-N 2.61Å; A84-A87 PolarHBondContact O-N 3.18Å; A87-N89 PolarHBondContact O-N 3.46Å; A87-K90 WeakPolarHBondContact O-CB 3.5Å; A87-K90 PolarHBondContact O-N 2.97Å; A87-G91 PolarHBondContact O-N 2.9Å; A87-E109 HydrophobicContact CB-CB 4.42Å; A87-E109 HydrophobicContact CB-CG 4.19Å; A87-A110 HydrophobicContact CB-CB 3.87Å
88	K	96.9	Very high	94.2	Very high	34 Å²	34	63.3 Å²	63.3	15%	0.148	33%	0.33	C	S	.	.	H	α-helix	trans	-56.5	-47.5	171.8	-175	-147.7	81.3	-167.5	0	111.7	A84 Q85 A86 K90 G91 N92 Y107 A110 F125	A84-K88 PolarHBondContact O-N 2.86Å; Q85-K88 PolarHBondContact O-N 3.25Å; A86-K88 PolarHBondContact O-N 2.89Å; K88-K90 VanDerWaalsContact C-N 3.31Å; K88-K90 PolarHBondContact O-N 3.11Å; K88-G91 WeakPolarHBondContact O-CA 3.32Å; K88-G91 PolarHBondContact O-N 3.49Å; K88-N92 PolarHBondContact O-N 3.38Å; K88-Y107 HydrophobicContact CG-CD1 4.48Å; K88-Y107 HydrophobicContact CG-CE1 4.31Å; K88-A110 HydrophobicContact CB-CB 4.38Å; K88-F125 HydrophobicContact CB-CD1 4.02Å; K88-F125 HydrophobicContact CB-CE1 3.88Å; K88-F125 HydrophobicContact CD-CD1 3.95Å; K88-F125 HydrophobicContact CD-CE1 3.71Å; K88-F125 HydrophobicContact CG-CD1 3.82Å; K88-F125 HydrophobicContact CG-CE1 3.92Å
89	N	97	Very high	95.2	Very high	73 Å²	73	65.8 Å²	65.8	39%	0.39	34%	0.339	S	S	.	.	H	α-helix	trans	-65.7	-35.9	-178.4	-72.1	-26.6	0	0	0	111.9	Q85 A86 A87 N92 K93	Q85-N89 PolarHBondContact NE2-OD1 3.12Å; Q85-N89 VanDerWaalsContact O-CG 3.29Å; Q85-N89 PolarHBondContact O-N 3.09Å; Q85-N89 PolarHBondContact O-ND2 3.24Å; A86-N89 PolarHBondContact O-N 3.33Å; A86-N89 VanDerWaalsContact O-N 3.14Å; A87-N89 PolarHBondContact O-N 3.46Å; N89-N92 PolarHBondContact O-N 3.46Å; N89-K93 WeakPolarHBondContact O-CG 3.17Å; N89-K93 PolarHBondContact O-N 2.97Å; N89-K93 VanDerWaalsContact O-N 3.14Å
90	K	97.3	Very high	95.6	Very high	102 Å²	102	66.6 Å²	66.6	44%	0.443	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-44	171	-170.5	-179.1	178.9	-177.7	0	111.3	A86 A87 K88 N92 K93 Y94	A86-K90 PolarHBondContact O-N 3.17Å; A87-K90 WeakPolarHBondContact O-CB 3.5Å; A87-K90 PolarHBondContact O-N 2.97Å; K88-K90 VanDerWaalsContact C-N 3.31Å; K88-K90 PolarHBondContact O-N 3.11Å; K90-N92 PolarHBondContact O-N 2.96Å; K90-K93 WeakPolarHBondContact O-CB 3.31Å; K90-K93 PolarHBondContact O-N 3.11Å; K90-Y94 HydrophobicContact CG-CD2 4.34Å; K90-Y94 HydrophobicContact CG-CE2 3.95Å; K90-Y94 WeakPolarHBondContact O-CD2 2.99Å; K90-Y94 PolarHBondContact O-N 3.37Å; K90-Y94 VanDerWaalsContact O-N 3.15Å
91	G	97.6	Very high	96.1	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57	-46	172.4	0	0	0	0	0	112.7	A87 K88 K93 Y94 F95 C106 Y107	A87-G91 PolarHBondContact O-N 2.9Å; K88-G91 WeakPolarHBondContact O-CA 3.32Å; K88-G91 PolarHBondContact O-N 3.49Å; G91-K93 VanDerWaalsContact C-N 3.3Å; G91-K93 PolarHBondContact O-N 3.22Å; G91-Y94 PolarHBondContact O-N 3.03Å; G91-Y94 VanDerWaalsContact O-N 3.13Å; G91-F95 WeakPolarHBondContact O-CB 3.39Å; G91-F95 PolarHBondContact O-N 2.8Å; G91-C106 VanDerWaalsContact CA-CB 3.5Å; G91-Y107 PolarHBondContact O-OH 3.35Å
92	N	97.7	Very high	96.4	Very high	47 Å²	47	70.5 Å²	70.5	25%	0.251	35%	0.348	S	S	.	.	H	α-helix	trans	-59.2	-38.2	176.6	-74.1	-6.8	0	0	0	112.5	K88 N89 K90 F95 K96 Y107	K88-N92 PolarHBondContact O-N 3.38Å; N89-N92 PolarHBondContact O-N 3.46Å; K90-N92 PolarHBondContact O-N 2.96Å; N92-F95 PolarHBondContact O-N 2.65Å; N92-K96 WeakPolarHBondContact O-CG 3.23Å; N92-K96 PolarHBondContact O-N 2.96Å; N92-Y107 WeakPolarHBondContact CA-OH 3.46Å; N92-Y107 PolarHBondContact N-OH 2.9Å; N92-Y107 PolarHBondContact OD1-OH 3.14Å
93	K	97.9	Very high	96.7	Very high	159 Å²	159	66.6 Å²	66.6	69%	0.691	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-45.2	175.3	-70	175.9	-176.3	179.6	0	111.1	N89 K90 G91 A97	N89-K93 WeakPolarHBondContact O-CG 3.17Å; N89-K93 PolarHBondContact O-N 2.97Å; N89-K93 VanDerWaalsContact O-N 3.14Å; K90-K93 WeakPolarHBondContact O-CB 3.31Å; K90-K93 PolarHBondContact O-N 3.11Å; G91-K93 VanDerWaalsContact C-N 3.3Å; G91-K93 PolarHBondContact O-N 3.22Å; K93-A97 WeakPolarHBondContact O-CB 3.5Å; K93-A97 PolarHBondContact O-N 3.04Å; K93-A97 VanDerWaalsContact O-N 3.13Å
94	Y	98.1	Very high	97	Very high	70 Å²	70	62.7 Å²	62.7	28%	0.275	31%	0.313	S	S	.	.	H	α-helix	trans	-67.5	-37.8	176.6	-73.9	-53.7	0	0	0	113	K90 G91 A97 G98 K99 K102	K90-Y94 HydrophobicContact CG-CD2 4.34Å; K90-Y94 HydrophobicContact CG-CE2 3.95Å; K90-Y94 WeakPolarHBondContact O-CD2 2.99Å; K90-Y94 PolarHBondContact O-N 3.37Å; K90-Y94 VanDerWaalsContact O-N 3.15Å; G91-Y94 PolarHBondContact O-N 3.03Å; G91-Y94 VanDerWaalsContact O-N 3.13Å; Y94-A97 CarbonylContact O-C 3.59Å; Y94-A97 PolarHBondContact O-N 2.91Å; Y94-A97 VanDerWaalsContact O-N 3.14Å; Y94-G98 PolarHBondContact O-N 2.78Å; Y94-K99 HydrophobicContact CD1-CB 4.16Å; Y94-K99 HydrophobicContact CD1-CD 4.13Å; Y94-K99 PolarHBondContact O-N 3.43Å; Y94-K102 HydrophobicContact CD1-CB 4.06Å; Y94-K102 HydrophobicContact CD1-CD 4.24Å; Y94-K102 HydrophobicContact CD2-CB 3.85Å; Y94-K102 HydrophobicContact CE1-CB 4.41Å; Y94-K102 HydrophobicContact CE1-CD 3.96Å; Y94-K102 HydrophobicContact CE2-CB 4.19Å; Y94-K102 HydrophobicContact CG-CB 3.78Å
95	F	97.8	Very high	97.2	Very high	58 Å²	58	69 Å²	69	25%	0.254	34%	0.343	S	S	.	.	H	α-helix	trans	-60.3	-48.3	175.8	-175.2	-88.1	0	0	0	111.1	G91 N92 A97 G98 Y100 A103 A131 A132 Q135	G91-F95 WeakPolarHBondContact O-CB 3.39Å; G91-F95 PolarHBondContact O-N 2.8Å; N92-F95 PolarHBondContact O-N 2.65Å; F95-A97 PolarHBondContact O-N 3.38Å; F95-G98 PolarHBondContact O-N 3.18Å; F95-Y100 AromaticContact CD2-CD1 3.88Å; F95-Y100 HydrophobicContact CD2-CD1 3.88Å; F95-Y100 AromaticContact CD2-CE1 3.97Å; F95-Y100 HydrophobicContact CD2-CE1 3.97Å; F95-Y100 HydrophobicContact CE2-CD1 4.09Å; F95-Y100 AromaticContact CE2-CE1 3.95Å; F95-Y100 HydrophobicContact CE2-CE1 3.95Å; F95-Y100 HydrophobicContact CG-CE1 4.44Å; F95-Y100 HydrophobicContact CZ-CE1 4.41Å; F95-A103 HydrophobicContact CB-CB 4.08Å; F95-A131 HydrophobicContact CE2-CB 4.07Å; F95-A131 HydrophobicContact CZ-CB 4.26Å; F95-A132 HydrophobicContact CD2-CB 4.04Å; F95-A132 HydrophobicContact CE2-CB 4.24Å; F95-Q135 HydrophobicContact CE2-CG 3.98Å; F95-Q135 HydrophobicContact CZ-CG 4.07Å
96	K	97.6	Very high	97.4	Very high	186 Å²	186	66.9 Å²	66.9	81%	0.809	33%	0.334	S	S	*	.	H	α-helix	trans	-61.7	-29.8	174.8	-73.2	-179.4	179.4	-174	0	113	N92 G98	N92-K96 WeakPolarHBondContact O-CG 3.23Å; N92-K96 PolarHBondContact O-N 2.96Å; K96-G98 VanDerWaalsContact C-N 3.27Å; K96-G98 PolarHBondContact O-N 3.15Å
97	A	97.1	Very high	97.6	Very high	61 Å²	61	64.9 Å²	64.9	50%	0.504	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	5.6	176.3	0	0	0	0	0	113.8	K93 Y94 F95 K99	K93-A97 WeakPolarHBondContact O-CB 3.5Å; K93-A97 PolarHBondContact O-N 3.04Å; K93-A97 VanDerWaalsContact O-N 3.13Å; Y94-A97 CarbonylContact O-C 3.59Å; Y94-A97 PolarHBondContact O-N 2.91Å; Y94-A97 VanDerWaalsContact O-N 3.14Å; F95-A97 PolarHBondContact O-N 3.38Å; A97-K99 HydrophobicContact CB-CG 4.48Å; A97-K99 PolarHBondContact O-N 3.09Å
98	G	96.5	Very high	97.7	Very high	38 Å²	38	67.3 Å²	67.3	39%	0.392	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	9.2	-177.7	0	0	0	0	0	114.8	Y94 F95 K96 Y100	Y94-G98 PolarHBondContact O-N 2.78Å; F95-G98 PolarHBondContact O-N 3.18Å; K96-G98 VanDerWaalsContact C-N 3.27Å; K96-G98 PolarHBondContact O-N 3.15Å; G98-Y100 PolarHBondContact O-N 2.96Å
99	K	97.9	Very high	97.7	Very high	113 Å²	113	70.2 Å²	70.2	49%	0.491	35%	0.345	S	S	.	.			trans	-91	69.5	-178.7	-64.6	-176.7	-177.2	176	0	110.2	Y94 A97 D101 K102 A103	Y94-K99 HydrophobicContact CD1-CB 4.16Å; Y94-K99 HydrophobicContact CD1-CD 4.13Å; Y94-K99 PolarHBondContact O-N 3.43Å; A97-K99 HydrophobicContact CB-CG 4.48Å; A97-K99 PolarHBondContact O-N 3.09Å; K99-D101 PolarHBondContact O-N 2.95Å; K99-K102 HydrophobicContact CB-CB 4.44Å; K99-K102 PolarHBondContact O-N 3.41Å; K99-A103 PolarHBondContact O-N 3.01Å
100	Y	97.7	Very high	97.7	Very high	62 Å²	62	66.7 Å²	66.7	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-38.1	-168.5	-56.5	-54.9	0	0	0	114.4	F95 G98 K102 A103 I104 Q135	F95-Y100 AromaticContact CD2-CD1 3.88Å; F95-Y100 HydrophobicContact CD2-CD1 3.88Å; F95-Y100 AromaticContact CD2-CE1 3.97Å; F95-Y100 HydrophobicContact CD2-CE1 3.97Å; F95-Y100 HydrophobicContact CE2-CD1 4.09Å; F95-Y100 AromaticContact CE2-CE1 3.95Å; F95-Y100 HydrophobicContact CE2-CE1 3.95Å; F95-Y100 HydrophobicContact CG-CE1 4.44Å; F95-Y100 HydrophobicContact CZ-CE1 4.41Å; G98-Y100 PolarHBondContact O-N 2.96Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; Y100-K102 PolarHBondContact O-N 3.31Å; Y100-A103 WeakPolarHBondContact O-CB 3.46Å; Y100-A103 PolarHBondContact O-N 3.23Å; Y100-A103 VanDerWaalsContact O-N 3.13Å; Y100-I104 VanDerWaalsContact O-CG1 3.3Å; Y100-I104 WeakPolarHBondContact O-CG1 3.32Å; Y100-I104 PolarHBondContact O-N 3.3Å; Y100-Q135 HydrophobicContact CD1-CB 3.93Å; Y100-Q135 HydrophobicContact CD1-CG 4.1Å; Y100-Q135 HydrophobicContact CD2-CB 3.7Å; Y100-Q135 HydrophobicContact CE1-CB 3.74Å; Y100-Q135 HydrophobicContact CE1-CG 3.59Å; Y100-Q135 HydrophobicContact CE2-CB 3.47Å; Y100-Q135 VanDerWaalsContact CE2-CB 3.47Å; Y100-Q135 HydrophobicContact CE2-CG 4.12Å; Y100-Q135 HydrophobicContact CG-CB 3.92Å; Y100-Q135 VanDerWaalsContact CZ-CB 3.48Å
101	D	97.9	Very high	97.7	Very high	96 Å²	96	63 Å²	63	51%	0.513	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177.2	-62.5	-57.2	0	0	0	112.2	K99 A103 I104 Q105 Q136	K99-D101 PolarHBondContact O-N 2.95Å; D101-A103 VanDerWaalsContact C-N 3.33Å; D101-I104 PolarHBondContact O-N 3.18Å; D101-Q105 WeakPolarHBondContact O-CG 3.44Å; D101-Q105 PolarHBondContact O-N 3.41Å; D101-Q136 VanDerWaalsContact CG-NE2 3.3Å; D101-Q136 PolarHBondContact OD1-NE2 3.08Å
102	K	97.6	Very high	97.6	Very high	101 Å²	101	67 Å²	67	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-35.6	176.1	-63.6	-169.5	179.6	-168.7	0	111.5	Y94 K99 Y100 Q105 C106	Y94-K102 HydrophobicContact CD1-CB 4.06Å; Y94-K102 HydrophobicContact CD1-CD 4.24Å; Y94-K102 HydrophobicContact CD2-CB 3.85Å; Y94-K102 HydrophobicContact CE1-CB 4.41Å; Y94-K102 HydrophobicContact CE1-CD 3.96Å; Y94-K102 HydrophobicContact CE2-CB 4.19Å; Y94-K102 HydrophobicContact CG-CB 3.78Å; K99-K102 HydrophobicContact CB-CB 4.44Å; K99-K102 PolarHBondContact O-N 3.41Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; Y100-K102 PolarHBondContact O-N 3.31Å; K102-Q105 PolarHBondContact O-N 3.27Å; K102-C106 PolarHBondContact O-N 3.46Å; K102-C106 VanDerWaalsContact O-N 3.1Å; K102-C106 PolarHBondContact O-SG 2.75Å
103	A	98	Very high	97.4	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-46	173.9	0	0	0	0	0	111.1	F95 K99 Y100 D101 Q105 C106 Y107 A132	F95-A103 HydrophobicContact CB-CB 4.08Å; K99-A103 PolarHBondContact O-N 3.01Å; Y100-A103 WeakPolarHBondContact O-CB 3.46Å; Y100-A103 PolarHBondContact O-N 3.23Å; Y100-A103 VanDerWaalsContact O-N 3.13Å; D101-A103 VanDerWaalsContact C-N 3.33Å; A103-Q105 VanDerWaalsContact C-N 3.34Å; A103-Q105 PolarHBondContact O-N 3.49Å; A103-C106 PolarHBondContact O-N 3.3Å; A103-Y107 HydrophobicContact CB-CD2 4.4Å; A103-Y107 HydrophobicContact CB-CE2 3.91Å; A103-Y107 WeakPolarHBondContact O-CD2 3.15Å; A103-Y107 VanDerWaalsContact O-CG 3.31Å; A103-Y107 PolarHBondContact O-N 2.8Å; A103-A132 HydrophobicContact CB-CB 4.5Å
104	I	98.4	Very high	97.2	Very high	16 Å²	16	60.6 Å²	60.6	8%	0.082	32%	0.318	C	S	.	.	H	α-helix	trans	-58.4	-44.1	176.9	-69.3	160	0	0	0	111.2	Y100 D101 Y107 T108 R129 A132 Y133	Y100-I104 VanDerWaalsContact O-CG1 3.3Å; Y100-I104 WeakPolarHBondContact O-CG1 3.32Å; Y100-I104 PolarHBondContact O-N 3.3Å; D101-I104 PolarHBondContact O-N 3.18Å; I104-Y107 PolarHBondContact O-N 2.73Å; I104-T108 WeakPolarHBondContact O-CB 3.48Å; I104-T108 PolarHBondContact O-N 2.97Å; I104-T108 PolarHBondContact O-OG1 2.92Å; I104-R129 HydrophobicContact CG1-CG 4.46Å; I104-R129 HydrophobicContact CG2-CG 4.2Å; I104-A132 HydrophobicContact CD1-CB 4.11Å; I104-A132 HydrophobicContact CG1-CB 3.54Å; I104-Y133 HydrophobicContact CD1-CD1 3.65Å; I104-Y133 HydrophobicContact CD1-CE1 3.63Å; I104-Y133 HydrophobicContact CD1-CG 4.42Å; I104-Y133 HydrophobicContact CG1-CD1 4.35Å; I104-Y133 HydrophobicContact CG1-CE1 4.18Å; I104-Y133 HydrophobicContact CG2-CE1 4.02Å; I104-Y133 WeakPolarHBondContact CG2-OH 3.46Å
105	Q	98.1	Very high	97	Very high	132 Å²	132	58.9 Å²	58.9	62%	0.617	32%	0.315	S	S	*	.	H	α-helix	trans	-58.9	-49.1	175.2	-71.6	171.3	2	0	0	111.4	D101 K102 A103 Y107 T108 E109	D101-Q105 WeakPolarHBondContact O-CG 3.44Å; D101-Q105 PolarHBondContact O-N 3.41Å; K102-Q105 PolarHBondContact O-N 3.27Å; A103-Q105 VanDerWaalsContact C-N 3.34Å; A103-Q105 PolarHBondContact O-N 3.49Å; Q105-Y107 PolarHBondContact O-N 3.24Å; Q105-T108 PolarHBondContact O-N 3.25Å; Q105-E109 PolarHBondContact O-N 3.06Å
106	C	97.9	Very high	96.7	Very high	7 Å²	7	64.5 Å²	64.5	5%	0.047	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-37.9	179.6	-62.9	0	0	0	0	112.6	G91 K102 A103 A110	G91-C106 VanDerWaalsContact CA-CB 3.5Å; K102-C106 PolarHBondContact O-N 3.46Å; K102-C106 VanDerWaalsContact O-N 3.1Å; K102-C106 PolarHBondContact O-SG 2.75Å; A103-C106 PolarHBondContact O-N 3.3Å; C106-A110 PolarHBondContact O-N 3.13Å
107	Y	98.2	Very high	96.4	Very high	3 Å²	3	63.1 Å²	63.1	1%	0.012	34%	0.336	C	S	.	.	H	α-helix	trans	-71.2	-34.4	175.4	-61	-47.1	0	0	0	112.3	K88 G91 N92 A103 I104 Q105 E109 A110 I111 N128 R129 A132	K88-Y107 HydrophobicContact CG-CD1 4.48Å; K88-Y107 HydrophobicContact CG-CE1 4.31Å; G91-Y107 PolarHBondContact O-OH 3.35Å; N92-Y107 WeakPolarHBondContact CA-OH 3.46Å; N92-Y107 PolarHBondContact N-OH 2.9Å; N92-Y107 PolarHBondContact OD1-OH 3.14Å; A103-Y107 HydrophobicContact CB-CD2 4.4Å; A103-Y107 HydrophobicContact CB-CE2 3.91Å; A103-Y107 WeakPolarHBondContact O-CD2 3.15Å; A103-Y107 VanDerWaalsContact O-CG 3.31Å; A103-Y107 PolarHBondContact O-N 2.8Å; I104-Y107 PolarHBondContact O-N 2.73Å; Q105-Y107 PolarHBondContact O-N 3.24Å; Y107-E109 VanDerWaalsContact C-N 3.34Å; Y107-A110 WeakPolarHBondContact O-CB 3.39Å; Y107-A110 PolarHBondContact O-N 3.23Å; Y107-I111 VanDerWaalsContact O-CG1 3.3Å; Y107-I111 WeakPolarHBondContact O-CG1 3.41Å; Y107-I111 PolarHBondContact O-N 2.9Å; Y107-N128 HydrophobicContact CD1-CB 3.97Å; Y107-N128 HydrophobicContact CD2-CB 4.35Å; Y107-N128 HydrophobicContact CE1-CB 3.7Å; Y107-N128 HydrophobicContact CE2-CB 4.08Å; Y107-N128 WeakPolarHBondContact CE2-O 3.45Å; Y107-N128 HydrophobicContact CG-CB 4.3Å; Y107-R129 HydrophobicContact CD2-CB 4.16Å; Y107-R129 HydrophobicContact CG-CB 4.32Å; Y107-A132 HydrophobicContact CE2-CB 4.4Å
108	T	98.3	Very high	96.1	Very high	56 Å²	56	63.6 Å²	63.6	34%	0.344	33%	0.327	S	S	.	.	H	α-helix	trans	-65.1	-40.9	174.6	-59.3	0	0	0	0	111.1	I104 Q105 I111 A112 R129	I104-T108 WeakPolarHBondContact O-CB 3.48Å; I104-T108 PolarHBondContact O-N 2.97Å; I104-T108 PolarHBondContact O-OG1 2.92Å; Q105-T108 PolarHBondContact O-N 3.25Å; T108-I111 PolarHBondContact O-N 3.05Å; T108-A112 WeakPolarHBondContact O-CB 3.44Å; T108-A112 PolarHBondContact O-N 3.18Å; T108-R129 VanDerWaalsContact OG1-CD 3.29Å; T108-R129 WeakPolarHBondContact OG1-CD 3.21Å; T108-R129 PolarHBondContact OG1-NH1 2.96Å
109	E	97.1	Very high	96	Very high	94 Å²	94	67.8 Å²	67.8	44%	0.439	34%	0.335	S	S	.	.	H	α-helix	trans	-59.9	-45.7	169.7	-177.3	-178.5	-171.1	0	0	111.3	A87 Q105 Y107 I111 A112 L113	A87-E109 HydrophobicContact CB-CB 4.42Å; A87-E109 HydrophobicContact CB-CG 4.19Å; Q105-E109 PolarHBondContact O-N 3.06Å; Y107-E109 VanDerWaalsContact C-N 3.34Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 3.34Å; E109-A112 PolarHBondContact O-N 3.42Å; E109-L113 HydrophobicContact CG-CD1 3.77Å; E109-L113 HydrophobicContact CG-CG 4.42Å; E109-L113 WeakPolarHBondContact O-CB 3.42Å; E109-L113 VanDerWaalsContact O-CG 3.29Å; E109-L113 WeakPolarHBondContact O-CG 3.41Å; E109-L113 PolarHBondContact O-N 3.19Å
110	A	96.4	Very high	95.8	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.1	-42.1	176.8	0	0	0	0	0	112.7	A84 A87 K88 C106 Y107 L113 C114 F125	A84-A110 WeakPolarHBondContact CB-O 3.37Å; A84-A110 WeakPolarHBondContact O-CB 3.49Å; A87-A110 HydrophobicContact CB-CB 3.87Å; K88-A110 HydrophobicContact CB-CB 4.38Å; C106-A110 PolarHBondContact O-N 3.13Å; Y107-A110 WeakPolarHBondContact O-CB 3.39Å; Y107-A110 PolarHBondContact O-N 3.23Å; A110-L113 PolarHBondContact O-N 2.99Å; A110-C114 WeakPolarHBondContact O-CB 3.39Å; A110-C114 PolarHBondContact O-N 3.45Å; A110-C114 VanDerWaalsContact O-N 3.12Å; A110-F125 HydrophobicContact CB-CD2 4.01Å; A110-F125 HydrophobicContact CB-CE2 4.39Å; A110-F125 HydrophobicContact CB-CG 4.13Å
111	I	97.3	Very high	95.6	Very high	23 Å²	23	65.3 Å²	65.3	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-42.6	176.1	-70.7	161.8	0	0	0	111	Y107 T108 E109 L122 F125 Y126	Y107-I111 VanDerWaalsContact O-CG1 3.3Å; Y107-I111 WeakPolarHBondContact O-CG1 3.41Å; Y107-I111 PolarHBondContact O-N 2.9Å; T108-I111 PolarHBondContact O-N 3.05Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 3.34Å; I111-L122 HydrophobicContact CB-CD1 4.39Å; I111-L122 HydrophobicContact CG1-CD1 4.38Å; I111-L122 HydrophobicContact CG2-CD1 4.01Å; I111-F125 HydrophobicContact CD1-CB 4.45Å; I111-F125 HydrophobicContact CG1-CB 3.67Å; I111-Y126 HydrophobicContact CD1-CD1 3.73Å; I111-Y126 HydrophobicContact CD1-CE1 3.9Å; I111-Y126 HydrophobicContact CD1-CG 4.15Å; I111-Y126 HydrophobicContact CG2-CE1 4.18Å; I111-Y126 HydrophobicContact CG2-CE2 4.28Å
112	A	96.4	Very high	95.5	Very high	85 Å²	85	61.5 Å²	61.5	70%	0.702	32%	0.317	S	S	*	.	H	α-helix	trans	-68.4	-33.1	-179.6	0	0	0	0	0	113.3	T108 E109	T108-A112 WeakPolarHBondContact O-CB 3.44Å; T108-A112 PolarHBondContact O-N 3.18Å; E109-A112 PolarHBondContact O-N 3.42Å
113	L	94.1	Very high	95.5	Very high	61 Å²	61	56.8 Å²	56.8	32%	0.319	30%	0.297	S	S	.	.	H	α-helix	trans	-83.7	-22.1	-179.4	-67.7	171.4	0	0	0	113.6	R83 A84 E109 A110 P115	R83-L113 HydrophobicContact CB-CD1 4.07Å; A84-L113 HydrophobicContact CB-CB 3.91Å; E109-L113 HydrophobicContact CG-CD1 3.77Å; E109-L113 HydrophobicContact CG-CG 4.42Å; E109-L113 WeakPolarHBondContact O-CB 3.42Å; E109-L113 VanDerWaalsContact O-CG 3.29Å; E109-L113 WeakPolarHBondContact O-CG 3.41Å; E109-L113 PolarHBondContact O-N 3.19Å; A110-L113 PolarHBondContact O-N 2.99Å; L113-P115 WeakPolarHBondContact O-CD 3.37Å
114	C	93.9	Very high	95.4	Very high	11 Å²	11	58.7 Å²	58.7	7%	0.074	31%	0.308	C	S	.	.	S	Bend	trans	-72	124.4	-175.9	-166.8	0	0	0	0	111.4	A84 A110 L122 F125	A84-C114 HydrophobicContact CB-CB 4.13Å; A110-C114 WeakPolarHBondContact O-CB 3.39Å; A110-C114 PolarHBondContact O-N 3.45Å; A110-C114 VanDerWaalsContact O-N 3.12Å; C114-L122 HydrophobicContact CB-CD1 4.14Å; C114-F125 HydrophobicContact CB-CD2 4.02Å; C114-F125 HydrophobicContact CB-CE2 3.74Å
115	P	93	Very high	95.4	Very high	34 Å²	34	58 Å²	58	22%	0.221	31%	0.305	C	S	.	.			trans	-62.9	140.8	172.8	-16.3	27.7	0	0	0	111.5	P80 L113 E117 H118	P80-P115 HydrophobicContact CB-CG 4.08Å; L113-P115 WeakPolarHBondContact O-CD 3.37Å; P115-E117 HydrophobicContact CB-CG 4.19Å; P115-E117 PolarHBondContact O-N 3.26Å; P115-E117 VanDerWaalsContact O-N 3.13Å; P115-H118 PolarHBondContact O-N 3.48Å
116	K	90.6	Very high	95.4	Very high	176 Å²	176	53.4 Å²	53.4	77%	0.765	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.8	-173.2	-66.2	-175.9	179.2	-179.5	0	113.9	H118	K116-H118 VanDerWaalsContact C-N 3.25Å; K116-H118 PolarHBondContact O-N 3.25Å
117	E	91.5	Very high	95.4	Very high	156 Å²	156	53.4 Å²	53.4	73%	0.729	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.3	173.7	15.2	-79.6	172.3	0	0	112.6	P115 K119	P115-E117 HydrophobicContact CB-CG 4.19Å; P115-E117 PolarHBondContact O-N 3.26Å; P115-E117 VanDerWaalsContact O-N 3.13Å; E117-K119 PolarHBondContact O-N 2.98Å
118	H	92.4	Very high	95.4	Very high	71 Å²	71	54.5 Å²	54.5	33%	0.329	29%	0.287	S	S	.	.			trans	-84.1	60.9	-178.7	-63.7	-73.1	0	0	0	112.4	L81 P115 K116 S120 D121 L122	L81-H118 HydrophobicContact CD1-CB 4.22Å; P115-H118 PolarHBondContact O-N 3.48Å; K116-H118 VanDerWaalsContact C-N 3.25Å; K116-H118 PolarHBondContact O-N 3.25Å; H118-S120 VanDerWaalsContact C-N 3.26Å; H118-S120 PolarHBondContact O-N 2.98Å; H118-D121 HydrophobicContact CB-CB 4.31Å; H118-D121 PolarHBondContact O-N 3.19Å; H118-L122 WeakPolarHBondContact O-CB 3.48Å; H118-L122 PolarHBondContact O-N 3.12Å
119	K	94.3	Very high	95.4	Very high	126 Å²	126	53.5 Å²	53.5	55%	0.548	28%	0.277	S	S	.	.	H	α-helix	trans	-55.1	-38	-176.5	-61.9	-175.6	-179.1	-178	0	113.6	E117 S123 L152	E117-K119 PolarHBondContact O-N 2.98Å; K119-S123 WeakPolarHBondContact O-CB 3.34Å; K119-S123 PolarHBondContact O-N 3.09Å; K119-S123 PolarHBondContact O-OG 3.35Å; K119-L152 HydrophobicContact CB-CB 4.49Å; K119-L152 HydrophobicContact CB-CD2 4.25Å; K119-L152 HydrophobicContact CG-CD2 4.12Å
120	S	92.9	Very high	95.5	Very high	77 Å²	77	49 Å²	49	54%	0.538	26%	0.256	S	S	.	.	H	α-helix	trans	-63.5	-50.3	179.7	-178.6	0	0	0	0	111.8	H118 S123 T124	H118-S120 VanDerWaalsContact C-N 3.26Å; H118-S120 PolarHBondContact O-N 2.98Å; S120-S123 PolarHBondContact O-N 3.23Å; S120-S123 PolarHBondContact O-OG 3.38Å; S120-T124 PolarHBondContact O-N 2.81Å; S120-T124 VanDerWaalsContact O-N 3.14Å; S120-T124 PolarHBondContact O-OG1 3.48Å
121	D	93.4	Very high	95.6	Very high	47 Å²	47	49.3 Å²	49.3	25%	0.251	26%	0.259	S	S	.	.	H	α-helix	trans	-65.2	-44.5	178.4	-61.7	-74	0	0	0	111.1	L81 H118 S123 T124 F125	L81-D121 HydrophobicContact CD1-CB 4.23Å; H118-D121 HydrophobicContact CB-CB 4.31Å; H118-D121 PolarHBondContact O-N 3.19Å; D121-S123 VanDerWaalsContact C-N 3.35Å; D121-S123 PolarHBondContact O-N 3.02Å; D121-T124 WeakPolarHBondContact O-CA 3.42Å; D121-T124 VanDerWaalsContact O-CB 3.31Å; D121-T124 WeakPolarHBondContact O-CB 3.42Å; D121-T124 PolarHBondContact O-N 3.04Å; D121-F125 HydrophobicContact CB-CE1 4.33Å; D121-F125 HydrophobicContact CB-CE2 4.13Å; D121-F125 HydrophobicContact CB-CZ 3.81Å; D121-F125 VanDerWaalsContact O-CD1 3.24Å; D121-F125 WeakPolarHBondContact O-CD1 3.29Å; D121-F125 WeakPolarHBondContact O-CG 3.45Å; D121-F125 PolarHBondContact O-N 3.4Å
122	L	96.3	Very high	95.6	Very high	16 Å²	16	48.2 Å²	48.2	8%	0.084	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-44.5	177.4	-171.2	61.2	0	0	0	111.7	I111 C114 H118 T124 F125 Y126 L152	I111-L122 HydrophobicContact CB-CD1 4.39Å; I111-L122 HydrophobicContact CG1-CD1 4.38Å; I111-L122 HydrophobicContact CG2-CD1 4.01Å; C114-L122 HydrophobicContact CB-CD1 4.14Å; H118-L122 WeakPolarHBondContact O-CB 3.48Å; H118-L122 PolarHBondContact O-N 3.12Å; L122-T124 VanDerWaalsContact C-N 3.25Å; L122-T124 PolarHBondContact O-N 3.05Å; L122-F125 PolarHBondContact O-N 3.48Å; L122-F125 VanDerWaalsContact O-N 3.16Å; L122-Y126 HydrophobicContact CD1-CD2 4.2Å; L122-Y126 HydrophobicContact CD1-CE2 3.75Å; L122-Y126 HydrophobicContact CD2-CE2 4.22Å; L122-Y126 HydrophobicContact CG-CD2 3.99Å; L122-Y126 HydrophobicContact CG-CE2 3.67Å; L122-Y126 VanDerWaalsContact O-CD2 3.23Å; L122-Y126 WeakPolarHBondContact O-CD2 3.19Å; L122-Y126 PolarHBondContact O-N 2.83Å; L122-L152 HydrophobicContact CB-CD1 3.9Å; L122-L152 HydrophobicContact CD2-CD1 3.65Å; L122-L152 HydrophobicContact CD2-CD2 4.16Å; L122-L152 HydrophobicContact CG-CD1 3.53Å
123	S	96.8	Very high	95.7	Very high	1 Å²	1	46 Å²	46	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-35.8	174.6	76.4	0	0	0	0	112.6	K119 S120 D121 Q127 A149	K119-S123 WeakPolarHBondContact O-CB 3.34Å; K119-S123 PolarHBondContact O-N 3.09Å; K119-S123 PolarHBondContact O-OG 3.35Å; S120-S123 PolarHBondContact O-N 3.23Å; S120-S123 PolarHBondContact O-OG 3.38Å; D121-S123 VanDerWaalsContact C-N 3.35Å; D121-S123 PolarHBondContact O-N 3.02Å; S123-Q127 WeakPolarHBondContact O-CB 3.27Å; S123-Q127 PolarHBondContact O-N 3.42Å; S123-A149 WeakPolarHBondContact CB-O 3.47Å; S123-A149 WeakPolarHBondContact O-CB 3.29Å
124	T	97.1	Very high	95.9	Very high	40 Å²	40	44.1 Å²	44.1	25%	0.245	22%	0.216	C	C	.	.	H	α-helix	trans	-69.5	-39.7	176.9	-58.9	0	0	0	0	111.2	S120 D121 L122 Q127 N128	S120-T124 PolarHBondContact O-N 2.81Å; S120-T124 VanDerWaalsContact O-N 3.14Å; S120-T124 PolarHBondContact O-OG1 3.48Å; D121-T124 WeakPolarHBondContact O-CA 3.42Å; D121-T124 VanDerWaalsContact O-CB 3.31Å; D121-T124 WeakPolarHBondContact O-CB 3.42Å; D121-T124 PolarHBondContact O-N 3.04Å; L122-T124 VanDerWaalsContact C-N 3.25Å; L122-T124 PolarHBondContact O-N 3.05Å; T124-Q127 PolarHBondContact O-N 3.33Å; T124-N128 WeakPolarHBondContact O-CB 3.47Å; T124-N128 VanDerWaalsContact O-CG 3.24Å; T124-N128 PolarHBondContact O-N 3.05Å; T124-N128 PolarHBondContact O-ND2 3.36Å
125	F	97.8	Very high	96.1	Very high	1 Å²	1	47.9 Å²	47.9	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-43.9	179.6	-54.6	-19.4	0	0	0	111.6	A84 K88 A110 I111 C114 D121 L122 Q127 N128 R129	A84-F125 HydrophobicContact CB-CE2 3.8Å; A84-F125 HydrophobicContact CB-CZ 4.24Å; K88-F125 HydrophobicContact CB-CD1 4.02Å; K88-F125 HydrophobicContact CB-CE1 3.88Å; K88-F125 HydrophobicContact CD-CD1 3.95Å; K88-F125 HydrophobicContact CD-CE1 3.71Å; K88-F125 HydrophobicContact CG-CD1 3.82Å; K88-F125 HydrophobicContact CG-CE1 3.92Å; A110-F125 HydrophobicContact CB-CD2 4.01Å; A110-F125 HydrophobicContact CB-CE2 4.39Å; A110-F125 HydrophobicContact CB-CG 4.13Å; I111-F125 HydrophobicContact CD1-CB 4.45Å; I111-F125 HydrophobicContact CG1-CB 3.67Å; C114-F125 HydrophobicContact CB-CD2 4.02Å; C114-F125 HydrophobicContact CB-CE2 3.74Å; D121-F125 HydrophobicContact CB-CE1 4.33Å; D121-F125 HydrophobicContact CB-CE2 4.13Å; D121-F125 HydrophobicContact CB-CZ 3.81Å; D121-F125 VanDerWaalsContact O-CD1 3.24Å; D121-F125 WeakPolarHBondContact O-CD1 3.29Å; D121-F125 WeakPolarHBondContact O-CG 3.45Å; D121-F125 PolarHBondContact O-N 3.4Å; L122-F125 PolarHBondContact O-N 3.48Å; L122-F125 VanDerWaalsContact O-N 3.16Å; F125-Q127 PolarHBondContact O-N 3Å; F125-N128 PolarHBondContact O-N 3.38Å; F125-R129 PolarHBondContact O-N 3.31Å
126	Y	98.6	Very high	96.3	Very high	36 Å²	36	48.4 Å²	48.4	14%	0.141	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-47.9	171.5	-81	-66.5	0	0	0	111.8	I111 L122 N128 R129 A130 D145 Q148 L152	I111-Y126 HydrophobicContact CD1-CD1 3.73Å; I111-Y126 HydrophobicContact CD1-CE1 3.9Å; I111-Y126 HydrophobicContact CD1-CG 4.15Å; I111-Y126 HydrophobicContact CG2-CE1 4.18Å; I111-Y126 HydrophobicContact CG2-CE2 4.28Å; L122-Y126 HydrophobicContact CD1-CD2 4.2Å; L122-Y126 HydrophobicContact CD1-CE2 3.75Å; L122-Y126 HydrophobicContact CD2-CE2 4.22Å; L122-Y126 HydrophobicContact CG-CD2 3.99Å; L122-Y126 HydrophobicContact CG-CE2 3.67Å; L122-Y126 VanDerWaalsContact O-CD2 3.23Å; L122-Y126 WeakPolarHBondContact O-CD2 3.19Å; L122-Y126 PolarHBondContact O-N 2.83Å; Y126-N128 VanDerWaalsContact C-N 3.34Å; Y126-N128 PolarHBondContact O-N 3.36Å; Y126-R129 PolarHBondContact O-N 3.43Å; Y126-A130 PolarHBondContact O-N 2.97Å; Y126-D145 HydrophobicContact CD1-CB 4.49Å; Y126-Q148 HydrophobicContact CD1-CB 3.82Å; Y126-Q148 HydrophobicContact CD1-CG 4.44Å; Y126-Q148 HydrophobicContact CD2-CB 4Å; Y126-Q148 HydrophobicContact CE1-CB 3.87Å; Y126-Q148 HydrophobicContact CE1-CG 4.11Å; Y126-Q148 HydrophobicContact CE2-CB 4.05Å; Y126-Q148 HydrophobicContact CG-CB 3.9Å; Y126-L152 HydrophobicContact CD2-CD1 3.81Å; Y126-L152 HydrophobicContact CE2-CD1 3.92Å
127	Q	98.1	Very high	96.6	Very high	7 Å²	7	45.7 Å²	45.7	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-37.5	179.5	-172.1	-80.1	-60	0	0	112.7	S123 T124 F125 A130 A131 A149 Y156 K158 A159 R162	S123-Q127 WeakPolarHBondContact O-CB 3.27Å; S123-Q127 PolarHBondContact O-N 3.42Å; T124-Q127 PolarHBondContact O-N 3.33Å; F125-Q127 PolarHBondContact O-N 3Å; Q127-A130 WeakPolarHBondContact O-CB 3.41Å; Q127-A130 PolarHBondContact O-N 3.47Å; Q127-A131 PolarHBondContact O-N 2.88Å; Q127-A149 HydrophobicContact CB-CB 4.35Å; Q127-Y156 HydrophobicContact CB-CD1 4.39Å; Q127-Y156 HydrophobicContact CB-CE1 3.44Å; Q127-Y156 VanDerWaalsContact CB-CE1 3.44Å; Q127-Y156 HydrophobicContact CG-CE1 3.62Å; Q127-Y156 PolarHBondContact OE1-OH 3.1Å; Q127-K158 HydrophobicContact CG-CB 4.45Å; Q127-A159 HydrophobicContact CG-CB 4.19Å; Q127-R162 VanDerWaalsContact NE2-NE 3.19Å
128	N	97.9	Very high	96.9	Very high	27 Å²	27	41.9 Å²	41.9	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-37.1	175.9	-73.1	-24.1	0	0	0	112.1	Y107 T124 F125 Y126 A131 A132	Y107-N128 HydrophobicContact CD1-CB 3.97Å; Y107-N128 HydrophobicContact CD2-CB 4.35Å; Y107-N128 HydrophobicContact CE1-CB 3.7Å; Y107-N128 HydrophobicContact CE2-CB 4.08Å; Y107-N128 WeakPolarHBondContact CE2-O 3.45Å; Y107-N128 HydrophobicContact CG-CB 4.3Å; T124-N128 WeakPolarHBondContact O-CB 3.47Å; T124-N128 VanDerWaalsContact O-CG 3.24Å; T124-N128 PolarHBondContact O-N 3.05Å; T124-N128 PolarHBondContact O-ND2 3.36Å; F125-N128 PolarHBondContact O-N 3.38Å; Y126-N128 VanDerWaalsContact C-N 3.34Å; Y126-N128 PolarHBondContact O-N 3.36Å; N128-A131 WeakPolarHBondContact O-CB 2.99Å; N128-A131 PolarHBondContact O-N 2.93Å; N128-A132 PolarHBondContact O-N 3.21Å
129	R	98.5	Very high	97.2	Very high	34 Å²	34	40.8 Å²	40.8	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-68.2	-43.4	174.1	-166	173.1	66.8	179.6	0.8	111.8	I104 Y107 T108 F125 Y126 A131 A132 Y133 D145	I104-R129 HydrophobicContact CG1-CG 4.46Å; I104-R129 HydrophobicContact CG2-CG 4.2Å; Y107-R129 HydrophobicContact CD2-CB 4.16Å; Y107-R129 HydrophobicContact CG-CB 4.32Å; T108-R129 VanDerWaalsContact OG1-CD 3.29Å; T108-R129 WeakPolarHBondContact OG1-CD 3.21Å; T108-R129 PolarHBondContact OG1-NH1 2.96Å; F125-R129 PolarHBondContact O-N 3.31Å; Y126-R129 PolarHBondContact O-N 3.43Å; R129-A131 PolarHBondContact O-N 3.33Å; R129-A132 WeakPolarHBondContact O-CB 3.48Å; R129-A132 PolarHBondContact O-N 3.07Å; R129-Y133 HydrophobicContact CG-CD2 4.15Å; R129-Y133 HydrophobicContact CG-CE2 3.68Å; R129-Y133 WeakPolarHBondContact O-CD2 3.49Å; R129-Y133 PolarHBondContact O-N 3.32Å; R129-D145 VanDerWaalsContact CB-OD2 3.31Å; R129-D145 WeakPolarHBondContact CB-OD2 3.46Å; R129-D145 VanDerWaalsContact CG-OD2 3.31Å; R129-D145 WeakPolarHBondContact CG-OD2 3.27Å; R129-D145 IonicContact CZ-OD1 2.74Å; R129-D145 IonicContact CZ-OD2 3.85Å; R129-D145 IonicContact NE-OD1 3.38Å; R129-D145 PolarHBondContact NE-OD1 3.19Å; R129-D145 IonicContact NE-OD2 2.78Å; R129-D145 PolarHBondContact NE-OD2 2.64Å; R129-D145 IonicContact NH2-OD1 2.83Å; R129-D145 PolarHBondContact NH2-OD1 3.14Å; R129-D145 IonicContact NH2-OD2 3.74Å
130	A	98.4	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-54.8	-38	170.3	0	0	0	0	0	112	Y126 Q127 A132 Y133 E134 V142 D145 C146	Y126-A130 PolarHBondContact O-N 2.97Å; Q127-A130 WeakPolarHBondContact O-CB 3.41Å; Q127-A130 PolarHBondContact O-N 3.47Å; A130-A132 VanDerWaalsContact C-N 3.31Å; A130-A132 PolarHBondContact O-N 3.1Å; A130-Y133 PolarHBondContact O-N 3.36Å; A130-E134 PolarHBondContact O-N 2.95Å; A130-V142 HydrophobicContact CB-CG1 4.39Å; A130-D145 HydrophobicContact CB-CB 3.69Å; A130-D145 PolarHBondContact N-OD2 3.41Å; A130-C146 WeakPolarHBondContact CB-SG 3.42Å
131	A	98.2	Very high	97.7	Very high	6 Å²	6	37.5 Å²	37.5	5%	0.05	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-37.3	177.3	0	0	0	0	0	113.1	F95 Q127 N128 R129 Q135 R162	F95-A131 HydrophobicContact CE2-CB 4.07Å; F95-A131 HydrophobicContact CZ-CB 4.26Å; Q127-A131 PolarHBondContact O-N 2.88Å; N128-A131 WeakPolarHBondContact O-CB 2.99Å; N128-A131 PolarHBondContact O-N 2.93Å; R129-A131 PolarHBondContact O-N 3.33Å; A131-Q135 WeakPolarHBondContact O-CG 3.42Å; A131-Q135 PolarHBondContact O-N 2.93Å; A131-R162 VanDerWaalsContact CB-NH1 3.28Å
132	A	98.1	Very high	97.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71	-38.8	175.2	0	0	0	0	0	112.1	F95 A103 I104 Y107 N128 R129 A130 E134 Q135 Q136	F95-A132 HydrophobicContact CD2-CB 4.04Å; F95-A132 HydrophobicContact CE2-CB 4.24Å; A103-A132 HydrophobicContact CB-CB 4.5Å; I104-A132 HydrophobicContact CD1-CB 4.11Å; I104-A132 HydrophobicContact CG1-CB 3.54Å; Y107-A132 HydrophobicContact CE2-CB 4.4Å; N128-A132 PolarHBondContact O-N 3.21Å; R129-A132 WeakPolarHBondContact O-CB 3.48Å; R129-A132 PolarHBondContact O-N 3.07Å; A130-A132 VanDerWaalsContact C-N 3.31Å; A130-A132 PolarHBondContact O-N 3.1Å; A132-E134 VanDerWaalsContact C-N 3.33Å; A132-E134 PolarHBondContact O-N 3.14Å; A132-Q135 PolarHBondContact O-N 3.42Å; A132-Q136 PolarHBondContact O-N 3.43Å
133	Y	98.6	Very high	98	Very high	39 Å²	39	35.8 Å²	35.8	15%	0.153	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-36.9	173.1	-72.7	-51.3	0	0	0	112.9	I104 R129 A130 Q135 Q136 L137 K138 E141 D145	I104-Y133 HydrophobicContact CD1-CD1 3.65Å; I104-Y133 HydrophobicContact CD1-CE1 3.63Å; I104-Y133 HydrophobicContact CD1-CG 4.42Å; I104-Y133 HydrophobicContact CG1-CD1 4.35Å; I104-Y133 HydrophobicContact CG1-CE1 4.18Å; I104-Y133 HydrophobicContact CG2-CE1 4.02Å; I104-Y133 WeakPolarHBondContact CG2-OH 3.46Å; R129-Y133 HydrophobicContact CG-CD2 4.15Å; R129-Y133 HydrophobicContact CG-CE2 3.68Å; R129-Y133 WeakPolarHBondContact O-CD2 3.49Å; R129-Y133 PolarHBondContact O-N 3.32Å; A130-Y133 PolarHBondContact O-N 3.36Å; Y133-Q135 VanDerWaalsContact C-N 3.31Å; Y133-Q135 PolarHBondContact O-N 2.82Å; Y133-Q136 CarbonylContact O-C 3.06Å; Y133-Q136 WeakPolarHBondContact O-CA 3.14Å; Y133-Q136 PolarHBondContact O-N 3.23Å; Y133-L137 PolarHBondContact O-N 2.97Å; Y133-L137 VanDerWaalsContact O-N 3.13Å; Y133-K138 HydrophobicContact CD1-CB 4.19Å; Y133-K138 HydrophobicContact CD1-CD 3.91Å; Y133-K138 HydrophobicContact CE1-CD 4.3Å; Y133-K138 PolarHBondContact O-N 3.45Å; Y133-E141 HydrophobicContact CD1-CB 4.02Å; Y133-E141 HydrophobicContact CD2-CB 3.74Å; Y133-E141 HydrophobicContact CE1-CB 4.24Å; Y133-E141 HydrophobicContact CE1-CG 4.42Å; Y133-E141 HydrophobicContact CE2-CB 3.98Å; Y133-E141 HydrophobicContact CG-CB 3.77Å; Y133-D145 WeakPolarHBondContact CD2-OD2 3.3Å; Y133-D145 VanDerWaalsContact CE2-OD2 3.31Å; Y133-D145 WeakPolarHBondContact CE2-OD2 3.28Å
134	E	97.9	Very high	98.1	Very high	21 Å²	21	41.7 Å²	41.7	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-39.1	175.2	173	171	-172.9	0	0	111.9	A130 A132 Q136 L137 W139 V142 R162 K165	A130-E134 PolarHBondContact O-N 2.95Å; A132-E134 VanDerWaalsContact C-N 3.33Å; A132-E134 PolarHBondContact O-N 3.14Å; E134-Q136 PolarHBondContact O-N 3.16Å; E134-L137 PolarHBondContact O-N 3.25Å; E134-W139 HydrophobicContact CB-CZ3 4.47Å; E134-W139 HydrophobicContact CG-CH2 4.3Å; E134-W139 HydrophobicContact CG-CZ3 3.86Å; E134-V142 HydrophobicContact CB-CG2 3.91Å; E134-V142 VanDerWaalsContact N-CG2 3.29Å; E134-R162 WeakPolarHBondContact OE2-CD 3.46Å; E134-R162 VanDerWaalsContact OE2-CG 3.3Å; E134-R162 WeakPolarHBondContact OE2-CG 3.41Å; E134-R162 IonicContact OE2-CZ 3.68Å; E134-R162 IonicContact OE2-NE 3.82Å; E134-R162 IonicContact OE2-NH1 2.73Å; E134-R162 PolarHBondContact OE2-NH1 3.41Å; E134-K165 IonicContact OE1-NZ 2.74Å; E134-K165 PolarHBondContact OE1-NZ 2.64Å
135	Q	97.8	Very high	98.1	Very high	91 Å²	91	40.1 Å²	40.1	43%	0.425	19%	0.193	S	C	.	.	H	α-helix	trans	-67	-20.6	175.6	-59.5	-56	-59.2	0	0	112.9	F95 Y100 A131 A132 Y133	F95-Q135 HydrophobicContact CE2-CG 3.98Å; F95-Q135 HydrophobicContact CZ-CG 4.07Å; Y100-Q135 HydrophobicContact CD1-CB 3.93Å; Y100-Q135 HydrophobicContact CD1-CG 4.1Å; Y100-Q135 HydrophobicContact CD2-CB 3.7Å; Y100-Q135 HydrophobicContact CE1-CB 3.74Å; Y100-Q135 HydrophobicContact CE1-CG 3.59Å; Y100-Q135 HydrophobicContact CE2-CB 3.47Å; Y100-Q135 VanDerWaalsContact CE2-CB 3.47Å; Y100-Q135 HydrophobicContact CE2-CG 4.12Å; Y100-Q135 HydrophobicContact CG-CB 3.92Å; Y100-Q135 VanDerWaalsContact CZ-CB 3.48Å; A131-Q135 WeakPolarHBondContact O-CG 3.42Å; A131-Q135 PolarHBondContact O-N 2.93Å; A132-Q135 PolarHBondContact O-N 3.42Å; Y133-Q135 VanDerWaalsContact C-N 3.31Å; Y133-Q135 PolarHBondContact O-N 2.82Å
136	Q	97.5	Very high	98.2	Very high	44 Å²	44	40.1 Å²	40.1	21%	0.206	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	2.8	174	-62.9	-171.6	-15.1	0	0	113.2	D101 A132 Y133 E134 K138	D101-Q136 VanDerWaalsContact CG-NE2 3.3Å; D101-Q136 PolarHBondContact OD1-NE2 3.08Å; A132-Q136 PolarHBondContact O-N 3.43Å; Y133-Q136 CarbonylContact O-C 3.06Å; Y133-Q136 WeakPolarHBondContact O-CA 3.14Å; Y133-Q136 PolarHBondContact O-N 3.23Å; E134-Q136 PolarHBondContact O-N 3.16Å; Q136-K138 HydrophobicContact CB-CD 4.27Å; Q136-K138 HydrophobicContact CB-CG 4.13Å; Q136-K138 PolarHBondContact O-N 3.42Å
137	L	97.4	Very high	98.1	Very high	119 Å²	119	39.5 Å²	39.5	62%	0.623	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	24.3	-175.9	-46.3	175.4	0	0	0	113.8	Y133 E134 W139	Y133-L137 PolarHBondContact O-N 2.97Å; Y133-L137 VanDerWaalsContact O-N 3.13Å; E134-L137 PolarHBondContact O-N 3.25Å; L137-W139 VanDerWaalsContact C-N 3.31Å; L137-W139 HydrophobicContact CB-CZ2 4.1Å; L137-W139 HydrophobicContact CD2-CH2 3.92Å; L137-W139 HydrophobicContact CD2-CZ2 3.47Å; L137-W139 VanDerWaalsContact CD2-CZ2 3.47Å; L137-W139 HydrophobicContact CG-CZ2 4.38Å; L137-W139 VanDerWaalsContact O-CD1 3.29Å; L137-W139 PolarHBondContact O-N 3.26Å; L137-W139 VanDerWaalsContact O-N 3.08Å; L137-W139 PolarHBondContact O-NE1 2.93Å
138	K	98	Very high	98.1	Very high	77 Å²	77	42.5 Å²	42.5	34%	0.335	21%	0.208	S	C	.	.			trans	-85.1	70.8	177.9	-74.7	-177	-178.9	163.1	0	110.7	Y133 Q136 T140 E141 V142	Y133-K138 HydrophobicContact CD1-CB 4.19Å; Y133-K138 HydrophobicContact CD1-CD 3.91Å; Y133-K138 HydrophobicContact CE1-CD 4.3Å; Y133-K138 PolarHBondContact O-N 3.45Å; Q136-K138 HydrophobicContact CB-CD 4.27Å; Q136-K138 HydrophobicContact CB-CG 4.13Å; Q136-K138 PolarHBondContact O-N 3.42Å; K138-T140 VanDerWaalsContact C-N 3.33Å; K138-T140 PolarHBondContact O-N 3.33Å; K138-E141 HydrophobicContact CB-CB 4.37Å; K138-E141 WeakPolarHBondContact CB-OE2 3.29Å; K138-E141 PolarHBondContact O-N 3.23Å; K138-V142 WeakPolarHBondContact O-CG2 3.42Å; K138-V142 PolarHBondContact O-N 3.48Å; K138-V142 VanDerWaalsContact O-N 3.09Å
139	W	98	Very high	98.1	Very high	48 Å²	48	41.2 Å²	41.2	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-36	-167.3	-55.3	119.3	0	0	0	114	E134 L137 E141 V142 V143 A166 R169 L170	E134-W139 HydrophobicContact CB-CZ3 4.47Å; E134-W139 HydrophobicContact CG-CH2 4.3Å; E134-W139 HydrophobicContact CG-CZ3 3.86Å; L137-W139 VanDerWaalsContact C-N 3.31Å; L137-W139 HydrophobicContact CB-CZ2 4.1Å; L137-W139 HydrophobicContact CD2-CH2 3.92Å; L137-W139 HydrophobicContact CD2-CZ2 3.47Å; L137-W139 VanDerWaalsContact CD2-CZ2 3.47Å; L137-W139 HydrophobicContact CG-CZ2 4.38Å; L137-W139 VanDerWaalsContact O-CD1 3.29Å; L137-W139 PolarHBondContact O-N 3.26Å; L137-W139 VanDerWaalsContact O-N 3.08Å; L137-W139 PolarHBondContact O-NE1 2.93Å; W139-E141 PolarHBondContact O-N 2.65Å; W139-V142 WeakPolarHBondContact O-CB 3.5Å; W139-V142 PolarHBondContact O-N 3.42Å; W139-V143 WeakPolarHBondContact O-CG2 3.49Å; W139-V143 PolarHBondContact O-N 3.3Å; W139-A166 HydrophobicContact CE3-CB 4.13Å; W139-R169 HydrophobicContact CD2-CB 3.79Å; W139-R169 HydrophobicContact CD2-CG 3.98Å; W139-R169 HydrophobicContact CE3-CB 4.3Å; W139-R169 HydrophobicContact CE3-CG 4.17Å; W139-R169 HydrophobicContact CG-CB 3.9Å; W139-R169 HydrophobicContact CH2-CG 4.08Å; W139-R169 HydrophobicContact CZ2-CB 4.41Å; W139-R169 HydrophobicContact CZ2-CG 3.86Å; W139-R169 HydrophobicContact CZ3-CG 4.21Å; W139-L170 HydrophobicContact CB-CD1 4.14Å; W139-L170 HydrophobicContact CB-CD2 3.88Å; W139-L170 HydrophobicContact CB-CG 3.85Å
140	T	98.2	Very high	98	Very high	78 Å²	78	40 Å²	40	48%	0.479	20%	0.197	S	C	.	.	H	α-helix	trans	-60.8	-44.4	177.1	33.4	0	0	0	0	112.1	K138 V143 Q144 L170	K138-T140 VanDerWaalsContact C-N 3.33Å; K138-T140 PolarHBondContact O-N 3.33Å; T140-V143 PolarHBondContact O-N 2.86Å; T140-Q144 WeakPolarHBondContact O-CG 3.44Å; T140-Q144 PolarHBondContact O-N 3.07Å; T140-Q144 VanDerWaalsContact O-N 3.07Å; T140-L170 HydrophobicContact CG2-CD1 4.31Å; T140-L170 HydrophobicContact CG2-CD2 4.29Å
141	E	98.3	Very high	97.9	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	23%	0.227	S	C	.	.	H	α-helix	trans	-71.3	-35.2	178.8	-64.5	89.7	143.4	0	0	111.3	Y133 K138 W139 V143 Q144 D145	Y133-E141 HydrophobicContact CD1-CB 4.02Å; Y133-E141 HydrophobicContact CD2-CB 3.74Å; Y133-E141 HydrophobicContact CE1-CB 4.24Å; Y133-E141 HydrophobicContact CE1-CG 4.42Å; Y133-E141 HydrophobicContact CE2-CB 3.98Å; Y133-E141 HydrophobicContact CG-CB 3.77Å; K138-E141 HydrophobicContact CB-CB 4.37Å; K138-E141 WeakPolarHBondContact CB-OE2 3.29Å; K138-E141 PolarHBondContact O-N 3.23Å; W139-E141 PolarHBondContact O-N 2.65Å; E141-V143 VanDerWaalsContact C-N 3.35Å; E141-V143 PolarHBondContact O-N 3.39Å; E141-Q144 PolarHBondContact O-N 3.18Å; E141-D145 PolarHBondContact O-N 2.96Å
142	V	98.6	Very high	97.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-47.3	171.3	178.2	0	0	0	0	110.6	A130 E134 K138 W139 C146 R162 A166	A130-V142 HydrophobicContact CB-CG1 4.39Å; E134-V142 HydrophobicContact CB-CG2 3.91Å; E134-V142 VanDerWaalsContact N-CG2 3.29Å; K138-V142 WeakPolarHBondContact O-CG2 3.42Å; K138-V142 PolarHBondContact O-N 3.48Å; K138-V142 VanDerWaalsContact O-N 3.09Å; W139-V142 WeakPolarHBondContact O-CB 3.5Å; W139-V142 PolarHBondContact O-N 3.42Å; V142-C146 VanDerWaalsContact O-CB 3.29Å; V142-C146 WeakPolarHBondContact O-CB 3.47Å; V142-C146 PolarHBondContact O-N 3.36Å; V142-C146 PolarHBondContact O-SG 3.2Å; V142-R162 HydrophobicContact CG1-CG 3.81Å; V142-A166 HydrophobicContact CB-CB 3.93Å; V142-A166 HydrophobicContact CG1-CB 3.64Å
143	V	98.5	Very high	97.6	Very high	26 Å²	26	50.8 Å²	50.8	16%	0.158	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-43.7	179.2	171.9	0	0	0	0	111.3	W139 T140 E141 S147 R163 A166 L167 L170	W139-V143 WeakPolarHBondContact O-CG2 3.49Å; W139-V143 PolarHBondContact O-N 3.3Å; T140-V143 PolarHBondContact O-N 2.86Å; E141-V143 VanDerWaalsContact C-N 3.35Å; E141-V143 PolarHBondContact O-N 3.39Å; V143-S147 VanDerWaalsContact O-CB 3.3Å; V143-S147 WeakPolarHBondContact O-CB 3.42Å; V143-S147 PolarHBondContact O-N 3.28Å; V143-S147 PolarHBondContact O-OG 3.01Å; V143-R163 HydrophobicContact CG1-CG 4.26Å; V143-R163 HydrophobicContact CG2-CG 4.44Å; V143-A166 HydrophobicContact CG2-CB 3.62Å; V143-L167 HydrophobicContact CG1-CD2 4.21Å; V143-L167 HydrophobicContact CG2-CD2 4.04Å; V143-L167 HydrophobicContact CG2-CG 4.1Å; V143-L170 HydrophobicContact CG2-CD1 3.94Å
144	Q	98.3	Very high	97.3	Very high	125 Å²	125	51.9 Å²	51.9	58%	0.584	26%	0.261	S	S	*	.	H	α-helix	trans	-60.4	-52.9	178.3	-72.5	174.7	0.1	0	0	111.5	T140 E141 C146 S147 Q148	T140-Q144 WeakPolarHBondContact O-CG 3.44Å; T140-Q144 PolarHBondContact O-N 3.07Å; T140-Q144 VanDerWaalsContact O-N 3.07Å; E141-Q144 PolarHBondContact O-N 3.18Å; Q144-C146 PolarHBondContact O-N 3.2Å; Q144-S147 PolarHBondContact O-N 3.05Å; Q144-Q148 PolarHBondContact O-N 3.11Å
145	D	98.4	Very high	97.1	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.043	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-40	-178.9	-86	-4.9	0	0	0	112.2	Y126 R129 A130 Y133 E141 S147 Q148 A149	Y126-D145 HydrophobicContact CD1-CB 4.49Å; R129-D145 VanDerWaalsContact CB-OD2 3.31Å; R129-D145 WeakPolarHBondContact CB-OD2 3.46Å; R129-D145 VanDerWaalsContact CG-OD2 3.31Å; R129-D145 WeakPolarHBondContact CG-OD2 3.27Å; R129-D145 IonicContact CZ-OD1 2.74Å; R129-D145 IonicContact CZ-OD2 3.85Å; R129-D145 IonicContact NE-OD1 3.38Å; R129-D145 PolarHBondContact NE-OD1 3.19Å; R129-D145 IonicContact NE-OD2 2.78Å; R129-D145 PolarHBondContact NE-OD2 2.64Å; R129-D145 IonicContact NH2-OD1 2.83Å; R129-D145 PolarHBondContact NH2-OD1 3.14Å; R129-D145 IonicContact NH2-OD2 3.74Å; A130-D145 HydrophobicContact CB-CB 3.69Å; A130-D145 PolarHBondContact N-OD2 3.41Å; Y133-D145 WeakPolarHBondContact CD2-OD2 3.3Å; Y133-D145 VanDerWaalsContact CE2-OD2 3.31Å; Y133-D145 WeakPolarHBondContact CE2-OD2 3.28Å; E141-D145 PolarHBondContact O-N 2.96Å; D145-S147 VanDerWaalsContact C-N 3.3Å; D145-S147 PolarHBondContact O-N 3.39Å; D145-Q148 PolarHBondContact O-N 3.24Å; D145-A149 PolarHBondContact O-N 3.17Å
146	C	98.5	Very high	97	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-34.2	175.2	-64.9	0	0	0	0	111.8	A130 V142 Q144 A149 V150 R163	A130-C146 WeakPolarHBondContact CB-SG 3.42Å; V142-C146 VanDerWaalsContact O-CB 3.29Å; V142-C146 WeakPolarHBondContact O-CB 3.47Å; V142-C146 PolarHBondContact O-N 3.36Å; V142-C146 PolarHBondContact O-SG 3.2Å; Q144-C146 PolarHBondContact O-N 3.2Å; C146-A149 PolarHBondContact O-N 2.95Å; C146-V150 WeakPolarHBondContact O-CB 3.23Å; C146-V150 VanDerWaalsContact O-CG2 3.24Å; C146-V150 WeakPolarHBondContact O-CG2 3.41Å; C146-V150 PolarHBondContact O-N 2.91Å; C146-R163 HydrophobicContact CB-CB 3.64Å; C146-R163 HydrophobicContact CB-CG 4.09Å
147	S	97.9	Very high	97	Very high	24 Å²	24	56 Å²	56	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-43.5	175.9	-60.1	0	0	0	0	111.7	V143 Q144 D145 A149 V150 E151 R163	V143-S147 VanDerWaalsContact O-CB 3.3Å; V143-S147 WeakPolarHBondContact O-CB 3.42Å; V143-S147 PolarHBondContact O-N 3.28Å; V143-S147 PolarHBondContact O-OG 3.01Å; Q144-S147 PolarHBondContact O-N 3.05Å; D145-S147 VanDerWaalsContact C-N 3.3Å; D145-S147 PolarHBondContact O-N 3.39Å; S147-A149 VanDerWaalsContact C-N 3.32Å; S147-A149 PolarHBondContact O-N 2.67Å; S147-V150 PolarHBondContact O-N 3.3Å; S147-E151 WeakPolarHBondContact O-CG 3.41Å; S147-E151 PolarHBondContact O-N 3.47Å; S147-R163 VanDerWaalsContact OG-CD 3.24Å; S147-R163 WeakPolarHBondContact OG-CD 3.45Å; S147-R163 PolarHBondContact OG-NH1 3.09Å
148	Q	97.8	Very high	96.9	Very high	70 Å²	70	57 Å²	57	33%	0.327	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-41.5	172.6	-68.7	-61.3	-65.2	0	0	111.9	Y126 Q144 D145 V150 E151 L152	Y126-Q148 HydrophobicContact CD1-CB 3.82Å; Y126-Q148 HydrophobicContact CD1-CG 4.44Å; Y126-Q148 HydrophobicContact CD2-CB 4Å; Y126-Q148 HydrophobicContact CE1-CB 3.87Å; Y126-Q148 HydrophobicContact CE1-CG 4.11Å; Y126-Q148 HydrophobicContact CE2-CB 4.05Å; Y126-Q148 HydrophobicContact CG-CB 3.9Å; Q144-Q148 PolarHBondContact O-N 3.11Å; D145-Q148 PolarHBondContact O-N 3.24Å; Q148-V150 VanDerWaalsContact C-N 3.35Å; Q148-V150 PolarHBondContact O-N 3.1Å; Q148-E151 PolarHBondContact NE2-OE2 3.45Å; Q148-E151 PolarHBondContact O-N 2.93Å; Q148-L152 WeakPolarHBondContact O-CD1 3.46Å; Q148-L152 VanDerWaalsContact O-CG 3.3Å; Q148-L152 WeakPolarHBondContact O-CG 3.41Å; Q148-L152 PolarHBondContact O-N 3.48Å
149	A	97.6	Very high	96.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-39.8	175.4	0	0	0	0	0	112.7	S123 Q127 D145 C146 S147 L152 N153 Y156 A159	S123-A149 WeakPolarHBondContact CB-O 3.47Å; S123-A149 WeakPolarHBondContact O-CB 3.29Å; Q127-A149 HydrophobicContact CB-CB 4.35Å; D145-A149 PolarHBondContact O-N 3.17Å; C146-A149 PolarHBondContact O-N 2.95Å; S147-A149 VanDerWaalsContact C-N 3.32Å; S147-A149 PolarHBondContact O-N 2.67Å; A149-L152 PolarHBondContact O-N 3.28Å; A149-N153 PolarHBondContact O-N 3.47Å; A149-Y156 HydrophobicContact CB-CD1 4.35Å; A149-A159 HydrophobicContact CB-CB 3.84Å
150	V	96.2	Very high	96.9	Very high	9 Å²	9	51 Å²	51	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-73.6	-35.9	179.3	171.4	0	0	0	0	112	C146 S147 Q148 L152 N153 P154 A159 L160 Y571	C146-V150 WeakPolarHBondContact O-CB 3.23Å; C146-V150 VanDerWaalsContact O-CG2 3.24Å; C146-V150 WeakPolarHBondContact O-CG2 3.41Å; C146-V150 PolarHBondContact O-N 2.91Å; S147-V150 PolarHBondContact O-N 3.3Å; Q148-V150 VanDerWaalsContact C-N 3.35Å; Q148-V150 PolarHBondContact O-N 3.1Å; V150-L152 VanDerWaalsContact C-N 3.27Å; V150-L152 PolarHBondContact O-N 3.43Å; V150-N153 CarbonylContact O-C 3.47Å; V150-N153 PolarHBondContact O-N 3.37Å; V150-P154 WeakPolarHBondContact O-CA 3.22Å; V150-P154 WeakPolarHBondContact O-CD 3.49Å; V150-A159 HydrophobicContact CG2-CB 3.87Å; V150-L160 HydrophobicContact CG1-CD2 3.88Å; V150-L160 HydrophobicContact CG2-CD2 3.73Å; V150-L160 HydrophobicContact CG2-CG 3.9Å; V150-Y571 HydrophobicContact CG1-CE1 3.73Å
151	E	95.3	Very high	96.9	Very high	133 Å²	133	49.1 Å²	49.1	62%	0.621	23%	0.234	S	C	*	.	H	α-helix	trans	-59.9	-39.2	172.5	-78	170.8	-163.8	0	0	111.8	S147 Q148	S147-E151 WeakPolarHBondContact O-CG 3.41Å; S147-E151 PolarHBondContact O-N 3.47Å; Q148-E151 PolarHBondContact NE2-OE2 3.45Å; Q148-E151 PolarHBondContact O-N 2.93Å
152	L	95.6	Very high	96.9	Very high	43 Å²	43	49 Å²	49	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-77.4	-35.7	177.9	-67	168.4	0	0	0	112.8	K119 L122 Y126 Q148 A149 V150	K119-L152 HydrophobicContact CB-CB 4.49Å; K119-L152 HydrophobicContact CB-CD2 4.25Å; K119-L152 HydrophobicContact CG-CD2 4.12Å; L122-L152 HydrophobicContact CB-CD1 3.9Å; L122-L152 HydrophobicContact CD2-CD1 3.65Å; L122-L152 HydrophobicContact CD2-CD2 4.16Å; L122-L152 HydrophobicContact CG-CD1 3.53Å; Y126-L152 HydrophobicContact CD2-CD1 3.81Å; Y126-L152 HydrophobicContact CE2-CD1 3.92Å; Q148-L152 WeakPolarHBondContact O-CD1 3.46Å; Q148-L152 VanDerWaalsContact O-CG 3.3Å; Q148-L152 WeakPolarHBondContact O-CG 3.41Å; Q148-L152 PolarHBondContact O-N 3.48Å; A149-L152 PolarHBondContact O-N 3.28Å; V150-L152 VanDerWaalsContact C-N 3.27Å; V150-L152 PolarHBondContact O-N 3.43Å
153	N	94.6	Very high	96.9	Very high	55 Å²	55	50.4 Å²	50.4	29%	0.294	24%	0.236	S	C	.	.			trans	-139	91	178.7	-177	-0.7	0	0	0	110.9	A149 V150 R155 Y156	A149-N153 PolarHBondContact O-N 3.47Å; V150-N153 CarbonylContact O-C 3.47Å; V150-N153 PolarHBondContact O-N 3.37Å; N153-R155 PolarHBondContact O-N 3.31Å; N153-R155 VanDerWaalsContact O-N 3.07Å; N153-R155 PolarHBondContact OD1-N 2.97Å; N153-Y156 VanDerWaalsContact O-CB 3.29Å; N153-Y156 WeakPolarHBondContact O-CB 2.92Å; N153-Y156 PolarHBondContact O-N 2.91Å; N153-Y156 VanDerWaalsContact O-N 3.08Å
154	P	92.7	Very high	96.9	Very high	62 Å²	62	49.2 Å²	49.2	40%	0.403	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.3	-174.4	-27	35.8	0	0	0	115.4	V150 Y571	V150-P154 WeakPolarHBondContact O-CA 3.22Å; V150-P154 WeakPolarHBondContact O-CD 3.49Å; P154-Y571 HydrophobicContact CB-CD1 4.17Å
155	R	94.3	Very high	96.9	Very high	154 Å²	154	46.5 Å²	46.5	58%	0.581	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.2	17.4	179.4	-62.5	-172.3	175.6	-166.4	-2.4	112.6	N153 I157 L186	N153-R155 PolarHBondContact O-N 3.31Å; N153-R155 VanDerWaalsContact O-N 3.07Å; N153-R155 PolarHBondContact OD1-N 2.97Å; R155-I157 PolarHBondContact O-N 3.2Å; R155-L186 HydrophobicContact CB-CD1 4.47Å; R155-L186 HydrophobicContact CB-CD2 4.2Å; R155-L186 HydrophobicContact CG-CD2 4.18Å
156	Y	96	Very high	96.9	Very high	36 Å²	36	46.1 Å²	46.1	14%	0.141	21%	0.213	C	C	.	.			trans	-79.8	88.7	-177.2	-168.3	-168	0	0	0	112.6	Q127 A149 N153 K158 A159 L160	Q127-Y156 HydrophobicContact CB-CD1 4.39Å; Q127-Y156 HydrophobicContact CB-CE1 3.44Å; Q127-Y156 VanDerWaalsContact CB-CE1 3.44Å; Q127-Y156 HydrophobicContact CG-CE1 3.62Å; Q127-Y156 PolarHBondContact OE1-OH 3.1Å; A149-Y156 HydrophobicContact CB-CD1 4.35Å; N153-Y156 VanDerWaalsContact O-CB 3.29Å; N153-Y156 WeakPolarHBondContact O-CB 2.92Å; N153-Y156 PolarHBondContact O-N 2.91Å; N153-Y156 VanDerWaalsContact O-N 3.08Å; Y156-K158 VanDerWaalsContact C-N 3.3Å; Y156-K158 HydrophobicContact CD2-CB 4.24Å; Y156-K158 HydrophobicContact CE2-CB 3.66Å; Y156-K158 HydrophobicContact CE2-CD 4.2Å; Y156-K158 HydrophobicContact CE2-CG 4.14Å; Y156-K158 PolarHBondContact O-N 3.29Å; Y156-K158 VanDerWaalsContact O-N 3.17Å; Y156-A159 HydrophobicContact CD1-CB 3.52Å; Y156-A159 HydrophobicContact CE1-CB 4.09Å; Y156-A159 HydrophobicContact CG-CB 3.91Å; Y156-A159 PolarHBondContact O-N 3.08Å; Y156-L160 PolarHBondContact O-N 3.01Å
157	I	96.5	Very high	96.9	Very high	54 Å²	54	46.6 Å²	46.6	28%	0.277	22%	0.216	S	C	.	.	H	α-helix	trans	-48.8	-45.8	-176.6	-60.8	173.8	0	0	0	112.9	R155 A159 L160 F161 V183 L186 E187	R155-I157 PolarHBondContact O-N 3.2Å; I157-A159 VanDerWaalsContact C-N 3.34Å; I157-A159 PolarHBondContact O-N 3.29Å; I157-L160 PolarHBondContact O-N 3.05Å; I157-F161 WeakPolarHBondContact O-CB 3.43Å; I157-F161 PolarHBondContact O-N 2.78Å; I157-V183 HydrophobicContact CG2-CG1 4.15Å; I157-L186 HydrophobicContact CD1-CB 3.88Å; I157-L186 HydrophobicContact CG1-CB 3.79Å; I157-L186 HydrophobicContact CG1-CD1 3.86Å; I157-L186 HydrophobicContact CG1-CG 4.44Å; I157-E187 HydrophobicContact CD1-CG 4Å; I157-E187 HydrophobicContact CG2-CG 3.97Å
158	K	96.6	Very high	96.8	Very high	138 Å²	138	47.4 Å²	47.4	60%	0.6	22%	0.217	S	C	*	.	H	α-helix	trans	-65.1	-35	-178.6	-67	-178.4	178.6	174.8	0	113.1	Q127 Y156 R162	Q127-K158 HydrophobicContact CG-CB 4.45Å; Y156-K158 VanDerWaalsContact C-N 3.3Å; Y156-K158 HydrophobicContact CD2-CB 4.24Å; Y156-K158 HydrophobicContact CE2-CB 3.66Å; Y156-K158 HydrophobicContact CE2-CD 4.2Å; Y156-K158 HydrophobicContact CE2-CG 4.14Å; Y156-K158 PolarHBondContact O-N 3.29Å; Y156-K158 VanDerWaalsContact O-N 3.17Å; K158-R162 VanDerWaalsContact O-CB 3.26Å; K158-R162 WeakPolarHBondContact O-CB 3.26Å; K158-R162 PolarHBondContact O-N 3.36Å
159	A	97.8	Very high	96.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.3	-45.5	177.7	0	0	0	0	0	110.7	Q127 A149 V150 Y156 I157 R162 R163	Q127-A159 HydrophobicContact CG-CB 4.19Å; A149-A159 HydrophobicContact CB-CB 3.84Å; V150-A159 HydrophobicContact CG2-CB 3.87Å; Y156-A159 HydrophobicContact CD1-CB 3.52Å; Y156-A159 HydrophobicContact CE1-CB 4.09Å; Y156-A159 HydrophobicContact CG-CB 3.91Å; Y156-A159 PolarHBondContact O-N 3.08Å; I157-A159 VanDerWaalsContact C-N 3.34Å; I157-A159 PolarHBondContact O-N 3.29Å; A159-R162 PolarHBondContact O-N 3.23Å; A159-R163 WeakPolarHBondContact O-CB 3.46Å; A159-R163 PolarHBondContact O-N 3.39Å
160	L	97.8	Very high	96.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-50.1	175.4	-71.1	166.9	0	0	0	111.6	V150 Y156 I157 R162 R163 A164 A182 V183 L186 Y571	V150-L160 HydrophobicContact CG1-CD2 3.88Å; V150-L160 HydrophobicContact CG2-CD2 3.73Å; V150-L160 HydrophobicContact CG2-CG 3.9Å; Y156-L160 PolarHBondContact O-N 3.01Å; I157-L160 PolarHBondContact O-N 3.05Å; L160-R162 PolarHBondContact O-N 2.92Å; L160-R163 PolarHBondContact O-N 3.47Å; L160-A164 PolarHBondContact O-N 2.7Å; L160-A182 HydrophobicContact CD1-CB 4.26Å; L160-V183 HydrophobicContact CB-CG2 3.52Å; L160-L186 HydrophobicContact CD1-CD1 3.74Å; L160-Y571 HydrophobicContact CD2-CE1 4.07Å
161	F	98.1	Very high	96.8	Very high	39 Å²	39	59.2 Å²	59.2	17%	0.171	27%	0.269	C	S	.	.	H	α-helix	trans	-66	-37.3	-178.7	-171.4	-117.5	0	0	0	112.6	I157 A164 K165 V183 Q193 L197	I157-F161 WeakPolarHBondContact O-CB 3.43Å; I157-F161 PolarHBondContact O-N 2.78Å; F161-A164 PolarHBondContact O-N 3.31Å; F161-K165 HydrophobicContact CD1-CD 4.36Å; F161-K165 HydrophobicContact CE1-CD 3.99Å; F161-K165 HydrophobicContact CZ-CD 4.36Å; F161-K165 HydrophobicContact CZ-CG 4.48Å; F161-K165 WeakPolarHBondContact O-CG 3.34Å; F161-K165 PolarHBondContact O-N 3.35Å; F161-K165 VanDerWaalsContact O-N 3.07Å; F161-V183 HydrophobicContact CB-CG1 4.37Å; F161-V183 HydrophobicContact CB-CG2 3.96Å; F161-V183 HydrophobicContact CD2-CG1 4.19Å; F161-Q193 HydrophobicContact CZ-CB 4.12Å; F161-L197 HydrophobicContact CD2-CD2 4.43Å; F161-L197 HydrophobicContact CE2-CD2 3.87Å
162	R	98.3	Very high	96.9	Very high	52 Å²	52	56.2 Å²	56.2	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-37.7	175	-168	177.4	-54	-101.6	3	111.7	Q127 A131 E134 V142 K158 A159 L160 A166	Q127-R162 VanDerWaalsContact NE2-NE 3.19Å; A131-R162 VanDerWaalsContact CB-NH1 3.28Å; E134-R162 WeakPolarHBondContact OE2-CD 3.46Å; E134-R162 VanDerWaalsContact OE2-CG 3.3Å; E134-R162 WeakPolarHBondContact OE2-CG 3.41Å; E134-R162 IonicContact OE2-CZ 3.68Å; E134-R162 IonicContact OE2-NE 3.82Å; E134-R162 IonicContact OE2-NH1 2.73Å; E134-R162 PolarHBondContact OE2-NH1 3.41Å; V142-R162 HydrophobicContact CG1-CG 3.81Å; K158-R162 VanDerWaalsContact O-CB 3.26Å; K158-R162 WeakPolarHBondContact O-CB 3.26Å; K158-R162 PolarHBondContact O-N 3.36Å; A159-R162 PolarHBondContact O-N 3.23Å; L160-R162 PolarHBondContact O-N 2.92Å; R162-A166 PolarHBondContact O-N 3.4Å; R162-A166 VanDerWaalsContact O-N 3.08Å
163	R	98.5	Very high	96.9	Very high	31 Å²	31	55.1 Å²	55.1	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-46.2	174	-164.2	167.6	65.6	170.5	3.5	111.4	V143 C146 S147 A159 L160 K165 A166 L167 D179 Y571	V143-R163 HydrophobicContact CG1-CG 4.26Å; V143-R163 HydrophobicContact CG2-CG 4.44Å; C146-R163 HydrophobicContact CB-CB 3.64Å; C146-R163 HydrophobicContact CB-CG 4.09Å; S147-R163 VanDerWaalsContact OG-CD 3.24Å; S147-R163 WeakPolarHBondContact OG-CD 3.45Å; S147-R163 PolarHBondContact OG-NH1 3.09Å; A159-R163 WeakPolarHBondContact O-CB 3.46Å; A159-R163 PolarHBondContact O-N 3.39Å; L160-R163 PolarHBondContact O-N 3.47Å; R163-K165 VanDerWaalsContact C-N 3.34Å; R163-K165 PolarHBondContact O-N 3.32Å; R163-A166 PolarHBondContact O-N 3.17Å; R163-L167 HydrophobicContact CG-CD1 3.93Å; R163-L167 HydrophobicContact CG-CG 4.3Å; R163-L167 WeakPolarHBondContact O-CB 3.49Å; R163-L167 VanDerWaalsContact O-CG 3.29Å; R163-L167 WeakPolarHBondContact O-CG 3.48Å; R163-L167 PolarHBondContact O-N 3.48Å; R163-D179 WeakPolarHBondContact CB-OD2 3.3Å; R163-D179 VanDerWaalsContact CG-OD2 3.32Å; R163-D179 WeakPolarHBondContact CG-OD2 3.01Å; R163-D179 IonicContact CZ-OD1 2.58Å; R163-D179 IonicContact CZ-OD2 3.67Å; R163-D179 IonicContact NE-OD1 3.7Å; R163-D179 PolarHBondContact NE-OD1 3.24Å; R163-D179 IonicContact NE-OD2 2.69Å; R163-D179 PolarHBondContact NE-OD2 2.78Å; R163-D179 IonicContact NH2-OD1 3.42Å; R163-D179 PolarHBondContact NH2-OD1 3.05Å; R163-D179 IonicContact NH2-OD2 2.82Å; R163-Y571 PolarHBondContact NH2-OH 3.38Å
164	A	98.1	Very high	97	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.9	-49.6	174.9	0	0	0	0	0	111.6	L160 F161 A166 L167 E168 C176 D179 V180 L197	L160-A164 PolarHBondContact O-N 2.7Å; F161-A164 PolarHBondContact O-N 3.31Å; A164-A166 VanDerWaalsContact C-N 3.33Å; A164-A166 PolarHBondContact O-N 3.31Å; A164-L167 PolarHBondContact O-N 3.14Å; A164-E168 PolarHBondContact O-N 3.37Å; A164-C176 PolarHBondContact O-SG 2.89Å; A164-D179 HydrophobicContact CB-CB 3.78Å; A164-V180 HydrophobicContact CB-CB 4.31Å; A164-L197 HydrophobicContact CB-CD2 4.02Å
165	K	98.1	Very high	97.1	Very high	68 Å²	68	61.7 Å²	61.7	30%	0.296	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-41.6	175.6	-73.6	-179.6	69.7	-160.7	0	113	E134 F161 R163 E168 R169 L197	E134-K165 IonicContact OE1-NZ 2.74Å; E134-K165 PolarHBondContact OE1-NZ 2.64Å; F161-K165 HydrophobicContact CD1-CD 4.36Å; F161-K165 HydrophobicContact CE1-CD 3.99Å; F161-K165 HydrophobicContact CZ-CD 4.36Å; F161-K165 HydrophobicContact CZ-CG 4.48Å; F161-K165 WeakPolarHBondContact O-CG 3.34Å; F161-K165 PolarHBondContact O-N 3.35Å; F161-K165 VanDerWaalsContact O-N 3.07Å; R163-K165 VanDerWaalsContact C-N 3.34Å; R163-K165 PolarHBondContact O-N 3.32Å; K165-E168 WeakPolarHBondContact O-CB 3.47Å; K165-R169 VanDerWaalsContact O-CG 3.32Å; K165-R169 WeakPolarHBondContact O-CG 3.46Å; K165-R169 PolarHBondContact O-N 2.77Å; K165-L197 HydrophobicContact CG-CD2 4.35Å
166	A	98.3	Very high	97.3	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-38.4	179	0	0	0	0	0	111.9	W139 V142 V143 R162 R163 A164 R169 L170	W139-A166 HydrophobicContact CE3-CB 4.13Å; V142-A166 HydrophobicContact CB-CB 3.93Å; V142-A166 HydrophobicContact CG1-CB 3.64Å; V143-A166 HydrophobicContact CG2-CB 3.62Å; R162-A166 PolarHBondContact O-N 3.4Å; R162-A166 VanDerWaalsContact O-N 3.08Å; R163-A166 PolarHBondContact O-N 3.17Å; A164-A166 VanDerWaalsContact C-N 3.33Å; A164-A166 PolarHBondContact O-N 3.31Å; A166-R169 PolarHBondContact O-N 3.37Å; A166-L170 WeakPolarHBondContact O-CG 3.38Å; A166-L170 PolarHBondContact O-N 2.73Å; A166-L170 VanDerWaalsContact O-N 3.09Å
167	L	98.4	Very high	97.3	Very high	10 Å²	10	53 Å²	53	5%	0.052	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-40.7	174.3	-70.1	165.9	0	0	0	111.7	V143 R163 A164 R169 L170 D171 N172 E175 C176 D179	V143-L167 HydrophobicContact CG1-CD2 4.21Å; V143-L167 HydrophobicContact CG2-CD2 4.04Å; V143-L167 HydrophobicContact CG2-CG 4.1Å; R163-L167 HydrophobicContact CG-CD1 3.93Å; R163-L167 HydrophobicContact CG-CG 4.3Å; R163-L167 WeakPolarHBondContact O-CB 3.49Å; R163-L167 VanDerWaalsContact O-CG 3.29Å; R163-L167 WeakPolarHBondContact O-CG 3.48Å; R163-L167 PolarHBondContact O-N 3.48Å; A164-L167 PolarHBondContact O-N 3.14Å; L167-R169 VanDerWaalsContact C-N 3.28Å; L167-R169 PolarHBondContact O-N 3.11Å; L167-L170 CarbonylContact O-C 3.43Å; L167-L170 PolarHBondContact O-N 2.82Å; L167-L170 VanDerWaalsContact O-N 3.11Å; L167-D171 PolarHBondContact O-N 3.08Å; L167-D171 VanDerWaalsContact O-N 3.13Å; L167-N172 HydrophobicContact CB-CB 4.16Å; L167-N172 HydrophobicContact CD2-CB 3.73Å; L167-N172 PolarHBondContact O-N 2.96Å; L167-E175 HydrophobicContact CD1-CB 3.69Å; L167-E175 HydrophobicContact CD2-CB 4.18Å; L167-E175 HydrophobicContact CG-CB 4.5Å; L167-C176 HydrophobicContact CB-CB 3.83Å; L167-D179 WeakPolarHBondContact CD1-OD2 3.45Å
168	E	97.1	Very high	97.2	Very high	41 Å²	41	51.2 Å²	51.2	19%	0.192	23%	0.226	C	C	.	.	H	α-helix	trans	-56.6	-41.6	171.7	-170.1	-158.9	-176.7	0	0	111.5	A164 K165 L170 D171 L197 K200	A164-E168 PolarHBondContact O-N 3.37Å; K165-E168 WeakPolarHBondContact O-CB 3.47Å; E168-L170 VanDerWaalsContact C-N 3.29Å; E168-L170 PolarHBondContact O-N 2.88Å; E168-D171 PolarHBondContact O-N 3.31Å; E168-L197 HydrophobicContact CB-CD1 4.46Å; E168-L197 HydrophobicContact CG-CD1 4.14Å; E168-L197 WeakPolarHBondContact OE2-CD1 3.44Å; E168-K200 WeakPolarHBondContact OE1-CE 3.2Å; E168-K200 IonicContact OE1-NZ 3.2Å; E168-K200 PolarHBondContact OE1-NZ 2.89Å
169	R	96.9	Very high	97.2	Very high	161 Å²	161	44.8 Å²	44.8	61%	0.608	20%	0.198	S	C	*	.	H	α-helix	trans	-71.3	-23.8	178.1	-63.7	-62.9	179.4	143.5	1.5	113.7	W139 K165 A166 L167 D171	W139-R169 HydrophobicContact CD2-CB 3.79Å; W139-R169 HydrophobicContact CD2-CG 3.98Å; W139-R169 HydrophobicContact CE3-CB 4.3Å; W139-R169 HydrophobicContact CE3-CG 4.17Å; W139-R169 HydrophobicContact CG-CB 3.9Å; W139-R169 HydrophobicContact CH2-CG 4.08Å; W139-R169 HydrophobicContact CZ2-CB 4.41Å; W139-R169 HydrophobicContact CZ2-CG 3.86Å; W139-R169 HydrophobicContact CZ3-CG 4.21Å; K165-R169 VanDerWaalsContact O-CG 3.32Å; K165-R169 WeakPolarHBondContact O-CG 3.46Å; K165-R169 PolarHBondContact O-N 2.77Å; A166-R169 PolarHBondContact O-N 3.37Å; L167-R169 VanDerWaalsContact C-N 3.28Å; L167-R169 PolarHBondContact O-N 3.11Å; R169-D171 VanDerWaalsContact C-N 3.34Å
170	L	97.4	Very high	97.1	Very high	63 Å²	63	44.8 Å²	44.8	33%	0.33	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	4.1	176.2	-67.4	173.1	0	0	0	112.8	W139 T140 V143 A166 L167 E168 N172	W139-L170 HydrophobicContact CB-CD1 4.14Å; W139-L170 HydrophobicContact CB-CD2 3.88Å; W139-L170 HydrophobicContact CB-CG 3.85Å; T140-L170 HydrophobicContact CG2-CD1 4.31Å; T140-L170 HydrophobicContact CG2-CD2 4.29Å; V143-L170 HydrophobicContact CG2-CD1 3.94Å; A166-L170 WeakPolarHBondContact O-CG 3.38Å; A166-L170 PolarHBondContact O-N 2.73Å; A166-L170 VanDerWaalsContact O-N 3.09Å; L167-L170 CarbonylContact O-C 3.43Å; L167-L170 PolarHBondContact O-N 2.82Å; L167-L170 VanDerWaalsContact O-N 3.11Å; E168-L170 VanDerWaalsContact C-N 3.29Å; E168-L170 PolarHBondContact O-N 2.88Å; L170-N172 PolarHBondContact O-N 3.01Å
171	D	96.8	Very high	96.8	Very high	102 Å²	102	45.6 Å²	45.6	55%	0.545	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	18.4	-174.9	-153.3	44.9	0	0	0	114.8	L167 E168 R169 K173	L167-D171 PolarHBondContact O-N 3.08Å; L167-D171 VanDerWaalsContact O-N 3.13Å; E168-D171 PolarHBondContact O-N 3.31Å; R169-D171 VanDerWaalsContact C-N 3.34Å; D171-K173 VanDerWaalsContact C-N 3.26Å; D171-K173 PolarHBondContact O-N 3.2Å; D171-K173 WeakPolarHBondContact OD1-CE 3.39Å; D171-K173 IonicContact OD1-NZ 3.39Å; D171-K173 PolarHBondContact OD1-NZ 3.4Å; D171-K173 IonicContact OD2-NZ 2.63Å; D171-K173 PolarHBondContact OD2-NZ 3Å; D171-K173 VanDerWaalsContact OD2-NZ 3.12Å
172	N	97.2	Very high	96.7	Very high	70 Å²	70	43.7 Å²	43.7	37%	0.374	19%	0.194	S	C	.	.			trans	-83.8	69.1	174.2	-74.5	-9.1	0	0	0	110.3	L167 L170 R174 C176	L167-N172 HydrophobicContact CB-CB 4.16Å; L167-N172 HydrophobicContact CD2-CB 3.73Å; L167-N172 PolarHBondContact O-N 2.96Å; L170-N172 PolarHBondContact O-N 3.01Å; N172-R174 VanDerWaalsContact C-N 3.34Å; N172-R174 PolarHBondContact O-N 3.24Å; N172-C176 WeakPolarHBondContact O-CB 3.32Å; N172-C176 PolarHBondContact O-N 3.06Å
173	K	96.4	Very high	96.5	Very high	21 Å²	21	41.2 Å²	41.2	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-35	-171.5	-59.6	-174.1	-168.2	87.6	0	113.3	D171 C176 L177 V201 Q204 L205 E208	D171-K173 VanDerWaalsContact C-N 3.26Å; D171-K173 PolarHBondContact O-N 3.2Å; D171-K173 WeakPolarHBondContact OD1-CE 3.39Å; D171-K173 IonicContact OD1-NZ 3.39Å; D171-K173 PolarHBondContact OD1-NZ 3.4Å; D171-K173 IonicContact OD2-NZ 2.63Å; D171-K173 PolarHBondContact OD2-NZ 3Å; D171-K173 VanDerWaalsContact OD2-NZ 3.12Å; K173-C176 WeakPolarHBondContact O-CB 3.31Å; K173-C176 PolarHBondContact O-N 2.83Å; K173-L177 WeakPolarHBondContact O-CB 3.5Å; K173-L177 PolarHBondContact O-N 3.28Å; K173-V201 HydrophobicContact CB-CG1 4.15Å; K173-V201 VanDerWaalsContact O-CG1 3.32Å; K173-V201 WeakPolarHBondContact O-CG1 3.17Å; K173-Q204 HydrophobicContact CD-CB 4.11Å; K173-L205 HydrophobicContact CB-CD1 4.18Å; K173-L205 HydrophobicContact CB-CD2 3.71Å; K173-L205 HydrophobicContact CB-CG 3.88Å; K173-L205 HydrophobicContact CD-CD2 4.25Å; K173-L205 HydrophobicContact CD-CG 4.35Å; K173-E208 WeakPolarHBondContact CE-OE1 3.35Å; K173-E208 IonicContact NZ-OE1 3.44Å; K173-E208 PolarHBondContact NZ-OE1 2.73Å; K173-E208 IonicContact NZ-OE2 3.65Å; K173-E208 PolarHBondContact NZ-OE2 3.04Å
174	R	95.6	Very high	96.2	Very high	168 Å²	168	39.9 Å²	39.9	63%	0.634	18%	0.18	S	C	*	.	H	α-helix	trans	-68	-53.6	-177.4	-168	-178.2	-156.3	161.6	7.1	111.7	N172 C176 L177 E178	N172-R174 VanDerWaalsContact C-N 3.34Å; N172-R174 PolarHBondContact O-N 3.24Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 3.14Å; R174-L177 WeakPolarHBondContact O-CB 3.43Å; R174-L177 PolarHBondContact O-N 3.4Å; R174-E178 WeakPolarHBondContact O-CG 3.25Å; R174-E178 PolarHBondContact O-N 2.83Å; R174-E178 VanDerWaalsContact O-N 3.11Å
175	E	96.1	Very high	95.7	Very high	86 Å²	86	41 Å²	41	40%	0.402	19%	0.186	S	C	.	.	H	α-helix	trans	-65.1	-34.3	176.5	-62.1	89.2	171.4	0	0	111.3	L167 L177 E178 D179	L167-E175 HydrophobicContact CD1-CB 3.69Å; L167-E175 HydrophobicContact CD2-CB 4.18Å; L167-E175 HydrophobicContact CG-CB 4.5Å; E175-L177 VanDerWaalsContact C-N 3.33Å; E175-L177 PolarHBondContact O-N 3.42Å; E175-E178 PolarHBondContact O-N 3.2Å; E175-D179 PolarHBondContact O-N 3.2Å
176	C	97.8	Very high	95.3	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-46	172.9	-179.5	0	0	0	0	111.4	A164 L167 N172 K173 R174 E178 D179 V180	A164-C176 PolarHBondContact O-SG 2.89Å; L167-C176 HydrophobicContact CB-CB 3.83Å; N172-C176 WeakPolarHBondContact O-CB 3.32Å; N172-C176 PolarHBondContact O-N 3.06Å; K173-C176 WeakPolarHBondContact O-CB 3.31Å; K173-C176 PolarHBondContact O-N 2.83Å; R174-C176 VanDerWaalsContact C-N 3.26Å; R174-C176 PolarHBondContact O-N 3.14Å; C176-E178 PolarHBondContact O-N 3.1Å; C176-D179 PolarHBondContact O-N 3.24Å; C176-V180 WeakPolarHBondContact O-CG1 3.39Å; C176-V180 PolarHBondContact O-N 3.23Å
177	L	94.9	Very high	94.9	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-42.4	178.6	-178.2	60.8	0	0	0	111.9	K173 R174 E175 V180 T181 V201 L202 L205 D559 A563	K173-L177 WeakPolarHBondContact O-CB 3.5Å; K173-L177 PolarHBondContact O-N 3.28Å; R174-L177 WeakPolarHBondContact O-CB 3.43Å; R174-L177 PolarHBondContact O-N 3.4Å; E175-L177 VanDerWaalsContact C-N 3.33Å; E175-L177 PolarHBondContact O-N 3.42Å; L177-V180 HydrophobicContact CD1-CG1 4.3Å; L177-V180 WeakPolarHBondContact O-CG1 3.48Å; L177-T181 WeakPolarHBondContact O-CB 3.43Å; L177-T181 PolarHBondContact O-N 2.74Å; L177-T181 PolarHBondContact O-OG1 3.26Å; L177-V201 HydrophobicContact CB-CG1 3.92Å; L177-V201 HydrophobicContact CD1-CG1 4.49Å; L177-L202 HydrophobicContact CD1-CD1 4.39Å; L177-L202 HydrophobicContact CD1-CD2 3.66Å; L177-L202 HydrophobicContact CD1-CG 3.66Å; L177-L202 HydrophobicContact CD2-CD2 3.59Å; L177-L202 HydrophobicContact CD2-CG 4.46Å; L177-L202 HydrophobicContact CG-CD2 4.28Å; L177-L205 HydrophobicContact CB-CD1 4.32Å; L177-L205 HydrophobicContact CD2-CD1 3.86Å; L177-D559 HydrophobicContact CD2-CB 3.99Å; L177-A563 HydrophobicContact CD2-CB 3.99Å; L177-A563 HydrophobicContact CG-CB 3.83Å
178	E	94.8	Very high	94.5	Very high	18 Å²	18	43.1 Å²	43.1	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-47.4	177	-66.2	169.3	-176.3	0	0	111.5	R174 E175 C176 T181 A182 E566 V567 K570	R174-E178 WeakPolarHBondContact O-CG 3.25Å; R174-E178 PolarHBondContact O-N 2.83Å; R174-E178 VanDerWaalsContact O-N 3.11Å; E175-E178 PolarHBondContact O-N 3.2Å; C176-E178 PolarHBondContact O-N 3.1Å; E178-T181 PolarHBondContact O-N 3.13Å; E178-A182 PolarHBondContact O-N 3.01Å; E178-E566 HydrophobicContact CG-CB 4.23Å; E178-V567 WeakPolarHBondContact O-CG2 3.42Å; E178-K570 IonicContact OE1-NZ 3.14Å; E178-K570 IonicContact OE2-NZ 3.75Å; E178-K570 PolarHBondContact OE2-NZ 3.28Å
179	D	96.7	Very high	94	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-46.3	179.3	-83.4	-11.1	0	0	0	112.2	R163 A164 L167 E175 C176 T181 A182 V183 Y571	R163-D179 WeakPolarHBondContact CB-OD2 3.3Å; R163-D179 VanDerWaalsContact CG-OD2 3.32Å; R163-D179 WeakPolarHBondContact CG-OD2 3.01Å; R163-D179 IonicContact CZ-OD1 2.58Å; R163-D179 IonicContact CZ-OD2 3.67Å; R163-D179 IonicContact NE-OD1 3.7Å; R163-D179 PolarHBondContact NE-OD1 3.24Å; R163-D179 IonicContact NE-OD2 2.69Å; R163-D179 PolarHBondContact NE-OD2 2.78Å; R163-D179 IonicContact NH2-OD1 3.42Å; R163-D179 PolarHBondContact NH2-OD1 3.05Å; R163-D179 IonicContact NH2-OD2 2.82Å; A164-D179 HydrophobicContact CB-CB 3.78Å; L167-D179 WeakPolarHBondContact CD1-OD2 3.45Å; E175-D179 PolarHBondContact O-N 3.2Å; C176-D179 PolarHBondContact O-N 3.24Å; D179-T181 VanDerWaalsContact C-N 3.3Å; D179-T181 PolarHBondContact O-N 3.25Å; D179-A182 PolarHBondContact O-N 3.43Å; D179-V183 WeakPolarHBondContact O-CG2 3.46Å; D179-V183 PolarHBondContact O-N 2.99Å; D179-Y571 PolarHBondContact OD1-OH 3.24Å
180	V	95.4	Very high	93.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-32	179	75.2	0	0	0	0	111.4	A164 C176 L177 V183 C184 S194 L197 A198	A164-V180 HydrophobicContact CB-CB 4.31Å; C176-V180 WeakPolarHBondContact O-CG1 3.39Å; C176-V180 PolarHBondContact O-N 3.23Å; L177-V180 HydrophobicContact CD1-CG1 4.3Å; L177-V180 WeakPolarHBondContact O-CG1 3.48Å; V180-V183 WeakPolarHBondContact O-CB 3.49Å; V180-V183 PolarHBondContact O-N 3.39Å; V180-C184 WeakPolarHBondContact O-CB 3.26Å; V180-C184 PolarHBondContact O-N 3.28Å; V180-C184 PolarHBondContact O-SG 2.95Å; V180-S194 WeakPolarHBondContact CG2-O 3.35Å; V180-L197 HydrophobicContact CB-CD2 4.38Å; V180-L197 HydrophobicContact CG2-CB 4.03Å; V180-L197 HydrophobicContact CG2-CD2 4.02Å; V180-L197 HydrophobicContact CG2-CG 4.05Å; V180-A198 HydrophobicContact CG1-CB 3.8Å; V180-A198 HydrophobicContact CG2-CB 4.09Å
181	T	92.8	Very high	93.1	Very high	16 Å²	16	44 Å²	44	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-44.3	172.8	-62.2	0	0	0	0	111	L177 E178 D179 V183 C184 I185 A563 Q564 V567	L177-T181 WeakPolarHBondContact O-CB 3.43Å; L177-T181 PolarHBondContact O-N 2.74Å; L177-T181 PolarHBondContact O-OG1 3.26Å; E178-T181 PolarHBondContact O-N 3.13Å; D179-T181 VanDerWaalsContact C-N 3.3Å; D179-T181 PolarHBondContact O-N 3.25Å; T181-V183 VanDerWaalsContact C-N 3.33Å; T181-V183 PolarHBondContact O-N 2.88Å; T181-C184 PolarHBondContact O-N 3.49Å; T181-I185 HydrophobicContact CG2-CD1 4.06Å; T181-I185 WeakPolarHBondContact O-CG1 3.48Å; T181-I185 PolarHBondContact O-N 3.24Å; T181-A563 HydrophobicContact CG2-CB 4.26Å; T181-Q564 HydrophobicContact CG2-CG 4.05Å; T181-V567 HydrophobicContact CG2-CG2 4.03Å
182	A	94.4	Very high	92.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-42.3	173.9	0	0	0	0	0	111.9	L160 E178 D179 I185 L186 V567 Y571 L573	L160-A182 HydrophobicContact CD1-CB 4.26Å; E178-A182 PolarHBondContact O-N 3.01Å; D179-A182 PolarHBondContact O-N 3.43Å; A182-I185 PolarHBondContact O-N 3.27Å; A182-L186 WeakPolarHBondContact O-CB 3.27Å; A182-L186 VanDerWaalsContact O-CG 3.26Å; A182-L186 WeakPolarHBondContact O-CG 3.48Å; A182-L186 PolarHBondContact O-N 3.04Å; A182-V567 HydrophobicContact CB-CG1 3.91Å; A182-V567 HydrophobicContact CB-CG2 4.05Å; A182-Y571 HydrophobicContact CB-CD2 3.99Å; A182-Y571 HydrophobicContact CB-CE2 4.08Å; A182-L573 HydrophobicContact CB-CD1 4.19Å
183	V	95.4	Very high	92.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-49.6	175	169.3	0	0	0	0	111.2	I157 L160 F161 D179 V180 T181 I185 L186 E187	I157-V183 HydrophobicContact CG2-CG1 4.15Å; L160-V183 HydrophobicContact CB-CG2 3.52Å; F161-V183 HydrophobicContact CB-CG1 4.37Å; F161-V183 HydrophobicContact CB-CG2 3.96Å; F161-V183 HydrophobicContact CD2-CG1 4.19Å; D179-V183 WeakPolarHBondContact O-CG2 3.46Å; D179-V183 PolarHBondContact O-N 2.99Å; V180-V183 WeakPolarHBondContact O-CB 3.49Å; V180-V183 PolarHBondContact O-N 3.39Å; T181-V183 VanDerWaalsContact C-N 3.33Å; T181-V183 PolarHBondContact O-N 2.88Å; V183-I185 VanDerWaalsContact C-N 3.31Å; V183-I185 PolarHBondContact O-N 2.93Å; V183-L186 PolarHBondContact O-N 3.35Å; V183-E187 HydrophobicContact CG1-CG 4.29Å; V183-E187 WeakPolarHBondContact CG1-OE2 3.32Å; V183-E187 WeakPolarHBondContact O-CB 3.41Å; V183-E187 WeakPolarHBondContact O-CG 3.38Å; V183-E187 PolarHBondContact O-N 3.36Å
184	C	90.7	Very high	92.4	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-42.4	178.8	-70.6	0	0	0	0	111.8	V180 T181 A188 F189 M195	V180-C184 WeakPolarHBondContact O-CB 3.26Å; V180-C184 PolarHBondContact O-N 3.28Å; V180-C184 PolarHBondContact O-SG 2.95Å; T181-C184 PolarHBondContact O-N 3.49Å; C184-A188 PolarHBondContact O-N 3.34Å; C184-A188 VanDerWaalsContact O-N 3.11Å; C184-F189 HydrophobicContact CB-CD1 3.82Å; C184-F189 HydrophobicContact CB-CE1 3.74Å; C184-F189 HydrophobicContact CB-CZ 4.42Å; C184-F189 PolarHBondContact O-N 3.29Å; C184-M195 HydrophobicContact CB-SD 4.35Å
185	I	88.1	Confident	92.1	Very high	22 Å²	22	44.2 Å²	44.2	11%	0.113	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-46.3	176.5	-67.7	167.3	0	0	0	111	T181 A182 V183 E187 A188 F189 V567 L573	T181-I185 HydrophobicContact CG2-CD1 4.06Å; T181-I185 WeakPolarHBondContact O-CG1 3.48Å; T181-I185 PolarHBondContact O-N 3.24Å; A182-I185 PolarHBondContact O-N 3.27Å; V183-I185 VanDerWaalsContact C-N 3.31Å; V183-I185 PolarHBondContact O-N 2.93Å; I185-E187 VanDerWaalsContact C-N 3.33Å; I185-E187 PolarHBondContact O-N 3.45Å; I185-A188 PolarHBondContact O-N 3.1Å; I185-A188 VanDerWaalsContact O-N 3.12Å; I185-F189 HydrophobicContact CG1-CE2 4.3Å; I185-F189 HydrophobicContact CG1-CZ 3.96Å; I185-V567 HydrophobicContact CD1-CG1 3.89Å; I185-L573 HydrophobicContact CG2-CB 4.16Å
186	L	90.3	Very high	91.9	Very high	47 Å²	47	45.7 Å²	45.7	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-65.7	-34.1	-179.9	-72.6	170.9	0	0	0	113.1	R155 I157 L160 A182 V183 A188 L573	R155-L186 HydrophobicContact CB-CD1 4.47Å; R155-L186 HydrophobicContact CB-CD2 4.2Å; R155-L186 HydrophobicContact CG-CD2 4.18Å; I157-L186 HydrophobicContact CD1-CB 3.88Å; I157-L186 HydrophobicContact CG1-CB 3.79Å; I157-L186 HydrophobicContact CG1-CD1 3.86Å; I157-L186 HydrophobicContact CG1-CG 4.44Å; L160-L186 HydrophobicContact CD1-CD1 3.74Å; A182-L186 WeakPolarHBondContact O-CB 3.27Å; A182-L186 VanDerWaalsContact O-CG 3.26Å; A182-L186 WeakPolarHBondContact O-CG 3.48Å; A182-L186 PolarHBondContact O-N 3.04Å; V183-L186 PolarHBondContact O-N 3.35Å; L186-A188 VanDerWaalsContact C-N 3.25Å; L186-L573 HydrophobicContact CD1-CD1 3.99Å; L186-L573 HydrophobicContact CD2-CD1 3.84Å; L186-L573 HydrophobicContact CD2-CD2 3.61Å; L186-L573 HydrophobicContact CD2-CG 4.39Å; L186-L573 HydrophobicContact CG-CD1 3.71Å; L186-L573 HydrophobicContact CG-CD2 4.37Å
187	E	90.6	Very high	91.6	Very high	42 Å²	42	46.3 Å²	46.3	20%	0.196	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	4.9	175.7	-65.4	-177.8	133.6	0	0	112.7	I157 V183 I185 F189 Q190 N191 S194	I157-E187 HydrophobicContact CD1-CG 4Å; I157-E187 HydrophobicContact CG2-CG 3.97Å; V183-E187 HydrophobicContact CG1-CG 4.29Å; V183-E187 WeakPolarHBondContact CG1-OE2 3.32Å; V183-E187 WeakPolarHBondContact O-CB 3.41Å; V183-E187 WeakPolarHBondContact O-CG 3.38Å; V183-E187 PolarHBondContact O-N 3.36Å; I185-E187 VanDerWaalsContact C-N 3.33Å; I185-E187 PolarHBondContact O-N 3.45Å; E187-F189 PolarHBondContact O-N 2.9Å; E187-F189 VanDerWaalsContact O-N 3.15Å; E187-Q190 WeakPolarHBondContact O-CB 3.46Å; E187-Q190 WeakPolarHBondContact O-CG 3.36Å; E187-Q190 PolarHBondContact O-N 3.28Å; E187-Q190 VanDerWaalsContact O-N 3.09Å; E187-N191 HydrophobicContact CB-CB 4.43Å; E187-N191 PolarHBondContact OE1-ND2 2.91Å; E187-N191 WeakPolarHBondContact OE2-CB 3.42Å; E187-N191 PolarHBondContact OE2-ND2 3.31Å; E187-S194 WeakPolarHBondContact OE2-CB 3.24Å; E187-S194 PolarHBondContact OE2-OG 3.27Å
188	A	88.6	Confident	91.4	Very high	35 Å²	35	46.6 Å²	46.6	29%	0.289	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	38.5	-176.1	0	0	0	0	0	113	F37 C184 I185 L186 Q190	F37-A188 HydrophobicContact CZ-CB 4.27Å; C184-A188 PolarHBondContact O-N 3.34Å; C184-A188 VanDerWaalsContact O-N 3.11Å; I185-A188 PolarHBondContact O-N 3.1Å; I185-A188 VanDerWaalsContact O-N 3.12Å; L186-A188 VanDerWaalsContact C-N 3.25Å; A188-Q190 PolarHBondContact O-N 2.95Å; A188-Q190 VanDerWaalsContact O-N 3.16Å
189	F	87.2	Confident	91	Very high	85 Å²	85	48.8 Å²	48.8	37%	0.373	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	22.1	178.8	-54.4	-95.6	0	0	0	114.4	C184 I185 E187 M195	C184-F189 HydrophobicContact CB-CD1 3.82Å; C184-F189 HydrophobicContact CB-CE1 3.74Å; C184-F189 HydrophobicContact CB-CZ 4.42Å; C184-F189 PolarHBondContact O-N 3.29Å; I185-F189 HydrophobicContact CG1-CE2 4.3Å; I185-F189 HydrophobicContact CG1-CZ 3.96Å; E187-F189 PolarHBondContact O-N 2.9Å; E187-F189 VanDerWaalsContact O-N 3.15Å; F189-M195 HydrophobicContact CB-SD 4.1Å; F189-M195 HydrophobicContact CD1-CE 4.09Å; F189-M195 HydrophobicContact CD1-SD 3.59Å; F189-M195 VanDerWaalsContact CD1-SD 3.59Å; F189-M195 HydrophobicContact CG-SD 4.33Å
190	Q	86.1	Confident	90.8	Very high	150 Å²	150	53.2 Å²	53.2	70%	0.701	27%	0.265	S	S	*	.			trans	-85.2	-25.7	-177	-62.9	175.4	16.4	0	0	113.6	E187 A188	E187-Q190 WeakPolarHBondContact O-CB 3.46Å; E187-Q190 WeakPolarHBondContact O-CG 3.36Å; E187-Q190 PolarHBondContact O-N 3.28Å; E187-Q190 VanDerWaalsContact O-N 3.09Å; A188-Q190 PolarHBondContact O-N 2.95Å; A188-Q190 VanDerWaalsContact O-N 3.16Å
191	N	89.6	Confident	90.7	Very high	48 Å²	48	53.2 Å²	53.2	26%	0.257	27%	0.266	S	S	.	.			trans	-90.1	116.2	-175.5	-175.6	-10.1	0	0	0	110.9	E187 Q193 S194 M195	E187-N191 HydrophobicContact CB-CB 4.43Å; E187-N191 PolarHBondContact OE1-ND2 2.91Å; E187-N191 WeakPolarHBondContact OE2-CB 3.42Å; E187-N191 PolarHBondContact OE2-ND2 3.31Å; N191-Q193 VanDerWaalsContact C-N 3.26Å; N191-Q193 PolarHBondContact O-N 2.9Å; N191-Q193 WeakPolarHBondContact OD1-CB 3.27Å; N191-Q193 PolarHBondContact OD1-N 3.47Å; N191-S194 PolarHBondContact O-N 3.35Å; N191-S194 PolarHBondContact O-OG 2.8Å; N191-M195 WeakPolarHBondContact O-CG 3.45Å; N191-M195 PolarHBondContact O-N 3.36Å
192	Q	91	Very high	90.6	Very high	157 Å²	157	54 Å²	54	73%	0.734	27%	0.269	S	S	*	.	H	α-helix	trans	-64.9	-28.4	-178.9	-68	-179.5	-18.4	0	0	113.2	M195 L196	Q192-M195 PolarHBondContact O-N 2.98Å; Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 VanDerWaalsContact O-CG 3.25Å; Q192-L196 WeakPolarHBondContact O-CG 3.39Å; Q192-L196 PolarHBondContact O-N 3.21Å
193	Q	93.2	Very high	90.3	Very high	130 Å²	130	57.7 Å²	57.7	61%	0.607	29%	0.285	S	S	*	.	H	α-helix	trans	-68.3	-41.5	-177.9	-65.8	-173.4	-14.6	0	0	112.3	F161 N191 L197	F161-Q193 HydrophobicContact CZ-CB 4.12Å; N191-Q193 VanDerWaalsContact C-N 3.26Å; N191-Q193 PolarHBondContact O-N 2.9Å; N191-Q193 WeakPolarHBondContact OD1-CB 3.27Å; N191-Q193 PolarHBondContact OD1-N 3.47Å; Q193-L197 PolarHBondContact O-N 2.9Å
194	S	90.3	Very high	90.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69	-40.2	175.6	46.8	0	0	0	0	111.1	V180 E187 N191 L196 L197 A198	V180-S194 WeakPolarHBondContact CG2-O 3.35Å; E187-S194 WeakPolarHBondContact OE2-CB 3.24Å; E187-S194 PolarHBondContact OE2-OG 3.27Å; N191-S194 PolarHBondContact O-N 3.35Å; N191-S194 PolarHBondContact O-OG 2.8Å; S194-L196 PolarHBondContact O-N 2.72Å; S194-L197 PolarHBondContact O-N 2.91Å; S194-A198 WeakPolarHBondContact O-CB 3.39Å; S194-A198 PolarHBondContact O-N 2.75Å
195	M	89.9	Confident	90.3	Very high	79 Å²	79	61.7 Å²	61.7	39%	0.389	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-44.5	174.8	-66.8	-61.7	-71.7	0	0	113.3	C184 F189 N191 Q192 A198 D199	C184-M195 HydrophobicContact CB-SD 4.35Å; F189-M195 HydrophobicContact CB-SD 4.1Å; F189-M195 HydrophobicContact CD1-CE 4.09Å; F189-M195 HydrophobicContact CD1-SD 3.59Å; F189-M195 VanDerWaalsContact CD1-SD 3.59Å; F189-M195 HydrophobicContact CG-SD 4.33Å; N191-M195 WeakPolarHBondContact O-CG 3.45Å; N191-M195 PolarHBondContact O-N 3.36Å; Q192-M195 PolarHBondContact O-N 2.98Å; M195-A198 PolarHBondContact O-N 2.9Å; M195-D199 WeakPolarHBondContact O-CB 3.32Å; M195-D199 PolarHBondContact O-N 3.17Å
196	L	92.3	Very high	90.5	Very high	117 Å²	117	60.6 Å²	60.6	61%	0.613	30%	0.298	S	S	*	.	H	α-helix	trans	-65.8	-38.2	178	-74.1	171	0	0	0	112.3	Q192 S194 K200	Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 VanDerWaalsContact O-CG 3.25Å; Q192-L196 WeakPolarHBondContact O-CG 3.39Å; Q192-L196 PolarHBondContact O-N 3.21Å; S194-L196 PolarHBondContact O-N 2.72Å; L196-K200 VanDerWaalsContact O-CB 3.3Å; L196-K200 WeakPolarHBondContact O-CB 3.36Å; L196-K200 PolarHBondContact O-N 3.38Å
197	L	91.5	Very high	90.6	Very high	13 Å²	13	64.4 Å²	64.4	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-44	175.4	178.7	60.6	0	0	0	111	F161 A164 K165 E168 V180 Q193 S194 K200 V201	F161-L197 HydrophobicContact CD2-CD2 4.43Å; F161-L197 HydrophobicContact CE2-CD2 3.87Å; A164-L197 HydrophobicContact CB-CD2 4.02Å; K165-L197 HydrophobicContact CG-CD2 4.35Å; E168-L197 HydrophobicContact CB-CD1 4.46Å; E168-L197 HydrophobicContact CG-CD1 4.14Å; E168-L197 WeakPolarHBondContact OE2-CD1 3.44Å; V180-L197 HydrophobicContact CB-CD2 4.38Å; V180-L197 HydrophobicContact CG2-CB 4.03Å; V180-L197 HydrophobicContact CG2-CD2 4.02Å; V180-L197 HydrophobicContact CG2-CG 4.05Å; Q193-L197 PolarHBondContact O-N 2.9Å; S194-L197 PolarHBondContact O-N 2.91Å; L197-K200 PolarHBondContact O-N 3.25Å; L197-V201 HydrophobicContact CD1-CG2 4.01Å; L197-V201 VanDerWaalsContact O-CG2 3.27Å; L197-V201 WeakPolarHBondContact O-CG2 3.3Å; L197-V201 PolarHBondContact O-N 2.89Å
198	A	90.3	Very high	90.8	Very high	13 Å²	13	66.5 Å²	66.5	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-50.1	175.8	0	0	0	0	0	111.8	V180 S194 M195 K200 V201 L202	V180-A198 HydrophobicContact CG1-CB 3.8Å; V180-A198 HydrophobicContact CG2-CB 4.09Å; S194-A198 WeakPolarHBondContact O-CB 3.39Å; S194-A198 PolarHBondContact O-N 2.75Å; M195-A198 PolarHBondContact O-N 2.9Å; A198-K200 VanDerWaalsContact C-N 3.34Å; A198-K200 PolarHBondContact O-N 3.39Å; A198-V201 PolarHBondContact O-N 3.48Å; A198-L202 WeakPolarHBondContact O-CB 3.46Å; A198-L202 VanDerWaalsContact O-CG 3.29Å; A198-L202 WeakPolarHBondContact O-CG 3.26Å; A198-L202 PolarHBondContact O-N 3.28Å
199	D	87.5	Confident	91.1	Very high	64 Å²	64	68 Å²	68	34%	0.342	32%	0.323	S	S	.	.	H	α-helix	trans	-58.1	-44.4	177.5	173.7	75.9	0	0	0	112.1	M195 K203	M195-D199 WeakPolarHBondContact O-CB 3.32Å; M195-D199 PolarHBondContact O-N 3.17Å; D199-K203 WeakPolarHBondContact O-CB 3.4Å; D199-K203 WeakPolarHBondContact O-CG 3.25Å; D199-K203 PolarHBondContact O-N 2.75Å; D199-K203 WeakPolarHBondContact OD1-CE 3.49Å; D199-K203 IonicContact OD1-NZ 2.73Å; D199-K203 PolarHBondContact OD1-NZ 3.02Å; D199-K203 WeakPolarHBondContact OD2-CE 3.39Å; D199-K203 IonicContact OD2-NZ 2.68Å; D199-K203 PolarHBondContact OD2-NZ 3.5Å
200	K	92.1	Very high	91.4	Very high	96 Å²	96	64 Å²	64	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-49	177.6	-178.4	-175.3	176.2	-171	0	111.8	E168 L196 L197 A198 K203 Q204	E168-K200 WeakPolarHBondContact OE1-CE 3.2Å; E168-K200 IonicContact OE1-NZ 3.2Å; E168-K200 PolarHBondContact OE1-NZ 2.89Å; L196-K200 VanDerWaalsContact O-CB 3.3Å; L196-K200 WeakPolarHBondContact O-CB 3.36Å; L196-K200 PolarHBondContact O-N 3.38Å; L197-K200 PolarHBondContact O-N 3.25Å; A198-K200 VanDerWaalsContact C-N 3.34Å; A198-K200 PolarHBondContact O-N 3.39Å; K200-K203 PolarHBondContact O-N 2.84Å; K200-Q204 WeakPolarHBondContact O-CG 3.48Å; K200-Q204 PolarHBondContact O-N 3.37Å; K200-Q204 VanDerWaalsContact O-N 3.08Å
201	V	91.9	Very high	91.7	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-67.8	-42	-177.1	174.8	0	0	0	0	110.9	K173 L177 L197 A198 Q204 L205	K173-V201 HydrophobicContact CB-CG1 4.15Å; K173-V201 VanDerWaalsContact O-CG1 3.32Å; K173-V201 WeakPolarHBondContact O-CG1 3.17Å; L177-V201 HydrophobicContact CB-CG1 3.92Å; L177-V201 HydrophobicContact CD1-CG1 4.49Å; L197-V201 HydrophobicContact CD1-CG2 4.01Å; L197-V201 VanDerWaalsContact O-CG2 3.27Å; L197-V201 WeakPolarHBondContact O-CG2 3.3Å; L197-V201 PolarHBondContact O-N 2.89Å; A198-V201 PolarHBondContact O-N 3.48Å; V201-Q204 PolarHBondContact O-N 2.91Å; V201-L205 HydrophobicContact CG1-CD1 3.94Å; V201-L205 HydrophobicContact CG1-CG 4.47Å; V201-L205 PolarHBondContact O-N 3.11Å
202	L	91.1	Very high	91.9	Very high	31 Å²	31	66.4 Å²	66.4	16%	0.162	31%	0.313	C	S	.	.	H	α-helix	trans	-58.2	-48.2	174.1	-76.5	171.1	0	0	0	111.7	L177 A198 Q204 L205 G206 S556 D559 A560	L177-L202 HydrophobicContact CD1-CD1 4.39Å; L177-L202 HydrophobicContact CD1-CD2 3.66Å; L177-L202 HydrophobicContact CD1-CG 3.66Å; L177-L202 HydrophobicContact CD2-CD2 3.59Å; L177-L202 HydrophobicContact CD2-CG 4.46Å; L177-L202 HydrophobicContact CG-CD2 4.28Å; A198-L202 WeakPolarHBondContact O-CB 3.46Å; A198-L202 VanDerWaalsContact O-CG 3.29Å; A198-L202 WeakPolarHBondContact O-CG 3.26Å; A198-L202 PolarHBondContact O-N 3.28Å; L202-Q204 VanDerWaalsContact C-N 3.29Å; L202-Q204 PolarHBondContact O-N 3.21Å; L202-L205 PolarHBondContact O-N 3.19Å; L202-G206 PolarHBondContact O-N 2.86Å; L202-S556 WeakPolarHBondContact CD2-O 3.31Å; L202-S556 PolarHBondContact O-OG 3.32Å; L202-D559 HydrophobicContact CD2-CB 3.91Å; L202-A560 HydrophobicContact CD1-CB 4.28Å; L202-A560 HydrophobicContact CD2-CB 4.16Å
203	K	88.8	Confident	92	Very high	78 Å²	78	63.1 Å²	63.1	34%	0.339	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-37.2	177.2	-77.6	171.6	178.2	160	0	112.8	D199 K200 K207	D199-K203 WeakPolarHBondContact O-CB 3.4Å; D199-K203 WeakPolarHBondContact O-CG 3.25Å; D199-K203 PolarHBondContact O-N 2.75Å; D199-K203 WeakPolarHBondContact OD1-CE 3.49Å; D199-K203 IonicContact OD1-NZ 2.73Å; D199-K203 PolarHBondContact OD1-NZ 3.02Å; D199-K203 WeakPolarHBondContact OD2-CE 3.39Å; D199-K203 IonicContact OD2-NZ 2.68Å; D199-K203 PolarHBondContact OD2-NZ 3.5Å; K200-K203 PolarHBondContact O-N 2.84Å; K203-K207 WeakPolarHBondContact O-CB 3.49Å; K203-K207 WeakPolarHBondContact O-CG 3.42Å; K203-K207 PolarHBondContact O-N 2.9Å; K203-K207 VanDerWaalsContact O-N 3.14Å
204	Q	93.4	Very high	91.9	Very high	68 Å²	68	59.1 Å²	59.1	32%	0.318	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-51.4	177.3	-73.6	176.9	-11.7	0	0	111.3	K173 K200 V201 L202 G206 K207 E208	K173-Q204 HydrophobicContact CD-CB 4.11Å; K200-Q204 WeakPolarHBondContact O-CG 3.48Å; K200-Q204 PolarHBondContact O-N 3.37Å; K200-Q204 VanDerWaalsContact O-N 3.08Å; V201-Q204 PolarHBondContact O-N 2.91Å; L202-Q204 VanDerWaalsContact C-N 3.29Å; L202-Q204 PolarHBondContact O-N 3.21Å; Q204-G206 PolarHBondContact O-N 3.01Å; Q204-K207 PolarHBondContact O-N 2.66Å; Q204-E208 WeakPolarHBondContact O-CG 3.44Å; Q204-E208 PolarHBondContact O-N 3.06Å
205	L	92.3	Very high	91.8	Very high	19 Å²	19	66.2 Å²	66.2	10%	0.099	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-44.8	177.8	-77.4	170.7	0	0	0	112.1	K173 L177 V201 L202 K207 E208 K209	K173-L205 HydrophobicContact CB-CD1 4.18Å; K173-L205 HydrophobicContact CB-CD2 3.71Å; K173-L205 HydrophobicContact CB-CG 3.88Å; K173-L205 HydrophobicContact CD-CD2 4.25Å; K173-L205 HydrophobicContact CD-CG 4.35Å; L177-L205 HydrophobicContact CB-CD1 4.32Å; L177-L205 HydrophobicContact CD2-CD1 3.86Å; V201-L205 HydrophobicContact CG1-CD1 3.94Å; V201-L205 HydrophobicContact CG1-CG 4.47Å; V201-L205 PolarHBondContact O-N 3.11Å; L202-L205 PolarHBondContact O-N 3.19Å; L205-K207 PolarHBondContact O-N 2.66Å; L205-E208 PolarHBondContact O-N 3.15Å; L205-K209 WeakPolarHBondContact O-CG 3.44Å; L205-K209 PolarHBondContact O-N 3.39Å
206	G	92.4	Very high	91.8	Very high	0 Å²	0	69 Å²	69	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.1	-46.3	177.1	0	0	0	0	0	111.9	L202 Q204 A210	L202-G206 PolarHBondContact O-N 2.86Å; Q204-G206 PolarHBondContact O-N 3.01Å; G206-A210 WeakPolarHBondContact O-CB 3.37Å; G206-A210 PolarHBondContact O-N 2.85Å
207	K	93	Very high	91.6	Very high	126 Å²	126	66 Å²	66	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-43.1	177.4	-76.4	178.9	-179.4	-170.6	0	112.7	K203 Q204 L205 A210 K211 S552	K203-K207 WeakPolarHBondContact O-CB 3.49Å; K203-K207 WeakPolarHBondContact O-CG 3.42Å; K203-K207 PolarHBondContact O-N 2.9Å; K203-K207 VanDerWaalsContact O-N 3.14Å; Q204-K207 PolarHBondContact O-N 2.66Å; L205-K207 PolarHBondContact O-N 2.66Å; K207-A210 PolarHBondContact O-N 3.43Å; K207-K211 VanDerWaalsContact O-CB 3.27Å; K207-K211 WeakPolarHBondContact O-CB 3.36Å; K207-K211 PolarHBondContact O-N 3.31Å; K207-S552 WeakPolarHBondContact CG-OG 3.44Å; K207-S552 PolarHBondContact N-OG 3.13Å
208	E	94.6	Very high	91.2	Very high	86 Å²	86	73.5 Å²	73.5	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-60.4	-50.4	179	-73.7	171.1	-177.7	0	0	110.8	K173 Q204 L205 K211 E212	K173-E208 WeakPolarHBondContact CE-OE1 3.35Å; K173-E208 IonicContact NZ-OE1 3.44Å; K173-E208 PolarHBondContact NZ-OE1 2.73Å; K173-E208 IonicContact NZ-OE2 3.65Å; K173-E208 PolarHBondContact NZ-OE2 3.04Å; Q204-E208 WeakPolarHBondContact O-CG 3.44Å; Q204-E208 PolarHBondContact O-N 3.06Å; L205-E208 PolarHBondContact O-N 3.15Å; E208-K211 PolarHBondContact O-N 2.7Å; E208-E212 PolarHBondContact O-N 3.02Å
209	K	95.3	Very high	90.9	Very high	67 Å²	67	76.6 Å²	76.6	29%	0.291	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-42.7	178	-70.1	177.6	178.6	172.2	0	112.8	L205 K211 E212 K213 Y555 D559	L205-K209 WeakPolarHBondContact O-CG 3.44Å; L205-K209 PolarHBondContact O-N 3.39Å; K209-K211 PolarHBondContact O-N 2.87Å; K209-E212 PolarHBondContact O-N 3.29Å; K209-K213 WeakPolarHBondContact O-CB 3Å; K209-K213 PolarHBondContact O-N 2.84Å; K209-Y555 HydrophobicContact CB-CD1 3.95Å; K209-Y555 HydrophobicContact CB-CD2 3.71Å; K209-Y555 HydrophobicContact CB-CE1 4.13Å; K209-Y555 HydrophobicContact CB-CE2 3.89Å; K209-Y555 HydrophobicContact CB-CG 3.76Å; K209-Y555 HydrophobicContact CD-CD1 3.87Å; K209-Y555 HydrophobicContact CD-CE1 4.28Å; K209-Y555 HydrophobicContact CD-CG 4.28Å; K209-D559 IonicContact NZ-OD1 3.52Å; K209-D559 PolarHBondContact NZ-OD1 3.19Å; K209-D559 IonicContact NZ-OD2 2.65Å; K209-D559 PolarHBondContact NZ-OD2 2.83Å
210	A	93.4	Very high	90.9	Very high	0 Å²	0	78 Å²	78	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-47.2	177.4	0	0	0	0	0	111	G206 K207 E212 K213 Y214 E548 M551 Y555	G206-A210 WeakPolarHBondContact O-CB 3.37Å; G206-A210 PolarHBondContact O-N 2.85Å; K207-A210 PolarHBondContact O-N 3.43Å; A210-E212 VanDerWaalsContact C-N 3.31Å; A210-E212 PolarHBondContact O-N 3.36Å; A210-K213 PolarHBondContact O-N 3.31Å; A210-Y214 WeakPolarHBondContact O-CA 3.16Å; A210-Y214 WeakPolarHBondContact O-CB 3.45Å; A210-Y214 PolarHBondContact O-N 3.35Å; A210-E548 HydrophobicContact CB-CG 4.1Å; A210-M551 HydrophobicContact CB-CB 4Å; A210-M551 HydrophobicContact CB-CG 3.97Å; A210-M551 HydrophobicContact CB-SD 4.45Å; A210-Y555 HydrophobicContact CB-CD2 4.15Å
211	K	92.7	Very high	90.9	Very high	112 Å²	112	75.3 Å²	75.3	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-39.9	178.8	-173.6	176.4	-176.7	177.5	0	112.6	K207 E208 K209 K215	K207-K211 VanDerWaalsContact O-CB 3.27Å; K207-K211 WeakPolarHBondContact O-CB 3.36Å; K207-K211 PolarHBondContact O-N 3.31Å; E208-K211 PolarHBondContact O-N 2.7Å; K209-K211 PolarHBondContact O-N 2.87Å; K211-K215 WeakPolarHBondContact O-CD 3.37Å; K211-K215 WeakPolarHBondContact O-CG 3.46Å; K211-K215 PolarHBondContact O-N 3.31Å
212	E	93.3	Very high	90.8	Very high	137 Å²	137	75.8 Å²	75.8	64%	0.64	36%	0.355	S	S	*	.	H	α-helix	trans	-71	-45.3	178	-71.3	-175.3	174.6	0	0	112.6	E208 K209 A210 N216	E208-E212 PolarHBondContact O-N 3.02Å; K209-E212 PolarHBondContact O-N 3.29Å; A210-E212 VanDerWaalsContact C-N 3.31Å; A210-E212 PolarHBondContact O-N 3.36Å; E212-N216 PolarHBondContact O-ND2 2.94Å
213	K	93.6	Very high	90.7	Very high	89 Å²	89	74.8 Å²	74.8	39%	0.387	35%	0.351	S	S	.	.	H	α-helix	trans	-70.3	-42.1	-179.2	-178	69.9	173.2	178.2	0	111.8	K209 A210 K215 N216 R217 M551 Y555	K209-K213 WeakPolarHBondContact O-CB 3Å; K209-K213 PolarHBondContact O-N 2.84Å; A210-K213 PolarHBondContact O-N 3.31Å; K213-K215 VanDerWaalsContact C-N 3.32Å; K213-K215 PolarHBondContact O-N 3.36Å; K213-N216 CarbonylContact O-C 3.55Å; K213-N216 PolarHBondContact O-N 3.23Å; K213-N216 VanDerWaalsContact O-N 3.1Å; K213-R217 PolarHBondContact O-N 3.48Å; K213-R217 VanDerWaalsContact O-N 3.15Å; K213-M551 HydrophobicContact CB-SD 3.63Å; K213-M551 HydrophobicContact CG-CE 4.08Å; K213-M551 HydrophobicContact CG-SD 3.61Å; K213-Y555 HydrophobicContact CB-CE2 3.99Å; K213-Y555 WeakPolarHBondContact CB-OH 3.46Å; K213-Y555 HydrophobicContact CG-CE2 4.34Å; K213-Y555 VanDerWaalsContact CG-OH 3.31Å; K213-Y555 WeakPolarHBondContact CG-OH 3.29Å
214	Y	89.9	Confident	90.8	Very high	45 Å²	45	73.8 Å²	73.8	18%	0.176	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-33.8	-176.4	-166.9	-101.3	0	0	0	112.7	A210 N216 R217 G313 K546 E548 M551	A210-Y214 WeakPolarHBondContact O-CA 3.16Å; A210-Y214 WeakPolarHBondContact O-CB 3.45Å; A210-Y214 PolarHBondContact O-N 3.35Å; Y214-N216 PolarHBondContact O-N 3.06Å; Y214-R217 VanDerWaalsContact CE2-NH1 3.29Å; Y214-R217 VanDerWaalsContact CZ-CZ 3.47Å; Y214-R217 PolarHBondContact O-N 3.25Å; Y214-R217 PolarHBondContact OH-NH1 3.13Å; Y214-R217 VanDerWaalsContact OH-NH1 3.09Å; Y214-G313 PolarHBondContact OH-O 3.4Å; Y214-K546 PolarHBondContact OH-O 2.96Å; Y214-K546 VanDerWaalsContact OH-O 3.13Å; Y214-E548 HydrophobicContact CD1-CB 4.16Å; Y214-E548 HydrophobicContact CD2-CB 4.43Å; Y214-E548 HydrophobicContact CE1-CB 4.42Å; Y214-E548 HydrophobicContact CG-CB 4.15Å; Y214-M551 HydrophobicContact CD2-CE 4.06Å; Y214-M551 HydrophobicContact CD2-SD 4.41Å
215	K	89.3	Confident	90.4	Very high	150 Å²	150	73.3 Å²	73.3	65%	0.652	35%	0.351	S	S	*	.	H	α-helix	trans	-58.8	-33.2	172.9	-79.4	172.4	-178.9	-176.5	0	113.3	K211 K213	K211-K215 WeakPolarHBondContact O-CD 3.37Å; K211-K215 WeakPolarHBondContact O-CG 3.46Å; K211-K215 PolarHBondContact O-N 3.31Å; K213-K215 VanDerWaalsContact C-N 3.32Å; K213-K215 PolarHBondContact O-N 3.36Å
216	N	88.2	Confident	90.2	Very high	137 Å²	137	76.4 Å²	76.4	73%	0.733	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	16.7	-177	-58.6	-56.2	0	0	0	111.9	E212 K213 Y214	E212-N216 PolarHBondContact O-ND2 2.94Å; K213-N216 CarbonylContact O-C 3.55Å; K213-N216 PolarHBondContact O-N 3.23Å; K213-N216 VanDerWaalsContact O-N 3.1Å; Y214-N216 PolarHBondContact O-N 3.06Å
217	R	88.4	Confident	90	Very high	54 Å²	54	76.5 Å²	76.5	20%	0.204	36%	0.364	C	S	.	.			trans	-72.3	143.2	-179.4	90.5	176.6	-166.1	-80.5	-1.5	110	K213 Y214 I312 G313	K213-R217 PolarHBondContact O-N 3.48Å; K213-R217 VanDerWaalsContact O-N 3.15Å; Y214-R217 VanDerWaalsContact CE2-NH1 3.29Å; Y214-R217 VanDerWaalsContact CZ-CZ 3.47Å; Y214-R217 PolarHBondContact O-N 3.25Å; Y214-R217 PolarHBondContact OH-NH1 3.13Å; Y214-R217 VanDerWaalsContact OH-NH1 3.09Å; R217-I312 PolarHBondContact NH2-O 3.02Å; R217-G313 PolarHBondContact NH2-O 3.09Å
218	E	84.4	Confident	89.7	Confident	171 Å²	171	74.7 Å²	74.7	80%	0.799	36%	0.356	S	S	*	.			trans	-83.1	127.6	167.8	-65.6	-177.1	175.3	0	0	108.6	M220	E218-M220 PolarHBondContact O-N 3.5Å; E218-M220 VanDerWaalsContact O-N 3.09Å
219	P	82.8	Confident	89.3	Confident	77 Å²	77	73.9 Å²	73.9	50%	0.5	36%	0.36	S	S	.	.			trans	-60.8	115.1	173.9	-19.6	30.9	0	0	0	109.7	I312	P219-I312 HydrophobicContact CB-CB 4.16Å; P219-I312 HydrophobicContact CB-CD1 3.78Å; P219-I312 HydrophobicContact CB-CG1 4.12Å
220	M	87.9	Confident	89	Confident	94 Å²	94	73.2 Å²	73.2	46%	0.463	36%	0.356	S	S	.	.			trans	-105.2	129.8	179.9	-168.3	179.3	-62.4	0	0	109.7	E218 L544	E218-M220 PolarHBondContact O-N 3.5Å; E218-M220 VanDerWaalsContact O-N 3.09Å; M220-L544 HydrophobicContact SD-CD2 3.7Å
221	M	91.3	Very high	88.7	Confident	39 Å²	39	74.2 Å²	74.2	19%	0.192	36%	0.36	C	S	.	.			trans	-65.1	131.9	171.7	-164.8	60.8	65.4	0	0	109.6	I227 F308 I312 K513	M221-I227 HydrophobicContact CG-CD1 3.92Å; M221-I227 HydrophobicContact SD-CD1 3.9Å; M221-F308 HydrophobicContact CE-CD1 4.01Å; M221-F308 HydrophobicContact CE-CE1 4.47Å; M221-F308 HydrophobicContact SD-CD1 3.93Å; M221-F308 HydrophobicContact SD-CE1 4.08Å; M221-I312 HydrophobicContact CE-CG2 4.01Å; M221-I312 HydrophobicContact SD-CG2 3.98Å; M221-K513 PolarHBondContact O-NZ 3.08Å
222	P	90.2	Very high	88.3	Confident	11 Å²	11	72.6 Å²	72.6	7%	0.071	36%	0.363	C	S	.	.			trans	-58.8	177.3	172.5	-25	35.2	0	0	0	113.2	F226 I227 L311 K513	P222-F226 HydrophobicContact CB-CB 4.27Å; P222-F226 HydrophobicContact CB-CD1 3.58Å; P222-F226 HydrophobicContact CB-CE1 4.31Å; P222-F226 HydrophobicContact CB-CG 4.19Å; P222-F226 HydrophobicContact CG-CD1 4.09Å; P222-F226 HydrophobicContact CG-CE1 4.38Å; P222-I227 HydrophobicContact CB-CG1 4.23Å; P222-L311 HydrophobicContact CG-CB 4.24Å; P222-L311 WeakPolarHBondContact CG-O 3.4Å; P222-K513 PolarHBondContact O-NZ 3.28Å
223	S	89.1	Confident	87.9	Confident	10 Å²	10	67 Å²	67	7%	0.07	34%	0.339	C	S	.	.			trans	-67.9	148.2	172.9	68.6	0	0	0	0	111.4	Q225 F226 I227 D511	S223-Q225 PolarHBondContact O-N 3.2Å; S223-F226 WeakPolarHBondContact O-CB 3.45Å; S223-F226 PolarHBondContact O-N 2.68Å; S223-F226 VanDerWaalsContact O-N 3.1Å; S223-F226 WeakPolarHBondContact OG-CB 3.34Å; S223-F226 PolarHBondContact OG-N 3.14Å; S223-I227 WeakPolarHBondContact O-CG1 3.5Å; S223-I227 PolarHBondContact O-N 3.47Å; S223-I227 VanDerWaalsContact O-N 3.08Å; S223-D511 WeakPolarHBondContact CB-OD1 3.37Å; S223-D511 WeakPolarHBondContact CB-OD2 3.47Å; S223-D511 PolarHBondContact OG-OD2 3.13Å
224	P	90.3	Very high	87.5	Confident	58 Å²	58	63.2 Å²	63.2	38%	0.377	32%	0.323	S	S	.	.	H	α-helix	trans	-54.3	-39.5	175.4	-28.7	36.7	0	0	0	113	F226 I227 K228 Y280	P224-F226 PolarHBondContact O-N 2.96Å; P224-I227 PolarHBondContact O-N 2.74Å; P224-K228 WeakPolarHBondContact O-CG 3.39Å; P224-K228 PolarHBondContact O-N 3.28Å; P224-Y280 HydrophobicContact CB-CE2 4Å; P224-Y280 HydrophobicContact CG-CE2 4.42Å
225	Q	86.9	Confident	87.1	Confident	58 Å²	58	63.1 Å²	63.1	27%	0.271	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-41.8	177.4	-176.1	59.2	15	0	0	111.9	S223 I227 K228 S229	S223-Q225 PolarHBondContact O-N 3.2Å; Q225-I227 VanDerWaalsContact C-N 3.34Å; Q225-I227 PolarHBondContact O-N 3.12Å; Q225-K228 PolarHBondContact O-N 3.04Å; Q225-S229 WeakPolarHBondContact O-CB 3.38Å; Q225-S229 PolarHBondContact O-N 3.43Å
226	F	86.9	Confident	86.6	Confident	84 Å²	84	57.5 Å²	57.5	37%	0.368	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-43	174.1	-178.8	-91.1	0	0	0	111.7	P222 S223 P224 S229 Y230 L311 K546	P222-F226 HydrophobicContact CB-CB 4.27Å; P222-F226 HydrophobicContact CB-CD1 3.58Å; P222-F226 HydrophobicContact CB-CE1 4.31Å; P222-F226 HydrophobicContact CB-CG 4.19Å; P222-F226 HydrophobicContact CG-CD1 4.09Å; P222-F226 HydrophobicContact CG-CE1 4.38Å; S223-F226 WeakPolarHBondContact O-CB 3.45Å; S223-F226 PolarHBondContact O-N 2.68Å; S223-F226 VanDerWaalsContact O-N 3.1Å; S223-F226 WeakPolarHBondContact OG-CB 3.34Å; S223-F226 PolarHBondContact OG-N 3.14Å; P224-F226 PolarHBondContact O-N 2.96Å; F226-S229 PolarHBondContact O-N 3.49Å; F226-Y230 VanDerWaalsContact O-CB 3.31Å; F226-Y230 WeakPolarHBondContact O-CB 3.31Å; F226-Y230 PolarHBondContact O-N 2.98Å; F226-L311 HydrophobicContact CD1-CD2 4.34Å; F226-L311 HydrophobicContact CE1-CD2 3.77Å; F226-K546 VanDerWaalsContact CZ-NZ 3.34Å
227	I	89.2	Confident	86.2	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-45.3	179.7	-63.6	169.2	0	0	0	110.7	M221 P222 S223 P224 Q225 Y230 F231 Y280 F308 L311	M221-I227 HydrophobicContact CG-CD1 3.92Å; M221-I227 HydrophobicContact SD-CD1 3.9Å; P222-I227 HydrophobicContact CB-CG1 4.23Å; S223-I227 WeakPolarHBondContact O-CG1 3.5Å; S223-I227 PolarHBondContact O-N 3.47Å; S223-I227 VanDerWaalsContact O-N 3.08Å; P224-I227 PolarHBondContact O-N 2.74Å; Q225-I227 VanDerWaalsContact C-N 3.34Å; Q225-I227 PolarHBondContact O-N 3.12Å; I227-Y230 WeakPolarHBondContact O-CB 3.35Å; I227-Y230 PolarHBondContact O-N 3.27Å; I227-F231 HydrophobicContact CG2-CD2 3.74Å; I227-F231 HydrophobicContact CG2-CE2 3.79Å; I227-F231 VanDerWaalsContact O-CD2 3.32Å; I227-F231 WeakPolarHBondContact O-CD2 3.35Å; I227-F231 PolarHBondContact O-N 3.41Å; I227-Y280 HydrophobicContact CB-CE1 4.5Å; I227-Y280 HydrophobicContact CB-CE2 4.31Å; I227-Y280 HydrophobicContact CD1-CD1 4.23Å; I227-Y280 HydrophobicContact CD1-CD2 3.46Å; I227-Y280 VanDerWaalsContact CD1-CD2 3.46Å; I227-Y280 HydrophobicContact CD1-CE2 3.79Å; I227-Y280 HydrophobicContact CD1-CG 3.7Å; I227-Y280 HydrophobicContact CG2-CD1 4.08Å; I227-Y280 HydrophobicContact CG2-CE1 3.66Å; I227-Y280 HydrophobicContact CG2-CE2 4.32Å; I227-F308 HydrophobicContact CG2-CZ 4.31Å; I227-L311 HydrophobicContact CG1-CD1 4.47Å; I227-L311 HydrophobicContact CG2-CD1 4.5Å
228	K	86.8	Confident	85.8	Confident	88 Å²	88	50.6 Å²	50.6	38%	0.383	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.1	-73.9	171	176	169.4	0	111.9	P224 Q225 Y230 F231 S232 E278	P224-K228 WeakPolarHBondContact O-CG 3.39Å; P224-K228 PolarHBondContact O-N 3.28Å; Q225-K228 PolarHBondContact O-N 3.04Å; K228-Y230 VanDerWaalsContact C-N 3.34Å; K228-Y230 PolarHBondContact O-N 3.03Å; K228-F231 PolarHBondContact O-N 3.45Å; K228-S232 WeakPolarHBondContact O-CB 3.34Å; K228-S232 PolarHBondContact O-N 3.31Å; K228-E278 WeakPolarHBondContact CE-OE1 3.36Å; K228-E278 VanDerWaalsContact CE-OE2 3.29Å; K228-E278 WeakPolarHBondContact CE-OE2 3.45Å; K228-E278 IonicContact NZ-OE1 3.32Å; K228-E278 PolarHBondContact NZ-OE1 3.26Å; K228-E278 IonicContact NZ-OE2 3.7Å; K228-E278 PolarHBondContact NZ-OE2 3.29Å
229	S	84.9	Confident	85.7	Confident	69 Å²	69	42.5 Å²	42.5	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-60.3	-44.1	177.2	-178.2	0	0	0	0	111.3	Q225 F226 F231 S232 S233	Q225-S229 WeakPolarHBondContact O-CB 3.38Å; Q225-S229 PolarHBondContact O-N 3.43Å; F226-S229 PolarHBondContact O-N 3.49Å; S229-F231 PolarHBondContact O-N 3.42Å; S229-S232 WeakPolarHBondContact O-CB 3.49Å; S229-S232 PolarHBondContact O-N 3.15Å; S229-S232 PolarHBondContact O-OG 3.43Å; S229-S233 PolarHBondContact O-N 3.4Å
230	Y	88.6	Confident	85.4	Confident	53 Å²	53	40.3 Å²	40.3	21%	0.208	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-50.5	176	176.7	-90.2	0	0	0	112.3	F226 I227 K228 S232 S233 F234 T307 L311 K342	F226-Y230 VanDerWaalsContact O-CB 3.31Å; F226-Y230 WeakPolarHBondContact O-CB 3.31Å; F226-Y230 PolarHBondContact O-N 2.98Å; I227-Y230 WeakPolarHBondContact O-CB 3.35Å; I227-Y230 PolarHBondContact O-N 3.27Å; K228-Y230 VanDerWaalsContact C-N 3.34Å; K228-Y230 PolarHBondContact O-N 3.03Å; Y230-S232 VanDerWaalsContact C-N 3.26Å; Y230-S232 PolarHBondContact O-N 3.14Å; Y230-S233 PolarHBondContact O-N 2.97Å; Y230-S233 PolarHBondContact O-OG 3.28Å; Y230-F234 HydrophobicContact CD1-CE2 4.3Å; Y230-F234 HydrophobicContact CE1-CD2 4.28Å; Y230-F234 AromaticContact CE1-CE2 3.68Å; Y230-F234 HydrophobicContact CE1-CE2 3.68Å; Y230-F234 HydrophobicContact CE2-CE2 4.03Å; Y230-F234 AromaticContact CZ-CE2 3.54Å; Y230-F234 WeakPolarHBondContact O-CD2 3.12Å; Y230-T307 HydrophobicContact CD1-CG2 4.47Å; Y230-T307 HydrophobicContact CE1-CG2 3.55Å; Y230-L311 HydrophobicContact CD1-CD1 4.41Å; Y230-L311 HydrophobicContact CD1-CD2 4.02Å; Y230-L311 HydrophobicContact CD2-CD2 4.01Å; Y230-L311 HydrophobicContact CE1-CD2 4.35Å; Y230-L311 HydrophobicContact CE2-CD2 4.33Å; Y230-L311 HydrophobicContact CG-CD2 3.84Å; Y230-K342 PolarHBondContact OH-NZ 2.69Å
231	F	87.2	Confident	84.7	Confident	21 Å²	21	39.7 Å²	39.7	9%	0.092	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-25.7	179.3	-79.3	-74.4	0	0	0	112.6	I227 K228 S229 S233 F234 I239 S240 M275 L304 T307 F308 L311	I227-F231 HydrophobicContact CG2-CD2 3.74Å; I227-F231 HydrophobicContact CG2-CE2 3.79Å; I227-F231 VanDerWaalsContact O-CD2 3.32Å; I227-F231 WeakPolarHBondContact O-CD2 3.35Å; I227-F231 PolarHBondContact O-N 3.41Å; K228-F231 PolarHBondContact O-N 3.45Å; S229-F231 PolarHBondContact O-N 3.42Å; F231-S233 PolarHBondContact O-N 3.11Å; F231-F234 PolarHBondContact O-N 3.02Å; F231-I239 HydrophobicContact CE1-CG2 4.01Å; F231-S240 WeakPolarHBondContact CD1-OG 2.96Å; F231-M275 HydrophobicContact CD1-CE 4.01Å; F231-M275 HydrophobicContact CD2-CE 3.85Å; F231-M275 HydrophobicContact CE1-CE 3.73Å; F231-M275 HydrophobicContact CE2-CE 3.58Å; F231-M275 HydrophobicContact CG-CE 4.07Å; F231-M275 HydrophobicContact CZ-CE 3.51Å; F231-L304 HydrophobicContact CZ-CD1 4.33Å; F231-T307 HydrophobicContact CE1-CG2 4Å; F231-T307 HydrophobicContact CE2-CG2 4.49Å; F231-T307 HydrophobicContact CZ-CG2 3.63Å; F231-F308 AromaticContact CE2-CE2 3.83Å; F231-F308 HydrophobicContact CE2-CE2 3.83Å; F231-F308 AromaticContact CE2-CZ 3.86Å; F231-F308 HydrophobicContact CE2-CZ 3.86Å; F231-F308 HydrophobicContact CZ-CD2 4.47Å; F231-F308 AromaticContact CZ-CE2 3.68Å; F231-F308 HydrophobicContact CZ-CE2 3.68Å; F231-F308 HydrophobicContact CZ-CZ 4.21Å; F231-L311 HydrophobicContact CE2-CD1 4.15Å
232	S	84.3	Confident	83.2	Confident	78 Å²	78	43.2 Å²	43.2	55%	0.545	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-18.3	174.2	80	0	0	0	0	114	K228 S229 Y230 F234	K228-S232 WeakPolarHBondContact O-CB 3.34Å; K228-S232 PolarHBondContact O-N 3.31Å; S229-S232 WeakPolarHBondContact O-CB 3.49Å; S229-S232 PolarHBondContact O-N 3.15Å; S229-S232 PolarHBondContact O-OG 3.43Å; Y230-S232 VanDerWaalsContact C-N 3.26Å; Y230-S232 PolarHBondContact O-N 3.14Å; S232-F234 VanDerWaalsContact C-N 3.28Å
233	S	84.8	Confident	81.5	Confident	21 Å²	21	48.8 Å²	48.8	15%	0.147	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.6	175.6	81.1	0	0	0	0	113.4	S229 Y230 F231 H376	S229-S233 PolarHBondContact O-N 3.4Å; Y230-S233 PolarHBondContact O-N 2.97Å; Y230-S233 PolarHBondContact O-OG 3.28Å; F231-S233 PolarHBondContact O-N 3.11Å; S233-H376 PolarHBondContact O-CE1 3.35Å; S233-H376 PolarHBondContact OG-NE2 2.96Å; S233-H376 VanDerWaalsContact OG-NE2 3.11Å
234	F	86	Confident	79.1	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.039	30%	0.298	C	S	.	.			trans	-104.9	107	176.9	-65.5	-85.7	0	0	0	109.6	Y230 F231 S232 D237 S240 N338 I341 D372 H376	Y230-F234 HydrophobicContact CD1-CE2 4.3Å; Y230-F234 HydrophobicContact CE1-CD2 4.28Å; Y230-F234 AromaticContact CE1-CE2 3.68Å; Y230-F234 HydrophobicContact CE1-CE2 3.68Å; Y230-F234 HydrophobicContact CE2-CE2 4.03Å; Y230-F234 AromaticContact CZ-CE2 3.54Å; Y230-F234 WeakPolarHBondContact O-CD2 3.12Å; F231-F234 PolarHBondContact O-N 3.02Å; S232-F234 VanDerWaalsContact C-N 3.28Å; F234-D237 HydrophobicContact CB-CB 3.85Å; F234-S240 WeakPolarHBondContact O-CB 3.43Å; F234-N338 VanDerWaalsContact CD1-ND2 3.33Å; F234-N338 WeakPolarHBondContact CD1-ND2 3.26Å; F234-I341 HydrophobicContact CE1-CG2 4.07Å; F234-I341 HydrophobicContact CZ-CG2 4.49Å; F234-D372 WeakPolarHBondContact CA-OD2 3.33Å; F234-H376 AromaticContact CD1-CE1 3.67Å; F234-H376 AromaticContact CE1-CE1 3.49Å; F234-H376 VanDerWaalsContact CE1-CE1 3.49Å; F234-H376 WeakPolarHBondContact CE1-CE1 3.4Å; F234-H376 AromaticContact CE1-NE2 3.75Å; F234-H376 AromaticContact CE2-NE2 3.86Å; F234-H376 AromaticContact CZ-CE1 3.79Å; F234-H376 AromaticContact CZ-NE2 3.54Å
235	T	81.1	Confident	76.4	Confident	43 Å²	43	63.3 Å²	63.3	26%	0.264	32%	0.324	S	S	.	.	S	Bend	trans	-102.1	-30.3	-173.1	70	0	0	0	0	113.9	Q241 D372 R401	T235-Q241 PolarHBondContact O-NE2 2.99Å; T235-D372 WeakPolarHBondContact CB-OD1 3.4Å; T235-D372 PolarHBondContact N-OD1 3.03Å; T235-D372 PolarHBondContact N-OD2 3.22Å; T235-D372 PolarHBondContact OG1-OD1 3.4Å; T235-R401 PolarHBondContact OG1-NH1 3.26Å
236	D	79	Confident	73.8	Confident	32 Å²	32	63 Å²	63	17%	0.171	34%	0.337	C	S	.	.	S	Bend	trans	-110.5	47.7	178	-159.7	31.1	0	0	0	111.4	K334 P371 D372	D236-K334 IonicContact OD1-NZ 3.47Å; D236-K334 PolarHBondContact OD1-NZ 3.04Å; D236-K334 VanDerWaalsContact OD2-CE 3.29Å; D236-K334 WeakPolarHBondContact OD2-CE 3.47Å; D236-K334 IonicContact OD2-NZ 3.51Å; D236-K334 PolarHBondContact OD2-NZ 3.08Å; D236-P371 HydrophobicContact CB-CG 4.16Å; D236-D372 PolarHBondContact N-OD1 3.08Å; D236-D372 PolarHBondContact N-OD2 3.26Å
237	D	78.9	Confident	71	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	36%	0.359	C	S	.	.			trans	-120.5	131.4	-177.3	172.2	34.4	0	0	0	111.9	F234 I239 S240 Q241	F234-D237 HydrophobicContact CB-CB 3.85Å; D237-I239 PolarHBondContact O-N 3.41Å; D237-I239 PolarHBondContact OD1-N 3.48Å; D237-I239 WeakPolarHBondContact OD2-CB 3.32Å; D237-S240 PolarHBondContact O-N 2.86Å; D237-S240 WeakPolarHBondContact OD2-CB 3.33Å; D237-S240 PolarHBondContact OD2-N 3.48Å; D237-S240 VanDerWaalsContact OD2-N 3.1Å; D237-S240 PolarHBondContact OD2-OG 3.31Å; D237-Q241 WeakPolarHBondContact O-CB 3.31Å; D237-Q241 VanDerWaalsContact O-CG 3.26Å; D237-Q241 WeakPolarHBondContact O-CG 3.23Å; D237-Q241 PolarHBondContact O-N 3.43Å
238	I	80.9	Confident	68.3	Low	45 Å²	45	73 Å²	73	23%	0.231	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.6	-179.2	-63.4	149.5	0	0	0	111.1	E300 N332 K334 L335	I238-E300 HydrophobicContact CG2-CG 4.42Å; I238-N332 HydrophobicContact CD1-CB 3.86Å; I238-N332 VanDerWaalsContact CD1-CG 3.43Å; I238-N332 WeakPolarHBondContact CD1-ND2 3.4Å; I238-K334 HydrophobicContact CD1-CB 3.95Å; I238-L335 HydrophobicContact CB-CD2 4.1Å; I238-L335 HydrophobicContact CD1-CD1 4.42Å; I238-L335 HydrophobicContact CD1-CD2 3.93Å; I238-L335 HydrophobicContact CD1-CG 3.72Å
239	I	82.6	Confident	65.8	Low	0 Å²	0	76.6 Å²	76.6	0%	0	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-42.6	176.4	-62.3	172.8	0	0	0	110.3	F231 D237 K272 M275 L303 L304	F231-I239 HydrophobicContact CE1-CG2 4.01Å; D237-I239 PolarHBondContact O-N 3.41Å; D237-I239 PolarHBondContact OD1-N 3.48Å; D237-I239 WeakPolarHBondContact OD2-CB 3.32Å; I239-K272 PolarHBondContact O-NZ 3.05Å; I239-M275 HydrophobicContact CG2-SD 4.35Å; I239-L303 HydrophobicContact CD1-CB 3.77Å; I239-L303 HydrophobicContact CD1-CD2 3.56Å; I239-L303 HydrophobicContact CD1-CG 3.45Å; I239-L303 VanDerWaalsContact CD1-CG 3.45Å; I239-L303 HydrophobicContact CG1-CD2 4.47Å; I239-L304 HydrophobicContact CD1-CB 4.06Å; I239-L304 HydrophobicContact CG2-CB 4.46Å; I239-L304 HydrophobicContact CG2-CD1 3.73Å
240	S	76.7	Confident	63.5	Low	32 Å²	32	79.8 Å²	79.8	22%	0.224	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-27.9	-174.2	-56.5	0	0	0	0	113.2	F231 F234 D237	F231-S240 WeakPolarHBondContact CD1-OG 2.96Å; F234-S240 WeakPolarHBondContact O-CB 3.43Å; D237-S240 PolarHBondContact O-N 2.86Å; D237-S240 WeakPolarHBondContact OD2-CB 3.33Å; D237-S240 PolarHBondContact OD2-N 3.48Å; D237-S240 VanDerWaalsContact OD2-N 3.1Å; D237-S240 PolarHBondContact OD2-OG 3.31Å
241	Q	73.4	Confident	61.3	Low	81 Å²	81	85.5 Å²	85.5	38%	0.379	44%	0.439	S	S	.	.	S	Bend	trans	-70.5	138.1	178.6	-72.6	171.8	10.8	0	0	111.6	T235 D237 K272	T235-Q241 PolarHBondContact O-NE2 2.99Å; D237-Q241 WeakPolarHBondContact O-CB 3.31Å; D237-Q241 VanDerWaalsContact O-CG 3.26Å; D237-Q241 WeakPolarHBondContact O-CG 3.23Å; D237-Q241 PolarHBondContact O-N 3.43Å; Q241-K272 PolarHBondContact O-NZ 2.6Å
242	P	58.7	Low	59.2	Low	112 Å²	112	89 Å²	89	73%	0.727	46%	0.459	S	S	*	.			trans	-58.6	140.7	167.9	-19.6	30.7	0	0	0	109.2	Q244	P242-Q244 PolarHBondContact O-N 3.21Å
243	Q	55.8	Low	57.1	Low	129 Å²	129	91.5 Å²	91.5	60%	0.603	46%	0.459	S	S	*	.			trans	-54.3	115.3	174.4	-89.2	-179.3	-46.2	0	0	109.4	K245	Q243-K245 PolarHBondContact O-N 2.85Å
244	Q	38	Very low	55.2	Low	157 Å²	157	97.9 Å²	97.9	73%	0.734	49%	0.492	S	S	*	.			trans	-59.3	123.8	158.2	-72.1	-172.1	-6.4	0	0	106.3	P242 G246	P242-Q244 PolarHBondContact O-N 3.21Å; Q244-G246 PolarHBondContact O-N 3.49Å
245	K	32.6	Very low	53.3	Low	215 Å²	215	102.2 Å²	102.2	94%	0.935	51%	0.511	S	S	*	.	S	Bend	trans	-60.2	87.5	166.9	-87.6	-175.9	173.4	179.4	0	108	Q243	Q243-K245 PolarHBondContact O-N 2.85Å
246	G	32.7	Very low	51.5	Low	51 Å²	51	107.8 Å²	107.8	53%	0.526	53%	0.534	S	S	.	.			trans	52.9	112.1	171.1	0	0	0	0	0	115.6	Q244 K248	Q244-G246 PolarHBondContact O-N 3.49Å; G246-K248 PolarHBondContact O-N 2.89Å
247	E	29.5	Very low	49.9	Very low	180 Å²	180	109 Å²	109	84%	0.841	55%	0.554	S	S	*	*				-61.2	85.4	128.6	-75.8	-172.7	162.2	0	0	106.3	K249	E247-K249 PolarHBondContact O-N 3.39Å
248	K	32.6	Very low	48.3	Very low	117 Å²	117	113.5 Å²	113.5	51%	0.509	58%	0.575	S	S	.	*			trans	-58.7	111.4	162.9	-74	-172.5	176.2	-170	0	104.7	G246 D250	G246-K248 PolarHBondContact O-N 2.89Å; K248-D250 PolarHBondContact O-N 3.3Å
249	K	32.8	Very low	46.5	Very low	162 Å²	162	114.5 Å²	114.5	70%	0.704	59%	0.59	S	S	*	*			trans	-55.7	136.9	150.2	-76.3	-175.2	176.4	-178.7	0	105.6	E247 E251 D252	E247-K249 PolarHBondContact O-N 3.39Å; K249-E251 PolarHBondContact O-N 2.96Å; K249-D252 PolarHBondContact O-N 3.48Å
250	D	37.7	Very low	44.5	Very low	137 Å²	137	117.5 Å²	117.5	73%	0.733	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-5.5	-175.4	-82.7	-47.9	0	0	0	114.3	K248	K248-D250 PolarHBondContact O-N 3.3Å
251	E	41.9	Very low	42.9	Very low	173 Å²	173	122.7 Å²	122.7	81%	0.808	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-14.5	176.4	-63.3	-178.8	162.8	0	0	114.9	K249	K249-E251 PolarHBondContact O-N 2.96Å
252	D	43.2	Very low	41.8	Very low	95 Å²	95	122.6 Å²	122.6	51%	0.508	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-99.5	29.3	-174.9	-79	-31.6	0	0	0	114	K249 D254	K249-D252 PolarHBondContact O-N 3.48Å; D252-D254 VanDerWaalsContact C-N 3.33Å
253	K	40.9	Very low	41.5	Very low	129 Å²	129	119.4 Å²	119.4	56%	0.561	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-79.3	-12.6	175.5	-79	-176.1	-177.5	166.1	0	114.3
254	D	44.2	Very low	41.4	Very low	156 Å²	156	120.4 Å²	120.4	83%	0.834	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-105.4	10.5	-171	-63.6	-20.9	0	0	0	114.6	D252	D252-D254 VanDerWaalsContact C-N 3.33Å
255	K	46.3	Very low	42.8	Very low	99 Å²	99	117.2 Å²	117.2	43%	0.43	62%	0.617	S	S	.	*			trans	-128.5	49.2	-171.9	-59	-151.6	-174	-169.6	0	115.4	G257 E258	K255-G257 PolarHBondContact O-N 3.26Å; K255-E258 HydrophobicContact CB-CB 4.42Å; K255-E258 HydrophobicContact CD-CG 4.28Å; K255-E258 WeakPolarHBondContact CD-OE2 3.38Å; K255-E258 IonicContact NZ-OE1 2.71Å; K255-E258 PolarHBondContact NZ-OE1 3.07Å; K255-E258 IonicContact NZ-OE2 2.69Å; K255-E258 PolarHBondContact NZ-OE2 2.86Å; K255-E258 PolarHBondContact O-N 3.43Å
256	E	43.6	Very low	45.3	Very low	161 Å²	161	107.3 Å²	107.3	75%	0.752	58%	0.575	S	S	*	*	H	α-helix	trans	-64	-20	175.2	-70.9	-174.6	157	0	0	113.5
257	G	45.7	Very low	48.1	Very low	58 Å²	58	105.1 Å²	105.1	60%	0.598	55%	0.552	S	S	*	*	H	α-helix	trans	-77.3	-37.1	175	0	0	0	0	0	115.2	K255	K255-G257 PolarHBondContact O-N 3.26Å
258	E	44.1	Very low	51.1	Low	94 Å²	94	97.1 Å²	97.1	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-75.2	-30.5	-179.4	-77.8	179.9	-165.3	0	0	112.1	K255 A260 E261 I262	K255-E258 HydrophobicContact CB-CB 4.42Å; K255-E258 HydrophobicContact CD-CG 4.28Å; K255-E258 WeakPolarHBondContact CD-OE2 3.38Å; K255-E258 IonicContact NZ-OE1 2.71Å; K255-E258 PolarHBondContact NZ-OE1 3.07Å; K255-E258 IonicContact NZ-OE2 2.69Å; K255-E258 PolarHBondContact NZ-OE2 2.86Å; K255-E258 PolarHBondContact O-N 3.43Å; E258-A260 VanDerWaalsContact C-N 3.29Å; E258-A260 PolarHBondContact O-N 2.83Å; E258-E261 PolarHBondContact O-N 2.86Å; E258-I262 HydrophobicContact CB-CD1 4.4Å; E258-I262 WeakPolarHBondContact O-CB 3.47Å; E258-I262 VanDerWaalsContact O-CD1 3.32Å; E258-I262 WeakPolarHBondContact O-CD1 3.4Å; E258-I262 WeakPolarHBondContact O-CG1 3.44Å; E258-I262 PolarHBondContact O-N 3.46Å
259	A	42.8	Very low	53.8	Low	66 Å²	66	92.1 Å²	92.1	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-29.8	179.9	0	0	0	0	0	113.4	S263	A259-S263 PolarHBondContact O-N 3.29Å
260	A	41	Very low	56.7	Low	63 Å²	63	87.6 Å²	87.6	52%	0.521	47%	0.474	S	S	.	.	H	α-helix	trans	-76	-41.2	176.4	0	0	0	0	0	112.3	E258 S263 E264	E258-A260 VanDerWaalsContact C-N 3.29Å; E258-A260 PolarHBondContact O-N 2.83Å; A260-S263 WeakPolarHBondContact O-CB 3.49Å; A260-S263 PolarHBondContact O-N 3.29Å; A260-E264 PolarHBondContact O-N 3.35Å
261	E	44.3	Very low	59.3	Low	141 Å²	141	81.1 Å²	81.1	66%	0.659	44%	0.439	S	S	*	.	H	α-helix	trans	-68.4	-34.3	176.5	-86.4	-176.1	152.4	0	0	113.1	E258 S263 E264 S265	E258-E261 PolarHBondContact O-N 2.86Å; E261-S263 VanDerWaalsContact C-N 3.3Å; E261-S263 PolarHBondContact O-N 3.33Å; E261-E264 PolarHBondContact O-N 2.97Å; E261-S265 PolarHBondContact O-N 3.49Å; E261-S265 PolarHBondContact O-OG 3.33Å
262	I	49.6	Very low	61.7	Low	79 Å²	79	73.5 Å²	73.5	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-68.8	-32	176.2	-66	163.7	0	0	0	111.1	E258 S265 S266	E258-I262 HydrophobicContact CB-CD1 4.4Å; E258-I262 WeakPolarHBondContact O-CB 3.47Å; E258-I262 VanDerWaalsContact O-CD1 3.32Å; E258-I262 WeakPolarHBondContact O-CD1 3.4Å; E258-I262 WeakPolarHBondContact O-CG1 3.44Å; E258-I262 PolarHBondContact O-N 3.46Å; I262-S265 PolarHBondContact O-OG 3.14Å; I262-S266 PolarHBondContact O-N 2.82Å
263	S	51.5	Low	64	Low	46 Å²	46	73 Å²	73	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-69.3	-32	175.3	-174.1	0	0	0	0	112.8	A259 A260 E261	A259-S263 PolarHBondContact O-N 3.29Å; A260-S263 WeakPolarHBondContact O-CB 3.49Å; A260-S263 PolarHBondContact O-N 3.29Å; E261-S263 VanDerWaalsContact C-N 3.3Å; E261-S263 PolarHBondContact O-N 3.33Å
264	E	54	Low	66.5	Low	149 Å²	149	69.2 Å²	69.2	70%	0.696	38%	0.38	S	S	*	.	H	α-helix	trans	-84.6	-18.9	179.8	-75.9	-171.1	164.3	0	0	113.7	A260 E261 K270	A260-E264 PolarHBondContact O-N 3.35Å; E261-E264 PolarHBondContact O-N 2.97Å; E264-K270 WeakPolarHBondContact O-CE 3.5Å; E264-K270 PolarHBondContact O-NZ 3.47Å
265	S	67.6	Low	68.7	Low	91 Å²	91	62.9 Å²	62.9	64%	0.636	35%	0.346	S	S	*	.	H	α-helix	trans	-99.8	-26.3	-176.2	52.8	0	0	0	0	114.8	E261 I262	E261-S265 PolarHBondContact O-N 3.49Å; E261-S265 PolarHBondContact O-OG 3.33Å; I262-S265 PolarHBondContact O-OG 3.14Å
266	S	85.8	Confident	70.7	Confident	7 Å²	7	64.1 Å²	64.1	5%	0.049	36%	0.357	C	S	.	.			trans	-77.7	125.8	-179.5	175.6	0	0	0	0	112.8	I262 Y268 L269 K270 E290 Y297	I262-S266 PolarHBondContact O-N 2.82Å; S266-Y268 PolarHBondContact OG-N 2.91Å; S266-L269 PolarHBondContact OG-N 3.34Å; S266-K270 PolarHBondContact O-N 3Å; S266-E290 VanDerWaalsContact CA-OE2 3.24Å; S266-E290 WeakPolarHBondContact CA-OE2 3.48Å; S266-E290 WeakPolarHBondContact CB-OE2 3.28Å; S266-E290 PolarHBondContact OG-OE2 3.23Å; S266-Y297 VanDerWaalsContact OG-CD2 3.27Å; S266-Y297 WeakPolarHBondContact OG-CD2 3Å
267	G	90.9	Very high	73	Confident	4 Å²	4	62.4 Å²	62.4	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-35.9	173.5	0	0	0	0	0	112.6	K270 A271 E286 E290	G267-K270 PolarHBondContact O-N 3.38Å; G267-A271 WeakPolarHBondContact O-CB 3.31Å; G267-A271 PolarHBondContact O-N 3.07Å; G267-E286 CarbonylContact C-O 3.49Å; G267-E286 VanDerWaalsContact CA-O 3.32Å; G267-E286 WeakPolarHBondContact CA-O 3.29Å; G267-E286 WeakPolarHBondContact O-CB 3.28Å; G267-E290 PolarHBondContact N-OE2 3.44Å
268	Y	92	Very high	75.2	Confident	12 Å²	12	63.8 Å²	63.8	5%	0.047	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-42.5	176.3	174	-111	0	0	0	112.2	S266 K270 A271 K272 E290 Y297 E300 L304	S266-Y268 PolarHBondContact OG-N 2.91Å; Y268-K270 VanDerWaalsContact C-N 3.34Å; Y268-K270 PolarHBondContact O-N 2.63Å; Y268-A271 WeakPolarHBondContact O-CB 3.35Å; Y268-A271 PolarHBondContact O-N 2.9Å; Y268-A271 VanDerWaalsContact O-N 3.17Å; Y268-K272 HydrophobicContact CE1-CG 4.11Å; Y268-K272 HydrophobicContact CE2-CG 4.05Å; Y268-K272 PolarHBondContact O-N 3.05Å; Y268-E290 PolarHBondContact N-OE2 2.93Å; Y268-Y297 AromaticContact CD1-CD1 3.81Å; Y268-Y297 HydrophobicContact CD1-CD1 3.81Å; Y268-Y297 HydrophobicContact CD1-CD2 4.37Å; Y268-Y297 AromaticContact CD1-CG 3.68Å; Y268-Y297 HydrophobicContact CD1-CG 3.68Å; Y268-Y297 HydrophobicContact CE1-CD1 4.23Å; Y268-Y297 HydrophobicContact CG-CG 4.29Å; Y268-E300 HydrophobicContact CD1-CB 4.23Å; Y268-E300 HydrophobicContact CD2-CB 3.88Å; Y268-E300 HydrophobicContact CE1-CB 3.95Å; Y268-E300 HydrophobicContact CE1-CG 4.32Å; Y268-E300 HydrophobicContact CE2-CB 3.59Å; Y268-E300 HydrophobicContact CG-CB 4.2Å; Y268-L304 HydrophobicContact CD2-CD2 4Å; Y268-L304 HydrophobicContact CE2-CB 4.39Å; Y268-L304 HydrophobicContact CE2-CD2 3.84Å
269	L	90.6	Very high	77.6	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-65.7	-38.7	179	-63.6	-174.4	0	0	0	111.9	S266 K272 Q273 Y297	S266-L269 PolarHBondContact OG-N 3.34Å; L269-K272 PolarHBondContact O-N 3.31Å; L269-Q273 WeakPolarHBondContact O-CG 3.42Å; L269-Q273 PolarHBondContact O-N 3.34Å; L269-Y297 HydrophobicContact CD1-CE2 3.98Å; L269-Y297 HydrophobicContact CD2-CE2 4.28Å; L269-Y297 HydrophobicContact CG-CD2 4.4Å; L269-Y297 HydrophobicContact CG-CE2 3.99Å
270	K	92.6	Very high	80.1	Confident	68 Å²	68	58.7 Å²	58.7	30%	0.296	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-41.1	170.6	-71.8	178.3	-178.3	169.8	0	112.3	E264 S266 G267 Y268 K272 Q273 Y274 E286	E264-K270 WeakPolarHBondContact O-CE 3.5Å; E264-K270 PolarHBondContact O-NZ 3.47Å; S266-K270 PolarHBondContact O-N 3Å; G267-K270 PolarHBondContact O-N 3.38Å; Y268-K270 VanDerWaalsContact C-N 3.34Å; Y268-K270 PolarHBondContact O-N 2.63Å; K270-K272 VanDerWaalsContact C-N 3.29Å; K270-K272 PolarHBondContact O-N 2.99Å; K270-Q273 WeakPolarHBondContact O-CB 3.29Å; K270-Q273 PolarHBondContact O-N 3.48Å; K270-Y274 VanDerWaalsContact O-CD2 3.27Å; K270-Y274 WeakPolarHBondContact O-CD2 3.31Å; K270-Y274 PolarHBondContact O-N 2.95Å; K270-E286 HydrophobicContact CB-CB 4.3Å; K270-E286 HydrophobicContact CB-CG 4.05Å
271	A	93.7	Very high	82.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-39.9	175.3	0	0	0	0	0	111.7	G267 Y268 Y274 M275 I283 E286 L304	G267-A271 WeakPolarHBondContact O-CB 3.31Å; G267-A271 PolarHBondContact O-N 3.07Å; Y268-A271 WeakPolarHBondContact O-CB 3.35Å; Y268-A271 PolarHBondContact O-N 2.9Å; Y268-A271 VanDerWaalsContact O-N 3.17Å; A271-Y274 PolarHBondContact O-N 3.47Å; A271-M275 WeakPolarHBondContact O-CG 3.39Å; A271-M275 PolarHBondContact O-N 2.79Å; A271-I283 HydrophobicContact CB-CG2 4.27Å; A271-E286 HydrophobicContact CB-CB 4.14Å; A271-L304 HydrophobicContact CB-CD2 3.8Å
272	K	91.2	Very high	85	Confident	14 Å²	14	58.2 Å²	58.2	6%	0.061	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-42.6	173.7	-79.3	-73.1	-67.9	173.1	0	112.7	I239 Q241 Y268 L269 K270 Y274 M275 D276	I239-K272 PolarHBondContact O-NZ 3.05Å; Q241-K272 PolarHBondContact O-NZ 2.6Å; Y268-K272 HydrophobicContact CE1-CG 4.11Å; Y268-K272 HydrophobicContact CE2-CG 4.05Å; Y268-K272 PolarHBondContact O-N 3.05Å; L269-K272 PolarHBondContact O-N 3.31Å; K270-K272 VanDerWaalsContact C-N 3.29Å; K270-K272 PolarHBondContact O-N 2.99Å; K272-Y274 VanDerWaalsContact C-N 3.29Å; K272-Y274 PolarHBondContact O-N 3.34Å; K272-M275 HydrophobicContact CD-SD 4.08Å; K272-M275 WeakPolarHBondContact O-CB 3.43Å; K272-M275 PolarHBondContact O-N 2.93Å; K272-M275 VanDerWaalsContact O-N 3.09Å; K272-D276 PolarHBondContact O-N 3.09Å; K272-D276 VanDerWaalsContact O-N 3.11Å
273	Q	90.9	Very high	87.2	Confident	85 Å²	85	54.4 Å²	54.4	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-57.7	-44.6	172.6	-70.1	171.8	-11.5	0	0	111.1	L269 K270 M275 D276 E277	L269-Q273 WeakPolarHBondContact O-CG 3.42Å; L269-Q273 PolarHBondContact O-N 3.34Å; K270-Q273 WeakPolarHBondContact O-CB 3.29Å; K270-Q273 PolarHBondContact O-N 3.48Å; Q273-M275 VanDerWaalsContact C-N 3.3Å; Q273-M275 PolarHBondContact O-N 3.29Å; Q273-D276 PolarHBondContact O-N 3Å; Q273-D276 VanDerWaalsContact O-N 3.14Å; Q273-E277 WeakPolarHBondContact O-CB 3.49Å; Q273-E277 WeakPolarHBondContact O-CG 3.2Å; Q273-E277 PolarHBondContact O-N 3.44Å
274	Y	94	Very high	89.4	Confident	48 Å²	48	53.8 Å²	53.8	19%	0.188	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-27.2	175.9	-70.4	-42	0	0	0	114	K270 A271 K272 E278 N279 K282 E286	K270-Y274 VanDerWaalsContact O-CD2 3.27Å; K270-Y274 WeakPolarHBondContact O-CD2 3.31Å; K270-Y274 PolarHBondContact O-N 2.95Å; A271-Y274 PolarHBondContact O-N 3.47Å; K272-Y274 VanDerWaalsContact C-N 3.29Å; K272-Y274 PolarHBondContact O-N 3.34Å; Y274-E278 PolarHBondContact O-N 3.13Å; Y274-E278 VanDerWaalsContact O-N 3.15Å; Y274-N279 HydrophobicContact CD1-CB 3.74Å; Y274-N279 HydrophobicContact CG-CB 4.23Å; Y274-N279 PolarHBondContact O-N 3.21Å; Y274-K282 HydrophobicContact CD1-CD 4.03Å; Y274-K282 HydrophobicContact CD2-CB 3.54Å; Y274-K282 HydrophobicContact CD2-CD 4.13Å; Y274-K282 HydrophobicContact CE1-CD 3.54Å; Y274-K282 HydrophobicContact CE2-CB 3.63Å; Y274-K282 HydrophobicContact CE2-CD 3.63Å; Y274-K282 HydrophobicContact CE2-CG 4.32Å; Y274-K282 HydrophobicContact CG-CB 4.02Å; Y274-K282 HydrophobicContact CG-CD 4.31Å; Y274-E286 HydrophobicContact CD2-CG 3.91Å; Y274-E286 HydrophobicContact CE2-CG 3.62Å
275	M	91.3	Very high	91.4	Very high	23 Å²	23	49.7 Å²	49.7	11%	0.113	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-44.1	169.3	-71	-176.2	72.2	0	0	111.7	F231 I239 A271 K272 Q273 E277 E278 I283 L304 F308	F231-M275 HydrophobicContact CD1-CE 4.01Å; F231-M275 HydrophobicContact CD2-CE 3.85Å; F231-M275 HydrophobicContact CE1-CE 3.73Å; F231-M275 HydrophobicContact CE2-CE 3.58Å; F231-M275 HydrophobicContact CG-CE 4.07Å; F231-M275 HydrophobicContact CZ-CE 3.51Å; I239-M275 HydrophobicContact CG2-SD 4.35Å; A271-M275 WeakPolarHBondContact O-CG 3.39Å; A271-M275 PolarHBondContact O-N 2.79Å; K272-M275 HydrophobicContact CD-SD 4.08Å; K272-M275 WeakPolarHBondContact O-CB 3.43Å; K272-M275 PolarHBondContact O-N 2.93Å; K272-M275 VanDerWaalsContact O-N 3.09Å; Q273-M275 VanDerWaalsContact C-N 3.3Å; Q273-M275 PolarHBondContact O-N 3.29Å; M275-E277 VanDerWaalsContact C-N 3.35Å; M275-E278 PolarHBondContact O-N 3.44Å; M275-I283 HydrophobicContact CB-CD1 4.44Å; M275-I283 HydrophobicContact CG-CD1 3.43Å; M275-I283 VanDerWaalsContact CG-CD1 3.43Å; M275-I283 HydrophobicContact CG-CG1 4.29Å; M275-L304 HydrophobicContact CE-CD1 4.41Å; M275-L304 HydrophobicContact SD-CD1 3.62Å; M275-L304 HydrophobicContact SD-CD2 4.12Å; M275-F308 HydrophobicContact CE-CE2 4.47Å
276	D	88.4	Confident	92.8	Very high	125 Å²	125	46.2 Å²	46.2	67%	0.668	23%	0.23	S	C	*	.	H	α-helix	trans	-70	-33.1	-179.5	-63.5	-23	0	0	0	111.8	K272 Q273 E278	K272-D276 PolarHBondContact O-N 3.09Å; K272-D276 VanDerWaalsContact O-N 3.11Å; Q273-D276 PolarHBondContact O-N 3Å; Q273-D276 VanDerWaalsContact O-N 3.14Å; D276-E278 VanDerWaalsContact C-N 3.27Å
277	E	91.4	Very high	93.4	Very high	126 Å²	126	45.9 Å²	45.9	59%	0.589	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.1	173.7	-67.5	176.7	-178.7	0	0	113.7	Q273 M275 N279	Q273-E277 WeakPolarHBondContact O-CB 3.49Å; Q273-E277 WeakPolarHBondContact O-CG 3.2Å; Q273-E277 PolarHBondContact O-N 3.44Å; M275-E277 VanDerWaalsContact C-N 3.35Å; E277-N279 HydrophobicContact CB-CB 4.36Å; E277-N279 PolarHBondContact O-N 2.86Å
278	E	92.2	Very high	93.7	Very high	86 Å²	86	47 Å²	47	40%	0.402	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	23.9	-175.2	-51.4	-176.2	-147.3	0	0	114.1	K228 Y274 M275 D276 Y280	K228-E278 WeakPolarHBondContact CE-OE1 3.36Å; K228-E278 VanDerWaalsContact CE-OE2 3.29Å; K228-E278 WeakPolarHBondContact CE-OE2 3.45Å; K228-E278 IonicContact NZ-OE1 3.32Å; K228-E278 PolarHBondContact NZ-OE1 3.26Å; K228-E278 IonicContact NZ-OE2 3.7Å; K228-E278 PolarHBondContact NZ-OE2 3.29Å; Y274-E278 PolarHBondContact O-N 3.13Å; Y274-E278 VanDerWaalsContact O-N 3.15Å; M275-E278 PolarHBondContact O-N 3.44Å; D276-E278 VanDerWaalsContact C-N 3.27Å; E278-Y280 VanDerWaalsContact C-N 3.31Å; E278-Y280 HydrophobicContact CB-CE2 3.91Å; E278-Y280 WeakPolarHBondContact O-CD2 3.45Å; E278-Y280 PolarHBondContact O-N 2.94Å
279	N	94.3	Very high	93.8	Very high	38 Å²	38	51.2 Å²	51.2	20%	0.203	25%	0.252	C	S	.	.			trans	-90.4	60	179	-160.5	-28.1	0	0	0	111.2	Y274 E277 D281 K282	Y274-N279 HydrophobicContact CD1-CB 3.74Å; Y274-N279 HydrophobicContact CG-CB 4.23Å; Y274-N279 PolarHBondContact O-N 3.21Å; E277-N279 HydrophobicContact CB-CB 4.36Å; E277-N279 PolarHBondContact O-N 2.86Å; N279-D281 VanDerWaalsContact C-N 3.28Å; N279-D281 PolarHBondContact O-N 3.02Å; N279-D281 PolarHBondContact OD1-OD1 3.35Å; N279-K282 WeakPolarHBondContact ND2-CE 3.37Å; N279-K282 PolarHBondContact ND2-NZ 3.45Å; N279-K282 VanDerWaalsContact ND2-NZ 3.18Å; N279-K282 PolarHBondContact O-N 3.22Å; N279-K282 WeakPolarHBondContact OD1-CD 3.17Å
280	Y	94.8	Very high	94	Very high	16 Å²	16	50.9 Å²	50.9	6%	0.063	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-65.4	-25.3	-165.7	-60.1	-58.4	0	0	0	115.2	P224 I227 E278 K282 I283 F308	P224-Y280 HydrophobicContact CB-CE2 4Å; P224-Y280 HydrophobicContact CG-CE2 4.42Å; I227-Y280 HydrophobicContact CB-CE1 4.5Å; I227-Y280 HydrophobicContact CB-CE2 4.31Å; I227-Y280 HydrophobicContact CD1-CD1 4.23Å; I227-Y280 HydrophobicContact CD1-CD2 3.46Å; I227-Y280 VanDerWaalsContact CD1-CD2 3.46Å; I227-Y280 HydrophobicContact CD1-CE2 3.79Å; I227-Y280 HydrophobicContact CD1-CG 3.7Å; I227-Y280 HydrophobicContact CG2-CD1 4.08Å; I227-Y280 HydrophobicContact CG2-CE1 3.66Å; I227-Y280 HydrophobicContact CG2-CE2 4.32Å; E278-Y280 VanDerWaalsContact C-N 3.31Å; E278-Y280 HydrophobicContact CB-CE2 3.91Å; E278-Y280 WeakPolarHBondContact O-CD2 3.45Å; E278-Y280 PolarHBondContact O-N 2.94Å; Y280-K282 PolarHBondContact O-N 3.39Å; Y280-I283 HydrophobicContact CD1-CD1 3.76Å; Y280-I283 PolarHBondContact O-N 2.97Å; Y280-F308 AromaticContact CD1-CE1 3.85Å; Y280-F308 HydrophobicContact CD1-CE1 3.85Å; Y280-F308 AromaticContact CD1-CZ 3.79Å; Y280-F308 HydrophobicContact CD1-CZ 3.79Å; Y280-F308 HydrophobicContact CE1-CZ 4.5Å; Y280-F308 HydrophobicContact CG-CE1 4.15Å
281	D	93.4	Very high	94.2	Very high	118 Å²	118	49 Å²	49	63%	0.631	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-65.2	-24.8	-178.8	52.2	-61.2	0	0	0	113.4	N279	N279-D281 VanDerWaalsContact C-N 3.28Å; N279-D281 PolarHBondContact O-N 3.02Å; N279-D281 PolarHBondContact OD1-OD1 3.35Å
282	K	95.4	Very high	94.2	Very high	75 Å²	75	56.3 Å²	56.3	33%	0.326	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-86.7	-16.5	-179.7	-64.2	-178.2	-175.3	170.1	0	114.3	Y274 N279 Y280 I284 S285 E286	Y274-K282 HydrophobicContact CD1-CD 4.03Å; Y274-K282 HydrophobicContact CD2-CB 3.54Å; Y274-K282 HydrophobicContact CD2-CD 4.13Å; Y274-K282 HydrophobicContact CE1-CD 3.54Å; Y274-K282 HydrophobicContact CE2-CB 3.63Å; Y274-K282 HydrophobicContact CE2-CD 3.63Å; Y274-K282 HydrophobicContact CE2-CG 4.32Å; Y274-K282 HydrophobicContact CG-CB 4.02Å; Y274-K282 HydrophobicContact CG-CD 4.31Å; N279-K282 WeakPolarHBondContact ND2-CE 3.37Å; N279-K282 PolarHBondContact ND2-NZ 3.45Å; N279-K282 VanDerWaalsContact ND2-NZ 3.18Å; N279-K282 PolarHBondContact O-N 3.22Å; N279-K282 WeakPolarHBondContact OD1-CD 3.17Å; Y280-K282 PolarHBondContact O-N 3.39Å; K282-I284 PolarHBondContact O-N 3.27Å; K282-S285 PolarHBondContact O-N 2.94Å; K282-S285 VanDerWaalsContact O-N 3.14Å; K282-E286 PolarHBondContact O-N 3Å; K282-E286 VanDerWaalsContact O-N 3.09Å
283	I	96.1	Very high	94.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-48.4	-171.9	-69.7	171.8	0	0	0	111.7	A271 M275 Y280 S285 E286 C287 L304 F308	A271-I283 HydrophobicContact CB-CG2 4.27Å; M275-I283 HydrophobicContact CB-CD1 4.44Å; M275-I283 HydrophobicContact CG-CD1 3.43Å; M275-I283 VanDerWaalsContact CG-CD1 3.43Å; M275-I283 HydrophobicContact CG-CG1 4.29Å; Y280-I283 HydrophobicContact CD1-CD1 3.76Å; Y280-I283 PolarHBondContact O-N 2.97Å; I283-S285 VanDerWaalsContact C-N 3.27Å; I283-S285 PolarHBondContact O-N 3.19Å; I283-E286 PolarHBondContact O-N 2.86Å; I283-C287 WeakPolarHBondContact O-CB 3.47Å; I283-C287 PolarHBondContact O-N 3.25Å; I283-C287 PolarHBondContact O-SG 3Å; I283-L304 HydrophobicContact CG2-CD1 4.17Å; I283-L304 HydrophobicContact CG2-CD2 4.07Å; I283-L304 HydrophobicContact CG2-CG 3.86Å; I283-F308 HydrophobicContact CB-CD2 4.36Å; I283-F308 HydrophobicContact CB-CE2 4.46Å; I283-F308 HydrophobicContact CB-CG 4.43Å; I283-F308 HydrophobicContact CD1-CD1 4.35Å; I283-F308 HydrophobicContact CD1-CD2 4.25Å; I283-F308 HydrophobicContact CD1-CE1 3.67Å; I283-F308 HydrophobicContact CD1-CE2 3.54Å; I283-F308 HydrophobicContact CD1-CZ 3.21Å; I283-F308 HydrophobicContact CG1-CZ 4.48Å; I283-F308 HydrophobicContact CG2-CD2 3.54Å; I283-F308 HydrophobicContact CG2-CE2 3.82Å; I283-F308 HydrophobicContact CG2-CG 3.96Å; I283-F308 HydrophobicContact CG2-CZ 4.46Å
284	I	97.2	Very high	94.1	Very high	33 Å²	33	58.5 Å²	58.5	17%	0.169	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-40.3	-179.3	-67	174.3	0	0	0	111	K282 T288 R305 F308 Y309 I312	K282-I284 PolarHBondContact O-N 3.27Å; I284-T288 WeakPolarHBondContact O-CB 3.3Å; I284-T288 PolarHBondContact O-N 3.03Å; I284-T288 PolarHBondContact O-OG1 3.4Å; I284-R305 HydrophobicContact CG1-CG 4.5Å; I284-R305 HydrophobicContact CG2-CG 4.12Å; I284-F308 HydrophobicContact CD1-CB 4.12Å; I284-F308 HydrophobicContact CG1-CB 3.82Å; I284-Y309 HydrophobicContact CD1-CD1 3.94Å; I284-Y309 HydrophobicContact CD1-CE1 3.95Å; I284-Y309 HydrophobicContact CG2-CE1 3.88Å; I284-I312 HydrophobicContact CD1-CD1 3.87Å
285	S	96.4	Very high	93.4	Very high	62 Å²	62	57.3 Å²	57.3	43%	0.434	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-47	-179.8	-175.5	0	0	0	0	111.6	K282 I283 T288 K289	K282-S285 PolarHBondContact O-N 2.94Å; K282-S285 VanDerWaalsContact O-N 3.14Å; I283-S285 VanDerWaalsContact C-N 3.27Å; I283-S285 PolarHBondContact O-N 3.19Å; S285-T288 WeakPolarHBondContact O-CB 3.46Å; S285-T288 PolarHBondContact O-N 3.3Å; S285-K289 PolarHBondContact O-N 3.41Å; S285-K289 VanDerWaalsContact O-N 3.14Å
286	E	96.4	Very high	93.2	Very high	18 Å²	18	66.3 Å²	66.3	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-69.8	-39.3	-179.3	-61.6	-53.2	147.2	0	0	112.5	G267 K270 A271 Y274 K282 I283 T288 K289 E290	G267-E286 CarbonylContact C-O 3.49Å; G267-E286 VanDerWaalsContact CA-O 3.32Å; G267-E286 WeakPolarHBondContact CA-O 3.29Å; G267-E286 WeakPolarHBondContact O-CB 3.28Å; K270-E286 HydrophobicContact CB-CB 4.3Å; K270-E286 HydrophobicContact CB-CG 4.05Å; A271-E286 HydrophobicContact CB-CB 4.14Å; Y274-E286 HydrophobicContact CD2-CG 3.91Å; Y274-E286 HydrophobicContact CE2-CG 3.62Å; K282-E286 PolarHBondContact O-N 3Å; K282-E286 VanDerWaalsContact O-N 3.09Å; I283-E286 PolarHBondContact O-N 2.86Å; E286-T288 PolarHBondContact O-N 3.32Å; E286-K289 VanDerWaalsContact CD-NZ 3.26Å; E286-K289 PolarHBondContact O-N 3.39Å; E286-K289 IonicContact OE1-NZ 2.75Å; E286-K289 PolarHBondContact OE1-NZ 3.43Å; E286-K289 WeakPolarHBondContact OE2-CD 3.18Å; E286-K289 IonicContact OE2-NZ 2.61Å; E286-K289 PolarHBondContact OE2-NZ 3.44Å; E286-K289 VanDerWaalsContact OE2-NZ 3.11Å; E286-E290 PolarHBondContact O-N 3.34Å; E286-E290 VanDerWaalsContact O-N 3.13Å
287	C	97.3	Very high	93.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-38.4	171.5	-67.5	0	0	0	0	111.6	I283 K289 E290 I291 A301 R305	I283-C287 WeakPolarHBondContact O-CB 3.47Å; I283-C287 PolarHBondContact O-N 3.25Å; I283-C287 PolarHBondContact O-SG 3Å; C287-K289 PolarHBondContact O-N 2.95Å; C287-E290 PolarHBondContact O-N 3.12Å; C287-I291 VanDerWaalsContact O-CD1 3.29Å; C287-I291 WeakPolarHBondContact O-CD1 3.37Å; C287-I291 WeakPolarHBondContact O-CG1 3.31Å; C287-I291 PolarHBondContact O-N 3.34Å; C287-A301 HydrophobicContact CB-CB 4.2Å; C287-R305 HydrophobicContact CB-CB 3.74Å; C287-R305 HydrophobicContact CB-CG 4.22Å
288	T	97.3	Very high	93.5	Very high	29 Å²	29	57.3 Å²	57.3	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-43	177.7	-60.6	0	0	0	0	111.9	I284 S285 E286 E290 I291 E292 R305	I284-T288 WeakPolarHBondContact O-CB 3.3Å; I284-T288 PolarHBondContact O-N 3.03Å; I284-T288 PolarHBondContact O-OG1 3.4Å; S285-T288 WeakPolarHBondContact O-CB 3.46Å; S285-T288 PolarHBondContact O-N 3.3Å; E286-T288 PolarHBondContact O-N 3.32Å; T288-E290 PolarHBondContact O-N 2.94Å; T288-I291 PolarHBondContact O-N 2.89Å; T288-E292 HydrophobicContact CG2-CG 4.38Å; T288-E292 WeakPolarHBondContact O-CG 3.29Å; T288-E292 PolarHBondContact O-N 3.49Å; T288-R305 VanDerWaalsContact OG1-CD 3.28Å; T288-R305 WeakPolarHBondContact OG1-CD 3.49Å; T288-R305 PolarHBondContact OG1-NH1 2.97Å
289	K	95.3	Very high	93.7	Very high	99 Å²	99	53.6 Å²	53.6	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-42	175.8	-64.6	173.5	-163	163.8	0	112.4	S285 E286 C287 I291 E292 S293	S285-K289 PolarHBondContact O-N 3.41Å; S285-K289 VanDerWaalsContact O-N 3.14Å; E286-K289 VanDerWaalsContact CD-NZ 3.26Å; E286-K289 PolarHBondContact O-N 3.39Å; E286-K289 IonicContact OE1-NZ 2.75Å; E286-K289 PolarHBondContact OE1-NZ 3.43Å; E286-K289 WeakPolarHBondContact OE2-CD 3.18Å; E286-K289 IonicContact OE2-NZ 2.61Å; E286-K289 PolarHBondContact OE2-NZ 3.44Å; E286-K289 VanDerWaalsContact OE2-NZ 3.11Å; C287-K289 PolarHBondContact O-N 2.95Å; K289-I291 VanDerWaalsContact C-N 3.35Å; K289-I291 PolarHBondContact O-N 2.93Å; K289-E292 PolarHBondContact O-N 3.2Å; K289-S293 WeakPolarHBondContact O-CB 3.37Å; K289-S293 PolarHBondContact O-N 3.28Å; K289-S293 PolarHBondContact O-OG 3Å
290	E	95.1	Very high	93.7	Very high	5 Å²	5	53.6 Å²	53.6	2%	0.023	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-47.3	176.1	-177.4	74.1	-160.2	0	0	110.9	S266 G267 Y268 E286 C287 T288 S293 G294 G295 R296 Y297 A301	S266-E290 VanDerWaalsContact CA-OE2 3.24Å; S266-E290 WeakPolarHBondContact CA-OE2 3.48Å; S266-E290 WeakPolarHBondContact CB-OE2 3.28Å; S266-E290 PolarHBondContact OG-OE2 3.23Å; G267-E290 PolarHBondContact N-OE2 3.44Å; Y268-E290 PolarHBondContact N-OE2 2.93Å; E286-E290 PolarHBondContact O-N 3.34Å; E286-E290 VanDerWaalsContact O-N 3.13Å; C287-E290 PolarHBondContact O-N 3.12Å; T288-E290 PolarHBondContact O-N 2.94Å; E290-S293 PolarHBondContact O-N 3.22Å; E290-S293 PolarHBondContact O-OG 3.49Å; E290-G294 PolarHBondContact O-N 2.91Å; E290-G295 PolarHBondContact O-N 2.96Å; E290-G295 VanDerWaalsContact OE1-C 3.29Å; E290-G295 VanDerWaalsContact OE1-CA 3.28Å; E290-G295 WeakPolarHBondContact OE1-CA 3.43Å; E290-R296 PolarHBondContact OE1-N 3.32Å; E290-Y297 PolarHBondContact OE1-N 3.01Å; E290-A301 HydrophobicContact CB-CB 3.87Å; E290-A301 HydrophobicContact CG-CB 3.78Å
291	I	96.1	Very high	93.8	Very high	29 Å²	29	52.9 Å²	52.9	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-44.3	-178	-65.1	160.9	0	0	0	111.1	C287 T288 K289 S293 G294 A301 L302	C287-I291 VanDerWaalsContact O-CD1 3.29Å; C287-I291 WeakPolarHBondContact O-CD1 3.37Å; C287-I291 WeakPolarHBondContact O-CG1 3.31Å; C287-I291 PolarHBondContact O-N 3.34Å; T288-I291 PolarHBondContact O-N 2.89Å; K289-I291 VanDerWaalsContact C-N 3.35Å; K289-I291 PolarHBondContact O-N 2.93Å; I291-S293 VanDerWaalsContact C-N 3.3Å; I291-S293 PolarHBondContact O-N 2.83Å; I291-G294 PolarHBondContact O-N 3.37Å; I291-A301 HydrophobicContact CD1-CB 4.22Å; I291-A301 HydrophobicContact CG1-CB 3.84Å; I291-L302 HydrophobicContact CD1-CD2 3.76Å; I291-L302 HydrophobicContact CD1-CG 3.97Å; I291-L302 HydrophobicContact CG1-CD2 4.15Å; I291-L302 HydrophobicContact CG1-CG 4.04Å; I291-L302 HydrophobicContact CG2-CD2 4.16Å
292	E	94.8	Very high	94.1	Very high	154 Å²	154	47.2 Å²	47.2	72%	0.72	25%	0.252	S	S	*	.	H	α-helix	trans	-66.1	-33	178.2	-72.8	175.8	173.5	0	0	112.6	T288 K289 G294	T288-E292 HydrophobicContact CG2-CG 4.38Å; T288-E292 WeakPolarHBondContact O-CG 3.29Å; T288-E292 PolarHBondContact O-N 3.49Å; K289-E292 PolarHBondContact O-N 3.2Å; E292-G294 VanDerWaalsContact C-N 3.25Å; E292-G294 PolarHBondContact O-N 2.9Å
293	S	91.2	Very high	94.2	Very high	84 Å²	84	43.7 Å²	43.7	59%	0.587	24%	0.237	S	C	*	.	H	α-helix	trans	-75.2	-12.4	177	72.7	0	0	0	0	113.9	K289 E290 I291 G295	K289-S293 WeakPolarHBondContact O-CB 3.37Å; K289-S293 PolarHBondContact O-N 3.28Å; K289-S293 PolarHBondContact O-OG 3Å; E290-S293 PolarHBondContact O-N 3.22Å; E290-S293 PolarHBondContact O-OG 3.49Å; I291-S293 VanDerWaalsContact C-N 3.3Å; I291-S293 PolarHBondContact O-N 2.83Å; S293-G295 PolarHBondContact O-N 3.16Å; S293-G295 PolarHBondContact OG-N 2.94Å
294	G	87	Confident	94.2	Very high	60 Å²	60	43.7 Å²	43.7	62%	0.619	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	33.6	-172.2	0	0	0	0	0	112.4	E290 I291 E292	E290-G294 PolarHBondContact O-N 2.91Å; I291-G294 PolarHBondContact O-N 3.37Å; E292-G294 VanDerWaalsContact C-N 3.25Å; E292-G294 PolarHBondContact O-N 2.9Å
295	G	79.6	Confident	94.3	Very high	23 Å²	23	43.5 Å²	43.5	24%	0.237	23%	0.234	C	C	.	.			trans	-67.5	170.7	-174.6	0	0	0	0	0	113.5	E290 S293 Y297 T298	E290-G295 PolarHBondContact O-N 2.96Å; E290-G295 VanDerWaalsContact OE1-C 3.29Å; E290-G295 VanDerWaalsContact OE1-CA 3.28Å; E290-G295 WeakPolarHBondContact OE1-CA 3.43Å; S293-G295 PolarHBondContact O-N 3.16Å; S293-G295 PolarHBondContact OG-N 2.94Å; G295-Y297 PolarHBondContact O-N 3.47Å; G295-Y297 VanDerWaalsContact O-N 3.12Å; G295-T298 PolarHBondContact N-OG1 3.01Å; G295-T298 WeakPolarHBondContact O-CB 3.37Å; G295-T298 PolarHBondContact O-N 3.34Å; G295-T298 PolarHBondContact O-OG1 2.94Å
296	R	88.4	Confident	94.4	Very high	212 Å²	212	40.6 Å²	40.6	80%	0.8	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.1	-178.4	176.6	178.2	175.4	174.5	-1.2	112.8	E290	E290-R296 PolarHBondContact OE1-N 3.32Å
297	Y	91.7	Very high	94.4	Very high	41 Å²	41	39.7 Å²	39.7	16%	0.161	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	26.2	-174.3	-55.5	-77.2	0	0	0	112.5	S266 Y268 L269 E290 G295 A299 E300 A301	S266-Y297 VanDerWaalsContact OG-CD2 3.27Å; S266-Y297 WeakPolarHBondContact OG-CD2 3Å; Y268-Y297 AromaticContact CD1-CD1 3.81Å; Y268-Y297 HydrophobicContact CD1-CD1 3.81Å; Y268-Y297 HydrophobicContact CD1-CD2 4.37Å; Y268-Y297 AromaticContact CD1-CG 3.68Å; Y268-Y297 HydrophobicContact CD1-CG 3.68Å; Y268-Y297 HydrophobicContact CE1-CD1 4.23Å; Y268-Y297 HydrophobicContact CG-CG 4.29Å; L269-Y297 HydrophobicContact CD1-CE2 3.98Å; L269-Y297 HydrophobicContact CD2-CE2 4.28Å; L269-Y297 HydrophobicContact CG-CD2 4.4Å; L269-Y297 HydrophobicContact CG-CE2 3.99Å; E290-Y297 PolarHBondContact OE1-N 3.01Å; G295-Y297 PolarHBondContact O-N 3.47Å; G295-Y297 VanDerWaalsContact O-N 3.12Å; Y297-A299 VanDerWaalsContact C-N 3.31Å; Y297-A299 PolarHBondContact O-N 3.05Å; Y297-E300 VanDerWaalsContact CA-OE2 3.31Å; Y297-E300 WeakPolarHBondContact CA-OE2 3.47Å; Y297-E300 PolarHBondContact O-N 2.94Å; Y297-A301 VanDerWaalsContact O-CB 3.28Å; Y297-A301 WeakPolarHBondContact O-CB 3.3Å; Y297-A301 PolarHBondContact O-N 2.97Å
298	T	94.7	Very high	94.3	Very high	21 Å²	21	39.7 Å²	39.7	13%	0.129	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-42.8	-177.2	-65.9	0	0	0	0	112.1	G295 A301 L302	G295-T298 PolarHBondContact N-OG1 3.01Å; G295-T298 WeakPolarHBondContact O-CB 3.37Å; G295-T298 PolarHBondContact O-N 3.34Å; G295-T298 PolarHBondContact O-OG1 2.94Å; T298-A301 PolarHBondContact O-N 3.47Å; T298-L302 HydrophobicContact CG2-CD1 4.03Å; T298-L302 HydrophobicContact CG2-CG 4.49Å; T298-L302 WeakPolarHBondContact O-CB 3.34Å; T298-L302 WeakPolarHBondContact O-CD1 3.24Å; T298-L302 VanDerWaalsContact O-CG 3.26Å; T298-L302 WeakPolarHBondContact O-CG 3.15Å; T298-L302 PolarHBondContact O-N 3.12Å
299	A	95.1	Very high	94.3	Very high	9 Å²	9	40.2 Å²	40.2	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-42.5	-179.3	0	0	0	0	0	112.1	Y297 L303 M328 A331 L335	Y297-A299 VanDerWaalsContact C-N 3.31Å; Y297-A299 PolarHBondContact O-N 3.05Å; A299-L303 PolarHBondContact O-N 3.13Å; A299-L303 VanDerWaalsContact O-N 3.16Å; A299-M328 HydrophobicContact CB-CE 4Å; A299-M328 HydrophobicContact CB-SD 4.17Å; A299-A331 HydrophobicContact CB-CB 3.98Å; A299-L335 HydrophobicContact CB-CD1 4.07Å
300	E	95.4	Very high	94.2	Very high	38 Å²	38	36.7 Å²	36.7	18%	0.178	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-41.9	176.3	-63.7	85.1	163.3	0	0	111.6	I238 Y268 Y297 L303 L304 L335	I238-E300 HydrophobicContact CG2-CG 4.42Å; Y268-E300 HydrophobicContact CD1-CB 4.23Å; Y268-E300 HydrophobicContact CD2-CB 3.88Å; Y268-E300 HydrophobicContact CE1-CB 3.95Å; Y268-E300 HydrophobicContact CE1-CG 4.32Å; Y268-E300 HydrophobicContact CE2-CB 3.59Å; Y268-E300 HydrophobicContact CG-CB 4.2Å; Y297-E300 VanDerWaalsContact CA-OE2 3.31Å; Y297-E300 WeakPolarHBondContact CA-OE2 3.47Å; Y297-E300 PolarHBondContact O-N 2.94Å; E300-L303 PolarHBondContact O-N 3.25Å; E300-L304 VanDerWaalsContact O-CB 3.3Å; E300-L304 WeakPolarHBondContact O-CB 3.47Å; E300-L304 PolarHBondContact O-N 3.26Å; E300-L335 HydrophobicContact CG-CD1 3.85Å; E300-L335 HydrophobicContact CG-CD2 4.22Å
301	A	96.6	Very high	94	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-41.4	176.7	0	0	0	0	0	112.3	C287 E290 I291 Y297 T298 R305	C287-A301 HydrophobicContact CB-CB 4.2Å; E290-A301 HydrophobicContact CB-CB 3.87Å; E290-A301 HydrophobicContact CG-CB 3.78Å; I291-A301 HydrophobicContact CD1-CB 4.22Å; I291-A301 HydrophobicContact CG1-CB 3.84Å; Y297-A301 VanDerWaalsContact O-CB 3.28Å; Y297-A301 WeakPolarHBondContact O-CB 3.3Å; Y297-A301 PolarHBondContact O-N 2.97Å; T298-A301 PolarHBondContact O-N 3.47Å; A301-R305 WeakPolarHBondContact O-CB 3.49Å; A301-R305 PolarHBondContact O-N 3.39Å
302	L	98.3	Very high	93.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-50	174	-75.7	162.4	0	0	0	110.8	I291 T298 R305 A306 D321 Q324 V325 M328	I291-L302 HydrophobicContact CD1-CD2 3.76Å; I291-L302 HydrophobicContact CD1-CG 3.97Å; I291-L302 HydrophobicContact CG1-CD2 4.15Å; I291-L302 HydrophobicContact CG1-CG 4.04Å; I291-L302 HydrophobicContact CG2-CD2 4.16Å; T298-L302 HydrophobicContact CG2-CD1 4.03Å; T298-L302 HydrophobicContact CG2-CG 4.49Å; T298-L302 WeakPolarHBondContact O-CB 3.34Å; T298-L302 WeakPolarHBondContact O-CD1 3.24Å; T298-L302 VanDerWaalsContact O-CG 3.26Å; T298-L302 WeakPolarHBondContact O-CG 3.15Å; T298-L302 PolarHBondContact O-N 3.12Å; L302-R305 PolarHBondContact O-N 2.84Å; L302-A306 VanDerWaalsContact O-CB 3.27Å; L302-A306 WeakPolarHBondContact O-CB 3.47Å; L302-A306 PolarHBondContact O-N 3.28Å; L302-D321 HydrophobicContact CB-CB 4.47Å; L302-D321 HydrophobicContact CD2-CB 4.07Å; L302-Q324 HydrophobicContact CD1-CB 4.18Å; L302-Q324 HydrophobicContact CD1-CG 3.74Å; L302-V325 HydrophobicContact CB-CG2 3.41Å; L302-V325 VanDerWaalsContact CB-CG2 3.41Å; L302-V325 HydrophobicContact CD1-CG2 4.1Å; L302-V325 HydrophobicContact CG-CG2 4.39Å; L302-M328 HydrophobicContact CD1-SD 3.91Å
303	L	97.9	Very high	93.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-38.9	-178.2	-177.6	63.1	0	0	0	112.5	I239 A299 E300 T307 L322 V325 L335 N338 A339 K342	I239-L303 HydrophobicContact CD1-CB 3.77Å; I239-L303 HydrophobicContact CD1-CD2 3.56Å; I239-L303 HydrophobicContact CD1-CG 3.45Å; I239-L303 VanDerWaalsContact CD1-CG 3.45Å; I239-L303 HydrophobicContact CG1-CD2 4.47Å; A299-L303 PolarHBondContact O-N 3.13Å; A299-L303 VanDerWaalsContact O-N 3.16Å; E300-L303 PolarHBondContact O-N 3.25Å; L303-T307 WeakPolarHBondContact O-CB 3.45Å; L303-T307 PolarHBondContact O-N 3.2Å; L303-T307 PolarHBondContact O-OG1 3.33Å; L303-L322 HydrophobicContact CD1-CD2 4.03Å; L303-V325 HydrophobicContact CB-CG2 4.23Å; L303-L335 HydrophobicContact CD2-CB 4.16Å; L303-L335 HydrophobicContact CD2-CD2 3.61Å; L303-N338 HydrophobicContact CD2-CB 4.02Å; L303-A339 HydrophobicContact CD1-CB 3.84Å; L303-K342 HydrophobicContact CD1-CD 3.92Å
304	L	97.3	Very high	93.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-45.7	175.5	178.1	56.4	0	0	0	111	F231 I239 Y268 A271 M275 I283 E300 T307 F308	F231-L304 HydrophobicContact CZ-CD1 4.33Å; I239-L304 HydrophobicContact CD1-CB 4.06Å; I239-L304 HydrophobicContact CG2-CB 4.46Å; I239-L304 HydrophobicContact CG2-CD1 3.73Å; Y268-L304 HydrophobicContact CD2-CD2 4Å; Y268-L304 HydrophobicContact CE2-CB 4.39Å; Y268-L304 HydrophobicContact CE2-CD2 3.84Å; A271-L304 HydrophobicContact CB-CD2 3.8Å; M275-L304 HydrophobicContact CE-CD1 4.41Å; M275-L304 HydrophobicContact SD-CD1 3.62Å; M275-L304 HydrophobicContact SD-CD2 4.12Å; I283-L304 HydrophobicContact CG2-CD1 4.17Å; I283-L304 HydrophobicContact CG2-CD2 4.07Å; I283-L304 HydrophobicContact CG2-CG 3.86Å; E300-L304 VanDerWaalsContact O-CB 3.3Å; E300-L304 WeakPolarHBondContact O-CB 3.47Å; E300-L304 PolarHBondContact O-N 3.26Å; L304-T307 WeakPolarHBondContact O-CB 3.32Å; L304-T307 PolarHBondContact O-N 3.35Å; L304-F308 HydrophobicContact CD1-CD2 3.69Å; L304-F308 HydrophobicContact CD1-CE2 3.55Å; L304-F308 HydrophobicContact CG-CD2 4.4Å; L304-F308 WeakPolarHBondContact O-CD2 3.07Å; L304-F308 PolarHBondContact O-N 3.43Å
305	R	98	Very high	93.7	Very high	30 Å²	30	25.1 Å²	25.1	11%	0.113	12%	0.12	C	C	.	.	H	α-helix	trans	-62.3	-44.9	176.5	-166	173.5	68.3	179.8	-2.9	111.7	I284 C287 T288 A301 L302 T307 F308 Y309 D321	I284-R305 HydrophobicContact CG1-CG 4.5Å; I284-R305 HydrophobicContact CG2-CG 4.12Å; C287-R305 HydrophobicContact CB-CB 3.74Å; C287-R305 HydrophobicContact CB-CG 4.22Å; T288-R305 VanDerWaalsContact OG1-CD 3.28Å; T288-R305 WeakPolarHBondContact OG1-CD 3.49Å; T288-R305 PolarHBondContact OG1-NH1 2.97Å; A301-R305 WeakPolarHBondContact O-CB 3.49Å; A301-R305 PolarHBondContact O-N 3.39Å; L302-R305 PolarHBondContact O-N 2.84Å; R305-T307 VanDerWaalsContact C-N 3.29Å; R305-T307 PolarHBondContact O-N 3.49Å; R305-F308 PolarHBondContact O-N 2.92Å; R305-Y309 HydrophobicContact CG-CD2 4.02Å; R305-Y309 HydrophobicContact CG-CE2 3.56Å; R305-Y309 WeakPolarHBondContact O-CD2 3.35Å; R305-Y309 PolarHBondContact O-N 3.36Å; R305-D321 IonicContact CZ-OD1 2.73Å; R305-D321 IonicContact CZ-OD2 3.13Å; R305-D321 IonicContact NE-OD1 3.52Å; R305-D321 IonicContact NE-OD2 2.62Å; R305-D321 PolarHBondContact NE-OD2 3.3Å; R305-D321 VanDerWaalsContact NH2-CG 3.34Å; R305-D321 IonicContact NH2-OD1 3.11Å; R305-D321 PolarHBondContact NH2-OD1 3.31Å; R305-D321 IonicContact NH2-OD2 3.63Å; R305-D321 PolarHBondContact NH2-OD2 3.43Å
306	A	98.2	Very high	94.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-43	173.5	0	0	0	0	0	112	L302 F308 Y309 L310 A318 D321 L322	L302-A306 VanDerWaalsContact O-CB 3.27Å; L302-A306 WeakPolarHBondContact O-CB 3.47Å; L302-A306 PolarHBondContact O-N 3.28Å; A306-F308 PolarHBondContact O-N 3.29Å; A306-Y309 PolarHBondContact O-N 3.46Å; A306-L310 WeakPolarHBondContact O-CG 3.49Å; A306-L310 PolarHBondContact O-N 3.18Å; A306-A318 HydrophobicContact CB-CB 4.47Å; A306-D321 HydrophobicContact CB-CB 3.79Å; A306-L322 HydrophobicContact CB-CD2 3.66Å; A306-L322 HydrophobicContact CB-CG 3.8Å
307	T	96.6	Very high	94.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.9	-47.9	176.7	-61.4	0	0	0	0	111.2	Y230 F231 L303 L304 R305 L310 L311 K342	Y230-T307 HydrophobicContact CD1-CG2 4.47Å; Y230-T307 HydrophobicContact CE1-CG2 3.55Å; F231-T307 HydrophobicContact CE1-CG2 4Å; F231-T307 HydrophobicContact CE2-CG2 4.49Å; F231-T307 HydrophobicContact CZ-CG2 3.63Å; L303-T307 WeakPolarHBondContact O-CB 3.45Å; L303-T307 PolarHBondContact O-N 3.2Å; L303-T307 PolarHBondContact O-OG1 3.33Å; L304-T307 WeakPolarHBondContact O-CB 3.32Å; L304-T307 PolarHBondContact O-N 3.35Å; R305-T307 VanDerWaalsContact C-N 3.29Å; R305-T307 PolarHBondContact O-N 3.49Å; T307-L310 WeakPolarHBondContact O-CB 3.32Å; T307-L310 PolarHBondContact O-N 2.91Å; T307-L311 HydrophobicContact CG2-CD1 4.2Å; T307-L311 WeakPolarHBondContact O-CG 3.43Å; T307-L311 PolarHBondContact O-N 3.19Å; T307-K342 VanDerWaalsContact CG2-NZ 3.31Å; T307-K342 VanDerWaalsContact OG1-CD 3.28Å; T307-K342 WeakPolarHBondContact OG1-CD 3.49Å; T307-K342 WeakPolarHBondContact OG1-CE 3.4Å; T307-K342 PolarHBondContact OG1-NZ 3.22Å
308	F	96.3	Very high	94.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-69.1	-33.4	178.4	-86	-89.5	0	0	0	112.9	M221 I227 F231 M275 Y280 I283 I284 L304 R305 A306 L310 L311 I312	M221-F308 HydrophobicContact CE-CD1 4.01Å; M221-F308 HydrophobicContact CE-CE1 4.47Å; M221-F308 HydrophobicContact SD-CD1 3.93Å; M221-F308 HydrophobicContact SD-CE1 4.08Å; I227-F308 HydrophobicContact CG2-CZ 4.31Å; F231-F308 AromaticContact CE2-CE2 3.83Å; F231-F308 HydrophobicContact CE2-CE2 3.83Å; F231-F308 AromaticContact CE2-CZ 3.86Å; F231-F308 HydrophobicContact CE2-CZ 3.86Å; F231-F308 HydrophobicContact CZ-CD2 4.47Å; F231-F308 AromaticContact CZ-CE2 3.68Å; F231-F308 HydrophobicContact CZ-CE2 3.68Å; F231-F308 HydrophobicContact CZ-CZ 4.21Å; M275-F308 HydrophobicContact CE-CE2 4.47Å; Y280-F308 AromaticContact CD1-CE1 3.85Å; Y280-F308 HydrophobicContact CD1-CE1 3.85Å; Y280-F308 AromaticContact CD1-CZ 3.79Å; Y280-F308 HydrophobicContact CD1-CZ 3.79Å; Y280-F308 HydrophobicContact CE1-CZ 4.5Å; Y280-F308 HydrophobicContact CG-CE1 4.15Å; I283-F308 HydrophobicContact CB-CD2 4.36Å; I283-F308 HydrophobicContact CB-CE2 4.46Å; I283-F308 HydrophobicContact CB-CG 4.43Å; I283-F308 HydrophobicContact CD1-CD1 4.35Å; I283-F308 HydrophobicContact CD1-CD2 4.25Å; I283-F308 HydrophobicContact CD1-CE1 3.67Å; I283-F308 HydrophobicContact CD1-CE2 3.54Å; I283-F308 HydrophobicContact CD1-CZ 3.21Å; I283-F308 HydrophobicContact CG1-CZ 4.48Å; I283-F308 HydrophobicContact CG2-CD2 3.54Å; I283-F308 HydrophobicContact CG2-CE2 3.82Å; I283-F308 HydrophobicContact CG2-CG 3.96Å; I283-F308 HydrophobicContact CG2-CZ 4.46Å; I284-F308 HydrophobicContact CD1-CB 4.12Å; I284-F308 HydrophobicContact CG1-CB 3.82Å; L304-F308 HydrophobicContact CD1-CD2 3.69Å; L304-F308 HydrophobicContact CD1-CE2 3.55Å; L304-F308 HydrophobicContact CG-CD2 4.4Å; L304-F308 WeakPolarHBondContact O-CD2 3.07Å; L304-F308 PolarHBondContact O-N 3.43Å; R305-F308 PolarHBondContact O-N 2.92Å; A306-F308 PolarHBondContact O-N 3.29Å; F308-L310 VanDerWaalsContact C-N 3.35Å; F308-L311 HydrophobicContact CD1-CD1 4.19Å; F308-L311 HydrophobicContact CE1-CD1 4.14Å; F308-L311 HydrophobicContact CG-CD1 4.44Å; F308-L311 HydrophobicContact CZ-CD1 4.34Å; F308-L311 PolarHBondContact O-N 2.93Å; F308-I312 WeakPolarHBondContact O-CG1 3.42Å; F308-I312 PolarHBondContact O-N 3.48Å; F308-I312 VanDerWaalsContact O-N 3.11Å
309	Y	96.1	Very high	95.1	Very high	40 Å²	40	20.8 Å²	20.8	16%	0.157	12%	0.115	C	C	.	.	H	α-helix	trans	-60.3	-42.7	168.5	-75.3	-41.1	0	0	0	112.1	I284 R305 A306 I312 G313 N314 A317	I284-Y309 HydrophobicContact CD1-CD1 3.94Å; I284-Y309 HydrophobicContact CD1-CE1 3.95Å; I284-Y309 HydrophobicContact CG2-CE1 3.88Å; R305-Y309 HydrophobicContact CG-CD2 4.02Å; R305-Y309 HydrophobicContact CG-CE2 3.56Å; R305-Y309 WeakPolarHBondContact O-CD2 3.35Å; R305-Y309 PolarHBondContact O-N 3.36Å; A306-Y309 PolarHBondContact O-N 3.46Å; Y309-I312 HydrophobicContact CD1-CD1 4.14Å; Y309-I312 VanDerWaalsContact O-CG1 3.31Å; Y309-I312 WeakPolarHBondContact O-CG1 3.31Å; Y309-I312 PolarHBondContact O-N 3.22Å; Y309-G313 PolarHBondContact O-N 2.93Å; Y309-N314 HydrophobicContact CD1-CB 4.39Å; Y309-N314 WeakPolarHBondContact O-CA 3.35Å; Y309-N314 PolarHBondContact O-N 2.93Å; Y309-A317 HydrophobicContact CD1-CB 3.84Å; Y309-A317 HydrophobicContact CD2-CB 3.81Å; Y309-A317 HydrophobicContact CE1-CB 3.94Å; Y309-A317 HydrophobicContact CE2-CB 3.89Å; Y309-A317 HydrophobicContact CG-CB 3.79Å
310	L	93.4	Very high	95.2	Very high	25 Å²	25	23.8 Å²	23.8	13%	0.131	13%	0.133	C	C	.	.	H	α-helix	trans	-65	-41.4	174.8	-68	174.8	0	0	0	112.3	A306 T307 F308 I312 G313 A318 L322 K342 M346	A306-L310 WeakPolarHBondContact O-CG 3.49Å; A306-L310 PolarHBondContact O-N 3.18Å; T307-L310 WeakPolarHBondContact O-CB 3.32Å; T307-L310 PolarHBondContact O-N 2.91Å; F308-L310 VanDerWaalsContact C-N 3.35Å; L310-I312 VanDerWaalsContact C-N 3.3Å; L310-I312 PolarHBondContact O-N 2.77Å; L310-G313 WeakPolarHBondContact O-CA 3.43Å; L310-G313 PolarHBondContact O-N 3.38Å; L310-A318 HydrophobicContact CD2-CB 3.68Å; L310-A318 HydrophobicContact CG-CB 3.72Å; L310-L322 HydrophobicContact CD1-CD1 4.34Å; L310-K342 HydrophobicContact CD1-CB 3.8Å; L310-K342 HydrophobicContact CD1-CG 4.36Å; L310-M346 HydrophobicContact CD2-CB 3.93Å; L310-M346 HydrophobicContact CD2-CG 3.9Å; L310-M346 HydrophobicContact CD2-SD 4.13Å
311	L	91.4	Very high	95.4	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-61.5	-35.8	179.2	-73.2	172.1	0	0	0	112.8	P222 F226 I227 Y230 F231 T307 F308 G313	P222-L311 HydrophobicContact CG-CB 4.24Å; P222-L311 WeakPolarHBondContact CG-O 3.4Å; F226-L311 HydrophobicContact CD1-CD2 4.34Å; F226-L311 HydrophobicContact CE1-CD2 3.77Å; I227-L311 HydrophobicContact CG1-CD1 4.47Å; I227-L311 HydrophobicContact CG2-CD1 4.5Å; Y230-L311 HydrophobicContact CD1-CD1 4.41Å; Y230-L311 HydrophobicContact CD1-CD2 4.02Å; Y230-L311 HydrophobicContact CD2-CD2 4.01Å; Y230-L311 HydrophobicContact CE1-CD2 4.35Å; Y230-L311 HydrophobicContact CE2-CD2 4.33Å; Y230-L311 HydrophobicContact CG-CD2 3.84Å; F231-L311 HydrophobicContact CE2-CD1 4.15Å; T307-L311 HydrophobicContact CG2-CD1 4.2Å; T307-L311 WeakPolarHBondContact O-CG 3.43Å; T307-L311 PolarHBondContact O-N 3.19Å; F308-L311 HydrophobicContact CD1-CD1 4.19Å; F308-L311 HydrophobicContact CE1-CD1 4.14Å; F308-L311 HydrophobicContact CG-CD1 4.44Å; F308-L311 HydrophobicContact CZ-CD1 4.34Å; F308-L311 PolarHBondContact O-N 2.93Å; L311-G313 VanDerWaalsContact C-N 3.25Å; L311-G313 PolarHBondContact O-N 3.29Å
312	I	91.8	Very high	95.5	Very high	15 Å²	15	22.3 Å²	22.3	8%	0.077	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	7.4	173.8	71.7	-175.2	0	0	0	113	R217 P219 M221 I284 F308 Y309 L310 N314	R217-I312 PolarHBondContact NH2-O 3.02Å; P219-I312 HydrophobicContact CB-CB 4.16Å; P219-I312 HydrophobicContact CB-CD1 3.78Å; P219-I312 HydrophobicContact CB-CG1 4.12Å; M221-I312 HydrophobicContact CE-CG2 4.01Å; M221-I312 HydrophobicContact SD-CG2 3.98Å; I284-I312 HydrophobicContact CD1-CD1 3.87Å; F308-I312 WeakPolarHBondContact O-CG1 3.42Å; F308-I312 PolarHBondContact O-N 3.48Å; F308-I312 VanDerWaalsContact O-N 3.11Å; Y309-I312 HydrophobicContact CD1-CD1 4.14Å; Y309-I312 VanDerWaalsContact O-CG1 3.31Å; Y309-I312 WeakPolarHBondContact O-CG1 3.31Å; Y309-I312 PolarHBondContact O-N 3.22Å; L310-I312 VanDerWaalsContact C-N 3.3Å; L310-I312 PolarHBondContact O-N 2.77Å; I312-N314 VanDerWaalsContact C-N 3.31Å; I312-N314 HydrophobicContact CD1-CB 4.33Å; I312-N314 HydrophobicContact CG1-CB 3.98Å; I312-N314 PolarHBondContact O-N 3.29Å
313	G	89.1	Confident	95.5	Very high	5 Å²	5	24.3 Å²	24.3	5%	0.052	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	9.9	179.2	0	0	0	0	0	115.1	Y214 R217 Y309 L310 L311 A315 K546	Y214-G313 PolarHBondContact OH-O 3.4Å; R217-G313 PolarHBondContact NH2-O 3.09Å; Y309-G313 PolarHBondContact O-N 2.93Å; L310-G313 WeakPolarHBondContact O-CA 3.43Å; L310-G313 PolarHBondContact O-N 3.38Å; L311-G313 VanDerWaalsContact C-N 3.25Å; L311-G313 PolarHBondContact O-N 3.29Å; G313-A315 VanDerWaalsContact C-N 3.27Å; G313-A315 PolarHBondContact O-N 3.49Å; G313-A315 VanDerWaalsContact O-N 3.08Å; G313-K546 WeakPolarHBondContact CA-O 3.34Å
314	N	91.7	Very high	95.5	Very high	46 Å²	46	28.6 Å²	28.6	25%	0.246	16%	0.157	C	C	.	.			trans	-86.2	64.7	-178.1	-166.4	-5.2	0	0	0	111.6	Y309 I312 T316 A317 A318	Y309-N314 HydrophobicContact CD1-CB 4.39Å; Y309-N314 WeakPolarHBondContact O-CA 3.35Å; Y309-N314 PolarHBondContact O-N 2.93Å; I312-N314 VanDerWaalsContact C-N 3.31Å; I312-N314 HydrophobicContact CD1-CB 4.33Å; I312-N314 HydrophobicContact CG1-CB 3.98Å; I312-N314 PolarHBondContact O-N 3.29Å; N314-T316 PolarHBondContact O-N 3.11Å; N314-A317 HydrophobicContact CB-CB 4.4Å; N314-A317 VanDerWaalsContact CG-CB 3.49Å; N314-A317 WeakPolarHBondContact ND2-CB 3.2Å; N314-A317 PolarHBondContact O-N 2.87Å; N314-A317 VanDerWaalsContact O-N 3.15Å; N314-A317 WeakPolarHBondContact OD1-CB 3.49Å; N314-A317 PolarHBondContact OD1-N 3.21Å; N314-A318 PolarHBondContact O-N 2.72Å; N314-A318 VanDerWaalsContact O-N 3.08Å
315	A	90.4	Very high	95.5	Very high	15 Å²	15	28.6 Å²	28.6	12%	0.124	16%	0.157	C	C	.	.	H	α-helix	trans	-56	-35.4	179.6	0	0	0	0	0	113.2	G313 A317 A318 Q319 M346	G313-A315 VanDerWaalsContact C-N 3.27Å; G313-A315 PolarHBondContact O-N 3.49Å; G313-A315 VanDerWaalsContact O-N 3.08Å; A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 2.85Å; A315-A318 PolarHBondContact O-N 3.4Å; A315-Q319 PolarHBondContact O-N 2.95Å; A315-M346 HydrophobicContact CB-CG 3.79Å; A315-M346 HydrophobicContact CB-SD 3.93Å
316	T	92.9	Very high	95.5	Very high	120 Å²	120	27.9 Å²	27.9	74%	0.736	16%	0.156	S	C	*	.	H	α-helix	trans	-64.2	-37.3	179.4	-52.9	0	0	0	0	112.6	N314 P320	N314-T316 PolarHBondContact O-N 3.11Å; T316-P320 WeakPolarHBondContact O-CD 3.26Å
317	A	95.5	Very high	95.5	Very high	23 Å²	23	33.3 Å²	33.3	19%	0.19	19%	0.185	C	C	.	.	H	α-helix	trans	-79.5	-29.6	175	0	0	0	0	0	112.8	Y309 N314 A315 P320	Y309-A317 HydrophobicContact CD1-CB 3.84Å; Y309-A317 HydrophobicContact CD2-CB 3.81Å; Y309-A317 HydrophobicContact CE1-CB 3.94Å; Y309-A317 HydrophobicContact CE2-CB 3.89Å; Y309-A317 HydrophobicContact CG-CB 3.79Å; N314-A317 HydrophobicContact CB-CB 4.4Å; N314-A317 VanDerWaalsContact CG-CB 3.49Å; N314-A317 WeakPolarHBondContact ND2-CB 3.2Å; N314-A317 PolarHBondContact O-N 2.87Å; N314-A317 VanDerWaalsContact O-N 3.15Å; N314-A317 WeakPolarHBondContact OD1-CB 3.49Å; N314-A317 PolarHBondContact OD1-N 3.21Å; A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 2.85Å; A317-P320 WeakPolarHBondContact O-CD 3.44Å; A317-P320 WeakPolarHBondContact O-CG 3.48Å
318	A	97.2	Very high	95.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.1	-40	178	0	0	0	0	0	113.1	A306 L310 N314 A315 D321 L322	A306-A318 HydrophobicContact CB-CB 4.47Å; L310-A318 HydrophobicContact CD2-CB 3.68Å; L310-A318 HydrophobicContact CG-CB 3.72Å; N314-A318 PolarHBondContact O-N 2.72Å; N314-A318 VanDerWaalsContact O-N 3.08Å; A315-A318 PolarHBondContact O-N 3.4Å; A318-D321 PolarHBondContact O-N 2.87Å; A318-L322 HydrophobicContact CB-CD1 4.45Å; A318-L322 WeakPolarHBondContact O-CG 3.33Å; A318-L322 PolarHBondContact O-N 3.16Å; A318-L322 VanDerWaalsContact O-N 3.08Å
319	Q	97.6	Very high	95.2	Very high	63 Å²	63	41.4 Å²	41.4	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-53.2	-51.3	-173.3	-175.8	171.5	-16.7	0	0	115	A315 D321 L322 D323 M346	A315-Q319 PolarHBondContact O-N 2.95Å; Q319-D321 VanDerWaalsContact C-N 3.3Å; Q319-D321 PolarHBondContact O-N 2.74Å; Q319-L322 PolarHBondContact O-N 3.22Å; Q319-D323 WeakPolarHBondContact O-CB 3.35Å; Q319-D323 VanDerWaalsContact O-CG 3.29Å; Q319-D323 PolarHBondContact O-N 2.99Å; Q319-M346 HydrophobicContact CB-CE 4.02Å; Q319-M346 HydrophobicContact CB-SD 4.14Å; Q319-M346 HydrophobicContact CG-CE 4.01Å
320	P	98.4	Very high	94.9	Very high	71 Å²	71	46.8 Å²	46.8	46%	0.461	25%	0.25	S	C	.	.	H	α-helix	trans	-61.8	-36.5	-179.7	23.6	-34.8	0	0	0	113.1	T316 A317 D323 Q324	T316-P320 WeakPolarHBondContact O-CD 3.26Å; A317-P320 WeakPolarHBondContact O-CD 3.44Å; A317-P320 WeakPolarHBondContact O-CG 3.48Å; P320-D323 PolarHBondContact O-N 3.11Å; P320-Q324 WeakPolarHBondContact O-CB 3.39Å; P320-Q324 PolarHBondContact O-N 3.2Å
321	D	98.6	Very high	94.8	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-43.1	177.4	-73.6	-2.3	0	0	0	111	L302 R305 A306 A318 Q319 Q324 V325	L302-D321 HydrophobicContact CB-CB 4.47Å; L302-D321 HydrophobicContact CD2-CB 4.07Å; R305-D321 IonicContact CZ-OD1 2.73Å; R305-D321 IonicContact CZ-OD2 3.13Å; R305-D321 IonicContact NE-OD1 3.52Å; R305-D321 IonicContact NE-OD2 2.62Å; R305-D321 PolarHBondContact NE-OD2 3.3Å; R305-D321 VanDerWaalsContact NH2-CG 3.34Å; R305-D321 IonicContact NH2-OD1 3.11Å; R305-D321 PolarHBondContact NH2-OD1 3.31Å; R305-D321 IonicContact NH2-OD2 3.63Å; R305-D321 PolarHBondContact NH2-OD2 3.43Å; A306-D321 HydrophobicContact CB-CB 3.79Å; A318-D321 PolarHBondContact O-N 2.87Å; Q319-D321 VanDerWaalsContact C-N 3.3Å; Q319-D321 PolarHBondContact O-N 2.74Å; D321-Q324 PolarHBondContact O-N 2.73Å; D321-V325 WeakPolarHBondContact O-CG2 3.5Å; D321-V325 PolarHBondContact O-N 2.94Å; D321-V325 VanDerWaalsContact O-N 3.07Å
322	L	98.5	Very high	94.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-47.2	175.7	-64.6	170.3	0	0	0	111.3	L303 A306 L310 A318 Q319 Q324 V325 I326 A339 K342 R343 M346	L303-L322 HydrophobicContact CD1-CD2 4.03Å; A306-L322 HydrophobicContact CB-CD2 3.66Å; A306-L322 HydrophobicContact CB-CG 3.8Å; L310-L322 HydrophobicContact CD1-CD1 4.34Å; A318-L322 HydrophobicContact CB-CD1 4.45Å; A318-L322 WeakPolarHBondContact O-CG 3.33Å; A318-L322 PolarHBondContact O-N 3.16Å; A318-L322 VanDerWaalsContact O-N 3.08Å; Q319-L322 PolarHBondContact O-N 3.22Å; L322-Q324 VanDerWaalsContact C-N 3.26Å; L322-Q324 PolarHBondContact O-N 3.49Å; L322-V325 PolarHBondContact O-N 3.17Å; L322-I326 WeakPolarHBondContact O-CD1 3.28Å; L322-I326 WeakPolarHBondContact O-CG1 3.49Å; L322-I326 PolarHBondContact O-N 3.43Å; L322-A339 HydrophobicContact CD2-CB 4.23Å; L322-K342 HydrophobicContact CD1-CB 4.43Å; L322-K342 HydrophobicContact CD2-CB 3.89Å; L322-R343 HydrophobicContact CB-CB 4.4Å; L322-R343 HydrophobicContact CD1-CB 3.96Å; L322-R343 HydrophobicContact CD1-CG 4.35Å; L322-M346 HydrophobicContact CD1-SD 4.5Å
323	D	98.4	Very high	95	Very high	41 Å²	41	51 Å²	51	22%	0.219	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-38.8	178.9	-71.4	-20.5	0	0	0	111.2	Q319 P320 N327 R343	Q319-D323 WeakPolarHBondContact O-CB 3.35Å; Q319-D323 VanDerWaalsContact O-CG 3.29Å; Q319-D323 PolarHBondContact O-N 2.99Å; P320-D323 PolarHBondContact O-N 3.11Å; D323-N327 PolarHBondContact O-N 3.44Å; D323-N327 PolarHBondContact O-ND2 2.91Å; D323-R343 VanDerWaalsContact OD1-CD 3.22Å; D323-R343 WeakPolarHBondContact OD1-CD 3.43Å; D323-R343 IonicContact OD1-CZ 3.59Å; D323-R343 IonicContact OD1-NE 3.28Å; D323-R343 IonicContact OD1-NH1 2.6Å; D323-R343 PolarHBondContact OD1-NH1 3.17Å
324	Q	98.1	Very high	95.2	Very high	90 Å²	90	53.7 Å²	53.7	42%	0.421	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-50.3	176.1	-172.3	172	-9.8	0	0	111.4	L302 P320 D321 L322 I326 N327 M328	L302-Q324 HydrophobicContact CD1-CB 4.18Å; L302-Q324 HydrophobicContact CD1-CG 3.74Å; P320-Q324 WeakPolarHBondContact O-CB 3.39Å; P320-Q324 PolarHBondContact O-N 3.2Å; D321-Q324 PolarHBondContact O-N 2.73Å; L322-Q324 VanDerWaalsContact C-N 3.26Å; L322-Q324 PolarHBondContact O-N 3.49Å; Q324-I326 VanDerWaalsContact C-N 3.3Å; Q324-I326 PolarHBondContact O-N 2.84Å; Q324-N327 PolarHBondContact O-N 3.26Å; Q324-N327 VanDerWaalsContact O-N 3.11Å; Q324-M328 HydrophobicContact CG-SD 4.28Å; Q324-M328 VanDerWaalsContact O-CG 3.31Å; Q324-M328 WeakPolarHBondContact O-CG 3.23Å; Q324-M328 PolarHBondContact O-N 2.99Å; Q324-M328 VanDerWaalsContact O-N 3.16Å
325	V	97.7	Very high	95.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.5	-43.5	179.3	173.6	0	0	0	0	111.5	L302 L303 D321 L322 N327 M328 L335 R336 A339	L302-V325 HydrophobicContact CB-CG2 3.41Å; L302-V325 VanDerWaalsContact CB-CG2 3.41Å; L302-V325 HydrophobicContact CD1-CG2 4.1Å; L302-V325 HydrophobicContact CG-CG2 4.39Å; L303-V325 HydrophobicContact CB-CG2 4.23Å; D321-V325 WeakPolarHBondContact O-CG2 3.5Å; D321-V325 PolarHBondContact O-N 2.94Å; D321-V325 VanDerWaalsContact O-N 3.07Å; L322-V325 PolarHBondContact O-N 3.17Å; V325-N327 PolarHBondContact O-N 3.19Å; V325-M328 PolarHBondContact O-N 3.49Å; V325-L335 HydrophobicContact CG1-CB 4.3Å; V325-R336 WeakPolarHBondContact O-CG 3.47Å; V325-A339 HydrophobicContact CB-CB 4.09Å; V325-A339 HydrophobicContact CG1-CB 3.76Å
326	I	97.8	Very high	95.6	Very high	16 Å²	16	52.6 Å²	52.6	8%	0.082	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-34.9	-179.5	-67.6	165.2	0	0	0	111.6	L322 Q324 A339 L340 R343	L322-I326 WeakPolarHBondContact O-CD1 3.28Å; L322-I326 WeakPolarHBondContact O-CG1 3.49Å; L322-I326 PolarHBondContact O-N 3.43Å; Q324-I326 VanDerWaalsContact C-N 3.3Å; Q324-I326 PolarHBondContact O-N 2.84Å; I326-A339 HydrophobicContact CD1-CB 4.22Å; I326-A339 HydrophobicContact CG1-CB 3.71Å; I326-L340 HydrophobicContact CD1-CD2 3.7Å; I326-L340 HydrophobicContact CD1-CG 3.96Å; I326-L340 HydrophobicContact CG1-CD2 4.19Å; I326-L340 HydrophobicContact CG1-CG 4.04Å; I326-L340 HydrophobicContact CG2-CD2 4.24Å; I326-R343 HydrophobicContact CD1-CB 4.47Å
327	N	97.2	Very high	95.8	Very high	113 Å²	113	46.9 Å²	46.9	60%	0.604	24%	0.24	S	C	*	.	H	α-helix	trans	-86.2	-12.1	-177.6	-71.3	-48.3	0	0	0	114.3	D323 Q324 V325 Q329	D323-N327 PolarHBondContact O-N 3.44Å; D323-N327 PolarHBondContact O-ND2 2.91Å; Q324-N327 PolarHBondContact O-N 3.26Å; Q324-N327 VanDerWaalsContact O-N 3.11Å; V325-N327 PolarHBondContact O-N 3.19Å; N327-Q329 PolarHBondContact O-N 2.95Å; N327-Q329 VanDerWaalsContact O-N 3.15Å
328	M	95.4	Very high	95.8	Very high	33 Å²	33	46 Å²	46	16%	0.163	23%	0.232	C	C	.	.			trans	-76.5	95.4	176.5	-70.3	172.9	79.6	0	0	110.8	A299 L302 Q324 V325 E330 A331 R336	A299-M328 HydrophobicContact CB-CE 4Å; A299-M328 HydrophobicContact CB-SD 4.17Å; L302-M328 HydrophobicContact CD1-SD 3.91Å; Q324-M328 HydrophobicContact CG-SD 4.28Å; Q324-M328 VanDerWaalsContact O-CG 3.31Å; Q324-M328 WeakPolarHBondContact O-CG 3.23Å; Q324-M328 PolarHBondContact O-N 2.99Å; Q324-M328 VanDerWaalsContact O-N 3.16Å; V325-M328 PolarHBondContact O-N 3.49Å; M328-E330 VanDerWaalsContact C-N 3.25Å; M328-E330 PolarHBondContact O-N 3.42Å; M328-A331 HydrophobicContact CB-CB 3.73Å; M328-A331 VanDerWaalsContact O-CB 3.27Å; M328-A331 WeakPolarHBondContact O-CB 3.46Å; M328-A331 PolarHBondContact O-N 3.41Å; M328-R336 WeakPolarHBondContact O-CD 2.74Å
329	Q	91.4	Very high	95.8	Very high	137 Å²	137	46 Å²	46	64%	0.64	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.5	-175.1	-64.7	-60.8	-31.7	0	0	113	N327 A331	N327-Q329 PolarHBondContact O-N 2.95Å; N327-Q329 VanDerWaalsContact O-N 3.15Å; Q329-A331 VanDerWaalsContact C-N 3.29Å
330	E	89.7	Confident	95.9	Very high	154 Å²	154	43 Å²	43	72%	0.72	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.9	175.2	66.8	-76.9	176.4	0	0	113.8	M328	M328-E330 VanDerWaalsContact C-N 3.25Å; M328-E330 PolarHBondContact O-N 3.42Å
331	A	91.7	Very high	95.8	Very high	10 Å²	10	39.6 Å²	39.6	8%	0.083	20%	0.196	C	C	.	.	S	Bend	trans	-69.5	146.9	177.6	0	0	0	0	0	111.2	A299 M328 Q329 V333 R336	A299-A331 HydrophobicContact CB-CB 3.98Å; M328-A331 HydrophobicContact CB-CB 3.73Å; M328-A331 VanDerWaalsContact O-CB 3.27Å; M328-A331 WeakPolarHBondContact O-CB 3.46Å; M328-A331 PolarHBondContact O-N 3.41Å; Q329-A331 VanDerWaalsContact C-N 3.29Å; A331-V333 PolarHBondContact O-N 2.97Å; A331-R336 HydrophobicContact CB-CG 4.36Å; A331-R336 PolarHBondContact O-NE 3.03Å
332	N	92.4	Very high	95.6	Very high	77 Å²	77	39.3 Å²	39.3	41%	0.412	20%	0.195	S	C	.	.			trans	-51.9	133	178.3	-171.5	-49.3	0	0	0	110.6	I238 K334 L335 R336	I238-N332 HydrophobicContact CD1-CB 3.86Å; I238-N332 VanDerWaalsContact CD1-CG 3.43Å; I238-N332 WeakPolarHBondContact CD1-ND2 3.4Å; N332-K334 PolarHBondContact O-N 3.41Å; N332-K334 VanDerWaalsContact O-N 3.16Å; N332-K334 WeakPolarHBondContact OD1-CB 3.14Å; N332-K334 PolarHBondContact OD1-N 3.47Å; N332-L335 HydrophobicContact CB-CD1 4Å; N332-L335 HydrophobicContact CB-CG 4.1Å; N332-L335 WeakPolarHBondContact O-CB 3.47Å; N332-L335 PolarHBondContact O-N 3.44Å; N332-R336 PolarHBondContact O-N 3.22Å
333	V	94.4	Very high	95.6	Very high	50 Å²	50	40.7 Å²	40.7	30%	0.303	20%	0.2	S	C	.	.	H	α-helix	trans	-54.8	-35.6	-177.6	71.2	0	0	0	0	112.6	A331 R336 A337 I366 D367	A331-V333 PolarHBondContact O-N 2.97Å; V333-R336 PolarHBondContact O-N 3.41Å; V333-A337 PolarHBondContact O-N 3.28Å; V333-I366 HydrophobicContact CG2-CG2 3.4Å; V333-I366 VanDerWaalsContact CG2-O 3.28Å; V333-I366 WeakPolarHBondContact CG2-O 3.31Å; V333-D367 HydrophobicContact CG2-CB 4.26Å
334	K	94.4	Very high	95.4	Very high	61 Å²	61	38.8 Å²	38.8	27%	0.265	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-38.7	177.7	-61	-171.4	177.4	-165.8	0	112.3	D236 I238 N332 R336 A337 N338	D236-K334 IonicContact OD1-NZ 3.47Å; D236-K334 PolarHBondContact OD1-NZ 3.04Å; D236-K334 VanDerWaalsContact OD2-CE 3.29Å; D236-K334 WeakPolarHBondContact OD2-CE 3.47Å; D236-K334 IonicContact OD2-NZ 3.51Å; D236-K334 PolarHBondContact OD2-NZ 3.08Å; I238-K334 HydrophobicContact CD1-CB 3.95Å; N332-K334 PolarHBondContact O-N 3.41Å; N332-K334 VanDerWaalsContact O-N 3.16Å; N332-K334 WeakPolarHBondContact OD1-CB 3.14Å; N332-K334 PolarHBondContact OD1-N 3.47Å; K334-R336 VanDerWaalsContact C-N 3.35Å; K334-A337 PolarHBondContact O-N 3.26Å; K334-N338 WeakPolarHBondContact O-CB 3.08Å; K334-N338 PolarHBondContact O-N 3.26Å
335	L	94.8	Very high	95.1	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-42.5	175.2	-64.5	172.3	0	0	0	110.7	I238 A299 E300 L303 V325 N332 N338 A339	I238-L335 HydrophobicContact CB-CD2 4.1Å; I238-L335 HydrophobicContact CD1-CD1 4.42Å; I238-L335 HydrophobicContact CD1-CD2 3.93Å; I238-L335 HydrophobicContact CD1-CG 3.72Å; A299-L335 HydrophobicContact CB-CD1 4.07Å; E300-L335 HydrophobicContact CG-CD1 3.85Å; E300-L335 HydrophobicContact CG-CD2 4.22Å; L303-L335 HydrophobicContact CD2-CB 4.16Å; L303-L335 HydrophobicContact CD2-CD2 3.61Å; V325-L335 HydrophobicContact CG1-CB 4.3Å; N332-L335 HydrophobicContact CB-CD1 4Å; N332-L335 HydrophobicContact CB-CG 4.1Å; N332-L335 WeakPolarHBondContact O-CB 3.47Å; N332-L335 PolarHBondContact O-N 3.44Å; L335-N338 PolarHBondContact O-N 3.42Å; L335-A339 WeakPolarHBondContact O-CB 3.37Å; L335-A339 PolarHBondContact O-N 2.94Å
336	R	96.5	Very high	94.8	Very high	37 Å²	37	36.9 Å²	36.9	14%	0.14	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-44.4	178.4	-70.5	-171.8	-76.4	127.2	-1.8	112.2	V325 M328 A331 N332 V333 K334 N338 A339 L340	V325-R336 WeakPolarHBondContact O-CG 3.47Å; M328-R336 WeakPolarHBondContact O-CD 2.74Å; A331-R336 HydrophobicContact CB-CG 4.36Å; A331-R336 PolarHBondContact O-NE 3.03Å; N332-R336 PolarHBondContact O-N 3.22Å; V333-R336 PolarHBondContact O-N 3.41Å; K334-R336 VanDerWaalsContact C-N 3.35Å; R336-N338 VanDerWaalsContact C-N 3.34Å; R336-A339 PolarHBondContact O-N 3.36Å; R336-L340 WeakPolarHBondContact O-CG 3.4Å; R336-L340 PolarHBondContact O-N 3.26Å
337	A	96.3	Very high	94.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-43.5	174.2	0	0	0	0	0	111.5	V333 K334 L340 I341 D367 V373	V333-A337 PolarHBondContact O-N 3.28Å; K334-A337 PolarHBondContact O-N 3.26Å; A337-L340 WeakPolarHBondContact O-CB 3.36Å; A337-L340 PolarHBondContact O-N 3.29Å; A337-I341 WeakPolarHBondContact O-CG1 3.41Å; A337-I341 PolarHBondContact O-N 3.24Å; A337-D367 HydrophobicContact CB-CB 3.67Å; A337-V373 HydrophobicContact CB-CG2 4.14Å
338	N	95.8	Very high	93.9	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-41.1	177.3	-172.1	-67.5	0	0	0	112.5	F234 L303 K334 L335 R336 L340 I341 K342	F234-N338 VanDerWaalsContact CD1-ND2 3.33Å; F234-N338 WeakPolarHBondContact CD1-ND2 3.26Å; L303-N338 HydrophobicContact CD2-CB 4.02Å; K334-N338 WeakPolarHBondContact O-CB 3.08Å; K334-N338 PolarHBondContact O-N 3.26Å; L335-N338 PolarHBondContact O-N 3.42Å; R336-N338 VanDerWaalsContact C-N 3.34Å; N338-L340 VanDerWaalsContact C-N 3.32Å; N338-L340 PolarHBondContact O-N 2.93Å; N338-I341 WeakPolarHBondContact O-CB 3.46Å; N338-I341 PolarHBondContact O-N 2.99Å; N338-K342 WeakPolarHBondContact O-CG 3.23Å; N338-K342 PolarHBondContact O-N 2.74Å; N338-K342 WeakPolarHBondContact OD1-CE 3.5Å
339	A	97.5	Very high	93.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-41.5	173	0	0	0	0	0	112	L303 L322 V325 I326 L335 R336 K342 R343	L303-A339 HydrophobicContact CD1-CB 3.84Å; L322-A339 HydrophobicContact CD2-CB 4.23Å; V325-A339 HydrophobicContact CB-CB 4.09Å; V325-A339 HydrophobicContact CG1-CB 3.76Å; I326-A339 HydrophobicContact CD1-CB 4.22Å; I326-A339 HydrophobicContact CG1-CB 3.71Å; L335-A339 WeakPolarHBondContact O-CB 3.37Å; L335-A339 PolarHBondContact O-N 2.94Å; R336-A339 PolarHBondContact O-N 3.36Å; A339-K342 PolarHBondContact O-N 2.83Å; A339-R343 WeakPolarHBondContact O-CB 3.16Å; A339-R343 PolarHBondContact O-N 3.32Å
340	L	98.3	Very high	93	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-41.4	174.6	-74.1	163.3	0	0	0	112.4	I326 R336 A337 N338 K342 R343 G344 D359 M362 A363 I366	I326-L340 HydrophobicContact CD1-CD2 3.7Å; I326-L340 HydrophobicContact CD1-CG 3.96Å; I326-L340 HydrophobicContact CG1-CD2 4.19Å; I326-L340 HydrophobicContact CG1-CG 4.04Å; I326-L340 HydrophobicContact CG2-CD2 4.24Å; R336-L340 WeakPolarHBondContact O-CG 3.4Å; R336-L340 PolarHBondContact O-N 3.26Å; A337-L340 WeakPolarHBondContact O-CB 3.36Å; A337-L340 PolarHBondContact O-N 3.29Å; N338-L340 VanDerWaalsContact C-N 3.32Å; N338-L340 PolarHBondContact O-N 2.93Å; L340-K342 VanDerWaalsContact C-N 3.3Å; L340-K342 PolarHBondContact O-N 3.2Å; L340-R343 PolarHBondContact O-N 3.35Å; L340-G344 PolarHBondContact O-N 3.15Å; L340-D359 HydrophobicContact CD2-CB 4.15Å; L340-M362 HydrophobicContact CD1-CB 3.95Å; L340-M362 HydrophobicContact CD2-CB 4.27Å; L340-M362 HydrophobicContact CD2-CE 4.23Å; L340-A363 HydrophobicContact CB-CB 3.79Å; L340-A363 HydrophobicContact CD1-CB 4.3Å; L340-I366 HydrophobicContact CD1-CD1 3.62Å
341	I	96	Very high	92.8	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-46.4	173.1	-67	167.1	0	0	0	110.4	F234 A337 N338 S345 F360 A363 D372 V373 H376	F234-I341 HydrophobicContact CE1-CG2 4.07Å; F234-I341 HydrophobicContact CZ-CG2 4.49Å; A337-I341 WeakPolarHBondContact O-CG1 3.41Å; A337-I341 PolarHBondContact O-N 3.24Å; N338-I341 WeakPolarHBondContact O-CB 3.46Å; N338-I341 PolarHBondContact O-N 2.99Å; I341-S345 WeakPolarHBondContact O-CB 3.39Å; I341-S345 PolarHBondContact O-N 3.37Å; I341-S345 PolarHBondContact O-OG 2.84Å; I341-F360 HydrophobicContact CB-CE1 4.3Å; I341-F360 HydrophobicContact CG1-CE1 4.29Å; I341-F360 HydrophobicContact CG2-CE1 3.95Å; I341-F360 HydrophobicContact CG2-CZ 4.35Å; I341-A363 HydrophobicContact CG1-CB 4.39Å; I341-D372 HydrophobicContact CD1-CB 4.35Å; I341-V373 HydrophobicContact CD1-CB 4.32Å; I341-V373 HydrophobicContact CD1-CG2 3.83Å; I341-V373 HydrophobicContact CG1-CG2 4.35Å; I341-H376 HydrophobicContact CG2-CB 3.76Å
342	K	96	Very high	92.8	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-68.4	-42.5	-179	-71	-179.9	-163.9	-90.3	0	112.3	Y230 L303 T307 L310 L322 N338 A339 L340 S345 M346	Y230-K342 PolarHBondContact OH-NZ 2.69Å; L303-K342 HydrophobicContact CD1-CD 3.92Å; T307-K342 VanDerWaalsContact CG2-NZ 3.31Å; T307-K342 VanDerWaalsContact OG1-CD 3.28Å; T307-K342 WeakPolarHBondContact OG1-CD 3.49Å; T307-K342 WeakPolarHBondContact OG1-CE 3.4Å; T307-K342 PolarHBondContact OG1-NZ 3.22Å; L310-K342 HydrophobicContact CD1-CB 3.8Å; L310-K342 HydrophobicContact CD1-CG 4.36Å; L322-K342 HydrophobicContact CD1-CB 4.43Å; L322-K342 HydrophobicContact CD2-CB 3.89Å; N338-K342 WeakPolarHBondContact O-CG 3.23Å; N338-K342 PolarHBondContact O-N 2.74Å; N338-K342 WeakPolarHBondContact OD1-CE 3.5Å; A339-K342 PolarHBondContact O-N 2.83Å; L340-K342 VanDerWaalsContact C-N 3.3Å; L340-K342 PolarHBondContact O-N 3.2Å; K342-S345 PolarHBondContact O-N 2.97Å; K342-M346 WeakPolarHBondContact O-CB 3.41Å; K342-M346 PolarHBondContact O-N 2.95Å
343	R	97.9	Very high	92.6	Very high	29 Å²	29	34.8 Å²	34.8	11%	0.109	17%	0.172	C	C	.	.	H	α-helix	trans	-67.3	-40.3	176.6	-163.7	176.9	67.9	-176.8	-1	111.6	L322 D323 I326 A339 L340 S345 M346 Y347 D359	L322-R343 HydrophobicContact CB-CB 4.4Å; L322-R343 HydrophobicContact CD1-CB 3.96Å; L322-R343 HydrophobicContact CD1-CG 4.35Å; D323-R343 VanDerWaalsContact OD1-CD 3.22Å; D323-R343 WeakPolarHBondContact OD1-CD 3.43Å; D323-R343 IonicContact OD1-CZ 3.59Å; D323-R343 IonicContact OD1-NE 3.28Å; D323-R343 IonicContact OD1-NH1 2.6Å; D323-R343 PolarHBondContact OD1-NH1 3.17Å; I326-R343 HydrophobicContact CD1-CB 4.47Å; A339-R343 WeakPolarHBondContact O-CB 3.16Å; A339-R343 PolarHBondContact O-N 3.32Å; L340-R343 PolarHBondContact O-N 3.35Å; R343-S345 PolarHBondContact O-N 3.4Å; R343-M346 HydrophobicContact CG-CE 3.9Å; R343-M346 WeakPolarHBondContact O-CB 3.28Å; R343-M346 PolarHBondContact O-N 3.48Å; R343-Y347 HydrophobicContact CG-CD2 4.2Å; R343-Y347 HydrophobicContact CG-CE2 3.73Å; R343-Y347 WeakPolarHBondContact O-CD2 3.35Å; R343-Y347 PolarHBondContact O-N 2.94Å; R343-D359 WeakPolarHBondContact CB-OD2 3.49Å; R343-D359 WeakPolarHBondContact CG-OD2 3.28Å; R343-D359 IonicContact CZ-OD1 3.48Å; R343-D359 IonicContact CZ-OD2 2.7Å; R343-D359 IonicContact NE-OD1 3.5Å; R343-D359 PolarHBondContact NE-OD1 3Å; R343-D359 IonicContact NE-OD2 2.68Å; R343-D359 PolarHBondContact NE-OD2 2.97Å; R343-D359 IonicContact NH2-OD1 3.49Å; R343-D359 PolarHBondContact NH2-OD1 3.22Å; R343-D359 IonicContact NH2-OD2 2.8Å
344	G	94.5	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-44.5	172.5	0	0	0	0	0	112.3	L340 Y347 M348 S356 D359	L340-G344 PolarHBondContact O-N 3.15Å; G344-Y347 PolarHBondContact O-N 3.09Å; G344-M348 PolarHBondContact O-N 3.14Å; G344-M348 VanDerWaalsContact O-N 3.1Å; G344-S356 VanDerWaalsContact O-CB 3.26Å; G344-S356 WeakPolarHBondContact O-CB 3.27Å; G344-S356 PolarHBondContact O-OG 3.24Å; G344-D359 PolarHBondContact N-OD2 3.36Å
345	S	91.1	Very high	92.7	Very high	49 Å²	49	39.3 Å²	39.3	34%	0.343	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-41.4	175.5	-57.2	0	0	0	0	112	I341 K342 R343 M348 Q349	I341-S345 WeakPolarHBondContact O-CB 3.39Å; I341-S345 PolarHBondContact O-N 3.37Å; I341-S345 PolarHBondContact O-OG 2.84Å; K342-S345 PolarHBondContact O-N 2.97Å; R343-S345 PolarHBondContact O-N 3.4Å; S345-M348 WeakPolarHBondContact O-CB 3.31Å; S345-M348 PolarHBondContact O-N 2.76Å; S345-Q349 PolarHBondContact O-N 3.08Å; S345-Q349 VanDerWaalsContact O-N 3.16Å
346	M	91.4	Very high	92.6	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-44.4	174.3	-178.8	-168.2	73	0	0	111.9	L310 A315 Q319 L322 K342 R343 M348 Q349 Q350	L310-M346 HydrophobicContact CD2-CB 3.93Å; L310-M346 HydrophobicContact CD2-CG 3.9Å; L310-M346 HydrophobicContact CD2-SD 4.13Å; A315-M346 HydrophobicContact CB-CG 3.79Å; A315-M346 HydrophobicContact CB-SD 3.93Å; Q319-M346 HydrophobicContact CB-CE 4.02Å; Q319-M346 HydrophobicContact CB-SD 4.14Å; Q319-M346 HydrophobicContact CG-CE 4.01Å; L322-M346 HydrophobicContact CD1-SD 4.5Å; K342-M346 WeakPolarHBondContact O-CB 3.41Å; K342-M346 PolarHBondContact O-N 2.95Å; R343-M346 HydrophobicContact CG-CE 3.9Å; R343-M346 WeakPolarHBondContact O-CB 3.28Å; R343-M346 PolarHBondContact O-N 3.48Å; M346-M348 VanDerWaalsContact C-N 3.28Å; M346-M348 PolarHBondContact O-N 2.77Å; M346-Q349 WeakPolarHBondContact O-CB 3.39Å; M346-Q349 PolarHBondContact O-N 3.34Å; M346-Q350 WeakPolarHBondContact O-CG 3.27Å; M346-Q350 PolarHBondContact O-N 2.98Å; M346-Q350 VanDerWaalsContact O-N 3.11Å
347	Y	91.1	Very high	92.5	Very high	25 Å²	25	39.8 Å²	39.8	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-35	175.6	-75.8	-47.2	0	0	0	112.6	R343 G344 Q350 Q351 Q352 Q355 D359	R343-Y347 HydrophobicContact CG-CD2 4.2Å; R343-Y347 HydrophobicContact CG-CE2 3.73Å; R343-Y347 WeakPolarHBondContact O-CD2 3.35Å; R343-Y347 PolarHBondContact O-N 2.94Å; G344-Y347 PolarHBondContact O-N 3.09Å; Y347-Q350 CarbonylContact O-C 3.43Å; Y347-Q350 PolarHBondContact O-N 3.21Å; Y347-Q351 PolarHBondContact O-N 3.4Å; Y347-Q352 HydrophobicContact CD1-CB 4.36Å; Y347-Q352 PolarHBondContact O-N 2.96Å; Y347-Q355 HydrophobicContact CD1-CB 4.15Å; Y347-Q355 HydrophobicContact CD2-CB 3.63Å; Y347-Q355 HydrophobicContact CE1-CB 4.44Å; Y347-Q355 HydrophobicContact CE2-CB 3.92Å; Y347-Q355 HydrophobicContact CG-CB 3.76Å; Y347-D359 WeakPolarHBondContact CD2-OD2 3.33Å; Y347-D359 WeakPolarHBondContact CE2-OD2 3.48Å
348	M	86.1	Confident	92.6	Very high	42 Å²	42	45.4 Å²	45.4	21%	0.207	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-44.2	174.9	-173.2	58.8	-166.4	0	0	111.6	G344 S345 M346 Q350 Q351 L380 L384	G344-M348 PolarHBondContact O-N 3.14Å; G344-M348 VanDerWaalsContact O-N 3.1Å; S345-M348 WeakPolarHBondContact O-CB 3.31Å; S345-M348 PolarHBondContact O-N 2.76Å; M346-M348 VanDerWaalsContact C-N 3.28Å; M346-M348 PolarHBondContact O-N 2.77Å; M348-Q350 PolarHBondContact O-N 3.26Å; M348-Q351 PolarHBondContact O-N 3.46Å; M348-L380 HydrophobicContact CB-CD1 4.08Å; M348-L380 HydrophobicContact CG-CD1 3.64Å; M348-L380 HydrophobicContact SD-CD1 3.77Å; M348-L384 HydrophobicContact CE-CD2 3.71Å; M348-L384 HydrophobicContact SD-CD2 4.02Å
349	Q	82.6	Confident	92.7	Very high	101 Å²	101	45.5 Å²	45.5	47%	0.472	23%	0.229	S	C	.	.	H	α-helix	trans	-60.5	-31.2	174.3	-67.8	-178.6	-31.5	0	0	112.6	S345 M346 Q351	S345-Q349 PolarHBondContact O-N 3.08Å; S345-Q349 VanDerWaalsContact O-N 3.16Å; M346-Q349 WeakPolarHBondContact O-CB 3.39Å; M346-Q349 PolarHBondContact O-N 3.34Å; Q349-Q351 PolarHBondContact O-N 3.49Å
350	Q	84.4	Confident	92.6	Very high	74 Å²	74	45.7 Å²	45.7	35%	0.346	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	7.9	175.9	-63.5	174	10.5	0	0	113.6	M346 Y347 M348 Q352	M346-Q350 WeakPolarHBondContact O-CG 3.27Å; M346-Q350 PolarHBondContact O-N 2.98Å; M346-Q350 VanDerWaalsContact O-N 3.11Å; Y347-Q350 CarbonylContact O-C 3.43Å; Y347-Q350 PolarHBondContact O-N 3.21Å; M348-Q350 PolarHBondContact O-N 3.26Å; Q350-Q352 VanDerWaalsContact C-N 3.27Å; Q350-Q352 HydrophobicContact CB-CG 4.5Å; Q350-Q352 PolarHBondContact O-N 2.96Å
351	Q	85.6	Confident	92.6	Very high	121 Å²	121	48.7 Å²	48.7	57%	0.565	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	35.6	-176.5	-54.7	-178.5	23.7	0	0	113.7	Y347 M348 Q349 P353 M549	Y347-Q351 PolarHBondContact O-N 3.4Å; M348-Q351 PolarHBondContact O-N 3.46Å; Q349-Q351 PolarHBondContact O-N 3.49Å; Q351-P353 WeakPolarHBondContact O-CD 3.38Å; Q351-M549 HydrophobicContact CG-CE 4.35Å; Q351-M549 HydrophobicContact CG-SD 4.07Å; Q351-M549 PolarHBondContact NE2-SD 2.87Å
352	Q	90.9	Very high	92.7	Very high	77 Å²	77	52.4 Å²	52.4	36%	0.36	26%	0.264	S	S	.	.			trans	-111.3	68.7	176.3	-67.5	178	94.9	0	0	110.4	Y347 Q350 L354 Q355 S356	Y347-Q352 HydrophobicContact CD1-CB 4.36Å; Y347-Q352 PolarHBondContact O-N 2.96Å; Q350-Q352 VanDerWaalsContact C-N 3.27Å; Q350-Q352 HydrophobicContact CB-CG 4.5Å; Q350-Q352 PolarHBondContact O-N 2.96Å; Q352-L354 VanDerWaalsContact C-N 3.29Å; Q352-L354 PolarHBondContact O-N 3.17Å; Q352-Q355 VanDerWaalsContact CB-OE1 3.29Å; Q352-Q355 PolarHBondContact O-N 3.14Å; Q352-S356 PolarHBondContact O-N 2.88Å; Q352-S356 VanDerWaalsContact O-N 3.09Å
353	P	88.9	Confident	92.7	Very high	56 Å²	56	52.3 Å²	52.3	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-31.4	-171.5	26.6	-35.9	0	0	0	113	Q351 S356 T357 L384	Q351-P353 WeakPolarHBondContact O-CD 3.38Å; P353-S356 WeakPolarHBondContact O-CB 3.21Å; P353-S356 PolarHBondContact O-N 2.79Å; P353-T357 WeakPolarHBondContact O-CB 3.49Å; P353-T357 PolarHBondContact O-N 3.36Å; P353-T357 PolarHBondContact O-OG1 3.47Å; P353-L384 HydrophobicContact CB-CD2 4.36Å
354	L	94.3	Very high	92.7	Very high	140 Å²	140	51.2 Å²	51.2	73%	0.733	26%	0.26	S	S	*	.	H	α-helix	trans	-64.7	-45.3	179.2	-67	176.5	0	0	0	112.2	Q352 Q358	Q352-L354 VanDerWaalsContact C-N 3.29Å; Q352-L354 PolarHBondContact O-N 3.17Å; L354-Q358 VanDerWaalsContact O-CG 3.27Å; L354-Q358 WeakPolarHBondContact O-CG 3.42Å; L354-Q358 PolarHBondContact O-N 3.39Å; L354-Q358 VanDerWaalsContact O-N 3.08Å
355	Q	96.1	Very high	92.8	Very high	66 Å²	66	57.5 Å²	57.5	31%	0.308	29%	0.294	S	S	.	.	H	α-helix	trans	-69	-38.7	176.6	-70.7	172.2	-43.7	0	0	111.2	Y347 Q352 T357 Q358 D359	Y347-Q355 HydrophobicContact CD1-CB 4.15Å; Y347-Q355 HydrophobicContact CD2-CB 3.63Å; Y347-Q355 HydrophobicContact CE1-CB 4.44Å; Y347-Q355 HydrophobicContact CE2-CB 3.92Å; Y347-Q355 HydrophobicContact CG-CB 3.76Å; Q352-Q355 VanDerWaalsContact CB-OE1 3.29Å; Q352-Q355 PolarHBondContact O-N 3.14Å; Q355-T357 PolarHBondContact O-N 2.94Å; Q355-Q358 PolarHBondContact O-N 3.39Å; Q355-D359 PolarHBondContact O-N 2.85Å
356	S	94.2	Very high	93	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-54.6	-54.2	173.4	-173.2	0	0	0	0	111.3	G344 Q352 P353 Q358 D359 F360 L380	G344-S356 VanDerWaalsContact O-CB 3.26Å; G344-S356 WeakPolarHBondContact O-CB 3.27Å; G344-S356 PolarHBondContact O-OG 3.24Å; Q352-S356 PolarHBondContact O-N 2.88Å; Q352-S356 VanDerWaalsContact O-N 3.09Å; P353-S356 WeakPolarHBondContact O-CB 3.21Å; P353-S356 PolarHBondContact O-N 2.79Å; S356-Q358 VanDerWaalsContact C-N 3.31Å; S356-Q358 PolarHBondContact O-N 3.13Å; S356-D359 PolarHBondContact O-N 2.93Å; S356-F360 VanDerWaalsContact O-CD2 3.25Å; S356-F360 WeakPolarHBondContact O-CD2 3.31Å; S356-F360 PolarHBondContact O-N 2.8Å; S356-L380 WeakPolarHBondContact OG-CD2 3.21Å
357	T	93.8	Very high	93.2	Very high	49 Å²	49	58.8 Å²	58.8	30%	0.301	30%	0.297	S	S	.	.	H	α-helix	trans	-61.1	-37.5	178.8	-59	0	0	0	0	112.6	P353 Q355 N361	P353-T357 WeakPolarHBondContact O-CB 3.49Å; P353-T357 PolarHBondContact O-N 3.36Å; P353-T357 PolarHBondContact O-OG1 3.47Å; Q355-T357 PolarHBondContact O-N 2.94Å; T357-N361 WeakPolarHBondContact O-CB 3.2Å; T357-N361 PolarHBondContact O-N 3.24Å; T357-N361 PolarHBondContact O-ND2 3.1Å
358	Q	97.4	Very high	93.4	Very high	117 Å²	117	60.9 Å²	60.9	55%	0.547	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-48.2	175.6	-75.8	169.1	0.7	0	0	111.7	L354 Q355 S356 F360 N361 M362	L354-Q358 VanDerWaalsContact O-CG 3.27Å; L354-Q358 WeakPolarHBondContact O-CG 3.42Å; L354-Q358 PolarHBondContact O-N 3.39Å; L354-Q358 VanDerWaalsContact O-N 3.08Å; Q355-Q358 PolarHBondContact O-N 3.39Å; S356-Q358 VanDerWaalsContact C-N 3.31Å; S356-Q358 PolarHBondContact O-N 3.13Å; Q358-F360 PolarHBondContact O-N 3.42Å; Q358-N361 PolarHBondContact O-N 3.06Å; Q358-M362 WeakPolarHBondContact O-CG 3.26Å; Q358-M362 PolarHBondContact O-N 3.13Å
359	D	98.1	Very high	93.9	Very high	6 Å²	6	68.3 Å²	68.3	3%	0.032	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-42.8	179.1	-82.2	-3.8	0	0	0	112.3	L340 R343 G344 Y347 Q355 S356 N361 M362 A363	L340-D359 HydrophobicContact CD2-CB 4.15Å; R343-D359 WeakPolarHBondContact CB-OD2 3.49Å; R343-D359 WeakPolarHBondContact CG-OD2 3.28Å; R343-D359 IonicContact CZ-OD1 3.48Å; R343-D359 IonicContact CZ-OD2 2.7Å; R343-D359 IonicContact NE-OD1 3.5Å; R343-D359 PolarHBondContact NE-OD1 3Å; R343-D359 IonicContact NE-OD2 2.68Å; R343-D359 PolarHBondContact NE-OD2 2.97Å; R343-D359 IonicContact NH2-OD1 3.49Å; R343-D359 PolarHBondContact NH2-OD1 3.22Å; R343-D359 IonicContact NH2-OD2 2.8Å; G344-D359 PolarHBondContact N-OD2 3.36Å; Y347-D359 WeakPolarHBondContact CD2-OD2 3.33Å; Y347-D359 WeakPolarHBondContact CE2-OD2 3.48Å; Q355-D359 PolarHBondContact O-N 2.85Å; S356-D359 PolarHBondContact O-N 2.93Å; D359-N361 VanDerWaalsContact C-N 3.3Å; D359-N361 PolarHBondContact O-N 3.39Å; D359-M362 PolarHBondContact O-N 3.4Å; D359-A363 WeakPolarHBondContact O-CB 3.43Å; D359-A363 PolarHBondContact O-N 3.33Å
360	F	96.8	Very high	94.4	Very high	3 Å²	3	63.6 Å²	63.6	1%	0.013	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-33.4	176.4	-85	-71.8	0	0	0	113.2	I341 S356 Q358 A364 H376 R377 L380	I341-F360 HydrophobicContact CB-CE1 4.3Å; I341-F360 HydrophobicContact CG1-CE1 4.29Å; I341-F360 HydrophobicContact CG2-CE1 3.95Å; I341-F360 HydrophobicContact CG2-CZ 4.35Å; S356-F360 VanDerWaalsContact O-CD2 3.25Å; S356-F360 WeakPolarHBondContact O-CD2 3.31Å; S356-F360 PolarHBondContact O-N 2.8Å; Q358-F360 PolarHBondContact O-N 3.42Å; F360-A364 PolarHBondContact O-N 3.29Å; F360-H376 HydrophobicContact CE1-CB 3.84Å; F360-H376 HydrophobicContact CZ-CB 4.42Å; F360-R377 HydrophobicContact CB-CB 4.36Å; F360-R377 HydrophobicContact CB-CG 3.86Å; F360-R377 HydrophobicContact CD1-CB 3.77Å; F360-R377 HydrophobicContact CD1-CG 4.18Å; F360-R377 HydrophobicContact CE1-CB 4.41Å; F360-R377 HydrophobicContact CG-CB 4.28Å; F360-R377 HydrophobicContact CG-CG 4.18Å; F360-L380 HydrophobicContact CD2-CD2 3.3Å; F360-L380 HydrophobicContact CE2-CB 4.26Å; F360-L380 HydrophobicContact CE2-CD2 3.49Å; F360-L380 VanDerWaalsContact CE2-CD2 3.49Å; F360-L380 HydrophobicContact CE2-CG 4.35Å; F360-L380 HydrophobicContact CG-CD2 4.18Å; F360-L380 HydrophobicContact CZ-CD2 4.45Å
361	N	97.1	Very high	94.9	Very high	64 Å²	64	60.6 Å²	60.6	34%	0.342	31%	0.306	S	S	.	.	H	α-helix	trans	-70.9	-45.3	173.5	-71.1	-18	0	0	0	111.3	T357 Q358 D359 A363 A364 D365 R377	T357-N361 WeakPolarHBondContact O-CB 3.2Å; T357-N361 PolarHBondContact O-N 3.24Å; T357-N361 PolarHBondContact O-ND2 3.1Å; Q358-N361 PolarHBondContact O-N 3.06Å; D359-N361 VanDerWaalsContact C-N 3.3Å; D359-N361 PolarHBondContact O-N 3.39Å; N361-A363 VanDerWaalsContact C-N 3.26Å; N361-A363 PolarHBondContact O-N 3.32Å; N361-A364 PolarHBondContact O-N 3.31Å; N361-A364 VanDerWaalsContact O-N 3.08Å; N361-D365 PolarHBondContact O-N 3.15Å; N361-R377 PolarHBondContact OD1-NH1 3.29Å
362	M	97.9	Very high	95.2	Very high	78 Å²	78	55 Å²	55	38%	0.384	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-37.9	174.7	-71.8	174.8	61	0	0	112.2	L340 Q358 D359 A364 D365 I366	L340-M362 HydrophobicContact CD1-CB 3.95Å; L340-M362 HydrophobicContact CD2-CB 4.27Å; L340-M362 HydrophobicContact CD2-CE 4.23Å; Q358-M362 WeakPolarHBondContact O-CG 3.26Å; Q358-M362 PolarHBondContact O-N 3.13Å; D359-M362 PolarHBondContact O-N 3.4Å; M362-A364 VanDerWaalsContact C-N 3.31Å; M362-A364 PolarHBondContact O-N 3.28Å; M362-D365 PolarHBondContact O-N 2.74Å; M362-I366 WeakPolarHBondContact O-CB 3.47Å; M362-I366 WeakPolarHBondContact O-CG1 3.39Å; M362-I366 PolarHBondContact O-N 3.03Å
363	A	97.6	Very high	95.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-42.4	176.1	0	0	0	0	0	111.4	L340 I341 D359 N361 I366 D367 V373	L340-A363 HydrophobicContact CB-CB 3.79Å; L340-A363 HydrophobicContact CD1-CB 4.3Å; I341-A363 HydrophobicContact CG1-CB 4.39Å; D359-A363 WeakPolarHBondContact O-CB 3.43Å; D359-A363 PolarHBondContact O-N 3.33Å; N361-A363 VanDerWaalsContact C-N 3.26Å; N361-A363 PolarHBondContact O-N 3.32Å; A363-I366 PolarHBondContact O-N 3.37Å; A363-D367 PolarHBondContact O-N 3.27Å; A363-V373 HydrophobicContact CB-CG1 3.87Å; A363-V373 HydrophobicContact CB-CG2 4.1Å
364	A	96.9	Very high	95.7	Very high	6 Å²	6	49.7 Å²	49.7	5%	0.05	25%	0.249	C	C	.	.	H	α-helix	trans	-71.4	-32.3	177.9	0	0	0	0	0	112.8	F360 N361 M362 S368 V373 Y374	F360-A364 PolarHBondContact O-N 3.29Å; N361-A364 PolarHBondContact O-N 3.31Å; N361-A364 VanDerWaalsContact O-N 3.08Å; M362-A364 VanDerWaalsContact C-N 3.31Å; M362-A364 PolarHBondContact O-N 3.28Å; A364-S368 WeakPolarHBondContact O-CA 3.41Å; A364-S368 WeakPolarHBondContact O-CB 3.46Å; A364-S368 PolarHBondContact O-N 3.02Å; A364-S368 VanDerWaalsContact O-N 3.14Å; A364-V373 HydrophobicContact CB-CG1 3.82Å; A364-Y374 HydrophobicContact CB-CE1 4.3Å
365	D	97	Very high	95.7	Very high	133 Å²	133	43.3 Å²	43.3	71%	0.711	22%	0.216	S	C	*	.	H	α-helix	trans	-69.7	-39.2	175.6	-67.4	-22.8	0	0	0	111.6	N361 M362	N361-D365 PolarHBondContact O-N 3.15Å; M362-D365 PolarHBondContact O-N 2.74Å
366	I	95.7	Very high	95.4	Very high	59 Å²	59	40.9 Å²	40.9	30%	0.303	20%	0.204	S	C	.	.	H	α-helix	trans	-76.1	-40.2	-178.8	-72.5	167.9	0	0	0	111.6	V333 L340 M362 A363	V333-I366 HydrophobicContact CG2-CG2 3.4Å; V333-I366 VanDerWaalsContact CG2-O 3.28Å; V333-I366 WeakPolarHBondContact CG2-O 3.31Å; L340-I366 HydrophobicContact CD1-CD1 3.62Å; M362-I366 WeakPolarHBondContact O-CB 3.47Å; M362-I366 WeakPolarHBondContact O-CG1 3.39Å; M362-I366 PolarHBondContact O-N 3.03Å; A363-I366 PolarHBondContact O-N 3.37Å
367	D	95.3	Very high	95.5	Very high	18 Å²	18	42.3 Å²	42.3	10%	0.096	21%	0.21	C	C	.	.			trans	-135.7	69.4	-177.9	-163.7	0.2	0	0	0	112.4	V333 A337 A363 R369 N370	V333-D367 HydrophobicContact CG2-CB 4.26Å; A337-D367 HydrophobicContact CB-CB 3.67Å; A363-D367 PolarHBondContact O-N 3.27Å; D367-R369 PolarHBondContact O-N 3.08Å; D367-N370 HydrophobicContact CB-CB 4.06Å; D367-N370 VanDerWaalsContact CG-CB 3.48Å; D367-N370 WeakPolarHBondContact O-CB 3.23Å; D367-N370 PolarHBondContact O-N 3.09Å; D367-N370 VanDerWaalsContact O-N 3.09Å; D367-N370 WeakPolarHBondContact OD2-CB 3.35Å; D367-N370 PolarHBondContact OD2-ND2 3.15Å; D367-N370 VanDerWaalsContact OD2-ND2 3.12Å
368	S	95.8	Very high	95.4	Very high	68 Å²	68	40 Å²	40	48%	0.476	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-6.3	-179.5	60.8	0	0	0	0	115.6	A364 Y374	A364-S368 WeakPolarHBondContact O-CA 3.41Å; A364-S368 WeakPolarHBondContact O-CB 3.46Å; A364-S368 PolarHBondContact O-N 3.02Å; A364-S368 VanDerWaalsContact O-N 3.14Å; S368-Y374 WeakPolarHBondContact CA-OH 3.42Å; S368-Y374 WeakPolarHBondContact O-CE2 3.25Å; S368-Y374 PolarHBondContact O-OH 3.07Å; S368-Y374 VanDerWaalsContact O-OH 3.09Å
369	R	94.8	Very high	94.9	Very high	198 Å²	198	35.8 Å²	35.8	75%	0.747	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	7.7	177.5	-72.1	-170.2	164.6	-177.7	-4	113.2	D367 P371 L400	D367-R369 PolarHBondContact O-N 3.08Å; R369-P371 WeakPolarHBondContact O-CD 3.4Å; R369-L400 HydrophobicContact CB-CD2 4.41Å
370	N	94.1	Very high	94.4	Very high	2 Å²	2	36 Å²	36	1%	0.011	18%	0.177	C	C	.	.			trans	-91.4	112.7	-179.1	-167.1	-42.3	0	0	0	111.7	D367 D372 V373 Y374	D367-N370 HydrophobicContact CB-CB 4.06Å; D367-N370 VanDerWaalsContact CG-CB 3.48Å; D367-N370 WeakPolarHBondContact O-CB 3.23Å; D367-N370 PolarHBondContact O-N 3.09Å; D367-N370 VanDerWaalsContact O-N 3.09Å; D367-N370 WeakPolarHBondContact OD2-CB 3.35Å; D367-N370 PolarHBondContact OD2-ND2 3.15Å; D367-N370 VanDerWaalsContact OD2-ND2 3.12Å; N370-D372 PolarHBondContact O-N 3.44Å; N370-D372 VanDerWaalsContact OD1-CB 3.28Å; N370-D372 WeakPolarHBondContact OD1-CB 3.29Å; N370-D372 PolarHBondContact OD1-N 3.22Å; N370-V373 HydrophobicContact CB-CB 4.48Å; N370-V373 HydrophobicContact CB-CG2 3.82Å; N370-V373 PolarHBondContact O-N 3.24Å; N370-Y374 WeakPolarHBondContact O-CD2 3.45Å
371	P	94.3	Very high	94.1	Very high	12 Å²	12	36.9 Å²	36.9	8%	0.078	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-27.2	-179.6	27	-34.6	0	0	0	113.1	D236 R369 V373 Y374 H375 C397 L400 R401	D236-P371 HydrophobicContact CB-CG 4.16Å; R369-P371 WeakPolarHBondContact O-CD 3.4Å; P371-V373 VanDerWaalsContact C-N 3.32Å; P371-V373 PolarHBondContact O-N 3.39Å; P371-Y374 PolarHBondContact O-N 3.22Å; P371-H375 VanDerWaalsContact O-CB 3.31Å; P371-H375 WeakPolarHBondContact O-CB 3.19Å; P371-H375 PolarHBondContact O-N 3.35Å; P371-C397 PolarHBondContact O-SG 3.02Å; P371-C397 VanDerWaalsContact O-SG 3.33Å; P371-L400 HydrophobicContact CB-CB 4.15Å; P371-R401 HydrophobicContact CB-CB 4.18Å
372	D	91.7	Very high	93.4	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-69.2	-33.1	-177.9	-60.6	-13.4	0	0	0	111.5	F234 T235 D236 I341 N370 H375 H376	F234-D372 WeakPolarHBondContact CA-OD2 3.33Å; T235-D372 WeakPolarHBondContact CB-OD1 3.4Å; T235-D372 PolarHBondContact N-OD1 3.03Å; T235-D372 PolarHBondContact N-OD2 3.22Å; T235-D372 PolarHBondContact OG1-OD1 3.4Å; D236-D372 PolarHBondContact N-OD1 3.08Å; D236-D372 PolarHBondContact N-OD2 3.26Å; I341-D372 HydrophobicContact CD1-CB 4.35Å; N370-D372 PolarHBondContact O-N 3.44Å; N370-D372 VanDerWaalsContact OD1-CB 3.28Å; N370-D372 WeakPolarHBondContact OD1-CB 3.29Å; N370-D372 PolarHBondContact OD1-N 3.22Å; D372-H375 PolarHBondContact O-N 3.16Å; D372-H376 PolarHBondContact O-N 3.27Å; D372-H376 PolarHBondContact O-ND1 3.08Å
373	V	95.2	Very high	92.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-53.2	176	173.8	0	0	0	0	110	A337 I341 A363 A364 N370 P371 R377	A337-V373 HydrophobicContact CB-CG2 4.14Å; I341-V373 HydrophobicContact CD1-CB 4.32Å; I341-V373 HydrophobicContact CD1-CG2 3.83Å; I341-V373 HydrophobicContact CG1-CG2 4.35Å; A363-V373 HydrophobicContact CB-CG1 3.87Å; A363-V373 HydrophobicContact CB-CG2 4.1Å; A364-V373 HydrophobicContact CB-CG1 3.82Å; N370-V373 HydrophobicContact CB-CB 4.48Å; N370-V373 HydrophobicContact CB-CG2 3.82Å; N370-V373 PolarHBondContact O-N 3.24Å; P371-V373 VanDerWaalsContact C-N 3.32Å; P371-V373 PolarHBondContact O-N 3.39Å; V373-R377 WeakPolarHBondContact O-CB 3.48Å; V373-R377 PolarHBondContact O-N 3.39Å
374	Y	96.8	Very high	91.8	Very high	22 Å²	22	35 Å²	35	9%	0.086	17%	0.172	C	C	.	.	H	α-helix	trans	-69.1	-37.9	-178.6	-58.8	-79.1	0	0	0	111.7	A364 S368 N370 P371 R377 G378 D393 E396 L400	A364-Y374 HydrophobicContact CB-CE1 4.3Å; S368-Y374 WeakPolarHBondContact CA-OH 3.42Å; S368-Y374 WeakPolarHBondContact O-CE2 3.25Å; S368-Y374 PolarHBondContact O-OH 3.07Å; S368-Y374 VanDerWaalsContact O-OH 3.09Å; N370-Y374 WeakPolarHBondContact O-CD2 3.45Å; P371-Y374 PolarHBondContact O-N 3.22Å; Y374-R377 PolarHBondContact O-N 3.31Å; Y374-G378 PolarHBondContact O-N 3.36Å; Y374-D393 WeakPolarHBondContact CB-O 3.35Å; Y374-D393 WeakPolarHBondContact O-CB 3.44Å; Y374-E396 HydrophobicContact CD1-CB 3.95Å; Y374-E396 HydrophobicContact CD1-CG 3.71Å; Y374-E396 HydrophobicContact CD2-CB 4.49Å; Y374-E396 HydrophobicContact CD2-CG 3.85Å; Y374-E396 HydrophobicContact CE1-CB 4.34Å; Y374-E396 HydrophobicContact CE1-CG 3.66Å; Y374-E396 HydrophobicContact CE2-CG 3.82Å; Y374-E396 HydrophobicContact CG-CB 4.04Å; Y374-E396 HydrophobicContact CG-CG 3.81Å; Y374-L400 HydrophobicContact CD2-CD1 3.71Å; Y374-L400 HydrophobicContact CE2-CD1 3.69Å
375	H	92.4	Very high	91.2	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-56.8	-55.2	174.7	175.7	-109.5	0	0	0	112.3	P371 D372 G378 Q379 L406 Q410	P371-H375 VanDerWaalsContact O-CB 3.31Å; P371-H375 WeakPolarHBondContact O-CB 3.19Å; P371-H375 PolarHBondContact O-N 3.35Å; D372-H375 PolarHBondContact O-N 3.16Å; H375-G378 PolarHBondContact O-N 3.1Å; H375-Q379 PolarHBondContact CE1-NE2 2.9Å; H375-Q379 PolarHBondContact NE2-NE2 3.15Å; H375-Q379 WeakPolarHBondContact O-CG 3.41Å; H375-Q379 PolarHBondContact O-N 3.39Å; H375-L406 VanDerWaalsContact NE2-CD2 3.34Å; H375-L406 WeakPolarHBondContact NE2-CD2 3.31Å; H375-Q410 PolarHBondContact CD2-OE1 3.5Å; H375-Q410 PolarHBondContact NE2-OE1 3.07Å
376	H	91.7	Very high	90.7	Very high	14 Å²	14	36.1 Å²	36.1	7%	0.065	17%	0.174	C	C	.	.	H	α-helix	trans	-72	-32.2	-177.8	-66	90.9	0	0	0	112.4	S233 F234 I341 F360 D372 Q379 L380	S233-H376 PolarHBondContact O-CE1 3.35Å; S233-H376 PolarHBondContact OG-NE2 2.96Å; S233-H376 VanDerWaalsContact OG-NE2 3.11Å; F234-H376 AromaticContact CD1-CE1 3.67Å; F234-H376 AromaticContact CE1-CE1 3.49Å; F234-H376 VanDerWaalsContact CE1-CE1 3.49Å; F234-H376 WeakPolarHBondContact CE1-CE1 3.4Å; F234-H376 AromaticContact CE1-NE2 3.75Å; F234-H376 AromaticContact CE2-NE2 3.86Å; F234-H376 AromaticContact CZ-CE1 3.79Å; F234-H376 AromaticContact CZ-NE2 3.54Å; I341-H376 HydrophobicContact CG2-CB 3.76Å; F360-H376 HydrophobicContact CE1-CB 3.84Å; F360-H376 HydrophobicContact CZ-CB 4.42Å; D372-H376 PolarHBondContact O-N 3.27Å; D372-H376 PolarHBondContact O-ND1 3.08Å; H376-Q379 PolarHBondContact O-N 3.41Å; H376-L380 PolarHBondContact O-N 3.15Å
377	R	94.8	Very high	90.4	Very high	31 Å²	31	34.1 Å²	34.1	12%	0.117	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-38.6	173.2	-167.7	171.6	72.2	-176.4	-2.7	111.9	F360 N361 V373 Y374 L380 K381 D393	F360-R377 HydrophobicContact CB-CB 4.36Å; F360-R377 HydrophobicContact CB-CG 3.86Å; F360-R377 HydrophobicContact CD1-CB 3.77Å; F360-R377 HydrophobicContact CD1-CG 4.18Å; F360-R377 HydrophobicContact CE1-CB 4.41Å; F360-R377 HydrophobicContact CG-CB 4.28Å; F360-R377 HydrophobicContact CG-CG 4.18Å; N361-R377 PolarHBondContact OD1-NH1 3.29Å; V373-R377 WeakPolarHBondContact O-CB 3.48Å; V373-R377 PolarHBondContact O-N 3.39Å; Y374-R377 PolarHBondContact O-N 3.31Å; R377-L380 PolarHBondContact O-N 2.66Å; R377-K381 HydrophobicContact CG-CD 4.37Å; R377-K381 WeakPolarHBondContact O-CB 3.37Å; R377-K381 WeakPolarHBondContact O-CG 3.39Å; R377-K381 PolarHBondContact O-N 3.36Å; R377-D393 VanDerWaalsContact CG-OD2 3.29Å; R377-D393 WeakPolarHBondContact CG-OD2 3.46Å; R377-D393 IonicContact CZ-OD1 3.86Å; R377-D393 IonicContact CZ-OD2 3.49Å; R377-D393 IonicContact NE-OD1 2.96Å; R377-D393 PolarHBondContact NE-OD1 3.41Å; R377-D393 IonicContact NE-OD2 2.58Å; R377-D393 PolarHBondContact NE-OD2 3Å; R377-D393 IonicContact NH2-OD1 2.6Å; R377-D393 PolarHBondContact NH2-OD1 3.24Å; R377-D393 IonicContact NH2-OD2 3.68Å
378	G	91.4	Very high	90.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-45.6	172.7	0	0	0	0	0	111.9	Y374 H375 K381 I382 A390	Y374-G378 PolarHBondContact O-N 3.36Å; H375-G378 PolarHBondContact O-N 3.1Å; G378-K381 PolarHBondContact O-N 3.22Å; G378-I382 PolarHBondContact O-N 3.47Å; G378-A390 WeakPolarHBondContact O-CB 3.4Å
379	Q	88	Confident	90	Very high	29 Å²	29	40.1 Å²	40.1	14%	0.136	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-48.6	173.6	-70	174.8	-14	0	0	112	H375 H376 K381 I382 L383 F394	H375-Q379 PolarHBondContact CE1-NE2 2.9Å; H375-Q379 PolarHBondContact NE2-NE2 3.15Å; H375-Q379 WeakPolarHBondContact O-CG 3.41Å; H375-Q379 PolarHBondContact O-N 3.39Å; H376-Q379 PolarHBondContact O-N 3.41Å; Q379-K381 VanDerWaalsContact C-N 3.3Å; Q379-K381 PolarHBondContact O-N 3.27Å; Q379-I382 WeakPolarHBondContact O-CB 3.44Å; Q379-I382 PolarHBondContact O-N 3.02Å; Q379-L383 WeakPolarHBondContact O-CG 3.27Å; Q379-L383 PolarHBondContact O-N 3.48Å; Q379-L383 VanDerWaalsContact O-N 3.17Å; Q379-F394 HydrophobicContact CG-CE1 4.39Å; Q379-F394 HydrophobicContact CG-CZ 4.21Å
380	L	87.4	Confident	89.9	Confident	10 Å²	10	30.7 Å²	30.7	5%	0.052	15%	0.153	C	C	.	.	H	α-helix	trans	-55	-47.2	175.3	172.9	67	0	0	0	111.4	M348 S356 F360 H376 R377 I382 L383 L384	M348-L380 HydrophobicContact CB-CD1 4.08Å; M348-L380 HydrophobicContact CG-CD1 3.64Å; M348-L380 HydrophobicContact SD-CD1 3.77Å; S356-L380 WeakPolarHBondContact OG-CD2 3.21Å; F360-L380 HydrophobicContact CD2-CD2 3.3Å; F360-L380 HydrophobicContact CE2-CB 4.26Å; F360-L380 HydrophobicContact CE2-CD2 3.49Å; F360-L380 VanDerWaalsContact CE2-CD2 3.49Å; F360-L380 HydrophobicContact CE2-CG 4.35Å; F360-L380 HydrophobicContact CG-CD2 4.18Å; F360-L380 HydrophobicContact CZ-CD2 4.45Å; H376-L380 PolarHBondContact O-N 3.15Å; R377-L380 PolarHBondContact O-N 2.66Å; L380-I382 VanDerWaalsContact C-N 3.32Å; L380-I382 PolarHBondContact O-N 3.26Å; L380-L383 WeakPolarHBondContact O-CA 3.28Å; L380-L383 WeakPolarHBondContact O-CB 3.41Å; L380-L383 PolarHBondContact O-N 3.25Å; L380-L384 HydrophobicContact CD1-CD1 4.1Å; L380-L384 HydrophobicContact CD1-CG 4.2Å; L380-L384 HydrophobicContact CD2-CD1 4.36Å; L380-L384 HydrophobicContact CG-CD1 3.95Å; L380-L384 HydrophobicContact CG-CG 4.38Å; L380-L384 WeakPolarHBondContact O-CG 3.46Å; L380-L384 PolarHBondContact O-N 3.48Å
381	K	89.3	Confident	89.9	Confident	22 Å²	22	31.5 Å²	31.5	10%	0.096	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-33.5	-178.7	-77.9	169.3	168.1	176.5	0	112.8	R377 G378 Q379 L383 L384 D385 Q386 E389 A390 D393	R377-K381 HydrophobicContact CG-CD 4.37Å; R377-K381 WeakPolarHBondContact O-CB 3.37Å; R377-K381 WeakPolarHBondContact O-CG 3.39Å; R377-K381 PolarHBondContact O-N 3.36Å; G378-K381 PolarHBondContact O-N 3.22Å; Q379-K381 VanDerWaalsContact C-N 3.3Å; Q379-K381 PolarHBondContact O-N 3.27Å; K381-L383 VanDerWaalsContact C-N 3.34Å; K381-L384 CarbonylContact O-C 3.5Å; K381-L384 PolarHBondContact O-N 3.23Å; K381-D385 PolarHBondContact O-N 3.37Å; K381-D385 VanDerWaalsContact O-N 3.16Å; K381-Q386 HydrophobicContact CB-CB 4.1Å; K381-Q386 HydrophobicContact CG-CB 4.33Å; K381-Q386 PolarHBondContact O-N 2.82Å; K381-E389 HydrophobicContact CD-CB 3.62Å; K381-E389 WeakPolarHBondContact CE-OE2 3.47Å; K381-E389 HydrophobicContact CG-CB 4.46Å; K381-E389 PolarHBondContact NZ-O 3.02Å; K381-E389 IonicContact NZ-OE2 2.91Å; K381-A390 HydrophobicContact CB-CB 3.71Å; K381-D393 WeakPolarHBondContact CD-OD2 3.26Å; K381-D393 WeakPolarHBondContact CE-OD2 3.41Å; K381-D393 IonicContact NZ-OD1 2.72Å; K381-D393 IonicContact NZ-OD2 3.27Å; K381-D393 PolarHBondContact NZ-OD2 3.06Å
382	I	83.8	Confident	90	Very high	18 Å²	18	32.8 Å²	32.8	9%	0.092	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-47.7	168.1	-69.7	179.2	0	0	0	110.3	G378 Q379 L380 L384 D385 A390 F394 A414	G378-I382 PolarHBondContact O-N 3.47Å; Q379-I382 WeakPolarHBondContact O-CB 3.44Å; Q379-I382 PolarHBondContact O-N 3.02Å; L380-I382 VanDerWaalsContact C-N 3.32Å; L380-I382 PolarHBondContact O-N 3.26Å; I382-L384 PolarHBondContact O-N 3.42Å; I382-D385 PolarHBondContact O-N 3.16Å; I382-A390 HydrophobicContact CG1-CB 3.79Å; I382-F394 HydrophobicContact CD1-CE2 3.64Å; I382-F394 HydrophobicContact CD1-CZ 3.95Å; I382-F394 HydrophobicContact CG1-CE2 4.19Å; I382-A414 HydrophobicContact CD1-CB 4Å; I382-A414 HydrophobicContact CG1-CB 4.39Å
383	L	78.3	Confident	90.2	Very high	34 Å²	34	33 Å²	33	18%	0.178	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-30.2	-179.8	-56.6	175.7	0	0	0	112.3	L20 L23 Q379 L380 K381 D385	L20-L383 VanDerWaalsContact O-CD2 3.25Å; L20-L383 WeakPolarHBondContact O-CD2 3.31Å; L23-L383 HydrophobicContact CB-CD2 3.82Å; Q379-L383 WeakPolarHBondContact O-CG 3.27Å; Q379-L383 PolarHBondContact O-N 3.48Å; Q379-L383 VanDerWaalsContact O-N 3.17Å; L380-L383 WeakPolarHBondContact O-CA 3.28Å; L380-L383 WeakPolarHBondContact O-CB 3.41Å; L380-L383 PolarHBondContact O-N 3.25Å; K381-L383 VanDerWaalsContact C-N 3.34Å; L383-D385 VanDerWaalsContact C-N 3.3Å
384	L	83.7	Confident	90.3	Very high	51 Å²	51	33 Å²	33	27%	0.267	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.1	175.6	-62.7	178.3	0	0	0	113.8	M348 P353 L380 K381 I382 Q386	M348-L384 HydrophobicContact CE-CD2 3.71Å; M348-L384 HydrophobicContact SD-CD2 4.02Å; P353-L384 HydrophobicContact CB-CD2 4.36Å; L380-L384 HydrophobicContact CD1-CD1 4.1Å; L380-L384 HydrophobicContact CD1-CG 4.2Å; L380-L384 HydrophobicContact CD2-CD1 4.36Å; L380-L384 HydrophobicContact CG-CD1 3.95Å; L380-L384 HydrophobicContact CG-CG 4.38Å; L380-L384 WeakPolarHBondContact O-CG 3.46Å; L380-L384 PolarHBondContact O-N 3.48Å; K381-L384 CarbonylContact O-C 3.5Å; K381-L384 PolarHBondContact O-N 3.23Å; I382-L384 PolarHBondContact O-N 3.42Å; L384-Q386 HydrophobicContact CB-CG 4.13Å; L384-Q386 PolarHBondContact O-N 3.3Å
385	D	83.2	Confident	90.3	Very high	96 Å²	96	35.1 Å²	35.1	51%	0.513	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	22.6	-176.3	-157.9	40.1	0	0	0	113.7	L20 K381 I382 L383 V387	L20-D385 HydrophobicContact CD1-CB 4.42Å; K381-D385 PolarHBondContact O-N 3.37Å; K381-D385 VanDerWaalsContact O-N 3.16Å; I382-D385 PolarHBondContact O-N 3.16Å; L383-D385 VanDerWaalsContact C-N 3.3Å; D385-V387 VanDerWaalsContact C-N 3.3Å; D385-V387 PolarHBondContact O-N 2.98Å
386	Q	88	Confident	90.5	Very high	65 Å²	65	37.2 Å²	37.2	30%	0.304	20%	0.197	S	C	.	.			trans	-92	59.4	175.5	-61.9	179.3	-78.4	0	0	110.3	K381 L384 D388 E389 A390	K381-Q386 HydrophobicContact CB-CB 4.1Å; K381-Q386 HydrophobicContact CG-CB 4.33Å; K381-Q386 PolarHBondContact O-N 2.82Å; L384-Q386 HydrophobicContact CB-CG 4.13Å; L384-Q386 PolarHBondContact O-N 3.3Å; Q386-D388 PolarHBondContact O-N 3.28Å; Q386-E389 HydrophobicContact CB-CB 4.4Å; Q386-E389 PolarHBondContact NE2-OE1 3.48Å; Q386-E389 PolarHBondContact O-N 3.2Å; Q386-A390 PolarHBondContact O-N 3.48Å
387	V	87.8	Confident	90.7	Very high	17 Å²	17	36.7 Å²	36.7	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-39.2	-166.1	-171.5	0	0	0	0	113.1	D385 E389 A390 V391 A414 Q418	D385-V387 VanDerWaalsContact C-N 3.3Å; D385-V387 PolarHBondContact O-N 2.98Å; V387-E389 VanDerWaalsContact C-N 3.34Å; V387-E389 PolarHBondContact O-N 3.28Å; V387-A390 WeakPolarHBondContact O-CB 3.49Å; V387-A390 PolarHBondContact O-N 3.16Å; V387-A390 VanDerWaalsContact O-N 3.16Å; V387-V391 HydrophobicContact CG1-CG2 4.46Å; V387-V391 WeakPolarHBondContact O-CG2 3.4Å; V387-V391 PolarHBondContact O-N 3.02Å; V387-A414 HydrophobicContact CG1-CB 4.2Å; V387-A414 VanDerWaalsContact CG1-O 3.23Å; V387-A414 WeakPolarHBondContact CG1-O 3.42Å; V387-Q418 HydrophobicContact CB-CB 4.49Å; V387-Q418 HydrophobicContact CG1-CB 3.8Å
388	D	90.5	Very high	90.7	Very high	117 Å²	117	36.7 Å²	36.7	63%	0.626	20%	0.197	S	C	*	.	H	α-helix	trans	-59.3	-45.2	177.1	-73.6	-49.2	0	0	0	112.1	Q386 A390 V391 G392 Q418	Q386-D388 PolarHBondContact O-N 3.28Å; D388-A390 VanDerWaalsContact C-N 3.3Å; D388-A390 PolarHBondContact O-N 3.41Å; D388-V391 PolarHBondContact O-N 3.39Å; D388-G392 PolarHBondContact O-N 3.37Å; D388-Q418 PolarHBondContact OD1-NE2 2.72Å
389	E	93.1	Very high	91	Very high	96 Å²	96	43.4 Å²	43.4	45%	0.449	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-31.5	178.4	-61.9	-177.9	-122.1	0	0	111.8	K381 Q386 V387 D393	K381-E389 HydrophobicContact CD-CB 3.62Å; K381-E389 WeakPolarHBondContact CE-OE2 3.47Å; K381-E389 HydrophobicContact CG-CB 4.46Å; K381-E389 PolarHBondContact NZ-O 3.02Å; K381-E389 IonicContact NZ-OE2 2.91Å; Q386-E389 HydrophobicContact CB-CB 4.4Å; Q386-E389 PolarHBondContact NE2-OE1 3.48Å; Q386-E389 PolarHBondContact O-N 3.2Å; V387-E389 VanDerWaalsContact C-N 3.34Å; V387-E389 PolarHBondContact O-N 3.28Å; E389-D393 PolarHBondContact O-N 2.65Å
390	A	91.9	Very high	91.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-44.1	175.7	0	0	0	0	0	111.6	G378 K381 I382 Q386 V387 D388 G392 D393 F394	G378-A390 WeakPolarHBondContact O-CB 3.4Å; K381-A390 HydrophobicContact CB-CB 3.71Å; I382-A390 HydrophobicContact CG1-CB 3.79Å; Q386-A390 PolarHBondContact O-N 3.48Å; V387-A390 WeakPolarHBondContact O-CB 3.49Å; V387-A390 PolarHBondContact O-N 3.16Å; V387-A390 VanDerWaalsContact O-N 3.16Å; D388-A390 VanDerWaalsContact C-N 3.3Å; D388-A390 PolarHBondContact O-N 3.41Å; A390-G392 VanDerWaalsContact C-N 3.29Å; A390-G392 PolarHBondContact O-N 3.3Å; A390-D393 PolarHBondContact O-N 3.14Å; A390-D393 VanDerWaalsContact O-N 3.15Å; A390-F394 HydrophobicContact CB-CE2 4.22Å; A390-F394 WeakPolarHBondContact O-CD2 3.4Å; A390-F394 PolarHBondContact O-N 2.99Å
391	V	94.3	Very high	91.5	Very high	18 Å²	18	47.6 Å²	47.6	11%	0.109	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-43.4	176	171.7	0	0	0	0	110.5	V387 D388 D393 F394 D395 A414 L415	V387-V391 HydrophobicContact CG1-CG2 4.46Å; V387-V391 WeakPolarHBondContact O-CG2 3.4Å; V387-V391 PolarHBondContact O-N 3.02Å; D388-V391 PolarHBondContact O-N 3.39Å; V391-D393 VanDerWaalsContact C-N 3.32Å; V391-D393 PolarHBondContact O-N 3.29Å; V391-F394 PolarHBondContact O-N 2.96Å; V391-D395 WeakPolarHBondContact O-CB 3.47Å; V391-D395 PolarHBondContact O-N 3.31Å; V391-A414 HydrophobicContact CG2-CB 3.8Å; V391-L415 HydrophobicContact CG1-CD2 4.1Å; V391-L415 HydrophobicContact CG2-CD2 3.91Å; V391-L415 HydrophobicContact CG2-CG 4.18Å
392	G	96.2	Very high	91.7	Very high	39 Å²	39	50.4 Å²	50.4	40%	0.402	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-39.5	175.8	0	0	0	0	0	113.5	D388 A390 D395 E396	D388-G392 PolarHBondContact O-N 3.37Å; A390-G392 VanDerWaalsContact C-N 3.29Å; A390-G392 PolarHBondContact O-N 3.3Å; G392-D395 PolarHBondContact O-N 3.22Å; G392-E396 PolarHBondContact O-N 2.95Å
393	D	97.1	Very high	91.9	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-40.2	175.5	-79.1	-21.2	0	0	0	112.3	Y374 R377 K381 E389 A390 V391 D395 E396 C397	Y374-D393 WeakPolarHBondContact CB-O 3.35Å; Y374-D393 WeakPolarHBondContact O-CB 3.44Å; R377-D393 VanDerWaalsContact CG-OD2 3.29Å; R377-D393 WeakPolarHBondContact CG-OD2 3.46Å; R377-D393 IonicContact CZ-OD1 3.86Å; R377-D393 IonicContact CZ-OD2 3.49Å; R377-D393 IonicContact NE-OD1 2.96Å; R377-D393 PolarHBondContact NE-OD1 3.41Å; R377-D393 IonicContact NE-OD2 2.58Å; R377-D393 PolarHBondContact NE-OD2 3Å; R377-D393 IonicContact NH2-OD1 2.6Å; R377-D393 PolarHBondContact NH2-OD1 3.24Å; R377-D393 IonicContact NH2-OD2 3.68Å; K381-D393 WeakPolarHBondContact CD-OD2 3.26Å; K381-D393 WeakPolarHBondContact CE-OD2 3.41Å; K381-D393 IonicContact NZ-OD1 2.72Å; K381-D393 IonicContact NZ-OD2 3.27Å; K381-D393 PolarHBondContact NZ-OD2 3.06Å; E389-D393 PolarHBondContact O-N 2.65Å; A390-D393 PolarHBondContact O-N 3.14Å; A390-D393 VanDerWaalsContact O-N 3.15Å; V391-D393 VanDerWaalsContact C-N 3.32Å; V391-D393 PolarHBondContact O-N 3.29Å; D393-D395 VanDerWaalsContact C-N 3.31Å; D393-D395 PolarHBondContact O-N 3.34Å; D393-E396 PolarHBondContact O-N 2.9Å; D393-C397 PolarHBondContact O-N 3.25Å
394	F	95.9	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-36.5	173.4	-67.4	-58.7	0	0	0	112.2	Q379 I382 A390 V391 E396 C397 I398 Q410 K411 A414	Q379-F394 HydrophobicContact CG-CE1 4.39Å; Q379-F394 HydrophobicContact CG-CZ 4.21Å; I382-F394 HydrophobicContact CD1-CE2 3.64Å; I382-F394 HydrophobicContact CD1-CZ 3.95Å; I382-F394 HydrophobicContact CG1-CE2 4.19Å; A390-F394 HydrophobicContact CB-CE2 4.22Å; A390-F394 WeakPolarHBondContact O-CD2 3.4Å; A390-F394 PolarHBondContact O-N 2.99Å; V391-F394 PolarHBondContact O-N 2.96Å; F394-E396 VanDerWaalsContact C-N 3.31Å; F394-E396 PolarHBondContact O-N 3.46Å; F394-C397 WeakPolarHBondContact O-CB 3.43Å; F394-C397 PolarHBondContact O-N 3.49Å; F394-I398 WeakPolarHBondContact O-CB 3.46Å; F394-I398 WeakPolarHBondContact O-CD1 3.46Å; F394-I398 WeakPolarHBondContact O-CG1 3.42Å; F394-I398 PolarHBondContact O-N 2.86Å; F394-Q410 HydrophobicContact CD1-CB 4.19Å; F394-Q410 HydrophobicContact CE1-CB 3.7Å; F394-Q410 VanDerWaalsContact CE1-OE1 3.3Å; F394-Q410 HydrophobicContact CE2-CB 4.4Å; F394-Q410 HydrophobicContact CZ-CB 3.82Å; F394-K411 HydrophobicContact CB-CB 3.83Å; F394-K411 HydrophobicContact CB-CG 4.25Å; F394-K411 HydrophobicContact CG-CB 4.35Å; F394-A414 HydrophobicContact CD2-CB 4.38Å; F394-A414 HydrophobicContact CE2-CB 4.33Å
395	D	97.1	Very high	92.7	Very high	65 Å²	65	51.5 Å²	51.5	35%	0.348	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-42.6	173.2	-88.2	-33	0	0	0	111.9	V391 G392 D393 I398 R399 K411	V391-D395 WeakPolarHBondContact O-CB 3.47Å; V391-D395 PolarHBondContact O-N 3.31Å; G392-D395 PolarHBondContact O-N 3.22Å; D393-D395 VanDerWaalsContact C-N 3.31Å; D393-D395 PolarHBondContact O-N 3.34Å; D395-I398 PolarHBondContact O-N 3.31Å; D395-R399 VanDerWaalsContact O-CB 3.32Å; D395-R399 WeakPolarHBondContact O-CB 3.31Å; D395-R399 PolarHBondContact O-N 2.89Å; D395-K411 WeakPolarHBondContact OD1-CD 3.4Å; D395-K411 WeakPolarHBondContact OD1-CE 3.41Å; D395-K411 IonicContact OD1-NZ 3.35Å; D395-K411 PolarHBondContact OD1-NZ 3.43Å; D395-K411 IonicContact OD2-NZ 2.8Å
396	E	97.1	Very high	92.9	Very high	50 Å²	50	49 Å²	49	23%	0.234	26%	0.256	C	S	.	.	H	α-helix	trans	-67.3	-39.9	176.2	-170.8	60.8	-171.6	0	0	112.1	Y374 G392 D393 F394 I398 R399 L400	Y374-E396 HydrophobicContact CD1-CB 3.95Å; Y374-E396 HydrophobicContact CD1-CG 3.71Å; Y374-E396 HydrophobicContact CD2-CB 4.49Å; Y374-E396 HydrophobicContact CD2-CG 3.85Å; Y374-E396 HydrophobicContact CE1-CB 4.34Å; Y374-E396 HydrophobicContact CE1-CG 3.66Å; Y374-E396 HydrophobicContact CE2-CG 3.82Å; Y374-E396 HydrophobicContact CG-CB 4.04Å; Y374-E396 HydrophobicContact CG-CG 3.81Å; G392-E396 PolarHBondContact O-N 2.95Å; D393-E396 PolarHBondContact O-N 2.9Å; F394-E396 VanDerWaalsContact C-N 3.31Å; F394-E396 PolarHBondContact O-N 3.46Å; E396-I398 PolarHBondContact O-N 3.08Å; E396-R399 VanDerWaalsContact CD-NE 3.3Å; E396-R399 WeakPolarHBondContact O-CB 3.46Å; E396-R399 PolarHBondContact O-N 3.47Å; E396-R399 IonicContact OE1-CZ 3.63Å; E396-R399 VanDerWaalsContact OE1-CZ 3.28Å; E396-R399 IonicContact OE1-NE 3.41Å; E396-R399 PolarHBondContact OE1-NE 3.37Å; E396-R399 VanDerWaalsContact OE1-NE 3.14Å; E396-R399 IonicContact OE1-NH2 3.1Å; E396-R399 PolarHBondContact OE1-NH2 3.19Å; E396-R399 IonicContact OE2-CZ 2.97Å; E396-R399 IonicContact OE2-NE 4Å; E396-R399 PolarHBondContact OE2-NE 2.96Å; E396-R399 IonicContact OE2-NH2 3.19Å; E396-L400 HydrophobicContact CG-CD1 4.43Å; E396-L400 WeakPolarHBondContact O-CG 3.45Å; E396-L400 PolarHBondContact O-N 3.02Å
397	C	95.6	Very high	93	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-58.8	-46.6	172.2	-175	0	0	0	0	111.7	P371 D393 F394 R399 L400 R401 A407	P371-C397 PolarHBondContact O-SG 3.02Å; P371-C397 VanDerWaalsContact O-SG 3.33Å; D393-C397 PolarHBondContact O-N 3.25Å; F394-C397 WeakPolarHBondContact O-CB 3.43Å; F394-C397 PolarHBondContact O-N 3.49Å; C397-R399 VanDerWaalsContact C-N 3.35Å; C397-L400 PolarHBondContact O-N 3.4Å; C397-R401 PolarHBondContact O-N 2.86Å; C397-A407 HydrophobicContact CB-CB 4.27Å
398	I	95.6	Very high	93.3	Very high	31 Å²	31	45.8 Å²	45.8	16%	0.159	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-35.6	178.4	-65.8	161.4	0	0	0	111.1	F394 D395 E396 R401 P402 A407 Q408 K411	F394-I398 WeakPolarHBondContact O-CB 3.46Å; F394-I398 WeakPolarHBondContact O-CD1 3.46Å; F394-I398 WeakPolarHBondContact O-CG1 3.42Å; F394-I398 PolarHBondContact O-N 2.86Å; D395-I398 PolarHBondContact O-N 3.31Å; E396-I398 PolarHBondContact O-N 3.08Å; I398-R401 CarbonylContact O-C 3.32Å; I398-R401 PolarHBondContact O-N 3.42Å; I398-P402 VanDerWaalsContact O-CA 3.23Å; I398-P402 WeakPolarHBondContact O-CA 3.33Å; I398-P402 WeakPolarHBondContact O-CD 3.39Å; I398-P402 WeakPolarHBondContact O-CG 3.4Å; I398-A407 HydrophobicContact CG1-CB 3.89Å; I398-Q408 HydrophobicContact CD1-CG 3.77Å; I398-Q408 HydrophobicContact CG1-CG 3.86Å; I398-Q408 HydrophobicContact CG2-CG 4.31Å; I398-K411 HydrophobicContact CD1-CB 4.07Å; I398-K411 HydrophobicContact CD1-CD 3.66Å; I398-K411 HydrophobicContact CD1-CG 4.47Å
399	R	96.8	Very high	93.4	Very high	142 Å²	142	40.2 Å²	40.2	54%	0.536	21%	0.211	S	C	.	.	H	α-helix	trans	-63.5	-43.2	175.6	-169.7	-165.4	67.4	66.6	-2.2	111.5	D395 E396 C397	D395-R399 VanDerWaalsContact O-CB 3.32Å; D395-R399 WeakPolarHBondContact O-CB 3.31Å; D395-R399 PolarHBondContact O-N 2.89Å; E396-R399 VanDerWaalsContact CD-NE 3.3Å; E396-R399 WeakPolarHBondContact O-CB 3.46Å; E396-R399 PolarHBondContact O-N 3.47Å; E396-R399 IonicContact OE1-CZ 3.63Å; E396-R399 VanDerWaalsContact OE1-CZ 3.28Å; E396-R399 IonicContact OE1-NE 3.41Å; E396-R399 PolarHBondContact OE1-NE 3.37Å; E396-R399 VanDerWaalsContact OE1-NE 3.14Å; E396-R399 IonicContact OE1-NH2 3.1Å; E396-R399 PolarHBondContact OE1-NH2 3.19Å; E396-R399 IonicContact OE2-CZ 2.97Å; E396-R399 IonicContact OE2-NE 4Å; E396-R399 PolarHBondContact OE2-NE 2.96Å; E396-R399 IonicContact OE2-NH2 3.19Å; C397-R399 VanDerWaalsContact C-N 3.35Å
400	L	94.8	Very high	93.2	Very high	46 Å²	46	36.3 Å²	36.3	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-71.7	-33.8	175.4	-68.8	170.3	0	0	0	111.6	R369 P371 Y374 E396 C397	R369-L400 HydrophobicContact CB-CD2 4.41Å; P371-L400 HydrophobicContact CB-CB 4.15Å; Y374-L400 HydrophobicContact CD2-CD1 3.71Å; Y374-L400 HydrophobicContact CE2-CD1 3.69Å; E396-L400 HydrophobicContact CG-CD1 4.43Å; E396-L400 WeakPolarHBondContact O-CG 3.45Å; E396-L400 PolarHBondContact O-N 3.02Å; C397-L400 PolarHBondContact O-N 3.4Å
401	R	92.1	Very high	93.4	Very high	81 Å²	81	38.8 Å²	38.8	31%	0.306	20%	0.203	S	C	.	.			trans	-138.7	84	-176.2	-167.4	176	177.2	151.3	4.7	113.1	T235 P371 C397 I398 D403 S404	T235-R401 PolarHBondContact OG1-NH1 3.26Å; P371-R401 HydrophobicContact CB-CB 4.18Å; C397-R401 PolarHBondContact O-N 2.86Å; I398-R401 CarbonylContact O-C 3.32Å; I398-R401 PolarHBondContact O-N 3.42Å; R401-D403 VanDerWaalsContact C-N 3.25Å; R401-D403 WeakPolarHBondContact CG-OD1 3.21Å; R401-D403 IonicContact CZ-OD1 3.57Å; R401-D403 IonicContact CZ-OD2 3.57Å; R401-D403 IonicContact NE-OD1 3.59Å; R401-D403 PolarHBondContact NE-OD1 3.4Å; R401-D403 VanDerWaalsContact NE-OD1 3.1Å; R401-D403 IonicContact NE-OD2 3.74Å; R401-D403 PolarHBondContact NE-OD2 3.47Å; R401-D403 IonicContact NH2-OD2 3.83Å; R401-D403 PolarHBondContact NH2-OD2 3.39Å; R401-D403 PolarHBondContact O-N 3.01Å; R401-S404 WeakPolarHBondContact O-CB 3.38Å; R401-S404 PolarHBondContact O-N 2.86Å; R401-S404 VanDerWaalsContact O-N 3.14Å
402	P	92.4	Very high	93.4	Very high	81 Å²	81	38.7 Å²	38.7	53%	0.526	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.7	-175.8	-22.6	34.3	0	0	0	115.3	I398 Q408	I398-P402 VanDerWaalsContact O-CA 3.23Å; I398-P402 WeakPolarHBondContact O-CA 3.33Å; I398-P402 WeakPolarHBondContact O-CD 3.39Å; I398-P402 WeakPolarHBondContact O-CG 3.4Å; P402-Q408 PolarHBondContact O-NE2 2.84Å
403	D	88.8	Confident	93.2	Very high	90 Å²	90	37.3 Å²	37.3	48%	0.481	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.4	176.6	69.2	-44.4	0	0	0	112.9	R401 A405 F442	R401-D403 VanDerWaalsContact C-N 3.25Å; R401-D403 WeakPolarHBondContact CG-OD1 3.21Å; R401-D403 IonicContact CZ-OD1 3.57Å; R401-D403 IonicContact CZ-OD2 3.57Å; R401-D403 IonicContact NE-OD1 3.59Å; R401-D403 PolarHBondContact NE-OD1 3.4Å; R401-D403 VanDerWaalsContact NE-OD1 3.1Å; R401-D403 IonicContact NE-OD2 3.74Å; R401-D403 PolarHBondContact NE-OD2 3.47Å; R401-D403 IonicContact NH2-OD2 3.83Å; R401-D403 PolarHBondContact NH2-OD2 3.39Å; R401-D403 PolarHBondContact O-N 3.01Å; D403-A405 PolarHBondContact O-N 3.48Å; D403-F442 WeakPolarHBondContact O-CE1 3.39Å
404	S	89.5	Confident	92.8	Very high	16 Å²	16	36.9 Å²	36.9	11%	0.112	18%	0.184	C	C	.	.			trans	-69.9	98.4	178.4	-174.6	0	0	0	0	110.7	R401 L406 A407 Q408	R401-S404 WeakPolarHBondContact O-CB 3.38Å; R401-S404 PolarHBondContact O-N 2.86Å; R401-S404 VanDerWaalsContact O-N 3.14Å; S404-L406 VanDerWaalsContact C-N 3.29Å; S404-A407 WeakPolarHBondContact OG-CB 3.41Å; S404-A407 PolarHBondContact OG-N 2.88Å; S404-Q408 WeakPolarHBondContact O-CG 3.37Å; S404-Q408 PolarHBondContact O-N 3.05Å; S404-Q408 PolarHBondContact O-NE2 3.38Å; S404-Q408 VanDerWaalsContact O-NE2 3.09Å
405	A	88.9	Confident	92.7	Very high	19 Å²	19	39.7 Å²	39.7	16%	0.157	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-41.3	174.5	0	0	0	0	0	111.3	D403 Q408 A409 F442 C445	D403-A405 PolarHBondContact O-N 3.48Å; A405-Q408 PolarHBondContact O-N 3.46Å; A405-A409 WeakPolarHBondContact O-CB 3.31Å; A405-A409 PolarHBondContact O-N 3.1Å; A405-F442 HydrophobicContact CB-CB 3.56Å; A405-F442 HydrophobicContact CB-CD1 3.66Å; A405-F442 HydrophobicContact CB-CD2 3.92Å; A405-F442 HydrophobicContact CB-CE1 4.31Å; A405-F442 HydrophobicContact CB-CG 3.42Å; A405-F442 VanDerWaalsContact CB-CG 3.42Å; A405-C445 HydrophobicContact CB-CB 3.78Å
406	L	87.8	Confident	92.5	Very high	43 Å²	43	36.6 Å²	36.6	23%	0.225	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-50.2	-179.2	-178.2	60.6	0	0	0	111.8	H375 S404 Q408 A409 Q410 E447	H375-L406 VanDerWaalsContact NE2-CD2 3.34Å; H375-L406 WeakPolarHBondContact NE2-CD2 3.31Å; S404-L406 VanDerWaalsContact C-N 3.29Å; L406-Q408 VanDerWaalsContact C-N 3.29Å; L406-Q408 PolarHBondContact O-N 3.37Å; L406-A409 PolarHBondContact O-N 3.02Å; L406-Q410 HydrophobicContact CD1-CG 4.22Å; L406-Q410 WeakPolarHBondContact O-CB 3.42Å; L406-Q410 WeakPolarHBondContact O-CG 3.4Å; L406-Q410 PolarHBondContact O-N 3.42Å; L406-E447 HydrophobicContact CD1-CB 4.03Å; L406-E447 HydrophobicContact CD1-CG 3.57Å
407	A	90.3	Very high	92	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-36.4	179.8	0	0	0	0	0	112.1	C397 I398 S404 K411	C397-A407 HydrophobicContact CB-CB 4.27Å; I398-A407 HydrophobicContact CG1-CB 3.89Å; S404-A407 WeakPolarHBondContact OG-CB 3.41Å; S404-A407 PolarHBondContact OG-N 2.88Å; A407-K411 WeakPolarHBondContact O-CB 3.44Å; A407-K411 PolarHBondContact O-N 3.18Å
408	Q	94.4	Very high	91.7	Very high	16 Å²	16	39.1 Å²	39.1	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-43.4	176.2	-72.8	173.1	74.1	0	0	112.3	I398 P402 S404 A405 L406 K411 C412 V438 R441 F442	I398-Q408 HydrophobicContact CD1-CG 3.77Å; I398-Q408 HydrophobicContact CG1-CG 3.86Å; I398-Q408 HydrophobicContact CG2-CG 4.31Å; P402-Q408 PolarHBondContact O-NE2 2.84Å; S404-Q408 WeakPolarHBondContact O-CG 3.37Å; S404-Q408 PolarHBondContact O-N 3.05Å; S404-Q408 PolarHBondContact O-NE2 3.38Å; S404-Q408 VanDerWaalsContact O-NE2 3.09Å; A405-Q408 PolarHBondContact O-N 3.46Å; L406-Q408 VanDerWaalsContact C-N 3.29Å; L406-Q408 PolarHBondContact O-N 3.37Å; Q408-K411 PolarHBondContact O-N 3.01Å; Q408-C412 PolarHBondContact O-N 3.49Å; Q408-C412 PolarHBondContact O-SG 3.31Å; Q408-V438 HydrophobicContact CB-CG2 3.96Å; Q408-R441 VanDerWaalsContact OE1-CZ 3.22Å; Q408-R441 VanDerWaalsContact OE1-NH2 3.11Å; Q408-F442 VanDerWaalsContact NE2-CZ 3.3Å
409	A	91.4	Very high	91.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-45.8	174.4	0	0	0	0	0	111.5	A405 L406 C412 F413 V438 L451	A405-A409 WeakPolarHBondContact O-CB 3.31Å; A405-A409 PolarHBondContact O-N 3.1Å; L406-A409 PolarHBondContact O-N 3.02Å; A409-C412 PolarHBondContact O-N 3.16Å; A409-F413 PolarHBondContact O-N 3.42Å; A409-V438 HydrophobicContact CB-CG1 4.06Å; A409-L451 HydrophobicContact CB-CD1 4.11Å
410	Q	90.6	Very high	90.9	Very high	14 Å²	14	35.7 Å²	35.7	7%	0.065	18%	0.177	C	C	.	.	H	α-helix	trans	-68	-36.7	179.9	-70.7	-174.4	-11.4	0	0	112.7	H375 F394 L406 F413 A414 L451	H375-Q410 PolarHBondContact CD2-OE1 3.5Å; H375-Q410 PolarHBondContact NE2-OE1 3.07Å; F394-Q410 HydrophobicContact CD1-CB 4.19Å; F394-Q410 HydrophobicContact CE1-CB 3.7Å; F394-Q410 VanDerWaalsContact CE1-OE1 3.3Å; F394-Q410 HydrophobicContact CE2-CB 4.4Å; F394-Q410 HydrophobicContact CZ-CB 3.82Å; L406-Q410 HydrophobicContact CD1-CG 4.22Å; L406-Q410 WeakPolarHBondContact O-CB 3.42Å; L406-Q410 WeakPolarHBondContact O-CG 3.4Å; L406-Q410 PolarHBondContact O-N 3.42Å; Q410-F413 PolarHBondContact O-N 3.5Å; Q410-A414 WeakPolarHBondContact O-CB 3.39Å; Q410-A414 PolarHBondContact O-N 3.19Å; Q410-L451 HydrophobicContact CG-CD1 4.03Å
411	K	94.8	Very high	90.3	Very high	51 Å²	51	37.3 Å²	37.3	22%	0.222	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-47.3	169.9	-175.9	-176	169.6	-173.1	0	111.5	F394 D395 I398 A407 Q408 F413 A414 L415	F394-K411 HydrophobicContact CB-CB 3.83Å; F394-K411 HydrophobicContact CB-CG 4.25Å; F394-K411 HydrophobicContact CG-CB 4.35Å; D395-K411 WeakPolarHBondContact OD1-CD 3.4Å; D395-K411 WeakPolarHBondContact OD1-CE 3.41Å; D395-K411 IonicContact OD1-NZ 3.35Å; D395-K411 PolarHBondContact OD1-NZ 3.43Å; D395-K411 IonicContact OD2-NZ 2.8Å; I398-K411 HydrophobicContact CD1-CB 4.07Å; I398-K411 HydrophobicContact CD1-CD 3.66Å; I398-K411 HydrophobicContact CD1-CG 4.47Å; A407-K411 WeakPolarHBondContact O-CB 3.44Å; A407-K411 PolarHBondContact O-N 3.18Å; Q408-K411 PolarHBondContact O-N 3.01Å; K411-F413 VanDerWaalsContact C-N 3.26Å; K411-F413 PolarHBondContact O-N 3.41Å; K411-A414 WeakPolarHBondContact O-CB 3.49Å; K411-A414 PolarHBondContact O-N 3.22Å; K411-L415 HydrophobicContact CG-CD1 4.22Å; K411-L415 WeakPolarHBondContact O-CG 3.43Å; K411-L415 PolarHBondContact O-N 2.78Å
412	C	94.9	Very high	90.1	Very high	16 Å²	16	36 Å²	36	11%	0.108	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-40.9	177.8	-66.2	0	0	0	0	111	Q408 A409 L415 Y416 F435	Q408-C412 PolarHBondContact O-N 3.49Å; Q408-C412 PolarHBondContact O-SG 3.31Å; A409-C412 PolarHBondContact O-N 3.16Å; C412-L415 PolarHBondContact O-N 3.24Å; C412-Y416 WeakPolarHBondContact O-CB 3.35Å; C412-Y416 PolarHBondContact O-N 3.16Å; C412-F435 HydrophobicContact CB-CD1 3.91Å; C412-F435 HydrophobicContact CB-CD2 4.3Å; C412-F435 HydrophobicContact CB-CE1 3.82Å; C412-F435 HydrophobicContact CB-CE2 4.23Å; C412-F435 HydrophobicContact CB-CG 4.16Å; C412-F435 HydrophobicContact CB-CZ 4.01Å
413	F	92	Very high	90	Very high	10 Å²	10	39 Å²	39	4%	0.044	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-42.8	174.9	-171.7	-101.4	0	0	0	113	L23 A409 Q410 K411 L415 Y416 R417 F435 L451	L23-F413 HydrophobicContact CD2-CE1 4.12Å; L23-F413 HydrophobicContact CD2-CZ 4Å; A409-F413 PolarHBondContact O-N 3.42Å; Q410-F413 PolarHBondContact O-N 3.5Å; K411-F413 VanDerWaalsContact C-N 3.26Å; K411-F413 PolarHBondContact O-N 3.41Å; F413-L415 PolarHBondContact O-N 3.27Å; F413-Y416 WeakPolarHBondContact O-CB 3.47Å; F413-Y416 PolarHBondContact O-N 2.98Å; F413-R417 HydrophobicContact CD1-CG 4.05Å; F413-R417 HydrophobicContact CE1-CG 3.74Å; F413-R417 HydrophobicContact CE2-CG 4.49Å; F413-R417 HydrophobicContact CZ-CG 3.99Å; F413-R417 WeakPolarHBondContact O-CB 3.39Å; F413-R417 VanDerWaalsContact O-CG 3.24Å; F413-R417 WeakPolarHBondContact O-CG 3.48Å; F413-R417 PolarHBondContact O-N 3.11Å; F413-F435 HydrophobicContact CB-CE1 4.26Å; F413-F435 HydrophobicContact CB-CZ 3.79Å; F413-F435 HydrophobicContact CD2-CZ 4.08Å; F413-F435 HydrophobicContact CG-CZ 4.46Å; F413-L451 HydrophobicContact CB-CD1 4.21Å; F413-L451 HydrophobicContact CB-CD2 4.49Å; F413-L451 HydrophobicContact CD1-CD2 4.38Å; F413-L451 HydrophobicContact CD2-CB 4.19Å; F413-L451 HydrophobicContact CD2-CD2 3.94Å; F413-L451 HydrophobicContact CE2-CD2 4.22Å; F413-L451 HydrophobicContact CG-CD2 4.02Å
414	A	89.4	Confident	90.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.9	-48.1	174.6	0	0	0	0	0	111.6	I382 V387 V391 F394 Q410 K411 Y416 R417 Q418	I382-A414 HydrophobicContact CD1-CB 4Å; I382-A414 HydrophobicContact CG1-CB 4.39Å; V387-A414 HydrophobicContact CG1-CB 4.2Å; V387-A414 VanDerWaalsContact CG1-O 3.23Å; V387-A414 WeakPolarHBondContact CG1-O 3.42Å; V391-A414 HydrophobicContact CG2-CB 3.8Å; F394-A414 HydrophobicContact CD2-CB 4.38Å; F394-A414 HydrophobicContact CE2-CB 4.33Å; Q410-A414 WeakPolarHBondContact O-CB 3.39Å; Q410-A414 PolarHBondContact O-N 3.19Å; K411-A414 WeakPolarHBondContact O-CB 3.49Å; K411-A414 PolarHBondContact O-N 3.22Å; A414-Y416 PolarHBondContact O-N 3.38Å; A414-R417 PolarHBondContact O-N 3.23Å; A414-Q418 PolarHBondContact O-N 2.9Å
415	L	93.6	Very high	90.4	Very high	60 Å²	60	41.7 Å²	41.7	31%	0.314	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-41.3	176.8	-70.8	172.1	0	0	0	112.2	V391 K411 C412 F413 Q418 A419 A431	V391-L415 HydrophobicContact CG1-CD2 4.1Å; V391-L415 HydrophobicContact CG2-CD2 3.91Å; V391-L415 HydrophobicContact CG2-CG 4.18Å; K411-L415 HydrophobicContact CG-CD1 4.22Å; K411-L415 WeakPolarHBondContact O-CG 3.43Å; K411-L415 PolarHBondContact O-N 2.78Å; C412-L415 PolarHBondContact O-N 3.24Å; F413-L415 PolarHBondContact O-N 3.27Å; L415-Q418 PolarHBondContact O-N 3.4Å; L415-A419 VanDerWaalsContact O-CB 3.31Å; L415-A419 WeakPolarHBondContact O-CB 3.33Å; L415-A419 PolarHBondContact O-N 3.47Å; L415-A431 HydrophobicContact CB-CB 4.31Å
416	Y	92.8	Very high	90.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-50.1	173.8	168.7	-101.8	0	0	0	111	C412 F413 A414 Q418 A419 Y420 V428 M432 F435 A455 D458 Q459	C412-Y416 WeakPolarHBondContact O-CB 3.35Å; C412-Y416 PolarHBondContact O-N 3.16Å; F413-Y416 WeakPolarHBondContact O-CB 3.47Å; F413-Y416 PolarHBondContact O-N 2.98Å; A414-Y416 PolarHBondContact O-N 3.38Å; Y416-Q418 VanDerWaalsContact C-N 3.35Å; Y416-Q418 PolarHBondContact O-N 2.75Å; Y416-A419 PolarHBondContact O-N 3.13Å; Y416-Y420 WeakPolarHBondContact O-CB 3.44Å; Y416-Y420 PolarHBondContact O-N 2.58Å; Y416-V428 HydrophobicContact CD2-CG1 4.24Å; Y416-V428 HydrophobicContact CE2-CG1 3.97Å; Y416-M432 HydrophobicContact CD2-SD 3.96Å; Y416-M432 HydrophobicContact CE2-SD 4.07Å; Y416-F435 HydrophobicContact CG-CE2 4.47Å; Y416-A455 HydrophobicContact CD1-CB 3.93Å; Y416-A455 HydrophobicContact CD2-CB 4.14Å; Y416-A455 HydrophobicContact CE1-CB 3.87Å; Y416-A455 HydrophobicContact CE2-CB 4.09Å; Y416-A455 HydrophobicContact CG-CB 4.08Å; Y416-D458 HydrophobicContact CE1-CB 4.48Å; Y416-D458 WeakPolarHBondContact OH-CB 3.18Å; Y416-Q459 HydrophobicContact CE2-CG 4.13Å; Y416-Q459 PolarHBondContact OH-NE2 3.07Å; Y416-Q459 VanDerWaalsContact OH-NE2 3.08Å
417	R	85.6	Confident	91.1	Very high	48 Å²	48	47.3 Å²	47.3	18%	0.181	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-45.5	179	-71.4	-70.2	-63.8	-178.4	-1.8	111.5	L20 F413 A414 Y420 T421	L20-R417 VanDerWaalsContact CD2-NH2 3.33Å; F413-R417 HydrophobicContact CD1-CG 4.05Å; F413-R417 HydrophobicContact CE1-CG 3.74Å; F413-R417 HydrophobicContact CE2-CG 4.49Å; F413-R417 HydrophobicContact CZ-CG 3.99Å; F413-R417 WeakPolarHBondContact O-CB 3.39Å; F413-R417 VanDerWaalsContact O-CG 3.24Å; F413-R417 WeakPolarHBondContact O-CG 3.48Å; F413-R417 PolarHBondContact O-N 3.11Å; A414-R417 PolarHBondContact O-N 3.23Å; R417-Y420 PolarHBondContact O-N 2.91Å; R417-T421 WeakPolarHBondContact O-CG2 3.23Å; R417-T421 PolarHBondContact O-N 3.1Å; R417-T421 PolarHBondContact O-OG1 3.32Å
418	Q	88.4	Confident	91.3	Very high	57 Å²	57	47.9 Å²	47.9	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-59.4	-49.5	175.6	-177.3	179	30.2	0	0	112.2	V387 D388 A414 L415 Y416 Y420 T421 G422	V387-Q418 HydrophobicContact CB-CB 4.49Å; V387-Q418 HydrophobicContact CG1-CB 3.8Å; D388-Q418 PolarHBondContact OD1-NE2 2.72Å; A414-Q418 PolarHBondContact O-N 2.9Å; L415-Q418 PolarHBondContact O-N 3.4Å; Y416-Q418 VanDerWaalsContact C-N 3.35Å; Y416-Q418 PolarHBondContact O-N 2.75Å; Q418-Y420 VanDerWaalsContact C-N 3.3Å; Q418-Y420 PolarHBondContact O-N 2.88Å; Q418-T421 PolarHBondContact O-OG1 3.26Å; Q418-G422 PolarHBondContact O-N 3.11Å
419	A	92.1	Very high	91.4	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-37	-178.1	0	0	0	0	0	111.9	L415 Y416 N423 N424 Q427 V428	L415-A419 VanDerWaalsContact O-CB 3.31Å; L415-A419 WeakPolarHBondContact O-CB 3.33Å; L415-A419 PolarHBondContact O-N 3.47Å; Y416-A419 PolarHBondContact O-N 3.13Å; A419-N423 PolarHBondContact O-N 2.62Å; A419-N424 PolarHBondContact O-N 3.27Å; A419-Q427 HydrophobicContact CB-CB 3.51Å; A419-V428 HydrophobicContact CB-CB 4.41Å; A419-V428 HydrophobicContact CB-CG2 3.68Å
420	Y	84.1	Confident	91.6	Very high	100 Å²	100	56.2 Å²	56.2	39%	0.392	31%	0.312	S	S	.	.	H	α-helix	trans	-68.3	-48.4	178.5	-172.6	-103.7	0	0	0	111.7	Y416 R417 Q418 G422 N423 Q459	Y416-Y420 WeakPolarHBondContact O-CB 3.44Å; Y416-Y420 PolarHBondContact O-N 2.58Å; R417-Y420 PolarHBondContact O-N 2.91Å; Q418-Y420 VanDerWaalsContact C-N 3.3Å; Q418-Y420 PolarHBondContact O-N 2.88Å; Y420-G422 VanDerWaalsContact C-N 3.32Å; Y420-G422 PolarHBondContact O-N 2.72Å; Y420-N423 PolarHBondContact O-N 3.33Å; Y420-Q459 VanDerWaalsContact CD2-NE2 3.33Å
421	T	83.2	Confident	91.8	Very high	81 Å²	81	55.8 Å²	55.8	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-68.4	-33.2	176.9	56.6	0	0	0	0	112.3	R417 Q418 N423	R417-T421 WeakPolarHBondContact O-CG2 3.23Å; R417-T421 PolarHBondContact O-N 3.1Å; R417-T421 PolarHBondContact O-OG1 3.32Å; Q418-T421 PolarHBondContact O-OG1 3.26Å; T421-N423 PolarHBondContact O-N 3.33Å
422	G	87.1	Confident	91.9	Very high	54 Å²	54	53.7 Å²	53.7	56%	0.557	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-3	174.3	0	0	0	0	0	115.1	Q418 Y420 N424	Q418-G422 PolarHBondContact O-N 3.11Å; Y420-G422 VanDerWaalsContact C-N 3.32Å; Y420-G422 PolarHBondContact O-N 2.72Å; G422-N424 VanDerWaalsContact C-N 3.31Å; G422-N424 PolarHBondContact O-N 2.77Å
423	N	90.5	Very high	92	Very high	144 Å²	144	56.6 Å²	56.6	77%	0.77	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	46	-175.6	-64.7	-68	0	0	0	113.2	A419 Y420 T421 P425	A419-N423 PolarHBondContact O-N 2.62Å; Y420-N423 PolarHBondContact O-N 3.33Å; T421-N423 PolarHBondContact O-N 3.33Å; N423-P425 WeakPolarHBondContact O-CD 3.46Å
424	N	93.5	Very high	92.2	Very high	58 Å²	58	57 Å²	57	31%	0.31	32%	0.323	S	S	.	.			trans	-112.4	91.2	179.5	-168.1	-22.4	0	0	0	111.4	A419 G422 S426 Q427 V428	A419-N424 PolarHBondContact O-N 3.27Å; G422-N424 VanDerWaalsContact C-N 3.31Å; G422-N424 PolarHBondContact O-N 2.77Å; N424-S426 PolarHBondContact O-N 3.47Å; N424-S426 PolarHBondContact OD1-N 2.91Å; N424-Q427 HydrophobicContact CB-CB 4.19Å; N424-Q427 HydrophobicContact CB-CG 4.35Å; N424-Q427 PolarHBondContact ND2-NE2 3.49Å; N424-Q427 PolarHBondContact ND2-OE1 3.32Å; N424-Q427 PolarHBondContact O-N 3.19Å; N424-Q427 VanDerWaalsContact O-N 3.11Å; N424-V428 WeakPolarHBondContact O-CG2 3.25Å; N424-V428 PolarHBondContact O-N 3.32Å
425	P	93.2	Very high	92.6	Very high	103 Å²	103	57 Å²	57	67%	0.669	32%	0.323	S	S	*	.	H	α-helix	trans	-59	-32.6	-173.5	-25.7	34.3	0	0	0	114.3	N423 V428 Q429	N423-P425 WeakPolarHBondContact O-CD 3.46Å; P425-V428 PolarHBondContact O-N 3.49Å; P425-Q429 PolarHBondContact O-N 2.93Å
426	S	95.7	Very high	92.7	Very high	84 Å²	84	58.2 Å²	58.2	59%	0.587	33%	0.327	S	S	*	.	H	α-helix	trans	-65	-45.8	178.1	-177.9	0	0	0	0	111	N424 V428 Q429 T430	N424-S426 PolarHBondContact O-N 3.47Å; N424-S426 PolarHBondContact OD1-N 2.91Å; S426-V428 VanDerWaalsContact C-N 3.35Å; S426-Q429 PolarHBondContact O-N 2.95Å; S426-T430 PolarHBondContact O-N 2.79Å; S426-T430 PolarHBondContact O-OG1 3.16Å; S426-T430 VanDerWaalsContact O-OG1 3.11Å
427	Q	94.8	Very high	92.9	Very high	96 Å²	96	60.7 Å²	60.7	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-69.6	-33.4	176.8	-69.5	178.5	-11.4	0	0	112.3	A419 N424 Q429 T430 A431	A419-Q427 HydrophobicContact CB-CB 3.51Å; N424-Q427 HydrophobicContact CB-CB 4.19Å; N424-Q427 HydrophobicContact CB-CG 4.35Å; N424-Q427 PolarHBondContact ND2-NE2 3.49Å; N424-Q427 PolarHBondContact ND2-OE1 3.32Å; N424-Q427 PolarHBondContact O-N 3.19Å; N424-Q427 VanDerWaalsContact O-N 3.11Å; Q427-Q429 VanDerWaalsContact C-N 3.34Å; Q427-T430 PolarHBondContact O-N 3.15Å; Q427-A431 PolarHBondContact O-N 2.83Å
428	V	95.4	Very high	93.4	Very high	12 Å²	12	58.5 Å²	58.5	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-49.7	172.2	170.9	0	0	0	0	109.2	Y416 A419 N424 P425 S426 T430 A431 M432	Y416-V428 HydrophobicContact CD2-CG1 4.24Å; Y416-V428 HydrophobicContact CE2-CG1 3.97Å; A419-V428 HydrophobicContact CB-CB 4.41Å; A419-V428 HydrophobicContact CB-CG2 3.68Å; N424-V428 WeakPolarHBondContact O-CG2 3.25Å; N424-V428 PolarHBondContact O-N 3.32Å; P425-V428 PolarHBondContact O-N 3.49Å; S426-V428 VanDerWaalsContact C-N 3.35Å; V428-T430 PolarHBondContact O-N 3.5Å; V428-A431 PolarHBondContact O-N 3.12Å; V428-A431 VanDerWaalsContact O-N 3.14Å; V428-M432 HydrophobicContact CG1-CG 4.38Å; V428-M432 VanDerWaalsContact O-CG 3.3Å; V428-M432 WeakPolarHBondContact O-CG 3.26Å; V428-M432 PolarHBondContact O-N 3.18Å
429	Q	96.1	Very high	93.8	Very high	98 Å²	98	57.2 Å²	57.2	46%	0.458	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-43.7	178.5	-170.5	59.6	52	0	0	112	P425 S426 Q427 A431 M432 D433	P425-Q429 PolarHBondContact O-N 2.93Å; S426-Q429 PolarHBondContact O-N 2.95Å; Q427-Q429 VanDerWaalsContact C-N 3.34Å; Q429-A431 VanDerWaalsContact C-N 3.27Å; Q429-A431 PolarHBondContact O-N 3.11Å; Q429-M432 WeakPolarHBondContact O-CB 3.46Å; Q429-M432 PolarHBondContact O-N 2.96Å; Q429-M432 VanDerWaalsContact O-N 3.08Å; Q429-D433 PolarHBondContact NE2-OD1 3Å; Q429-D433 VanDerWaalsContact O-CG 3.27Å; Q429-D433 PolarHBondContact O-N 2.82Å
430	T	96.3	Very high	94	Very high	94 Å²	94	66 Å²	66	58%	0.577	36%	0.36	S	S	*	.	H	α-helix	trans	-57.2	-40.1	175	-58	0	0	0	0	112.4	S426 Q427 V428 G434	S426-T430 PolarHBondContact O-N 2.79Å; S426-T430 PolarHBondContact O-OG1 3.16Å; S426-T430 VanDerWaalsContact O-OG1 3.11Å; Q427-T430 PolarHBondContact O-N 3.15Å; V428-T430 PolarHBondContact O-N 3.5Å; T430-G434 PolarHBondContact O-N 2.91Å
431	A	95.3	Very high	94.6	Very high	5 Å²	5	66.9 Å²	66.9	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-68.9	-37.6	176.3	0	0	0	0	0	112.1	L415 Q427 V428 Q429 G434 F435	L415-A431 HydrophobicContact CB-CB 4.31Å; Q427-A431 PolarHBondContact O-N 2.83Å; V428-A431 PolarHBondContact O-N 3.12Å; V428-A431 VanDerWaalsContact O-N 3.14Å; Q429-A431 VanDerWaalsContact C-N 3.27Å; Q429-A431 PolarHBondContact O-N 3.11Å; A431-G434 WeakPolarHBondContact O-CA 3.34Å; A431-G434 PolarHBondContact O-N 3.03Å; A431-F435 VanDerWaalsContact O-CD2 3.25Å; A431-F435 WeakPolarHBondContact O-CD2 3.21Å; A431-F435 PolarHBondContact O-N 3.3Å; A431-F435 VanDerWaalsContact O-N 3.1Å
432	M	96.6	Very high	95.1	Very high	6 Å²	6	64.8 Å²	64.8	3%	0.03	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-43.7	174	-63.3	-55.8	-79.1	0	0	112.1	Y416 V428 Q429 G434 F435 E436 Y452 A455 L456 Q459	Y416-M432 HydrophobicContact CD2-SD 3.96Å; Y416-M432 HydrophobicContact CE2-SD 4.07Å; V428-M432 HydrophobicContact CG1-CG 4.38Å; V428-M432 VanDerWaalsContact O-CG 3.3Å; V428-M432 WeakPolarHBondContact O-CG 3.26Å; V428-M432 PolarHBondContact O-N 3.18Å; Q429-M432 WeakPolarHBondContact O-CB 3.46Å; Q429-M432 PolarHBondContact O-N 2.96Å; Q429-M432 VanDerWaalsContact O-N 3.08Å; M432-G434 PolarHBondContact O-N 3.33Å; M432-F435 WeakPolarHBondContact O-CB 3.46Å; M432-F435 PolarHBondContact O-N 3.45Å; M432-F435 HydrophobicContact SD-CD2 4.38Å; M432-E436 PolarHBondContact O-N 3.45Å; M432-Y452 HydrophobicContact CE-CD2 4.1Å; M432-Y452 HydrophobicContact CE-CE2 3.6Å; M432-Y452 HydrophobicContact SD-CE2 4.39Å; M432-A455 HydrophobicContact CE-CB 4.24Å; M432-A455 HydrophobicContact SD-CB 3.79Å; M432-L456 HydrophobicContact CE-CD2 3.48Å; M432-L456 VanDerWaalsContact CE-CD2 3.48Å; M432-L456 HydrophobicContact CE-CG 3.77Å; M432-Q459 HydrophobicContact CE-CG 4.39Å
433	D	96.9	Very high	95.6	Very high	78 Å²	78	65.8 Å²	65.8	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-34.4	174.4	-61	-11.1	0	0	0	110.9	Q429 E436 D437	Q429-D433 PolarHBondContact NE2-OD1 3Å; Q429-D433 VanDerWaalsContact O-CG 3.27Å; Q429-D433 PolarHBondContact O-N 2.82Å; D433-E436 PolarHBondContact O-N 3.36Å; D433-D437 PolarHBondContact O-N 3.41Å
434	G	96.6	Very high	95.8	Very high	19 Å²	19	67.5 Å²	67.5	20%	0.196	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-43.1	172.8	0	0	0	0	0	113	T430 A431 M432 E436 D437 V438	T430-G434 PolarHBondContact O-N 2.91Å; A431-G434 WeakPolarHBondContact O-CA 3.34Å; A431-G434 PolarHBondContact O-N 3.03Å; M432-G434 PolarHBondContact O-N 3.33Å; G434-E436 VanDerWaalsContact C-N 3.34Å; G434-E436 PolarHBondContact O-N 2.96Å; G434-D437 PolarHBondContact O-N 3.49Å; G434-V438 WeakPolarHBondContact O-CG2 3.33Å; G434-V438 PolarHBondContact O-N 3.33Å
435	F	96.8	Very high	95.6	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.3	-40.8	173.8	-75.8	-68.6	0	0	0	112.5	C412 F413 Y416 A431 M432 D437 V438 I439 L451 Y452 A455	C412-F435 HydrophobicContact CB-CD1 3.91Å; C412-F435 HydrophobicContact CB-CD2 4.3Å; C412-F435 HydrophobicContact CB-CE1 3.82Å; C412-F435 HydrophobicContact CB-CE2 4.23Å; C412-F435 HydrophobicContact CB-CG 4.16Å; C412-F435 HydrophobicContact CB-CZ 4.01Å; F413-F435 HydrophobicContact CB-CE1 4.26Å; F413-F435 HydrophobicContact CB-CZ 3.79Å; F413-F435 HydrophobicContact CD2-CZ 4.08Å; F413-F435 HydrophobicContact CG-CZ 4.46Å; Y416-F435 HydrophobicContact CG-CE2 4.47Å; A431-F435 VanDerWaalsContact O-CD2 3.25Å; A431-F435 WeakPolarHBondContact O-CD2 3.21Å; A431-F435 PolarHBondContact O-N 3.3Å; A431-F435 VanDerWaalsContact O-N 3.1Å; M432-F435 WeakPolarHBondContact O-CB 3.46Å; M432-F435 PolarHBondContact O-N 3.45Å; M432-F435 HydrophobicContact SD-CD2 4.38Å; F435-D437 VanDerWaalsContact C-N 3.31Å; F435-D437 PolarHBondContact O-N 3.4Å; F435-V438 PolarHBondContact O-N 3.08Å; F435-I439 WeakPolarHBondContact O-CG1 3.42Å; F435-I439 PolarHBondContact O-N 2.98Å; F435-L451 HydrophobicContact CE1-CB 3.82Å; F435-L451 HydrophobicContact CZ-CB 4.35Å; F435-Y452 HydrophobicContact CB-CD1 4.43Å; F435-Y452 HydrophobicContact CB-CD2 3.24Å; F435-Y452 HydrophobicContact CB-CE2 3.77Å; F435-Y452 HydrophobicContact CB-CG 3.63Å; F435-Y452 HydrophobicContact CD1-CD2 4.42Å; F435-Y452 AromaticContact CD2-CD2 3.79Å; F435-Y452 HydrophobicContact CD2-CD2 3.79Å; F435-Y452 HydrophobicContact CD2-CE2 4.5Å; F435-Y452 AromaticContact CG-CD2 3.6Å; F435-Y452 HydrophobicContact CG-CD2 3.6Å; F435-Y452 HydrophobicContact CG-CE2 4.45Å; F435-Y452 HydrophobicContact CG-CG 4.06Å; F435-A455 HydrophobicContact CD2-CB 4.46Å; F435-A455 HydrophobicContact CE2-CB 3.86Å; F435-A455 HydrophobicContact CZ-CB 4.4Å
436	E	96.8	Very high	95.5	Very high	85 Å²	85	61.1 Å²	61.1	40%	0.397	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-38.8	175.8	-67.2	-175.2	-174	0	0	111.7	M432 D433 G434 I439 R440 Y452	M432-E436 PolarHBondContact O-N 3.45Å; D433-E436 PolarHBondContact O-N 3.36Å; G434-E436 VanDerWaalsContact C-N 3.34Å; G434-E436 PolarHBondContact O-N 2.96Å; E436-I439 VanDerWaalsContact O-CG1 3.31Å; E436-I439 WeakPolarHBondContact O-CG1 3.27Å; E436-R440 VanDerWaalsContact O-CB 3.23Å; E436-R440 WeakPolarHBondContact O-CB 3.2Å; E436-R440 PolarHBondContact O-N 3.27Å; E436-R440 VanDerWaalsContact O-N 3.08Å; E436-Y452 HydrophobicContact CG-CE1 4.33Å; E436-Y452 WeakPolarHBondContact CG-OH 3.33Å; E436-Y452 PolarHBondContact OE1-OH 2.92Å
437	D	96.3	Very high	95.1	Very high	51 Å²	51	60.1 Å²	60.1	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-43.8	172.6	-173.4	60.5	0	0	0	112.2	D433 G434 F435 R440 R441	D433-D437 PolarHBondContact O-N 3.41Å; G434-D437 PolarHBondContact O-N 3.49Å; F435-D437 VanDerWaalsContact C-N 3.31Å; F435-D437 PolarHBondContact O-N 3.4Å; D437-R440 PolarHBondContact O-N 3.02Å; D437-R440 IonicContact OD1-CZ 2.65Å; D437-R440 IonicContact OD1-NE 2.67Å; D437-R440 IonicContact OD1-NH2 3.56Å; D437-R440 PolarHBondContact OD1-NH2 2.9Å; D437-R441 WeakPolarHBondContact O-CB 3.45Å; D437-R441 WeakPolarHBondContact O-CG 3.25Å; D437-R441 PolarHBondContact O-N 2.83Å; D437-R441 WeakPolarHBondContact OD2-CD 3.46Å; D437-R441 IonicContact OD2-NH1 2.76Å; D437-R441 PolarHBondContact OD2-NH1 3.09Å
438	V	95.5	Very high	94.9	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.018	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-51.9	178.8	170	0	0	0	0	110.9	Q408 A409 G434 F435 R440 R441 F442	Q408-V438 HydrophobicContact CB-CG2 3.96Å; A409-V438 HydrophobicContact CB-CG1 4.06Å; G434-V438 WeakPolarHBondContact O-CG2 3.33Å; G434-V438 PolarHBondContact O-N 3.33Å; F435-V438 PolarHBondContact O-N 3.08Å; V438-R440 VanDerWaalsContact C-N 3.27Å; V438-R440 PolarHBondContact O-N 3.26Å; V438-R441 PolarHBondContact O-N 2.65Å; V438-F442 HydrophobicContact CG1-CD2 4.32Å; V438-F442 WeakPolarHBondContact O-CB 3.49Å; V438-F442 WeakPolarHBondContact O-CD2 3.33Å; V438-F442 PolarHBondContact O-N 3.33Å
439	I	96.1	Very high	95	Very high	29 Å²	29	56.3 Å²	56.3	15%	0.149	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-30.4	-179.1	64.9	-179.5	0	0	0	112	F435 E436 F442 P443 Y449 Y452 M468	F435-I439 WeakPolarHBondContact O-CG1 3.42Å; F435-I439 PolarHBondContact O-N 2.98Å; E436-I439 VanDerWaalsContact O-CG1 3.31Å; E436-I439 WeakPolarHBondContact O-CG1 3.27Å; I439-F442 CarbonylContact O-C 3.46Å; I439-P443 WeakPolarHBondContact O-CA 3.34Å; I439-Y449 HydrophobicContact CB-CD1 4.29Å; I439-Y449 HydrophobicContact CB-CE1 3.79Å; I439-Y449 HydrophobicContact CD1-CE1 4.22Å; I439-Y449 HydrophobicContact CG2-CD1 3.81Å; I439-Y449 HydrophobicContact CG2-CD2 4.5Å; I439-Y449 HydrophobicContact CG2-CE1 3.83Å; I439-Y449 HydrophobicContact CG2-CG 4.16Å; I439-Y452 HydrophobicContact CD1-CD1 4.2Å; I439-Y452 HydrophobicContact CD1-CE1 4.18Å; I439-M468 HydrophobicContact CD1-SD 4.34Å
440	R	97	Very high	94.8	Very high	185 Å²	185	52 Å²	52	70%	0.698	26%	0.255	S	S	*	.	H	α-helix	trans	-68.5	-41.6	175.2	-177.5	-179.1	67	115.1	-1.3	112	E436 D437 V438	E436-R440 VanDerWaalsContact O-CB 3.23Å; E436-R440 WeakPolarHBondContact O-CB 3.2Å; E436-R440 PolarHBondContact O-N 3.27Å; E436-R440 VanDerWaalsContact O-N 3.08Å; D437-R440 PolarHBondContact O-N 3.02Å; D437-R440 IonicContact OD1-CZ 2.65Å; D437-R440 IonicContact OD1-NE 2.67Å; D437-R440 IonicContact OD1-NH2 3.56Å; D437-R440 PolarHBondContact OD1-NH2 2.9Å; V438-R440 VanDerWaalsContact C-N 3.27Å; V438-R440 PolarHBondContact O-N 3.26Å
441	R	96.2	Very high	94.5	Very high	119 Å²	119	48 Å²	48	45%	0.449	23%	0.229	S	C	.	.	H	α-helix	trans	-79.5	-32.7	179.8	-71.7	172.4	62.3	-150.8	-9.7	112.5	Q408 D437 V438 P443	Q408-R441 VanDerWaalsContact OE1-CZ 3.22Å; Q408-R441 VanDerWaalsContact OE1-NH2 3.11Å; D437-R441 WeakPolarHBondContact O-CB 3.45Å; D437-R441 WeakPolarHBondContact O-CG 3.25Å; D437-R441 PolarHBondContact O-N 2.83Å; D437-R441 WeakPolarHBondContact OD2-CD 3.46Å; D437-R441 IonicContact OD2-NH1 2.76Å; D437-R441 PolarHBondContact OD2-NH1 3.09Å; V438-R441 PolarHBondContact O-N 2.65Å; R441-P443 VanDerWaalsContact C-CD 3.46Å; R441-P443 WeakPolarHBondContact O-CD 3.35Å
442	F	95.4	Very high	94.6	Very high	38 Å²	38	48.2 Å²	48.2	17%	0.167	23%	0.229	C	C	.	.			trans	-126	66.9	-176	-52.8	-75.2	0	0	0	111.1	D403 A405 Q408 V438 I439 K444 C445	D403-F442 WeakPolarHBondContact O-CE1 3.39Å; A405-F442 HydrophobicContact CB-CB 3.56Å; A405-F442 HydrophobicContact CB-CD1 3.66Å; A405-F442 HydrophobicContact CB-CD2 3.92Å; A405-F442 HydrophobicContact CB-CE1 4.31Å; A405-F442 HydrophobicContact CB-CG 3.42Å; A405-F442 VanDerWaalsContact CB-CG 3.42Å; Q408-F442 VanDerWaalsContact NE2-CZ 3.3Å; V438-F442 HydrophobicContact CG1-CD2 4.32Å; V438-F442 WeakPolarHBondContact O-CB 3.49Å; V438-F442 WeakPolarHBondContact O-CD2 3.33Å; V438-F442 PolarHBondContact O-N 3.33Å; I439-F442 CarbonylContact O-C 3.46Å; F442-K444 PolarHBondContact O-N 3.44Å; F442-C445 HydrophobicContact CB-CB 4.01Å; F442-C445 WeakPolarHBondContact O-CB 3.4Å; F442-C445 PolarHBondContact O-N 3.35Å
443	P	96.2	Very high	94.5	Very high	74 Å²	74	47.9 Å²	47.9	48%	0.481	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.8	-171.2	27.3	-36.9	0	0	0	114.7	I439 R441 Y449	I439-P443 WeakPolarHBondContact O-CA 3.34Å; R441-P443 VanDerWaalsContact C-CD 3.46Å; R441-P443 WeakPolarHBondContact O-CD 3.35Å; P443-Y449 WeakPolarHBondContact O-CE2 3.45Å; P443-Y449 PolarHBondContact O-OH 3.32Å
444	K	94.2	Very high	94.2	Very high	180 Å²	180	45.1 Å²	45.1	78%	0.783	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	4.7	177.1	-62.3	-172.2	177	-174	0	113.7	F442 A446	F442-K444 PolarHBondContact O-N 3.44Å; K444-A446 PolarHBondContact O-N 2.8Å
445	C	90.8	Very high	93.9	Very high	20 Å²	20	44.2 Å²	44.2	14%	0.135	20%	0.203	C	C	.	.			trans	-85.1	92.9	-180	-176.5	0	0	0	0	110.4	A405 F442 E447 G448 Y449	A405-C445 HydrophobicContact CB-CB 3.78Å; F442-C445 HydrophobicContact CB-CB 4.01Å; F442-C445 WeakPolarHBondContact O-CB 3.4Å; F442-C445 PolarHBondContact O-N 3.35Å; C445-E447 VanDerWaalsContact C-N 3.27Å; C445-E447 PolarHBondContact O-N 3.21Å; C445-G448 PolarHBondContact O-N 3.14Å; C445-G448 VanDerWaalsContact O-N 3.07Å; C445-G448 PolarHBondContact SG-N 3.38Å; C445-G448 VanDerWaalsContact SG-N 3.43Å; C445-Y449 WeakPolarHBondContact O-CD2 3.48Å; C445-Y449 PolarHBondContact O-N 3.27Å
446	A	90.4	Very high	93.8	Very high	7 Å²	7	44.2 Å²	44.2	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-55.7	-40.9	179.2	0	0	0	0	0	112.6	K444 G448 Y449 A450 C472 L475 E476	K444-A446 PolarHBondContact O-N 2.8Å; A446-G448 VanDerWaalsContact C-N 3.3Å; A446-G448 PolarHBondContact O-N 3.37Å; A446-Y449 PolarHBondContact O-N 2.6Å; A446-A450 PolarHBondContact O-N 3.46Å; A446-C472 PolarHBondContact O-SG 3.08Å; A446-C472 VanDerWaalsContact O-SG 3.36Å; A446-L475 HydrophobicContact CB-CB 4.31Å; A446-L475 HydrophobicContact CB-CD1 4.31Å; A446-E476 VanDerWaalsContact CB-CD 3.49Å; A446-E476 HydrophobicContact CB-CG 3.95Å
447	E	87.6	Confident	93.6	Very high	64 Å²	64	40.8 Å²	40.8	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-36.1	176.9	-170.4	64.8	-164.8	0	0	112.6	L406 C445 Y449 A450 L451	L406-E447 HydrophobicContact CD1-CB 4.03Å; L406-E447 HydrophobicContact CD1-CG 3.57Å; C445-E447 VanDerWaalsContact C-N 3.27Å; C445-E447 PolarHBondContact O-N 3.21Å; E447-Y449 PolarHBondContact O-N 2.8Å; E447-A450 PolarHBondContact O-N 2.99Å; E447-L451 HydrophobicContact CG-CD1 4.05Å; E447-L451 HydrophobicContact CG-CG 4.28Å; E447-L451 WeakPolarHBondContact O-CB 3.45Å; E447-L451 WeakPolarHBondContact O-CG 3.33Å; E447-L451 PolarHBondContact O-N 3.28Å
448	G	91.6	Very high	93.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-43.6	175.6	0	0	0	0	0	112.3	C445 A446 Y452	C445-G448 PolarHBondContact O-N 3.14Å; C445-G448 VanDerWaalsContact O-N 3.07Å; C445-G448 PolarHBondContact SG-N 3.38Å; C445-G448 VanDerWaalsContact SG-N 3.43Å; A446-G448 VanDerWaalsContact C-N 3.3Å; A446-G448 PolarHBondContact O-N 3.37Å; G448-Y452 VanDerWaalsContact O-CB 3.28Å; G448-Y452 WeakPolarHBondContact O-CB 3.47Å; G448-Y452 PolarHBondContact O-N 2.86Å; G448-Y452 VanDerWaalsContact O-N 3.12Å
449	Y	96.1	Very high	93.1	Very high	27 Å²	27	43.5 Å²	43.5	11%	0.106	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-40.4	173.1	-64.9	-80.8	0	0	0	111.7	I439 P443 C445 A446 E447 Y452 A453 M468 K471 C472 L475	I439-Y449 HydrophobicContact CB-CD1 4.29Å; I439-Y449 HydrophobicContact CB-CE1 3.79Å; I439-Y449 HydrophobicContact CD1-CE1 4.22Å; I439-Y449 HydrophobicContact CG2-CD1 3.81Å; I439-Y449 HydrophobicContact CG2-CD2 4.5Å; I439-Y449 HydrophobicContact CG2-CE1 3.83Å; I439-Y449 HydrophobicContact CG2-CG 4.16Å; P443-Y449 WeakPolarHBondContact O-CE2 3.45Å; P443-Y449 PolarHBondContact O-OH 3.32Å; C445-Y449 WeakPolarHBondContact O-CD2 3.48Å; C445-Y449 PolarHBondContact O-N 3.27Å; A446-Y449 PolarHBondContact O-N 2.6Å; E447-Y449 PolarHBondContact O-N 2.8Å; Y449-Y452 PolarHBondContact O-N 3.45Å; Y449-A453 VanDerWaalsContact O-CB 3.3Å; Y449-A453 WeakPolarHBondContact O-CB 3.22Å; Y449-A453 PolarHBondContact O-N 3Å; Y449-M468 HydrophobicContact CD1-SD 3.8Å; Y449-M468 HydrophobicContact CE1-SD 4.41Å; Y449-K471 HydrophobicContact CD1-CB 3.9Å; Y449-K471 HydrophobicContact CD1-CG 4.42Å; Y449-K471 HydrophobicContact CE1-CB 4.09Å; Y449-K471 HydrophobicContact CE1-CG 4.27Å; Y449-K471 HydrophobicContact CG-CB 4.14Å; Y449-C472 WeakPolarHBondContact CB-SG 3.33Å; Y449-L475 HydrophobicContact CD2-CD1 3.76Å; Y449-L475 HydrophobicContact CE2-CD1 3.61Å
450	A	91.7	Very high	93	Very high	9 Å²	9	49 Å²	49	7%	0.074	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-47.9	-178.8	0	0	0	0	0	112	A446 E447 Y452 A453 Q454 C472	A446-A450 PolarHBondContact O-N 3.46Å; E447-A450 PolarHBondContact O-N 2.99Å; A450-Y452 VanDerWaalsContact C-N 3.34Å; A450-Y452 PolarHBondContact O-N 2.87Å; A450-A453 WeakPolarHBondContact O-CB 3.28Å; A450-A453 PolarHBondContact O-N 3.21Å; A450-Q454 WeakPolarHBondContact O-CG 3.11Å; A450-Q454 PolarHBondContact O-N 3.43Å; A450-C472 PolarHBondContact N-SG 2.94Å; A450-C472 VanDerWaalsContact N-SG 3.38Å
451	L	91.5	Very high	92.9	Very high	9 Å²	9	43.6 Å²	43.6	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-37.4	176.9	-67.7	175	0	0	0	111.8	A409 Q410 F413 F435 E447 Q454 A455	A409-L451 HydrophobicContact CB-CD1 4.11Å; Q410-L451 HydrophobicContact CG-CD1 4.03Å; F413-L451 HydrophobicContact CB-CD1 4.21Å; F413-L451 HydrophobicContact CB-CD2 4.49Å; F413-L451 HydrophobicContact CD1-CD2 4.38Å; F413-L451 HydrophobicContact CD2-CB 4.19Å; F413-L451 HydrophobicContact CD2-CD2 3.94Å; F413-L451 HydrophobicContact CE2-CD2 4.22Å; F413-L451 HydrophobicContact CG-CD2 4.02Å; F435-L451 HydrophobicContact CE1-CB 3.82Å; F435-L451 HydrophobicContact CZ-CB 4.35Å; E447-L451 HydrophobicContact CG-CD1 4.05Å; E447-L451 HydrophobicContact CG-CG 4.28Å; E447-L451 WeakPolarHBondContact O-CB 3.45Å; E447-L451 WeakPolarHBondContact O-CG 3.33Å; E447-L451 PolarHBondContact O-N 3.28Å; L451-Q454 PolarHBondContact O-N 2.92Å; L451-A455 PolarHBondContact O-N 3.09Å
452	Y	96.6	Very high	92.9	Very high	9 Å²	9	39.3 Å²	39.3	4%	0.035	19%	0.193	C	C	.	.	H	α-helix	trans	-66.7	-40.5	174.2	-175.5	-139.9	0	0	0	111.9	M432 F435 E436 I439 G448 Y449 A450 Q454 A455 L456 M468	M432-Y452 HydrophobicContact CE-CD2 4.1Å; M432-Y452 HydrophobicContact CE-CE2 3.6Å; M432-Y452 HydrophobicContact SD-CE2 4.39Å; F435-Y452 HydrophobicContact CB-CD1 4.43Å; F435-Y452 HydrophobicContact CB-CD2 3.24Å; F435-Y452 HydrophobicContact CB-CE2 3.77Å; F435-Y452 HydrophobicContact CB-CG 3.63Å; F435-Y452 HydrophobicContact CD1-CD2 4.42Å; F435-Y452 AromaticContact CD2-CD2 3.79Å; F435-Y452 HydrophobicContact CD2-CD2 3.79Å; F435-Y452 HydrophobicContact CD2-CE2 4.5Å; F435-Y452 AromaticContact CG-CD2 3.6Å; F435-Y452 HydrophobicContact CG-CD2 3.6Å; F435-Y452 HydrophobicContact CG-CE2 4.45Å; F435-Y452 HydrophobicContact CG-CG 4.06Å; E436-Y452 HydrophobicContact CG-CE1 4.33Å; E436-Y452 WeakPolarHBondContact CG-OH 3.33Å; E436-Y452 PolarHBondContact OE1-OH 2.92Å; I439-Y452 HydrophobicContact CD1-CD1 4.2Å; I439-Y452 HydrophobicContact CD1-CE1 4.18Å; G448-Y452 VanDerWaalsContact O-CB 3.28Å; G448-Y452 WeakPolarHBondContact O-CB 3.47Å; G448-Y452 PolarHBondContact O-N 2.86Å; G448-Y452 VanDerWaalsContact O-N 3.12Å; Y449-Y452 PolarHBondContact O-N 3.45Å; A450-Y452 VanDerWaalsContact C-N 3.34Å; A450-Y452 PolarHBondContact O-N 2.87Å; Y452-Q454 VanDerWaalsContact C-N 3.31Å; Y452-Q454 PolarHBondContact O-N 2.84Å; Y452-A455 PolarHBondContact O-N 3.03Å; Y452-L456 HydrophobicContact CD1-CD1 3.86Å; Y452-L456 HydrophobicContact CD2-CD1 4.14Å; Y452-L456 HydrophobicContact CD2-CG 4.05Å; Y452-L456 HydrophobicContact CE1-CD1 3.66Å; Y452-L456 HydrophobicContact CE1-CG 4.41Å; Y452-L456 HydrophobicContact CE2-CD1 4.02Å; Y452-L456 HydrophobicContact CE2-CD2 4.06Å; Y452-L456 HydrophobicContact CE2-CG 3.86Å; Y452-L456 HydrophobicContact CG-CD1 4.07Å; Y452-L456 HydrophobicContact CG-CG 4.45Å; Y452-L456 WeakPolarHBondContact O-CB 3.22Å; Y452-L456 VanDerWaalsContact O-CG 3.26Å; Y452-L456 WeakPolarHBondContact O-CG 3.36Å; Y452-L456 PolarHBondContact O-N 2.98Å; Y452-M468 HydrophobicContact CD1-CG 3.7Å; Y452-M468 HydrophobicContact CD1-SD 3.6Å; Y452-M468 VanDerWaalsContact CD1-SD 3.6Å; Y452-M468 HydrophobicContact CE1-CG 4.13Å; Y452-M468 HydrophobicContact CE1-SD 3.85Å
453	A	95	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-41	174.5	0	0	0	0	0	111.8	Y449 A450 L456 T457 A465 M468 Y469	Y449-A453 VanDerWaalsContact O-CB 3.3Å; Y449-A453 WeakPolarHBondContact O-CB 3.22Å; Y449-A453 PolarHBondContact O-N 3Å; A450-A453 WeakPolarHBondContact O-CB 3.28Å; A450-A453 PolarHBondContact O-N 3.21Å; A453-L456 PolarHBondContact O-N 3.42Å; A453-T457 WeakPolarHBondContact O-CB 3.02Å; A453-T457 PolarHBondContact O-N 2.92Å; A453-T457 PolarHBondContact O-OG1 3.32Å; A453-A465 WeakPolarHBondContact O-CB 3.18Å; A453-M468 HydrophobicContact CB-CB 3.66Å; A453-Y469 HydrophobicContact CB-CD1 3.87Å; A453-Y469 HydrophobicContact CB-CD2 4.01Å; A453-Y469 HydrophobicContact CB-CE1 3.53Å; A453-Y469 HydrophobicContact CB-CE2 3.7Å; A453-Y469 HydrophobicContact CB-CG 4.08Å; A453-Y469 VanDerWaalsContact CB-CZ 3.44Å
454	Q	90.1	Very high	93.1	Very high	20 Å²	20	40.1 Å²	40.1	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-49.1	174.2	-70.1	175.5	16	0	0	111.2	P27 A450 L451 Y452 L456 T457 D458	P27-Q454 HydrophobicContact CG-CG 4.11Å; A450-Q454 WeakPolarHBondContact O-CG 3.11Å; A450-Q454 PolarHBondContact O-N 3.43Å; L451-Q454 PolarHBondContact O-N 2.92Å; Y452-Q454 VanDerWaalsContact C-N 3.31Å; Y452-Q454 PolarHBondContact O-N 2.84Å; Q454-L456 VanDerWaalsContact C-N 3.33Å; Q454-L456 PolarHBondContact O-N 3.23Å; Q454-T457 WeakPolarHBondContact O-CB 3.49Å; Q454-T457 PolarHBondContact O-N 3.47Å; Q454-T457 VanDerWaalsContact O-N 3.13Å; Q454-D458 PolarHBondContact O-N 3.44Å
455	A	89.7	Confident	93.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-41.1	176.9	0	0	0	0	0	112.2	Y416 M432 F435 L451 Y452 T457 D458 Q459	Y416-A455 HydrophobicContact CD1-CB 3.93Å; Y416-A455 HydrophobicContact CD2-CB 4.14Å; Y416-A455 HydrophobicContact CE1-CB 3.87Å; Y416-A455 HydrophobicContact CE2-CB 4.09Å; Y416-A455 HydrophobicContact CG-CB 4.08Å; M432-A455 HydrophobicContact CE-CB 4.24Å; M432-A455 HydrophobicContact SD-CB 3.79Å; F435-A455 HydrophobicContact CD2-CB 4.46Å; F435-A455 HydrophobicContact CE2-CB 3.86Å; F435-A455 HydrophobicContact CZ-CB 4.4Å; L451-A455 PolarHBondContact O-N 3.09Å; Y452-A455 PolarHBondContact O-N 3.03Å; A455-T457 VanDerWaalsContact C-N 3.34Å; A455-T457 PolarHBondContact O-N 2.87Å; A455-D458 PolarHBondContact O-N 2.71Å; A455-Q459 VanDerWaalsContact O-CG 3.3Å; A455-Q459 WeakPolarHBondContact O-CG 3.32Å; A455-Q459 PolarHBondContact O-N 3.49Å
456	L	95.3	Very high	93.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-38.7	174.4	-73.8	166	0	0	0	112.4	M432 Y452 A453 Q454 Q459 Q460 Q461 K464 A465 M468	M432-L456 HydrophobicContact CE-CD2 3.48Å; M432-L456 VanDerWaalsContact CE-CD2 3.48Å; M432-L456 HydrophobicContact CE-CG 3.77Å; Y452-L456 HydrophobicContact CD1-CD1 3.86Å; Y452-L456 HydrophobicContact CD2-CD1 4.14Å; Y452-L456 HydrophobicContact CD2-CG 4.05Å; Y452-L456 HydrophobicContact CE1-CD1 3.66Å; Y452-L456 HydrophobicContact CE1-CG 4.41Å; Y452-L456 HydrophobicContact CE2-CD1 4.02Å; Y452-L456 HydrophobicContact CE2-CD2 4.06Å; Y452-L456 HydrophobicContact CE2-CG 3.86Å; Y452-L456 HydrophobicContact CG-CD1 4.07Å; Y452-L456 HydrophobicContact CG-CG 4.45Å; Y452-L456 WeakPolarHBondContact O-CB 3.22Å; Y452-L456 VanDerWaalsContact O-CG 3.26Å; Y452-L456 WeakPolarHBondContact O-CG 3.36Å; Y452-L456 PolarHBondContact O-N 2.98Å; A453-L456 PolarHBondContact O-N 3.42Å; Q454-L456 VanDerWaalsContact C-N 3.33Å; Q454-L456 PolarHBondContact O-N 3.23Å; L456-Q459 CarbonylContact O-C 3.49Å; L456-Q459 PolarHBondContact O-N 2.85Å; L456-Q460 PolarHBondContact O-N 3.32Å; L456-Q460 VanDerWaalsContact O-N 3.14Å; L456-Q461 HydrophobicContact CB-CB 4.31Å; L456-Q461 HydrophobicContact CD2-CB 3.8Å; L456-Q461 HydrophobicContact CD2-CG 4.41Å; L456-Q461 PolarHBondContact O-N 3.47Å; L456-K464 HydrophobicContact CD1-CB 3.85Å; L456-K464 HydrophobicContact CD2-CB 4.13Å; L456-K464 HydrophobicContact CD2-CD 4.2Å; L456-A465 HydrophobicContact CB-CB 3.8Å; L456-M468 HydrophobicContact CD1-CG 3.75Å
457	T	92.7	Very high	94	Very high	12 Å²	12	37 Å²	37	7%	0.074	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-45.3	177.3	-59.4	0	0	0	0	110.9	A453 Q454 A455 Q459 Q460 F462 A465 L489	A453-T457 WeakPolarHBondContact O-CB 3.02Å; A453-T457 PolarHBondContact O-N 2.92Å; A453-T457 PolarHBondContact O-OG1 3.32Å; Q454-T457 WeakPolarHBondContact O-CB 3.49Å; Q454-T457 PolarHBondContact O-N 3.47Å; Q454-T457 VanDerWaalsContact O-N 3.13Å; A455-T457 VanDerWaalsContact C-N 3.34Å; A455-T457 PolarHBondContact O-N 2.87Å; T457-Q459 VanDerWaalsContact C-N 3.29Å; T457-Q459 PolarHBondContact O-N 3.3Å; T457-Q460 WeakPolarHBondContact O-CA 3.47Å; T457-Q460 PolarHBondContact O-N 2.98Å; T457-F462 HydrophobicContact CG2-CD1 4.33Å; T457-F462 HydrophobicContact CG2-CE1 4.2Å; T457-A465 WeakPolarHBondContact OG1-CB 3.12Å; T457-L489 HydrophobicContact CG2-CD1 3.95Å
458	D	89.1	Confident	94.5	Very high	48 Å²	48	35.2 Å²	35.2	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-60.6	-38.4	174.5	-76.6	-8.5	0	0	0	111.9	Y416 Q454 A455 Q460	Y416-D458 HydrophobicContact CE1-CB 4.48Å; Y416-D458 WeakPolarHBondContact OH-CB 3.18Å; Q454-D458 PolarHBondContact O-N 3.44Å; A455-D458 PolarHBondContact O-N 2.71Å; D458-Q460 PolarHBondContact O-N 3.29Å
459	Q	91.8	Very high	94.8	Very high	64 Å²	64	35.4 Å²	35.4	30%	0.299	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	5.8	174	-64	-58.4	-49.1	0	0	113.9	Y416 Y420 M432 A455 L456 T457 Q461	Y416-Q459 HydrophobicContact CE2-CG 4.13Å; Y416-Q459 PolarHBondContact OH-NE2 3.07Å; Y416-Q459 VanDerWaalsContact OH-NE2 3.08Å; Y420-Q459 VanDerWaalsContact CD2-NE2 3.33Å; M432-Q459 HydrophobicContact CE-CG 4.39Å; A455-Q459 VanDerWaalsContact O-CG 3.3Å; A455-Q459 WeakPolarHBondContact O-CG 3.32Å; A455-Q459 PolarHBondContact O-N 3.49Å; L456-Q459 CarbonylContact O-C 3.49Å; L456-Q459 PolarHBondContact O-N 2.85Å; T457-Q459 VanDerWaalsContact C-N 3.29Å; T457-Q459 PolarHBondContact O-N 3.3Å; Q459-Q461 HydrophobicContact CB-CG 4.34Å; Q459-Q461 PolarHBondContact O-N 3.38Å; Q459-Q461 VanDerWaalsContact O-N 3.15Å
460	Q	93.5	Very high	94.9	Very high	144 Å²	144	37 Å²	37	67%	0.673	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	20.2	-178.4	-53.1	176.8	34.1	0	0	114.2	L456 T457 D458 F462	L456-Q460 PolarHBondContact O-N 3.32Å; L456-Q460 VanDerWaalsContact O-N 3.14Å; T457-Q460 WeakPolarHBondContact O-CA 3.47Å; T457-Q460 PolarHBondContact O-N 2.98Å; D458-Q460 PolarHBondContact O-N 3.29Å; Q460-F462 HydrophobicContact CB-CE1 4.42Å; Q460-F462 HydrophobicContact CB-CE2 3.85Å; Q460-F462 HydrophobicContact CB-CZ 3.78Å; Q460-F462 HydrophobicContact CG-CE2 4.4Å; Q460-F462 HydrophobicContact CG-CZ 3.94Å; Q460-F462 WeakPolarHBondContact O-CD2 3.49Å; Q460-F462 PolarHBondContact O-N 2.9Å
461	Q	96.4	Very high	95.2	Very high	72 Å²	72	40.3 Å²	40.3	34%	0.336	20%	0.199	S	C	.	.			trans	-85.5	55	174.1	-64.7	-171.6	46.2	0	0	110.7	L456 Q459 G463 K464 A465	L456-Q461 HydrophobicContact CB-CB 4.31Å; L456-Q461 HydrophobicContact CD2-CB 3.8Å; L456-Q461 HydrophobicContact CD2-CG 4.41Å; L456-Q461 PolarHBondContact O-N 3.47Å; Q459-Q461 HydrophobicContact CB-CG 4.34Å; Q459-Q461 PolarHBondContact O-N 3.38Å; Q459-Q461 VanDerWaalsContact O-N 3.15Å; Q461-G463 VanDerWaalsContact C-N 3.33Å; Q461-G463 PolarHBondContact O-N 2.93Å; Q461-K464 PolarHBondContact O-N 3.3Å; Q461-K464 VanDerWaalsContact O-N 3.13Å; Q461-A465 PolarHBondContact O-N 3.39Å
462	F	96.1	Very high	95.4	Very high	29 Å²	29	39.9 Å²	39.9	13%	0.127	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-37.8	-167.5	-54.5	-59.3	0	0	0	114.3	T457 Q460 K464 A465 D466 L489 Q492 W493	T457-F462 HydrophobicContact CG2-CD1 4.33Å; T457-F462 HydrophobicContact CG2-CE1 4.2Å; Q460-F462 HydrophobicContact CB-CE1 4.42Å; Q460-F462 HydrophobicContact CB-CE2 3.85Å; Q460-F462 HydrophobicContact CB-CZ 3.78Å; Q460-F462 HydrophobicContact CG-CE2 4.4Å; Q460-F462 HydrophobicContact CG-CZ 3.94Å; Q460-F462 WeakPolarHBondContact O-CD2 3.49Å; Q460-F462 PolarHBondContact O-N 2.9Å; F462-K464 VanDerWaalsContact C-N 3.34Å; F462-K464 PolarHBondContact O-N 3.41Å; F462-A465 PolarHBondContact O-N 3.31Å; F462-D466 WeakPolarHBondContact O-CB 3.21Å; F462-D466 PolarHBondContact O-N 3.34Å; F462-L489 HydrophobicContact CB-CD1 4.03Å; F462-L489 HydrophobicContact CD1-CD1 3.56Å; F462-L489 HydrophobicContact CE1-CD1 4.48Å; F462-L489 HydrophobicContact CG-CD1 4.22Å; F462-Q492 HydrophobicContact CE1-CG 4.01Å; F462-Q492 HydrophobicContact CZ-CG 4.22Å; F462-W493 HydrophobicContact CB-CB 3.72Å; F462-W493 HydrophobicContact CB-CD2 3.47Å; F462-W493 VanDerWaalsContact CB-CD2 3.47Å; F462-W493 HydrophobicContact CB-CE3 4.08Å; F462-W493 HydrophobicContact CB-CG 3.28Å; F462-W493 HydrophobicContact CD1-CB 4.19Å; F462-W493 HydrophobicContact CD2-CB 4.01Å; F462-W493 AromaticContact CD2-CD1 3.33Å; F462-W493 AromaticContact CD2-CG 3.77Å; F462-W493 HydrophobicContact CD2-CG 3.77Å; F462-W493 HydrophobicContact CG-CB 3.71Å; F462-W493 AromaticContact CG-CD1 3.69Å; F462-W493 HydrophobicContact CG-CD2 4.36Å; F462-W493 AromaticContact CG-CG 3.65Å; F462-W493 HydrophobicContact CG-CG 3.65Å
463	G	97.7	Very high	95.4	Very high	31 Å²	31	40.9 Å²	40.9	32%	0.32	20%	0.202	S	C	.	.	H	α-helix	trans	-64.8	-35.8	179.3	0	0	0	0	0	113.5	Q461 Q467	Q461-G463 VanDerWaalsContact C-N 3.33Å; Q461-G463 PolarHBondContact O-N 2.93Å; G463-Q467 WeakPolarHBondContact O-CG 3.27Å; G463-Q467 PolarHBondContact O-N 2.91Å
464	K	97.9	Very high	95.5	Very high	97 Å²	97	46.8 Å²	46.8	42%	0.422	23%	0.23	S	C	.	.	H	α-helix	trans	-73.9	-41.2	172.8	-72.9	-172	179.4	-179.2	0	111	L456 Q461 F462 D466 Q467 M468	L456-K464 HydrophobicContact CD1-CB 3.85Å; L456-K464 HydrophobicContact CD2-CB 4.13Å; L456-K464 HydrophobicContact CD2-CD 4.2Å; Q461-K464 PolarHBondContact O-N 3.3Å; Q461-K464 VanDerWaalsContact O-N 3.13Å; F462-K464 VanDerWaalsContact C-N 3.34Å; F462-K464 PolarHBondContact O-N 3.41Å; K464-D466 VanDerWaalsContact C-N 3.25Å; K464-D466 PolarHBondContact O-N 3.37Å; K464-Q467 WeakPolarHBondContact O-CB 3.44Å; K464-Q467 PolarHBondContact O-N 2.94Å; K464-M468 WeakPolarHBondContact O-CG 3.36Å; K464-M468 PolarHBondContact O-N 3.01Å
465	A	97.4	Very high	95.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-42	176.8	0	0	0	0	0	111.6	A453 L456 T457 Q461 F462 Q467 M468 Y469 L489	A453-A465 WeakPolarHBondContact O-CB 3.18Å; L456-A465 HydrophobicContact CB-CB 3.8Å; T457-A465 WeakPolarHBondContact OG1-CB 3.12Å; Q461-A465 PolarHBondContact O-N 3.39Å; F462-A465 PolarHBondContact O-N 3.31Å; A465-Q467 VanDerWaalsContact C-N 3.35Å; A465-Q467 PolarHBondContact O-N 3.48Å; A465-M468 WeakPolarHBondContact O-CB 3.43Å; A465-M468 PolarHBondContact O-N 2.92Å; A465-M468 VanDerWaalsContact O-N 3.12Å; A465-Y469 VanDerWaalsContact O-CD2 3.29Å; A465-Y469 WeakPolarHBondContact O-CD2 3.1Å; A465-Y469 PolarHBondContact O-N 2.99Å; A465-L489 HydrophobicContact CB-CD1 4.23Å; A465-L489 HydrophobicContact CB-CD2 3.96Å
466	D	97.9	Very high	95.9	Very high	26 Å²	26	52.3 Å²	52.3	14%	0.139	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-42.5	178	-165.3	44.4	0	0	0	112.2	F462 K464 M468 Y469 D470 K486 L489 Q490 W493	F462-D466 WeakPolarHBondContact O-CB 3.21Å; F462-D466 PolarHBondContact O-N 3.34Å; K464-D466 VanDerWaalsContact C-N 3.25Å; K464-D466 PolarHBondContact O-N 3.37Å; D466-M468 VanDerWaalsContact C-N 3.32Å; D466-M468 PolarHBondContact O-N 2.7Å; D466-Y469 PolarHBondContact O-N 2.98Å; D466-D470 PolarHBondContact O-N 3.35Å; D466-K486 WeakPolarHBondContact OD1-CE 3.49Å; D466-K486 IonicContact OD1-NZ 3.2Å; D466-K486 PolarHBondContact OD1-NZ 2.83Å; D466-K486 IonicContact OD2-NZ 3.7Å; D466-L489 HydrophobicContact CB-CD2 3.78Å; D466-Q490 PolarHBondContact OD1-NE2 2.68Å; D466-W493 HydrophobicContact CB-CZ3 4.12Å
467	Q	98.2	Very high	95.9	Very high	117 Å²	117	55.5 Å²	55.5	55%	0.547	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-36.4	174.6	-67	173.3	11.7	0	0	112.3	G463 K464 A465 D470 K471	G463-Q467 WeakPolarHBondContact O-CG 3.27Å; G463-Q467 PolarHBondContact O-N 2.91Å; K464-Q467 WeakPolarHBondContact O-CB 3.44Å; K464-Q467 PolarHBondContact O-N 2.94Å; A465-Q467 VanDerWaalsContact C-N 3.35Å; A465-Q467 PolarHBondContact O-N 3.48Å; Q467-D470 PolarHBondContact O-N 3Å; Q467-K471 PolarHBondContact O-N 3.37Å
468	M	98.3	Very high	95.8	Very high	25 Å²	25	60.2 Å²	60.2	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-68.5	-39.9	177	-63.5	-53	91.1	0	0	111	I439 Y449 Y452 A453 L456 K464 A465 D466 D470 K471 C472	I439-M468 HydrophobicContact CD1-SD 4.34Å; Y449-M468 HydrophobicContact CD1-SD 3.8Å; Y449-M468 HydrophobicContact CE1-SD 4.41Å; Y452-M468 HydrophobicContact CD1-CG 3.7Å; Y452-M468 HydrophobicContact CD1-SD 3.6Å; Y452-M468 VanDerWaalsContact CD1-SD 3.6Å; Y452-M468 HydrophobicContact CE1-CG 4.13Å; Y452-M468 HydrophobicContact CE1-SD 3.85Å; A453-M468 HydrophobicContact CB-CB 3.66Å; L456-M468 HydrophobicContact CD1-CG 3.75Å; K464-M468 WeakPolarHBondContact O-CG 3.36Å; K464-M468 PolarHBondContact O-N 3.01Å; A465-M468 WeakPolarHBondContact O-CB 3.43Å; A465-M468 PolarHBondContact O-N 2.92Å; A465-M468 VanDerWaalsContact O-N 3.12Å; D466-M468 VanDerWaalsContact C-N 3.32Å; D466-M468 PolarHBondContact O-N 2.7Å; M468-D470 VanDerWaalsContact C-N 3.34Å; M468-K471 WeakPolarHBondContact O-CB 3.44Å; M468-K471 PolarHBondContact O-N 3.11Å; M468-C472 PolarHBondContact O-N 2.91Å; M468-C472 PolarHBondContact O-SG 3.49Å; M468-C472 VanDerWaalsContact O-SG 3.37Å
469	Y	97.4	Very high	95.8	Very high	5 Å²	5	59.3 Å²	59.3	2%	0.02	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-35.5	171.8	-69.9	-53.3	0	0	0	112.7	A453 A465 D466 K471 C472 I473 T482 H485 K486 L489	A453-Y469 HydrophobicContact CB-CD1 3.87Å; A453-Y469 HydrophobicContact CB-CD2 4.01Å; A453-Y469 HydrophobicContact CB-CE1 3.53Å; A453-Y469 HydrophobicContact CB-CE2 3.7Å; A453-Y469 HydrophobicContact CB-CG 4.08Å; A453-Y469 VanDerWaalsContact CB-CZ 3.44Å; A465-Y469 VanDerWaalsContact O-CD2 3.29Å; A465-Y469 WeakPolarHBondContact O-CD2 3.1Å; A465-Y469 PolarHBondContact O-N 2.99Å; D466-Y469 PolarHBondContact O-N 2.98Å; Y469-K471 VanDerWaalsContact C-N 3.3Å; Y469-K471 PolarHBondContact O-N 3.48Å; Y469-C472 WeakPolarHBondContact O-CB 3.34Å; Y469-C472 PolarHBondContact O-N 3.24Å; Y469-I473 WeakPolarHBondContact O-CG1 3.33Å; Y469-I473 PolarHBondContact O-N 3.41Å; Y469-T482 HydrophobicContact CD1-CG2 4.22Å; Y469-H485 HydrophobicContact CD1-CB 4.16Å; Y469-H485 HydrophobicContact CE1-CB 3.5Å; Y469-H485 VanDerWaalsContact CE1-CB 3.5Å; Y469-H485 HydrophobicContact CE2-CB 4.38Å; Y469-K486 HydrophobicContact CD2-CB 4.41Å; Y469-K486 HydrophobicContact CG-CB 4.3Å; Y469-L489 HydrophobicContact CD2-CD2 3.7Å; Y469-L489 HydrophobicContact CE2-CB 4.22Å; Y469-L489 HydrophobicContact CE2-CD2 3.9Å
470	D	98.4	Very high	95.8	Very high	59 Å²	59	56.4 Å²	56.4	32%	0.316	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-41	171	-73.2	-32.2	0	0	0	111.5	D466 Q467 M468 I473 E474 K486	D466-D470 PolarHBondContact O-N 3.35Å; Q467-D470 PolarHBondContact O-N 3Å; M468-D470 VanDerWaalsContact C-N 3.34Å; D470-I473 PolarHBondContact O-N 3.07Å; D470-E474 WeakPolarHBondContact O-CG 3.47Å; D470-E474 PolarHBondContact O-N 3.5Å; D470-K486 WeakPolarHBondContact OD1-CE 3.44Å; D470-K486 IonicContact OD1-NZ 3.64Å; D470-K486 PolarHBondContact OD1-NZ 2.86Å; D470-K486 IonicContact OD2-NZ 3.35Å; D470-K486 PolarHBondContact OD2-NZ 3.35Å
471	K	98.1	Very high	95.7	Very high	79 Å²	79	51.5 Å²	51.5	34%	0.343	27%	0.265	S	S	.	.	H	α-helix	trans	-64.1	-38.1	173.2	-69.3	-49.5	-175.4	-163	0	113.3	Y449 Q467 M468 Y469 I473 E474 L475	Y449-K471 HydrophobicContact CD1-CB 3.9Å; Y449-K471 HydrophobicContact CD1-CG 4.42Å; Y449-K471 HydrophobicContact CE1-CB 4.09Å; Y449-K471 HydrophobicContact CE1-CG 4.27Å; Y449-K471 HydrophobicContact CG-CB 4.14Å; Q467-K471 PolarHBondContact O-N 3.37Å; M468-K471 WeakPolarHBondContact O-CB 3.44Å; M468-K471 PolarHBondContact O-N 3.11Å; Y469-K471 VanDerWaalsContact C-N 3.3Å; Y469-K471 PolarHBondContact O-N 3.48Å; K471-I473 VanDerWaalsContact C-N 3.34Å; K471-E474 VanDerWaalsContact CD-OE2 3.29Å; K471-E474 WeakPolarHBondContact CD-OE2 3.16Å; K471-E474 IonicContact NZ-OE1 3.82Å; K471-E474 PolarHBondContact NZ-OE1 3Å; K471-E474 IonicContact NZ-OE2 2.87Å; K471-E474 PolarHBondContact NZ-OE2 3.18Å; K471-E474 PolarHBondContact O-N 3.39Å; K471-L475 VanDerWaalsContact O-CG 3.3Å; K471-L475 WeakPolarHBondContact O-CG 3.35Å; K471-L475 PolarHBondContact O-N 3.42Å; K471-L475 VanDerWaalsContact O-N 3.09Å
472	C	95.9	Very high	95.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	25%	0.25	C	C	.	.	H	α-helix	trans	-59.3	-45.6	171	-65.3	0	0	0	0	111.5	A446 Y449 A450 M468 Y469 L475 E476 T482	A446-C472 PolarHBondContact O-SG 3.08Å; A446-C472 VanDerWaalsContact O-SG 3.36Å; Y449-C472 WeakPolarHBondContact CB-SG 3.33Å; A450-C472 PolarHBondContact N-SG 2.94Å; A450-C472 VanDerWaalsContact N-SG 3.38Å; M468-C472 PolarHBondContact O-N 2.91Å; M468-C472 PolarHBondContact O-SG 3.49Å; M468-C472 VanDerWaalsContact O-SG 3.37Å; Y469-C472 WeakPolarHBondContact O-CB 3.34Å; Y469-C472 PolarHBondContact O-N 3.24Å; C472-L475 PolarHBondContact O-N 2.74Å; C472-E476 PolarHBondContact O-N 2.72Å; C472-T482 HydrophobicContact CB-CG2 3.4Å
473	I	97	Very high	95.6	Very high	29 Å²	29	47.5 Å²	47.5	15%	0.149	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-39.6	179.1	-66.4	168.3	0	0	0	111.6	Y469 D470 K471 L475 E476 P477 T482 Y483 K486	Y469-I473 WeakPolarHBondContact O-CG1 3.33Å; Y469-I473 PolarHBondContact O-N 3.41Å; D470-I473 PolarHBondContact O-N 3.07Å; K471-I473 VanDerWaalsContact C-N 3.34Å; I473-L475 VanDerWaalsContact C-N 3.31Å; I473-L475 PolarHBondContact O-N 3.12Å; I473-E476 CarbonylContact O-C 3.46Å; I473-P477 VanDerWaalsContact O-CA 3.31Å; I473-P477 WeakPolarHBondContact O-CA 3.36Å; I473-P477 WeakPolarHBondContact O-CD 3.39Å; I473-P477 WeakPolarHBondContact O-CG 3.39Å; I473-P477 VanDerWaalsContact O-N 3.15Å; I473-T482 HydrophobicContact CD1-CG2 4.3Å; I473-T482 HydrophobicContact CG1-CG2 3.59Å; I473-Y483 HydrophobicContact CD1-CD1 4.08Å; I473-Y483 HydrophobicContact CD1-CE1 3.85Å; I473-Y483 HydrophobicContact CG1-CE1 4.31Å; I473-Y483 HydrophobicContact CG1-CE2 4.14Å; I473-Y483 HydrophobicContact CG2-CE1 4.34Å; I473-Y483 HydrophobicContact CG2-CE2 4.35Å; I473-Y483 WeakPolarHBondContact CG2-OH 3.41Å; I473-K486 HydrophobicContact CD1-CD 3.81Å
474	E	97.4	Very high	95.3	Very high	124 Å²	124	46 Å²	46	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-62.1	-38.6	175.6	-75.2	176.6	-158.2	0	0	112.2	D470 K471	D470-E474 WeakPolarHBondContact O-CG 3.47Å; D470-E474 PolarHBondContact O-N 3.5Å; K471-E474 VanDerWaalsContact CD-OE2 3.29Å; K471-E474 WeakPolarHBondContact CD-OE2 3.16Å; K471-E474 IonicContact NZ-OE1 3.82Å; K471-E474 PolarHBondContact NZ-OE1 3Å; K471-E474 IonicContact NZ-OE2 2.87Å; K471-E474 PolarHBondContact NZ-OE2 3.18Å; K471-E474 PolarHBondContact O-N 3.39Å
475	L	94.8	Very high	95	Very high	67 Å²	67	41.8 Å²	41.8	35%	0.351	21%	0.213	S	C	.	.	H	α-helix	trans	-79.1	-39.6	-179.1	-69.4	173.7	0	0	0	112.6	A446 Y449 K471 C472 I473	A446-L475 HydrophobicContact CB-CB 4.31Å; A446-L475 HydrophobicContact CB-CD1 4.31Å; Y449-L475 HydrophobicContact CD2-CD1 3.76Å; Y449-L475 HydrophobicContact CE2-CD1 3.61Å; K471-L475 VanDerWaalsContact O-CG 3.3Å; K471-L475 WeakPolarHBondContact O-CG 3.35Å; K471-L475 PolarHBondContact O-N 3.42Å; K471-L475 VanDerWaalsContact O-N 3.09Å; C472-L475 PolarHBondContact O-N 2.74Å; I473-L475 VanDerWaalsContact C-N 3.31Å; I473-L475 PolarHBondContact O-N 3.12Å
476	E	92.8	Very high	94.9	Very high	70 Å²	70	42.8 Å²	42.8	33%	0.327	22%	0.217	S	C	.	.			trans	-135.2	78.2	-176.8	-62.7	-179.2	174.1	0	0	110.8	A446 C472 I473 D478 N479	A446-E476 VanDerWaalsContact CB-CD 3.49Å; A446-E476 HydrophobicContact CB-CG 3.95Å; C472-E476 PolarHBondContact O-N 2.72Å; I473-E476 CarbonylContact O-C 3.46Å; E476-D478 PolarHBondContact O-N 3.25Å; E476-D478 VanDerWaalsContact O-N 3.12Å; E476-N479 HydrophobicContact CB-CB 3.81Å; E476-N479 WeakPolarHBondContact O-CB 3.21Å; E476-N479 PolarHBondContact O-N 3.05Å; E476-N479 VanDerWaalsContact O-N 3.09Å; E476-N479 PolarHBondContact OE2-ND2 3Å
477	P	95	Very high	94.7	Very high	67 Å²	67	41.5 Å²	41.5	44%	0.435	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.7	-178.7	-24.4	33.9	0	0	0	114	I473 N479 Y483	I473-P477 VanDerWaalsContact O-CA 3.31Å; I473-P477 WeakPolarHBondContact O-CA 3.36Å; I473-P477 WeakPolarHBondContact O-CD 3.39Å; I473-P477 WeakPolarHBondContact O-CG 3.39Å; I473-P477 VanDerWaalsContact O-N 3.15Å; P477-N479 VanDerWaalsContact C-N 3.34Å; P477-Y483 WeakPolarHBondContact O-CE2 3.41Å
478	D	91.4	Very high	94.3	Very high	111 Å²	111	36.9 Å²	36.9	59%	0.594	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	1	-176.9	-54.5	-28.1	0	0	0	112.6	E476 A480 I510	E476-D478 PolarHBondContact O-N 3.25Å; E476-D478 VanDerWaalsContact O-N 3.12Å; D478-A480 PolarHBondContact O-N 2.88Å; D478-A480 VanDerWaalsContact O-N 3.17Å; D478-I510 VanDerWaalsContact O-CG2 3.29Å; D478-I510 WeakPolarHBondContact O-CG2 3.42Å
479	N	88.4	Confident	93.9	Very high	28 Å²	28	35.9 Å²	35.9	15%	0.15	18%	0.184	C	C	.	.			trans	-84.4	90.2	177.7	-173.8	-11.1	0	0	0	111	E476 P477 T481 T482	E476-N479 HydrophobicContact CB-CB 3.81Å; E476-N479 WeakPolarHBondContact O-CB 3.21Å; E476-N479 PolarHBondContact O-N 3.05Å; E476-N479 VanDerWaalsContact O-N 3.09Å; E476-N479 PolarHBondContact OE2-ND2 3Å; P477-N479 VanDerWaalsContact C-N 3.34Å; N479-T481 PolarHBondContact O-N 3.18Å; N479-T481 PolarHBondContact OD1-N 3.08Å; N479-T481 PolarHBondContact OD1-OG1 3.05Å; N479-T482 WeakPolarHBondContact O-CB 3.27Å; N479-T482 PolarHBondContact O-N 2.89Å
480	A	92.4	Very high	93.6	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-54.2	-35.6	179.7	0	0	0	0	0	113.8	D478 T482 Y483 V484 A507 I510 D511 C514	D478-A480 PolarHBondContact O-N 2.88Å; D478-A480 VanDerWaalsContact O-N 3.17Å; A480-T482 VanDerWaalsContact C-N 3.25Å; A480-T482 PolarHBondContact O-N 3.41Å; A480-Y483 WeakPolarHBondContact O-CB 3.4Å; A480-Y483 PolarHBondContact O-N 3.07Å; A480-Y483 VanDerWaalsContact O-N 3.08Å; A480-V484 PolarHBondContact O-N 3.36Å; A480-A507 HydrophobicContact CB-CB 4.24Å; A480-A507 WeakPolarHBondContact CB-O 3.45Å; A480-A507 WeakPolarHBondContact O-CB 3.01Å; A480-I510 HydrophobicContact CB-CB 4.36Å; A480-I510 HydrophobicContact CB-CG2 4.18Å; A480-D511 HydrophobicContact CB-CB 3.67Å; A480-C514 HydrophobicContact CB-CB 4.2Å
481	T	90.6	Very high	93.1	Very high	40 Å²	40	34 Å²	34	25%	0.245	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-33.9	-176.6	66.3	0	0	0	0	112.6	N479 Y483 V484 H485	N479-T481 PolarHBondContact O-N 3.18Å; N479-T481 PolarHBondContact OD1-N 3.08Å; N479-T481 PolarHBondContact OD1-OG1 3.05Å; T481-Y483 VanDerWaalsContact C-N 3.33Å; T481-Y483 PolarHBondContact O-N 3.46Å; T481-V484 WeakPolarHBondContact O-CB 3.44Å; T481-V484 PolarHBondContact O-N 2.93Å; T481-V484 VanDerWaalsContact O-N 3.16Å; T481-H485 VanDerWaalsContact O-CG 3.32Å; T481-H485 PolarHBondContact O-N 3.17Å; T481-H485 PolarHBondContact O-ND1 3Å
482	T	93.1	Very high	92.6	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-40.8	175.9	-61.7	0	0	0	0	111.8	Y469 C472 I473 N479 A480 V484 H485 K486	Y469-T482 HydrophobicContact CD1-CG2 4.22Å; C472-T482 HydrophobicContact CB-CG2 3.4Å; I473-T482 HydrophobicContact CD1-CG2 4.3Å; I473-T482 HydrophobicContact CG1-CG2 3.59Å; N479-T482 WeakPolarHBondContact O-CB 3.27Å; N479-T482 PolarHBondContact O-N 2.89Å; A480-T482 VanDerWaalsContact C-N 3.25Å; A480-T482 PolarHBondContact O-N 3.41Å; T482-V484 VanDerWaalsContact C-N 3.35Å; T482-H485 PolarHBondContact O-N 3.39Å; T482-K486 WeakPolarHBondContact O-CB 3.41Å; T482-K486 PolarHBondContact O-N 3.49Å
483	Y	96.8	Very high	92.3	Very high	14 Å²	14	39.6 Å²	39.6	6%	0.055	20%	0.198	C	C	.	.	H	α-helix	trans	-66.4	-37.8	176	-70.1	-92.2	0	0	0	111.8	I473 P477 A480 T481 K486 G487 L503 K506 I510	I473-Y483 HydrophobicContact CD1-CD1 4.08Å; I473-Y483 HydrophobicContact CD1-CE1 3.85Å; I473-Y483 HydrophobicContact CG1-CE1 4.31Å; I473-Y483 HydrophobicContact CG1-CE2 4.14Å; I473-Y483 HydrophobicContact CG2-CE1 4.34Å; I473-Y483 HydrophobicContact CG2-CE2 4.35Å; I473-Y483 WeakPolarHBondContact CG2-OH 3.41Å; P477-Y483 WeakPolarHBondContact O-CE2 3.41Å; A480-Y483 WeakPolarHBondContact O-CB 3.4Å; A480-Y483 PolarHBondContact O-N 3.07Å; A480-Y483 VanDerWaalsContact O-N 3.08Å; T481-Y483 VanDerWaalsContact C-N 3.33Å; T481-Y483 PolarHBondContact O-N 3.46Å; Y483-K486 PolarHBondContact O-N 3.22Å; Y483-G487 PolarHBondContact O-N 3.46Å; Y483-L503 HydrophobicContact CD1-CD2 4.12Å; Y483-K506 HydrophobicContact CD1-CD 3.94Å; Y483-K506 HydrophobicContact CD1-CG 4.25Å; Y483-K506 HydrophobicContact CE1-CD 3.6Å; Y483-K506 VanDerWaalsContact CE1-CE 3.46Å; Y483-K506 HydrophobicContact CE1-CG 4.22Å; Y483-I510 HydrophobicContact CD2-CD1 3.55Å; Y483-I510 HydrophobicContact CE1-CD1 4.28Å; Y483-I510 HydrophobicContact CE2-CD1 3.22Å; Y483-I510 HydrophobicContact CG-CD1 4.19Å
484	V	93	Very high	91.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-45.6	173.7	-173.2	0	0	0	0	110.6	A480 T481 T482 G487 L488 A507 F516 A517 T520	A480-V484 PolarHBondContact O-N 3.36Å; T481-V484 WeakPolarHBondContact O-CB 3.44Å; T481-V484 PolarHBondContact O-N 2.93Å; T481-V484 VanDerWaalsContact O-N 3.16Å; T482-V484 VanDerWaalsContact C-N 3.35Å; V484-G487 PolarHBondContact O-N 3.19Å; V484-L488 HydrophobicContact CG1-CD1 4.33Å; V484-L488 WeakPolarHBondContact O-CG 3.45Å; V484-L488 PolarHBondContact O-N 2.91Å; V484-A507 HydrophobicContact CG2-CB 3.56Å; V484-F516 HydrophobicContact CB-CD1 3.92Å; V484-F516 HydrophobicContact CB-CE1 3.79Å; V484-F516 HydrophobicContact CG1-CD1 3.59Å; V484-F516 HydrophobicContact CG1-CE1 3.27Å; V484-F516 HydrophobicContact CG1-CG 4.48Å; V484-F516 HydrophobicContact CG1-CZ 3.97Å; V484-F516 HydrophobicContact CG2-CD1 4.29Å; V484-A517 HydrophobicContact CG2-CB 3.6Å; V484-T520 HydrophobicContact CG1-CG2 3.92Å
485	H	91.4	Very high	91.4	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-44.2	177.6	-62.1	-12.1	0	0	0	112.4	P27 Y469 T481 T482 G487 L488 L489 F516	P27-H485 WeakPolarHBondContact CD-CE1 3.26Å; P27-H485 WeakPolarHBondContact CD-ND1 3.4Å; Y469-H485 HydrophobicContact CD1-CB 4.16Å; Y469-H485 HydrophobicContact CE1-CB 3.5Å; Y469-H485 VanDerWaalsContact CE1-CB 3.5Å; Y469-H485 HydrophobicContact CE2-CB 4.38Å; T481-H485 VanDerWaalsContact O-CG 3.32Å; T481-H485 PolarHBondContact O-N 3.17Å; T481-H485 PolarHBondContact O-ND1 3Å; T482-H485 PolarHBondContact O-N 3.39Å; H485-G487 VanDerWaalsContact C-N 3.32Å; H485-G487 PolarHBondContact O-N 3.41Å; H485-L488 PolarHBondContact O-N 3.3Å; H485-L489 WeakPolarHBondContact O-CB 3.19Å; H485-L489 PolarHBondContact O-N 2.73Å; H485-F516 AromaticContact CE1-CE1 3.38Å; H485-F516 WeakPolarHBondContact CE1-CE1 3.47Å; H485-F516 AromaticContact ND1-CE1 3.52Å
486	K	95.5	Very high	91.1	Very high	21 Å²	21	43.9 Å²	43.9	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-40	174.8	-167.9	-176.8	171.7	82.7	0	111.1	D466 Y469 D470 I473 T482 Y483 L489 Q490 L503	D466-K486 WeakPolarHBondContact OD1-CE 3.49Å; D466-K486 IonicContact OD1-NZ 3.2Å; D466-K486 PolarHBondContact OD1-NZ 2.83Å; D466-K486 IonicContact OD2-NZ 3.7Å; Y469-K486 HydrophobicContact CD2-CB 4.41Å; Y469-K486 HydrophobicContact CG-CB 4.3Å; D470-K486 WeakPolarHBondContact OD1-CE 3.44Å; D470-K486 IonicContact OD1-NZ 3.64Å; D470-K486 PolarHBondContact OD1-NZ 2.86Å; D470-K486 IonicContact OD2-NZ 3.35Å; D470-K486 PolarHBondContact OD2-NZ 3.35Å; I473-K486 HydrophobicContact CD1-CD 3.81Å; T482-K486 WeakPolarHBondContact O-CB 3.41Å; T482-K486 PolarHBondContact O-N 3.49Å; Y483-K486 PolarHBondContact O-N 3.22Å; K486-L489 WeakPolarHBondContact O-CB 3.41Å; K486-L489 PolarHBondContact O-N 3.47Å; K486-Q490 WeakPolarHBondContact O-CG 3.33Å; K486-Q490 PolarHBondContact O-N 2.89Å; K486-L503 HydrophobicContact CB-CD1 4.36Å; K486-L503 HydrophobicContact CD-CD1 4.29Å; K486-L503 HydrophobicContact CD-CD2 4.26Å; K486-L503 HydrophobicContact CG-CD1 4.02Å
487	G	92.5	Very high	90.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-54.8	173.2	0	0	0	0	0	111.5	Y483 V484 H485 L489 Q490 L491	Y483-G487 PolarHBondContact O-N 3.46Å; V484-G487 PolarHBondContact O-N 3.19Å; H485-G487 VanDerWaalsContact C-N 3.32Å; H485-G487 PolarHBondContact O-N 3.41Å; G487-L489 VanDerWaalsContact C-N 3.27Å; G487-L489 PolarHBondContact O-N 3.21Å; G487-Q490 PolarHBondContact O-N 3.38Å; G487-L491 WeakPolarHBondContact O-CD1 3.18Å; G487-L491 PolarHBondContact O-N 3.24Å; G487-L491 VanDerWaalsContact O-N 3.1Å
488	L	90.2	Very high	90.7	Very high	20 Å²	20	44.9 Å²	44.9	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-55.8	-40.3	176.1	-74.1	172.6	0	0	0	112.9	P27 V29 V484 H485 Q490 L491 Q492 F516 T520	P27-L488 VanDerWaalsContact O-CD1 3.31Å; P27-L488 WeakPolarHBondContact O-CD1 3.34Å; V29-L488 HydrophobicContact CG1-CD2 4.3Å; V29-L488 HydrophobicContact CG2-CD1 4.04Å; V29-L488 HydrophobicContact CG2-CD2 3.85Å; V484-L488 HydrophobicContact CG1-CD1 4.33Å; V484-L488 WeakPolarHBondContact O-CG 3.45Å; V484-L488 PolarHBondContact O-N 2.91Å; H485-L488 PolarHBondContact O-N 3.3Å; L488-Q490 PolarHBondContact O-N 3.36Å; L488-L491 PolarHBondContact O-N 2.88Å; L488-Q492 WeakPolarHBondContact O-CB 3.49Å; L488-Q492 PolarHBondContact O-N 3.19Å; L488-F516 HydrophobicContact CD1-CE1 4.47Å; L488-F516 HydrophobicContact CD1-CZ 3.89Å; L488-T520 HydrophobicContact CD1-CG2 4.16Å; L488-T520 HydrophobicContact CD2-CG2 3.6Å; L488-T520 HydrophobicContact CG-CG2 3.88Å
489	L	90.8	Very high	90.7	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-44.2	173.9	174.6	67.1	0	0	0	111.7	T457 F462 A465 D466 Y469 H485 K486 G487 Q492 W493	T457-L489 HydrophobicContact CG2-CD1 3.95Å; F462-L489 HydrophobicContact CB-CD1 4.03Å; F462-L489 HydrophobicContact CD1-CD1 3.56Å; F462-L489 HydrophobicContact CE1-CD1 4.48Å; F462-L489 HydrophobicContact CG-CD1 4.22Å; A465-L489 HydrophobicContact CB-CD1 4.23Å; A465-L489 HydrophobicContact CB-CD2 3.96Å; D466-L489 HydrophobicContact CB-CD2 3.78Å; Y469-L489 HydrophobicContact CD2-CD2 3.7Å; Y469-L489 HydrophobicContact CE2-CB 4.22Å; Y469-L489 HydrophobicContact CE2-CD2 3.9Å; H485-L489 WeakPolarHBondContact O-CB 3.19Å; H485-L489 PolarHBondContact O-N 2.73Å; K486-L489 WeakPolarHBondContact O-CB 3.41Å; K486-L489 PolarHBondContact O-N 3.47Å; G487-L489 VanDerWaalsContact C-N 3.27Å; G487-L489 PolarHBondContact O-N 3.21Å; L489-Q492 PolarHBondContact O-N 2.86Å; L489-W493 WeakPolarHBondContact O-CB 3.19Å; L489-W493 PolarHBondContact O-N 3.06Å
490	Q	91	Very high	90.9	Very high	3 Å²	3	40.8 Å²	40.8	1%	0.014	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-37.8	179.5	-63.3	-58.8	-37.1	0	0	112.1	D466 K486 G487 L488 Q492 K494 Q495 D496 L499 L503	D466-Q490 PolarHBondContact OD1-NE2 2.68Å; K486-Q490 WeakPolarHBondContact O-CG 3.33Å; K486-Q490 PolarHBondContact O-N 2.89Å; G487-Q490 PolarHBondContact O-N 3.38Å; L488-Q490 PolarHBondContact O-N 3.36Å; Q490-Q492 VanDerWaalsContact C-N 3.34Å; Q490-K494 PolarHBondContact O-N 2.83Å; Q490-Q495 PolarHBondContact O-N 2.93Å; Q490-D496 PolarHBondContact O-N 2.71Å; Q490-L499 HydrophobicContact CB-CD2 4.39Å; Q490-L499 HydrophobicContact CG-CD2 3.79Å; Q490-L499 HydrophobicContact CG-CG 4.21Å; Q490-L503 HydrophobicContact CG-CD1 4.04Å
491	L	88.1	Confident	90.9	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.12	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-42.5	171.3	-80	90	0	0	0	111.6	G487 L488 Q495 L497 G500 I524	G487-L491 WeakPolarHBondContact O-CD1 3.18Å; G487-L491 PolarHBondContact O-N 3.24Å; G487-L491 VanDerWaalsContact O-N 3.1Å; L488-L491 PolarHBondContact O-N 2.88Å; L491-Q495 WeakPolarHBondContact O-CA 3.29Å; L491-Q495 PolarHBondContact O-N 3.02Å; L491-L497 HydrophobicContact CD2-CD1 4.18Å; L491-G500 VanDerWaalsContact CD1-CA 3.43Å; L491-I524 HydrophobicContact CD1-CD1 4.05Å; L491-I524 HydrophobicContact CD2-CD1 3.61Å; L491-I524 HydrophobicContact CD2-CG1 3.64Å; L491-I524 HydrophobicContact CD2-CG2 4.1Å
492	Q	87	Confident	91.2	Very high	105 Å²	105	45.9 Å²	45.9	49%	0.491	22%	0.218	S	C	.	.	H	α-helix	trans	-73.4	-42.1	-179.2	-176.3	176.4	-4.9	0	0	112.6	F462 L488 L489 Q490	F462-Q492 HydrophobicContact CE1-CG 4.01Å; F462-Q492 HydrophobicContact CZ-CG 4.22Å; L488-Q492 WeakPolarHBondContact O-CB 3.49Å; L488-Q492 PolarHBondContact O-N 3.19Å; L489-Q492 PolarHBondContact O-N 2.86Å; Q490-Q492 VanDerWaalsContact C-N 3.34Å
493	W	89.2	Confident	91.4	Very high	91 Å²	91	46.7 Å²	46.7	35%	0.345	22%	0.222	S	C	.	.	H	α-helix	trans	-77.7	-55.9	-172.2	177.2	21.2	0	0	0	112.2	F462 D466 L489	F462-W493 HydrophobicContact CB-CB 3.72Å; F462-W493 HydrophobicContact CB-CD2 3.47Å; F462-W493 VanDerWaalsContact CB-CD2 3.47Å; F462-W493 HydrophobicContact CB-CE3 4.08Å; F462-W493 HydrophobicContact CB-CG 3.28Å; F462-W493 HydrophobicContact CD1-CB 4.19Å; F462-W493 HydrophobicContact CD2-CB 4.01Å; F462-W493 AromaticContact CD2-CD1 3.33Å; F462-W493 AromaticContact CD2-CG 3.77Å; F462-W493 HydrophobicContact CD2-CG 3.77Å; F462-W493 HydrophobicContact CG-CB 3.71Å; F462-W493 AromaticContact CG-CD1 3.69Å; F462-W493 HydrophobicContact CG-CD2 4.36Å; F462-W493 AromaticContact CG-CG 3.65Å; F462-W493 HydrophobicContact CG-CG 3.65Å; D466-W493 HydrophobicContact CB-CZ3 4.12Å; L489-W493 WeakPolarHBondContact O-CB 3.19Å; L489-W493 PolarHBondContact O-N 3.06Å
494	K	89	Confident	91.3	Very high	111 Å²	111	46 Å²	46	48%	0.483	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-6.6	-171.9	-66.1	178.4	-174	159.3	0	113	Q490 D496	Q490-K494 PolarHBondContact O-N 2.83Å; K494-D496 HydrophobicContact CB-CB 3.99Å; K494-D496 PolarHBondContact O-N 2.65Å
495	Q	86.1	Confident	91.5	Very high	145 Å²	145	48.3 Å²	48.3	68%	0.678	24%	0.236	S	C	*	.			trans	54.5	30.2	-166.2	-57.3	-178.9	-16.4	0	0	111.3	Q490 L491 L497	Q490-Q495 PolarHBondContact O-N 2.93Å; L491-Q495 WeakPolarHBondContact O-CA 3.29Å; L491-Q495 PolarHBondContact O-N 3.02Å; Q495-L497 VanDerWaalsContact C-N 3.33Å; Q495-L497 PolarHBondContact O-N 3.13Å
496	D	88.9	Confident	91.8	Very high	55 Å²	55	52.5 Å²	52.5	29%	0.294	25%	0.254	S	S	.	.			trans	-81.5	86.4	179	-168.2	-21.1	0	0	0	108.7	Q490 K494 D498 L499 G500	Q490-D496 PolarHBondContact O-N 2.71Å; K494-D496 HydrophobicContact CB-CB 3.99Å; K494-D496 PolarHBondContact O-N 2.65Å; D496-D498 VanDerWaalsContact C-N 3.34Å; D496-D498 PolarHBondContact OD1-N 3.37Å; D496-L499 HydrophobicContact CB-CB 4.31Å; D496-L499 VanDerWaalsContact CG-CB 3.48Å; D496-L499 WeakPolarHBondContact OD1-CB 3.49Å; D496-L499 PolarHBondContact OD1-N 2.92Å; D496-G500 PolarHBondContact O-N 3.11Å
497	L	87.4	Confident	91.8	Very high	39 Å²	39	51.5 Å²	51.5	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-37.9	-177.8	-179.3	65	0	0	0	111.9	L491 Q495 G500 L501 I524 R528	L491-L497 HydrophobicContact CD2-CD1 4.18Å; Q495-L497 VanDerWaalsContact C-N 3.33Å; Q495-L497 PolarHBondContact O-N 3.13Å; L497-G500 PolarHBondContact O-N 3.39Å; L497-L501 HydrophobicContact CD1-CD1 4.09Å; L497-L501 HydrophobicContact CD1-CG 4.21Å; L497-L501 HydrophobicContact CG-CD1 3.92Å; L497-L501 HydrophobicContact CG-CG 4.44Å; L497-L501 WeakPolarHBondContact O-CB 3.36Å; L497-L501 WeakPolarHBondContact O-CG 3.41Å; L497-L501 PolarHBondContact O-N 3.42Å; L497-I524 HydrophobicContact CD1-CG2 3.38Å; L497-R528 HydrophobicContact CD1-CG 4.31Å; L497-R528 HydrophobicContact CD2-CG 3.77Å
498	D	91	Very high	92	Very high	118 Å²	118	53 Å²	53	63%	0.631	26%	0.257	S	S	*	.	H	α-helix	trans	-68	-49.9	-176.1	-68.7	-35.8	0	0	0	110.4	D496 G500 L501 E502	D496-D498 VanDerWaalsContact C-N 3.34Å; D496-D498 PolarHBondContact OD1-N 3.37Å; D498-G500 VanDerWaalsContact C-N 3.3Å; D498-G500 PolarHBondContact O-N 3.38Å; D498-L501 PolarHBondContact O-N 2.98Å; D498-E502 WeakPolarHBondContact O-CB 3.33Å; D498-E502 PolarHBondContact O-N 3.4Å
499	L	93.4	Very high	92.4	Very high	54 Å²	54	59.7 Å²	59.7	28%	0.283	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-39	175.3	-179.1	59.7	0	0	0	111.7	Q490 D496 E502 L503	Q490-L499 HydrophobicContact CB-CD2 4.39Å; Q490-L499 HydrophobicContact CG-CD2 3.79Å; Q490-L499 HydrophobicContact CG-CG 4.21Å; D496-L499 HydrophobicContact CB-CB 4.31Å; D496-L499 VanDerWaalsContact CG-CB 3.48Å; D496-L499 WeakPolarHBondContact OD1-CB 3.49Å; D496-L499 PolarHBondContact OD1-N 2.92Å; L499-E502 PolarHBondContact O-N 2.97Å; L499-L503 HydrophobicContact CD1-CD1 4.29Å; L499-L503 HydrophobicContact CD1-CG 4.29Å; L499-L503 HydrophobicContact CG-CD1 4.07Å; L499-L503 WeakPolarHBondContact O-CB 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.5Å; L499-L503 PolarHBondContact O-N 3.27Å
500	G	91.5	Very high	92.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56	-50.6	175.1	0	0	0	0	0	113.3	L491 D496 L497 D498 L503 I504	L491-G500 VanDerWaalsContact CD1-CA 3.43Å; D496-G500 PolarHBondContact O-N 3.11Å; L497-G500 PolarHBondContact O-N 3.39Å; D498-G500 VanDerWaalsContact C-N 3.3Å; D498-G500 PolarHBondContact O-N 3.38Å; G500-L503 PolarHBondContact O-N 3.14Å; G500-I504 WeakPolarHBondContact O-CD1 3.3Å; G500-I504 VanDerWaalsContact O-CG1 3.26Å; G500-I504 WeakPolarHBondContact O-CG1 3.44Å; G500-I504 PolarHBondContact O-N 2.96Å; G500-I504 VanDerWaalsContact O-N 3.14Å
501	L	92	Very high	92.7	Very high	18 Å²	18	63.3 Å²	63.3	9%	0.094	31%	0.306	C	S	.	.	H	α-helix	trans	-66.6	-38.8	177.7	-70.7	168	0	0	0	112.2	L497 D498 I504 S505 M521 I524	L497-L501 HydrophobicContact CD1-CD1 4.09Å; L497-L501 HydrophobicContact CD1-CG 4.21Å; L497-L501 HydrophobicContact CG-CD1 3.92Å; L497-L501 HydrophobicContact CG-CG 4.44Å; L497-L501 WeakPolarHBondContact O-CB 3.36Å; L497-L501 WeakPolarHBondContact O-CG 3.41Å; L497-L501 PolarHBondContact O-N 3.42Å; D498-L501 PolarHBondContact O-N 2.98Å; L501-I504 PolarHBondContact O-N 3.41Å; L501-S505 WeakPolarHBondContact O-CB 3.37Å; L501-S505 PolarHBondContact O-N 2.89Å; L501-S505 PolarHBondContact O-OG 3.03Å; L501-M521 HydrophobicContact CD2-CE 4.46Å; L501-M521 HydrophobicContact CD2-SD 3.33Å; L501-M521 WeakPolarHBondContact CD2-SD 3.48Å; L501-I524 HydrophobicContact CD2-CB 4.33Å; L501-I524 HydrophobicContact CD2-CG2 3.66Å; L501-I524 HydrophobicContact CG-CG2 4.26Å
502	E	96.6	Very high	93.1	Very high	133 Å²	133	67.2 Å²	67.2	62%	0.621	33%	0.328	S	S	*	.	H	α-helix	trans	-59.1	-47.6	175.2	-173.9	-174.5	157.9	0	0	111.3	D498 L499 I504 S505 K506	D498-E502 WeakPolarHBondContact O-CB 3.33Å; D498-E502 PolarHBondContact O-N 3.4Å; L499-E502 PolarHBondContact O-N 2.97Å; E502-I504 PolarHBondContact O-N 3.24Å; E502-S505 PolarHBondContact O-N 3.04Å; E502-K506 WeakPolarHBondContact O-CB 3.37Å; E502-K506 PolarHBondContact O-N 3.07Å
503	L	97.2	Very high	93.4	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.099	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-41.3	178.6	-74.3	168.1	0	0	0	112.3	Y483 K486 Q490 L499 G500 K506 A507	Y483-L503 HydrophobicContact CD1-CD2 4.12Å; K486-L503 HydrophobicContact CB-CD1 4.36Å; K486-L503 HydrophobicContact CD-CD1 4.29Å; K486-L503 HydrophobicContact CD-CD2 4.26Å; K486-L503 HydrophobicContact CG-CD1 4.02Å; Q490-L503 HydrophobicContact CG-CD1 4.04Å; L499-L503 HydrophobicContact CD1-CD1 4.29Å; L499-L503 HydrophobicContact CD1-CG 4.29Å; L499-L503 HydrophobicContact CG-CD1 4.07Å; L499-L503 WeakPolarHBondContact O-CB 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.5Å; L499-L503 PolarHBondContact O-N 3.27Å; G500-L503 PolarHBondContact O-N 3.14Å; L503-K506 PolarHBondContact O-N 2.89Å; L503-A507 PolarHBondContact O-N 2.71Å
504	I	94.6	Very high	93.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.6	-36.9	178.8	-59.2	158.7	0	0	0	110.9	G500 L501 E502 K506 A507 I508 A517 T520 M521 I524	G500-I504 WeakPolarHBondContact O-CD1 3.3Å; G500-I504 VanDerWaalsContact O-CG1 3.26Å; G500-I504 WeakPolarHBondContact O-CG1 3.44Å; G500-I504 PolarHBondContact O-N 2.96Å; G500-I504 VanDerWaalsContact O-N 3.14Å; L501-I504 PolarHBondContact O-N 3.41Å; E502-I504 PolarHBondContact O-N 3.24Å; I504-K506 VanDerWaalsContact C-N 3.32Å; I504-K506 PolarHBondContact O-N 3.2Å; I504-A507 VanDerWaalsContact O-CB 3.31Å; I504-A507 WeakPolarHBondContact O-CB 3.33Å; I504-A507 PolarHBondContact O-N 3.21Å; I504-I508 WeakPolarHBondContact O-CG1 3.32Å; I504-I508 PolarHBondContact O-N 3.44Å; I504-I508 VanDerWaalsContact O-N 3.07Å; I504-A517 HydrophobicContact CG2-CB 4.25Å; I504-A517 WeakPolarHBondContact CG2-O 3.32Å; I504-T520 HydrophobicContact CD1-CG2 3.73Å; I504-T520 HydrophobicContact CG1-CG2 4.44Å; I504-M521 HydrophobicContact CB-CE 3.78Å; I504-M521 HydrophobicContact CG2-CB 4.08Å; I504-M521 HydrophobicContact CG2-CE 3.65Å; I504-I524 HydrophobicContact CD1-CD1 3.19Å
505	S	97.6	Very high	93.4	Very high	49 Å²	49	58.2 Å²	58.2	34%	0.343	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-44.1	170.9	-79.4	0	0	0	0	111.2	L501 E502 A507 I508 E509 M521	L501-S505 WeakPolarHBondContact O-CB 3.37Å; L501-S505 PolarHBondContact O-N 2.89Å; L501-S505 PolarHBondContact O-OG 3.03Å; E502-S505 PolarHBondContact O-N 3.04Å; S505-A507 VanDerWaalsContact C-N 3.29Å; S505-A507 PolarHBondContact O-N 3.13Å; S505-I508 WeakPolarHBondContact O-CB 3.49Å; S505-I508 PolarHBondContact O-N 3.32Å; S505-I508 VanDerWaalsContact O-N 3.11Å; S505-E509 WeakPolarHBondContact O-CG 3.2Å; S505-E509 PolarHBondContact O-N 2.98Å; S505-M521 WeakPolarHBondContact OG-CE 3.48Å
506	K	97.7	Very high	93.5	Very high	95 Å²	95	52.1 Å²	52.1	41%	0.413	26%	0.263	S	S	.	.	H	α-helix	trans	-60.9	-37.7	174.2	-174.6	173.6	177.9	-178.6	0	112.1	Y483 E502 L503 I504 I508 E509 I510	Y483-K506 HydrophobicContact CD1-CD 3.94Å; Y483-K506 HydrophobicContact CD1-CG 4.25Å; Y483-K506 HydrophobicContact CE1-CD 3.6Å; Y483-K506 VanDerWaalsContact CE1-CE 3.46Å; Y483-K506 HydrophobicContact CE1-CG 4.22Å; E502-K506 WeakPolarHBondContact O-CB 3.37Å; E502-K506 PolarHBondContact O-N 3.07Å; L503-K506 PolarHBondContact O-N 2.89Å; I504-K506 VanDerWaalsContact C-N 3.32Å; I504-K506 PolarHBondContact O-N 3.2Å; K506-I508 VanDerWaalsContact C-N 3.32Å; K506-I508 PolarHBondContact O-N 3.42Å; K506-E509 PolarHBondContact O-N 3.36Å; K506-I510 HydrophobicContact CG-CD1 4.02Å; K506-I510 VanDerWaalsContact O-CG1 3.27Å; K506-I510 WeakPolarHBondContact O-CG1 3.25Å; K506-I510 PolarHBondContact O-N 2.68Å
507	A	96.4	Very high	93.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-42.8	173.5	0	0	0	0	0	112.1	A480 V484 L503 I504 S505 E509 I510 D511 A517	A480-A507 HydrophobicContact CB-CB 4.24Å; A480-A507 WeakPolarHBondContact CB-O 3.45Å; A480-A507 WeakPolarHBondContact O-CB 3.01Å; V484-A507 HydrophobicContact CG2-CB 3.56Å; L503-A507 PolarHBondContact O-N 2.71Å; I504-A507 VanDerWaalsContact O-CB 3.31Å; I504-A507 WeakPolarHBondContact O-CB 3.33Å; I504-A507 PolarHBondContact O-N 3.21Å; S505-A507 VanDerWaalsContact C-N 3.29Å; S505-A507 PolarHBondContact O-N 3.13Å; A507-E509 VanDerWaalsContact C-N 3.34Å; A507-I510 PolarHBondContact O-N 3.04Å; A507-D511 PolarHBondContact O-N 3.48Å; A507-A517 HydrophobicContact CB-CB 4.18Å
508	I	96.8	Very high	94.1	Very high	31 Å²	31	48.8 Å²	48.8	16%	0.159	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-35.8	176.8	-66.2	166.8	0	0	0	111.4	I504 S505 K506 D511 N512 A517 Y518 M521	I504-I508 WeakPolarHBondContact O-CG1 3.32Å; I504-I508 PolarHBondContact O-N 3.44Å; I504-I508 VanDerWaalsContact O-N 3.07Å; S505-I508 WeakPolarHBondContact O-CB 3.49Å; S505-I508 PolarHBondContact O-N 3.32Å; S505-I508 VanDerWaalsContact O-N 3.11Å; K506-I508 VanDerWaalsContact C-N 3.32Å; K506-I508 PolarHBondContact O-N 3.42Å; I508-D511 CarbonylContact O-C 3.54Å; I508-N512 VanDerWaalsContact O-CA 3.3Å; I508-N512 WeakPolarHBondContact O-CA 3.14Å; I508-N512 PolarHBondContact O-N 3.43Å; I508-A517 HydrophobicContact CD1-CB 4.43Å; I508-A517 HydrophobicContact CG1-CB 3.67Å; I508-Y518 HydrophobicContact CD1-CD1 3.82Å; I508-Y518 HydrophobicContact CD1-CE1 3.86Å; I508-Y518 HydrophobicContact CG1-CD1 4.29Å; I508-Y518 HydrophobicContact CG1-CE1 4.09Å; I508-Y518 HydrophobicContact CG2-CE1 3.72Å; I508-Y518 WeakPolarHBondContact CG2-OH 3.48Å; I508-M521 HydrophobicContact CD1-CE 4.15Å
509	E	97.2	Very high	94.1	Very high	162 Å²	162	44.8 Å²	44.8	76%	0.757	22%	0.222	S	C	*	.	H	α-helix	trans	-67.2	-38.9	175.3	-71.4	173.7	-172.8	0	0	112.3	S505 K506 A507	S505-E509 WeakPolarHBondContact O-CG 3.2Å; S505-E509 PolarHBondContact O-N 2.98Å; K506-E509 PolarHBondContact O-N 3.36Å; A507-E509 VanDerWaalsContact C-N 3.34Å
510	I	95.8	Very high	94	Very high	57 Å²	57	42.2 Å²	42.2	29%	0.292	21%	0.208	S	C	.	.	H	α-helix	trans	-68.7	-50.2	177.2	-69	164.8	0	0	0	110.8	D478 A480 Y483 K506 A507	D478-I510 VanDerWaalsContact O-CG2 3.29Å; D478-I510 WeakPolarHBondContact O-CG2 3.42Å; A480-I510 HydrophobicContact CB-CB 4.36Å; A480-I510 HydrophobicContact CB-CG2 4.18Å; Y483-I510 HydrophobicContact CD2-CD1 3.55Å; Y483-I510 HydrophobicContact CE1-CD1 4.28Å; Y483-I510 HydrophobicContact CE2-CD1 3.22Å; Y483-I510 HydrophobicContact CG-CD1 4.19Å; K506-I510 HydrophobicContact CG-CD1 4.02Å; K506-I510 VanDerWaalsContact O-CG1 3.27Å; K506-I510 WeakPolarHBondContact O-CG1 3.25Å; K506-I510 PolarHBondContact O-N 2.68Å; A507-I510 PolarHBondContact O-N 3.04Å
511	D	93.7	Very high	94.1	Very high	24 Å²	24	42.4 Å²	42.4	13%	0.128	21%	0.209	C	C	.	.			trans	-135.2	99	178.1	-173.5	-2.8	0	0	0	110.5	S223 A480 A507 I508 K513 C514	S223-D511 WeakPolarHBondContact CB-OD1 3.37Å; S223-D511 WeakPolarHBondContact CB-OD2 3.47Å; S223-D511 PolarHBondContact OG-OD2 3.13Å; A480-D511 HydrophobicContact CB-CB 3.67Å; A507-D511 PolarHBondContact O-N 3.48Å; I508-D511 CarbonylContact O-C 3.54Å; D511-K513 PolarHBondContact O-N 2.92Å; D511-K513 VanDerWaalsContact O-N 3.11Å; D511-K513 WeakPolarHBondContact OD1-CA 3.45Å; D511-K513 WeakPolarHBondContact OD1-CB 3.3Å; D511-K513 PolarHBondContact OD1-N 3.45Å; D511-C514 HydrophobicContact CB-CB 4.19Å; D511-C514 VanDerWaalsContact O-CB 3.25Å; D511-C514 WeakPolarHBondContact O-CB 3.29Å; D511-C514 PolarHBondContact O-N 3.4Å
512	N	95.4	Very high	94	Very high	106 Å²	106	41.5 Å²	41.5	57%	0.567	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-3.1	178.8	71.5	0	0	0	0	113.9	I508 Y518	I508-N512 VanDerWaalsContact O-CA 3.3Å; I508-N512 WeakPolarHBondContact O-CA 3.14Å; I508-N512 PolarHBondContact O-N 3.43Å; N512-Y518 VanDerWaalsContact O-CE2 3.27Å; N512-Y518 WeakPolarHBondContact O-CE2 3.24Å; N512-Y518 PolarHBondContact O-OH 3.33Å; N512-Y518 VanDerWaalsContact O-OH 3.05Å
513	K	93.7	Very high	93.5	Very high	67 Å²	67	36.1 Å²	36.1	29%	0.291	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	7	171.4	-61.6	-177.8	179.4	-179.9	0	112.8	M221 P222 D511 D515 L544	M221-K513 PolarHBondContact O-NZ 3.08Å; P222-K513 PolarHBondContact O-NZ 3.28Å; D511-K513 PolarHBondContact O-N 2.92Å; D511-K513 VanDerWaalsContact O-N 3.11Å; D511-K513 WeakPolarHBondContact OD1-CA 3.45Å; D511-K513 WeakPolarHBondContact OD1-CB 3.3Å; D511-K513 PolarHBondContact OD1-N 3.45Å; K513-D515 PolarHBondContact O-N 3.22Å; K513-L544 HydrophobicContact CB-CD2 4.25Å; K513-L544 HydrophobicContact CG-CD2 4.34Å
514	C	90.1	Very high	93	Very high	7 Å²	7	35.2 Å²	35.2	5%	0.047	18%	0.176	C	C	.	.			trans	-72.8	92	172.2	-171.9	0	0	0	0	110.2	A480 D511 F516 A517 Y518	A480-C514 HydrophobicContact CB-CB 4.2Å; D511-C514 HydrophobicContact CB-CB 4.19Å; D511-C514 VanDerWaalsContact O-CB 3.25Å; D511-C514 WeakPolarHBondContact O-CB 3.29Å; D511-C514 PolarHBondContact O-N 3.4Å; C514-F516 VanDerWaalsContact C-N 3.27Å; C514-F516 PolarHBondContact O-N 3.03Å; C514-A517 HydrophobicContact CB-CB 4.06Å; C514-A517 WeakPolarHBondContact O-CB 3.36Å; C514-A517 PolarHBondContact O-N 2.97Å; C514-Y518 VanDerWaalsContact O-CD2 3.29Å; C514-Y518 WeakPolarHBondContact O-CD2 3.42Å
515	D	87.9	Confident	92.7	Very high	43 Å²	43	35.2 Å²	35.2	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-39.1	177.7	62.5	-53.4	0	0	0	112	K513 A517 Y518 E519 L544	K513-D515 PolarHBondContact O-N 3.22Å; D515-A517 VanDerWaalsContact C-N 3.26Å; D515-A517 PolarHBondContact O-N 3.38Å; D515-Y518 PolarHBondContact O-N 3.5Å; D515-Y518 VanDerWaalsContact O-N 3.15Å; D515-E519 PolarHBondContact O-N 3.04Å; D515-L544 HydrophobicContact CB-CB 3.81Å; D515-L544 HydrophobicContact CB-CD1 4.15Å
516	F	89.2	Confident	92.1	Very high	17 Å²	17	34.5 Å²	34.5	8%	0.075	17%	0.169	C	C	.	.	H	α-helix	trans	-58.9	-34.6	176.6	-177.9	-122.4	0	0	0	113.2	A26 V484 H485 L488 C514 T520	A26-F516 HydrophobicContact CB-CD1 3.89Å; A26-F516 HydrophobicContact CB-CD2 3.33Å; A26-F516 HydrophobicContact CB-CE1 3.87Å; A26-F516 HydrophobicContact CB-CE2 3.32Å; A26-F516 HydrophobicContact CB-CG 3.63Å; A26-F516 HydrophobicContact CB-CZ 3.59Å; V484-F516 HydrophobicContact CB-CD1 3.92Å; V484-F516 HydrophobicContact CB-CE1 3.79Å; V484-F516 HydrophobicContact CG1-CD1 3.59Å; V484-F516 HydrophobicContact CG1-CE1 3.27Å; V484-F516 HydrophobicContact CG1-CG 4.48Å; V484-F516 HydrophobicContact CG1-CZ 3.97Å; V484-F516 HydrophobicContact CG2-CD1 4.29Å; H485-F516 AromaticContact CE1-CE1 3.38Å; H485-F516 WeakPolarHBondContact CE1-CE1 3.47Å; H485-F516 AromaticContact ND1-CE1 3.52Å; L488-F516 HydrophobicContact CD1-CE1 4.47Å; L488-F516 HydrophobicContact CD1-CZ 3.89Å; C514-F516 VanDerWaalsContact C-N 3.27Å; C514-F516 PolarHBondContact O-N 3.03Å; F516-T520 WeakPolarHBondContact CE2-OG1 3.29Å; F516-T520 VanDerWaalsContact O-CB 3.23Å; F516-T520 WeakPolarHBondContact O-CB 3.37Å; F516-T520 PolarHBondContact O-N 3.18Å; F516-T520 PolarHBondContact O-OG1 2.89Å
517	A	92.7	Very high	91.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-43.5	176.6	0	0	0	0	0	111.7	V484 I504 A507 I508 C514 D515 T520 M521	V484-A517 HydrophobicContact CG2-CB 3.6Å; I504-A517 HydrophobicContact CG2-CB 4.25Å; I504-A517 WeakPolarHBondContact CG2-O 3.32Å; A507-A517 HydrophobicContact CB-CB 4.18Å; I508-A517 HydrophobicContact CD1-CB 4.43Å; I508-A517 HydrophobicContact CG1-CB 3.67Å; C514-A517 HydrophobicContact CB-CB 4.06Å; C514-A517 WeakPolarHBondContact O-CB 3.36Å; C514-A517 PolarHBondContact O-N 2.97Å; D515-A517 VanDerWaalsContact C-N 3.26Å; D515-A517 PolarHBondContact O-N 3.38Å; A517-T520 PolarHBondContact O-N 3.07Å; A517-M521 VanDerWaalsContact O-CB 3.31Å; A517-M521 WeakPolarHBondContact O-CB 3.48Å; A517-M521 PolarHBondContact O-N 3.33Å
518	Y	96.1	Very high	90.7	Very high	25 Å²	25	36.2 Å²	36.2	10%	0.098	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-43.7	176.6	-66.1	-68.9	0	0	0	112.3	I508 N512 C514 D515 T520 M521 G522 M537 K540 L544	I508-Y518 HydrophobicContact CD1-CD1 3.82Å; I508-Y518 HydrophobicContact CD1-CE1 3.86Å; I508-Y518 HydrophobicContact CG1-CD1 4.29Å; I508-Y518 HydrophobicContact CG1-CE1 4.09Å; I508-Y518 HydrophobicContact CG2-CE1 3.72Å; I508-Y518 WeakPolarHBondContact CG2-OH 3.48Å; N512-Y518 VanDerWaalsContact O-CE2 3.27Å; N512-Y518 WeakPolarHBondContact O-CE2 3.24Å; N512-Y518 PolarHBondContact O-OH 3.33Å; N512-Y518 VanDerWaalsContact O-OH 3.05Å; C514-Y518 VanDerWaalsContact O-CD2 3.29Å; C514-Y518 WeakPolarHBondContact O-CD2 3.42Å; D515-Y518 PolarHBondContact O-N 3.5Å; D515-Y518 VanDerWaalsContact O-N 3.15Å; Y518-T520 VanDerWaalsContact C-N 3.31Å; Y518-T520 PolarHBondContact O-N 3.18Å; Y518-M521 PolarHBondContact O-N 3.5Å; Y518-G522 PolarHBondContact O-N 3.45Å; Y518-M537 HydrophobicContact CD1-SD 4.04Å; Y518-M537 WeakPolarHBondContact O-CB 3.48Å; Y518-K540 HydrophobicContact CD1-CB 3.78Å; Y518-K540 HydrophobicContact CD1-CD 3.79Å; Y518-K540 HydrophobicContact CD1-CG 4.43Å; Y518-K540 HydrophobicContact CD2-CB 4.3Å; Y518-K540 HydrophobicContact CE1-CB 4.07Å; Y518-K540 HydrophobicContact CE1-CD 3.5Å; Y518-K540 VanDerWaalsContact CE1-CD 3.5Å; Y518-K540 HydrophobicContact CE1-CG 4.39Å; Y518-K540 HydrophobicContact CG-CB 3.9Å; Y518-L544 HydrophobicContact CD2-CD1 3.7Å; Y518-L544 HydrophobicContact CE2-CD1 3.67Å
519	E	91.6	Very high	90	Very high	33 Å²	33	36.5 Å²	36.5	15%	0.154	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-44.9	176	-176.7	-176.1	174.4	0	0	111.3	D515 G522 T523 F538 A541 H553 L554 L557	D515-E519 PolarHBondContact O-N 3.04Å; E519-G522 PolarHBondContact O-N 3.28Å; E519-T523 PolarHBondContact O-N 3.28Å; E519-T523 PolarHBondContact O-OG1 3.09Å; E519-F538 HydrophobicContact CG-CE1 4.49Å; E519-A541 HydrophobicContact CB-CB 4.48Å; E519-H553 IonicContact OE1-CD2 2.75Å; E519-H553 IonicContact OE1-CE1 3.68Å; E519-H553 IonicContact OE1-NE2 3.25Å; E519-H553 PolarHBondContact OE1-NE2 3.25Å; E519-L554 HydrophobicContact CB-CD2 4.13Å; E519-L554 HydrophobicContact CG-CD2 3.87Å; E519-L557 HydrophobicContact CG-CD1 4.05Å
520	T	91	Very high	89.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-49	178.4	-61.6	0	0	0	0	111.3	V29 V484 L488 I504 F516 A517 Y518 G522 T523 I524	V29-T520 HydrophobicContact CG2-CG2 4Å; V484-T520 HydrophobicContact CG1-CG2 3.92Å; L488-T520 HydrophobicContact CD1-CG2 4.16Å; L488-T520 HydrophobicContact CD2-CG2 3.6Å; L488-T520 HydrophobicContact CG-CG2 3.88Å; I504-T520 HydrophobicContact CD1-CG2 3.73Å; I504-T520 HydrophobicContact CG1-CG2 4.44Å; F516-T520 WeakPolarHBondContact CE2-OG1 3.29Å; F516-T520 VanDerWaalsContact O-CB 3.23Å; F516-T520 WeakPolarHBondContact O-CB 3.37Å; F516-T520 PolarHBondContact O-N 3.18Å; F516-T520 PolarHBondContact O-OG1 2.89Å; A517-T520 PolarHBondContact O-N 3.07Å; Y518-T520 VanDerWaalsContact C-N 3.31Å; Y518-T520 PolarHBondContact O-N 3.18Å; T520-G522 VanDerWaalsContact C-N 3.31Å; T520-G522 PolarHBondContact O-N 2.92Å; T520-T523 PolarHBondContact O-N 3.16Å; T520-I524 HydrophobicContact CG2-CD1 4.01Å; T520-I524 WeakPolarHBondContact O-CG1 3.3Å; T520-I524 PolarHBondContact O-N 2.95Å
521	M	92.9	Very high	89.4	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.02	16%	0.156	C	C	.	.	H	α-helix	trans	-56.5	-45.7	175.6	-172.6	70.3	77.6	0	0	111.1	L501 I504 S505 I508 A517 Y518 T523 I524 E525 M537	L501-M521 HydrophobicContact CD2-CE 4.46Å; L501-M521 HydrophobicContact CD2-SD 3.33Å; L501-M521 WeakPolarHBondContact CD2-SD 3.48Å; I504-M521 HydrophobicContact CB-CE 3.78Å; I504-M521 HydrophobicContact CG2-CB 4.08Å; I504-M521 HydrophobicContact CG2-CE 3.65Å; S505-M521 WeakPolarHBondContact OG-CE 3.48Å; I508-M521 HydrophobicContact CD1-CE 4.15Å; A517-M521 VanDerWaalsContact O-CB 3.31Å; A517-M521 WeakPolarHBondContact O-CB 3.48Å; A517-M521 PolarHBondContact O-N 3.33Å; Y518-M521 PolarHBondContact O-N 3.5Å; M521-T523 VanDerWaalsContact C-N 3.32Å; M521-T523 PolarHBondContact O-N 3.41Å; M521-I524 PolarHBondContact O-N 3.38Å; M521-E525 WeakPolarHBondContact O-CG 3.22Å; M521-E525 PolarHBondContact O-N 3.45Å; M521-M537 HydrophobicContact CB-CG 4.06Å; M521-M537 HydrophobicContact CB-SD 4.41Å; M521-M537 HydrophobicContact CG-CG 3.73Å; M521-M537 HydrophobicContact CG-SD 3.93Å
522	G	89.3	Confident	89.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-44.5	178.2	0	0	0	0	0	112.2	Y518 E519 T520 I524 E525 V526 A534 F538	Y518-G522 PolarHBondContact O-N 3.45Å; E519-G522 PolarHBondContact O-N 3.28Å; T520-G522 VanDerWaalsContact C-N 3.31Å; T520-G522 PolarHBondContact O-N 2.92Å; G522-I524 PolarHBondContact O-N 3.31Å; G522-E525 PolarHBondContact O-N 2.97Å; G522-V526 WeakPolarHBondContact O-CG2 3.36Å; G522-V526 PolarHBondContact O-N 3.49Å; G522-A534 VanDerWaalsContact O-CB 3.26Å; G522-A534 WeakPolarHBondContact O-CB 3.4Å; G522-F538 VanDerWaalsContact C-CZ 3.46Å
523	T	87.3	Confident	89.3	Confident	19 Å²	19	33 Å²	33	12%	0.117	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-37.4	179.3	-54.5	0	0	0	0	112.4	V29 E519 T520 M521 V526 Q527	V29-T523 HydrophobicContact CB-CG2 4.09Å; V29-T523 HydrophobicContact CG1-CG2 3.35Å; E519-T523 PolarHBondContact O-N 3.28Å; E519-T523 PolarHBondContact O-OG1 3.09Å; T520-T523 PolarHBondContact O-N 3.16Å; M521-T523 VanDerWaalsContact C-N 3.32Å; M521-T523 PolarHBondContact O-N 3.41Å; T523-V526 WeakPolarHBondContact O-CB 3.24Å; T523-V526 PolarHBondContact O-N 2.88Å; T523-Q527 WeakPolarHBondContact O-CG 3.26Å; T523-Q527 PolarHBondContact O-N 3.19Å
524	I	85.6	Confident	89.1	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-44.1	174.5	-65	167.6	0	0	0	110.5	L491 L497 L501 I504 T520 M521 G522 V526 Q527 R528	L491-I524 HydrophobicContact CD1-CD1 4.05Å; L491-I524 HydrophobicContact CD2-CD1 3.61Å; L491-I524 HydrophobicContact CD2-CG1 3.64Å; L491-I524 HydrophobicContact CD2-CG2 4.1Å; L497-I524 HydrophobicContact CD1-CG2 3.38Å; L501-I524 HydrophobicContact CD2-CB 4.33Å; L501-I524 HydrophobicContact CD2-CG2 3.66Å; L501-I524 HydrophobicContact CG-CG2 4.26Å; I504-I524 HydrophobicContact CD1-CD1 3.19Å; T520-I524 HydrophobicContact CG2-CD1 4.01Å; T520-I524 WeakPolarHBondContact O-CG1 3.3Å; T520-I524 PolarHBondContact O-N 2.95Å; M521-I524 PolarHBondContact O-N 3.38Å; G522-I524 PolarHBondContact O-N 3.31Å; I524-V526 VanDerWaalsContact C-N 3.28Å; I524-V526 PolarHBondContact O-N 3.43Å; I524-Q527 WeakPolarHBondContact O-CB 3.44Å; I524-Q527 PolarHBondContact O-N 3.23Å; I524-R528 WeakPolarHBondContact O-CG 3.23Å; I524-R528 PolarHBondContact O-N 3.29Å
525	E	88.3	Confident	89.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-32.1	177.3	-65.8	-67.7	173.9	0	0	112.2	M521 G522 R528 G529 N530 K533 A534	M521-E525 WeakPolarHBondContact O-CG 3.22Å; M521-E525 PolarHBondContact O-N 3.45Å; G522-E525 PolarHBondContact O-N 2.97Å; E525-R528 PolarHBondContact O-N 3.41Å; E525-R528 IonicContact OE1-NH1 2.65Å; E525-R528 PolarHBondContact OE1-NH1 2.78Å; E525-R528 IonicContact OE2-NH1 2.9Å; E525-G529 PolarHBondContact O-N 3.38Å; E525-N530 HydrophobicContact CB-CB 4.32Å; E525-N530 PolarHBondContact O-N 3.34Å; E525-N530 VanDerWaalsContact OE2-CB 3.26Å; E525-N530 WeakPolarHBondContact OE2-CB 3.39Å; E525-N530 PolarHBondContact OE2-ND2 3Å; E525-K533 HydrophobicContact CG-CB 4.34Å; E525-K533 HydrophobicContact CG-CD 4.02Å; E525-K533 HydrophobicContact CG-CG 4.09Å; E525-K533 WeakPolarHBondContact OE1-CD 3.33Å; E525-K533 WeakPolarHBondContact OE1-CE 3.37Å; E525-K533 IonicContact OE1-NZ 2.72Å; E525-K533 PolarHBondContact OE1-NZ 2.58Å; E525-A534 HydrophobicContact CB-CB 3.95Å
526	V	84.6	Confident	89.8	Confident	34 Å²	34	32.3 Å²	32.3	21%	0.206	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-47.2	168.5	173.4	0	0	0	0	110.8	G522 T523 I524 R528 G529 L531 A534 F538 A561	G522-V526 WeakPolarHBondContact O-CG2 3.36Å; G522-V526 PolarHBondContact O-N 3.49Å; T523-V526 WeakPolarHBondContact O-CB 3.24Å; T523-V526 PolarHBondContact O-N 2.88Å; I524-V526 VanDerWaalsContact C-N 3.28Å; I524-V526 PolarHBondContact O-N 3.43Å; V526-R528 PolarHBondContact O-N 2.69Å; V526-G529 WeakPolarHBondContact O-CA 3.29Å; V526-G529 PolarHBondContact O-N 3.09Å; V526-L531 HydrophobicContact CG1-CD2 4.26Å; V526-L531 HydrophobicContact CG2-CD2 4.42Å; V526-A534 HydrophobicContact CB-CB 4.49Å; V526-A534 HydrophobicContact CG2-CB 3.51Å; V526-F538 HydrophobicContact CG2-CE2 3.87Å; V526-F538 HydrophobicContact CG2-CZ 4.13Å; V526-A561 HydrophobicContact CG2-CB 4.35Å
527	Q	82.3	Confident	90.1	Very high	34 Å²	34	32 Å²	32	16%	0.159	16%	0.164	C	C	.	.	H	α-helix	trans	-64.5	-31.7	-179.5	-64.4	171.2	13.7	0	0	112.2	T523 I524 G529 T577 L578	T523-Q527 WeakPolarHBondContact O-CG 3.26Å; T523-Q527 PolarHBondContact O-N 3.19Å; I524-Q527 WeakPolarHBondContact O-CB 3.44Å; I524-Q527 PolarHBondContact O-N 3.23Å; Q527-G529 PolarHBondContact O-N 2.94Å; Q527-T577 CarbonylContact O-C 3.09Å; Q527-T577 WeakPolarHBondContact O-CA 3.5Å; Q527-L578 HydrophobicContact CB-CD1 3.68Å; Q527-L578 HydrophobicContact CB-CG 4.1Å; Q527-L578 HydrophobicContact CG-CD1 4.34Å; Q527-L578 PolarHBondContact O-N 3.4Å
528	R	83	Confident	90.3	Very high	97 Å²	97	32.2 Å²	32.2	37%	0.366	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.8	172.5	-63	178.1	77.6	-177.9	16.9	113.8	L497 I524 E525 V526 N530	L497-R528 HydrophobicContact CD1-CG 4.31Å; L497-R528 HydrophobicContact CD2-CG 3.77Å; I524-R528 WeakPolarHBondContact O-CG 3.23Å; I524-R528 PolarHBondContact O-N 3.29Å; E525-R528 PolarHBondContact O-N 3.41Å; E525-R528 IonicContact OE1-NH1 2.65Å; E525-R528 PolarHBondContact OE1-NH1 2.78Å; E525-R528 IonicContact OE2-NH1 2.9Å; V526-R528 PolarHBondContact O-N 2.69Å; R528-N530 PolarHBondContact O-N 3.08Å
529	G	83	Confident	90.3	Very high	37 Å²	37	33.7 Å²	33.7	38%	0.381	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	11.2	-173.1	0	0	0	0	0	114.3	E525 V526 Q527 L531	E525-G529 PolarHBondContact O-N 3.38Å; V526-G529 WeakPolarHBondContact O-CA 3.29Å; V526-G529 PolarHBondContact O-N 3.09Å; Q527-G529 PolarHBondContact O-N 2.94Å; G529-L531 VanDerWaalsContact C-N 3.28Å; G529-L531 PolarHBondContact O-N 3.26Å; G529-L531 VanDerWaalsContact O-N 3.13Å
530	N	90.9	Very high	90.5	Very high	61 Å²	61	35.8 Å²	35.8	33%	0.326	18%	0.183	S	C	.	.			trans	-88.4	66.5	177.2	-171.1	7.8	0	0	0	110.5	E525 R528 D532 K533 A534	E525-N530 HydrophobicContact CB-CB 4.32Å; E525-N530 PolarHBondContact O-N 3.34Å; E525-N530 VanDerWaalsContact OE2-CB 3.26Å; E525-N530 WeakPolarHBondContact OE2-CB 3.39Å; E525-N530 PolarHBondContact OE2-ND2 3Å; R528-N530 PolarHBondContact O-N 3.08Å; N530-D532 VanDerWaalsContact C-N 3.3Å; N530-D532 PolarHBondContact O-N 3.46Å; N530-K533 VanDerWaalsContact ND2-CB 3.31Å; N530-K533 WeakPolarHBondContact ND2-CB 3.47Å; N530-K533 WeakPolarHBondContact ND2-CD 3.24Å; N530-K533 PolarHBondContact O-N 3.39Å; N530-A534 PolarHBondContact O-N 3.24Å
531	L	88.6	Confident	90.6	Very high	19 Å²	19	35.8 Å²	35.8	10%	0.099	18%	0.183	C	C	.	.	H	α-helix	trans	-63.6	-33.1	-170.3	-60.1	177.8	0	0	0	113.1	V526 G529 A534 I535 A561 Q564 T565	V526-L531 HydrophobicContact CG1-CD2 4.26Å; V526-L531 HydrophobicContact CG2-CD2 4.42Å; G529-L531 VanDerWaalsContact C-N 3.28Å; G529-L531 PolarHBondContact O-N 3.26Å; G529-L531 VanDerWaalsContact O-N 3.13Å; L531-A534 WeakPolarHBondContact O-CB 3.5Å; L531-A534 PolarHBondContact O-N 3.45Å; L531-I535 WeakPolarHBondContact O-CB 3.32Å; L531-I535 WeakPolarHBondContact O-CD1 3.39Å; L531-I535 VanDerWaalsContact O-CG1 3.23Å; L531-I535 WeakPolarHBondContact O-CG1 3.45Å; L531-I535 PolarHBondContact O-N 3.39Å; L531-A561 HydrophobicContact CD2-CB 4.45Å; L531-Q564 HydrophobicContact CD1-CB 3.65Å; L531-Q564 HydrophobicContact CD2-CB 4.44Å; L531-T565 VanDerWaalsContact CB-OG1 3.31Å; L531-T565 WeakPolarHBondContact CB-OG1 3.46Å; L531-T565 VanDerWaalsContact CD1-OG1 3.27Å; L531-T565 WeakPolarHBondContact CD1-OG1 3.38Å
532	D	92.9	Very high	90.6	Very high	121 Å²	121	35.7 Å²	35.7	65%	0.647	18%	0.182	S	C	*	.	H	α-helix	trans	-64.9	-46	178.5	-66.2	-33.3	0	0	0	111.5	N530 A534 I535 E536	N530-D532 VanDerWaalsContact C-N 3.3Å; N530-D532 PolarHBondContact O-N 3.46Å; D532-A534 VanDerWaalsContact C-N 3.35Å; D532-I535 PolarHBondContact O-N 3.19Å; D532-E536 PolarHBondContact O-N 2.59Å
533	K	94.4	Very high	90.8	Very high	73 Å²	73	40.1 Å²	40.1	32%	0.317	21%	0.206	S	C	.	.	H	α-helix	trans	-68.3	-36.1	175.7	-168.2	174.9	171.5	-157.2	0	111.5	E525 N530 I535 E536 M537	E525-K533 HydrophobicContact CG-CB 4.34Å; E525-K533 HydrophobicContact CG-CD 4.02Å; E525-K533 HydrophobicContact CG-CG 4.09Å; E525-K533 WeakPolarHBondContact OE1-CD 3.33Å; E525-K533 WeakPolarHBondContact OE1-CE 3.37Å; E525-K533 IonicContact OE1-NZ 2.72Å; E525-K533 PolarHBondContact OE1-NZ 2.58Å; N530-K533 VanDerWaalsContact ND2-CB 3.31Å; N530-K533 WeakPolarHBondContact ND2-CB 3.47Å; N530-K533 WeakPolarHBondContact ND2-CD 3.24Å; N530-K533 PolarHBondContact O-N 3.39Å; K533-I535 PolarHBondContact O-N 3.15Å; K533-E536 WeakPolarHBondContact O-CB 3.38Å; K533-E536 PolarHBondContact O-N 2.84Å; K533-M537 WeakPolarHBondContact O-CG 3.38Å; K533-M537 PolarHBondContact O-N 3.28Å
534	A	90.4	Very high	91	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-48.1	174.4	0	0	0	0	0	112	G522 E525 V526 N530 L531 D532 E536 M537 F538	G522-A534 VanDerWaalsContact O-CB 3.26Å; G522-A534 WeakPolarHBondContact O-CB 3.4Å; E525-A534 HydrophobicContact CB-CB 3.95Å; V526-A534 HydrophobicContact CB-CB 4.49Å; V526-A534 HydrophobicContact CG2-CB 3.51Å; N530-A534 PolarHBondContact O-N 3.24Å; L531-A534 WeakPolarHBondContact O-CB 3.5Å; L531-A534 PolarHBondContact O-N 3.45Å; D532-A534 VanDerWaalsContact C-N 3.35Å; A534-E536 VanDerWaalsContact C-N 3.32Å; A534-E536 PolarHBondContact O-N 3.47Å; A534-M537 PolarHBondContact O-N 3.03Å; A534-F538 HydrophobicContact CB-CE2 4.15Å; A534-F538 WeakPolarHBondContact O-CD2 3.31Å; A534-F538 WeakPolarHBondContact O-CG 3.21Å; A534-F538 PolarHBondContact O-N 2.87Å
535	I	93.8	Very high	91.1	Very high	10 Å²	10	41 Å²	41	5%	0.051	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-42.7	175.2	-71.7	162.4	0	0	0	110.8	L531 D532 K533 M537 F538 N539 A561 Y562	L531-I535 WeakPolarHBondContact O-CB 3.32Å; L531-I535 WeakPolarHBondContact O-CD1 3.39Å; L531-I535 VanDerWaalsContact O-CG1 3.23Å; L531-I535 WeakPolarHBondContact O-CG1 3.45Å; L531-I535 PolarHBondContact O-N 3.39Å; D532-I535 PolarHBondContact O-N 3.19Å; K533-I535 PolarHBondContact O-N 3.15Å; I535-M537 PolarHBondContact O-N 3.46Å; I535-F538 PolarHBondContact O-N 2.82Å; I535-N539 WeakPolarHBondContact CG2-ND2 3.3Å; I535-N539 WeakPolarHBondContact O-CB 3.45Å; I535-N539 VanDerWaalsContact O-CG 3.29Å; I535-N539 PolarHBondContact O-N 3.01Å; I535-N539 PolarHBondContact O-ND2 3.06Å; I535-A561 HydrophobicContact CD1-CB 4.22Å; I535-A561 HydrophobicContact CG1-CB 3.74Å; I535-Y562 HydrophobicContact CD1-CD1 3.71Å; I535-Y562 HydrophobicContact CD1-CD2 4.1Å; I535-Y562 HydrophobicContact CD1-CE1 3.78Å; I535-Y562 HydrophobicContact CD1-CE2 4.17Å; I535-Y562 HydrophobicContact CD1-CG 3.86Å; I535-Y562 HydrophobicContact CG1-CD2 4.27Å; I535-Y562 HydrophobicContact CG1-CE2 4.21Å; I535-Y562 HydrophobicContact CG1-CG 4.5Å; I535-Y562 HydrophobicContact CG2-CE1 4.25Å; I535-Y562 HydrophobicContact CG2-CE2 3.69Å; I535-Y562 VanDerWaalsContact CG2-CZ 3.49Å; I535-Y562 VanDerWaalsContact CG2-OH 3.31Å; I535-Y562 WeakPolarHBondContact CG2-OH 3.46Å
536	E	97.1	Very high	90.9	Very high	94 Å²	94	43.5 Å²	43.5	44%	0.439	22%	0.222	S	C	.	.	H	α-helix	trans	-57.1	-47.8	174.9	-169.2	-161.1	143.5	0	0	111.6	D532 K533 A534 N539 K540	D532-E536 PolarHBondContact O-N 2.59Å; K533-E536 WeakPolarHBondContact O-CB 3.38Å; K533-E536 PolarHBondContact O-N 2.84Å; A534-E536 VanDerWaalsContact C-N 3.32Å; A534-E536 PolarHBondContact O-N 3.47Å; E536-N539 PolarHBondContact O-N 3.25Å; E536-K540 PolarHBondContact O-N 2.96Å; E536-K540 WeakPolarHBondContact OE1-CE 3.35Å; E536-K540 IonicContact OE1-NZ 2.75Å; E536-K540 PolarHBondContact OE1-NZ 3.29Å
537	M	97.1	Very high	91	Very high	11 Å²	11	42.6 Å²	42.6	5%	0.054	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-42.9	-179.7	-63.2	-55	95.7	0	0	112.1	Y518 M521 K533 A534 I535 N539 K540 A541	Y518-M537 HydrophobicContact CD1-SD 4.04Å; Y518-M537 WeakPolarHBondContact O-CB 3.48Å; M521-M537 HydrophobicContact CB-CG 4.06Å; M521-M537 HydrophobicContact CB-SD 4.41Å; M521-M537 HydrophobicContact CG-CG 3.73Å; M521-M537 HydrophobicContact CG-SD 3.93Å; K533-M537 WeakPolarHBondContact O-CG 3.38Å; K533-M537 PolarHBondContact O-N 3.28Å; A534-M537 PolarHBondContact O-N 3.03Å; I535-M537 PolarHBondContact O-N 3.46Å; M537-N539 VanDerWaalsContact C-N 3.3Å; M537-N539 PolarHBondContact O-N 3.47Å; M537-K540 HydrophobicContact CE-CD 3.98Å; M537-K540 WeakPolarHBondContact O-CB 3.44Å; M537-K540 PolarHBondContact O-N 2.86Å; M537-K540 VanDerWaalsContact O-N 3.12Å; M537-A541 PolarHBondContact O-N 3.31Å
538	F	95.1	Very high	91.3	Very high	3 Å²	3	44.9 Å²	44.9	1%	0.013	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-38.6	174.9	-64.8	-43.6	0	0	0	111.9	E519 G522 V526 A534 I535 K540 A541 I542 L557 C558	E519-F538 HydrophobicContact CG-CE1 4.49Å; G522-F538 VanDerWaalsContact C-CZ 3.46Å; V526-F538 HydrophobicContact CG2-CE2 3.87Å; V526-F538 HydrophobicContact CG2-CZ 4.13Å; A534-F538 HydrophobicContact CB-CE2 4.15Å; A534-F538 WeakPolarHBondContact O-CD2 3.31Å; A534-F538 WeakPolarHBondContact O-CG 3.21Å; A534-F538 PolarHBondContact O-N 2.87Å; I535-F538 PolarHBondContact O-N 2.82Å; F538-K540 VanDerWaalsContact C-N 3.33Å; F538-K540 PolarHBondContact O-N 3.31Å; F538-A541 PolarHBondContact O-N 3.48Å; F538-I542 VanDerWaalsContact O-CG1 3.23Å; F538-I542 WeakPolarHBondContact O-CG1 3.38Å; F538-I542 PolarHBondContact O-N 2.9Å; F538-L557 HydrophobicContact CD1-CB 4.16Å; F538-L557 HydrophobicContact CD1-CD1 4.15Å; F538-L557 HydrophobicContact CD2-CB 4.19Å; F538-L557 HydrophobicContact CE1-CB 3.96Å; F538-L557 HydrophobicContact CE1-CD1 3.69Å; F538-L557 HydrophobicContact CE1-CG 4.45Å; F538-L557 HydrophobicContact CE2-CB 3.98Å; F538-L557 HydrophobicContact CG-CB 4.29Å; F538-L557 HydrophobicContact CZ-CB 3.87Å; F538-L557 HydrophobicContact CZ-CD1 4.21Å; F538-C558 HydrophobicContact CB-CB 4.22Å
539	N	96.1	Very high	91.4	Very high	56 Å²	56	44 Å²	44	30%	0.299	23%	0.229	S	C	.	.	H	α-helix	trans	-64.5	-36.3	174.6	-75.1	-41.3	0	0	0	112.5	I535 E536 M537 I542 N543	I535-N539 WeakPolarHBondContact CG2-ND2 3.3Å; I535-N539 WeakPolarHBondContact O-CB 3.45Å; I535-N539 VanDerWaalsContact O-CG 3.29Å; I535-N539 PolarHBondContact O-N 3.01Å; I535-N539 PolarHBondContact O-ND2 3.06Å; E536-N539 PolarHBondContact O-N 3.25Å; M537-N539 VanDerWaalsContact C-N 3.3Å; M537-N539 PolarHBondContact O-N 3.47Å; N539-I542 PolarHBondContact O-N 3.38Å; N539-N543 PolarHBondContact O-N 3.34Å; N539-N543 PolarHBondContact O-ND2 3.18Å; N539-N543 VanDerWaalsContact O-ND2 3.13Å
540	K	96.2	Very high	91.6	Very high	78 Å²	78	45 Å²	45	34%	0.339	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-45.8	171.7	-70.4	-179.5	-172.9	170.3	0	111.2	Y518 E536 M537 F538 I542 N543	Y518-K540 HydrophobicContact CD1-CB 3.78Å; Y518-K540 HydrophobicContact CD1-CD 3.79Å; Y518-K540 HydrophobicContact CD1-CG 4.43Å; Y518-K540 HydrophobicContact CD2-CB 4.3Å; Y518-K540 HydrophobicContact CE1-CB 4.07Å; Y518-K540 HydrophobicContact CE1-CD 3.5Å; Y518-K540 VanDerWaalsContact CE1-CD 3.5Å; Y518-K540 HydrophobicContact CE1-CG 4.39Å; Y518-K540 HydrophobicContact CG-CB 3.9Å; E536-K540 PolarHBondContact O-N 2.96Å; E536-K540 WeakPolarHBondContact OE1-CE 3.35Å; E536-K540 IonicContact OE1-NZ 2.75Å; E536-K540 PolarHBondContact OE1-NZ 3.29Å; M537-K540 HydrophobicContact CE-CD 3.98Å; M537-K540 WeakPolarHBondContact O-CB 3.44Å; M537-K540 PolarHBondContact O-N 2.86Å; M537-K540 VanDerWaalsContact O-N 3.12Å; F538-K540 VanDerWaalsContact C-N 3.33Å; F538-K540 PolarHBondContact O-N 3.31Å; K540-I542 PolarHBondContact O-N 3.12Å; K540-N543 PolarHBondContact O-N 3.49Å
541	A	93.4	Very high	91.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-41.4	175	0	0	0	0	0	112.5	E519 M537 F538 N543 L544 A545 L554	E519-A541 HydrophobicContact CB-CB 4.48Å; M537-A541 PolarHBondContact O-N 3.31Å; F538-A541 PolarHBondContact O-N 3.48Å; A541-N543 VanDerWaalsContact C-N 3.26Å; A541-N543 PolarHBondContact O-N 2.99Å; A541-L544 PolarHBondContact O-N 3.38Å; A541-A545 PolarHBondContact O-N 3.39Å; A541-L554 HydrophobicContact CB-CD1 3.94Å; A541-L554 HydrophobicContact CB-CD2 3.81Å
542	I	93.4	Very high	91.8	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-58.2	-38.6	178.3	-75	163.4	0	0	0	111.5	F538 N539 K540 L544 A545 M551 L554 Y555 C558	F538-I542 VanDerWaalsContact O-CG1 3.23Å; F538-I542 WeakPolarHBondContact O-CG1 3.38Å; F538-I542 PolarHBondContact O-N 2.9Å; N539-I542 PolarHBondContact O-N 3.38Å; K540-I542 PolarHBondContact O-N 3.12Å; I542-L544 PolarHBondContact O-N 3.37Å; I542-A545 WeakPolarHBondContact O-CB 3.3Å; I542-A545 PolarHBondContact O-N 2.91Å; I542-M551 HydrophobicContact CG2-CG 4.2Å; I542-L554 HydrophobicContact CD1-CB 4.19Å; I542-L554 HydrophobicContact CG1-CB 3.47Å; I542-L554 VanDerWaalsContact CG1-CB 3.47Å; I542-L554 HydrophobicContact CG1-CD1 4.14Å; I542-L554 HydrophobicContact CG1-CG 4.43Å; I542-Y555 HydrophobicContact CD1-CD1 3.76Å; I542-Y555 HydrophobicContact CD1-CE1 3.81Å; I542-Y555 HydrophobicContact CD1-CG 4.13Å; I542-Y555 HydrophobicContact CG2-CE2 4.14Å; I542-C558 HydrophobicContact CD1-CB 4.5Å
543	N	93.4	Very high	91.6	Very high	93 Å²	93	38.1 Å²	38.1	50%	0.497	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.1	179	-67.2	-36.6	0	0	0	113.4	N539 K540 A541	N539-N543 PolarHBondContact O-N 3.34Å; N539-N543 PolarHBondContact O-ND2 3.18Å; N539-N543 VanDerWaalsContact O-ND2 3.13Å; K540-N543 PolarHBondContact O-N 3.49Å; A541-N543 VanDerWaalsContact C-N 3.26Å; A541-N543 PolarHBondContact O-N 2.99Å
544	L	90.9	Very high	91.4	Very high	28 Å²	28	34.8 Å²	34.8	15%	0.147	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-6	177.8	-62.2	171.4	0	0	0	113	M220 K513 D515 Y518 A541 I542	M220-L544 HydrophobicContact SD-CD2 3.7Å; K513-L544 HydrophobicContact CB-CD2 4.25Å; K513-L544 HydrophobicContact CG-CD2 4.34Å; D515-L544 HydrophobicContact CB-CB 3.81Å; D515-L544 HydrophobicContact CB-CD1 4.15Å; Y518-L544 HydrophobicContact CD2-CD1 3.7Å; Y518-L544 HydrophobicContact CE2-CD1 3.67Å; A541-L544 PolarHBondContact O-N 3.38Å; I542-L544 PolarHBondContact O-N 3.37Å
545	A	88.6	Confident	91.6	Very high	10 Å²	10	36.4 Å²	36.4	8%	0.083	18%	0.179	C	C	.	.			trans	-62.7	137.7	-176.9	0	0	0	0	0	112.4	A541 I542 E550 M551 L554	A541-A545 PolarHBondContact O-N 3.39Å; I542-A545 WeakPolarHBondContact O-CB 3.3Å; I542-A545 PolarHBondContact O-N 2.91Å; A545-E550 HydrophobicContact CB-CB 4.2Å; A545-M551 HydrophobicContact CB-CB 4.09Å; A545-M551 HydrophobicContact CB-CE 4.19Å; A545-L554 HydrophobicContact CB-CD1 4.25Å
546	K	84.4	Confident	91.5	Very high	52 Å²	52	36.8 Å²	36.8	23%	0.226	18%	0.182	C	C	.	.			trans	-101.4	-14.1	-174.1	-59	172.8	-171.4	166.2	0	112.5	Y214 F226 G313 E550	Y214-K546 PolarHBondContact OH-O 2.96Å; Y214-K546 VanDerWaalsContact OH-O 3.13Å; F226-K546 VanDerWaalsContact CZ-NZ 3.34Å; G313-K546 WeakPolarHBondContact CA-O 3.34Å; K546-E550 WeakPolarHBondContact CA-OE2 3.46Å; K546-E550 WeakPolarHBondContact CB-OE2 3.32Å; K546-E550 PolarHBondContact N-OE2 3.26Å
547	S	84.9	Confident	91.1	Very high	15 Å²	15	33.8 Å²	33.8	11%	0.105	17%	0.169	C	C	.	.	S	Bend	trans	-136.6	157.3	178.4	68.3	0	0	0	0	113.1	M549 E550 M551	S547-M549 PolarHBondContact O-N 3.22Å; S547-E550 PolarHBondContact N-OE2 3.27Å; S547-E550 PolarHBondContact O-N 3.04Å; S547-E550 VanDerWaalsContact OG-CD 3.24Å; S547-E550 VanDerWaalsContact OG-CG 3.26Å; S547-E550 WeakPolarHBondContact OG-CG 3.33Å; S547-E550 PolarHBondContact OG-N 3.18Å; S547-E550 VanDerWaalsContact OG-N 3.13Å; S547-E550 PolarHBondContact OG-OE2 3.02Å; S547-M551 WeakPolarHBondContact O-CB 3.31Å; S547-M551 PolarHBondContact O-N 3.42Å; S547-M551 VanDerWaalsContact O-N 3.1Å
548	E	88.6	Confident	90.8	Very high	82 Å²	82	33.4 Å²	33.4	38%	0.383	17%	0.167	S	C	.	.	H	α-helix	trans	-60.1	-30.8	171.7	-173.6	179.2	159.1	0	0	111.2	A210 Y214 S552	A210-E548 HydrophobicContact CB-CG 4.1Å; Y214-E548 HydrophobicContact CD1-CB 4.16Å; Y214-E548 HydrophobicContact CD2-CB 4.43Å; Y214-E548 HydrophobicContact CE1-CB 4.42Å; Y214-E548 HydrophobicContact CG-CB 4.15Å; E548-S552 VanDerWaalsContact O-CB 3.28Å; E548-S552 WeakPolarHBondContact O-CB 3.48Å; E548-S552 PolarHBondContact O-N 3.05Å
549	M	86	Confident	90.5	Very high	80 Å²	80	33.7 Å²	33.7	39%	0.394	17%	0.169	S	C	.	.	H	α-helix	trans	-67.8	-49.7	179.3	-172.8	170.5	-168.4	0	0	112.3	Q351 S547 M551 S552 H553	Q351-M549 HydrophobicContact CG-CE 4.35Å; Q351-M549 HydrophobicContact CG-SD 4.07Å; Q351-M549 PolarHBondContact NE2-SD 2.87Å; S547-M549 PolarHBondContact O-N 3.22Å; M549-M551 VanDerWaalsContact C-N 3.33Å; M549-M551 PolarHBondContact O-N 2.94Å; M549-S552 PolarHBondContact O-N 3.21Å; M549-H553 PolarHBondContact O-N 3.01Å
550	E	87.5	Confident	90.2	Very high	56 Å²	56	32.1 Å²	32.1	26%	0.262	16%	0.164	S	C	.	.	H	α-helix	trans	-59.6	-45.6	174.5	-71.5	158.2	175	0	0	110.7	A545 K546 S547 S552 H553 L554	A545-E550 HydrophobicContact CB-CB 4.2Å; K546-E550 WeakPolarHBondContact CA-OE2 3.46Å; K546-E550 WeakPolarHBondContact CB-OE2 3.32Å; K546-E550 PolarHBondContact N-OE2 3.26Å; S547-E550 PolarHBondContact N-OE2 3.27Å; S547-E550 PolarHBondContact O-N 3.04Å; S547-E550 VanDerWaalsContact OG-CD 3.24Å; S547-E550 VanDerWaalsContact OG-CG 3.26Å; S547-E550 WeakPolarHBondContact OG-CG 3.33Å; S547-E550 PolarHBondContact OG-N 3.18Å; S547-E550 VanDerWaalsContact OG-N 3.13Å; S547-E550 PolarHBondContact OG-OE2 3.02Å; E550-S552 VanDerWaalsContact C-N 3.32Å; E550-S552 PolarHBondContact O-N 3.01Å; E550-H553 WeakPolarHBondContact O-CB 3.47Å; E550-H553 PolarHBondContact O-N 3.47Å; E550-H553 VanDerWaalsContact O-N 3.17Å; E550-L554 WeakPolarHBondContact O-CG 3.36Å; E550-L554 PolarHBondContact O-N 3.37Å
551	M	91.7	Very high	89.9	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-39.6	179.1	-168.8	175	-72.9	0	0	111.9	A210 K213 Y214 I542 A545 S547 M549 H553 L554 Y555	A210-M551 HydrophobicContact CB-CB 4Å; A210-M551 HydrophobicContact CB-CG 3.97Å; A210-M551 HydrophobicContact CB-SD 4.45Å; K213-M551 HydrophobicContact CB-SD 3.63Å; K213-M551 HydrophobicContact CG-CE 4.08Å; K213-M551 HydrophobicContact CG-SD 3.61Å; Y214-M551 HydrophobicContact CD2-CE 4.06Å; Y214-M551 HydrophobicContact CD2-SD 4.41Å; I542-M551 HydrophobicContact CG2-CG 4.2Å; A545-M551 HydrophobicContact CB-CB 4.09Å; A545-M551 HydrophobicContact CB-CE 4.19Å; S547-M551 WeakPolarHBondContact O-CB 3.31Å; S547-M551 PolarHBondContact O-N 3.42Å; S547-M551 VanDerWaalsContact O-N 3.1Å; M549-M551 VanDerWaalsContact C-N 3.33Å; M549-M551 PolarHBondContact O-N 2.94Å; M551-H553 VanDerWaalsContact C-N 3.34Å; M551-H553 PolarHBondContact O-N 3.02Å; M551-L554 PolarHBondContact O-N 3.26Å; M551-Y555 HydrophobicContact CG-CD2 3.73Å; M551-Y555 HydrophobicContact CG-CE2 3.54Å; M551-Y555 WeakPolarHBondContact O-CB 3.5Å; M551-Y555 VanDerWaalsContact O-CD2 3.22Å; M551-Y555 WeakPolarHBondContact O-CD2 3.32Å; M551-Y555 PolarHBondContact O-N 3.14Å; M551-Y555 HydrophobicContact SD-CE2 3.98Å
552	S	91	Very high	89.7	Confident	15 Å²	15	33.1 Å²	33.1	11%	0.105	17%	0.167	C	C	.	.	H	α-helix	trans	-64	-38.6	175.5	177.1	0	0	0	0	112.3	K207 E548 M549 E550 S556	K207-S552 WeakPolarHBondContact CG-OG 3.44Å; K207-S552 PolarHBondContact N-OG 3.13Å; E548-S552 VanDerWaalsContact O-CB 3.28Å; E548-S552 WeakPolarHBondContact O-CB 3.48Å; E548-S552 PolarHBondContact O-N 3.05Å; M549-S552 PolarHBondContact O-N 3.21Å; E550-S552 VanDerWaalsContact C-N 3.32Å; E550-S552 PolarHBondContact O-N 3.01Å; S552-S556 PolarHBondContact O-N 3.41Å; S552-S556 VanDerWaalsContact O-N 3.16Å; S552-S556 PolarHBondContact O-OG 3.06Å
553	H	89.7	Confident	89.5	Confident	38 Å²	38	33.2 Å²	33.2	18%	0.176	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-49.9	175.3	167.5	65.2	0	0	0	110.9	E519 M549 E550 M551 Y555 S556 L557	E519-H553 IonicContact OE1-CD2 2.75Å; E519-H553 IonicContact OE1-CE1 3.68Å; E519-H553 IonicContact OE1-NE2 3.25Å; E519-H553 PolarHBondContact OE1-NE2 3.25Å; M549-H553 PolarHBondContact O-N 3.01Å; E550-H553 WeakPolarHBondContact O-CB 3.47Å; E550-H553 PolarHBondContact O-N 3.47Å; E550-H553 VanDerWaalsContact O-N 3.17Å; M551-H553 VanDerWaalsContact C-N 3.34Å; M551-H553 PolarHBondContact O-N 3.02Å; H553-Y555 PolarHBondContact O-N 3.21Å; H553-S556 WeakPolarHBondContact O-CA 3.49Å; H553-S556 VanDerWaalsContact O-CB 3.25Å; H553-S556 WeakPolarHBondContact O-CB 3.42Å; H553-S556 PolarHBondContact O-N 3.14Å; H553-L557 PolarHBondContact O-N 3.19Å; H553-L557 VanDerWaalsContact O-N 3.1Å
554	L	90.1	Very high	89.3	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-39.2	179.6	-67.2	167.2	0	0	0	112.9	E519 A541 I542 A545 E550 M551 S556 L557 C558	E519-L554 HydrophobicContact CB-CD2 4.13Å; E519-L554 HydrophobicContact CG-CD2 3.87Å; A541-L554 HydrophobicContact CB-CD1 3.94Å; A541-L554 HydrophobicContact CB-CD2 3.81Å; I542-L554 HydrophobicContact CD1-CB 4.19Å; I542-L554 HydrophobicContact CG1-CB 3.47Å; I542-L554 VanDerWaalsContact CG1-CB 3.47Å; I542-L554 HydrophobicContact CG1-CD1 4.14Å; I542-L554 HydrophobicContact CG1-CG 4.43Å; A545-L554 HydrophobicContact CB-CD1 4.25Å; E550-L554 WeakPolarHBondContact O-CG 3.36Å; E550-L554 PolarHBondContact O-N 3.37Å; M551-L554 PolarHBondContact O-N 3.26Å; L554-S556 VanDerWaalsContact C-N 3.26Å; L554-S556 PolarHBondContact O-N 3.44Å; L554-L557 HydrophobicContact CD2-CD1 4.45Å; L554-L557 PolarHBondContact O-N 2.91Å; L554-C558 WeakPolarHBondContact O-CB 3.39Å; L554-C558 PolarHBondContact O-N 3.41Å
555	Y	94	Very high	89.2	Confident	34 Å²	34	30.8 Å²	30.8	13%	0.133	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-34.3	172.1	-86.2	-58.8	0	0	0	112.4	K209 A210 K213 I542 M551 H553 C558 D559	K209-Y555 HydrophobicContact CB-CD1 3.95Å; K209-Y555 HydrophobicContact CB-CD2 3.71Å; K209-Y555 HydrophobicContact CB-CE1 4.13Å; K209-Y555 HydrophobicContact CB-CE2 3.89Å; K209-Y555 HydrophobicContact CB-CG 3.76Å; K209-Y555 HydrophobicContact CD-CD1 3.87Å; K209-Y555 HydrophobicContact CD-CE1 4.28Å; K209-Y555 HydrophobicContact CD-CG 4.28Å; A210-Y555 HydrophobicContact CB-CD2 4.15Å; K213-Y555 HydrophobicContact CB-CE2 3.99Å; K213-Y555 WeakPolarHBondContact CB-OH 3.46Å; K213-Y555 HydrophobicContact CG-CE2 4.34Å; K213-Y555 VanDerWaalsContact CG-OH 3.31Å; K213-Y555 WeakPolarHBondContact CG-OH 3.29Å; I542-Y555 HydrophobicContact CD1-CD1 3.76Å; I542-Y555 HydrophobicContact CD1-CE1 3.81Å; I542-Y555 HydrophobicContact CD1-CG 4.13Å; I542-Y555 HydrophobicContact CG2-CE2 4.14Å; M551-Y555 HydrophobicContact CG-CD2 3.73Å; M551-Y555 HydrophobicContact CG-CE2 3.54Å; M551-Y555 WeakPolarHBondContact O-CB 3.5Å; M551-Y555 VanDerWaalsContact O-CD2 3.22Å; M551-Y555 WeakPolarHBondContact O-CD2 3.32Å; M551-Y555 PolarHBondContact O-N 3.14Å; M551-Y555 HydrophobicContact SD-CE2 3.98Å; H553-Y555 PolarHBondContact O-N 3.21Å; Y555-C558 PolarHBondContact O-N 3.49Å; Y555-D559 WeakPolarHBondContact O-CB 3.47Å; Y555-D559 VanDerWaalsContact O-CG 3.32Å; Y555-D559 PolarHBondContact O-N 3.02Å
556	S	91.4	Very high	89.4	Confident	17 Å²	17	32.3 Å²	32.3	12%	0.119	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-41.9	175.3	-56.6	0	0	0	0	111.5	L202 S552 H553 L554 D559 A560	L202-S556 WeakPolarHBondContact CD2-O 3.31Å; L202-S556 PolarHBondContact O-OG 3.32Å; S552-S556 PolarHBondContact O-N 3.41Å; S552-S556 VanDerWaalsContact O-N 3.16Å; S552-S556 PolarHBondContact O-OG 3.06Å; H553-S556 WeakPolarHBondContact O-CA 3.49Å; H553-S556 VanDerWaalsContact O-CB 3.25Å; H553-S556 WeakPolarHBondContact O-CB 3.42Å; H553-S556 PolarHBondContact O-N 3.14Å; L554-S556 VanDerWaalsContact C-N 3.26Å; L554-S556 PolarHBondContact O-N 3.44Å; S556-D559 PolarHBondContact O-N 3.48Å; S556-A560 WeakPolarHBondContact O-CB 3.06Å; S556-A560 PolarHBondContact O-N 3.49Å
557	L	89.3	Confident	89.6	Confident	31 Å²	31	29.9 Å²	29.9	16%	0.162	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-44.8	174.1	-63.1	178.9	0	0	0	111.6	E519 F538 H553 L554 A560 A561	E519-L557 HydrophobicContact CG-CD1 4.05Å; F538-L557 HydrophobicContact CD1-CB 4.16Å; F538-L557 HydrophobicContact CD1-CD1 4.15Å; F538-L557 HydrophobicContact CD2-CB 4.19Å; F538-L557 HydrophobicContact CE1-CB 3.96Å; F538-L557 HydrophobicContact CE1-CD1 3.69Å; F538-L557 HydrophobicContact CE1-CG 4.45Å; F538-L557 HydrophobicContact CE2-CB 3.98Å; F538-L557 HydrophobicContact CG-CB 4.29Å; F538-L557 HydrophobicContact CZ-CB 3.87Å; F538-L557 HydrophobicContact CZ-CD1 4.21Å; H553-L557 PolarHBondContact O-N 3.19Å; H553-L557 VanDerWaalsContact O-N 3.1Å; L554-L557 HydrophobicContact CD2-CD1 4.45Å; L554-L557 PolarHBondContact O-N 2.91Å; L557-A560 PolarHBondContact O-N 3.11Å; L557-A561 PolarHBondContact O-N 2.88Å
558	C	90.4	Very high	89.8	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.02	15%	0.154	C	C	.	.	H	α-helix	trans	-61	-46.5	178	-163.7	0	0	0	0	111.4	F538 I542 L554 Y555 A560 A561 Y562	F538-C558 HydrophobicContact CB-CB 4.22Å; I542-C558 HydrophobicContact CD1-CB 4.5Å; L554-C558 WeakPolarHBondContact O-CB 3.39Å; L554-C558 PolarHBondContact O-N 3.41Å; Y555-C558 PolarHBondContact O-N 3.49Å; C558-A560 PolarHBondContact O-N 2.93Å; C558-A561 WeakPolarHBondContact O-CB 3.3Å; C558-A561 PolarHBondContact O-N 3.15Å; C558-Y562 WeakPolarHBondContact O-CD2 3.48Å; C558-Y562 PolarHBondContact O-N 3.47Å; C558-Y562 WeakPolarHBondContact SG-CE2 3.45Å
559	D	88.9	Confident	89.8	Confident	9 Å²	9	35 Å²	35	5%	0.048	17%	0.168	C	C	.	.	H	α-helix	trans	-67.2	-34.5	179.4	-77.2	-11.4	0	0	0	113	L177 L202 K209 Y555 S556 Y562 A563	L177-D559 HydrophobicContact CD2-CB 3.99Å; L202-D559 HydrophobicContact CD2-CB 3.91Å; K209-D559 IonicContact NZ-OD1 3.52Å; K209-D559 PolarHBondContact NZ-OD1 3.19Å; K209-D559 IonicContact NZ-OD2 2.65Å; K209-D559 PolarHBondContact NZ-OD2 2.83Å; Y555-D559 WeakPolarHBondContact O-CB 3.47Å; Y555-D559 VanDerWaalsContact O-CG 3.32Å; Y555-D559 PolarHBondContact O-N 3.02Å; S556-D559 PolarHBondContact O-N 3.48Å; D559-Y562 PolarHBondContact O-N 2.82Å; D559-A563 VanDerWaalsContact O-CB 3.27Å; D559-A563 WeakPolarHBondContact O-CB 3.31Å; D559-A563 PolarHBondContact O-N 3.13Å
560	A	90.4	Very high	89.9	Confident	23 Å²	23	35.9 Å²	35.9	19%	0.19	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-44.3	171.1	0	0	0	0	0	111.4	L202 S556 L557 C558 A563 Q564	L202-A560 HydrophobicContact CD1-CB 4.28Å; L202-A560 HydrophobicContact CD2-CB 4.16Å; S556-A560 WeakPolarHBondContact O-CB 3.06Å; S556-A560 PolarHBondContact O-N 3.49Å; L557-A560 PolarHBondContact O-N 3.11Å; C558-A560 PolarHBondContact O-N 2.93Å; A560-A563 PolarHBondContact O-N 3.03Å; A560-Q564 WeakPolarHBondContact O-CG 3.49Å; A560-Q564 PolarHBondContact O-N 3.43Å
561	A	88.9	Confident	89.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-44.7	176	0	0	0	0	0	111.7	V526 L531 I535 L557 C558 A563 Q564 T565	V526-A561 HydrophobicContact CG2-CB 4.35Å; L531-A561 HydrophobicContact CD2-CB 4.45Å; I535-A561 HydrophobicContact CD1-CB 4.22Å; I535-A561 HydrophobicContact CG1-CB 3.74Å; L557-A561 PolarHBondContact O-N 2.88Å; C558-A561 WeakPolarHBondContact O-CB 3.3Å; C558-A561 PolarHBondContact O-N 3.15Å; A561-A563 PolarHBondContact O-N 2.91Å; A561-Q564 PolarHBondContact O-N 3.39Å; A561-T565 PolarHBondContact O-N 3.19Å; A561-T565 PolarHBondContact O-OG1 2.76Å
562	Y	90.1	Very high	89.6	Confident	99 Å²	99	37 Å²	37	39%	0.388	19%	0.189	S	C	.	.	H	α-helix	trans	-58.6	-46.5	173.8	-85.5	-67.4	0	0	0	112.3	I535 C558 D559 Q564 T565 E566	I535-Y562 HydrophobicContact CD1-CD1 3.71Å; I535-Y562 HydrophobicContact CD1-CD2 4.1Å; I535-Y562 HydrophobicContact CD1-CE1 3.78Å; I535-Y562 HydrophobicContact CD1-CE2 4.17Å; I535-Y562 HydrophobicContact CD1-CG 3.86Å; I535-Y562 HydrophobicContact CG1-CD2 4.27Å; I535-Y562 HydrophobicContact CG1-CE2 4.21Å; I535-Y562 HydrophobicContact CG1-CG 4.5Å; I535-Y562 HydrophobicContact CG2-CE1 4.25Å; I535-Y562 HydrophobicContact CG2-CE2 3.69Å; I535-Y562 VanDerWaalsContact CG2-CZ 3.49Å; I535-Y562 VanDerWaalsContact CG2-OH 3.31Å; I535-Y562 WeakPolarHBondContact CG2-OH 3.46Å; C558-Y562 WeakPolarHBondContact O-CD2 3.48Å; C558-Y562 PolarHBondContact O-N 3.47Å; C558-Y562 WeakPolarHBondContact SG-CE2 3.45Å; D559-Y562 PolarHBondContact O-N 2.82Å; Y562-Q564 VanDerWaalsContact C-N 3.29Å; Y562-Q564 PolarHBondContact O-N 2.89Å; Y562-T565 WeakPolarHBondContact O-CB 3.46Å; Y562-T565 PolarHBondContact O-N 3.1Å; Y562-E566 WeakPolarHBondContact O-CG 3.45Å; Y562-E566 PolarHBondContact O-N 3.42Å
563	A	89.6	Confident	89.1	Confident	3 Å²	3	36.9 Å²	36.9	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-39	178.9	0	0	0	0	0	111.5	L177 T181 D559 A560 A561 E566 V567	L177-A563 HydrophobicContact CD2-CB 3.99Å; L177-A563 HydrophobicContact CG-CB 3.83Å; T181-A563 HydrophobicContact CG2-CB 4.26Å; D559-A563 VanDerWaalsContact O-CB 3.27Å; D559-A563 WeakPolarHBondContact O-CB 3.31Å; D559-A563 PolarHBondContact O-N 3.13Å; A560-A563 PolarHBondContact O-N 3.03Å; A561-A563 PolarHBondContact O-N 2.91Å; A563-E566 PolarHBondContact O-N 3.49Å; A563-V567 WeakPolarHBondContact O-CB 3.5Å; A563-V567 WeakPolarHBondContact O-CG2 3.29Å; A563-V567 PolarHBondContact O-N 3.22Å
564	Q	88.6	Confident	88.4	Confident	31 Å²	31	42.8 Å²	42.8	15%	0.145	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-41.5	174.3	-71.7	177.7	22.6	0	0	112.4	T181 L531 A560 A561 Y562 E566 V567 A568	T181-Q564 HydrophobicContact CG2-CG 4.05Å; L531-Q564 HydrophobicContact CD1-CB 3.65Å; L531-Q564 HydrophobicContact CD2-CB 4.44Å; A560-Q564 WeakPolarHBondContact O-CG 3.49Å; A560-Q564 PolarHBondContact O-N 3.43Å; A561-Q564 PolarHBondContact O-N 3.39Å; Y562-Q564 VanDerWaalsContact C-N 3.29Å; Y562-Q564 PolarHBondContact O-N 2.89Å; Q564-E566 VanDerWaalsContact C-N 3.32Å; Q564-E566 PolarHBondContact O-N 3.04Å; Q564-V567 PolarHBondContact O-N 3.14Å; Q564-A568 WeakPolarHBondContact O-CB 3.33Å; Q564-A568 PolarHBondContact O-N 3.13Å
565	T	89.8	Confident	87.4	Confident	39 Å²	39	43.8 Å²	43.8	24%	0.239	22%	0.219	C	C	.	.	H	α-helix	trans	-59.9	-45.2	174.9	-60.6	0	0	0	0	110.9	L531 A561 Y562 A568 R569	L531-T565 VanDerWaalsContact CB-OG1 3.31Å; L531-T565 WeakPolarHBondContact CB-OG1 3.46Å; L531-T565 VanDerWaalsContact CD1-OG1 3.27Å; L531-T565 WeakPolarHBondContact CD1-OG1 3.38Å; A561-T565 PolarHBondContact O-N 3.19Å; A561-T565 PolarHBondContact O-OG1 2.76Å; Y562-T565 WeakPolarHBondContact O-CB 3.46Å; Y562-T565 PolarHBondContact O-N 3.1Å; T565-A568 PolarHBondContact O-N 3.05Å; T565-R569 WeakPolarHBondContact O-CB 3.26Å; T565-R569 PolarHBondContact O-N 3.42Å
566	E	91.1	Very high	85.9	Confident	43 Å²	43	47.3 Å²	47.3	20%	0.201	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-41.8	179.1	-74.5	-58	141.6	0	0	112.8	E178 Y562 A563 Q564 R569 K570	E178-E566 HydrophobicContact CG-CB 4.23Å; Y562-E566 WeakPolarHBondContact O-CG 3.45Å; Y562-E566 PolarHBondContact O-N 3.42Å; A563-E566 PolarHBondContact O-N 3.49Å; Q564-E566 VanDerWaalsContact C-N 3.32Å; Q564-E566 PolarHBondContact O-N 3.04Å; E566-R569 VanDerWaalsContact CD-NH2 3.32Å; E566-R569 PolarHBondContact O-N 2.73Å; E566-R569 IonicContact OE1-CZ 2.72Å; E566-R569 IonicContact OE1-NE 2.73Å; E566-R569 IonicContact OE1-NH2 3.12Å; E566-R569 PolarHBondContact OE1-NH2 3.35Å; E566-R569 IonicContact OE2-CZ 2.74Å; E566-R569 IonicContact OE2-NE 2.66Å; E566-R569 PolarHBondContact OE2-NE 3.47Å; E566-R569 VanDerWaalsContact OE2-NE 3.13Å; E566-R569 IonicContact OE2-NH2 3.42Å; E566-R569 PolarHBondContact OE2-NH2 2.86Å; E566-K570 WeakPolarHBondContact O-CB 3.43Å; E566-K570 WeakPolarHBondContact O-CG 3.44Å; E566-K570 PolarHBondContact O-N 3.13Å; E566-K570 WeakPolarHBondContact OE2-CE 3.4Å
567	V	89.4	Confident	84.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-39.3	176.6	166.4	0	0	0	0	111.5	E178 T181 A182 I185 A563 Q564 R569 Y571 L573	E178-V567 WeakPolarHBondContact O-CG2 3.42Å; T181-V567 HydrophobicContact CG2-CG2 4.03Å; A182-V567 HydrophobicContact CB-CG1 3.91Å; A182-V567 HydrophobicContact CB-CG2 4.05Å; I185-V567 HydrophobicContact CD1-CG1 3.89Å; A563-V567 WeakPolarHBondContact O-CB 3.5Å; A563-V567 WeakPolarHBondContact O-CG2 3.29Å; A563-V567 PolarHBondContact O-N 3.22Å; Q564-V567 PolarHBondContact O-N 3.14Å; V567-R569 VanDerWaalsContact C-N 3.31Å; V567-R569 PolarHBondContact O-N 3.46Å; V567-Y571 HydrophobicContact CB-CD2 4.38Å; V567-Y571 HydrophobicContact CG1-CD2 4.1Å; V567-Y571 HydrophobicContact CG2-CD2 4.35Å; V567-Y571 WeakPolarHBondContact O-CB 3.38Å; V567-Y571 PolarHBondContact O-N 3.14Å; V567-L573 HydrophobicContact CG1-CB 3.79Å; V567-L573 HydrophobicContact CG1-CD1 4.32Å
568	A	88.9	Confident	83.2	Confident	24 Å²	24	55.1 Å²	55.1	20%	0.198	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-41.7	173.4	0	0	0	0	0	111.5	Q564 T565 G572 L573 K574	Q564-A568 WeakPolarHBondContact O-CB 3.33Å; Q564-A568 PolarHBondContact O-N 3.13Å; T565-A568 PolarHBondContact O-N 3.05Å; A568-G572 VanDerWaalsContact O-CA 3.23Å; A568-G572 WeakPolarHBondContact O-CA 3.46Å; A568-G572 PolarHBondContact O-N 3.39Å; A568-G572 VanDerWaalsContact O-N 3.08Å; A568-L573 WeakPolarHBondContact CA-O 3.46Å; A568-L573 PolarHBondContact N-O 3.3Å; A568-K574 HydrophobicContact CB-CG 3.92Å
569	R	89.9	Confident	82.9	Confident	181 Å²	181	57.7 Å²	57.7	68%	0.683	30%	0.302	S	S	*	.	H	α-helix	trans	-68.2	-47.8	177.4	-175.7	177.7	71.7	149.1	2.3	112.9	T565 E566 V567	T565-R569 WeakPolarHBondContact O-CB 3.26Å; T565-R569 PolarHBondContact O-N 3.42Å; E566-R569 VanDerWaalsContact CD-NH2 3.32Å; E566-R569 PolarHBondContact O-N 2.73Å; E566-R569 IonicContact OE1-CZ 2.72Å; E566-R569 IonicContact OE1-NE 2.73Å; E566-R569 IonicContact OE1-NH2 3.12Å; E566-R569 PolarHBondContact OE1-NH2 3.35Å; E566-R569 IonicContact OE2-CZ 2.74Å; E566-R569 IonicContact OE2-NE 2.66Å; E566-R569 PolarHBondContact OE2-NE 3.47Å; E566-R569 VanDerWaalsContact OE2-NE 3.13Å; E566-R569 IonicContact OE2-NH2 3.42Å; E566-R569 PolarHBondContact OE2-NH2 2.86Å; V567-R569 VanDerWaalsContact C-N 3.31Å; V567-R569 PolarHBondContact O-N 3.46Å
570	K	87.4	Confident	82.5	Confident	98 Å²	98	60.3 Å²	60.3	43%	0.426	32%	0.315	S	S	.	.	H	α-helix	trans	-78.5	-38.9	-173.1	-70	179.7	-175	-177.5	0	113.1	E178 E566	E178-K570 IonicContact OE1-NZ 3.14Å; E178-K570 IonicContact OE2-NZ 3.75Å; E178-K570 PolarHBondContact OE2-NZ 3.28Å; E566-K570 WeakPolarHBondContact O-CB 3.43Å; E566-K570 WeakPolarHBondContact O-CG 3.44Å; E566-K570 PolarHBondContact O-N 3.13Å; E566-K570 WeakPolarHBondContact OE2-CE 3.4Å
571	Y	86.1	Confident	82.1	Confident	31 Å²	31	62.3 Å²	62.3	12%	0.122	32%	0.322	C	S	.	.	H	α-helix	trans	-116.6	-6.7	-170.1	-57.6	-71.7	0	0	0	113.9	V150 P154 L160 R163 D179 A182 V567 L573	V150-Y571 HydrophobicContact CG1-CE1 3.73Å; P154-Y571 HydrophobicContact CB-CD1 4.17Å; L160-Y571 HydrophobicContact CD2-CE1 4.07Å; R163-Y571 PolarHBondContact NH2-OH 3.38Å; D179-Y571 PolarHBondContact OD1-OH 3.24Å; A182-Y571 HydrophobicContact CB-CD2 3.99Å; A182-Y571 HydrophobicContact CB-CE2 4.08Å; V567-Y571 HydrophobicContact CB-CD2 4.38Å; V567-Y571 HydrophobicContact CG1-CD2 4.1Å; V567-Y571 HydrophobicContact CG2-CD2 4.35Å; V567-Y571 WeakPolarHBondContact O-CB 3.38Å; V567-Y571 PolarHBondContact O-N 3.14Å; Y571-L573 HydrophobicContact CG-CD1 4.29Å; Y571-L573 PolarHBondContact O-N 3.18Å
572	G	86.3	Confident	81.7	Confident	54 Å²	54	65.9 Å²	65.9	56%	0.557	34%	0.341	S	S	*	.			trans	62.4	26	-171.9	0	0	0	0	0	112.5	A568	A568-G572 VanDerWaalsContact O-CA 3.23Å; A568-G572 WeakPolarHBondContact O-CA 3.46Å; A568-G572 PolarHBondContact O-N 3.39Å; A568-G572 VanDerWaalsContact O-N 3.08Å
573	L	81.3	Confident	81.2	Confident	11 Å²	11	63.9 Å²	63.9	6%	0.058	34%	0.338	C	S	.	.			trans	-101.8	122	-179.1	-64.6	174.1	0	0	0	109.1	A182 I185 L186 V567 A568 Y571	A182-L573 HydrophobicContact CB-CD1 4.19Å; I185-L573 HydrophobicContact CG2-CB 4.16Å; L186-L573 HydrophobicContact CD1-CD1 3.99Å; L186-L573 HydrophobicContact CD2-CD1 3.84Å; L186-L573 HydrophobicContact CD2-CD2 3.61Å; L186-L573 HydrophobicContact CD2-CG 4.39Å; L186-L573 HydrophobicContact CG-CD1 3.71Å; L186-L573 HydrophobicContact CG-CD2 4.37Å; V567-L573 HydrophobicContact CG1-CB 3.79Å; V567-L573 HydrophobicContact CG1-CD1 4.32Å; A568-L573 WeakPolarHBondContact CA-O 3.46Å; A568-L573 PolarHBondContact N-O 3.3Å; Y571-L573 HydrophobicContact CG-CD1 4.29Å; Y571-L573 PolarHBondContact O-N 3.18Å
574	K	74.9	Confident	80.6	Confident	162 Å²	162	67.9 Å²	67.9	70%	0.704	36%	0.359	S	S	*	.			trans	-120.8	142.2	175	-66.8	-175.2	176.9	-172.5	0	109.4	A568	A568-K574 HydrophobicContact CB-CG 3.92Å
575	P	67.9	Low	80.1	Confident	25 Å²	25	70.6 Å²	70.6	16%	0.162	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-64.8	161.9	169.3	28.8	-33.1	0	0	0	110.4	T577	P575-T577 PolarHBondContact O-N 3.42Å
576	P	62.7	Low	79.3	Confident	108 Å²	108	73 Å²	73	70%	0.701	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-58.7	127.3	168.7	-15.7	28.6	0	0	0	109.5
577	T	69.1	Low	78.3	Confident	82 Å²	82	75.5 Å²	75.5	50%	0.503	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-97.3	152.1	173.1	57	0	0	0	0	109.8	Q527 P575	Q527-T577 CarbonylContact O-C 3.09Å; Q527-T577 WeakPolarHBondContact O-CA 3.5Å; P575-T577 PolarHBondContact O-N 3.42Å
578	L	55.9	Low	77.3	Confident	130 Å²	130	82.4 Å²	82.4	68%	0.681	44%	0.436	S	S	*	.			trans	-66.4	0	170.6	-76.9	176.8	0	0	0	111.9	Q527	Q527-L578 HydrophobicContact CB-CD1 3.68Å; Q527-L578 HydrophobicContact CB-CG 4.1Å; Q527-L578 HydrophobicContact CG-CD1 4.34Å; Q527-L578 PolarHBondContact O-N 3.4Å

Retrieved 578 of 578 residues in 114.6 ms (Link to these results)

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