A0A3Q0KPR1_SCHMA Loading...

MAU2 chromatid cohesion factor homolog

AlphaFold DB , UniProt , Accession A0A3Q0KPR1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 706 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	28.8	Very low	25.9	Very low	242 Å²	242	142.5 Å²	142.5	100%	1.192	85%	0.847	S	S	*	*				0	136.1	0	-80.4	-167.6	174.6	0	0	107.9
2	Q	30.3	Very low	25.8	Very low	200 Å²	200	139.3 Å²	139.3	94%	0.935	84%	0.836	S	S	*	*			trans	70	96.2	-174.5	-63.2	-176.3	-9.4	0	0	114.8
3	G	26.8	Very low	25.5	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	85%	0.845	S	S	*	*			trans	-78.8	132.6	174.2	0	0	0	0	0	111.7	N5	G3-N5 PolarHBondContact O-N 3.11Å
4	T	25.4	Very low	25.5	Very low	129 Å²	129	138.7 Å²	138.7	79%	0.791	83%	0.825	S	S	*	*			trans	-73.7	101.8	165.1	41.8	0	0	0	0	109.2	I6	T4-I6 PolarHBondContact O-N 2.77Å
5	N	26.8	Very low	25.4	Very low	165 Å²	165	137.3 Å²	137.3	88%	0.882	83%	0.825	S	S	*	*			trans	-76.2	106.2	170.8	-83.7	-19.1	0	0	0	109.5	G3	G3-N5 PolarHBondContact O-N 3.11Å
6	I	24.1	Very low	25.3	Very low	149 Å²	149	137.7 Å²	137.7	76%	0.764	82%	0.815	S	S	*	*			trans	-72.9	133.4	170.4	-68.5	171	0	0	0	108.6	T4 T8	T4-I6 PolarHBondContact O-N 2.77Å; I6-T8 PolarHBondContact O-N 3.19Å
7	A	22.9	Very low	25.3	Very low	96 Å²	96	135.8 Å²	135.8	79%	0.793	81%	0.807	S	S	*	*			trans	-55.2	116.5	175.8	0	0	0	0	0	112
8	T	25.4	Very low	25.3	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	81%	0.807	S	S	*	*			trans	-91.2	110	161.8	48.2	0	0	0	0	108.7	I6 S10	I6-T8 PolarHBondContact O-N 3.19Å; T8-S10 PolarHBondContact O-N 3.35Å
9	S	24.4	Very low	25.9	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	78%	0.776	S	S	*	*			trans	-52.2	117.9	166.6	46.4	0	0	0	0	110.9	L11	S9-L11 PolarHBondContact O-N 3.28Å
10	S	27.4	Very low	26.4	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	75%	0.747	S	S	*	*			trans	-66.6	109.2	171.3	48.8	0	0	0	0	110	T8	T8-S10 PolarHBondContact O-N 3.35Å
11	L	22.8	Very low	26.5	Very low	155 Å²	155	126.3 Å²	126.3	81%	0.812	74%	0.738	S	S	*	*			trans	-63.6	137.1	172.7	-86.7	113.3	0	0	0	112.1	S9	S9-L11 PolarHBondContact O-N 3.28Å
12	S	24.2	Very low	26.3	Very low	103 Å²	103	119.8 Å²	119.8	72%	0.72	71%	0.714	S	S	*	*			trans	49.1	96.2	148	62	0	0	0	0	118.1	A14	S12-A14 PolarHBondContact O-N 2.88Å; S12-A14 VanDerWaalsContact O-N 3.09Å
13	Q	22.5	Very low	26	Very low	203 Å²	203	116.6 Å²	116.6	95%	0.949	70%	0.701	S	S	*	*			trans	-64.7	98.6	152.9	-74.6	177	-11.5	0	0	108.8	S15	Q13-S15 PolarHBondContact O-N 3.32Å
14	A	25.1	Very low	25.9	Very low	68 Å²	68	120.4 Å²	120.4	56%	0.562	71%	0.705	S	S	*	*			trans	-60.1	127.2	154.5	0	0	0	0	0	107.2	S12 Q16	S12-A14 PolarHBondContact O-N 2.88Å; S12-A14 VanDerWaalsContact O-N 3.09Å; A14-Q16 PolarHBondContact O-N 3.1Å
15	S	24.2	Very low	25.7	Very low	118 Å²	118	118.6 Å²	118.6	83%	0.825	70%	0.697	S	S	*	*			trans	-60	87.2	-175.3	40	0	0	0	0	111.9	Q13	Q13-S15 PolarHBondContact O-N 3.32Å
16	Q	23.1	Very low	25.6	Very low	143 Å²	143	117.8 Å²	117.8	67%	0.668	69%	0.691	S	S	*	*			trans	-60	132.5	155.5	-72.9	-171.7	-2.4	0	0	107.3	A14 Q18	A14-Q16 PolarHBondContact O-N 3.1Å; Q16-Q18 PolarHBondContact O-N 3.06Å; Q16-Q18 VanDerWaalsContact O-N 3.09Å
17	P	25.2	Very low	25.5	Very low	105 Å²	105	116 Å²	116	68%	0.682	69%	0.687	S	S	*	*			trans	-56.1	123.6	179	21.5	-30.9	0	0	0	108.5	L19	P17-L19 PolarHBondContact O-N 3.37Å
18	Q	26.6	Very low	25.5	Very low	173 Å²	173	119.3 Å²	119.3	81%	0.808	69%	0.686	S	S	*	*			trans	-55.9	100.4	175.6	-78.6	-158.2	-20.9	0	0	108.6	Q16 W20	Q16-Q18 PolarHBondContact O-N 3.06Å; Q16-Q18 VanDerWaalsContact O-N 3.09Å; Q18-W20 VanDerWaalsContact C-N 3.28Å; Q18-W20 PolarHBondContact O-N 2.81Å
19	L	36.9	Very low	25.3	Very low	40 Å²	40	120.8 Å²	120.8	21%	0.209	68%	0.684	C	S	.	*			trans	-70.9	-27.3	-172.4	-96.7	138.3	0	0	0	112.1	P17 R132	P17-L19 PolarHBondContact O-N 3.37Å; L19-R132 HydrophobicContact CD2-CG 4.29Å; L19-R132 PolarHBondContact O-NH1 3.43Å; L19-R132 VanDerWaalsContact O-NH1 3.13Å
20	W	34.9	Very low	25.2	Very low	53 Å²	53	125 Å²	125	20%	0.201	69%	0.689	C	S	.	*	S	Bend	trans	-123.7	136.8	-179.5	-58.7	-15.9	0	0	0	110.3	Q18 L89 A92 E93	Q18-W20 VanDerWaalsContact C-N 3.28Å; Q18-W20 PolarHBondContact O-N 2.81Å; W20-L89 HydrophobicContact CH2-CD1 3.71Å; W20-L89 HydrophobicContact CH2-CG 4.11Å; W20-L89 WeakPolarHBondContact CH2-O 3.39Å; W20-L89 HydrophobicContact CZ2-CD1 4.18Å; W20-L89 HydrophobicContact CZ3-CD1 3.89Å; W20-L89 HydrophobicContact CZ3-CG 3.85Å; W20-A92 HydrophobicContact CH2-CB 4.29Å; W20-E93 HydrophobicContact CE3-CB 4.16Å; W20-E93 HydrophobicContact CE3-CG 4.02Å; W20-E93 HydrophobicContact CH2-CB 3.46Å; W20-E93 VanDerWaalsContact CH2-CB 3.46Å; W20-E93 HydrophobicContact CH2-CG 4.11Å; W20-E93 VanDerWaalsContact CH2-OE2 3.27Å; W20-E93 WeakPolarHBondContact CH2-OE2 3.27Å; W20-E93 HydrophobicContact CZ2-CB 4.49Å; W20-E93 WeakPolarHBondContact CZ2-OE2 3.38Å; W20-E93 HydrophobicContact CZ3-CB 3.3Å; W20-E93 HydrophobicContact CZ3-CG 3.66Å; W20-E93 WeakPolarHBondContact CZ3-OE2 3.38Å
21	S	28.4	Very low	25	Very low	79 Å²	79	125 Å²	125	55%	0.552	68%	0.684	S	S	*	*			trans	-69.8	144.8	165.2	32.6	0	0	0	0	109.8	I23 R125	S21-I23 PolarHBondContact O-N 3.28Å; S21-R125 PolarHBondContact OG-NH2 3.4Å
22	P	24.3	Very low	24.8	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	69%	0.686	S	S	*	*			trans	-58.3	137.3	178.6	-15.5	25.3	0	0	0	110.7	N24	P22-N24 PolarHBondContact O-N 2.93Å; P22-N24 VanDerWaalsContact O-N 3.09Å
23	I	25.6	Very low	24.7	Very low	133 Å²	133	127.2 Å²	127.2	68%	0.682	69%	0.69	S	S	*	*			trans	-60.1	113.3	168.1	-62.7	168.5	0	0	0	106.3	S21 S25 L89	S21-I23 PolarHBondContact O-N 3.28Å; I23-S25 VanDerWaalsContact C-N 3.28Å; I23-S25 PolarHBondContact O-N 3.07Å; I23-L89 HydrophobicContact CD1-CD2 4.43Å
24	N	23.5	Very low	25	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	68%	0.682	S	S	*	*			trans	-59	101.8	162.5	-89.3	-14.7	0	0	0	106.2	P22 I26	P22-N24 PolarHBondContact O-N 2.93Å; P22-N24 VanDerWaalsContact O-N 3.09Å; N24-I26 PolarHBondContact O-N 3.22Å
25	S	22.4	Very low	24.7	Very low	90 Å²	90	124.7 Å²	124.7	63%	0.629	69%	0.694	S	S	*	*			trans	-56.8	107.8	173.5	46.2	0	0	0	0	107.4	I23 T27	I23-S25 VanDerWaalsContact C-N 3.28Å; I23-S25 PolarHBondContact O-N 3.07Å; S25-T27 PolarHBondContact O-N 3.4Å
26	I	23.4	Very low	24.6	Very low	149 Å²	149	128.2 Å²	128.2	76%	0.764	70%	0.697	S	S	*	*			trans	-59.7	97	159.1	-62.9	171.4	0	0	0	104.1	N24 H28	N24-I26 PolarHBondContact O-N 3.22Å; I26-H28 PolarHBondContact O-N 2.95Å
27	T	22	Very low	24.5	Very low	111 Å²	111	128.1 Å²	128.1	68%	0.681	71%	0.707	S	S	*	*			trans	-64	88.4	175.8	39.4	0	0	0	0	107.8	S25 Q29	S25-T27 PolarHBondContact O-N 3.4Å; T27-Q29 PolarHBondContact O-N 3.04Å
28	H	23.2	Very low	24.4	Very low	166 Å²	166	127.8 Å²	127.8	77%	0.769	71%	0.713	S	S	*	*			trans	-66.6	95.4	149.5	-82	-70	0	0	0	105.9	I26 K30	I26-H28 PolarHBondContact O-N 2.95Å; H28-K30 PolarHBondContact O-N 3.47Å
29	Q	21.2	Very low	24.1	Very low	166 Å²	166	130.3 Å²	130.3	78%	0.776	72%	0.716	S	S	*	*			trans	-55.7	89	165.6	-77.7	178.7	-21.7	0	0	108.1	T27 T31	T27-Q29 PolarHBondContact O-N 3.04Å; Q29-T31 PolarHBondContact O-N 3.09Å
30	K	21.4	Very low	23.4	Very low	191 Å²	191	134 Å²	134	83%	0.83	75%	0.746	S	S	*	*			trans	-80.6	79.7	154.3	-82.4	-177.3	176.5	175.5	0	106.1	H28 M32	H28-K30 PolarHBondContact O-N 3.47Å; K30-M32 VanDerWaalsContact C-N 3.26Å; K30-M32 PolarHBondContact O-N 3.14Å
31	T	23.5	Very low	22.7	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	77%	0.772	S	S	*	*			trans	-63.7	94.7	160.3	25.8	0	0	0	0	107.5	Q29	Q29-T31 PolarHBondContact O-N 3.09Å
32	M	18.3	Very low	22.6	Very low	173 Å²	173	141 Å²	141	85%	0.852	79%	0.785	S	S	*	*			trans	-73.7	120.9	157	-64.9	-162.4	98.1	0	0	107.8	K30	K30-M32 VanDerWaalsContact C-N 3.26Å; K30-M32 PolarHBondContact O-N 3.14Å
33	T	23.6	Very low	22.6	Very low	131 Å²	131	141.3 Å²	141.3	80%	0.804	79%	0.785	S	S	*	*			trans	-174.9	153.3	146.7	22.9	0	0	0	0	109.1
34	P	27.5	Very low	22.4	Very low	119 Å²	119	142.7 Å²	142.7	77%	0.773	79%	0.793	S	S	*	*				-104.3	168.8	-123.8	37.9	-36.3	0	0	0	115.7	Q36	P34-Q36 PolarHBondContact O-N 3.06Å
35	A	20	Very low	22.4	Very low	99 Å²	99	139.3 Å²	139.3	82%	0.818	79%	0.786	S	S	*	*			trans	-48	121.1	177	0	0	0	0	0	114.2
36	Q	22.6	Very low	22.3	Very low	191 Å²	191	140 Å²	140	89%	0.893	79%	0.791	S	S	*	*			trans	-133.8	115.1	151.2	-76.5	-171.7	-10.4	0	0	109.4	P34	P34-Q36 PolarHBondContact O-N 3.06Å
37	T	19.7	Very low	22.4	Very low	142 Å²	142	139.8 Å²	139.8	87%	0.871	80%	0.797	S	S	*	*			trans	-64.4	128.7	164.4	38.6	0	0	0	0	111.4
38	A	23.4	Very low	22.4	Very low	97 Å²	97	140.8 Å²	140.8	80%	0.802	80%	0.803	S	S	*	*			trans	-167.3	134.8	142.6	0	0	0	0	0	111.1
39	Y	19.9	Very low	22.4	Very low	226 Å²	226	138.6 Å²	138.6	89%	0.886	80%	0.803	S	S	*	*			trans	-61.8	146.1	176.3	-69.5	-101.8	0	0	0	113
40	S	22.9	Very low	22.4	Very low	119 Å²	119	135.7 Å²	135.7	83%	0.832	80%	0.801	S	S	*	*				175.1	142.5	111.3	-74	0	0	0	0	112.9
41	T	20.5	Very low	22.5	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	80%	0.799	S	S	*	*			trans	-65.5	145.2	175.1	33.3	0	0	0	0	115.2
42	D	25.6	Very low	22.6	Very low	156 Å²	156	135.2 Å²	135.2	83%	0.834	81%	0.806	S	S	*	*			trans	-162.2	109.2	139.2	-87.6	-31.4	0	0	0	106.8
43	V	23.6	Very low	22.9	Very low	111 Å²	111	132.5 Å²	132.5	67%	0.673	80%	0.801	S	S	*	*				83.9	103.2	68.7	175.3	0	0	0	0	113.5
44	L	22.3	Very low	22.7	Very low	162 Å²	162	134.5 Å²	134.5	85%	0.848	81%	0.806	S	S	*	*			trans	87	139.4	137.8	-75.8	168.5	0	0	0	124.6
45	A	23.7	Very low	22.4	Very low	82 Å²	82	133 Å²	133	68%	0.678	80%	0.804	S	S	*	*			trans	82.5	101.9	151.3	0	0	0	0	0	117
46	S	20.2	Very low	22.4	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	80%	0.799	S	S	*	*				61.8	102.2	58.6	84.6	0	0	0	0	114.2
47	T	25.4	Very low	22.4	Very low	144 Å²	144	135.3 Å²	135.3	88%	0.883	80%	0.8	S	S	*	*			trans	-164.6	117.9	138.7	3.9	0	0	0	0	111
48	V	21.6	Very low	22.5	Very low	132 Å²	132	133.1 Å²	133.1	80%	0.8	79%	0.791	S	S	*	*			trans	-96.1	145.8	162	168.8	0	0	0	0	106.8
49	P	24.5	Very low	22.3	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	79%	0.793	S	S	*	*			trans	-132.5	132.4	135	28.4	-12.4	0	0	0	112.9
50	S	20.3	Very low	22.6	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	79%	0.79	S	S	*	*			trans	-65.9	143.2	165.3	52.8	0	0	0	0	112.9
51	S	24	Very low	22.6	Very low	111 Å²	111	134 Å²	134	78%	0.776	79%	0.789	S	S	*	*			trans	-167.4	121.9	144.5	39.5	0	0	0	0	111.5
52	Q	24.3	Very low	22.7	Very low	191 Å²	191	132.9 Å²	132.9	89%	0.893	79%	0.786	S	S	*	*			trans	147.5	149.8	131	-78.1	-168.4	-3	0	0	114.2
53	P	26.1	Very low	22.6	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	79%	0.789	S	S	*	*			trans	-111	169.8	-147.4	38.6	-27.2	0	0	0	115.9
54	L	18.5	Very low	22.7	Very low	172 Å²	172	134.8 Å²	134.8	90%	0.901	79%	0.792	S	S	*	*			trans	-59.9	151	169.9	-64.1	115.3	0	0	0	114.6
55	A	22.3	Very low	22.8	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	79%	0.79	S	S	*	*				167.6	131.1	112.9	0	0	0	0	0	114.4
56	C	18.2	Very low	22.7	Very low	106 Å²	106	139.3 Å²	139.3	72%	0.716	80%	0.798	S	S	*	*			trans	46.1	122.3	137.9	-56.3	0	0	0	0	121.6
57	Y	23.1	Very low	23	Very low	232 Å²	232	139.3 Å²	139.3	91%	0.91	81%	0.805	S	S	*	*				-177.8	159	97.1	-99.9	-78.4	0	0	0	111.8
58	S	21.3	Very low	23	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	79%	0.791	S	S	*	*			trans	-87.9	152.6	-156.6	45.4	0	0	0	0	117.9
59	Q	19.8	Very low	23.3	Very low	184 Å²	184	138.5 Å²	138.5	86%	0.86	79%	0.791	S	S	*	*			trans	28.6	137.3	144.9	-67.4	-168	-13.9	0	0	121.1
60	P	26.1	Very low	23.5	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	80%	0.797	S	S	*	*				-146.3	147.7	97.3	35.4	-17.9	0	0	0	117.1
61	N	23.1	Very low	23.8	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	79%	0.794	S	S	*	*			trans	38	117.1	139.9	-96.9	0.6	0	0	0	123.3
62	S	22.3	Very low	24	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	79%	0.792	S	S	*	*				59.6	103.6	126.9	65.7	0	0	0	0	120.6
63	Q	24.9	Very low	24.2	Very low	195 Å²	195	140.1 Å²	140.1	91%	0.911	79%	0.79	S	S	*	*				-171.7	158.5	129.3	-102.7	176.8	16.9	0	0	110.4
64	P	24.5	Very low	24.4	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	80%	0.795	S	S	*	*			trans	-85.3	128.2	-152.7	32.2	-33.5	0	0	0	115
65	I	25	Very low	25.3	Very low	157 Å²	157	138.5 Å²	138.5	81%	0.805	78%	0.78	S	S	*	*			trans	43.7	79.7	130.8	-45.1	175.4	0	0	0	115.7
66	Q	22.3	Very low	26.4	Very low	183 Å²	183	139.1 Å²	139.1	86%	0.855	79%	0.785	S	S	*	*			trans	-79.3	111.7	142.8	-88.1	177.1	-26.5	0	0	107.8	S68	Q66-S68 PolarHBondContact O-N 2.66Å
67	A	25.7	Very low	28.1	Very low	105 Å²	105	139 Å²	139	87%	0.868	78%	0.778	S	S	*	*			trans	-74.2	77.8	171.7	0	0	0	0	0	109.7
68	S	25.5	Very low	30	Very low	84 Å²	84	130.1 Å²	130.1	59%	0.587	76%	0.757	S	S	*	*			trans	-119.4	96.1	167.4	56.3	0	0	0	0	108	Q66	Q66-S68 PolarHBondContact O-N 2.66Å
69	H	26.9	Very low	32.5	Very low	175 Å²	175	130 Å²	130	81%	0.81	75%	0.754	S	S	*	*			trans	-179	86.5	143.2	-92.7	-66.9	0	0	0	105.5	S71	H69-S71 PolarHBondContact O-N 3.35Å
70	I	28.7	Very low	35.4	Very low	176 Å²	176	126.8 Å²	126.8	90%	0.903	74%	0.742	S	S	*	*			trans	-67.4	89.4	158.4	-64.3	171.2	0	0	0	104.3	S72	I70-S72 PolarHBondContact O-N 3.02Å
71	S	26.9	Very low	38	Very low	96 Å²	96	122.4 Å²	122.4	67%	0.671	71%	0.713	S	S	*	*			trans	-60.1	121.2	168.7	-66.3	0	0	0	0	107.6	H69 E73	H69-S71 PolarHBondContact O-N 3.35Å; S71-E73 PolarHBondContact O-N 2.86Å
72	S	28.1	Very low	40.8	Very low	107 Å²	107	118.5 Å²	118.5	75%	0.748	70%	0.698	S	S	*	*			trans	-58.2	88.3	171.7	48.9	0	0	0	0	111.1	I70	I70-S72 PolarHBondContact O-N 3.02Å
73	E	29	Very low	43.9	Very low	182 Å²	182	119.2 Å²	119.2	85%	0.85	69%	0.694	S	S	*	*			trans	-84.8	98.6	154.5	-78.4	-179.9	161	0	0	107.6	S71 P75	S71-E73 PolarHBondContact O-N 2.86Å; E73-P75 VanDerWaalsContact O-CD 3.29Å; E73-P75 WeakPolarHBondContact O-CD 3.43Å
74	L	30.7	Very low	46.9	Very low	163 Å²	163	112 Å²	112	85%	0.853	66%	0.664	S	S	*	*			trans	-71.3	113.3	163	-94.8	125.6	0	0	0	107.7
75	P	37.2	Very low	50.1	Low	92 Å²	92	108 Å²	108	60%	0.597	64%	0.635	S	S	*	*			trans	-76.1	140.9	176.2	-2	19.8	0	0	0	109.6	E73 D77	E73-P75 VanDerWaalsContact O-CD 3.29Å; E73-P75 WeakPolarHBondContact O-CD 3.43Å; P75-D77 PolarHBondContact O-N 3.36Å
76	A	45.5	Very low	53.2	Low	102 Å²	102	102.9 Å²	102.9	84%	0.843	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	2.2	-179.6	0	0	0	0	0	115.8
77	D	53.4	Low	56.5	Low	103 Å²	103	96.9 Å²	96.9	55%	0.551	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-0.8	-177.5	-68	-31.8	0	0	0	114.6	P75 L80 V81	P75-D77 PolarHBondContact O-N 3.36Å; D77-L80 PolarHBondContact O-N 3.46Å; D77-V81 HydrophobicContact CB-CG2 4.31Å; D77-V81 WeakPolarHBondContact O-CG2 3.37Å; D77-V81 PolarHBondContact O-N 3.18Å
78	G	63.2	Low	59.7	Low	47 Å²	47	93.5 Å²	93.5	49%	0.485	57%	0.565	S	S	.	*	H	α-helix	trans	-50.3	-47.2	-175	0	0	0	0	0	116.1	S82	G78-S82 PolarHBondContact O-N 3.49Å
79	P	74.7	Confident	62.9	Low	92 Å²	92	90.5 Å²	90.5	60%	0.597	54%	0.542	S	S	*	.	H	α-helix	trans	-68.2	-43.3	179.4	-19.6	32	0	0	0	113.1	V81 S82 D83	P79-V81 VanDerWaalsContact C-N 3.33Å; P79-V81 PolarHBondContact O-N 3.42Å; P79-S82 WeakPolarHBondContact O-CB 3.36Å; P79-S82 PolarHBondContact O-N 2.9Å; P79-D83 PolarHBondContact O-N 3.01Å
80	L	79.3	Confident	66.1	Low	118 Å²	118	83.7 Å²	83.7	62%	0.618	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-39.2	-179	-164.4	99.4	0	0	0	111.4	D77 D83 C84	D77-L80 PolarHBondContact O-N 3.46Å; L80-D83 PolarHBondContact O-N 3.37Å; L80-C84 WeakPolarHBondContact O-CB 3.3Å; L80-C84 PolarHBondContact O-N 2.83Å; L80-C84 PolarHBondContact O-SG 2.99Å
81	V	81.1	Confident	69.2	Low	33 Å²	33	79.2 Å²	79.2	20%	0.2	50%	0.497	C	S	.	.	H	α-helix	trans	-65.2	-40.3	175.4	174.1	0	0	0	0	111	D77 P79 Y85 F116 L118	D77-V81 HydrophobicContact CB-CG2 4.31Å; D77-V81 WeakPolarHBondContact O-CG2 3.37Å; D77-V81 PolarHBondContact O-N 3.18Å; P79-V81 VanDerWaalsContact C-N 3.33Å; P79-V81 PolarHBondContact O-N 3.42Å; V81-Y85 VanDerWaalsContact O-CB 3.25Å; V81-Y85 WeakPolarHBondContact O-CB 3.47Å; V81-Y85 PolarHBondContact O-N 3.3Å; V81-F116 HydrophobicContact CG1-CB 4.12Å; V81-L118 HydrophobicContact CG1-CD2 4.37Å
82	S	83.2	Confident	72.4	Confident	69 Å²	69	74.7 Å²	74.7	48%	0.483	47%	0.465	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.9	-175.6	0	0	0	0	112.1	G78 P79 Y85 A86	G78-S82 PolarHBondContact O-N 3.49Å; P79-S82 WeakPolarHBondContact O-CB 3.36Å; P79-S82 PolarHBondContact O-N 2.9Å; S82-Y85 WeakPolarHBondContact O-CB 3.19Å; S82-Y85 PolarHBondContact O-N 2.99Å; S82-A86 PolarHBondContact O-N 3.3Å
83	D	87	Confident	75.5	Confident	113 Å²	113	71.8 Å²	71.8	60%	0.604	44%	0.44	S	S	*	.	H	α-helix	trans	-67.2	-43.8	178.8	-70	-17.7	0	0	0	111.6	P79 L80 Y85 A86 A87	P79-D83 PolarHBondContact O-N 3.01Å; L80-D83 PolarHBondContact O-N 3.37Å; D83-Y85 VanDerWaalsContact C-N 3.35Å; D83-Y85 PolarHBondContact O-N 3.43Å; D83-A86 PolarHBondContact O-N 3.13Å; D83-A87 WeakPolarHBondContact O-CB 3.45Å; D83-A87 PolarHBondContact O-N 3.48Å
84	C	87.7	Confident	78.5	Confident	44 Å²	44	66.7 Å²	66.7	30%	0.297	42%	0.421	S	S	.	.	H	α-helix	trans	-62	-40.9	174.6	-75.7	0	0	0	0	112.2	L80 A87 L88 F116	L80-C84 WeakPolarHBondContact O-CB 3.3Å; L80-C84 PolarHBondContact O-N 2.83Å; L80-C84 PolarHBondContact O-SG 2.99Å; C84-A87 PolarHBondContact O-N 3.31Å; C84-L88 WeakPolarHBondContact O-CB 3.27Å; C84-L88 WeakPolarHBondContact O-CG 3.49Å; C84-L88 PolarHBondContact O-N 3.03Å; C84-F116 HydrophobicContact CB-CE2 4.39Å; C84-F116 HydrophobicContact CB-CZ 4.14Å
85	Y	90.4	Very high	81.5	Confident	26 Å²	26	61 Å²	61	10%	0.102	39%	0.39	C	S	.	.	H	α-helix	trans	-58.7	-51.7	175	175.5	-91.6	0	0	0	111	V81 S82 D83 A87 L88 L89 I113 L118 L122	V81-Y85 VanDerWaalsContact O-CB 3.25Å; V81-Y85 WeakPolarHBondContact O-CB 3.47Å; V81-Y85 PolarHBondContact O-N 3.3Å; S82-Y85 WeakPolarHBondContact O-CB 3.19Å; S82-Y85 PolarHBondContact O-N 2.99Å; D83-Y85 VanDerWaalsContact C-N 3.35Å; D83-Y85 PolarHBondContact O-N 3.43Å; Y85-A87 PolarHBondContact O-N 3.4Å; Y85-L88 PolarHBondContact O-N 2.93Å; Y85-L89 HydrophobicContact CE1-CD2 4.06Å; Y85-L89 VanDerWaalsContact O-CB 3.3Å; Y85-L89 WeakPolarHBondContact O-CB 3.38Å; Y85-L89 PolarHBondContact O-N 3.4Å; Y85-I113 HydrophobicContact CD2-CD1 4.43Å; Y85-I113 HydrophobicContact CD2-CG2 3.5Å; Y85-I113 VanDerWaalsContact CD2-CG2 3.5Å; Y85-I113 HydrophobicContact CE2-CD1 4.47Å; Y85-I113 HydrophobicContact CE2-CG2 3.69Å; Y85-L118 HydrophobicContact CD2-CD2 3.84Å; Y85-L122 HydrophobicContact CD1-CD1 4.45Å; Y85-L122 HydrophobicContact CD2-CD1 4.49Å; Y85-L122 HydrophobicContact CE1-CD1 4.45Å; Y85-L122 HydrophobicContact CE1-CD2 3.94Å; Y85-L122 HydrophobicContact CE2-CB 4.01Å; Y85-L122 HydrophobicContact CE2-CD1 4.48Å; Y85-L122 HydrophobicContact CE2-CD2 4.43Å; Y85-L122 HydrophobicContact CG-CD1 4.49Å
86	A	90.2	Very high	84	Confident	51 Å²	51	57.9 Å²	57.9	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-42	179	0	0	0	0	0	112	S82 D83 L89 G90	S82-A86 PolarHBondContact O-N 3.3Å; D83-A86 PolarHBondContact O-N 3.13Å; A86-L89 PolarHBondContact O-N 2.9Å; A86-G90 PolarHBondContact O-N 2.96Å
87	A	92.2	Very high	86.2	Confident	56 Å²	56	56.8 Å²	56.8	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-47.2	178.1	0	0	0	0	0	112.3	D83 C84 Y85 G90 L91	D83-A87 WeakPolarHBondContact O-CB 3.45Å; D83-A87 PolarHBondContact O-N 3.48Å; C84-A87 PolarHBondContact O-N 3.31Å; Y85-A87 PolarHBondContact O-N 3.4Å; A87-G90 PolarHBondContact O-N 3.27Å; A87-L91 WeakPolarHBondContact O-CB 3.18Å; A87-L91 WeakPolarHBondContact O-CG 3.41Å; A87-L91 PolarHBondContact O-N 3.49Å
88	L	93.9	Very high	87.9	Confident	34 Å²	34	56.2 Å²	56.2	18%	0.178	34%	0.344	C	S	.	.	H	α-helix	trans	-68	-36.3	178.7	-73.9	170.9	0	0	0	112.2	C84 Y85 L91 A92 A112 I113 F116	C84-L88 WeakPolarHBondContact O-CB 3.27Å; C84-L88 WeakPolarHBondContact O-CG 3.49Å; C84-L88 PolarHBondContact O-N 3.03Å; Y85-L88 PolarHBondContact O-N 2.93Å; L88-L91 PolarHBondContact O-N 3.33Å; L88-A92 WeakPolarHBondContact O-CB 3.38Å; L88-A92 PolarHBondContact O-N 3Å; L88-A112 HydrophobicContact CD1-CB 4.12Å; L88-A112 HydrophobicContact CD2-CB 4.38Å; L88-I113 HydrophobicContact CB-CD1 3.75Å; L88-I113 HydrophobicContact CB-CG1 3.43Å; L88-I113 VanDerWaalsContact CB-CG1 3.43Å; L88-I113 HydrophobicContact CD1-CG1 3.7Å; L88-I113 HydrophobicContact CG-CG1 4.22Å; L88-F116 HydrophobicContact CD1-CE2 3.68Å; L88-F116 HydrophobicContact CD1-CZ 4.5Å
89	L	92.4	Very high	89	Confident	21 Å²	21	59.7 Å²	59.7	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-66.2	-43.9	174.6	-172.5	66.1	0	0	0	110.8	W20 I23 Y85 A86 L91 A92 E93 L110 I113	W20-L89 HydrophobicContact CH2-CD1 3.71Å; W20-L89 HydrophobicContact CH2-CG 4.11Å; W20-L89 WeakPolarHBondContact CH2-O 3.39Å; W20-L89 HydrophobicContact CZ2-CD1 4.18Å; W20-L89 HydrophobicContact CZ3-CD1 3.89Å; W20-L89 HydrophobicContact CZ3-CG 3.85Å; I23-L89 HydrophobicContact CD1-CD2 4.43Å; Y85-L89 HydrophobicContact CE1-CD2 4.06Å; Y85-L89 VanDerWaalsContact O-CB 3.3Å; Y85-L89 WeakPolarHBondContact O-CB 3.38Å; Y85-L89 PolarHBondContact O-N 3.4Å; A86-L89 PolarHBondContact O-N 2.9Å; L89-L91 PolarHBondContact O-N 3.29Å; L89-A92 WeakPolarHBondContact O-CB 3.4Å; L89-A92 PolarHBondContact O-N 3.25Å; L89-E93 PolarHBondContact O-N 3.25Å; L89-L110 HydrophobicContact CD1-CD2 4.05Å; L89-I113 HydrophobicContact CB-CD1 4.29Å
90	G	93	Very high	89.6	Confident	33 Å²	33	60.5 Å²	60.5	34%	0.34	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-40.7	174.7	0	0	0	0	0	113	A86 A87 E93 T94	A86-G90 PolarHBondContact O-N 2.96Å; A87-G90 PolarHBondContact O-N 3.27Å; G90-E93 PolarHBondContact O-N 3.47Å; G90-T94 WeakPolarHBondContact O-CB 3.32Å; G90-T94 PolarHBondContact O-N 3.45Å; G90-T94 PolarHBondContact O-OG1 3.47Å
91	L	94.9	Very high	90	Very high	82 Å²	82	58.3 Å²	58.3	43%	0.429	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-43.9	172.7	-75.8	172.8	0	0	0	111.6	A87 L88 L89 E93 T94 F95	A87-L91 WeakPolarHBondContact O-CB 3.18Å; A87-L91 WeakPolarHBondContact O-CG 3.41Å; A87-L91 PolarHBondContact O-N 3.49Å; L88-L91 PolarHBondContact O-N 3.33Å; L89-L91 PolarHBondContact O-N 3.29Å; L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 2.95Å; L91-T94 PolarHBondContact O-N 3.32Å; L91-F95 HydrophobicContact CB-CD2 4.49Å; L91-F95 HydrophobicContact CB-CE2 4.15Å; L91-F95 WeakPolarHBondContact O-CD2 3.5Å; L91-F95 WeakPolarHBondContact O-CG 3.3Å; L91-F95 PolarHBondContact O-N 3.08Å
92	A	93.8	Very high	90.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-41.2	176.5	0	0	0	0	0	111.5	W20 L88 L89 F95 R96 A106 C109 L110	W20-A92 HydrophobicContact CH2-CB 4.29Å; L88-A92 WeakPolarHBondContact O-CB 3.38Å; L88-A92 PolarHBondContact O-N 3Å; L89-A92 WeakPolarHBondContact O-CB 3.4Å; L89-A92 PolarHBondContact O-N 3.25Å; A92-F95 PolarHBondContact O-N 3.4Å; A92-R96 WeakPolarHBondContact O-CB 3.02Å; A92-R96 PolarHBondContact O-N 3.42Å; A92-A106 HydrophobicContact CB-CB 4.49Å; A92-A106 WeakPolarHBondContact O-CB 3.35Å; A92-C109 HydrophobicContact CB-CB 3.77Å; A92-L110 HydrophobicContact CB-CD2 4.07Å; A92-L110 HydrophobicContact CB-CG 4.15Å
93	E	92.4	Very high	90.9	Very high	47 Å²	47	57.9 Å²	57.9	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-43.7	176.8	-165.8	47.8	-171.5	0	0	112.5	W20 L89 G90 L91 F95 R96 T97	W20-E93 HydrophobicContact CE3-CB 4.16Å; W20-E93 HydrophobicContact CE3-CG 4.02Å; W20-E93 HydrophobicContact CH2-CB 3.46Å; W20-E93 VanDerWaalsContact CH2-CB 3.46Å; W20-E93 HydrophobicContact CH2-CG 4.11Å; W20-E93 VanDerWaalsContact CH2-OE2 3.27Å; W20-E93 WeakPolarHBondContact CH2-OE2 3.27Å; W20-E93 HydrophobicContact CZ2-CB 4.49Å; W20-E93 WeakPolarHBondContact CZ2-OE2 3.38Å; W20-E93 HydrophobicContact CZ3-CB 3.3Å; W20-E93 HydrophobicContact CZ3-CG 3.66Å; W20-E93 WeakPolarHBondContact CZ3-OE2 3.38Å; L89-E93 PolarHBondContact O-N 3.25Å; G90-E93 PolarHBondContact O-N 3.47Å; L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 2.95Å; E93-F95 VanDerWaalsContact C-N 3.28Å; E93-F95 PolarHBondContact O-N 2.75Å; E93-R96 WeakPolarHBondContact O-CB 3.3Å; E93-R96 PolarHBondContact O-N 3.43Å; E93-R96 VanDerWaalsContact O-N 3.12Å; E93-R96 IonicContact OE1-CZ 3.73Å; E93-R96 IonicContact OE1-NE 2.7Å; E93-R96 IonicContact OE1-NH2 2.65Å; E93-R96 PolarHBondContact OE1-NH2 2.8Å; E93-R96 IonicContact OE2-CZ 3.27Å; E93-R96 IonicContact OE2-NE 3.83Å; E93-R96 PolarHBondContact OE2-NE 3.03Å; E93-R96 IonicContact OE2-NH2 3.68Å; E93-R96 PolarHBondContact OE2-NH2 3.07Å; E93-T97 HydrophobicContact CG-CG2 4.44Å; E93-T97 WeakPolarHBondContact O-CB 3.21Å; E93-T97 WeakPolarHBondContact O-CG2 3.48Å; E93-T97 PolarHBondContact O-N 3.47Å; E93-T97 PolarHBondContact O-OG1 2.94Å
94	T	93.2	Very high	91.1	Very high	74 Å²	74	61.4 Å²	61.4	45%	0.454	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-44.6	178.8	-56	0	0	0	0	109.5	G90 L91 R96 T97 M98	G90-T94 WeakPolarHBondContact O-CB 3.32Å; G90-T94 PolarHBondContact O-N 3.45Å; G90-T94 PolarHBondContact O-OG1 3.47Å; L91-T94 PolarHBondContact O-N 3.32Å; T94-R96 PolarHBondContact O-N 2.87Å; T94-T97 PolarHBondContact O-N 3.46Å; T94-T97 PolarHBondContact O-OG1 3.16Å; T94-M98 VanDerWaalsContact O-CB 3.28Å; T94-M98 WeakPolarHBondContact O-CB 3.27Å; T94-M98 PolarHBondContact O-N 3.32Å
95	F	94	Very high	91.4	Very high	43 Å²	43	62.5 Å²	62.5	19%	0.189	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-34.6	175.7	-66.4	-48.6	0	0	0	113.2	L91 A92 E93 N102 L105 A106	L91-F95 HydrophobicContact CB-CD2 4.49Å; L91-F95 HydrophobicContact CB-CE2 4.15Å; L91-F95 WeakPolarHBondContact O-CD2 3.5Å; L91-F95 WeakPolarHBondContact O-CG 3.3Å; L91-F95 PolarHBondContact O-N 3.08Å; A92-F95 PolarHBondContact O-N 3.4Å; E93-F95 VanDerWaalsContact C-N 3.28Å; E93-F95 PolarHBondContact O-N 2.75Å; F95-N102 PolarHBondContact O-N 3.29Å; F95-L105 HydrophobicContact CB-CB 4.2Å; F95-L105 HydrophobicContact CD1-CB 4.05Å; F95-L105 HydrophobicContact CD1-CD1 3.91Å; F95-L105 HydrophobicContact CD2-CB 3.62Å; F95-L105 HydrophobicContact CE1-CB 4.34Å; F95-L105 HydrophobicContact CE1-CD1 3.66Å; F95-L105 HydrophobicContact CE2-CB 3.93Å; F95-L105 HydrophobicContact CE2-CD1 4.44Å; F95-L105 HydrophobicContact CG-CB 3.69Å; F95-L105 HydrophobicContact CG-CD1 4.41Å; F95-L105 HydrophobicContact CZ-CB 4.29Å; F95-L105 HydrophobicContact CZ-CD1 3.95Å; F95-A106 HydrophobicContact CB-CB 4.11Å
96	R	89.6	Confident	91.5	Very high	27 Å²	27	61.2 Å²	61.2	10%	0.102	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-34.5	176.4	-168.6	-168.5	69.6	75	-5.3	112.6	A92 E93 T94 P101 M103 L133	A92-R96 WeakPolarHBondContact O-CB 3.02Å; A92-R96 PolarHBondContact O-N 3.42Å; E93-R96 WeakPolarHBondContact O-CB 3.3Å; E93-R96 PolarHBondContact O-N 3.43Å; E93-R96 VanDerWaalsContact O-N 3.12Å; E93-R96 IonicContact OE1-CZ 3.73Å; E93-R96 IonicContact OE1-NE 2.7Å; E93-R96 IonicContact OE1-NH2 2.65Å; E93-R96 PolarHBondContact OE1-NH2 2.8Å; E93-R96 IonicContact OE2-CZ 3.27Å; E93-R96 IonicContact OE2-NE 3.83Å; E93-R96 PolarHBondContact OE2-NE 3.03Å; E93-R96 IonicContact OE2-NH2 3.68Å; E93-R96 PolarHBondContact OE2-NH2 3.07Å; T94-R96 PolarHBondContact O-N 2.87Å; R96-P101 VanDerWaalsContact O-CB 3.26Å; R96-P101 WeakPolarHBondContact O-CB 3.47Å; R96-M103 HydrophobicContact CG-CE 4.22Å; R96-M103 HydrophobicContact CG-SD 4.08Å; R96-L133 HydrophobicContact CG-CD2 4.31Å
97	T	89.9	Confident	91.7	Very high	79 Å²	79	59.8 Å²	59.8	49%	0.485	34%	0.338	S	S	.	.	H	α-helix	trans	-100.6	-7.2	-175	56.1	0	0	0	0	114.1	E93 T94	E93-T97 HydrophobicContact CG-CG2 4.44Å; E93-T97 WeakPolarHBondContact O-CB 3.21Å; E93-T97 WeakPolarHBondContact O-CG2 3.48Å; E93-T97 PolarHBondContact O-N 3.47Å; E93-T97 PolarHBondContact O-OG1 2.94Å; T94-T97 PolarHBondContact O-N 3.46Å; T94-T97 PolarHBondContact O-OG1 3.16Å
98	M	90.8	Very high	91.7	Very high	92 Å²	92	61.6 Å²	61.6	45%	0.453	34%	0.337	S	S	.	.	S	Bend	trans	-57.1	153.1	172.9	-175.2	170.6	-83.5	0	0	111.2	T94 P100 P101	T94-M98 VanDerWaalsContact O-CB 3.28Å; T94-M98 WeakPolarHBondContact O-CB 3.27Å; T94-M98 PolarHBondContact O-N 3.32Å; M98-P100 CarbonylContact C-O 3.05Å; M98-P100 CarbonylContact O-C 3.46Å; M98-P101 WeakPolarHBondContact O-CA 3.43Å; M98-P101 WeakPolarHBondContact O-CB 3.37Å; M98-P101 WeakPolarHBondContact O-CD 3.35Å
99	S	86.5	Confident	91.8	Very high	120 Å²	120	60.7 Å²	60.7	84%	0.839	33%	0.333	S	S	*	.	S	Bend	trans	-115.1	109.1	173.3	-172.9	0	0	0	0	109.9
100	P	86.4	Confident	91.9	Very high	109 Å²	109	59.7 Å²	59.7	71%	0.708	33%	0.328	S	S	*	.	S	Bend	cis	-74.9	153	-2.7	32.3	-35	0	0	0	112.6	M98	M98-P100 CarbonylContact C-O 3.05Å; M98-P100 CarbonylContact O-C 3.46Å
101	P	88.1	Confident	91.9	Very high	71 Å²	71	61.4 Å²	61.4	46%	0.461	33%	0.326	S	S	.	.			trans	-73.2	136.7	-177	29	-35.8	0	0	0	111.1	R96 M98 M103	R96-P101 VanDerWaalsContact O-CB 3.26Å; R96-P101 WeakPolarHBondContact O-CB 3.47Å; M98-P101 WeakPolarHBondContact O-CA 3.43Å; M98-P101 WeakPolarHBondContact O-CB 3.37Å; M98-P101 WeakPolarHBondContact O-CD 3.35Å; P101-M103 HydrophobicContact CB-CE 3.63Å; P101-M103 HydrophobicContact CG-CE 4Å
102	N	91.1	Very high	91.8	Very high	61 Å²	61	59 Å²	59	33%	0.326	32%	0.317	S	S	.	.			trans	-107.6	79.6	-178.8	-164.2	-29.8	0	0	0	111.4	F95 R104 L105 A106	F95-N102 PolarHBondContact O-N 3.29Å; N102-R104 PolarHBondContact O-N 3.03Å; N102-R104 PolarHBondContact OD1-N 3.1Å; N102-L105 HydrophobicContact CB-CB 4.43Å; N102-L105 HydrophobicContact CB-CD1 4.41Å; N102-L105 VanDerWaalsContact ND2-CD1 3.31Å; N102-L105 WeakPolarHBondContact ND2-CD1 3.37Å; N102-L105 PolarHBondContact O-N 3.34Å; N102-L105 PolarHBondContact OD1-N 3.37Å; N102-A106 PolarHBondContact O-N 3.47Å; N102-A106 VanDerWaalsContact O-N 3.13Å
103	M	90.5	Very high	91.8	Very high	32 Å²	32	59 Å²	59	16%	0.158	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-28.4	-177.8	-58	-54.8	173	0	0	113.1	R96 P101 A106 V107 L133 Y137	R96-M103 HydrophobicContact CG-CE 4.22Å; R96-M103 HydrophobicContact CG-SD 4.08Å; P101-M103 HydrophobicContact CB-CE 3.63Å; P101-M103 HydrophobicContact CG-CE 4Å; M103-A106 PolarHBondContact O-N 3.35Å; M103-V107 WeakPolarHBondContact O-CB 3.28Å; M103-V107 VanDerWaalsContact O-CG2 3.28Å; M103-V107 WeakPolarHBondContact O-CG2 3.37Å; M103-V107 PolarHBondContact O-N 3.12Å; M103-L133 HydrophobicContact SD-CD2 4.26Å; M103-Y137 HydrophobicContact CB-CG 4.33Å; M103-Y137 HydrophobicContact CE-CD1 4.37Å; M103-Y137 HydrophobicContact CE-CD2 4.36Å; M103-Y137 HydrophobicContact CE-CE1 3.89Å; M103-Y137 HydrophobicContact CE-CE2 3.89Å; M103-Y137 HydrophobicContact CG-CD1 3.95Å; M103-Y137 HydrophobicContact CG-CD2 4.01Å; M103-Y137 HydrophobicContact CG-CE1 4.4Å; M103-Y137 HydrophobicContact CG-CE2 4.48Å; M103-Y137 HydrophobicContact CG-CG 3.74Å; M103-Y137 HydrophobicContact SD-CD2 3.98Å; M103-Y137 HydrophobicContact SD-CE2 3.99Å; M103-Y137 HydrophobicContact SD-CG 4.3Å
104	R	92.3	Very high	91.8	Very high	187 Å²	187	58.9 Å²	58.9	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-65.9	-47.2	177.7	-177.9	176.7	176	171.6	-0.1	111	N102 V107 H108	N102-R104 PolarHBondContact O-N 3.03Å; N102-R104 PolarHBondContact OD1-N 3.1Å; R104-V107 PolarHBondContact O-N 2.61Å; R104-H108 PolarHBondContact NE-NE2 2.89Å; R104-H108 PolarHBondContact O-CD2 3.17Å; R104-H108 PolarHBondContact O-N 3.22Å
105	L	93.1	Very high	91.6	Very high	67 Å²	67	63.5 Å²	63.5	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-66.9	-39.1	177.3	-68.2	-178.7	0	0	0	111.7	F95 N102 V107 H108 C109	F95-L105 HydrophobicContact CB-CB 4.2Å; F95-L105 HydrophobicContact CD1-CB 4.05Å; F95-L105 HydrophobicContact CD1-CD1 3.91Å; F95-L105 HydrophobicContact CD2-CB 3.62Å; F95-L105 HydrophobicContact CE1-CB 4.34Å; F95-L105 HydrophobicContact CE1-CD1 3.66Å; F95-L105 HydrophobicContact CE2-CB 3.93Å; F95-L105 HydrophobicContact CE2-CD1 4.44Å; F95-L105 HydrophobicContact CG-CB 3.69Å; F95-L105 HydrophobicContact CG-CD1 4.41Å; F95-L105 HydrophobicContact CZ-CB 4.29Å; F95-L105 HydrophobicContact CZ-CD1 3.95Å; N102-L105 HydrophobicContact CB-CB 4.43Å; N102-L105 HydrophobicContact CB-CD1 4.41Å; N102-L105 VanDerWaalsContact ND2-CD1 3.31Å; N102-L105 WeakPolarHBondContact ND2-CD1 3.37Å; N102-L105 PolarHBondContact O-N 3.34Å; N102-L105 PolarHBondContact OD1-N 3.37Å; L105-V107 VanDerWaalsContact C-N 3.32Å; L105-V107 PolarHBondContact O-N 3.33Å; L105-H108 WeakPolarHBondContact O-CB 3.38Å; L105-H108 PolarHBondContact O-N 3.49Å; L105-H108 VanDerWaalsContact O-N 3.11Å; L105-C109 PolarHBondContact O-N 3.05Å; L105-C109 PolarHBondContact O-SG 3.09Å; L105-C109 VanDerWaalsContact O-SG 3.36Å
106	A	93.6	Very high	91.4	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.4	-45.4	173.2	0	0	0	0	0	111.9	A92 F95 N102 M103 H108 C109 L110 L133	A92-A106 HydrophobicContact CB-CB 4.49Å; A92-A106 WeakPolarHBondContact O-CB 3.35Å; F95-A106 HydrophobicContact CB-CB 4.11Å; N102-A106 PolarHBondContact O-N 3.47Å; N102-A106 VanDerWaalsContact O-N 3.13Å; M103-A106 PolarHBondContact O-N 3.35Å; A106-H108 PolarHBondContact O-N 2.84Å; A106-C109 PolarHBondContact O-N 3.47Å; A106-L110 WeakPolarHBondContact O-CG 3.41Å; A106-L110 PolarHBondContact O-N 3.31Å; A106-L110 VanDerWaalsContact O-N 3.1Å; A106-L133 HydrophobicContact CB-CD1 4.4Å
107	V	93.3	Very high	91.2	Very high	20 Å²	20	73.4 Å²	73.4	12%	0.121	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-40.6	174.2	164.7	0	0	0	0	111.9	M103 R104 L105 L110 K111 L130 L133 L134	M103-V107 WeakPolarHBondContact O-CB 3.28Å; M103-V107 VanDerWaalsContact O-CG2 3.28Å; M103-V107 WeakPolarHBondContact O-CG2 3.37Å; M103-V107 PolarHBondContact O-N 3.12Å; R104-V107 PolarHBondContact O-N 2.61Å; L105-V107 VanDerWaalsContact C-N 3.32Å; L105-V107 PolarHBondContact O-N 3.33Å; V107-L110 PolarHBondContact O-N 3.4Å; V107-K111 HydrophobicContact CG1-CD 4.03Å; V107-K111 HydrophobicContact CG1-CG 4.43Å; V107-K111 WeakPolarHBondContact O-CB 3.21Å; V107-K111 WeakPolarHBondContact O-CG 3.26Å; V107-K111 PolarHBondContact O-N 3.03Å; V107-L130 HydrophobicContact CB-CD1 4.29Å; V107-L130 HydrophobicContact CG1-CD1 3.86Å; V107-L130 HydrophobicContact CG2-CD1 4.11Å; V107-L133 HydrophobicContact CG2-CB 4.41Å; V107-L134 HydrophobicContact CG1-CD2 4.32Å; V107-L134 HydrophobicContact CG2-CD2 4.2Å
108	H	93.9	Very high	91	Very high	95 Å²	95	70.9 Å²	70.9	44%	0.44	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-42.6	176.3	-77.2	-65.3	0	0	0	112.3	R104 L105 A106 K111 A112	R104-H108 PolarHBondContact NE-NE2 2.89Å; R104-H108 PolarHBondContact O-CD2 3.17Å; R104-H108 PolarHBondContact O-N 3.22Å; L105-H108 WeakPolarHBondContact O-CB 3.38Å; L105-H108 PolarHBondContact O-N 3.49Å; L105-H108 VanDerWaalsContact O-N 3.11Å; A106-H108 PolarHBondContact O-N 2.84Å; H108-K111 PolarHBondContact O-N 3.46Å; H108-A112 WeakPolarHBondContact O-CB 3.44Å; H108-A112 PolarHBondContact O-N 3.38Å
109	C	94.4	Very high	90.9	Very high	14 Å²	14	69.7 Å²	69.7	10%	0.095	36%	0.362	C	S	.	.	H	α-helix	trans	-59.3	-47.6	175.2	-69	0	0	0	0	111.6	A92 L105 A106 K111 A112 I113	A92-C109 HydrophobicContact CB-CB 3.77Å; L105-C109 PolarHBondContact O-N 3.05Å; L105-C109 PolarHBondContact O-SG 3.09Å; L105-C109 VanDerWaalsContact O-SG 3.36Å; A106-C109 PolarHBondContact O-N 3.47Å; C109-K111 PolarHBondContact O-N 3.16Å; C109-A112 WeakPolarHBondContact O-CB 3.24Å; C109-A112 PolarHBondContact O-N 3.5Å; C109-I113 WeakPolarHBondContact O-CG1 3.47Å; C109-I113 PolarHBondContact O-N 2.89Å; C109-I113 VanDerWaalsContact O-N 3.08Å
110	L	94.3	Very high	91	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-66.2	-36.9	178.2	-64.9	-179.8	0	0	0	112.9	L89 A92 A106 V107 A112 I113 L114 T126 Q129 L130 L133	L89-L110 HydrophobicContact CD1-CD2 4.05Å; A92-L110 HydrophobicContact CB-CD2 4.07Å; A92-L110 HydrophobicContact CB-CG 4.15Å; A106-L110 WeakPolarHBondContact O-CG 3.41Å; A106-L110 PolarHBondContact O-N 3.31Å; A106-L110 VanDerWaalsContact O-N 3.1Å; V107-L110 PolarHBondContact O-N 3.4Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-I113 HydrophobicContact CD2-CD1 4.03Å; L110-I113 WeakPolarHBondContact O-CB 3.45Å; L110-I113 PolarHBondContact O-N 3.43Å; L110-L114 PolarHBondContact O-N 3.38Å; L110-T126 HydrophobicContact CB-CG2 4.44Å; L110-T126 HydrophobicContact CD2-CG2 4.39Å; L110-Q129 HydrophobicContact CD1-CB 4.17Å; L110-L130 HydrophobicContact CB-CB 4.32Å; L110-L130 HydrophobicContact CB-CD1 4.26Å; L110-L130 HydrophobicContact CD1-CB 4.1Å; L110-L130 HydrophobicContact CD1-CD1 4.44Å; L110-L133 HydrophobicContact CD1-CD1 3.6Å
111	K	93.9	Very high	91	Very high	69 Å²	69	63.9 Å²	63.9	30%	0.3	32%	0.318	S	S	.	.	H	α-helix	trans	-66	-35.6	173.7	-75.8	-179.1	177.5	-176.8	0	112.1	V107 H108 C109 I113 L114 L130	V107-K111 HydrophobicContact CG1-CD 4.03Å; V107-K111 HydrophobicContact CG1-CG 4.43Å; V107-K111 WeakPolarHBondContact O-CB 3.21Å; V107-K111 WeakPolarHBondContact O-CG 3.26Å; V107-K111 PolarHBondContact O-N 3.03Å; H108-K111 PolarHBondContact O-N 3.46Å; C109-K111 PolarHBondContact O-N 3.16Å; K111-I113 VanDerWaalsContact C-N 3.34Å; K111-L114 PolarHBondContact O-N 3.28Å; K111-L130 HydrophobicContact CG-CD1 4.4Å; K111-L130 HydrophobicContact CG-CD2 3.78Å
112	A	93.3	Very high	91	Very high	30 Å²	30	63.2 Å²	63.2	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-36.9	175.6	0	0	0	0	0	111.9	L88 H108 C109 L110 L114 Q115	L88-A112 HydrophobicContact CD1-CB 4.12Å; L88-A112 HydrophobicContact CD2-CB 4.38Å; H108-A112 WeakPolarHBondContact O-CB 3.44Å; H108-A112 PolarHBondContact O-N 3.38Å; C109-A112 WeakPolarHBondContact O-CB 3.24Å; C109-A112 PolarHBondContact O-N 3.5Å; L110-A112 VanDerWaalsContact C-N 3.33Å; A112-L114 PolarHBondContact O-N 3.45Å; A112-Q115 WeakPolarHBondContact O-CB 3.44Å; A112-Q115 PolarHBondContact O-N 3.1Å; A112-Q115 VanDerWaalsContact O-N 3.08Å
113	I	93.3	Very high	91.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-55.9	-41.2	174.1	-69.9	172.3	0	0	0	111.3	Y85 L88 L89 C109 L110 K111 Q115 F116 L118 T126	Y85-I113 HydrophobicContact CD2-CD1 4.43Å; Y85-I113 HydrophobicContact CD2-CG2 3.5Å; Y85-I113 VanDerWaalsContact CD2-CG2 3.5Å; Y85-I113 HydrophobicContact CE2-CD1 4.47Å; Y85-I113 HydrophobicContact CE2-CG2 3.69Å; L88-I113 HydrophobicContact CB-CD1 3.75Å; L88-I113 HydrophobicContact CB-CG1 3.43Å; L88-I113 VanDerWaalsContact CB-CG1 3.43Å; L88-I113 HydrophobicContact CD1-CG1 3.7Å; L88-I113 HydrophobicContact CG-CG1 4.22Å; L89-I113 HydrophobicContact CB-CD1 4.29Å; C109-I113 WeakPolarHBondContact O-CG1 3.47Å; C109-I113 PolarHBondContact O-N 2.89Å; C109-I113 VanDerWaalsContact O-N 3.08Å; L110-I113 HydrophobicContact CD2-CD1 4.03Å; L110-I113 WeakPolarHBondContact O-CB 3.45Å; L110-I113 PolarHBondContact O-N 3.43Å; K111-I113 VanDerWaalsContact C-N 3.34Å; I113-Q115 PolarHBondContact O-N 3.46Å; I113-Q115 VanDerWaalsContact O-N 3.13Å; I113-F116 WeakPolarHBondContact O-CD2 3.2Å; I113-F116 PolarHBondContact O-N 3.01Å; I113-L118 HydrophobicContact CG2-CD1 3.58Å; I113-L118 HydrophobicContact CG2-CD2 4.24Å; I113-T126 HydrophobicContact CB-CG2 4.07Å; I113-T126 HydrophobicContact CG2-CG2 3.77Å
114	L	91.9	Very high	91.2	Very high	46 Å²	46	61.1 Å²	61.1	24%	0.241	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-4.2	-179.1	-62.5	175.7	0	0	0	114.4	L110 K111 A112 L118 E123 T126 L130	L110-L114 PolarHBondContact O-N 3.38Å; K111-L114 PolarHBondContact O-N 3.28Å; A112-L114 PolarHBondContact O-N 3.45Å; L114-L118 HydrophobicContact CD2-CD1 4.27Å; L114-E123 HydrophobicContact CD2-CG 4.24Å; L114-T126 HydrophobicContact CD2-CG2 3.77Å; L114-T126 HydrophobicContact CG-CG2 3.96Å; L114-L130 HydrophobicContact CD1-CD2 3.96Å
115	Q	90.3	Very high	91.2	Very high	170 Å²	170	54.3 Å²	54.3	79%	0.794	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-16.7	172.6	-61.6	-174.3	-12.7	0	0	112.7	A112 I113	A112-Q115 WeakPolarHBondContact O-CB 3.44Å; A112-Q115 PolarHBondContact O-N 3.1Å; A112-Q115 VanDerWaalsContact O-N 3.08Å; I113-Q115 PolarHBondContact O-N 3.46Å; I113-Q115 VanDerWaalsContact O-N 3.13Å
116	F	88.7	Confident	91.2	Very high	77 Å²	77	51.2 Å²	51.2	34%	0.338	26%	0.257	S	S	.	.	S	Bend	trans	-84.5	155.2	175.6	-58.6	-74.8	0	0	0	111.4	V81 C84 L88 I113 L118	V81-F116 HydrophobicContact CG1-CB 4.12Å; C84-F116 HydrophobicContact CB-CE2 4.39Å; C84-F116 HydrophobicContact CB-CZ 4.14Å; L88-F116 HydrophobicContact CD1-CE2 3.68Å; L88-F116 HydrophobicContact CD1-CZ 4.5Å; I113-F116 WeakPolarHBondContact O-CD2 3.2Å; I113-F116 PolarHBondContact O-N 3.01Å; F116-L118 HydrophobicContact CB-CD2 4.22Å; F116-L118 HydrophobicContact CB-CG 4.45Å; F116-L118 PolarHBondContact O-N 3.29Å
117	K	86.3	Confident	91.3	Very high	201 Å²	201	51.7 Å²	51.7	87%	0.874	26%	0.259	S	S	*	.			trans	-75	89.4	168.5	-70.6	-176.8	179.6	178.3	0	109.4
118	L	85.6	Confident	91.4	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.141	25%	0.253	C	S	.	.			trans	-83.9	158.8	179.7	-60.1	170.5	0	0	0	111.4	V81 Y85 I113 L114 F116 L122 E123	V81-L118 HydrophobicContact CG1-CD2 4.37Å; Y85-L118 HydrophobicContact CD2-CD2 3.84Å; I113-L118 HydrophobicContact CG2-CD1 3.58Å; I113-L118 HydrophobicContact CG2-CD2 4.24Å; L114-L118 HydrophobicContact CD2-CD1 4.27Å; F116-L118 HydrophobicContact CB-CD2 4.22Å; F116-L118 HydrophobicContact CB-CG 4.45Å; F116-L118 PolarHBondContact O-N 3.29Å; L118-L122 HydrophobicContact CB-CB 4.37Å; L118-E123 HydrophobicContact CB-CB 4.16Å; L118-E123 HydrophobicContact CD1-CB 4.42Å
119	S	87.4	Confident	91.3	Very high	66 Å²	66	46.6 Å²	46.6	46%	0.462	23%	0.234	S	C	.	.			trans	-66.7	152.4	162.7	69.4	0	0	0	0	110	N121 L122 E123	S119-N121 PolarHBondContact O-N 2.93Å; S119-N121 VanDerWaalsContact O-N 3.13Å; S119-L122 PolarHBondContact O-N 3.44Å; S119-L122 VanDerWaalsContact O-N 3.09Å; S119-L122 WeakPolarHBondContact OG-CG 3.45Å; S119-E123 PolarHBondContact O-N 3.32Å
120	V	88.3	Confident	91.4	Very high	69 Å²	69	45.9 Å²	45.9	42%	0.418	23%	0.229	S	C	.	.	H	α-helix	trans	-54.3	-36.5	-177.9	-179.5	0	0	0	0	112.2	A124 L154 L158	V120-A124 VanDerWaalsContact O-CB 3.28Å; V120-A124 WeakPolarHBondContact O-CB 3.35Å; V120-A124 PolarHBondContact O-N 3.05Å; V120-L154 HydrophobicContact CG1-CB 4.3Å; V120-L154 HydrophobicContact CG1-CD2 4.27Å; V120-L158 HydrophobicContact CB-CD2 4.33Å; V120-L158 HydrophobicContact CG1-CD2 3.99Å
121	N	86.9	Confident	91.4	Very high	39 Å²	39	45.9 Å²	45.9	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-53.7	176.8	177.1	-62.7	0	0	0	111.7	S119 E123 A124 R125 L158 D162	S119-N121 PolarHBondContact O-N 2.93Å; S119-N121 VanDerWaalsContact O-N 3.13Å; N121-E123 VanDerWaalsContact C-N 3.31Å; N121-E123 PolarHBondContact O-N 3.44Å; N121-A124 PolarHBondContact O-N 2.87Å; N121-R125 PolarHBondContact O-N 3.49Å; N121-L158 HydrophobicContact CB-CD1 4.46Å; N121-L158 HydrophobicContact CB-CD2 3.97Å; N121-D162 WeakPolarHBondContact ND2-CB 3.32Å; N121-D162 PolarHBondContact ND2-OD1 3.33Å; N121-D162 PolarHBondContact ND2-OD2 3Å
122	L	89.1	Confident	91.5	Very high	56 Å²	56	44 Å²	44	29%	0.293	22%	0.22	S	C	.	.	H	α-helix	trans	-66	-37.1	-177.5	-63.7	-178.5	0	0	0	111.3	Y85 L118 S119 T126	Y85-L122 HydrophobicContact CD1-CD1 4.45Å; Y85-L122 HydrophobicContact CD2-CD1 4.49Å; Y85-L122 HydrophobicContact CE1-CD1 4.45Å; Y85-L122 HydrophobicContact CE1-CD2 3.94Å; Y85-L122 HydrophobicContact CE2-CB 4.01Å; Y85-L122 HydrophobicContact CE2-CD1 4.48Å; Y85-L122 HydrophobicContact CE2-CD2 4.43Å; Y85-L122 HydrophobicContact CG-CD1 4.49Å; L118-L122 HydrophobicContact CB-CB 4.37Å; S119-L122 PolarHBondContact O-N 3.44Å; S119-L122 VanDerWaalsContact O-N 3.09Å; S119-L122 WeakPolarHBondContact OG-CG 3.45Å; L122-T126 VanDerWaalsContact O-CB 3.31Å; L122-T126 WeakPolarHBondContact O-CB 3.42Å; L122-T126 PolarHBondContact O-N 2.89Å; L122-T126 PolarHBondContact O-OG1 3.48Å
123	E	92.3	Very high	91.4	Very high	50 Å²	50	42.9 Å²	42.9	23%	0.234	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-50.8	172.9	-169.7	-174.5	161.6	0	0	110.8	L114 L118 S119 N121 R125 T126 H127 L154	L114-E123 HydrophobicContact CD2-CG 4.24Å; L118-E123 HydrophobicContact CB-CB 4.16Å; L118-E123 HydrophobicContact CD1-CB 4.42Å; S119-E123 PolarHBondContact O-N 3.32Å; N121-E123 VanDerWaalsContact C-N 3.31Å; N121-E123 PolarHBondContact O-N 3.44Å; E123-R125 PolarHBondContact O-N 2.98Å; E123-T126 PolarHBondContact O-N 2.92Å; E123-H127 PolarHBondContact O-CD2 3.16Å; E123-H127 PolarHBondContact O-N 3Å; E123-L154 HydrophobicContact CB-CD1 4.1Å; E123-L154 HydrophobicContact CG-CD1 3.6Å; E123-L154 WeakPolarHBondContact OE1-CD1 3.23Å
124	A	92.2	Very high	91.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-45.7	179.3	0	0	0	0	0	112.2	V120 N121 H127 L128 L154 L158 I165	V120-A124 VanDerWaalsContact O-CB 3.28Å; V120-A124 WeakPolarHBondContact O-CB 3.35Å; V120-A124 PolarHBondContact O-N 3.05Å; N121-A124 PolarHBondContact O-N 2.87Å; A124-H127 PolarHBondContact O-N 3.42Å; A124-L128 WeakPolarHBondContact O-CB 3.36Å; A124-L128 PolarHBondContact O-N 2.99Å; A124-L154 HydrophobicContact CB-CB 3.64Å; A124-L154 HydrophobicContact CB-CD1 4.39Å; A124-L158 HydrophobicContact CB-CD1 4.36Å; A124-I165 HydrophobicContact CB-CD1 4.43Å; A124-I165 HydrophobicContact CB-CG2 4.04Å
125	R	92.2	Very high	91.5	Very high	43 Å²	43	41.9 Å²	41.9	16%	0.162	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-40.6	178.7	-166.6	69.7	174.6	135.1	-7.1	111.6	S21 N121 E123 L128 Q129 I165 E168	S21-R125 PolarHBondContact OG-NH2 3.4Å; N121-R125 PolarHBondContact O-N 3.49Å; E123-R125 PolarHBondContact O-N 2.98Å; R125-L128 WeakPolarHBondContact O-CB 3.4Å; R125-L128 PolarHBondContact O-N 3.38Å; R125-Q129 VanDerWaalsContact CZ-NE2 3.33Å; R125-Q129 VanDerWaalsContact NH1-NE2 3.11Å; R125-Q129 WeakPolarHBondContact O-CG 3.49Å; R125-Q129 PolarHBondContact O-N 2.98Å; R125-I165 HydrophobicContact CB-CD1 4.03Å; R125-E168 IonicContact CZ-OE2 3.84Å; R125-E168 IonicContact NH1-OE1 3.39Å; R125-E168 IonicContact NH1-OE2 3.39Å; R125-E168 PolarHBondContact NH1-OE2 2.92Å
126	T	94	Very high	91.4	Very high	2 Å²	2	38 Å²	38	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-45.3	177.4	-55.3	0	0	0	0	111.1	L110 I113 L114 L122 E123 L128 Q129 L130	L110-T126 HydrophobicContact CB-CG2 4.44Å; L110-T126 HydrophobicContact CD2-CG2 4.39Å; I113-T126 HydrophobicContact CB-CG2 4.07Å; I113-T126 HydrophobicContact CG2-CG2 3.77Å; L114-T126 HydrophobicContact CD2-CG2 3.77Å; L114-T126 HydrophobicContact CG-CG2 3.96Å; L122-T126 VanDerWaalsContact O-CB 3.31Å; L122-T126 WeakPolarHBondContact O-CB 3.42Å; L122-T126 PolarHBondContact O-N 2.89Å; L122-T126 PolarHBondContact O-OG1 3.48Å; E123-T126 PolarHBondContact O-N 2.92Å; T126-L128 VanDerWaalsContact C-N 3.29Å; T126-L128 PolarHBondContact O-N 3.33Å; T126-Q129 PolarHBondContact O-N 3.27Å; T126-L130 VanDerWaalsContact O-CB 3.28Å; T126-L130 WeakPolarHBondContact O-CB 3.46Å; T126-L130 PolarHBondContact O-N 3.22Å
127	H	96.2	Very high	91.4	Very high	11 Å²	11	41 Å²	41	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-41.1	173.8	-91.2	-85.5	0	0	0	112	E123 A124 L130 G131 H147 A151	E123-H127 PolarHBondContact O-CD2 3.16Å; E123-H127 PolarHBondContact O-N 3Å; A124-H127 PolarHBondContact O-N 3.42Å; H127-L130 PolarHBondContact O-N 3.24Å; H127-G131 PolarHBondContact O-N 3.44Å; H127-H147 AromaticContact CE1-CE1 3.87Å; H127-H147 AromaticContact CE1-ND1 3.33Å; H127-H147 PolarHBondContact CE1-ND1 3.2Å; H127-H147 VanDerWaalsContact CE1-ND1 3.33Å; H127-H147 AromaticContact CG-ND1 3.98Å; H127-H147 AromaticContact ND1-CE1 3.91Å; H127-H147 AromaticContact ND1-CG 3.84Å; H127-H147 AromaticContact ND1-ND1 2.95Å; H127-H147 PolarHBondContact ND1-ND1 2.89Å; H127-A151 HydrophobicContact CB-CB 3.87Å
128	L	94.8	Very high	91.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-47.6	177.5	178.4	56.9	0	0	0	112.3	A124 R125 T126 L130 G131 R132 L148 A151 I165 E168 A169 L172	A124-L128 WeakPolarHBondContact O-CB 3.36Å; A124-L128 PolarHBondContact O-N 2.99Å; R125-L128 WeakPolarHBondContact O-CB 3.4Å; R125-L128 PolarHBondContact O-N 3.38Å; T126-L128 VanDerWaalsContact C-N 3.29Å; T126-L128 PolarHBondContact O-N 3.33Å; L128-L130 VanDerWaalsContact C-N 3.34Å; L128-L130 PolarHBondContact O-N 2.94Å; L128-G131 PolarHBondContact O-N 3.21Å; L128-R132 WeakPolarHBondContact O-CB 3.32Å; L128-R132 PolarHBondContact O-N 2.89Å; L128-L148 HydrophobicContact CD1-CD2 4.22Å; L128-A151 HydrophobicContact CB-CB 3.89Å; L128-I165 HydrophobicContact CD2-CB 4.42Å; L128-I165 HydrophobicContact CD2-CG2 3.91Å; L128-E168 HydrophobicContact CD1-CG 4.3Å; L128-E168 HydrophobicContact CD2-CB 3.91Å; L128-E168 HydrophobicContact CD2-CG 3.87Å; L128-E168 VanDerWaalsContact CD2-OE2 3.31Å; L128-E168 WeakPolarHBondContact CD2-OE2 3.24Å; L128-A169 HydrophobicContact CD1-CB 3.98Å; L128-L172 HydrophobicContact CD1-CD1 3.81Å
129	Q	93	Very high	91.6	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.033	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-41	178.5	-67.7	-55.9	-26	0	0	112	L110 R125 T126 R132 L133	L110-Q129 HydrophobicContact CD1-CB 4.17Å; R125-Q129 VanDerWaalsContact CZ-NE2 3.33Å; R125-Q129 VanDerWaalsContact NH1-NE2 3.11Å; R125-Q129 WeakPolarHBondContact O-CG 3.49Å; R125-Q129 PolarHBondContact O-N 2.98Å; T126-Q129 PolarHBondContact O-N 3.27Å; Q129-R132 PolarHBondContact O-N 3.11Å; Q129-L133 PolarHBondContact O-N 3.26Å
130	L	94.8	Very high	91.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-45.8	175.8	-179.4	52.9	0	0	0	111.3	V107 L110 K111 L114 T126 H127 L128 R132 L133 L134 H147	V107-L130 HydrophobicContact CB-CD1 4.29Å; V107-L130 HydrophobicContact CG1-CD1 3.86Å; V107-L130 HydrophobicContact CG2-CD1 4.11Å; L110-L130 HydrophobicContact CB-CB 4.32Å; L110-L130 HydrophobicContact CB-CD1 4.26Å; L110-L130 HydrophobicContact CD1-CB 4.1Å; L110-L130 HydrophobicContact CD1-CD1 4.44Å; K111-L130 HydrophobicContact CG-CD1 4.4Å; K111-L130 HydrophobicContact CG-CD2 3.78Å; L114-L130 HydrophobicContact CD1-CD2 3.96Å; T126-L130 VanDerWaalsContact O-CB 3.28Å; T126-L130 WeakPolarHBondContact O-CB 3.46Å; T126-L130 PolarHBondContact O-N 3.22Å; H127-L130 PolarHBondContact O-N 3.24Å; L128-L130 VanDerWaalsContact C-N 3.34Å; L128-L130 PolarHBondContact O-N 2.94Å; L130-R132 VanDerWaalsContact C-N 3.35Å; L130-R132 PolarHBondContact O-N 3.02Å; L130-L133 PolarHBondContact O-N 3.03Å; L130-L134 HydrophobicContact CD1-CD1 3.93Å; L130-L134 HydrophobicContact CD1-CG 4.07Å; L130-L134 HydrophobicContact CG-CD1 3.98Å; L130-L134 WeakPolarHBondContact O-CB 3.26Å; L130-L134 WeakPolarHBondContact O-CG 3.45Å; L130-L134 PolarHBondContact O-N 3.46Å; L130-H147 WeakPolarHBondContact CD2-CE1 3.41Å; L130-H147 WeakPolarHBondContact CD2-NE2 3.5Å
131	G	95.5	Very high	91.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.7	-43.7	175.4	0	0	0	0	0	112.5	H127 L128 L134 F135	H127-G131 PolarHBondContact O-N 3.44Å; L128-G131 PolarHBondContact O-N 3.21Å; G131-L134 PolarHBondContact O-N 2.62Å; G131-F135 WeakPolarHBondContact O-CB 3.5Å; G131-F135 PolarHBondContact O-N 3.32Å
132	R	94.6	Very high	92.2	Very high	30 Å²	30	46.7 Å²	46.7	11%	0.113	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-50.1	175.1	177.5	176.9	-70.2	166.6	-6.5	112.6	L19 L128 Q129 L130 L134 F135 H136 E168 L172	L19-R132 HydrophobicContact CD2-CG 4.29Å; L19-R132 PolarHBondContact O-NH1 3.43Å; L19-R132 VanDerWaalsContact O-NH1 3.13Å; L128-R132 WeakPolarHBondContact O-CB 3.32Å; L128-R132 PolarHBondContact O-N 2.89Å; Q129-R132 PolarHBondContact O-N 3.11Å; L130-R132 VanDerWaalsContact C-N 3.35Å; L130-R132 PolarHBondContact O-N 3.02Å; R132-L134 VanDerWaalsContact C-N 3.32Å; R132-L134 PolarHBondContact O-N 3.49Å; R132-F135 WeakPolarHBondContact O-CB 2.96Å; R132-F135 PolarHBondContact O-N 3.05Å; R132-H136 PolarHBondContact O-CD2 3.3Å; R132-H136 PolarHBondContact O-N 3.27Å; R132-E168 IonicContact CZ-OE1 2.64Å; R132-E168 IonicContact NH1-OE1 2.88Å; R132-E168 PolarHBondContact NH1-OE1 3.41Å; R132-E168 VanDerWaalsContact NH1-OE1 3.07Å; R132-E168 IonicContact NH2-OE1 3.99Å; R132-E168 PolarHBondContact NH2-OE1 3.23Å; R132-L172 HydrophobicContact CB-CD1 4.08Å; R132-L172 HydrophobicContact CG-CD1 4.48Å
133	L	93	Very high	92.4	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-43.1	179.2	-77.2	172.7	0	0	0	111.5	R96 M103 A106 V107 L110 Q129 L130 F135 H136 Y137	R96-L133 HydrophobicContact CG-CD2 4.31Å; M103-L133 HydrophobicContact SD-CD2 4.26Å; A106-L133 HydrophobicContact CB-CD1 4.4Å; V107-L133 HydrophobicContact CG2-CB 4.41Å; L110-L133 HydrophobicContact CD1-CD1 3.6Å; Q129-L133 PolarHBondContact O-N 3.26Å; L130-L133 PolarHBondContact O-N 3.03Å; L133-F135 VanDerWaalsContact C-N 3.32Å; L133-F135 PolarHBondContact O-N 2.97Å; L133-H136 PolarHBondContact O-N 2.9Å; L133-Y137 HydrophobicContact CD2-CD2 4.06Å; L133-Y137 HydrophobicContact CD2-CE2 4.06Å; L133-Y137 WeakPolarHBondContact O-CB 3.31Å; L133-Y137 WeakPolarHBondContact O-CD2 3.46Å; L133-Y137 PolarHBondContact O-N 2.82Å
134	L	93.7	Very high	92.5	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-39.5	176.3	-68.8	169.9	0	0	0	111.6	V107 L130 G131 R132 H136 S138 Q143 T144	V107-L134 HydrophobicContact CG1-CD2 4.32Å; V107-L134 HydrophobicContact CG2-CD2 4.2Å; L130-L134 HydrophobicContact CD1-CD1 3.93Å; L130-L134 HydrophobicContact CD1-CG 4.07Å; L130-L134 HydrophobicContact CG-CD1 3.98Å; L130-L134 WeakPolarHBondContact O-CB 3.26Å; L130-L134 WeakPolarHBondContact O-CG 3.45Å; L130-L134 PolarHBondContact O-N 3.46Å; G131-L134 PolarHBondContact O-N 2.62Å; R132-L134 VanDerWaalsContact C-N 3.32Å; R132-L134 PolarHBondContact O-N 3.49Å; L134-H136 VanDerWaalsContact C-N 3.33Å; L134-H136 PolarHBondContact O-N 3.44Å; L134-S138 WeakPolarHBondContact O-CA 3.5Å; L134-S138 WeakPolarHBondContact O-CB 3.31Å; L134-S138 PolarHBondContact O-N 3.4Å; L134-Q143 HydrophobicContact CD1-CB 3.86Å; L134-T144 WeakPolarHBondContact CB-OG1 3.49Å
135	F	92.4	Very high	92.7	Very high	20 Å²	20	49 Å²	49	9%	0.088	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-39.7	178.7	-178.5	-135.5	0	0	0	113.4	G131 R132 L133 T144 L172 E175 F176 R179	G131-F135 WeakPolarHBondContact O-CB 3.5Å; G131-F135 PolarHBondContact O-N 3.32Å; R132-F135 WeakPolarHBondContact O-CB 2.96Å; R132-F135 PolarHBondContact O-N 3.05Å; L133-F135 VanDerWaalsContact C-N 3.32Å; L133-F135 PolarHBondContact O-N 2.97Å; F135-T144 HydrophobicContact CB-CG2 3.66Å; F135-T144 HydrophobicContact CD2-CG2 4.1Å; F135-T144 HydrophobicContact CG-CG2 4.26Å; F135-L172 HydrophobicContact CD1-CD2 4.46Å; F135-E175 HydrophobicContact CE1-CB 4.31Å; F135-E175 HydrophobicContact CE1-CG 4.09Å; F135-E175 HydrophobicContact CZ-CB 4.26Å; F135-E175 HydrophobicContact CZ-CG 3.98Å; F135-F176 HydrophobicContact CD2-CB 4.12Å; F135-F176 AromaticContact CD2-CD2 3.87Å; F135-F176 HydrophobicContact CD2-CD2 3.87Å; F135-F176 HydrophobicContact CD2-CG 4.5Å; F135-F176 HydrophobicContact CE2-CB 3.73Å; F135-F176 AromaticContact CE2-CD2 3.89Å; F135-F176 HydrophobicContact CE2-CD2 3.89Å; F135-F176 HydrophobicContact CE2-CG 4.31Å; F135-F176 HydrophobicContact CZ-CB 4.15Å; F135-R179 HydrophobicContact CZ-CG 4.47Å; F135-R179 VanDerWaalsContact CZ-CZ 3.4Å
136	H	88.9	Confident	92.9	Very high	90 Å²	90	52.4 Å²	52.4	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-86.9	-30.1	-178.5	-68.8	-70.2	0	0	0	113.9	R132 L133 L134	R132-H136 PolarHBondContact O-CD2 3.3Å; R132-H136 PolarHBondContact O-N 3.27Å; L133-H136 PolarHBondContact O-N 2.9Å; L134-H136 VanDerWaalsContact C-N 3.33Å; L134-H136 PolarHBondContact O-N 3.44Å
137	Y	88.7	Confident	93.1	Very high	139 Å²	139	53 Å²	53	55%	0.545	25%	0.247	S	C	.	.	H	α-helix	trans	-124.4	-3.8	-167.3	-56.8	-72.4	0	0	0	115	M103 L133	M103-Y137 HydrophobicContact CB-CG 4.33Å; M103-Y137 HydrophobicContact CE-CD1 4.37Å; M103-Y137 HydrophobicContact CE-CD2 4.36Å; M103-Y137 HydrophobicContact CE-CE1 3.89Å; M103-Y137 HydrophobicContact CE-CE2 3.89Å; M103-Y137 HydrophobicContact CG-CD1 3.95Å; M103-Y137 HydrophobicContact CG-CD2 4.01Å; M103-Y137 HydrophobicContact CG-CE1 4.4Å; M103-Y137 HydrophobicContact CG-CE2 4.48Å; M103-Y137 HydrophobicContact CG-CG 3.74Å; M103-Y137 HydrophobicContact SD-CD2 3.98Å; M103-Y137 HydrophobicContact SD-CE2 3.99Å; M103-Y137 HydrophobicContact SD-CG 4.3Å; L133-Y137 HydrophobicContact CD2-CD2 4.06Å; L133-Y137 HydrophobicContact CD2-CE2 4.06Å; L133-Y137 WeakPolarHBondContact O-CB 3.31Å; L133-Y137 WeakPolarHBondContact O-CD2 3.46Å; L133-Y137 PolarHBondContact O-N 2.82Å
138	S	88.8	Confident	93.1	Very high	46 Å²	46	52.5 Å²	52.5	32%	0.322	24%	0.244	S	C	.	.			trans	-112.8	153.5	178.7	-171.7	0	0	0	0	112	L134 S140	L134-S138 WeakPolarHBondContact O-CA 3.5Å; L134-S138 WeakPolarHBondContact O-CB 3.31Å; L134-S138 PolarHBondContact O-N 3.4Å; S138-S140 PolarHBondContact OG-N 3.14Å; S138-S140 VanDerWaalsContact OG-N 3.13Å
139	K	86.7	Confident	93.1	Very high	208 Å²	208	55.8 Å²	55.8	90%	0.904	26%	0.26	S	S	*	.			trans	-91.9	-4.5	169.5	-61.9	-176.4	179.6	-178.7	0	112.8	D141	K139-D141 PolarHBondContact O-N 3.36Å
140	S	90.7	Very high	93.3	Very high	37 Å²	37	59.2 Å²	59.2	26%	0.259	27%	0.274	S	S	.	.			trans	-85.3	94	-176	-175.7	0	0	0	0	111.5	S138 E142 Q143 T144	S138-S140 PolarHBondContact OG-N 3.14Å; S138-S140 VanDerWaalsContact OG-N 3.13Å; S140-E142 VanDerWaalsContact C-N 3.32Å; S140-E142 PolarHBondContact O-N 2.88Å; S140-Q143 PolarHBondContact O-N 3.11Å; S140-Q143 WeakPolarHBondContact OG-CG 3.28Å; S140-T144 PolarHBondContact O-N 3.35Å; S140-T144 PolarHBondContact O-OG1 3.39Å; S140-T144 VanDerWaalsContact O-OG1 3.11Å
141	D	91.7	Very high	93.3	Very high	65 Å²	65	59.2 Å²	59.2	35%	0.348	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-38.3	178	-69.6	-17.7	0	0	0	112.9	K139 T144 K145 F176 K180	K139-D141 PolarHBondContact O-N 3.36Å; D141-T144 PolarHBondContact O-N 2.99Å; D141-K145 VanDerWaalsContact O-CB 3.32Å; D141-K145 WeakPolarHBondContact O-CB 3.44Å; D141-K145 PolarHBondContact O-N 2.89Å; D141-F176 HydrophobicContact CB-CE2 4.13Å; D141-F176 HydrophobicContact CB-CZ 3.96Å; D141-K180 WeakPolarHBondContact OD1-CE 3.29Å; D141-K180 IonicContact OD1-NZ 3.48Å; D141-K180 PolarHBondContact OD1-NZ 3.34Å; D141-K180 WeakPolarHBondContact OD2-CE 3.48Å; D141-K180 IonicContact OD2-NZ 3.85Å; D141-K180 PolarHBondContact OD2-NZ 3.26Å
142	E	93.7	Very high	93.2	Very high	165 Å²	165	62.7 Å²	62.7	77%	0.771	29%	0.287	S	S	*	.	H	α-helix	trans	-63.8	-45	-179.4	-66.6	179.7	176.3	0	0	111.9	S140 F146	S140-E142 VanDerWaalsContact C-N 3.32Å; S140-E142 PolarHBondContact O-N 2.88Å; E142-F146 VanDerWaalsContact O-CB 3.24Å; E142-F146 WeakPolarHBondContact O-CB 3.3Å; E142-F146 PolarHBondContact O-N 2.73Å
143	Q	93.4	Very high	93.1	Very high	77 Å²	77	64.7 Å²	64.7	36%	0.36	30%	0.303	S	S	.	.	H	α-helix	trans	-67.9	-43.4	178.6	-69.3	-173.6	7.3	0	0	111.2	L134 S140 K145 F146 H147	L134-Q143 HydrophobicContact CD1-CB 3.86Å; S140-Q143 PolarHBondContact O-N 3.11Å; S140-Q143 WeakPolarHBondContact OG-CG 3.28Å; Q143-K145 PolarHBondContact O-N 3Å; Q143-F146 PolarHBondContact O-N 3.45Å; Q143-H147 PolarHBondContact O-CD2 3.03Å; Q143-H147 PolarHBondContact O-N 3.29Å
144	T	94.3	Very high	93	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-56.6	-52.3	176.3	-61	0	0	0	0	110.8	L134 F135 S140 D141 H147 L148 F176	L134-T144 WeakPolarHBondContact CB-OG1 3.49Å; F135-T144 HydrophobicContact CB-CG2 3.66Å; F135-T144 HydrophobicContact CD2-CG2 4.1Å; F135-T144 HydrophobicContact CG-CG2 4.26Å; S140-T144 PolarHBondContact O-N 3.35Å; S140-T144 PolarHBondContact O-OG1 3.39Å; S140-T144 VanDerWaalsContact O-OG1 3.11Å; D141-T144 PolarHBondContact O-N 2.99Å; T144-H147 PolarHBondContact O-N 2.81Å; T144-L148 HydrophobicContact CG2-CD1 3.91Å; T144-L148 WeakPolarHBondContact O-CB 3.49Å; T144-L148 VanDerWaalsContact O-CG 3.3Å; T144-L148 WeakPolarHBondContact O-CG 3.25Å; T144-L148 PolarHBondContact O-N 3.35Å; T144-L148 VanDerWaalsContact O-N 3.08Å; T144-F176 HydrophobicContact CG2-CD2 3.89Å; T144-F176 HydrophobicContact CG2-CE2 4.18Å
145	K	95.8	Very high	92.8	Very high	77 Å²	77	65.1 Å²	65.1	34%	0.335	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-50.7	178	-178.7	-177.2	170.8	-176.1	0	111.5	D141 Q143 H147 L148 E149 L173 F176 F177	D141-K145 VanDerWaalsContact O-CB 3.32Å; D141-K145 WeakPolarHBondContact O-CB 3.44Å; D141-K145 PolarHBondContact O-N 2.89Å; Q143-K145 PolarHBondContact O-N 3Å; K145-H147 PolarHBondContact O-N 3.17Å; K145-L148 PolarHBondContact O-N 3.33Å; K145-E149 WeakPolarHBondContact CE-OE1 3.34Å; K145-E149 WeakPolarHBondContact CE-OE2 3.36Å; K145-E149 HydrophobicContact CG-CG 4.23Å; K145-E149 IonicContact NZ-OE1 3.96Å; K145-E149 WeakPolarHBondContact O-CB 3.41Å; K145-E149 WeakPolarHBondContact O-CG 3.38Å; K145-E149 PolarHBondContact O-N 3.23Å; K145-L173 HydrophobicContact CG-CD1 4.38Å; K145-F176 HydrophobicContact CB-CE1 4.09Å; K145-F176 HydrophobicContact CB-CZ 4.29Å; K145-F177 HydrophobicContact CD-CZ 4.2Å
146	F	96.8	Very high	92.6	Very high	114 Å²	114	66.9 Å²	66.9	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-56.4	-48.7	-179.1	171.7	-100.7	0	0	0	112.4	E142 Q143 K150	E142-F146 VanDerWaalsContact O-CB 3.24Å; E142-F146 WeakPolarHBondContact O-CB 3.3Å; E142-F146 PolarHBondContact O-N 2.73Å; Q143-F146 PolarHBondContact O-N 3.45Å; F146-K150 VanDerWaalsContact O-CB 3.23Å; F146-K150 WeakPolarHBondContact O-CB 3.12Å; F146-K150 PolarHBondContact O-N 2.85Å
147	H	96.8	Very high	92.5	Very high	15 Å²	15	69.5 Å²	69.5	7%	0.069	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-38.6	-177.8	-75.1	-68.3	0	0	0	112.2	H127 L130 Q143 T144 K145 A151	H127-H147 AromaticContact CE1-CE1 3.87Å; H127-H147 AromaticContact CE1-ND1 3.33Å; H127-H147 PolarHBondContact CE1-ND1 3.2Å; H127-H147 VanDerWaalsContact CE1-ND1 3.33Å; H127-H147 AromaticContact CG-ND1 3.98Å; H127-H147 AromaticContact ND1-CE1 3.91Å; H127-H147 AromaticContact ND1-CG 3.84Å; H127-H147 AromaticContact ND1-ND1 2.95Å; H127-H147 PolarHBondContact ND1-ND1 2.89Å; L130-H147 WeakPolarHBondContact CD2-CE1 3.41Å; L130-H147 WeakPolarHBondContact CD2-NE2 3.5Å; Q143-H147 PolarHBondContact O-CD2 3.03Å; Q143-H147 PolarHBondContact O-N 3.29Å; T144-H147 PolarHBondContact O-N 2.81Å; K145-H147 PolarHBondContact O-N 3.17Å; H147-A151 WeakPolarHBondContact O-CB 3.39Å; H147-A151 PolarHBondContact O-N 2.8Å
148	L	96.4	Very high	92.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.5	-42.8	175.9	-68.8	177	0	0	0	112.4	L128 T144 K145 A151 R152 L172 L173	L128-L148 HydrophobicContact CD1-CD2 4.22Å; T144-L148 HydrophobicContact CG2-CD1 3.91Å; T144-L148 WeakPolarHBondContact O-CB 3.49Å; T144-L148 VanDerWaalsContact O-CG 3.3Å; T144-L148 WeakPolarHBondContact O-CG 3.25Å; T144-L148 PolarHBondContact O-N 3.35Å; T144-L148 VanDerWaalsContact O-N 3.08Å; K145-L148 PolarHBondContact O-N 3.33Å; L148-A151 PolarHBondContact O-N 3.45Å; L148-R152 WeakPolarHBondContact O-CB 3.09Å; L148-R152 PolarHBondContact O-N 3.48Å; L148-L172 HydrophobicContact CD1-CB 4.2Å; L148-L172 HydrophobicContact CD2-CB 4Å; L148-L172 HydrophobicContact CD2-CD1 4.03Å; L148-L173 HydrophobicContact CB-CB 4.34Å; L148-L173 HydrophobicContact CB-CD1 3.95Å; L148-L173 HydrophobicContact CD1-CB 4.4Å; L148-L173 HydrophobicContact CD1-CD1 4.19Å
149	E	96.4	Very high	91.3	Very high	69 Å²	69	70.8 Å²	70.8	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-45	175.3	-75.9	-179.5	157.4	0	0	111.3	K145 A151 R152 T153 L173	K145-E149 WeakPolarHBondContact CE-OE1 3.34Å; K145-E149 WeakPolarHBondContact CE-OE2 3.36Å; K145-E149 HydrophobicContact CG-CG 4.23Å; K145-E149 IonicContact NZ-OE1 3.96Å; K145-E149 WeakPolarHBondContact O-CB 3.41Å; K145-E149 WeakPolarHBondContact O-CG 3.38Å; K145-E149 PolarHBondContact O-N 3.23Å; E149-A151 PolarHBondContact O-N 3.31Å; E149-R152 WeakPolarHBondContact O-CB 3.49Å; E149-R152 PolarHBondContact O-N 3.36Å; E149-T153 PolarHBondContact O-N 3.15Å; E149-T153 PolarHBondContact O-OG1 3.29Å; E149-T153 VanDerWaalsContact O-OG1 3.14Å; E149-L173 HydrophobicContact CG-CD1 4.39Å; E149-L173 HydrophobicContact CG-CD2 3.78Å
150	K	95.3	Very high	90.2	Very high	78 Å²	78	64.8 Å²	64.8	34%	0.339	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-43.3	177.4	-171.8	68	175.2	-175.1	0	111.6	F146 R152 T153 L154	F146-K150 VanDerWaalsContact O-CB 3.23Å; F146-K150 WeakPolarHBondContact O-CB 3.12Å; F146-K150 PolarHBondContact O-N 2.85Å; K150-R152 VanDerWaalsContact C-N 3.32Å; K150-R152 PolarHBondContact O-N 2.97Å; K150-T153 PolarHBondContact O-N 3.28Å; K150-L154 HydrophobicContact CD-CD1 4.34Å; K150-L154 HydrophobicContact CD-CG 4.37Å; K150-L154 HydrophobicContact CG-CD1 4Å; K150-L154 HydrophobicContact CG-CG 4.41Å; K150-L154 WeakPolarHBondContact O-CB 3.46Å; K150-L154 VanDerWaalsContact O-CG 3.3Å; K150-L154 WeakPolarHBondContact O-CG 3.44Å; K150-L154 PolarHBondContact O-N 3.29Å
151	A	94.9	Very high	88.6	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.3	-43.7	174	0	0	0	0	0	111.9	H127 L128 H147 L148 E149 G155 A169	H127-A151 HydrophobicContact CB-CB 3.87Å; L128-A151 HydrophobicContact CB-CB 3.89Å; H147-A151 WeakPolarHBondContact O-CB 3.39Å; H147-A151 PolarHBondContact O-N 2.8Å; L148-A151 PolarHBondContact O-N 3.45Å; E149-A151 PolarHBondContact O-N 3.31Å; A151-G155 WeakPolarHBondContact O-CA 3.37Å; A151-G155 PolarHBondContact O-N 3.09Å; A151-A169 HydrophobicContact CB-CB 4.04Å
152	R	94	Very high	87.2	Confident	73 Å²	73	68.1 Å²	68.1	28%	0.275	35%	0.352	S	S	.	.	H	α-helix	trans	-63.9	-46.8	177.5	-167.8	-178.4	74	112.9	-2.1	112	L148 E149 K150 G155 A156 A169 D192	L148-R152 WeakPolarHBondContact O-CB 3.09Å; L148-R152 PolarHBondContact O-N 3.48Å; E149-R152 WeakPolarHBondContact O-CB 3.49Å; E149-R152 PolarHBondContact O-N 3.36Å; K150-R152 VanDerWaalsContact C-N 3.32Å; K150-R152 PolarHBondContact O-N 2.97Å; R152-G155 PolarHBondContact O-N 2.93Å; R152-A156 PolarHBondContact O-N 2.98Å; R152-A169 HydrophobicContact CB-CB 3.88Å; R152-D192 IonicContact NH1-OD2 2.97Å
153	T	93	Very high	86	Confident	73 Å²	73	61.3 Å²	61.3	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-64.9	-45.6	179.7	-60.1	0	0	0	0	111.9	E149 K150 A156 H157	E149-T153 PolarHBondContact O-N 3.15Å; E149-T153 PolarHBondContact O-OG1 3.29Å; E149-T153 VanDerWaalsContact O-OG1 3.14Å; K150-T153 PolarHBondContact O-N 3.28Å; T153-A156 PolarHBondContact O-N 2.97Å; T153-H157 PolarHBondContact O-CE1 3.43Å; T153-H157 PolarHBondContact O-ND1 2.66Å
154	L	91.7	Very high	85.7	Confident	20 Å²	20	59.8 Å²	59.8	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-66	-42.3	176.4	-66.3	172.1	0	0	0	111	V120 E123 A124 K150 A156 H157	V120-L154 HydrophobicContact CG1-CB 4.3Å; V120-L154 HydrophobicContact CG1-CD2 4.27Å; E123-L154 HydrophobicContact CB-CD1 4.1Å; E123-L154 HydrophobicContact CG-CD1 3.6Å; E123-L154 WeakPolarHBondContact OE1-CD1 3.23Å; A124-L154 HydrophobicContact CB-CB 3.64Å; A124-L154 HydrophobicContact CB-CD1 4.39Å; K150-L154 HydrophobicContact CD-CD1 4.34Å; K150-L154 HydrophobicContact CD-CG 4.37Å; K150-L154 HydrophobicContact CG-CD1 4Å; K150-L154 HydrophobicContact CG-CG 4.41Å; K150-L154 WeakPolarHBondContact O-CB 3.46Å; K150-L154 VanDerWaalsContact O-CG 3.3Å; K150-L154 WeakPolarHBondContact O-CG 3.44Å; K150-L154 PolarHBondContact O-N 3.29Å; L154-A156 VanDerWaalsContact C-N 3.25Å; L154-A156 PolarHBondContact O-N 3.41Å; L154-H157 PolarHBondContact O-N 2.9Å; L154-H157 VanDerWaalsContact O-N 3.07Å
155	G	89.4	Confident	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.6	-30.9	176.9	0	0	0	0	0	113.8	A151 R152 H157 L158	A151-G155 WeakPolarHBondContact O-CA 3.37Å; A151-G155 PolarHBondContact O-N 3.09Å; R152-G155 PolarHBondContact O-N 2.93Å; G155-H157 PolarHBondContact O-N 3.06Å; G155-L158 WeakPolarHBondContact O-CB 3.31Å; G155-L158 PolarHBondContact O-N 3.34Å
156	A	88	Confident	85.4	Confident	56 Å²	56	57.5 Å²	57.5	46%	0.463	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.3	175.9	0	0	0	0	0	113.6	R152 T153 L154	R152-A156 PolarHBondContact O-N 2.98Å; T153-A156 PolarHBondContact O-N 2.97Å; L154-A156 VanDerWaalsContact C-N 3.25Å; L154-A156 PolarHBondContact O-N 3.41Å
157	H	85.9	Confident	85.2	Confident	146 Å²	146	52.1 Å²	52.1	68%	0.676	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.5	178.2	-61.7	88.4	0	0	0	113.2	T153 L154 G155	T153-H157 PolarHBondContact O-CE1 3.43Å; T153-H157 PolarHBondContact O-ND1 2.66Å; L154-H157 PolarHBondContact O-N 2.9Å; L154-H157 VanDerWaalsContact O-N 3.07Å; G155-H157 PolarHBondContact O-N 3.06Å
158	L	83.4	Confident	85.1	Confident	26 Å²	26	52.5 Å²	52.5	14%	0.136	29%	0.287	C	S	.	.	S	Bend	trans	-81.5	155.3	179.3	-60.1	178	0	0	0	111.8	V120 N121 A124 G155 D162 I165	V120-L158 HydrophobicContact CB-CD2 4.33Å; V120-L158 HydrophobicContact CG1-CD2 3.99Å; N121-L158 HydrophobicContact CB-CD1 4.46Å; N121-L158 HydrophobicContact CB-CD2 3.97Å; A124-L158 HydrophobicContact CB-CD1 4.36Å; G155-L158 WeakPolarHBondContact O-CB 3.31Å; G155-L158 PolarHBondContact O-N 3.34Å; L158-D162 HydrophobicContact CB-CB 4.49Å; L158-D162 HydrophobicContact CD1-CB 4.18Å; L158-I165 HydrophobicContact CD1-CD1 3.91Å
159	K	69.6	Low	85	Confident	185 Å²	185	52.5 Å²	52.5	80%	0.804	29%	0.287	S	S	*	.			trans	-91.8	164.4	175.1	-68.5	-177.4	179.6	178.9	0	111.3	S161 D162	K159-S161 VanDerWaalsContact C-N 3.31Å; K159-S161 PolarHBondContact O-N 3.23Å; K159-D162 PolarHBondContact O-N 3.2Å; K159-D162 VanDerWaalsContact O-N 3.08Å
160	A	62.6	Low	85	Confident	83 Å²	83	49.3 Å²	49.3	69%	0.686	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-45.7	-29.8	-162.9	0	0	0	0	0	119	D162	A160-D162 PolarHBondContact O-N 3.06Å
161	S	58.5	Low	85	Confident	109 Å²	109	45.8 Å²	45.8	76%	0.762	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23.9	179.2	52.8	0	0	0	0	113.4	K159	K159-S161 VanDerWaalsContact C-N 3.31Å; K159-S161 PolarHBondContact O-N 3.23Å
162	D	61.2	Low	85	Confident	62 Å²	62	46.3 Å²	46.3	33%	0.332	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-118	21	-176.4	-61.6	-61.6	0	0	0	112.9	N121 L158 K159 A160 S164 I165	N121-D162 WeakPolarHBondContact ND2-CB 3.32Å; N121-D162 PolarHBondContact ND2-OD1 3.33Å; N121-D162 PolarHBondContact ND2-OD2 3Å; L158-D162 HydrophobicContact CB-CB 4.49Å; L158-D162 HydrophobicContact CD1-CB 4.18Å; K159-D162 PolarHBondContact O-N 3.2Å; K159-D162 VanDerWaalsContact O-N 3.08Å; A160-D162 PolarHBondContact O-N 3.06Å; D162-S164 PolarHBondContact O-N 3.27Å; D162-I165 PolarHBondContact O-N 3.35Å
163	D	69.7	Low	85.1	Confident	23 Å²	23	42.9 Å²	42.9	12%	0.123	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.1	-174	-102.9	15.5	0	0	0	114.3	K166 F167	D163-K166 WeakPolarHBondContact O-CE 3.3Å; D163-K166 WeakPolarHBondContact O-CG 3.29Å; D163-K166 IonicContact OD1-NZ 2.9Å; D163-K166 PolarHBondContact OD1-NZ 2.84Å; D163-K166 IonicContact OD2-NZ 3.22Å; D163-K166 PolarHBondContact OD2-NZ 3.47Å; D163-F167 WeakPolarHBondContact O-CD2 3.43Å; D163-F167 VanDerWaalsContact O-CE2 3.28Å; D163-F167 WeakPolarHBondContact O-CE2 3.29Å
164	S	86.5	Confident	85.2	Confident	45 Å²	45	39.6 Å²	39.6	32%	0.315	23%	0.228	S	C	.	.	H	α-helix	trans	-73.2	-28.5	-177.7	61	0	0	0	0	114.2	D162 K166 F167 E168 W203	D162-S164 PolarHBondContact O-N 3.27Å; S164-K166 VanDerWaalsContact C-N 3.34Å; S164-K166 PolarHBondContact O-N 3Å; S164-F167 PolarHBondContact O-N 3.02Å; S164-E168 WeakPolarHBondContact O-CB 3.38Å; S164-E168 PolarHBondContact O-N 3.01Å; S164-W203 VanDerWaalsContact CB-NE1 3.26Å
165	I	91	Very high	85.3	Confident	5 Å²	5	42 Å²	42	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-42.5	-173.4	-64.2	176.4	0	0	0	111.2	A124 R125 L128 L158 D162 F167 E168 A169	A124-I165 HydrophobicContact CB-CD1 4.43Å; A124-I165 HydrophobicContact CB-CG2 4.04Å; R125-I165 HydrophobicContact CB-CD1 4.03Å; L128-I165 HydrophobicContact CD2-CB 4.42Å; L128-I165 HydrophobicContact CD2-CG2 3.91Å; L158-I165 HydrophobicContact CD1-CD1 3.91Å; D162-I165 PolarHBondContact O-N 3.35Å; I165-F167 VanDerWaalsContact C-N 3.32Å; I165-F167 PolarHBondContact O-N 2.96Å; I165-E168 PolarHBondContact O-N 3.34Å; I165-A169 VanDerWaalsContact O-CB 3.25Å; I165-A169 WeakPolarHBondContact O-CB 3.5Å; I165-A169 PolarHBondContact O-N 3.17Å
166	K	91.5	Very high	85.5	Confident	26 Å²	26	42.5 Å²	42.5	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-36.1	-179.5	70.5	-159	173.6	-162.7	0	112.1	D163 S164 A170	D163-K166 WeakPolarHBondContact O-CE 3.3Å; D163-K166 WeakPolarHBondContact O-CG 3.29Å; D163-K166 IonicContact OD1-NZ 2.9Å; D163-K166 PolarHBondContact OD1-NZ 2.84Å; D163-K166 IonicContact OD2-NZ 3.22Å; D163-K166 PolarHBondContact OD2-NZ 3.47Å; S164-K166 VanDerWaalsContact C-N 3.34Å; S164-K166 PolarHBondContact O-N 3Å; K166-A170 VanDerWaalsContact O-CB 3.3Å; K166-A170 WeakPolarHBondContact O-CB 3.48Å; K166-A170 PolarHBondContact O-N 3.3Å
167	F	93.8	Very high	85.8	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-76.3	-44.1	177.4	-56.3	-52.2	0	0	0	111.5	D163 S164 I165 A169 A170 T171 A193 L196 S197 W203 I207	D163-F167 WeakPolarHBondContact O-CD2 3.43Å; D163-F167 VanDerWaalsContact O-CE2 3.28Å; D163-F167 WeakPolarHBondContact O-CE2 3.29Å; S164-F167 PolarHBondContact O-N 3.02Å; I165-F167 VanDerWaalsContact C-N 3.32Å; I165-F167 PolarHBondContact O-N 2.96Å; F167-A169 VanDerWaalsContact C-N 3.29Å; F167-A169 PolarHBondContact O-N 2.98Å; F167-A170 PolarHBondContact O-N 3.25Å; F167-A170 VanDerWaalsContact O-N 3.12Å; F167-T171 WeakPolarHBondContact O-CG2 3.33Å; F167-T171 PolarHBondContact O-N 2.63Å; F167-T171 PolarHBondContact O-OG1 3.48Å; F167-T171 VanDerWaalsContact O-OG1 3.06Å; F167-A193 HydrophobicContact CD1-CB 4.34Å; F167-A193 WeakPolarHBondContact CE1-O 3.43Å; F167-L196 HydrophobicContact CE1-CB 4.07Å; F167-L196 HydrophobicContact CZ-CB 4.34Å; F167-S197 VanDerWaalsContact CZ-CA 3.41Å; F167-W203 HydrophobicContact CB-CB 4.08Å; F167-W203 HydrophobicContact CB-CD2 3.57Å; F167-W203 HydrophobicContact CB-CE3 3.51Å; F167-W203 HydrophobicContact CB-CG 3.83Å; F167-W203 HydrophobicContact CB-CZ3 4.15Å; F167-W203 HydrophobicContact CD2-CB 3.71Å; F167-W203 AromaticContact CD2-CD1 3.99Å; F167-W203 HydrophobicContact CD2-CD2 4.34Å; F167-W203 AromaticContact CD2-CG 3.72Å; F167-W203 HydrophobicContact CD2-CG 3.72Å; F167-W203 HydrophobicContact CE2-CB 4.38Å; F167-W203 HydrophobicContact CG-CB 3.96Å; F167-W203 HydrophobicContact CG-CD2 4.34Å; F167-W203 HydrophobicContact CG-CG 4.07Å; F167-I207 HydrophobicContact CB-CD1 4.26Å; F167-I207 HydrophobicContact CD1-CD1 3.68Å; F167-I207 HydrophobicContact CE1-CD1 4.39Å; F167-I207 HydrophobicContact CG-CD1 4.16Å
168	E	94.1	Very high	86	Confident	23 Å²	23	37.7 Å²	37.7	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-40.5	175.1	-166.8	174.5	-171.7	0	0	111.3	R125 L128 R132 S164 I165 T171 L172 W203	R125-E168 IonicContact CZ-OE2 3.84Å; R125-E168 IonicContact NH1-OE1 3.39Å; R125-E168 IonicContact NH1-OE2 3.39Å; R125-E168 PolarHBondContact NH1-OE2 2.92Å; L128-E168 HydrophobicContact CD1-CG 4.3Å; L128-E168 HydrophobicContact CD2-CB 3.91Å; L128-E168 HydrophobicContact CD2-CG 3.87Å; L128-E168 VanDerWaalsContact CD2-OE2 3.31Å; L128-E168 WeakPolarHBondContact CD2-OE2 3.24Å; R132-E168 IonicContact CZ-OE1 2.64Å; R132-E168 IonicContact NH1-OE1 2.88Å; R132-E168 PolarHBondContact NH1-OE1 3.41Å; R132-E168 VanDerWaalsContact NH1-OE1 3.07Å; R132-E168 IonicContact NH2-OE1 3.99Å; R132-E168 PolarHBondContact NH2-OE1 3.23Å; S164-E168 WeakPolarHBondContact O-CB 3.38Å; S164-E168 PolarHBondContact O-N 3.01Å; I165-E168 PolarHBondContact O-N 3.34Å; E168-T171 PolarHBondContact O-OG1 3.49Å; E168-L172 WeakPolarHBondContact O-CG 3.46Å; E168-L172 PolarHBondContact O-N 2.92Å; E168-W203 HydrophobicContact CB-CH2 3.56Å; E168-W203 HydrophobicContact CB-CZ2 3.97Å; E168-W203 HydrophobicContact CB-CZ3 4.33Å; E168-W203 HydrophobicContact CG-CH2 3.94Å; E168-W203 HydrophobicContact CG-CZ2 4.49Å
169	A	95.2	Very high	86.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67	-41.4	173.2	0	0	0	0	0	112.6	L128 A151 R152 I165 F167 L173	L128-A169 HydrophobicContact CD1-CB 3.98Å; A151-A169 HydrophobicContact CB-CB 4.04Å; R152-A169 HydrophobicContact CB-CB 3.88Å; I165-A169 VanDerWaalsContact O-CB 3.25Å; I165-A169 WeakPolarHBondContact O-CB 3.5Å; I165-A169 PolarHBondContact O-N 3.17Å; F167-A169 VanDerWaalsContact C-N 3.29Å; F167-A169 PolarHBondContact O-N 2.98Å; A169-L173 WeakPolarHBondContact O-CB 3.43Å; A169-L173 PolarHBondContact O-N 3.41Å
170	A	95.2	Very high	87.2	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-45.5	179.4	0	0	0	0	0	112.5	K166 F167 L173 A174 I189 A193	K166-A170 VanDerWaalsContact O-CB 3.3Å; K166-A170 WeakPolarHBondContact O-CB 3.48Å; K166-A170 PolarHBondContact O-N 3.3Å; F167-A170 PolarHBondContact O-N 3.25Å; F167-A170 VanDerWaalsContact O-N 3.12Å; A170-L173 PolarHBondContact O-N 2.84Å; A170-A174 WeakPolarHBondContact O-CB 2.96Å; A170-A174 PolarHBondContact O-N 2.82Å; A170-I189 HydrophobicContact CB-CG2 3.85Å; A170-I189 WeakPolarHBondContact O-CG2 3.29Å; A170-A193 HydrophobicContact CB-CB 3.9Å
171	T	95.2	Very high	88.3	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-47.2	177.7	53.4	0	0	0	0	111.8	F167 E168 L173 A174 E175 W203 I207 E210	F167-T171 WeakPolarHBondContact O-CG2 3.33Å; F167-T171 PolarHBondContact O-N 2.63Å; F167-T171 PolarHBondContact O-OG1 3.48Å; F167-T171 VanDerWaalsContact O-OG1 3.06Å; E168-T171 PolarHBondContact O-OG1 3.49Å; T171-L173 VanDerWaalsContact C-N 3.34Å; T171-L173 PolarHBondContact O-N 3.44Å; T171-A174 PolarHBondContact O-N 2.96Å; T171-E175 PolarHBondContact O-N 3.04Å; T171-W203 HydrophobicContact CG2-CE3 4.45Å; T171-W203 HydrophobicContact CG2-CZ3 4.07Å; T171-I207 HydrophobicContact CG2-CG1 4.2Å; T171-E210 WeakPolarHBondContact CA-OE2 3.44Å; T171-E210 WeakPolarHBondContact CB-OE2 3.44Å; T171-E210 WeakPolarHBondContact CG2-OE2 3.49Å
172	L	95.5	Very high	89.9	Confident	10 Å²	10	35.8 Å²	35.8	5%	0.052	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-37.9	174.4	-72.1	174	0	0	0	113.1	L128 R132 F135 L148 E168 F176	L128-L172 HydrophobicContact CD1-CD1 3.81Å; R132-L172 HydrophobicContact CB-CD1 4.08Å; R132-L172 HydrophobicContact CG-CD1 4.48Å; F135-L172 HydrophobicContact CD1-CD2 4.46Å; L148-L172 HydrophobicContact CD1-CB 4.2Å; L148-L172 HydrophobicContact CD2-CB 4Å; L148-L172 HydrophobicContact CD2-CD1 4.03Å; E168-L172 WeakPolarHBondContact O-CG 3.46Å; E168-L172 PolarHBondContact O-N 2.92Å; L172-F176 WeakPolarHBondContact O-CB 3.38Å; L172-F176 PolarHBondContact O-N 3.02Å
173	L	95.8	Very high	91.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-70.2	-37.8	179	-171.8	64.9	0	0	0	111.3	K145 L148 E149 A169 A170 T171 F176 F177 I189	K145-L173 HydrophobicContact CG-CD1 4.38Å; L148-L173 HydrophobicContact CB-CB 4.34Å; L148-L173 HydrophobicContact CB-CD1 3.95Å; L148-L173 HydrophobicContact CD1-CB 4.4Å; L148-L173 HydrophobicContact CD1-CD1 4.19Å; E149-L173 HydrophobicContact CG-CD1 4.39Å; E149-L173 HydrophobicContact CG-CD2 3.78Å; A169-L173 WeakPolarHBondContact O-CB 3.43Å; A169-L173 PolarHBondContact O-N 3.41Å; A170-L173 PolarHBondContact O-N 2.84Å; T171-L173 VanDerWaalsContact C-N 3.34Å; T171-L173 PolarHBondContact O-N 3.44Å; L173-F176 HydrophobicContact CD1-CD1 4.22Å; L173-F176 WeakPolarHBondContact O-CB 3.4Å; L173-F176 PolarHBondContact O-N 3.19Å; L173-F177 HydrophobicContact CD1-CD2 4.22Å; L173-F177 HydrophobicContact CD1-CE2 3.7Å; L173-F177 HydrophobicContact CD1-CZ 4.42Å; L173-F177 HydrophobicContact CD2-CE2 4.13Å; L173-F177 HydrophobicContact CG-CD2 3.95Å; L173-F177 HydrophobicContact CG-CE2 3.62Å; L173-F177 WeakPolarHBondContact O-CD2 3.44Å; L173-F177 PolarHBondContact O-N 2.86Å; L173-I189 HydrophobicContact CB-CD1 4.47Å; L173-I189 HydrophobicContact CD2-CD1 3.61Å; L173-I189 HydrophobicContact CD2-CG1 4.39Å; L173-I189 HydrophobicContact CG-CD1 3.73Å
174	A	95.3	Very high	92.3	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-47.6	172.5	0	0	0	0	0	111.2	A170 T171 F176 F177 E178 A186 L190	A170-A174 WeakPolarHBondContact O-CB 2.96Å; A170-A174 PolarHBondContact O-N 2.82Å; T171-A174 PolarHBondContact O-N 2.96Å; A174-F176 VanDerWaalsContact C-N 3.29Å; A174-F176 PolarHBondContact O-N 3.13Å; A174-F177 PolarHBondContact O-N 3.14Å; A174-F177 VanDerWaalsContact O-N 3.15Å; A174-E178 WeakPolarHBondContact O-CB 3.43Å; A174-E178 PolarHBondContact O-N 3.05Å; A174-A186 HydrophobicContact CB-CB 4.23Å; A174-A186 WeakPolarHBondContact O-CB 3.45Å; A174-L190 HydrophobicContact CB-CD1 4.06Å; A174-L190 HydrophobicContact CB-CD2 3.77Å; A174-L190 HydrophobicContact CB-CG 3.71Å
175	E	93.7	Very high	92.6	Very high	70 Å²	70	45.1 Å²	45.1	33%	0.327	20%	0.202	S	C	.	.	H	α-helix	trans	-59.4	-40.3	175	-167.5	-171.3	166.9	0	0	111.8	F135 T171 E178 R179	F135-E175 HydrophobicContact CE1-CB 4.31Å; F135-E175 HydrophobicContact CE1-CG 4.09Å; F135-E175 HydrophobicContact CZ-CB 4.26Å; F135-E175 HydrophobicContact CZ-CG 3.98Å; T171-E175 PolarHBondContact O-N 3.04Å; E175-E178 PolarHBondContact O-N 2.71Å; E175-R179 WeakPolarHBondContact O-CG 3.17Å; E175-R179 PolarHBondContact O-N 3.09Å; E175-R179 IonicContact OE1-CZ 2.74Å; E175-R179 VanDerWaalsContact OE1-CZ 3.3Å; E175-R179 IonicContact OE1-NE 2.78Å; E175-R179 PolarHBondContact OE1-NE 3.28Å; E175-R179 IonicContact OE1-NH2 2.91Å; E175-R179 PolarHBondContact OE1-NH2 3.46Å
176	F	94.3	Very high	92.8	Very high	12 Å²	12	45.1 Å²	45.1	5%	0.053	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-47.8	174.2	166.7	-95	0	0	0	112.1	F135 D141 T144 K145 L172 L173 A174 R179 K180	F135-F176 HydrophobicContact CD2-CB 4.12Å; F135-F176 AromaticContact CD2-CD2 3.87Å; F135-F176 HydrophobicContact CD2-CD2 3.87Å; F135-F176 HydrophobicContact CD2-CG 4.5Å; F135-F176 HydrophobicContact CE2-CB 3.73Å; F135-F176 AromaticContact CE2-CD2 3.89Å; F135-F176 HydrophobicContact CE2-CD2 3.89Å; F135-F176 HydrophobicContact CE2-CG 4.31Å; F135-F176 HydrophobicContact CZ-CB 4.15Å; D141-F176 HydrophobicContact CB-CE2 4.13Å; D141-F176 HydrophobicContact CB-CZ 3.96Å; T144-F176 HydrophobicContact CG2-CD2 3.89Å; T144-F176 HydrophobicContact CG2-CE2 4.18Å; K145-F176 HydrophobicContact CB-CE1 4.09Å; K145-F176 HydrophobicContact CB-CZ 4.29Å; L172-F176 WeakPolarHBondContact O-CB 3.38Å; L172-F176 PolarHBondContact O-N 3.02Å; L173-F176 HydrophobicContact CD1-CD1 4.22Å; L173-F176 WeakPolarHBondContact O-CB 3.4Å; L173-F176 PolarHBondContact O-N 3.19Å; A174-F176 VanDerWaalsContact C-N 3.29Å; A174-F176 PolarHBondContact O-N 3.13Å; F176-R179 PolarHBondContact O-N 2.84Å; F176-K180 HydrophobicContact CE2-CG 4.4Å; F176-K180 HydrophobicContact CZ-CG 4.31Å; F176-K180 WeakPolarHBondContact O-CG 3.43Å; F176-K180 PolarHBondContact O-N 3.3Å
177	F	94	Very high	92.9	Very high	10 Å²	10	44.5 Å²	44.5	4%	0.044	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-38.2	178.1	-79	-60.5	0	0	0	112.3	K145 L173 A174 K180 G181 K182 E185 A186 I189	K145-F177 HydrophobicContact CD-CZ 4.2Å; L173-F177 HydrophobicContact CD1-CD2 4.22Å; L173-F177 HydrophobicContact CD1-CE2 3.7Å; L173-F177 HydrophobicContact CD1-CZ 4.42Å; L173-F177 HydrophobicContact CD2-CE2 4.13Å; L173-F177 HydrophobicContact CG-CD2 3.95Å; L173-F177 HydrophobicContact CG-CE2 3.62Å; L173-F177 WeakPolarHBondContact O-CD2 3.44Å; L173-F177 PolarHBondContact O-N 2.86Å; A174-F177 PolarHBondContact O-N 3.14Å; A174-F177 VanDerWaalsContact O-N 3.15Å; F177-K180 CarbonylContact O-C 3.51Å; F177-K180 WeakPolarHBondContact O-CA 3.46Å; F177-K180 PolarHBondContact O-N 3.33Å; F177-K180 VanDerWaalsContact O-N 3.08Å; F177-G181 PolarHBondContact O-N 2.95Å; F177-K182 HydrophobicContact CB-CB 4.12Å; F177-K182 HydrophobicContact CD1-CB 3.87Å; F177-K182 HydrophobicContact CD1-CD 3.77Å; F177-K182 HydrophobicContact CD1-CG 4.47Å; F177-K182 HydrophobicContact CE1-CD 4.08Å; F177-K182 HydrophobicContact CG-CB 4.44Å; F177-K182 PolarHBondContact O-N 3.49Å; F177-E185 HydrophobicContact CB-CB 4.46Å; F177-E185 HydrophobicContact CD1-CB 4.05Å; F177-E185 HydrophobicContact CD2-CB 4.27Å; F177-E185 HydrophobicContact CE1-CB 4.35Å; F177-E185 HydrophobicContact CG-CB 4.01Å; F177-A186 HydrophobicContact CB-CB 3.96Å; F177-I189 HydrophobicContact CD2-CD1 3.36Å; F177-I189 HydrophobicContact CE2-CD1 3.33Å
178	E	89.7	Confident	92.9	Very high	90 Å²	90	46.4 Å²	46.4	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-60.3	-47.2	175.3	-168	-172	166.1	0	0	111.5	A174 E175 K180 G181	A174-E178 WeakPolarHBondContact O-CB 3.43Å; A174-E178 PolarHBondContact O-N 3.05Å; E175-E178 PolarHBondContact O-N 2.71Å; E178-K180 PolarHBondContact O-N 2.85Å; E178-K180 VanDerWaalsContact O-N 3.15Å; E178-G181 PolarHBondContact O-N 3.46Å
179	R	88	Confident	93	Very high	138 Å²	138	46 Å²	46	52%	0.521	21%	0.212	S	C	.	.	H	α-helix	trans	-60.9	-24.2	175.5	-72.7	-172.4	-170.6	172.2	-0.5	113.2	F135 E175 F176 G181	F135-R179 HydrophobicContact CZ-CG 4.47Å; F135-R179 VanDerWaalsContact CZ-CZ 3.4Å; E175-R179 WeakPolarHBondContact O-CG 3.17Å; E175-R179 PolarHBondContact O-N 3.09Å; E175-R179 IonicContact OE1-CZ 2.74Å; E175-R179 VanDerWaalsContact OE1-CZ 3.3Å; E175-R179 IonicContact OE1-NE 2.78Å; E175-R179 PolarHBondContact OE1-NE 3.28Å; E175-R179 IonicContact OE1-NH2 2.91Å; E175-R179 PolarHBondContact OE1-NH2 3.46Å; F176-R179 PolarHBondContact O-N 2.84Å; R179-G181 VanDerWaalsContact C-N 3.35Å
180	K	89.7	Confident	93	Very high	98 Å²	98	46.1 Å²	46.1	43%	0.426	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.1	174.8	-62.1	-65.2	170	175.7	0	113.5	D141 F176 F177 E178 K182	D141-K180 WeakPolarHBondContact OD1-CE 3.29Å; D141-K180 IonicContact OD1-NZ 3.48Å; D141-K180 PolarHBondContact OD1-NZ 3.34Å; D141-K180 WeakPolarHBondContact OD2-CE 3.48Å; D141-K180 IonicContact OD2-NZ 3.85Å; D141-K180 PolarHBondContact OD2-NZ 3.26Å; F176-K180 HydrophobicContact CE2-CG 4.4Å; F176-K180 HydrophobicContact CZ-CG 4.31Å; F176-K180 WeakPolarHBondContact O-CG 3.43Å; F176-K180 PolarHBondContact O-N 3.3Å; F177-K180 CarbonylContact O-C 3.51Å; F177-K180 WeakPolarHBondContact O-CA 3.46Å; F177-K180 PolarHBondContact O-N 3.33Å; F177-K180 VanDerWaalsContact O-N 3.08Å; E178-K180 PolarHBondContact O-N 2.85Å; E178-K180 VanDerWaalsContact O-N 3.15Å; K180-K182 HydrophobicContact CB-CG 4.45Å; K180-K182 PolarHBondContact O-N 2.91Å
181	G	86.9	Confident	93	Very high	31 Å²	31	48.9 Å²	48.9	32%	0.32	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	9.5	-176.5	0	0	0	0	0	114	F177 E178 R179 R183	F177-G181 PolarHBondContact O-N 2.95Å; E178-G181 PolarHBondContact O-N 3.46Å; R179-G181 VanDerWaalsContact C-N 3.35Å; G181-R183 VanDerWaalsContact C-N 3.31Å; G181-R183 PolarHBondContact O-N 3.33Å; G181-R183 VanDerWaalsContact O-N 3.15Å
182	K	91.3	Very high	92.9	Very high	97 Å²	97	51.3 Å²	51.3	42%	0.422	24%	0.24	S	C	.	.			trans	-88.2	66.4	179.7	-73.7	-173.4	170	-158.7	0	110.6	F177 K180 E185 A186	F177-K182 HydrophobicContact CB-CB 4.12Å; F177-K182 HydrophobicContact CD1-CB 3.87Å; F177-K182 HydrophobicContact CD1-CD 3.77Å; F177-K182 HydrophobicContact CD1-CG 4.47Å; F177-K182 HydrophobicContact CE1-CD 4.08Å; F177-K182 HydrophobicContact CG-CB 4.44Å; F177-K182 PolarHBondContact O-N 3.49Å; K180-K182 HydrophobicContact CB-CG 4.45Å; K180-K182 PolarHBondContact O-N 2.91Å; K182-E185 HydrophobicContact CB-CB 4.44Å; K182-E185 WeakPolarHBondContact CB-OE2 3.42Å; K182-E185 WeakPolarHBondContact CD-OE1 3.45Å; K182-E185 PolarHBondContact O-N 3.02Å; K182-A186 PolarHBondContact O-N 2.69Å
183	R	90.1	Very high	92.8	Very high	82 Å²	82	51.1 Å²	51.1	31%	0.309	24%	0.24	S	C	.	.	H	α-helix	trans	-62.9	-43.9	-172.5	-65.1	-170.8	177	100.1	2.7	112.8	G181 E185 A186 T187 A217 E218 T476	G181-R183 VanDerWaalsContact C-N 3.31Å; G181-R183 PolarHBondContact O-N 3.33Å; G181-R183 VanDerWaalsContact O-N 3.15Å; R183-E185 VanDerWaalsContact C-N 3.34Å; R183-E185 PolarHBondContact O-N 3.25Å; R183-A186 WeakPolarHBondContact O-CB 3.41Å; R183-A186 PolarHBondContact O-N 2.89Å; R183-A186 VanDerWaalsContact O-N 3.15Å; R183-T187 PolarHBondContact O-N 2.97Å; R183-T187 PolarHBondContact O-OG1 2.75Å; R183-T187 VanDerWaalsContact O-OG1 3.1Å; R183-A217 PolarHBondContact NE-O 3.33Å; R183-A217 VanDerWaalsContact NE-O 3.07Å; R183-E218 HydrophobicContact CB-CG 4.02Å; R183-T476 PolarHBondContact NH1-OG1 3.03Å; R183-T476 PolarHBondContact NH2-OG1 3.09Å
184	Y	91.8	Very high	92.7	Very high	173 Å²	173	52 Å²	52	68%	0.678	25%	0.245	S	C	*	.	H	α-helix	trans	-57.5	-46.6	179.4	179.8	-101.6	0	0	0	111.8	A186 T187 C188	Y184-A186 PolarHBondContact O-N 2.78Å; Y184-T187 PolarHBondContact O-N 3.2Å; Y184-C188 VanDerWaalsContact CE1-SG 3.54Å; Y184-C188 VanDerWaalsContact CZ-SG 3.57Å; Y184-C188 PolarHBondContact O-N 3.45Å; Y184-C188 PolarHBondContact O-SG 3.15Å
185	E	93.2	Very high	92.5	Very high	71 Å²	71	59.8 Å²	59.8	33%	0.332	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-39	178.2	-64.4	96.9	133.8	0	0	112.6	F177 K182 R183 C188 I189	F177-E185 HydrophobicContact CB-CB 4.46Å; F177-E185 HydrophobicContact CD1-CB 4.05Å; F177-E185 HydrophobicContact CD2-CB 4.27Å; F177-E185 HydrophobicContact CE1-CB 4.35Å; F177-E185 HydrophobicContact CG-CB 4.01Å; K182-E185 HydrophobicContact CB-CB 4.44Å; K182-E185 WeakPolarHBondContact CB-OE2 3.42Å; K182-E185 WeakPolarHBondContact CD-OE1 3.45Å; K182-E185 PolarHBondContact O-N 3.02Å; R183-E185 VanDerWaalsContact C-N 3.34Å; R183-E185 PolarHBondContact O-N 3.25Å; E185-C188 PolarHBondContact O-N 3.04Å; E185-I189 WeakPolarHBondContact O-CD1 3.44Å; E185-I189 WeakPolarHBondContact O-CG1 3.44Å; E185-I189 PolarHBondContact O-N 3.29Å; E185-I189 VanDerWaalsContact O-N 3.11Å
186	A	93.7	Very high	92.3	Very high	4 Å²	4	61.6 Å²	61.6	3%	0.033	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-48.7	174	0	0	0	0	0	111.1	A174 F177 K182 R183 Y184 C188 I189 L190	A174-A186 HydrophobicContact CB-CB 4.23Å; A174-A186 WeakPolarHBondContact O-CB 3.45Å; F177-A186 HydrophobicContact CB-CB 3.96Å; K182-A186 PolarHBondContact O-N 2.69Å; R183-A186 WeakPolarHBondContact O-CB 3.41Å; R183-A186 PolarHBondContact O-N 2.89Å; R183-A186 VanDerWaalsContact O-N 3.15Å; Y184-A186 PolarHBondContact O-N 2.78Å; A186-C188 PolarHBondContact O-N 3.06Å; A186-I189 PolarHBondContact O-N 3.35Å; A186-L190 WeakPolarHBondContact O-CG 3.41Å; A186-L190 PolarHBondContact O-N 3.34Å
187	T	94.2	Very high	92.2	Very high	13 Å²	13	61 Å²	61	8%	0.08	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-41	177.5	-58.2	0	0	0	0	111.8	R183 Y184 I189 L190 N191 L211 E218	R183-T187 PolarHBondContact O-N 2.97Å; R183-T187 PolarHBondContact O-OG1 2.75Å; R183-T187 VanDerWaalsContact O-OG1 3.1Å; Y184-T187 PolarHBondContact O-N 3.2Å; T187-I189 PolarHBondContact O-N 2.93Å; T187-L190 PolarHBondContact O-N 3.45Å; T187-N191 WeakPolarHBondContact CG2-ND2 3.41Å; T187-N191 WeakPolarHBondContact O-CB 3.4Å; T187-N191 PolarHBondContact O-N 3.47Å; T187-N191 PolarHBondContact O-ND2 3.47Å; T187-L211 HydrophobicContact CG2-CD1 4.21Å; T187-E218 PolarHBondContact OG1-OE1 3.15Å
188	C	94.7	Very high	91.9	Very high	41 Å²	41	65.1 Å²	65.1	28%	0.277	30%	0.304	S	S	.	.	H	α-helix	trans	-60	-44.6	174.5	-73	0	0	0	0	112.3	Y184 E185 A186 N191 D192	Y184-C188 VanDerWaalsContact CE1-SG 3.54Å; Y184-C188 VanDerWaalsContact CZ-SG 3.57Å; Y184-C188 PolarHBondContact O-N 3.45Å; Y184-C188 PolarHBondContact O-SG 3.15Å; E185-C188 PolarHBondContact O-N 3.04Å; A186-C188 PolarHBondContact O-N 3.06Å; C188-N191 PolarHBondContact O-N 2.96Å; C188-D192 PolarHBondContact O-N 3.22Å
189	I	94.8	Very high	91.8	Very high	14 Å²	14	67.6 Å²	67.6	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-41.7	-179.2	-71.2	159.7	0	0	0	111.5	A170 L173 F177 E185 A186 T187 D192 A193	A170-I189 HydrophobicContact CB-CG2 3.85Å; A170-I189 WeakPolarHBondContact O-CG2 3.29Å; L173-I189 HydrophobicContact CB-CD1 4.47Å; L173-I189 HydrophobicContact CD2-CD1 3.61Å; L173-I189 HydrophobicContact CD2-CG1 4.39Å; L173-I189 HydrophobicContact CG-CD1 3.73Å; F177-I189 HydrophobicContact CD2-CD1 3.36Å; F177-I189 HydrophobicContact CE2-CD1 3.33Å; E185-I189 WeakPolarHBondContact O-CD1 3.44Å; E185-I189 WeakPolarHBondContact O-CG1 3.44Å; E185-I189 PolarHBondContact O-N 3.29Å; E185-I189 VanDerWaalsContact O-N 3.11Å; A186-I189 PolarHBondContact O-N 3.35Å; T187-I189 PolarHBondContact O-N 2.93Å; I189-D192 PolarHBondContact O-N 2.84Å; I189-A193 WeakPolarHBondContact O-CB 3.39Å; I189-A193 PolarHBondContact O-N 3.26Å
190	L	95.9	Very high	91.9	Very high	4 Å²	4	62 Å²	62	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-40.5	176.9	-66.7	173.5	0	0	0	111.4	A174 A186 T187 D192 A193 I194 I207 E210 L211 A214	A174-L190 HydrophobicContact CB-CD1 4.06Å; A174-L190 HydrophobicContact CB-CD2 3.77Å; A174-L190 HydrophobicContact CB-CG 3.71Å; A186-L190 WeakPolarHBondContact O-CG 3.41Å; A186-L190 PolarHBondContact O-N 3.34Å; T187-L190 PolarHBondContact O-N 3.45Å; L190-D192 VanDerWaalsContact C-N 3.32Å; L190-D192 PolarHBondContact O-N 3.28Å; L190-A193 PolarHBondContact O-N 3.32Å; L190-I194 PolarHBondContact O-N 2.97Å; L190-I207 HydrophobicContact CD2-CG2 4.34Å; L190-E210 HydrophobicContact CD1-CB 4.35Å; L190-E210 HydrophobicContact CD2-CB 4.26Å; L190-L211 HydrophobicContact CB-CB 4.43Å; L190-L211 HydrophobicContact CB-CD1 3.7Å; L190-L211 HydrophobicContact CD1-CB 4.41Å; L190-L211 HydrophobicContact CD1-CD1 4.27Å; L190-A214 HydrophobicContact CD1-CB 4.13Å
191	N	95.1	Very high	91.9	Very high	59 Å²	59	58.7 Å²	58.7	32%	0.316	29%	0.291	S	S	.	.	H	α-helix	trans	-64.2	-34.2	174.2	-82	-48.3	0	0	0	113	T187 C188 I194 R195	T187-N191 WeakPolarHBondContact CG2-ND2 3.41Å; T187-N191 WeakPolarHBondContact O-CB 3.4Å; T187-N191 PolarHBondContact O-N 3.47Å; T187-N191 PolarHBondContact O-ND2 3.47Å; C188-N191 PolarHBondContact O-N 2.96Å; N191-I194 VanDerWaalsContact O-CG2 3.26Å; N191-I194 WeakPolarHBondContact O-CG2 3.41Å; N191-R195 VanDerWaalsContact C-NH1 3.27Å; N191-R195 WeakPolarHBondContact O-CG 3.29Å; N191-R195 PolarHBondContact O-NH1 3.1Å
192	D	93.5	Very high	92.2	Very high	56 Å²	56	60 Å²	60	30%	0.299	29%	0.286	S	S	.	.	H	α-helix	trans	-68	-43.4	172.2	-72.6	-2.3	0	0	0	111.4	R152 C188 I189 L190 R195	R152-D192 IonicContact NH1-OD2 2.97Å; C188-D192 PolarHBondContact O-N 3.22Å; I189-D192 PolarHBondContact O-N 2.84Å; L190-D192 VanDerWaalsContact C-N 3.32Å; L190-D192 PolarHBondContact O-N 3.28Å; D192-R195 IonicContact OD1-CZ 2.63Å; D192-R195 IonicContact OD1-NH1 3.49Å; D192-R195 PolarHBondContact OD1-NH1 3.08Å; D192-R195 IonicContact OD1-NH2 2.87Å; D192-R195 PolarHBondContact OD1-NH2 3.24Å
193	A	93.3	Very high	92.3	Very high	6 Å²	6	56.7 Å²	56.7	5%	0.05	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-40.9	-178.5	0	0	0	0	0	112.1	F167 A170 I189 L190 R195 L196 S197 I207	F167-A193 HydrophobicContact CD1-CB 4.34Å; F167-A193 WeakPolarHBondContact CE1-O 3.43Å; A170-A193 HydrophobicContact CB-CB 3.9Å; I189-A193 WeakPolarHBondContact O-CB 3.39Å; I189-A193 PolarHBondContact O-N 3.26Å; L190-A193 PolarHBondContact O-N 3.32Å; A193-R195 VanDerWaalsContact C-N 3.31Å; A193-R195 PolarHBondContact O-N 2.98Å; A193-L196 PolarHBondContact O-N 3.44Å; A193-L196 VanDerWaalsContact O-N 3.13Å; A193-S197 WeakPolarHBondContact O-CB 3.47Å; A193-S197 PolarHBondContact O-N 3.3Å; A193-S197 VanDerWaalsContact O-N 3.1Å; A193-I207 HydrophobicContact CB-CD1 3.82Å; A193-I207 HydrophobicContact CB-CG2 4.46Å
194	I	93.4	Very high	92.5	Very high	20 Å²	20	53.5 Å²	53.5	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-40	-178.9	-167.1	69.8	0	0	0	111.4	L190 N191 L196 S197 H204 I207 L208	L190-I194 PolarHBondContact O-N 2.97Å; N191-I194 VanDerWaalsContact O-CG2 3.26Å; N191-I194 WeakPolarHBondContact O-CG2 3.41Å; I194-L196 PolarHBondContact O-N 2.86Å; I194-L196 VanDerWaalsContact O-N 3.16Å; I194-S197 WeakPolarHBondContact CA-OG 3.29Å; I194-S197 PolarHBondContact O-N 3.36Å; I194-S197 VanDerWaalsContact O-N 3.13Å; I194-S197 PolarHBondContact O-OG 3.13Å; I194-H204 WeakPolarHBondContact CD1-CE1 3.42Å; I194-H204 WeakPolarHBondContact CD1-ND1 3.12Å; I194-I207 HydrophobicContact CB-CG2 3.94Å; I194-I207 HydrophobicContact CD1-CB 4.25Å; I194-I207 HydrophobicContact CD1-CG2 3.99Å; I194-L208 HydrophobicContact CD1-CD1 4.5Å; I194-L208 HydrophobicContact CD1-CD2 3.53Å; I194-L208 HydrophobicContact CD1-CG 3.63Å; I194-L208 HydrophobicContact CG1-CD2 4.06Å
195	R	91.7	Very high	92.7	Very high	167 Å²	167	45.2 Å²	45.2	63%	0.63	23%	0.227	S	C	*	.	H	α-helix	trans	-60.2	-27.5	178.2	-68.2	-169.7	-56.2	-92.2	11.7	113.5	N191 D192 A193	N191-R195 VanDerWaalsContact C-NH1 3.27Å; N191-R195 WeakPolarHBondContact O-CG 3.29Å; N191-R195 PolarHBondContact O-NH1 3.1Å; D192-R195 IonicContact OD1-CZ 2.63Å; D192-R195 IonicContact OD1-NH1 3.49Å; D192-R195 PolarHBondContact OD1-NH1 3.08Å; D192-R195 IonicContact OD1-NH2 2.87Å; D192-R195 PolarHBondContact OD1-NH2 3.24Å; A193-R195 VanDerWaalsContact C-N 3.31Å; A193-R195 PolarHBondContact O-N 2.98Å
196	L	89.8	Confident	92.8	Very high	107 Å²	107	45.5 Å²	45.5	56%	0.56	23%	0.226	S	C	*	.	H	α-helix	trans	-96.4	-16	-179.4	-60.4	176.5	0	0	0	113.3	F167 A193 I194 N198	F167-L196 HydrophobicContact CE1-CB 4.07Å; F167-L196 HydrophobicContact CZ-CB 4.34Å; A193-L196 PolarHBondContact O-N 3.44Å; A193-L196 VanDerWaalsContact O-N 3.13Å; I194-L196 PolarHBondContact O-N 2.86Å; I194-L196 VanDerWaalsContact O-N 3.16Å; L196-N198 PolarHBondContact O-N 3.48Å
197	S	91.6	Very high	93	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-84.3	-3.8	-168.4	66.4	0	0	0	0	115.9	F167 A193 I194 N199 S200 H204	F167-S197 VanDerWaalsContact CZ-CA 3.41Å; A193-S197 WeakPolarHBondContact O-CB 3.47Å; A193-S197 PolarHBondContact O-N 3.3Å; A193-S197 VanDerWaalsContact O-N 3.1Å; I194-S197 WeakPolarHBondContact CA-OG 3.29Å; I194-S197 PolarHBondContact O-N 3.36Å; I194-S197 VanDerWaalsContact O-N 3.13Å; I194-S197 PolarHBondContact O-OG 3.13Å; S197-N199 PolarHBondContact O-N 2.81Å; S197-S200 CarbonylContact O-C 3.58Å; S197-S200 PolarHBondContact O-N 3.14Å; S197-H204 PolarHBondContact OG-ND1 3.23Å
198	N	87.6	Confident	93.1	Very high	96 Å²	96	44.7 Å²	44.7	51%	0.513	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-55.8	-29.9	-172.2	-164	41.6	0	0	0	114.3	L196 S200 Y234	L196-N198 PolarHBondContact O-N 3.48Å; N198-S200 VanDerWaalsContact C-N 3.34Å; N198-Y234 PolarHBondContact O-OH 2.86Å; N198-Y234 WeakPolarHBondContact OD1-CE2 3.4Å
199	N	87.3	Confident	93.2	Very high	143 Å²	143	45 Å²	45	77%	0.765	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-88.3	2.7	178.8	-64.3	-20.1	0	0	0	113.7	S197	S197-N199 PolarHBondContact O-N 2.81Å
200	S	89.8	Confident	93.2	Very high	21 Å²	21	46 Å²	46	15%	0.147	22%	0.223	C	C	.	.			trans	-127.1	82.9	-178.8	-63.4	0	0	0	0	109.6	S197 N198 Y202 W203 H204	S197-S200 CarbonylContact O-C 3.58Å; S197-S200 PolarHBondContact O-N 3.14Å; N198-S200 VanDerWaalsContact C-N 3.34Å; S200-Y202 VanDerWaalsContact C-N 3.34Å; S200-Y202 PolarHBondContact O-N 2.95Å; S200-W203 PolarHBondContact O-N 3.18Å; S200-H204 PolarHBondContact O-N 3.27Å
201	P	90.9	Very high	93.2	Very high	28 Å²	28	46 Å²	46	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-41.9	-167.1	-28	35.5	0	0	0	114.7	H204 C205 Y234 I337	P201-H204 PolarHBondContact O-N 2.82Å; P201-C205 PolarHBondContact O-N 2.79Å; P201-C205 VanDerWaalsContact O-N 3.08Å; P201-C205 PolarHBondContact O-SG 3.37Å; P201-Y234 WeakPolarHBondContact CA-OH 3.27Å; P201-Y234 HydrophobicContact CB-CE1 4.1Å; P201-I337 HydrophobicContact CB-CB 4.45Å; P201-I337 HydrophobicContact CB-CD1 4.3Å; P201-I337 HydrophobicContact CB-CG1 4.49Å
202	Y	92.4	Very high	93.2	Very high	57 Å²	57	43.4 Å²	43.4	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-51.6	175	171.6	-99.3	0	0	0	112	S200 H204 C205 R206 E336 R339 F340	S200-Y202 VanDerWaalsContact C-N 3.34Å; S200-Y202 PolarHBondContact O-N 2.95Å; Y202-H204 VanDerWaalsContact C-N 3.34Å; Y202-H204 PolarHBondContact O-N 3.21Å; Y202-C205 PolarHBondContact O-N 2.75Å; Y202-R206 WeakPolarHBondContact O-CB 3.49Å; Y202-R206 PolarHBondContact O-N 3.12Å; Y202-E336 WeakPolarHBondContact CD2-O 3.33Å; Y202-R339 HydrophobicContact CD2-CB 4.38Å; Y202-R339 HydrophobicContact CE2-CB 4.2Å; Y202-F340 HydrophobicContact CD2-CE1 4.32Å; Y202-F340 AromaticContact CD2-CE2 3.78Å; Y202-F340 HydrophobicContact CD2-CE2 3.78Å; Y202-F340 AromaticContact CD2-CZ 3.57Å; Y202-F340 HydrophobicContact CD2-CZ 3.57Å; Y202-F340 AromaticContact CE2-CE1 3.9Å; Y202-F340 HydrophobicContact CE2-CE1 3.9Å; Y202-F340 HydrophobicContact CE2-CE2 4.12Å; Y202-F340 AromaticContact CE2-CZ 3.62Å; Y202-F340 HydrophobicContact CE2-CZ 3.62Å; Y202-F340 HydrophobicContact CG-CZ 4.36Å; Y202-F340 WeakPolarHBondContact O-CZ 3.3Å
203	W	93.2	Very high	93.3	Very high	29 Å²	29	46.3 Å²	46.3	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-67.7	-35.7	-179.1	-75.5	105.9	0	0	0	112.4	S164 F167 E168 T171 S200 R206 I207	S164-W203 VanDerWaalsContact CB-NE1 3.26Å; F167-W203 HydrophobicContact CB-CB 4.08Å; F167-W203 HydrophobicContact CB-CD2 3.57Å; F167-W203 HydrophobicContact CB-CE3 3.51Å; F167-W203 HydrophobicContact CB-CG 3.83Å; F167-W203 HydrophobicContact CB-CZ3 4.15Å; F167-W203 HydrophobicContact CD2-CB 3.71Å; F167-W203 AromaticContact CD2-CD1 3.99Å; F167-W203 HydrophobicContact CD2-CD2 4.34Å; F167-W203 AromaticContact CD2-CG 3.72Å; F167-W203 HydrophobicContact CD2-CG 3.72Å; F167-W203 HydrophobicContact CE2-CB 4.38Å; F167-W203 HydrophobicContact CG-CB 3.96Å; F167-W203 HydrophobicContact CG-CD2 4.34Å; F167-W203 HydrophobicContact CG-CG 4.07Å; E168-W203 HydrophobicContact CB-CH2 3.56Å; E168-W203 HydrophobicContact CB-CZ2 3.97Å; E168-W203 HydrophobicContact CB-CZ3 4.33Å; E168-W203 HydrophobicContact CG-CH2 3.94Å; E168-W203 HydrophobicContact CG-CZ2 4.49Å; T171-W203 HydrophobicContact CG2-CE3 4.45Å; T171-W203 HydrophobicContact CG2-CZ3 4.07Å; S200-W203 PolarHBondContact O-N 3.18Å; W203-R206 PolarHBondContact O-N 2.89Å; W203-I207 WeakPolarHBondContact O-CB 3.42Å; W203-I207 WeakPolarHBondContact O-CD1 3.25Å; W203-I207 WeakPolarHBondContact O-CG1 3.49Å; W203-I207 PolarHBondContact O-N 3.4Å
204	H	95	Very high	93.2	Very high	14 Å²	14	46.4 Å²	46.4	7%	0.065	22%	0.222	C	C	.	.	H	α-helix	trans	-56.7	-53.7	173.9	-165.7	79.3	0	0	0	110.8	I194 S197 S200 P201 Y202 R206 I207 L208 Y234	I194-H204 WeakPolarHBondContact CD1-CE1 3.42Å; I194-H204 WeakPolarHBondContact CD1-ND1 3.12Å; S197-H204 PolarHBondContact OG-ND1 3.23Å; S200-H204 PolarHBondContact O-N 3.27Å; P201-H204 PolarHBondContact O-N 2.82Å; Y202-H204 VanDerWaalsContact C-N 3.34Å; Y202-H204 PolarHBondContact O-N 3.21Å; H204-R206 PolarHBondContact O-N 3.34Å; H204-I207 PolarHBondContact O-N 2.93Å; H204-L208 VanDerWaalsContact O-CG 3.31Å; H204-L208 WeakPolarHBondContact O-CG 3.33Å; H204-L208 PolarHBondContact O-N 3.39Å; H204-Y234 HydrophobicContact CB-CE1 3.85Å; H204-Y234 AromaticContact CD2-CD1 3.51Å; H204-Y234 AromaticContact CD2-CD2 3.43Å; H204-Y234 VanDerWaalsContact CD2-CD2 3.43Å; H204-Y234 WeakPolarHBondContact CD2-CD2 3.39Å; H204-Y234 AromaticContact CD2-CE1 3.53Å; H204-Y234 AromaticContact CD2-CE2 3.47Å; H204-Y234 VanDerWaalsContact CD2-CE2 3.47Å; H204-Y234 WeakPolarHBondContact CD2-CE2 3.47Å; H204-Y234 AromaticContact CD2-CG 3.44Å; H204-Y234 VanDerWaalsContact CD2-CG 3.44Å; H204-Y234 AromaticContact CD2-CZ 3.51Å; H204-Y234 AromaticContact CG-CE1 3.9Å; H204-Y234 AromaticContact CG-CE2 3.91Å; H204-Y234 AromaticContact CG-CZ 3.67Å; H204-Y234 AromaticContact NE2-CD2 3.55Å; H204-Y234 AromaticContact NE2-CE2 3.77Å; H204-Y234 AromaticContact NE2-CG 3.87Å
205	C	95.8	Very high	93.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-41.6	177.6	-69.6	0	0	0	0	112.8	P201 Y202 L208 L209 F247 F340	P201-C205 PolarHBondContact O-N 2.79Å; P201-C205 VanDerWaalsContact O-N 3.08Å; P201-C205 PolarHBondContact O-SG 3.37Å; Y202-C205 PolarHBondContact O-N 2.75Å; C205-L208 PolarHBondContact O-N 3.41Å; C205-L209 WeakPolarHBondContact O-CG 3.46Å; C205-L209 PolarHBondContact O-N 3.48Å; C205-L209 VanDerWaalsContact O-N 3.09Å; C205-F247 HydrophobicContact CB-CE2 3.94Å; C205-F247 HydrophobicContact CB-CZ 3.95Å; C205-F340 HydrophobicContact CB-CE2 3.69Å; C205-F340 HydrophobicContact CB-CZ 3.83Å
206	R	95.6	Very high	93.1	Very high	77 Å²	77	41.9 Å²	41.9	29%	0.291	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-47	177.7	-177.8	175.4	172.7	165.6	6.3	112	Y202 W203 H204 L208 L209 E210 F340	Y202-R206 WeakPolarHBondContact O-CB 3.49Å; Y202-R206 PolarHBondContact O-N 3.12Å; W203-R206 PolarHBondContact O-N 2.89Å; H204-R206 PolarHBondContact O-N 3.34Å; R206-L208 VanDerWaalsContact C-N 3.31Å; R206-L208 PolarHBondContact O-N 3.37Å; R206-L209 PolarHBondContact O-N 3.35Å; R206-E210 IonicContact CZ-OE1 2.65Å; R206-E210 IonicContact NE-OE1 3.65Å; R206-E210 PolarHBondContact NE-OE1 3.03Å; R206-E210 IonicContact NH2-OE1 3.64Å; R206-E210 PolarHBondContact O-N 3.01Å; R206-F340 HydrophobicContact CB-CE1 3.92Å; R206-F340 HydrophobicContact CB-CZ 3.98Å
207	I	96.3	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-37.9	179.3	-67.9	161.2	0	0	0	110.5	F167 T171 L190 A193 I194 W203 H204 L209 E210 L211	F167-I207 HydrophobicContact CB-CD1 4.26Å; F167-I207 HydrophobicContact CD1-CD1 3.68Å; F167-I207 HydrophobicContact CE1-CD1 4.39Å; F167-I207 HydrophobicContact CG-CD1 4.16Å; T171-I207 HydrophobicContact CG2-CG1 4.2Å; L190-I207 HydrophobicContact CD2-CG2 4.34Å; A193-I207 HydrophobicContact CB-CD1 3.82Å; A193-I207 HydrophobicContact CB-CG2 4.46Å; I194-I207 HydrophobicContact CB-CG2 3.94Å; I194-I207 HydrophobicContact CD1-CB 4.25Å; I194-I207 HydrophobicContact CD1-CG2 3.99Å; W203-I207 WeakPolarHBondContact O-CB 3.42Å; W203-I207 WeakPolarHBondContact O-CD1 3.25Å; W203-I207 WeakPolarHBondContact O-CG1 3.49Å; W203-I207 PolarHBondContact O-N 3.4Å; H204-I207 PolarHBondContact O-N 2.93Å; I207-L209 PolarHBondContact O-N 3.01Å; I207-E210 PolarHBondContact O-N 2.78Å; I207-L211 WeakPolarHBondContact O-CB 3.39Å; I207-L211 PolarHBondContact O-N 3.07Å
208	L	97.2	Very high	92.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-42.5	174.6	-69.9	173.3	0	0	0	112.3	I194 H204 C205 R206 L211 A212 I227 M230 G231 F247	I194-L208 HydrophobicContact CD1-CD1 4.5Å; I194-L208 HydrophobicContact CD1-CD2 3.53Å; I194-L208 HydrophobicContact CD1-CG 3.63Å; I194-L208 HydrophobicContact CG1-CD2 4.06Å; H204-L208 VanDerWaalsContact O-CG 3.31Å; H204-L208 WeakPolarHBondContact O-CG 3.33Å; H204-L208 PolarHBondContact O-N 3.39Å; C205-L208 PolarHBondContact O-N 3.41Å; R206-L208 VanDerWaalsContact C-N 3.31Å; R206-L208 PolarHBondContact O-N 3.37Å; L208-L211 PolarHBondContact O-N 3.09Å; L208-A212 WeakPolarHBondContact O-CB 3.45Å; L208-A212 PolarHBondContact O-N 3.31Å; L208-I227 HydrophobicContact CB-CG2 4.19Å; L208-I227 HydrophobicContact CD2-CG2 3.93Å; L208-I227 WeakPolarHBondContact O-CG2 3.44Å; L208-M230 HydrophobicContact CD2-CE 3.3Å; L208-G231 VanDerWaalsContact CD1-CA 3.47Å; L208-F247 HydrophobicContact CB-CE1 4.08Å; L208-F247 HydrophobicContact CB-CZ 4.17Å; L208-F247 HydrophobicContact CD1-CZ 4.47Å
209	L	96.3	Very high	92.7	Very high	46 Å²	46	45.3 Å²	45.3	24%	0.241	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-44	176.6	-69.4	168.4	0	0	0	111.7	C205 R206 I207 A212 Q213 L228 F247 F340	C205-L209 WeakPolarHBondContact O-CG 3.46Å; C205-L209 PolarHBondContact O-N 3.48Å; C205-L209 VanDerWaalsContact O-N 3.09Å; R206-L209 PolarHBondContact O-N 3.35Å; I207-L209 PolarHBondContact O-N 3.01Å; L209-A212 PolarHBondContact O-N 3.25Å; L209-Q213 WeakPolarHBondContact O-CG 3.3Å; L209-Q213 PolarHBondContact O-N 3.3Å; L209-L228 HydrophobicContact CD2-CD2 3.93Å; L209-F247 HydrophobicContact CD1-CZ 4.46Å; L209-F247 HydrophobicContact CD2-CD1 3.98Å; L209-F247 HydrophobicContact CD2-CE1 3.55Å; L209-F247 HydrophobicContact CD2-CZ 4.15Å; L209-F247 HydrophobicContact CG-CE1 3.73Å; L209-F247 HydrophobicContact CG-CZ 3.92Å; L209-F340 HydrophobicContact CD1-CD1 4.14Å; L209-F340 HydrophobicContact CD1-CE1 4.27Å
210	E	95.3	Very high	92.9	Very high	37 Å²	37	41.3 Å²	41.3	17%	0.173	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-38.6	176.8	-69.8	179.4	-162.8	0	0	111.9	T171 L190 R206 I207 Q213 A214	T171-E210 WeakPolarHBondContact CA-OE2 3.44Å; T171-E210 WeakPolarHBondContact CB-OE2 3.44Å; T171-E210 WeakPolarHBondContact CG2-OE2 3.49Å; L190-E210 HydrophobicContact CD1-CB 4.35Å; L190-E210 HydrophobicContact CD2-CB 4.26Å; R206-E210 IonicContact CZ-OE1 2.65Å; R206-E210 IonicContact NE-OE1 3.65Å; R206-E210 PolarHBondContact NE-OE1 3.03Å; R206-E210 IonicContact NH2-OE1 3.64Å; R206-E210 PolarHBondContact O-N 3.01Å; I207-E210 PolarHBondContact O-N 2.78Å; E210-Q213 WeakPolarHBondContact O-CB 3.48Å; E210-Q213 PolarHBondContact O-N 3Å; E210-A214 PolarHBondContact O-N 3.17Å
211	L	96	Very high	93.1	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-42.2	175.6	-173.1	67.5	0	0	0	110.9	T187 L190 I207 L208 Q213 A214 H215 I227	T187-L211 HydrophobicContact CG2-CD1 4.21Å; L190-L211 HydrophobicContact CB-CB 4.43Å; L190-L211 HydrophobicContact CB-CD1 3.7Å; L190-L211 HydrophobicContact CD1-CB 4.41Å; L190-L211 HydrophobicContact CD1-CD1 4.27Å; I207-L211 WeakPolarHBondContact O-CB 3.39Å; I207-L211 PolarHBondContact O-N 3.07Å; L208-L211 PolarHBondContact O-N 3.09Å; L211-Q213 VanDerWaalsContact C-N 3.29Å; L211-Q213 PolarHBondContact O-N 2.86Å; L211-A214 WeakPolarHBondContact O-CB 3.47Å; L211-A214 PolarHBondContact O-N 3.17Å; L211-A214 VanDerWaalsContact O-N 3.17Å; L211-H215 PolarHBondContact O-CD2 2.83Å; L211-H215 VanDerWaalsContact O-CD2 3.27Å; L211-H215 PolarHBondContact O-N 2.98Å; L211-I227 HydrophobicContact CB-CG2 4.45Å; L211-I227 HydrophobicContact CD2-CD1 3.86Å; L211-I227 HydrophobicContact CD2-CG1 4.23Å; L211-I227 HydrophobicContact CD2-CG2 4.43Å; L211-I227 HydrophobicContact CG-CD1 3.75Å
212	A	96.2	Very high	93.2	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-40.6	173	0	0	0	0	0	111.6	L208 L209 H215 I216 A224 I227 L228	L208-A212 WeakPolarHBondContact O-CB 3.45Å; L208-A212 PolarHBondContact O-N 3.31Å; L209-A212 PolarHBondContact O-N 3.25Å; A212-H215 PolarHBondContact O-N 3.12Å; A212-I216 WeakPolarHBondContact O-CD1 3.35Å; A212-I216 VanDerWaalsContact O-CG1 3.24Å; A212-I216 WeakPolarHBondContact O-CG1 3.2Å; A212-I216 PolarHBondContact O-N 3.46Å; A212-A224 HydrophobicContact CB-CB 4.47Å; A212-I227 HydrophobicContact CB-CB 4.42Å; A212-I227 HydrophobicContact CB-CG2 4.06Å; A212-L228 HydrophobicContact CB-CD1 4.49Å; A212-L228 HydrophobicContact CB-CD2 3.89Å; A212-L228 HydrophobicContact CB-CG 3.93Å
213	Q	93.9	Very high	93.4	Very high	117 Å²	117	44.3 Å²	44.3	55%	0.547	22%	0.216	S	C	.	.	H	α-helix	trans	-61.9	-42.4	173.5	-71.9	173.4	-4.6	0	0	112.6	L209 E210 L211 H215 I216 A217	L209-Q213 WeakPolarHBondContact O-CG 3.3Å; L209-Q213 PolarHBondContact O-N 3.3Å; E210-Q213 WeakPolarHBondContact O-CB 3.48Å; E210-Q213 PolarHBondContact O-N 3Å; L211-Q213 VanDerWaalsContact C-N 3.29Å; L211-Q213 PolarHBondContact O-N 2.86Å; Q213-H215 PolarHBondContact O-N 3.42Å; Q213-I216 PolarHBondContact O-N 3.36Å; Q213-A217 PolarHBondContact O-N 2.95Å
214	A	92.5	Very high	93.5	Very high	8 Å²	8	42.9 Å²	42.9	7%	0.066	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-44.7	176.1	0	0	0	0	0	112.1	L190 E210 L211 I216 A217 E218	L190-A214 HydrophobicContact CD1-CB 4.13Å; E210-A214 PolarHBondContact O-N 3.17Å; L211-A214 WeakPolarHBondContact O-CB 3.47Å; L211-A214 PolarHBondContact O-N 3.17Å; L211-A214 VanDerWaalsContact O-N 3.17Å; A214-I216 PolarHBondContact O-N 3.01Å; A214-A217 WeakPolarHBondContact O-CB 3.32Å; A214-A217 PolarHBondContact O-N 3.34Å; A214-A217 VanDerWaalsContact O-N 3.13Å; A214-E218 PolarHBondContact O-N 3.04Å; A214-E218 VanDerWaalsContact O-N 3.1Å
215	H	92.5	Very high	93.6	Very high	26 Å²	26	42.7 Å²	42.7	12%	0.12	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-38	175.8	-82.1	-82.6	0	0	0	112.8	L211 A212 Q213 A217 E218 R219 D220 A224 I227	L211-H215 PolarHBondContact O-CD2 2.83Å; L211-H215 VanDerWaalsContact O-CD2 3.27Å; L211-H215 PolarHBondContact O-N 2.98Å; A212-H215 PolarHBondContact O-N 3.12Å; Q213-H215 PolarHBondContact O-N 3.42Å; H215-A217 VanDerWaalsContact C-N 3.3Å; H215-A217 PolarHBondContact O-N 3.34Å; H215-E218 CarbonylContact O-C 3.46Å; H215-E218 WeakPolarHBondContact O-CA 3.44Å; H215-E218 PolarHBondContact O-N 3.32Å; H215-E218 VanDerWaalsContact O-N 3.12Å; H215-R219 PolarHBondContact O-N 3.44Å; H215-R219 VanDerWaalsContact O-N 3.16Å; H215-D220 PolarHBondContact O-N 2.89Å; H215-A224 HydrophobicContact CB-CB 3.97Å; H215-I227 WeakPolarHBondContact CD2-CD1 3.3Å
216	I	90.9	Very high	93.6	Very high	66 Å²	66	49 Å²	49	34%	0.338	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-39.6	172.9	-64.1	158	0	0	0	111	A212 Q213 A214 E218 R219 A224 L254	A212-I216 WeakPolarHBondContact O-CD1 3.35Å; A212-I216 VanDerWaalsContact O-CG1 3.24Å; A212-I216 WeakPolarHBondContact O-CG1 3.2Å; A212-I216 PolarHBondContact O-N 3.46Å; Q213-I216 PolarHBondContact O-N 3.36Å; A214-I216 PolarHBondContact O-N 3.01Å; I216-E218 PolarHBondContact O-N 3.47Å; I216-R219 WeakPolarHBondContact O-CA 3.45Å; I216-R219 PolarHBondContact O-N 2.8Å; I216-A224 HydrophobicContact CG1-CB 3.83Å; I216-L254 HydrophobicContact CD1-CD1 3.58Å; I216-L254 HydrophobicContact CD1-CD2 3.31Å; I216-L254 HydrophobicContact CD1-CG 4.07Å; I216-L254 HydrophobicContact CG1-CD1 4.02Å; I216-L254 HydrophobicContact CG1-CD2 4.08Å
217	A	87.2	Confident	93.7	Very high	28 Å²	28	45.9 Å²	45.9	23%	0.231	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-28.1	176.4	0	0	0	0	0	112.2	R183 Q213 A214 H215 R219	R183-A217 PolarHBondContact NE-O 3.33Å; R183-A217 VanDerWaalsContact NE-O 3.07Å; Q213-A217 PolarHBondContact O-N 2.95Å; A214-A217 WeakPolarHBondContact O-CB 3.32Å; A214-A217 PolarHBondContact O-N 3.34Å; A214-A217 VanDerWaalsContact O-N 3.13Å; H215-A217 VanDerWaalsContact C-N 3.3Å; H215-A217 PolarHBondContact O-N 3.34Å; A217-R219 VanDerWaalsContact C-N 3.29Å
218	E	86.9	Confident	93.8	Very high	79 Å²	79	46.1 Å²	46.1	37%	0.369	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	0.3	170.4	-66	-177.9	-176.7	0	0	113.7	R183 T187 A214 H215 I216 D220	R183-E218 HydrophobicContact CB-CG 4.02Å; T187-E218 PolarHBondContact OG1-OE1 3.15Å; A214-E218 PolarHBondContact O-N 3.04Å; A214-E218 VanDerWaalsContact O-N 3.1Å; H215-E218 CarbonylContact O-C 3.46Å; H215-E218 WeakPolarHBondContact O-CA 3.44Å; H215-E218 PolarHBondContact O-N 3.32Å; H215-E218 VanDerWaalsContact O-N 3.12Å; I216-E218 PolarHBondContact O-N 3.47Å; E218-D220 PolarHBondContact O-N 3.42Å
219	R	86.1	Confident	93.8	Very high	169 Å²	169	48 Å²	48	64%	0.638	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	19.6	-175.1	-53.6	-175.2	177.2	-133.1	-0.4	114.7	H215 I216 A217 V221 Q473	H215-R219 PolarHBondContact O-N 3.44Å; H215-R219 VanDerWaalsContact O-N 3.16Å; I216-R219 WeakPolarHBondContact O-CA 3.45Å; I216-R219 PolarHBondContact O-N 2.8Å; A217-R219 VanDerWaalsContact C-N 3.29Å; R219-V221 PolarHBondContact O-N 2.99Å; R219-Q473 VanDerWaalsContact NH2-CB 3.34Å
220	D	91.7	Very high	93.8	Very high	58 Å²	58	50.2 Å²	50.2	31%	0.31	26%	0.256	S	S	.	.			trans	-93.3	85.7	174	-168.2	-13	0	0	0	110.9	H215 E218 N222 S223 A224	H215-D220 PolarHBondContact O-N 2.89Å; E218-D220 PolarHBondContact O-N 3.42Å; D220-N222 VanDerWaalsContact C-N 3.33Å; D220-N222 PolarHBondContact OD1-N 3.33Å; D220-S223 PolarHBondContact OD1-N 3.34Å; D220-S223 WeakPolarHBondContact OD2-CB 3.43Å; D220-S223 PolarHBondContact OD2-OG 2.89Å; D220-S223 VanDerWaalsContact OD2-OG 3.09Å; D220-A224 WeakPolarHBondContact O-CB 3.35Å; D220-A224 PolarHBondContact O-N 3.32Å
221	V	92.4	Very high	93.9	Very high	41 Å²	41	48.4 Å²	48.4	25%	0.248	25%	0.247	C	C	.	.	H	α-helix	trans	-70.1	-32.2	-179.1	-178.9	0	0	0	0	111.7	R219 A224 C225	R219-V221 PolarHBondContact O-N 2.99Å; V221-A224 PolarHBondContact O-N 2.74Å; V221-C225 WeakPolarHBondContact O-CB 3.37Å; V221-C225 PolarHBondContact O-N 2.7Å; V221-C225 PolarHBondContact O-SG 3.28Å
222	N	94.8	Very high	93.9	Very high	96 Å²	96	49 Å²	49	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-70.9	-49.2	-174.9	-66.4	-22	0	0	0	110.2	D220 A224 C225 E226	D220-N222 VanDerWaalsContact C-N 3.33Å; D220-N222 PolarHBondContact OD1-N 3.33Å; N222-A224 VanDerWaalsContact C-N 3.32Å; N222-A224 PolarHBondContact O-N 3.48Å; N222-C225 WeakPolarHBondContact O-CB 3.48Å; N222-C225 PolarHBondContact O-N 3.19Å; N222-C225 VanDerWaalsContact O-N 3.09Å; N222-E226 WeakPolarHBondContact O-CG 3.28Å; N222-E226 PolarHBondContact O-N 3.23Å
223	S	95.2	Very high	94	Very high	32 Å²	32	52.5 Å²	52.5	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-36.6	175.1	-67.7	0	0	0	0	112.4	D220 C225 E226 I227	D220-S223 PolarHBondContact OD1-N 3.34Å; D220-S223 WeakPolarHBondContact OD2-CB 3.43Å; D220-S223 PolarHBondContact OD2-OG 2.89Å; D220-S223 VanDerWaalsContact OD2-OG 3.09Å; S223-C225 VanDerWaalsContact C-N 3.3Å; S223-C225 PolarHBondContact O-N 3.16Å; S223-E226 PolarHBondContact O-N 3.21Å; S223-I227 WeakPolarHBondContact O-CD1 3.42Å; S223-I227 VanDerWaalsContact O-CG1 3.31Å; S223-I227 WeakPolarHBondContact O-CG1 3.36Å; S223-I227 PolarHBondContact O-N 3.03Å
224	A	96.5	Very high	94.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-40.8	172.3	0	0	0	0	0	112.1	A212 H215 I216 D220 V221 N222 I227 L228 L254	A212-A224 HydrophobicContact CB-CB 4.47Å; H215-A224 HydrophobicContact CB-CB 3.97Å; I216-A224 HydrophobicContact CG1-CB 3.83Å; D220-A224 WeakPolarHBondContact O-CB 3.35Å; D220-A224 PolarHBondContact O-N 3.32Å; V221-A224 PolarHBondContact O-N 2.74Å; N222-A224 VanDerWaalsContact C-N 3.32Å; N222-A224 PolarHBondContact O-N 3.48Å; A224-I227 PolarHBondContact O-N 3.2Å; A224-L228 VanDerWaalsContact O-CG 3.31Å; A224-L228 WeakPolarHBondContact O-CG 3.39Å; A224-L228 PolarHBondContact O-N 3.26Å; A224-L228 VanDerWaalsContact O-N 3.08Å; A224-L254 HydrophobicContact CB-CD1 3.98Å
225	C	96.6	Very high	94.2	Very high	9 Å²	9	47.3 Å²	47.3	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-36	176.5	-73.3	0	0	0	0	113.1	V221 N222 S223 A229 K251	V221-C225 WeakPolarHBondContact O-CB 3.37Å; V221-C225 PolarHBondContact O-N 2.7Å; V221-C225 PolarHBondContact O-SG 3.28Å; N222-C225 WeakPolarHBondContact O-CB 3.48Å; N222-C225 PolarHBondContact O-N 3.19Å; N222-C225 VanDerWaalsContact O-N 3.09Å; S223-C225 VanDerWaalsContact C-N 3.3Å; S223-C225 PolarHBondContact O-N 3.16Å; C225-A229 WeakPolarHBondContact O-CB 3.31Å; C225-A229 PolarHBondContact O-N 2.97Å; C225-K251 HydrophobicContact CB-CG 4.26Å
226	E	96.6	Very high	94.3	Very high	132 Å²	132	52.1 Å²	52.1	62%	0.617	26%	0.258	S	S	*	.	H	α-helix	trans	-65	-43.8	174	-70.3	173.3	178	0	0	111.6	N222 S223 L228 A229 M230	N222-E226 WeakPolarHBondContact O-CG 3.28Å; N222-E226 PolarHBondContact O-N 3.23Å; S223-E226 PolarHBondContact O-N 3.21Å; E226-L228 VanDerWaalsContact C-N 3.34Å; E226-L228 PolarHBondContact O-N 3.33Å; E226-A229 WeakPolarHBondContact O-CB 3.48Å; E226-A229 PolarHBondContact O-N 2.93Å; E226-M230 PolarHBondContact O-N 2.87Å
227	I	97.3	Very high	94.4	Very high	13 Å²	13	54.3 Å²	54.3	7%	0.067	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-42.8	176.6	-69	159.2	0	0	0	111.1	L208 L211 A212 H215 S223 A224 A229 M230 G231	L208-I227 HydrophobicContact CB-CG2 4.19Å; L208-I227 HydrophobicContact CD2-CG2 3.93Å; L208-I227 WeakPolarHBondContact O-CG2 3.44Å; L211-I227 HydrophobicContact CB-CG2 4.45Å; L211-I227 HydrophobicContact CD2-CD1 3.86Å; L211-I227 HydrophobicContact CD2-CG1 4.23Å; L211-I227 HydrophobicContact CD2-CG2 4.43Å; L211-I227 HydrophobicContact CG-CD1 3.75Å; A212-I227 HydrophobicContact CB-CB 4.42Å; A212-I227 HydrophobicContact CB-CG2 4.06Å; H215-I227 WeakPolarHBondContact CD2-CD1 3.3Å; S223-I227 WeakPolarHBondContact O-CD1 3.42Å; S223-I227 VanDerWaalsContact O-CG1 3.31Å; S223-I227 WeakPolarHBondContact O-CG1 3.36Å; S223-I227 PolarHBondContact O-N 3.03Å; A224-I227 PolarHBondContact O-N 3.2Å; I227-A229 VanDerWaalsContact C-N 3.33Å; I227-A229 PolarHBondContact O-N 2.83Å; I227-M230 WeakPolarHBondContact O-CB 3.49Å; I227-M230 PolarHBondContact O-N 3.33Å; I227-G231 PolarHBondContact O-N 3.49Å
228	L	97.6	Very high	94.7	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-35	176.6	-66.9	172.9	0	0	0	112.1	L209 A212 A224 E226 G231 S232 F247 K251 L254	L209-L228 HydrophobicContact CD2-CD2 3.93Å; A212-L228 HydrophobicContact CB-CD1 4.49Å; A212-L228 HydrophobicContact CB-CD2 3.89Å; A212-L228 HydrophobicContact CB-CG 3.93Å; A224-L228 VanDerWaalsContact O-CG 3.31Å; A224-L228 WeakPolarHBondContact O-CG 3.39Å; A224-L228 PolarHBondContact O-N 3.26Å; A224-L228 VanDerWaalsContact O-N 3.08Å; E226-L228 VanDerWaalsContact C-N 3.34Å; E226-L228 PolarHBondContact O-N 3.33Å; L228-G231 PolarHBondContact O-N 3.47Å; L228-S232 PolarHBondContact O-N 3.41Å; L228-F247 HydrophobicContact CB-CD1 4.44Å; L228-F247 HydrophobicContact CD2-CD1 3.7Å; L228-F247 HydrophobicContact CD2-CE1 4.09Å; L228-K251 HydrophobicContact CB-CB 4.02Å; L228-K251 HydrophobicContact CD1-CB 4.06Å; L228-L254 HydrophobicContact CD1-CD1 3.48Å; L228-L254 VanDerWaalsContact CD1-CD1 3.48Å; L228-L254 HydrophobicContact CD1-CG 4.22Å
229	A	97.2	Very high	94.9	Very high	39 Å²	39	59.3 Å²	59.3	32%	0.322	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-40.3	173	0	0	0	0	0	111.9	C225 E226 I227 G231 S232 E233	C225-A229 WeakPolarHBondContact O-CB 3.31Å; C225-A229 PolarHBondContact O-N 2.97Å; E226-A229 WeakPolarHBondContact O-CB 3.48Å; E226-A229 PolarHBondContact O-N 2.93Å; I227-A229 VanDerWaalsContact C-N 3.33Å; I227-A229 PolarHBondContact O-N 2.83Å; A229-G231 VanDerWaalsContact C-N 3.33Å; A229-G231 PolarHBondContact O-N 3.44Å; A229-S232 WeakPolarHBondContact O-CB 3.29Å; A229-S232 PolarHBondContact O-N 2.83Å; A229-E233 PolarHBondContact O-N 3.45Å
230	M	96.9	Very high	95.2	Very high	93 Å²	93	51.2 Å²	51.2	46%	0.458	26%	0.263	S	S	.	.	H	α-helix	trans	-61.1	-40.7	172.4	177.6	167.2	66.5	0	0	111.9	L208 E226 I227 E233 Y234	L208-M230 HydrophobicContact CD2-CE 3.3Å; E226-M230 PolarHBondContact O-N 2.87Å; I227-M230 WeakPolarHBondContact O-CB 3.49Å; I227-M230 PolarHBondContact O-N 3.33Å; M230-E233 PolarHBondContact O-N 3.45Å; M230-Y234 WeakPolarHBondContact O-CB 3.17Å; M230-Y234 PolarHBondContact O-N 3.01Å
231	G	97	Very high	95.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.7	-38.7	174.6	0	0	0	0	0	113.9	L208 I227 L228 A229 Y234 A235 F247	L208-G231 VanDerWaalsContact CD1-CA 3.47Å; I227-G231 PolarHBondContact O-N 3.49Å; L228-G231 PolarHBondContact O-N 3.47Å; A229-G231 VanDerWaalsContact C-N 3.33Å; A229-G231 PolarHBondContact O-N 3.44Å; G231-Y234 PolarHBondContact O-N 2.87Å; G231-A235 WeakPolarHBondContact O-CB 3.33Å; G231-A235 PolarHBondContact O-N 3.27Å; G231-F247 VanDerWaalsContact C-CD2 3.43Å; G231-F247 WeakPolarHBondContact O-CD2 3.36Å
232	S	96.9	Very high	95.4	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-45.5	172.9	165.3	0	0	0	0	111.4	L228 A229 A235 R236 N244 L248	L228-S232 PolarHBondContact O-N 3.41Å; A229-S232 WeakPolarHBondContact O-CB 3.29Å; A229-S232 PolarHBondContact O-N 2.83Å; S232-A235 PolarHBondContact O-N 2.66Å; S232-R236 PolarHBondContact O-N 3.31Å; S232-R236 VanDerWaalsContact O-N 3.1Å; S232-N244 PolarHBondContact O-OD1 2.87Å; S232-N244 PolarHBondContact OG-OD1 2.76Å; S232-L248 WeakPolarHBondContact OG-CD2 3.45Å
233	E	96.5	Very high	95.4	Very high	77 Å²	77	45.2 Å²	45.2	36%	0.36	23%	0.229	S	C	.	.	H	α-helix	trans	-64.1	-44.8	176.7	-179.3	56.7	-158.6	0	0	112	A229 M230 A235 R236 L237	A229-E233 PolarHBondContact O-N 3.45Å; M230-E233 PolarHBondContact O-N 3.45Å; E233-A235 PolarHBondContact O-N 3.19Å; E233-R236 WeakPolarHBondContact O-CB 3.48Å; E233-R236 PolarHBondContact O-N 2.96Å; E233-R236 IonicContact OE1-CZ 3.9Å; E233-R236 IonicContact OE1-NE 3.37Å; E233-R236 IonicContact OE1-NH2 3.25Å; E233-R236 PolarHBondContact OE1-NH2 3.14Å; E233-R236 IonicContact OE2-CZ 2.83Å; E233-R236 IonicContact OE2-NE 2.67Å; E233-R236 PolarHBondContact OE2-NE 3.27Å; E233-R236 IonicContact OE2-NH2 2.71Å; E233-R236 PolarHBondContact OE2-NH2 3.05Å; E233-L237 WeakPolarHBondContact O-CG 3.46Å; E233-L237 PolarHBondContact O-N 3.18Å
234	Y	96.3	Very high	95.4	Very high	15 Å²	15	44.4 Å²	44.4	6%	0.059	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-46	177.1	-174.2	-93.1	0	0	0	112.1	N198 P201 H204 M230 G231 R236 L237 H238 I337	N198-Y234 PolarHBondContact O-OH 2.86Å; N198-Y234 WeakPolarHBondContact OD1-CE2 3.4Å; P201-Y234 WeakPolarHBondContact CA-OH 3.27Å; P201-Y234 HydrophobicContact CB-CE1 4.1Å; H204-Y234 HydrophobicContact CB-CE1 3.85Å; H204-Y234 AromaticContact CD2-CD1 3.51Å; H204-Y234 AromaticContact CD2-CD2 3.43Å; H204-Y234 VanDerWaalsContact CD2-CD2 3.43Å; H204-Y234 WeakPolarHBondContact CD2-CD2 3.39Å; H204-Y234 AromaticContact CD2-CE1 3.53Å; H204-Y234 AromaticContact CD2-CE2 3.47Å; H204-Y234 VanDerWaalsContact CD2-CE2 3.47Å; H204-Y234 WeakPolarHBondContact CD2-CE2 3.47Å; H204-Y234 AromaticContact CD2-CG 3.44Å; H204-Y234 VanDerWaalsContact CD2-CG 3.44Å; H204-Y234 AromaticContact CD2-CZ 3.51Å; H204-Y234 AromaticContact CG-CE1 3.9Å; H204-Y234 AromaticContact CG-CE2 3.91Å; H204-Y234 AromaticContact CG-CZ 3.67Å; H204-Y234 AromaticContact NE2-CD2 3.55Å; H204-Y234 AromaticContact NE2-CE2 3.77Å; H204-Y234 AromaticContact NE2-CG 3.87Å; M230-Y234 WeakPolarHBondContact O-CB 3.17Å; M230-Y234 PolarHBondContact O-N 3.01Å; G231-Y234 PolarHBondContact O-N 2.87Å; Y234-R236 VanDerWaalsContact C-N 3.26Å; Y234-R236 PolarHBondContact O-N 3.21Å; Y234-L237 WeakPolarHBondContact O-CB 3.49Å; Y234-L237 PolarHBondContact O-N 3.47Å; Y234-L237 VanDerWaalsContact O-N 3.16Å; Y234-H238 AromaticContact CD1-CD2 3.82Å; Y234-H238 AromaticContact CE1-CD2 3.43Å; Y234-H238 VanDerWaalsContact CE1-CD2 3.43Å; Y234-H238 WeakPolarHBondContact CE1-CD2 3.38Å; Y234-H238 AromaticContact CE1-NE2 3.68Å; Y234-H238 AromaticContact CE2-CD2 3.89Å; Y234-H238 AromaticContact CE2-NE2 3.59Å; Y234-H238 AromaticContact CZ-CD2 3.47Å; Y234-H238 VanDerWaalsContact CZ-CD2 3.47Å; Y234-H238 AromaticContact CZ-NE2 3.21Å; Y234-H238 PolarHBondContact O-CD2 3.18Å; Y234-H238 PolarHBondContact O-N 3.08Å; Y234-H238 VanDerWaalsContact O-N 3.13Å; Y234-H238 PolarHBondContact OH-NE2 3.01Å; Y234-I337 HydrophobicContact CD1-CD1 4.32Å; Y234-I337 HydrophobicContact CE1-CD1 4.32Å
235	A	95	Very high	95.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-36.3	177.1	0	0	0	0	0	112.3	G231 S232 E233 H238 N239 S240 T243 N244 I337	G231-A235 WeakPolarHBondContact O-CB 3.33Å; G231-A235 PolarHBondContact O-N 3.27Å; S232-A235 PolarHBondContact O-N 2.66Å; E233-A235 PolarHBondContact O-N 3.19Å; A235-H238 CarbonylContact O-C 3.59Å; A235-H238 PolarHBondContact O-N 2.89Å; A235-N239 PolarHBondContact O-N 3.05Å; A235-S240 PolarHBondContact O-N 3.48Å; A235-T243 HydrophobicContact CB-CG2 4.05Å; A235-N244 HydrophobicContact CB-CB 4Å; A235-I337 HydrophobicContact CB-CD1 4.31Å
236	R	94	Very high	95.4	Very high	127 Å²	127	44.7 Å²	44.7	48%	0.479	22%	0.223	S	C	.	.	H	α-helix	trans	-66.2	-40.4	174.9	-169.9	176.2	64.6	76.7	-11.5	112.3	S232 E233 Y234 H238 N239	S232-R236 PolarHBondContact O-N 3.31Å; S232-R236 VanDerWaalsContact O-N 3.1Å; E233-R236 WeakPolarHBondContact O-CB 3.48Å; E233-R236 PolarHBondContact O-N 2.96Å; E233-R236 IonicContact OE1-CZ 3.9Å; E233-R236 IonicContact OE1-NE 3.37Å; E233-R236 IonicContact OE1-NH2 3.25Å; E233-R236 PolarHBondContact OE1-NH2 3.14Å; E233-R236 IonicContact OE2-CZ 2.83Å; E233-R236 IonicContact OE2-NE 2.67Å; E233-R236 PolarHBondContact OE2-NE 3.27Å; E233-R236 IonicContact OE2-NH2 2.71Å; E233-R236 PolarHBondContact OE2-NH2 3.05Å; Y234-R236 VanDerWaalsContact C-N 3.26Å; Y234-R236 PolarHBondContact O-N 3.21Å; R236-H238 PolarHBondContact O-N 2.9Å; R236-N239 PolarHBondContact O-N 3.41Å; R236-N239 VanDerWaalsContact O-N 3.1Å
237	L	94.2	Very high	95.5	Very high	112 Å²	112	38.5 Å²	38.5	59%	0.586	19%	0.194	S	C	*	.	H	α-helix	trans	-62.9	-29.9	174.4	-67.9	172.9	0	0	0	112.5	E233 Y234 N239	E233-L237 WeakPolarHBondContact O-CG 3.46Å; E233-L237 PolarHBondContact O-N 3.18Å; Y234-L237 WeakPolarHBondContact O-CB 3.49Å; Y234-L237 PolarHBondContact O-N 3.47Å; Y234-L237 VanDerWaalsContact O-N 3.16Å; L237-N239 VanDerWaalsContact C-N 3.33Å
238	H	92.4	Very high	95.5	Very high	69 Å²	69	39.1 Å²	39.1	32%	0.319	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	15.9	175.1	-76	-82.3	0	0	0	114.1	Y234 A235 R236 S240 I337	Y234-H238 AromaticContact CD1-CD2 3.82Å; Y234-H238 AromaticContact CE1-CD2 3.43Å; Y234-H238 VanDerWaalsContact CE1-CD2 3.43Å; Y234-H238 WeakPolarHBondContact CE1-CD2 3.38Å; Y234-H238 AromaticContact CE1-NE2 3.68Å; Y234-H238 AromaticContact CE2-CD2 3.89Å; Y234-H238 AromaticContact CE2-NE2 3.59Å; Y234-H238 AromaticContact CZ-CD2 3.47Å; Y234-H238 VanDerWaalsContact CZ-CD2 3.47Å; Y234-H238 AromaticContact CZ-NE2 3.21Å; Y234-H238 PolarHBondContact O-CD2 3.18Å; Y234-H238 PolarHBondContact O-N 3.08Å; Y234-H238 VanDerWaalsContact O-N 3.13Å; Y234-H238 PolarHBondContact OH-NE2 3.01Å; A235-H238 CarbonylContact O-C 3.59Å; A235-H238 PolarHBondContact O-N 2.89Å; R236-H238 PolarHBondContact O-N 2.9Å; H238-S240 PolarHBondContact O-N 3.49Å; H238-I337 HydrophobicContact CB-CD1 3.79Å
239	N	91.1	Very high	95.5	Very high	143 Å²	143	39 Å²	39	77%	0.765	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	34.8	178.2	-60.6	-55.5	0	0	0	114.2	A235 R236 L237	A235-N239 PolarHBondContact O-N 3.05Å; R236-N239 PolarHBondContact O-N 3.41Å; R236-N239 VanDerWaalsContact O-N 3.1Å; L237-N239 VanDerWaalsContact C-N 3.33Å
240	S	92.8	Very high	95.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.			trans	-110.8	93.6	174.2	-173.6	0	0	0	0	111.3	A235 H238 Y242 T243 N244 E338	A235-S240 PolarHBondContact O-N 3.48Å; H238-S240 PolarHBondContact O-N 3.49Å; S240-Y242 PolarHBondContact O-N 2.92Å; S240-T243 PolarHBondContact OG-N 2.87Å; S240-T243 PolarHBondContact OG-OG1 3.13Å; S240-N244 VanDerWaalsContact O-CB 3.22Å; S240-N244 WeakPolarHBondContact O-CB 3.42Å; S240-N244 PolarHBondContact O-N 3.21Å; S240-E338 VanDerWaalsContact OG-CG 3.25Å; S240-E338 WeakPolarHBondContact OG-CG 3.45Å; S240-E338 PolarHBondContact OG-OE1 3.19Å
241	D	93.4	Very high	95.6	Very high	64 Å²	64	35.7 Å²	35.7	34%	0.342	18%	0.175	S	C	.	.	H	α-helix	trans	-61.7	-30.9	172.6	-68.6	-28.2	0	0	0	111.4	G245 F278	D241-G245 PolarHBondContact O-N 3.21Å; D241-F278 HydrophobicContact CB-CD2 3.9Å; D241-F278 HydrophobicContact CB-CE2 3.8Å
242	Y	94.6	Very high	95.5	Very high	3 Å²	3	35.8 Å²	35.8	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-56.9	179.5	176.3	-119.2	0	0	0	111.5	S240 N244 G245 L246 H284 A287 L288 E338 F340	S240-Y242 PolarHBondContact O-N 2.92Å; Y242-N244 VanDerWaalsContact C-N 3.31Å; Y242-N244 PolarHBondContact O-N 2.81Å; Y242-G245 WeakPolarHBondContact O-CA 3.47Å; Y242-G245 PolarHBondContact O-N 3.4Å; Y242-G245 VanDerWaalsContact O-N 3.09Å; Y242-L246 HydrophobicContact CD1-CD1 4.28Å; Y242-L246 HydrophobicContact CE1-CD1 3.7Å; Y242-L246 HydrophobicContact CE1-CG 4.43Å; Y242-L246 HydrophobicContact CE2-CD1 4.3Å; Y242-L246 HydrophobicContact CE2-CD2 4.29Å; Y242-L246 HydrophobicContact CE2-CG 4.22Å; Y242-L246 PolarHBondContact O-N 3.45Å; Y242-H284 HydrophobicContact CD2-CB 3.48Å; Y242-H284 VanDerWaalsContact CD2-CB 3.48Å; Y242-H284 AromaticContact CD2-CG 3.84Å; Y242-H284 AromaticContact CE1-CD2 3.93Å; Y242-H284 HydrophobicContact CE2-CB 3.93Å; Y242-H284 HydrophobicContact CG-CB 3.83Å; Y242-H284 AromaticContact CG-CG 3.8Å; Y242-H284 AromaticContact CZ-CD2 3.9Å; Y242-A287 HydrophobicContact CE2-CB 4.4Å; Y242-L288 HydrophobicContact CD2-CD1 3.88Å; Y242-L288 HydrophobicContact CD2-CD2 4.06Å; Y242-L288 HydrophobicContact CD2-CG 3.69Å; Y242-L288 HydrophobicContact CE2-CD2 4.11Å; Y242-L288 HydrophobicContact CE2-CG 3.94Å; Y242-E338 HydrophobicContact CD1-CB 4.18Å; Y242-E338 HydrophobicContact CD1-CG 4.36Å; Y242-E338 WeakPolarHBondContact CE1-O 3.32Å; Y242-F340 WeakPolarHBondContact CE1-O 3.25Å; Y242-F340 PolarHBondContact OH-O 3.35Å
243	T	95.1	Very high	95.5	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-33.9	-178.5	-56.4	0	0	0	0	111.4	A235 S240 G245 L246 F247 I337 F340	A235-T243 HydrophobicContact CB-CG2 4.05Å; S240-T243 PolarHBondContact OG-N 2.87Å; S240-T243 PolarHBondContact OG-OG1 3.13Å; T243-G245 VanDerWaalsContact C-N 3.34Å; T243-G245 PolarHBondContact O-N 2.88Å; T243-L246 PolarHBondContact O-N 3.21Å; T243-F247 HydrophobicContact CG2-CD2 3.94Å; T243-F247 HydrophobicContact CG2-CE2 3.74Å; T243-F247 VanDerWaalsContact O-CD2 3.26Å; T243-F247 WeakPolarHBondContact O-CD2 3.3Å; T243-F247 PolarHBondContact O-N 2.88Å; T243-I337 HydrophobicContact CG2-CG1 4.14Å; T243-I337 PolarHBondContact OG1-O 2.94Å; T243-F340 HydrophobicContact CG2-CD2 4.22Å
244	N	95.7	Very high	95.4	Very high	14 Å²	14	35.9 Å²	35.9	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-55.7	-49.4	168.5	177.4	17.7	0	0	0	111.3	S232 A235 S240 Y242 L246 F247 L248 L274	S232-N244 PolarHBondContact O-OD1 2.87Å; S232-N244 PolarHBondContact OG-OD1 2.76Å; A235-N244 HydrophobicContact CB-CB 4Å; S240-N244 VanDerWaalsContact O-CB 3.22Å; S240-N244 WeakPolarHBondContact O-CB 3.42Å; S240-N244 PolarHBondContact O-N 3.21Å; Y242-N244 VanDerWaalsContact C-N 3.31Å; Y242-N244 PolarHBondContact O-N 2.81Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 3.17Å; N244-F247 PolarHBondContact O-N 3.02Å; N244-L248 WeakPolarHBondContact O-CG 3.22Å; N244-L248 PolarHBondContact O-N 2.7Å; N244-L274 HydrophobicContact CB-CD1 4.39Å; N244-L274 WeakPolarHBondContact ND2-CD1 3.27Å
245	G	96.2	Very high	95.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-42.3	174.8	0	0	0	0	0	113.2	D241 Y242 T243 F247 L248 L249	D241-G245 PolarHBondContact O-N 3.21Å; Y242-G245 WeakPolarHBondContact O-CA 3.47Å; Y242-G245 PolarHBondContact O-N 3.4Å; Y242-G245 VanDerWaalsContact O-N 3.09Å; T243-G245 VanDerWaalsContact C-N 3.34Å; T243-G245 PolarHBondContact O-N 2.88Å; G245-F247 PolarHBondContact O-N 3.48Å; G245-L248 PolarHBondContact O-N 3.34Å; G245-L249 WeakPolarHBondContact O-CB 3.49Å; G245-L249 VanDerWaalsContact O-CG 3.29Å; G245-L249 WeakPolarHBondContact O-CG 3.38Å; G245-L249 PolarHBondContact O-N 2.94Å
246	L	96.9	Very high	95.2	Very high	15 Å²	15	35.6 Å²	35.6	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-42.5	176.7	-69.7	178.8	0	0	0	112.5	Y242 T243 N244 S250 L288 F291 F340 W342	Y242-L246 HydrophobicContact CD1-CD1 4.28Å; Y242-L246 HydrophobicContact CE1-CD1 3.7Å; Y242-L246 HydrophobicContact CE1-CG 4.43Å; Y242-L246 HydrophobicContact CE2-CD1 4.3Å; Y242-L246 HydrophobicContact CE2-CD2 4.29Å; Y242-L246 HydrophobicContact CE2-CG 4.22Å; Y242-L246 PolarHBondContact O-N 3.45Å; T243-L246 PolarHBondContact O-N 3.21Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 3.17Å; L246-S250 VanDerWaalsContact O-CB 3.28Å; L246-S250 WeakPolarHBondContact O-CB 3.27Å; L246-S250 PolarHBondContact O-N 2.9Å; L246-S250 PolarHBondContact O-OG 3.11Å; L246-L288 HydrophobicContact CD2-CD2 3.82Å; L246-L288 HydrophobicContact CG-CD2 4.04Å; L246-F291 HydrophobicContact CD2-CD1 4.34Å; L246-F340 HydrophobicContact CD1-CB 3.7Å; L246-W342 HydrophobicContact CD2-CB 4.49Å
247	F	98	Very high	95.1	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-45.6	176.3	-85.9	-71.1	0	0	0	112	C205 L208 L209 L228 G231 T243 N244 G245 L249 S250 K251	C205-F247 HydrophobicContact CB-CE2 3.94Å; C205-F247 HydrophobicContact CB-CZ 3.95Å; L208-F247 HydrophobicContact CB-CE1 4.08Å; L208-F247 HydrophobicContact CB-CZ 4.17Å; L208-F247 HydrophobicContact CD1-CZ 4.47Å; L209-F247 HydrophobicContact CD1-CZ 4.46Å; L209-F247 HydrophobicContact CD2-CD1 3.98Å; L209-F247 HydrophobicContact CD2-CE1 3.55Å; L209-F247 HydrophobicContact CD2-CZ 4.15Å; L209-F247 HydrophobicContact CG-CE1 3.73Å; L209-F247 HydrophobicContact CG-CZ 3.92Å; L228-F247 HydrophobicContact CB-CD1 4.44Å; L228-F247 HydrophobicContact CD2-CD1 3.7Å; L228-F247 HydrophobicContact CD2-CE1 4.09Å; G231-F247 VanDerWaalsContact C-CD2 3.43Å; G231-F247 WeakPolarHBondContact O-CD2 3.36Å; T243-F247 HydrophobicContact CG2-CD2 3.94Å; T243-F247 HydrophobicContact CG2-CE2 3.74Å; T243-F247 VanDerWaalsContact O-CD2 3.26Å; T243-F247 WeakPolarHBondContact O-CD2 3.3Å; T243-F247 PolarHBondContact O-N 2.88Å; N244-F247 PolarHBondContact O-N 3.02Å; G245-F247 PolarHBondContact O-N 3.48Å; F247-L249 PolarHBondContact O-N 2.91Å; F247-S250 PolarHBondContact O-N 3.43Å; F247-K251 WeakPolarHBondContact O-CB 3.28Å; F247-K251 PolarHBondContact O-N 3.16Å
248	L	97.6	Very high	94.9	Very high	27 Å²	27	30.2 Å²	30.2	14%	0.141	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-42.1	178	-70	175.4	0	0	0	112.2	S232 N244 G245 K251 C252 T267 V271 L274	S232-L248 WeakPolarHBondContact OG-CD2 3.45Å; N244-L248 WeakPolarHBondContact O-CG 3.22Å; N244-L248 PolarHBondContact O-N 2.7Å; G245-L248 PolarHBondContact O-N 3.34Å; L248-K251 WeakPolarHBondContact O-CB 3.36Å; L248-K251 PolarHBondContact O-N 3.49Å; L248-C252 WeakPolarHBondContact O-CB 3.44Å; L248-C252 PolarHBondContact O-N 2.74Å; L248-T267 WeakPolarHBondContact O-CG2 3.49Å; L248-V271 HydrophobicContact CB-CG2 3.57Å; L248-V271 HydrophobicContact CD1-CG2 4.12Å; L248-V271 HydrophobicContact CG-CG2 4.49Å; L248-L274 HydrophobicContact CD1-CD1 4.22Å
249	L	98	Very high	94.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.2	-37.6	176.7	-72.9	168.1	0	0	0	112.1	G245 F247 K251 C252 M253 V271 L288 F291 L295	G245-L249 WeakPolarHBondContact O-CB 3.49Å; G245-L249 VanDerWaalsContact O-CG 3.29Å; G245-L249 WeakPolarHBondContact O-CG 3.38Å; G245-L249 PolarHBondContact O-N 2.94Å; F247-L249 PolarHBondContact O-N 2.91Å; L249-K251 VanDerWaalsContact C-N 3.34Å; L249-K251 PolarHBondContact O-N 3.33Å; L249-C252 WeakPolarHBondContact O-CB 3.41Å; L249-C252 PolarHBondContact O-N 3.06Å; L249-M253 WeakPolarHBondContact O-CB 3.44Å; L249-M253 PolarHBondContact O-N 3.41Å; L249-V271 HydrophobicContact CD1-CG1 4.22Å; L249-V271 HydrophobicContact CD2-CB 4.44Å; L249-V271 HydrophobicContact CD2-CG1 3.82Å; L249-V271 HydrophobicContact CD2-CG2 4.27Å; L249-V271 HydrophobicContact CG-CG1 3.95Å; L249-V271 HydrophobicContact CG-CG2 4.25Å; L249-L288 HydrophobicContact CD1-CB 4.48Å; L249-L288 HydrophobicContact CD1-CD2 3.81Å; L249-F291 HydrophobicContact CB-CD1 3.55Å; L249-F291 HydrophobicContact CB-CD2 4.39Å; L249-F291 HydrophobicContact CB-CE1 3.38Å; L249-F291 HydrophobicContact CB-CE2 4.24Å; L249-F291 HydrophobicContact CB-CG 4.07Å; L249-F291 HydrophobicContact CB-CZ 3.75Å; L249-F291 HydrophobicContact CD1-CB 3.91Å; L249-F291 HydrophobicContact CD1-CD1 3.61Å; L249-F291 HydrophobicContact CD1-CE1 4.33Å; L249-F291 HydrophobicContact CD1-CG 3.82Å; L249-F291 HydrophobicContact CG-CD1 4.17Å; L249-F291 HydrophobicContact CG-CE1 4.47Å; L249-F291 HydrophobicContact CG-CG 4.41Å; L249-L295 HydrophobicContact CB-CD1 4.26Å; L249-L295 HydrophobicContact CD2-CD1 3.86Å; L249-L295 VanDerWaalsContact O-CD1 3.25Å; L249-L295 WeakPolarHBondContact O-CD1 3.22Å
250	S	97.5	Very high	94.5	Very high	21 Å²	21	27.8 Å²	27.8	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-42.3	172.5	-60.2	0	0	0	0	111.2	L246 F247 M253 L254	L246-S250 VanDerWaalsContact O-CB 3.28Å; L246-S250 WeakPolarHBondContact O-CB 3.27Å; L246-S250 PolarHBondContact O-N 2.9Å; L246-S250 PolarHBondContact O-OG 3.11Å; F247-S250 PolarHBondContact O-N 3.43Å; S250-M253 WeakPolarHBondContact O-CB 3.16Å; S250-M253 PolarHBondContact O-N 2.88Å; S250-L254 WeakPolarHBondContact O-CG 3.47Å; S250-L254 PolarHBondContact O-N 3.14Å; S250-L254 VanDerWaalsContact O-N 3.14Å
251	K	97.5	Very high	94.2	Very high	43 Å²	43	29.7 Å²	29.7	19%	0.187	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-47.4	173.6	-176.3	-174.6	176.4	-176.2	0	110.5	C225 L228 F247 L248 L249 M253 L254 L255	C225-K251 HydrophobicContact CB-CG 4.26Å; L228-K251 HydrophobicContact CB-CB 4.02Å; L228-K251 HydrophobicContact CD1-CB 4.06Å; F247-K251 WeakPolarHBondContact O-CB 3.28Å; F247-K251 PolarHBondContact O-N 3.16Å; L248-K251 WeakPolarHBondContact O-CB 3.36Å; L248-K251 PolarHBondContact O-N 3.49Å; L249-K251 VanDerWaalsContact C-N 3.34Å; L249-K251 PolarHBondContact O-N 3.33Å; K251-M253 VanDerWaalsContact C-N 3.27Å; K251-M253 PolarHBondContact O-N 2.89Å; K251-L254 PolarHBondContact O-N 3.19Å; K251-L254 VanDerWaalsContact O-N 3.13Å; K251-L255 HydrophobicContact CG-CD1 4.1Å; K251-L255 HydrophobicContact CG-CG 4.42Å; K251-L255 WeakPolarHBondContact O-CG 3.43Å; K251-L255 PolarHBondContact O-N 3.5Å
252	C	96.9	Very high	94	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-57.9	-39.5	177.2	-169.7	0	0	0	0	112.3	L248 L249 L255 L256 T267 L295	L248-C252 WeakPolarHBondContact O-CB 3.44Å; L248-C252 PolarHBondContact O-N 2.74Å; L249-C252 WeakPolarHBondContact O-CB 3.41Å; L249-C252 PolarHBondContact O-N 3.06Å; C252-L255 PolarHBondContact O-N 3.4Å; C252-L256 VanDerWaalsContact O-CB 3.3Å; C252-L256 WeakPolarHBondContact O-CB 3.48Å; C252-L256 PolarHBondContact O-N 3.36Å; C252-T267 HydrophobicContact CB-CG2 3.82Å; C252-L295 HydrophobicContact CB-CD1 3.9Å
253	M	96	Very high	93.8	Very high	72 Å²	72	35.9 Å²	35.9	36%	0.355	20%	0.197	S	C	.	.	H	α-helix	trans	-62.7	-41.7	176.1	-177.5	-179.5	63.8	0	0	111.9	L249 S250 K251 L256 A257 L295	L249-M253 WeakPolarHBondContact O-CB 3.44Å; L249-M253 PolarHBondContact O-N 3.41Å; S250-M253 WeakPolarHBondContact O-CB 3.16Å; S250-M253 PolarHBondContact O-N 2.88Å; K251-M253 VanDerWaalsContact C-N 3.27Å; K251-M253 PolarHBondContact O-N 2.89Å; M253-L256 PolarHBondContact O-N 2.97Å; M253-A257 WeakPolarHBondContact O-CB 3.37Å; M253-A257 PolarHBondContact O-N 3.33Å; M253-L295 HydrophobicContact CB-CD1 4.24Å; M253-L295 HydrophobicContact CB-CD2 3.91Å; M253-L295 HydrophobicContact CG-CD2 4.13Å
254	L	94.4	Very high	93.7	Very high	23 Å²	23	35.8 Å²	35.8	12%	0.12	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-45.7	176.4	-62.2	-174.1	0	0	0	112.4	I216 A224 L228 S250 K251 L256 A257 S258	I216-L254 HydrophobicContact CD1-CD1 3.58Å; I216-L254 HydrophobicContact CD1-CD2 3.31Å; I216-L254 HydrophobicContact CD1-CG 4.07Å; I216-L254 HydrophobicContact CG1-CD1 4.02Å; I216-L254 HydrophobicContact CG1-CD2 4.08Å; A224-L254 HydrophobicContact CB-CD1 3.98Å; L228-L254 HydrophobicContact CD1-CD1 3.48Å; L228-L254 VanDerWaalsContact CD1-CD1 3.48Å; L228-L254 HydrophobicContact CD1-CG 4.22Å; S250-L254 WeakPolarHBondContact O-CG 3.47Å; S250-L254 PolarHBondContact O-N 3.14Å; S250-L254 VanDerWaalsContact O-N 3.14Å; K251-L254 PolarHBondContact O-N 3.19Å; K251-L254 VanDerWaalsContact O-N 3.13Å; L254-L256 PolarHBondContact O-N 2.94Å; L254-A257 PolarHBondContact O-N 3.35Å; L254-A257 VanDerWaalsContact O-N 3.13Å; L254-S258 PolarHBondContact O-N 3.46Å; L254-S258 PolarHBondContact O-OG 3.32Å
255	L	94.6	Very high	93.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-37.6	176.1	-68.2	172.2	0	0	0	111.4	K251 C252 S258 R259 Q260 E263 V264	K251-L255 HydrophobicContact CG-CD1 4.1Å; K251-L255 HydrophobicContact CG-CG 4.42Å; K251-L255 WeakPolarHBondContact O-CG 3.43Å; K251-L255 PolarHBondContact O-N 3.5Å; C252-L255 PolarHBondContact O-N 3.4Å; L255-S258 WeakPolarHBondContact CA-OG 3.4Å; L255-S258 PolarHBondContact O-N 3.17Å; L255-S258 PolarHBondContact O-OG 3.09Å; L255-S258 VanDerWaalsContact O-OG 3.13Å; L255-R259 PolarHBondContact O-N 3.11Å; L255-R259 VanDerWaalsContact O-N 3.1Å; L255-Q260 HydrophobicContact CD2-CB 4.1Å; L255-Q260 PolarHBondContact O-N 2.86Å; L255-E263 HydrophobicContact CD1-CB 3.77Å; L255-E263 HydrophobicContact CD2-CB 4.15Å; L255-V264 HydrophobicContact CB-CG2 3.61Å
256	L	93.1	Very high	93.5	Very high	10 Å²	10	42.6 Å²	42.6	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-68.2	-43.2	175.6	-174.6	61.8	0	0	0	111.7	C252 M253 L254 S258 R259 V264 L295 F299 I302	C252-L256 VanDerWaalsContact O-CB 3.3Å; C252-L256 WeakPolarHBondContact O-CB 3.48Å; C252-L256 PolarHBondContact O-N 3.36Å; M253-L256 PolarHBondContact O-N 2.97Å; L254-L256 PolarHBondContact O-N 2.94Å; L256-S258 VanDerWaalsContact C-N 3.29Å; L256-S258 PolarHBondContact O-N 2.97Å; L256-R259 PolarHBondContact O-N 3.44Å; L256-V264 HydrophobicContact CB-CG2 4.31Å; L256-L295 HydrophobicContact CD2-CD2 4.41Å; L256-F299 HydrophobicContact CD1-CB 4.16Å; L256-F299 HydrophobicContact CD1-CD2 4.24Å; L256-I302 HydrophobicContact CD1-CD1 3.65Å; L256-I302 HydrophobicContact CD2-CD1 4Å; L256-I302 HydrophobicContact CG-CD1 3.64Å
257	A	90.7	Very high	93.4	Very high	84 Å²	84	42.3 Å²	42.3	69%	0.694	24%	0.238	S	C	*	.	H	α-helix	trans	-64	-33.3	176.3	0	0	0	0	0	112.7	M253 L254 R259	M253-A257 WeakPolarHBondContact O-CB 3.37Å; M253-A257 PolarHBondContact O-N 3.33Å; L254-A257 PolarHBondContact O-N 3.35Å; L254-A257 VanDerWaalsContact O-N 3.13Å; A257-R259 VanDerWaalsContact C-N 3.34Å
258	S	89.9	Confident	93.3	Very high	42 Å²	42	42.7 Å²	42.7	29%	0.294	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	3	175.8	67.6	0	0	0	0	114.4	L254 L255 L256 Q260	L254-S258 PolarHBondContact O-N 3.46Å; L254-S258 PolarHBondContact O-OG 3.32Å; L255-S258 WeakPolarHBondContact CA-OG 3.4Å; L255-S258 PolarHBondContact O-N 3.17Å; L255-S258 PolarHBondContact O-OG 3.09Å; L255-S258 VanDerWaalsContact O-OG 3.13Å; L256-S258 VanDerWaalsContact C-N 3.29Å; L256-S258 PolarHBondContact O-N 2.97Å; S258-Q260 VanDerWaalsContact C-N 3.28Å; S258-Q260 PolarHBondContact O-N 2.85Å
259	R	87.2	Confident	93.2	Very high	108 Å²	108	44.9 Å²	44.9	41%	0.408	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	27.1	179.6	-60.7	-75.8	-172.8	123.8	2.7	114.6	L255 L256 A257 L261 S507	L255-R259 PolarHBondContact O-N 3.11Å; L255-R259 VanDerWaalsContact O-N 3.1Å; L256-R259 PolarHBondContact O-N 3.44Å; A257-R259 VanDerWaalsContact C-N 3.34Å; R259-L261 VanDerWaalsContact C-N 3.26Å; R259-L261 PolarHBondContact O-N 2.96Å; R259-S507 PolarHBondContact NH1-OG 3.13Å; R259-S507 PolarHBondContact NH2-OG 3.08Å
260	Q	87.7	Confident	93.1	Very high	53 Å²	53	48.4 Å²	48.4	25%	0.248	27%	0.273	C	S	.	.			trans	-82.8	66.3	174.6	-65.6	-178.2	15.4	0	0	111.4	L255 S258 P262 E263 V264	L255-Q260 HydrophobicContact CD2-CB 4.1Å; L255-Q260 PolarHBondContact O-N 2.86Å; S258-Q260 VanDerWaalsContact C-N 3.28Å; S258-Q260 PolarHBondContact O-N 2.85Å; Q260-P262 VanDerWaalsContact C-CD 3.42Å; Q260-E263 PolarHBondContact O-N 3.29Å; Q260-V264 WeakPolarHBondContact O-CG2 3.12Å; Q260-V264 PolarHBondContact O-N 2.81Å
261	L	86.6	Confident	93.1	Very high	39 Å²	39	47.4 Å²	47.4	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-56.3	-36.8	-170.4	-54.6	-176.4	0	0	0	115.8	R259 E263 V264 T265 F299	R259-L261 VanDerWaalsContact C-N 3.26Å; R259-L261 PolarHBondContact O-N 2.96Å; L261-E263 PolarHBondContact O-N 3.33Å; L261-V264 PolarHBondContact O-N 3.48Å; L261-T265 PolarHBondContact O-N 2.88Å; L261-T265 PolarHBondContact O-OG1 3.3Å; L261-F299 HydrophobicContact CB-CE2 4.13Å; L261-F299 HydrophobicContact CD2-CD2 4.14Å; L261-F299 HydrophobicContact CD2-CE2 3.96Å
262	P	88.7	Confident	93.1	Very high	104 Å²	104	46.9 Å²	46.9	68%	0.675	27%	0.268	S	S	*	.	H	α-helix	trans	-61.9	-44	178.5	-24.8	35.7	0	0	0	113	Q260 V264 T265 V266	Q260-P262 VanDerWaalsContact C-CD 3.42Å; P262-V264 VanDerWaalsContact C-N 3.35Å; P262-T265 PolarHBondContact O-N 3.36Å; P262-V266 PolarHBondContact O-N 3.11Å
263	E	91.5	Very high	93.1	Very high	93 Å²	93	53.1 Å²	53.1	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-31	-179.9	-65.8	-169.2	-148.2	0	0	112.7	L255 Q260 L261 T265 V266 T267	L255-E263 HydrophobicContact CD1-CB 3.77Å; L255-E263 HydrophobicContact CD2-CB 4.15Å; Q260-E263 PolarHBondContact O-N 3.29Å; L261-E263 PolarHBondContact O-N 3.33Å; E263-T265 VanDerWaalsContact C-N 3.31Å; E263-T265 PolarHBondContact O-N 3.18Å; E263-V266 PolarHBondContact O-N 3.44Å; E263-T267 WeakPolarHBondContact O-CB 3.35Å; E263-T267 PolarHBondContact O-N 3.44Å; E263-T267 PolarHBondContact O-OG1 2.92Å
264	V	93.2	Very high	93	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-46.2	172.8	172.8	0	0	0	0	110.3	L255 L256 Q260 L261 P262 V266 T267 L268 F299	L255-V264 HydrophobicContact CB-CG2 3.61Å; L256-V264 HydrophobicContact CB-CG2 4.31Å; Q260-V264 WeakPolarHBondContact O-CG2 3.12Å; Q260-V264 PolarHBondContact O-N 2.81Å; L261-V264 PolarHBondContact O-N 3.48Å; P262-V264 VanDerWaalsContact C-N 3.35Å; V264-V266 PolarHBondContact O-N 3.02Å; V264-T267 PolarHBondContact O-N 2.83Å; V264-L268 HydrophobicContact CG1-CD1 3.79Å; V264-L268 HydrophobicContact CG1-CG 4.18Å; V264-L268 WeakPolarHBondContact O-CB 3.37Å; V264-L268 WeakPolarHBondContact O-CG 3.46Å; V264-L268 PolarHBondContact O-N 2.83Å; V264-F299 HydrophobicContact CB-CD2 4.29Å; V264-F299 HydrophobicContact CB-CE2 4.42Å; V264-F299 HydrophobicContact CG1-CB 4.48Å; V264-F299 HydrophobicContact CG1-CD2 3.6Å; V264-F299 HydrophobicContact CG1-CE2 4.11Å; V264-F299 HydrophobicContact CG1-CG 4.21Å
265	T	93.2	Very high	93.1	Very high	69 Å²	69	50 Å²	50	42%	0.423	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-42.4	-177.6	-55.2	0	0	0	0	111.9	L261 P262 E263 T269	L261-T265 PolarHBondContact O-N 2.88Å; L261-T265 PolarHBondContact O-OG1 3.3Å; P262-T265 PolarHBondContact O-N 3.36Å; E263-T265 VanDerWaalsContact C-N 3.31Å; E263-T265 PolarHBondContact O-N 3.18Å; T265-T269 PolarHBondContact O-N 2.78Å; T265-T269 VanDerWaalsContact O-N 3.11Å; T265-T269 PolarHBondContact O-OG1 2.95Å
266	V	95.3	Very high	93.1	Very high	87 Å²	87	56.3 Å²	56.3	53%	0.527	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-46	176.2	178	0	0	0	0	110.7	P262 E263 V264 T269 N270	P262-V266 PolarHBondContact O-N 3.11Å; E263-V266 PolarHBondContact O-N 3.44Å; V264-V266 PolarHBondContact O-N 3.02Å; V266-T269 PolarHBondContact O-N 3.27Å; V266-N270 PolarHBondContact O-N 3.35Å; V266-N270 VanDerWaalsContact O-N 3.08Å
267	T	94.8	Very high	93.1	Very high	10 Å²	10	62.1 Å²	62.1	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-43.1	-178.5	-53.3	0	0	0	0	111.5	L248 C252 E263 V264 T269 N270 V271	L248-T267 WeakPolarHBondContact O-CG2 3.49Å; C252-T267 HydrophobicContact CB-CG2 3.82Å; E263-T267 WeakPolarHBondContact O-CB 3.35Å; E263-T267 PolarHBondContact O-N 3.44Å; E263-T267 PolarHBondContact O-OG1 2.92Å; V264-T267 PolarHBondContact O-N 2.83Å; T267-T269 VanDerWaalsContact C-N 3.32Å; T267-T269 PolarHBondContact O-N 3.15Å; T267-N270 PolarHBondContact O-N 3.46Å; T267-V271 WeakPolarHBondContact O-CG2 3.39Å; T267-V271 PolarHBondContact O-N 3.5Å
268	L	95.3	Very high	93.3	Very high	9 Å²	9	58.9 Å²	58.9	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-39.4	175.4	-73.8	175.9	0	0	0	112.3	V264 V271 S272 Y292 L295 H296	V264-L268 HydrophobicContact CG1-CD1 3.79Å; V264-L268 HydrophobicContact CG1-CG 4.18Å; V264-L268 WeakPolarHBondContact O-CB 3.37Å; V264-L268 WeakPolarHBondContact O-CG 3.46Å; V264-L268 PolarHBondContact O-N 2.83Å; L268-V271 PolarHBondContact O-N 3.38Å; L268-S272 PolarHBondContact O-N 3.21Å; L268-Y292 HydrophobicContact CB-CE2 4.2Å; L268-Y292 HydrophobicContact CD2-CD2 3.84Å; L268-Y292 HydrophobicContact CD2-CE2 3.79Å; L268-Y292 WeakPolarHBondContact O-CE2 3.35Å; L268-L295 HydrophobicContact CD2-CB 4.48Å; L268-H296 HydrophobicContact CD1-CB 4.48Å; L268-H296 HydrophobicContact CD2-CB 4.45Å
269	T	96.1	Very high	93.1	Very high	73 Å²	73	66.1 Å²	66.1	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-42.9	177	-58	0	0	0	0	111.3	T265 V266 T267 S272 R273	T265-T269 PolarHBondContact O-N 2.78Å; T265-T269 VanDerWaalsContact O-N 3.11Å; T265-T269 PolarHBondContact O-OG1 2.95Å; V266-T269 PolarHBondContact O-N 3.27Å; T267-T269 VanDerWaalsContact C-N 3.32Å; T267-T269 PolarHBondContact O-N 3.15Å; T269-S272 PolarHBondContact O-N 3.09Å; T269-R273 PolarHBondContact O-N 3.04Å
270	N	95.7	Very high	92.8	Very high	74 Å²	74	62.7 Å²	62.7	40%	0.396	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-42.6	177.1	-68.4	-18.1	0	0	0	111.7	V266 T267 R273 L274	V266-N270 PolarHBondContact O-N 3.35Å; V266-N270 VanDerWaalsContact O-N 3.08Å; T267-N270 PolarHBondContact O-N 3.46Å; N270-R273 PolarHBondContact O-N 3.31Å; N270-L274 PolarHBondContact O-N 2.65Å; N270-L274 VanDerWaalsContact O-N 3.08Å
271	V	96.5	Very high	92.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-39.1	178.1	176	0	0	0	0	112	L248 L249 T267 L268 R273 L274 I275 Y292	L248-V271 HydrophobicContact CB-CG2 3.57Å; L248-V271 HydrophobicContact CD1-CG2 4.12Å; L248-V271 HydrophobicContact CG-CG2 4.49Å; L249-V271 HydrophobicContact CD1-CG1 4.22Å; L249-V271 HydrophobicContact CD2-CB 4.44Å; L249-V271 HydrophobicContact CD2-CG1 3.82Å; L249-V271 HydrophobicContact CD2-CG2 4.27Å; L249-V271 HydrophobicContact CG-CG1 3.95Å; L249-V271 HydrophobicContact CG-CG2 4.25Å; T267-V271 WeakPolarHBondContact O-CG2 3.39Å; T267-V271 PolarHBondContact O-N 3.5Å; L268-V271 PolarHBondContact O-N 3.38Å; V271-R273 VanDerWaalsContact C-N 3.3Å; V271-R273 PolarHBondContact O-N 3.23Å; V271-L274 WeakPolarHBondContact O-CB 3.44Å; V271-L274 PolarHBondContact O-N 3.38Å; V271-L274 VanDerWaalsContact O-N 3.13Å; V271-I275 HydrophobicContact CG1-CD1 3.67Å; V271-I275 HydrophobicContact CG1-CG1 4.16Å; V271-I275 WeakPolarHBondContact O-CG1 3.22Å; V271-I275 PolarHBondContact O-N 3.48Å; V271-Y292 HydrophobicContact CB-CD2 4.32Å; V271-Y292 HydrophobicContact CG1-CD2 3.98Å; V271-Y292 HydrophobicContact CG1-CG 4.47Å
272	S	96.8	Very high	92.9	Very high	32 Å²	32	65.3 Å²	65.3	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-55.9	-47.7	175.2	-166.7	0	0	0	0	110.9	L268 T269 L274 I275 E276	L268-S272 PolarHBondContact O-N 3.21Å; T269-S272 PolarHBondContact O-N 3.09Å; S272-L274 VanDerWaalsContact C-N 3.33Å; S272-L274 PolarHBondContact O-N 3.35Å; S272-I275 PolarHBondContact O-N 3.34Å; S272-E276 WeakPolarHBondContact O-CG 3.33Å; S272-E276 PolarHBondContact O-N 3.31Å; S272-E276 PolarHBondContact OG-OE1 3.21Å
273	R	96.9	Very high	93	Very high	133 Å²	133	61 Å²	61	50%	0.502	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-41.1	176.8	-169.7	-175.1	-55.3	164.1	6.8	112.2	T269 N270 V271 E276 Q277	T269-R273 PolarHBondContact O-N 3.04Å; N270-R273 PolarHBondContact O-N 3.31Å; V271-R273 VanDerWaalsContact C-N 3.3Å; V271-R273 PolarHBondContact O-N 3.23Å; R273-E276 PolarHBondContact O-N 3.11Å; R273-Q277 WeakPolarHBondContact O-CB 3.4Å; R273-Q277 WeakPolarHBondContact O-CG 3.45Å; R273-Q277 PolarHBondContact O-N 2.95Å; R273-Q277 VanDerWaalsContact O-N 3.08Å
274	L	95.9	Very high	93	Very high	21 Å²	21	56.7 Å²	56.7	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-44.8	176.6	-178	155.2	0	0	0	111.5	N244 L248 N270 V271 S272 Q277 F278 L288	N244-L274 HydrophobicContact CB-CD1 4.39Å; N244-L274 WeakPolarHBondContact ND2-CD1 3.27Å; L248-L274 HydrophobicContact CD1-CD1 4.22Å; N270-L274 PolarHBondContact O-N 2.65Å; N270-L274 VanDerWaalsContact O-N 3.08Å; V271-L274 WeakPolarHBondContact O-CB 3.44Å; V271-L274 PolarHBondContact O-N 3.38Å; V271-L274 VanDerWaalsContact O-N 3.13Å; S272-L274 VanDerWaalsContact C-N 3.33Å; S272-L274 PolarHBondContact O-N 3.35Å; L274-Q277 CarbonylContact O-C 3.58Å; L274-Q277 PolarHBondContact O-N 3.12Å; L274-F278 HydrophobicContact CD2-CD2 4.18Å; L274-F278 PolarHBondContact O-N 3.11Å; L274-L288 HydrophobicContact CD2-CD1 4.07Å
275	I	95.5	Very high	93	Very high	7 Å²	7	60.7 Å²	60.7	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-35.5	-179.9	-66.9	169	0	0	0	111.8	V271 S272 F278 R285 L288 R289 Y292	V271-I275 HydrophobicContact CG1-CD1 3.67Å; V271-I275 HydrophobicContact CG1-CG1 4.16Å; V271-I275 WeakPolarHBondContact O-CG1 3.22Å; V271-I275 PolarHBondContact O-N 3.48Å; S272-I275 PolarHBondContact O-N 3.34Å; I275-F278 WeakPolarHBondContact O-CB 3.28Å; I275-R285 HydrophobicContact CG2-CG 4.4Å; I275-R285 PolarHBondContact O-NE 3.31Å; I275-R285 VanDerWaalsContact O-NE 3.15Å; I275-L288 HydrophobicContact CD1-CB 4.23Å; I275-L288 HydrophobicContact CG1-CB 4.2Å; I275-R289 HydrophobicContact CG2-CB 4.42Å; I275-Y292 HydrophobicContact CD1-CD1 4.41Å; I275-Y292 HydrophobicContact CD1-CG 3.98Å
276	E	94.6	Very high	93	Very high	133 Å²	133	58.1 Å²	58.1	62%	0.621	29%	0.29	S	S	*	.	H	α-helix	trans	-65.8	-38.7	175.1	-75.1	166.1	-153.8	0	0	112.1	S272 R273	S272-E276 WeakPolarHBondContact O-CG 3.33Å; S272-E276 PolarHBondContact O-N 3.31Å; S272-E276 PolarHBondContact OG-OE1 3.21Å; R273-E276 PolarHBondContact O-N 3.11Å
277	Q	94.1	Very high	93	Very high	132 Å²	132	54.3 Å²	54.3	62%	0.617	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	6.7	-178.6	-63.6	179.4	-0.1	0	0	113.7	R273 L274 K279	R273-Q277 WeakPolarHBondContact O-CB 3.4Å; R273-Q277 WeakPolarHBondContact O-CG 3.45Å; R273-Q277 PolarHBondContact O-N 2.95Å; R273-Q277 VanDerWaalsContact O-N 3.08Å; L274-Q277 CarbonylContact O-C 3.58Å; L274-Q277 PolarHBondContact O-N 3.12Å; Q277-K279 PolarHBondContact O-N 2.79Å
278	F	93.4	Very high	93	Very high	16 Å²	16	53.9 Å²	53.9	7%	0.07	27%	0.265	C	S	.	.			trans	-66.4	120.6	-172.1	-166.1	-91	0	0	0	112.4	D241 L274 I275 N281 H284 R285 L288	D241-F278 HydrophobicContact CB-CD2 3.9Å; D241-F278 HydrophobicContact CB-CE2 3.8Å; L274-F278 HydrophobicContact CD2-CD2 4.18Å; L274-F278 PolarHBondContact O-N 3.11Å; I275-F278 WeakPolarHBondContact O-CB 3.28Å; F278-N281 WeakPolarHBondContact CE1-O 3.39Å; F278-H284 HydrophobicContact CE1-CB 4.12Å; F278-H284 HydrophobicContact CZ-CB 3.78Å; F278-R285 HydrophobicContact CB-CG 4.02Å; F278-R285 HydrophobicContact CD1-CB 3.53Å; F278-R285 HydrophobicContact CD1-CG 3.86Å; F278-R285 HydrophobicContact CE1-CB 3.84Å; F278-R285 HydrophobicContact CG-CB 4.16Å; F278-R285 HydrophobicContact CG-CG 4.07Å; F278-L288 HydrophobicContact CD2-CD1 4.24Å; F278-L288 HydrophobicContact CE2-CD1 3.88Å
279	K	85.8	Confident	93.1	Very high	194 Å²	194	57.2 Å²	57.2	84%	0.843	28%	0.277	S	S	*	.			trans	-101.2	-1.8	-177.1	-63.1	179.4	-176.3	173.7	0	114.7	Q277	Q277-K279 PolarHBondContact O-N 2.79Å
280	G	82.1	Confident	93.1	Very high	37 Å²	37	53.7 Å²	53.7	38%	0.381	26%	0.255	S	S	.	.	S	Bend	trans	-86.3	-161.4	-175.8	0	0	0	0	0	114.5	M282	G280-M282 WeakPolarHBondContact O-CE 3.47Å
281	N	87.4	Confident	93.2	Very high	50 Å²	50	50.2 Å²	50.2	27%	0.267	24%	0.237	S	C	.	.			trans	-55.4	135.9	177.1	-173.1	-9.5	0	0	0	111.9	F278 Y283 H284 R285 D330	F278-N281 WeakPolarHBondContact CE1-O 3.39Å; N281-Y283 PolarHBondContact O-N 3.19Å; N281-Y283 PolarHBondContact OD1-N 3.04Å; N281-H284 HydrophobicContact CB-CB 4.35Å; N281-H284 PolarHBondContact O-N 3.5Å; N281-R285 PolarHBondContact O-N 2.65Å; N281-D330 PolarHBondContact ND2-O 2.67Å
282	M	88.9	Confident	93.3	Very high	97 Å²	97	51.5 Å²	51.5	48%	0.478	24%	0.242	S	C	.	.	H	α-helix	trans	-57.7	-34.6	174.6	-67.2	-60.4	95.4	0	0	112.3	G280 R285 E286 M326	G280-M282 WeakPolarHBondContact O-CE 3.47Å; M282-R285 PolarHBondContact O-N 2.65Å; M282-E286 WeakPolarHBondContact O-CB 3.45Å; M282-E286 PolarHBondContact O-N 3.44Å; M282-M326 HydrophobicContact CB-CE 3.83Å
283	Y	90	Very high	93.4	Very high	13 Å²	13	50 Å²	50	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-49.1	175.9	179.5	-95.4	0	0	0	111.9	N281 R285 E286 A287 F323 M326 E328 T331	N281-Y283 PolarHBondContact O-N 3.19Å; N281-Y283 PolarHBondContact OD1-N 3.04Å; Y283-R285 VanDerWaalsContact C-N 3.33Å; Y283-R285 PolarHBondContact O-N 3.49Å; Y283-E286 PolarHBondContact O-N 2.94Å; Y283-A287 WeakPolarHBondContact O-CB 3.48Å; Y283-A287 PolarHBondContact O-N 3.39Å; Y283-F323 HydrophobicContact CD2-CD2 4.36Å; Y283-F323 AromaticContact CD2-CE2 3.69Å; Y283-F323 HydrophobicContact CD2-CE2 3.69Å; Y283-F323 HydrophobicContact CD2-CZ 4.38Å; Y283-F323 HydrophobicContact CE1-CE2 4.35Å; Y283-F323 HydrophobicContact CE1-CZ 4.44Å; Y283-F323 HydrophobicContact CE2-CD2 4.2Å; Y283-F323 AromaticContact CE2-CE2 3.28Å; Y283-F323 HydrophobicContact CE2-CE2 3.28Å; Y283-F323 AromaticContact CE2-CZ 3.53Å; Y283-F323 HydrophobicContact CE2-CZ 3.53Å; Y283-F323 HydrophobicContact CG-CE2 4.35Å; Y283-F323 AromaticContact CZ-CE2 3.69Å; Y283-F323 AromaticContact CZ-CZ 3.59Å; Y283-M326 HydrophobicContact CD2-CB 4.39Å; Y283-E328 HydrophobicContact CE2-CG 4.35Å; Y283-T331 HydrophobicContact CD1-CG2 3.29Å; Y283-T331 HydrophobicContact CE1-CG2 3.52Å; Y283-T331 HydrophobicContact CG-CG2 3.84Å
284	H	91.7	Very high	93.4	Very high	3 Å²	3	43.9 Å²	43.9	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-41.2	176.7	-71.3	166.2	0	0	0	112.2	Y242 F278 N281 E286 A287 L288 E338	Y242-H284 HydrophobicContact CD2-CB 3.48Å; Y242-H284 VanDerWaalsContact CD2-CB 3.48Å; Y242-H284 AromaticContact CD2-CG 3.84Å; Y242-H284 AromaticContact CE1-CD2 3.93Å; Y242-H284 HydrophobicContact CE2-CB 3.93Å; Y242-H284 HydrophobicContact CG-CB 3.83Å; Y242-H284 AromaticContact CG-CG 3.8Å; Y242-H284 AromaticContact CZ-CD2 3.9Å; F278-H284 HydrophobicContact CE1-CB 4.12Å; F278-H284 HydrophobicContact CZ-CB 3.78Å; N281-H284 HydrophobicContact CB-CB 4.35Å; N281-H284 PolarHBondContact O-N 3.5Å; H284-E286 VanDerWaalsContact C-N 3.34Å; H284-E286 PolarHBondContact O-N 3.11Å; H284-A287 PolarHBondContact O-N 3.43Å; H284-L288 WeakPolarHBondContact O-CG 3.49Å; H284-L288 PolarHBondContact O-N 3Å; H284-E338 IonicContact CE1-OE2 2.62Å; H284-E338 IonicContact ND1-OE2 3.64Å
285	R	93.8	Very high	93.5	Very high	85 Å²	85	43.3 Å²	43.3	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-59.5	-46.9	175.9	-170	-179.7	179.5	-149	0.7	111.4	I275 F278 N281 M282 Y283 L288 R289	I275-R285 HydrophobicContact CG2-CG 4.4Å; I275-R285 PolarHBondContact O-NE 3.31Å; I275-R285 VanDerWaalsContact O-NE 3.15Å; F278-R285 HydrophobicContact CB-CG 4.02Å; F278-R285 HydrophobicContact CD1-CB 3.53Å; F278-R285 HydrophobicContact CD1-CG 3.86Å; F278-R285 HydrophobicContact CE1-CB 3.84Å; F278-R285 HydrophobicContact CG-CB 4.16Å; F278-R285 HydrophobicContact CG-CG 4.07Å; N281-R285 PolarHBondContact O-N 2.65Å; M282-R285 PolarHBondContact O-N 2.65Å; Y283-R285 VanDerWaalsContact C-N 3.33Å; Y283-R285 PolarHBondContact O-N 3.49Å; R285-L288 PolarHBondContact O-N 2.81Å; R285-R289 WeakPolarHBondContact O-CB 3.42Å; R285-R289 PolarHBondContact O-N 3.47Å
286	E	93.6	Very high	93.6	Very high	14 Å²	14	44.5 Å²	44.5	7%	0.065	21%	0.211	C	C	.	.	H	α-helix	trans	-72.3	-36.4	-177.4	-162.8	60.4	-150.6	0	0	111.8	M282 Y283 H284 L288 R289 V290 S319 F323 M326	M282-E286 WeakPolarHBondContact O-CB 3.45Å; M282-E286 PolarHBondContact O-N 3.44Å; Y283-E286 PolarHBondContact O-N 2.94Å; H284-E286 VanDerWaalsContact C-N 3.34Å; H284-E286 PolarHBondContact O-N 3.11Å; E286-L288 PolarHBondContact O-N 2.91Å; E286-R289 WeakPolarHBondContact O-CB 3.36Å; E286-R289 PolarHBondContact O-N 3.3Å; E286-R289 VanDerWaalsContact O-N 3.13Å; E286-R289 WeakPolarHBondContact OE2-CD 3.4Å; E286-V290 WeakPolarHBondContact O-CG2 3.36Å; E286-V290 PolarHBondContact O-N 3.02Å; E286-S319 WeakPolarHBondContact OE1-CA 3.48Å; E286-S319 WeakPolarHBondContact OE1-CB 3.39Å; E286-S319 PolarHBondContact OE1-OG 2.99Å; E286-F323 HydrophobicContact CB-CD2 4.01Å; E286-F323 HydrophobicContact CG-CB 3.89Å; E286-F323 HydrophobicContact CG-CD2 4Å; E286-F323 HydrophobicContact CG-CG 4.41Å; E286-M326 HydrophobicContact CB-SD 4.06Å; E286-M326 HydrophobicContact CG-SD 4.23Å
287	A	93.6	Very high	93.7	Very high	8 Å²	8	38.1 Å²	38.1	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-59	-45.8	172.3	0	0	0	0	0	112.1	Y242 Y283 H284 R289 V290 F291 F323	Y242-A287 HydrophobicContact CE2-CB 4.4Å; Y283-A287 WeakPolarHBondContact O-CB 3.48Å; Y283-A287 PolarHBondContact O-N 3.39Å; H284-A287 PolarHBondContact O-N 3.43Å; A287-R289 VanDerWaalsContact C-N 3.32Å; A287-R289 PolarHBondContact O-N 2.85Å; A287-V290 PolarHBondContact O-N 3.3Å; A287-F291 PolarHBondContact O-N 3.3Å; A287-F291 VanDerWaalsContact O-N 3.13Å; A287-F323 HydrophobicContact CB-CE2 3.77Å; A287-F323 HydrophobicContact CB-CZ 4.05Å
288	L	95.9	Very high	93.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-39.4	173.5	-72.1	179.8	0	0	0	112	Y242 L246 L249 L274 I275 F278 H284 R285 E286 F291 Y292	Y242-L288 HydrophobicContact CD2-CD1 3.88Å; Y242-L288 HydrophobicContact CD2-CD2 4.06Å; Y242-L288 HydrophobicContact CD2-CG 3.69Å; Y242-L288 HydrophobicContact CE2-CD2 4.11Å; Y242-L288 HydrophobicContact CE2-CG 3.94Å; L246-L288 HydrophobicContact CD2-CD2 3.82Å; L246-L288 HydrophobicContact CG-CD2 4.04Å; L249-L288 HydrophobicContact CD1-CB 4.48Å; L249-L288 HydrophobicContact CD1-CD2 3.81Å; L274-L288 HydrophobicContact CD2-CD1 4.07Å; I275-L288 HydrophobicContact CD1-CB 4.23Å; I275-L288 HydrophobicContact CG1-CB 4.2Å; F278-L288 HydrophobicContact CD2-CD1 4.24Å; F278-L288 HydrophobicContact CE2-CD1 3.88Å; H284-L288 WeakPolarHBondContact O-CG 3.49Å; H284-L288 PolarHBondContact O-N 3Å; R285-L288 PolarHBondContact O-N 2.81Å; E286-L288 PolarHBondContact O-N 2.91Å; L288-F291 PolarHBondContact O-N 3.3Å; L288-Y292 VanDerWaalsContact O-CB 3.27Å; L288-Y292 WeakPolarHBondContact O-CB 3.31Å; L288-Y292 PolarHBondContact O-N 3.46Å
289	R	96.5	Very high	94	Very high	79 Å²	79	33.6 Å²	33.6	30%	0.298	16%	0.162	S	C	.	.	H	α-helix	trans	-62.3	-45.8	178.2	-174.1	178.6	174.8	81.3	5	111.7	I275 R285 E286 A287 Y292 L293	I275-R289 HydrophobicContact CG2-CB 4.42Å; R285-R289 WeakPolarHBondContact O-CB 3.42Å; R285-R289 PolarHBondContact O-N 3.47Å; E286-R289 WeakPolarHBondContact O-CB 3.36Å; E286-R289 PolarHBondContact O-N 3.3Å; E286-R289 VanDerWaalsContact O-N 3.13Å; E286-R289 WeakPolarHBondContact OE2-CD 3.4Å; A287-R289 VanDerWaalsContact C-N 3.32Å; A287-R289 PolarHBondContact O-N 2.85Å; R289-Y292 PolarHBondContact O-N 3.48Å; R289-L293 HydrophobicContact CG-CD1 3.85Å; R289-L293 HydrophobicContact CG-CG 4.39Å; R289-L293 WeakPolarHBondContact O-CB 3.33Å; R289-L293 WeakPolarHBondContact O-CG 3.32Å; R289-L293 PolarHBondContact O-N 3.1Å
290	V	97	Very high	94.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-48.4	175.2	172.3	0	0	0	0	110.4	E286 A287 L293 V294 L316 S319 I320 F323 M348	E286-V290 WeakPolarHBondContact O-CG2 3.36Å; E286-V290 PolarHBondContact O-N 3.02Å; A287-V290 PolarHBondContact O-N 3.3Å; V290-L293 PolarHBondContact O-N 3.2Å; V290-V294 HydrophobicContact CG1-CG2 4.48Å; V290-V294 WeakPolarHBondContact O-CG2 3.49Å; V290-V294 PolarHBondContact O-N 2.96Å; V290-L316 HydrophobicContact CG1-CD1 4.17Å; V290-S319 VanDerWaalsContact CG2-OG 3.27Å; V290-S319 WeakPolarHBondContact CG2-OG 3.4Å; V290-I320 HydrophobicContact CG1-CD1 4.04Å; V290-I320 HydrophobicContact CG2-CD1 4.29Å; V290-F323 HydrophobicContact CG2-CB 4.17Å; V290-F323 HydrophobicContact CG2-CG 4.37Å; V290-M348 HydrophobicContact CG1-SD 3.96Å
291	F	97.9	Very high	95	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-46.8	179.8	-173.4	-173.1	0	0	0	111.9	L246 L249 A287 L288 L293 V294 L295 W342	L246-F291 HydrophobicContact CD2-CD1 4.34Å; L249-F291 HydrophobicContact CB-CD1 3.55Å; L249-F291 HydrophobicContact CB-CD2 4.39Å; L249-F291 HydrophobicContact CB-CE1 3.38Å; L249-F291 HydrophobicContact CB-CE2 4.24Å; L249-F291 HydrophobicContact CB-CG 4.07Å; L249-F291 HydrophobicContact CB-CZ 3.75Å; L249-F291 HydrophobicContact CD1-CB 3.91Å; L249-F291 HydrophobicContact CD1-CD1 3.61Å; L249-F291 HydrophobicContact CD1-CE1 4.33Å; L249-F291 HydrophobicContact CD1-CG 3.82Å; L249-F291 HydrophobicContact CG-CD1 4.17Å; L249-F291 HydrophobicContact CG-CE1 4.47Å; L249-F291 HydrophobicContact CG-CG 4.41Å; A287-F291 PolarHBondContact O-N 3.3Å; A287-F291 VanDerWaalsContact O-N 3.13Å; L288-F291 PolarHBondContact O-N 3.3Å; F291-L293 PolarHBondContact O-N 2.82Å; F291-V294 PolarHBondContact O-N 3.49Å; F291-L295 HydrophobicContact CD2-CD1 4.01Å; F291-L295 HydrophobicContact CD2-CG 3.94Å; F291-L295 HydrophobicContact CE2-CD1 3.62Å; F291-L295 HydrophobicContact CE2-CD2 4.06Å; F291-L295 HydrophobicContact CE2-CG 3.78Å; F291-L295 HydrophobicContact CZ-CD1 4.3Å; F291-L295 PolarHBondContact O-N 3.4Å; F291-L295 VanDerWaalsContact O-N 3.1Å; F291-W342 HydrophobicContact CB-CD2 4.18Å; F291-W342 HydrophobicContact CB-CE3 3.53Å; F291-W342 HydrophobicContact CB-CZ3 3.75Å; F291-W342 HydrophobicContact CD1-CB 4.04Å; F291-W342 AromaticContact CD1-CD2 3.77Å; F291-W342 HydrophobicContact CD1-CD2 3.77Å; F291-W342 HydrophobicContact CD1-CE3 4.03Å; F291-W342 AromaticContact CD1-CG 3.79Å; F291-W342 HydrophobicContact CD1-CG 3.79Å; F291-W342 AromaticContact CD2-CD2 3.61Å; F291-W342 HydrophobicContact CD2-CD2 3.61Å; F291-W342 AromaticContact CD2-CE2 3.54Å; F291-W342 AromaticContact CD2-CE3 3.62Å; F291-W342 HydrophobicContact CD2-CE3 3.62Å; F291-W342 HydrophobicContact CD2-CG 4.39Å; F291-W342 AromaticContact CD2-CH2 3.52Å; F291-W342 HydrophobicContact CD2-CH2 3.52Å; F291-W342 AromaticContact CD2-CZ2 3.51Å; F291-W342 HydrophobicContact CD2-CZ2 3.51Å; F291-W342 AromaticContact CD2-CZ3 3.58Å; F291-W342 HydrophobicContact CD2-CZ3 3.58Å; F291-W342 HydrophobicContact CE1-CB 4.21Å; F291-W342 AromaticContact CE1-CD1 3.82Å; F291-W342 AromaticContact CE1-CD2 3.97Å; F291-W342 HydrophobicContact CE1-CD2 3.97Å; F291-W342 AromaticContact CE1-CG 3.74Å; F291-W342 HydrophobicContact CE1-CG 3.74Å; F291-W342 AromaticContact CE2-CD2 3.83Å; F291-W342 HydrophobicContact CE2-CD2 3.83Å; F291-W342 AromaticContact CE2-CE2 3.38Å; F291-W342 HydrophobicContact CE2-CE3 4.31Å; F291-W342 HydrophobicContact CE2-CG 4.37Å; F291-W342 HydrophobicContact CE2-CH2 4Å; F291-W342 AromaticContact CE2-CZ2 3.49Å; F291-W342 HydrophobicContact CE2-CZ2 3.49Å; F291-W342 VanDerWaalsContact CE2-CZ2 3.49Å; F291-W342 HydrophobicContact CE2-CZ3 4.39Å; F291-W342 AromaticContact CE2-NE1 3.71Å; F291-W342 AromaticContact CG-CD2 3.6Å; F291-W342 HydrophobicContact CG-CD2 3.6Å; F291-W342 AromaticContact CG-CE3 3.47Å; F291-W342 HydrophobicContact CG-CE3 3.47Å; F291-W342 VanDerWaalsContact CG-CE3 3.47Å; F291-W342 HydrophobicContact CG-CG 4.14Å; F291-W342 HydrophobicContact CG-CH2 4.23Å; F291-W342 HydrophobicContact CG-CZ2 4.35Å; F291-W342 AromaticContact CG-CZ3 3.81Å; F291-W342 HydrophobicContact CG-CZ3 3.81Å; F291-W342 AromaticContact CZ-CD1 3.81Å; F291-W342 HydrophobicContact CZ-CD2 4.02Å; F291-W342 AromaticContact CZ-CE2 3.74Å; F291-W342 HydrophobicContact CZ-CG 4.06Å; F291-W342 HydrophobicContact CZ-CZ2 4.29Å; F291-W342 AromaticContact CZ-NE1 3.6Å
292	Y	98.1	Very high	95.2	Very high	27 Å²	27	25.2 Å²	25.2	11%	0.106	11%	0.114	C	C	.	.	H	α-helix	trans	-54.2	-50	173	165.8	-99.4	0	0	0	112.2	L268 V271 I275 L288 R289 V294 L295 H296	L268-Y292 HydrophobicContact CB-CE2 4.2Å; L268-Y292 HydrophobicContact CD2-CD2 3.84Å; L268-Y292 HydrophobicContact CD2-CE2 3.79Å; L268-Y292 WeakPolarHBondContact O-CE2 3.35Å; V271-Y292 HydrophobicContact CB-CD2 4.32Å; V271-Y292 HydrophobicContact CG1-CD2 3.98Å; V271-Y292 HydrophobicContact CG1-CG 4.47Å; I275-Y292 HydrophobicContact CD1-CD1 4.41Å; I275-Y292 HydrophobicContact CD1-CG 3.98Å; L288-Y292 VanDerWaalsContact O-CB 3.27Å; L288-Y292 WeakPolarHBondContact O-CB 3.31Å; L288-Y292 PolarHBondContact O-N 3.46Å; R289-Y292 PolarHBondContact O-N 3.48Å; Y292-V294 PolarHBondContact O-N 2.86Å; Y292-L295 PolarHBondContact O-N 2.81Å; Y292-H296 AromaticContact CE1-ND1 3.91Å; Y292-H296 AromaticContact CZ-ND1 3.5Å; Y292-H296 VanDerWaalsContact O-CB 3.31Å; Y292-H296 WeakPolarHBondContact O-CB 3.37Å; Y292-H296 PolarHBondContact O-N 3.43Å; Y292-H296 PolarHBondContact OH-CE1 3.38Å; Y292-H296 PolarHBondContact OH-ND1 3.23Å
293	L	98.2	Very high	95.4	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.2	-38.1	-177.4	-72.2	171.5	0	0	0	111.9	R289 V290 F291 H296 V297 I312 Q315 L316	R289-L293 HydrophobicContact CG-CD1 3.85Å; R289-L293 HydrophobicContact CG-CG 4.39Å; R289-L293 WeakPolarHBondContact O-CB 3.33Å; R289-L293 WeakPolarHBondContact O-CG 3.32Å; R289-L293 PolarHBondContact O-N 3.1Å; V290-L293 PolarHBondContact O-N 3.2Å; F291-L293 PolarHBondContact O-N 2.82Å; L293-H296 PolarHBondContact O-N 3.32Å; L293-V297 VanDerWaalsContact O-CG2 3.29Å; L293-V297 WeakPolarHBondContact O-CG2 3.37Å; L293-V297 PolarHBondContact O-N 2.89Å; L293-I312 HydrophobicContact CD2-CG2 3.66Å; L293-Q315 HydrophobicContact CD1-CB 4.18Å; L293-Q315 HydrophobicContact CD2-CB 4.07Å; L293-L316 HydrophobicContact CB-CB 4Å; L293-L316 HydrophobicContact CB-CD1 3.76Å; L293-L316 HydrophobicContact CB-CG 4.35Å; L293-L316 HydrophobicContact CD1-CB 4.41Å
294	V	97.9	Very high	95.5	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.03	9%	0.092	C	C	.	.	H	α-helix	trans	-60.7	-46.8	174.1	170.6	0	0	0	0	111.1	V290 F291 Y292 S298 L316 W342 L351 V352 V355	V290-V294 HydrophobicContact CG1-CG2 4.48Å; V290-V294 WeakPolarHBondContact O-CG2 3.49Å; V290-V294 PolarHBondContact O-N 2.96Å; F291-V294 PolarHBondContact O-N 3.49Å; Y292-V294 PolarHBondContact O-N 2.86Å; V294-S298 VanDerWaalsContact O-CB 3.3Å; V294-S298 WeakPolarHBondContact O-CB 3.44Å; V294-S298 PolarHBondContact O-N 3.47Å; V294-S298 PolarHBondContact O-OG 3.06Å; V294-L316 HydrophobicContact CG2-CD1 3.81Å; V294-L316 HydrophobicContact CG2-CD2 3.87Å; V294-W342 HydrophobicContact CB-CH2 4.15Å; V294-W342 HydrophobicContact CG1-CH2 4.02Å; V294-W342 HydrophobicContact CG2-CH2 4.36Å; V294-L351 HydrophobicContact CG1-CD2 3.9Å; V294-L351 HydrophobicContact CG1-CG 4.2Å; V294-V352 HydrophobicContact CG2-CG2 4.48Å; V294-V355 HydrophobicContact CG1-CG2 4.47Å
295	L	97.5	Very high	95.5	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.047	11%	0.106	C	C	.	.	H	α-helix	trans	-65.8	-40.6	178.2	-67.6	-175.6	0	0	0	112	L249 C252 M253 L256 L268 F291 Y292 S298 F299	L249-L295 HydrophobicContact CB-CD1 4.26Å; L249-L295 HydrophobicContact CD2-CD1 3.86Å; L249-L295 VanDerWaalsContact O-CD1 3.25Å; L249-L295 WeakPolarHBondContact O-CD1 3.22Å; C252-L295 HydrophobicContact CB-CD1 3.9Å; M253-L295 HydrophobicContact CB-CD1 4.24Å; M253-L295 HydrophobicContact CB-CD2 3.91Å; M253-L295 HydrophobicContact CG-CD2 4.13Å; L256-L295 HydrophobicContact CD2-CD2 4.41Å; L268-L295 HydrophobicContact CD2-CB 4.48Å; F291-L295 HydrophobicContact CD2-CD1 4.01Å; F291-L295 HydrophobicContact CD2-CG 3.94Å; F291-L295 HydrophobicContact CE2-CD1 3.62Å; F291-L295 HydrophobicContact CE2-CD2 4.06Å; F291-L295 HydrophobicContact CE2-CG 3.78Å; F291-L295 HydrophobicContact CZ-CD1 4.3Å; F291-L295 PolarHBondContact O-N 3.4Å; F291-L295 VanDerWaalsContact O-N 3.1Å; Y292-L295 PolarHBondContact O-N 2.81Å; L295-S298 PolarHBondContact O-N 3.27Å; L295-F299 WeakPolarHBondContact O-CB 3.35Å; L295-F299 PolarHBondContact O-N 2.92Å
296	H	97.4	Very high	95.4	Very high	31 Å²	31	19.3 Å²	19.3	14%	0.144	9%	0.09	C	C	.	.	H	α-helix	trans	-66.7	-41.6	-179.6	-163.9	176.8	0	0	0	111.8	L268 Y292 L293 F299 Y300 I312	L268-H296 HydrophobicContact CD1-CB 4.48Å; L268-H296 HydrophobicContact CD2-CB 4.45Å; Y292-H296 AromaticContact CE1-ND1 3.91Å; Y292-H296 AromaticContact CZ-ND1 3.5Å; Y292-H296 VanDerWaalsContact O-CB 3.31Å; Y292-H296 WeakPolarHBondContact O-CB 3.37Å; Y292-H296 PolarHBondContact O-N 3.43Å; Y292-H296 PolarHBondContact OH-CE1 3.38Å; Y292-H296 PolarHBondContact OH-ND1 3.23Å; L293-H296 PolarHBondContact O-N 3.32Å; H296-F299 WeakPolarHBondContact O-CB 3.3Å; H296-F299 PolarHBondContact O-N 3.39Å; H296-Y300 AromaticContact CD2-CD2 3.96Å; H296-Y300 AromaticContact CD2-CE2 3.51Å; H296-Y300 AromaticContact NE2-CE2 3.39Å; H296-Y300 WeakPolarHBondContact NE2-CE2 3.4Å; H296-Y300 VanDerWaalsContact O-CD2 3.32Å; H296-Y300 WeakPolarHBondContact O-CD2 3.48Å; H296-Y300 PolarHBondContact O-N 3.21Å; H296-I312 HydrophobicContact CB-CG2 4.14Å
297	V	97.6	Very high	95.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.7	-44.7	171.8	176.2	0	0	0	0	110.5	L293 F299 Y300 L301 A309 I312 L313 L316 V355	L293-V297 VanDerWaalsContact O-CG2 3.29Å; L293-V297 WeakPolarHBondContact O-CG2 3.37Å; L293-V297 PolarHBondContact O-N 2.89Å; V297-F299 VanDerWaalsContact C-N 3.29Å; V297-F299 PolarHBondContact O-N 2.87Å; V297-Y300 PolarHBondContact O-N 3.34Å; V297-L301 HydrophobicContact CG1-CD1 3.9Å; V297-L301 HydrophobicContact CG1-CG 4.14Å; V297-L301 WeakPolarHBondContact O-CG 3.38Å; V297-L301 PolarHBondContact O-N 2.93Å; V297-A309 HydrophobicContact CG1-CB 4.3Å; V297-I312 HydrophobicContact CG2-CB 3.98Å; V297-I312 HydrophobicContact CG2-CG2 3.65Å; V297-L313 HydrophobicContact CG2-CB 4.14Å; V297-L316 HydrophobicContact CG2-CD2 4.43Å; V297-V355 HydrophobicContact CB-CG1 4.02Å; V297-V355 HydrophobicContact CG1-CG1 3.29Å
298	S	96.4	Very high	95.3	Very high	26 Å²	26	24.6 Å²	24.6	18%	0.182	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-36.8	-179.9	-59.5	0	0	0	0	112.5	V294 L295 L301 I302	V294-S298 VanDerWaalsContact O-CB 3.3Å; V294-S298 WeakPolarHBondContact O-CB 3.44Å; V294-S298 PolarHBondContact O-N 3.47Å; V294-S298 PolarHBondContact O-OG 3.06Å; L295-S298 PolarHBondContact O-N 3.27Å; S298-L301 PolarHBondContact O-N 3.37Å; S298-I302 VanDerWaalsContact O-CB 3.32Å; S298-I302 WeakPolarHBondContact O-CB 3.1Å; S298-I302 VanDerWaalsContact O-CG1 3.3Å; S298-I302 WeakPolarHBondContact O-CG1 3.2Å; S298-I302 PolarHBondContact O-N 3.27Å
299	F	96.1	Very high	95.3	Very high	26 Å²	26	24.6 Å²	24.6	11%	0.114	12%	0.117	C	C	.	.	H	α-helix	trans	-56.7	-48.4	173.4	169.1	-101.2	0	0	0	112.5	L256 L261 V264 L295 H296 V297 S303	L256-F299 HydrophobicContact CD1-CB 4.16Å; L256-F299 HydrophobicContact CD1-CD2 4.24Å; L261-F299 HydrophobicContact CB-CE2 4.13Å; L261-F299 HydrophobicContact CD2-CD2 4.14Å; L261-F299 HydrophobicContact CD2-CE2 3.96Å; V264-F299 HydrophobicContact CB-CD2 4.29Å; V264-F299 HydrophobicContact CB-CE2 4.42Å; V264-F299 HydrophobicContact CG1-CB 4.48Å; V264-F299 HydrophobicContact CG1-CD2 3.6Å; V264-F299 HydrophobicContact CG1-CE2 4.11Å; V264-F299 HydrophobicContact CG1-CG 4.21Å; L295-F299 WeakPolarHBondContact O-CB 3.35Å; L295-F299 PolarHBondContact O-N 2.92Å; H296-F299 WeakPolarHBondContact O-CB 3.3Å; H296-F299 PolarHBondContact O-N 3.39Å; V297-F299 VanDerWaalsContact C-N 3.29Å; V297-F299 PolarHBondContact O-N 2.87Å; F299-S303 PolarHBondContact O-N 3.27Å; F299-S303 PolarHBondContact O-OG 3.17Å
300	Y	95.6	Very high	95.2	Very high	54 Å²	54	23.4 Å²	23.4	21%	0.212	12%	0.115	C	C	.	.	H	α-helix	trans	-66.7	-42.7	176.3	-76.5	-66.4	0	0	0	112.4	H296 V297 I302 S303 G304 Q305 I312	H296-Y300 AromaticContact CD2-CD2 3.96Å; H296-Y300 AromaticContact CD2-CE2 3.51Å; H296-Y300 AromaticContact NE2-CE2 3.39Å; H296-Y300 WeakPolarHBondContact NE2-CE2 3.4Å; H296-Y300 VanDerWaalsContact O-CD2 3.32Å; H296-Y300 WeakPolarHBondContact O-CD2 3.48Å; H296-Y300 PolarHBondContact O-N 3.21Å; V297-Y300 PolarHBondContact O-N 3.34Å; Y300-I302 VanDerWaalsContact C-N 3.34Å; Y300-I302 PolarHBondContact O-N 3.38Å; Y300-S303 CarbonylContact O-C 3.59Å; Y300-S303 WeakPolarHBondContact O-CA 3.49Å; Y300-S303 WeakPolarHBondContact O-CB 3.44Å; Y300-S303 PolarHBondContact O-N 2.92Å; Y300-S303 VanDerWaalsContact O-N 3.11Å; Y300-G304 PolarHBondContact O-N 2.8Å; Y300-G304 VanDerWaalsContact O-N 3.08Å; Y300-Q305 HydrophobicContact CD1-CB 3.93Å; Y300-Q305 VanDerWaalsContact CD1-OE1 3.22Å; Y300-Q305 PolarHBondContact O-N 3.12Å; Y300-I312 HydrophobicContact CD2-CD1 3.66Å; Y300-I312 HydrophobicContact CE2-CD1 3.25Å
301	L	94.2	Very high	95.2	Very high	6 Å²	6	26.3 Å²	26.3	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-37.7	179.6	-66.7	-179.2	0	0	0	113.1	V297 S298 S303 G304 A309 V355 M358 Q359 Q362	V297-L301 HydrophobicContact CG1-CD1 3.9Å; V297-L301 HydrophobicContact CG1-CG 4.14Å; V297-L301 WeakPolarHBondContact O-CG 3.38Å; V297-L301 PolarHBondContact O-N 2.93Å; S298-L301 PolarHBondContact O-N 3.37Å; L301-S303 VanDerWaalsContact C-N 3.28Å; L301-G304 PolarHBondContact O-N 3.02Å; L301-G304 VanDerWaalsContact O-N 3.14Å; L301-A309 HydrophobicContact CD2-CB 4.08Å; L301-A309 HydrophobicContact CG-CB 4.44Å; L301-V355 HydrophobicContact CD1-CG1 3.99Å; L301-M358 HydrophobicContact CD1-CB 3.86Å; L301-Q359 HydrophobicContact CD1-CB 4.34Å; L301-Q359 HydrophobicContact CD2-CB 3.76Å; L301-Q359 HydrophobicContact CD2-CG 3.98Å; L301-Q362 PolarHBondContact O-NE2 3.03Å
302	I	91.9	Very high	95.2	Very high	45 Å²	45	27.1 Å²	27.1	23%	0.231	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-36.3	174.4	-78.4	168.2	0	0	0	110.9	L256 S298 Y300 G304	L256-I302 HydrophobicContact CD1-CD1 3.65Å; L256-I302 HydrophobicContact CD2-CD1 4Å; L256-I302 HydrophobicContact CG-CD1 3.64Å; S298-I302 VanDerWaalsContact O-CB 3.32Å; S298-I302 WeakPolarHBondContact O-CB 3.1Å; S298-I302 VanDerWaalsContact O-CG1 3.3Å; S298-I302 WeakPolarHBondContact O-CG1 3.2Å; S298-I302 PolarHBondContact O-N 3.27Å; Y300-I302 VanDerWaalsContact C-N 3.34Å; Y300-I302 PolarHBondContact O-N 3.38Å; I302-G304 PolarHBondContact O-N 3.33Å
303	S	92.3	Very high	95.2	Very high	10 Å²	10	25.9 Å²	25.9	7%	0.07	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-3.6	175.4	-51.6	0	0	0	0	113.3	F299 Y300 L301 Q305 G546 C547 C548	F299-S303 PolarHBondContact O-N 3.27Å; F299-S303 PolarHBondContact O-OG 3.17Å; Y300-S303 CarbonylContact O-C 3.59Å; Y300-S303 WeakPolarHBondContact O-CA 3.49Å; Y300-S303 WeakPolarHBondContact O-CB 3.44Å; Y300-S303 PolarHBondContact O-N 2.92Å; Y300-S303 VanDerWaalsContact O-N 3.11Å; L301-S303 VanDerWaalsContact C-N 3.28Å; S303-Q305 VanDerWaalsContact C-N 3.3Å; S303-G546 WeakPolarHBondContact CA-O 3.41Å; S303-C547 WeakPolarHBondContact O-CA 3.45Å; S303-C548 PolarHBondContact O-N 3.16Å; S303-C548 PolarHBondContact O-SG 3.33Å; S303-C548 VanDerWaalsContact O-SG 3.36Å
304	G	91.7	Very high	95.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	7.8	-176.1	0	0	0	0	0	114.8	Y300 L301 I302 A306 C548 C549	Y300-G304 PolarHBondContact O-N 2.8Å; Y300-G304 VanDerWaalsContact O-N 3.08Å; L301-G304 PolarHBondContact O-N 3.02Å; L301-G304 VanDerWaalsContact O-N 3.14Å; I302-G304 PolarHBondContact O-N 3.33Å; G304-A306 PolarHBondContact O-N 3.45Å; G304-A306 VanDerWaalsContact O-N 3.1Å; G304-C548 PolarHBondContact O-SG 3.12Å; G304-C549 PolarHBondContact O-SG 3.45Å
305	Q	93	Very high	95.1	Very high	64 Å²	64	36 Å²	36	30%	0.299	18%	0.175	S	C	.	.			trans	-91.3	67.7	-170.8	-62.1	-179.2	5.2	0	0	111.9	Y300 S303 K307 S308 A309 E585	Y300-Q305 HydrophobicContact CD1-CB 3.93Å; Y300-Q305 VanDerWaalsContact CD1-OE1 3.22Å; Y300-Q305 PolarHBondContact O-N 3.12Å; S303-Q305 VanDerWaalsContact C-N 3.3Å; Q305-K307 VanDerWaalsContact C-N 3.27Å; Q305-K307 PolarHBondContact O-N 3.28Å; Q305-S308 PolarHBondContact O-N 2.95Å; Q305-A309 WeakPolarHBondContact O-CB 3.41Å; Q305-A309 PolarHBondContact O-N 3.1Å; Q305-E585 VanDerWaalsContact CA-CD 3.47Å; Q305-E585 WeakPolarHBondContact CA-OE2 3.21Å; Q305-E585 HydrophobicContact CG-CG 4.44Å; Q305-E585 WeakPolarHBondContact CG-OE1 3.48Å
306	A	90.6	Very high	95.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-28.9	-173.3	0	0	0	0	0	113.6	G304 Q359 Q362 A363 E585	G304-A306 PolarHBondContact O-N 3.45Å; G304-A306 VanDerWaalsContact O-N 3.1Å; A306-Q359 PolarHBondContact O-NE2 2.89Å; A306-Q362 HydrophobicContact CB-CB 3.65Å; A306-A363 HydrophobicContact CB-CB 4.43Å; A306-E585 PolarHBondContact N-OE2 2.94Å
307	K	92.9	Very high	95.1	Very high	89 Å²	89	36.2 Å²	36.2	39%	0.387	18%	0.175	S	C	.	.	H	α-helix	trans	-72.8	-47.3	176.8	179.4	-178.7	-179	153.4	0	110.6	Q305 A309 H310 P311 E585 E586	Q305-K307 VanDerWaalsContact C-N 3.27Å; Q305-K307 PolarHBondContact O-N 3.28Å; K307-A309 PolarHBondContact O-N 3.18Å; K307-H310 VanDerWaalsContact O-CB 3.27Å; K307-H310 WeakPolarHBondContact O-CB 3.42Å; K307-H310 PolarHBondContact O-N 3.15Å; K307-P311 WeakPolarHBondContact O-CD 3.42Å; K307-E585 WeakPolarHBondContact CB-OE2 3.48Å; K307-E585 PolarHBondContact N-OE2 3.38Å; K307-E586 HydrophobicContact CD-CG 4.02Å; K307-E586 WeakPolarHBondContact CD-OE1 3.38Å; K307-E586 WeakPolarHBondContact CE-OE1 3.2Å; K307-E586 IonicContact NZ-OE1 2.64Å; K307-E586 PolarHBondContact NZ-OE1 3Å
308	S	93.1	Very high	95.1	Very high	44 Å²	44	42.3 Å²	42.3	31%	0.308	20%	0.204	S	C	.	.	H	α-helix	trans	-63.3	-30.9	177.6	-59.1	0	0	0	0	112.4	Q305 H310 P311	Q305-S308 PolarHBondContact O-N 2.95Å; S308-H310 VanDerWaalsContact C-N 3.3Å; S308-H310 PolarHBondContact O-N 3.2Å; S308-P311 WeakPolarHBondContact O-CD 3.41Å
309	A	95.2	Very high	95.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-26.4	173.1	0	0	0	0	0	114	V297 L301 Q305 K307 I312 L313 Q359	V297-A309 HydrophobicContact CG1-CB 4.3Å; L301-A309 HydrophobicContact CD2-CB 4.08Å; L301-A309 HydrophobicContact CG-CB 4.44Å; Q305-A309 WeakPolarHBondContact O-CB 3.41Å; Q305-A309 PolarHBondContact O-N 3.1Å; K307-A309 PolarHBondContact O-N 3.18Å; A309-I312 PolarHBondContact O-N 3.31Å; A309-L313 WeakPolarHBondContact O-CB 3.49Å; A309-L313 PolarHBondContact O-N 3.38Å; A309-Q359 HydrophobicContact CB-CG 4.26Å
310	H	95	Very high	95	Very high	54 Å²	54	40.6 Å²	40.6	25%	0.25	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-46	-167	-174.2	84.8	0	0	0	114.9	K307 S308 I312 L313 R314	K307-H310 VanDerWaalsContact O-CB 3.27Å; K307-H310 WeakPolarHBondContact O-CB 3.42Å; K307-H310 PolarHBondContact O-N 3.15Å; S308-H310 VanDerWaalsContact C-N 3.3Å; S308-H310 PolarHBondContact O-N 3.2Å; H310-I312 VanDerWaalsContact C-N 3.29Å; H310-I312 PolarHBondContact O-N 2.76Å; H310-L313 PolarHBondContact O-N 2.96Å; H310-R314 PolarHBondContact O-N 2.82Å; H310-R314 VanDerWaalsContact O-N 3.09Å
311	P	96.8	Very high	95	Very high	62 Å²	62	44.6 Å²	44.6	40%	0.403	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-38.7	177.4	-23	34.8	0	0	0	112.8	K307 S308 R314 Q315	K307-P311 WeakPolarHBondContact O-CD 3.42Å; S308-P311 WeakPolarHBondContact O-CD 3.41Å; P311-R314 PolarHBondContact O-N 3.36Å; P311-Q315 PolarHBondContact O-N 2.93Å
312	I	97.5	Very high	94.9	Very high	18 Å²	18	49.8 Å²	49.8	9%	0.092	24%	0.238	C	C	.	.	H	α-helix	trans	-72.9	-38.4	-178.9	-55.8	167.2	0	0	0	110	L293 H296 V297 Y300 A309 H310 R314 Q315 L316	L293-I312 HydrophobicContact CD2-CG2 3.66Å; H296-I312 HydrophobicContact CB-CG2 4.14Å; V297-I312 HydrophobicContact CG2-CB 3.98Å; V297-I312 HydrophobicContact CG2-CG2 3.65Å; Y300-I312 HydrophobicContact CD2-CD1 3.66Å; Y300-I312 HydrophobicContact CE2-CD1 3.25Å; A309-I312 PolarHBondContact O-N 3.31Å; H310-I312 VanDerWaalsContact C-N 3.29Å; H310-I312 PolarHBondContact O-N 2.76Å; I312-R314 VanDerWaalsContact C-N 3.28Å; I312-R314 PolarHBondContact O-N 2.96Å; I312-Q315 CarbonylContact O-C 3.55Å; I312-Q315 WeakPolarHBondContact O-CA 3.38Å; I312-Q315 WeakPolarHBondContact O-CB 3.49Å; I312-Q315 PolarHBondContact O-N 3.1Å; I312-Q315 VanDerWaalsContact O-N 3.08Å; I312-L316 PolarHBondContact O-N 3.48Å
313	L	97.3	Very high	94.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-37.4	173.2	-179	59.7	0	0	0	112	V297 A309 H310 L316 H317 V355 T356 Q359	V297-L313 HydrophobicContact CG2-CB 4.14Å; A309-L313 WeakPolarHBondContact O-CB 3.49Å; A309-L313 PolarHBondContact O-N 3.38Å; H310-L313 PolarHBondContact O-N 2.96Å; L313-L316 HydrophobicContact CD1-CD2 4.15Å; L313-L316 WeakPolarHBondContact O-CB 3.45Å; L313-L316 PolarHBondContact O-N 3.34Å; L313-H317 PolarHBondContact O-N 2.88Å; L313-H317 PolarHBondContact O-ND1 3.46Å; L313-V355 HydrophobicContact CD1-CG1 4.3Å; L313-T356 HydrophobicContact CD2-CG2 4.46Å; L313-Q359 HydrophobicContact CD2-CB 3.81Å; L313-Q359 HydrophobicContact CD2-CG 3.85Å
314	R	97.4	Very high	94.8	Very high	140 Å²	140	49.5 Å²	49.5	53%	0.528	24%	0.244	S	C	.	.	H	α-helix	trans	-63.8	-40.5	172.8	-70.8	-169.1	-66.2	-179.9	-3	112.1	H310 P311 I312 L316 H317 Q318	H310-R314 PolarHBondContact O-N 2.82Å; H310-R314 VanDerWaalsContact O-N 3.09Å; P311-R314 PolarHBondContact O-N 3.36Å; I312-R314 VanDerWaalsContact C-N 3.28Å; I312-R314 PolarHBondContact O-N 2.96Å; R314-L316 VanDerWaalsContact C-N 3.3Å; R314-L316 PolarHBondContact O-N 3.1Å; R314-H317 PolarHBondContact O-N 3.49Å; R314-Q318 WeakPolarHBondContact O-CG 3.19Å; R314-Q318 PolarHBondContact O-N 3.19Å; R314-Q318 VanDerWaalsContact O-N 3.12Å
315	Q	97.6	Very high	94.6	Very high	78 Å²	78	53.5 Å²	53.5	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-39.1	173.5	-64	179.9	24.8	0	0	111.3	L293 P311 I312 Q318 S319	L293-Q315 HydrophobicContact CD1-CB 4.18Å; L293-Q315 HydrophobicContact CD2-CB 4.07Å; P311-Q315 PolarHBondContact O-N 2.93Å; I312-Q315 CarbonylContact O-C 3.55Å; I312-Q315 WeakPolarHBondContact O-CA 3.38Å; I312-Q315 WeakPolarHBondContact O-CB 3.49Å; I312-Q315 PolarHBondContact O-N 3.1Å; I312-Q315 VanDerWaalsContact O-N 3.08Å; Q315-Q318 PolarHBondContact O-N 2.95Å; Q315-S319 WeakPolarHBondContact O-CB 3.41Å; Q315-S319 PolarHBondContact O-N 3.36Å
316	L	98.1	Very high	94.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-42.5	176	179.8	57.2	0	0	0	111.7	V290 L293 V294 V297 I312 L313 R314 Q318 S319 I320 V352	V290-L316 HydrophobicContact CG1-CD1 4.17Å; L293-L316 HydrophobicContact CB-CB 4Å; L293-L316 HydrophobicContact CB-CD1 3.76Å; L293-L316 HydrophobicContact CB-CG 4.35Å; L293-L316 HydrophobicContact CD1-CB 4.41Å; V294-L316 HydrophobicContact CG2-CD1 3.81Å; V294-L316 HydrophobicContact CG2-CD2 3.87Å; V297-L316 HydrophobicContact CG2-CD2 4.43Å; I312-L316 PolarHBondContact O-N 3.48Å; L313-L316 HydrophobicContact CD1-CD2 4.15Å; L313-L316 WeakPolarHBondContact O-CB 3.45Å; L313-L316 PolarHBondContact O-N 3.34Å; R314-L316 VanDerWaalsContact C-N 3.3Å; R314-L316 PolarHBondContact O-N 3.1Å; L316-Q318 PolarHBondContact O-N 3.21Å; L316-S319 PolarHBondContact O-N 2.89Å; L316-I320 WeakPolarHBondContact O-CG2 3.23Å; L316-I320 PolarHBondContact O-N 3.13Å; L316-V352 HydrophobicContact CD1-CG2 3.92Å; L316-V352 HydrophobicContact CD2-CG1 4.3Å; L316-V352 HydrophobicContact CD2-CG2 4.08Å; L316-V352 HydrophobicContact CG-CG1 4.15Å; L316-V352 HydrophobicContact CG-CG2 3.94Å
317	H	97.6	Very high	93.9	Very high	43 Å²	43	58.5 Å²	58.5	20%	0.199	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-41.7	175.4	-69.3	152.1	0	0	0	112.5	L313 R314 I320 Q321 T356	L313-H317 PolarHBondContact O-N 2.88Å; L313-H317 PolarHBondContact O-ND1 3.46Å; R314-H317 PolarHBondContact O-N 3.49Å; H317-I320 WeakPolarHBondContact O-CG2 3.5Å; H317-Q321 WeakPolarHBondContact O-CB 3.29Å; H317-Q321 WeakPolarHBondContact O-CG 3.49Å; H317-Q321 PolarHBondContact O-N 2.89Å; H317-T356 PolarHBondContact NE2-OG1 3.12Å
318	Q	96.6	Very high	92.8	Very high	128 Å²	128	59.2 Å²	59.2	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-66.3	-44.8	175.9	-69.4	171.7	-13.2	0	0	111.2	R314 Q315 L316 Q321 Q322	R314-Q318 WeakPolarHBondContact O-CG 3.19Å; R314-Q318 PolarHBondContact O-N 3.19Å; R314-Q318 VanDerWaalsContact O-N 3.12Å; Q315-Q318 PolarHBondContact O-N 2.95Å; L316-Q318 PolarHBondContact O-N 3.21Å; Q318-Q321 PolarHBondContact O-N 3.32Å; Q318-Q322 PolarHBondContact O-N 2.99Å
319	S	96.2	Very high	91.2	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-47.1	-178.9	178.7	0	0	0	0	112.2	E286 V290 Q315 L316 Q321 Q322 F323	E286-S319 WeakPolarHBondContact OE1-CA 3.48Å; E286-S319 WeakPolarHBondContact OE1-CB 3.39Å; E286-S319 PolarHBondContact OE1-OG 2.99Å; V290-S319 VanDerWaalsContact CG2-OG 3.27Å; V290-S319 WeakPolarHBondContact CG2-OG 3.4Å; Q315-S319 WeakPolarHBondContact O-CB 3.41Å; Q315-S319 PolarHBondContact O-N 3.36Å; L316-S319 PolarHBondContact O-N 2.89Å; S319-Q321 VanDerWaalsContact C-N 3.34Å; S319-Q321 PolarHBondContact O-N 2.98Å; S319-Q322 PolarHBondContact O-N 3.13Å; S319-F323 VanDerWaalsContact O-CB 3.32Å; S319-F323 WeakPolarHBondContact O-CB 3.5Å; S319-F323 PolarHBondContact O-N 3.14Å
320	I	95.2	Very high	89.3	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.072	36%	0.357	C	S	.	.	H	α-helix	trans	-68.3	-33	178.9	-165.2	63.7	0	0	0	112.6	V290 L316 H317 F323 A324 M348 V349 V352	V290-I320 HydrophobicContact CG1-CD1 4.04Å; V290-I320 HydrophobicContact CG2-CD1 4.29Å; L316-I320 WeakPolarHBondContact O-CG2 3.23Å; L316-I320 PolarHBondContact O-N 3.13Å; H317-I320 WeakPolarHBondContact O-CG2 3.5Å; I320-F323 HydrophobicContact CD1-CD1 4.23Å; I320-A324 WeakPolarHBondContact O-CB 3.44Å; I320-A324 PolarHBondContact O-N 3.09Å; I320-M348 HydrophobicContact CD1-CB 3.91Å; I320-V349 HydrophobicContact CD1-CG2 4.37Å; I320-V349 HydrophobicContact CG1-CG2 4.13Å; I320-V352 HydrophobicContact CB-CG2 4.2Å; I320-V352 HydrophobicContact CD1-CG2 4.48Å; I320-V352 HydrophobicContact CG1-CG2 4.12Å; I320-V352 HydrophobicContact CG2-CG1 4.17Å; I320-V352 HydrophobicContact CG2-CG2 4.38Å
321	Q	94.1	Very high	87.5	Confident	138 Å²	138	66.2 Å²	66.2	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-67	-43.2	175.9	-76.7	175.1	-10.4	0	0	111.2	H317 Q318 S319 A325	H317-Q321 WeakPolarHBondContact O-CB 3.29Å; H317-Q321 WeakPolarHBondContact O-CG 3.49Å; H317-Q321 PolarHBondContact O-N 2.89Å; Q318-Q321 PolarHBondContact O-N 3.32Å; S319-Q321 VanDerWaalsContact C-N 3.34Å; S319-Q321 PolarHBondContact O-N 2.98Å; Q321-A325 PolarHBondContact O-N 3.41Å
322	Q	92.6	Very high	85.5	Confident	114 Å²	114	69.3 Å²	69.3	53%	0.533	38%	0.376	S	S	.	.	H	α-helix	trans	-63	-50.5	173.8	-177.2	173.7	-6	0	0	110.6	Q318 S319 A324 A325 M326	Q318-Q322 PolarHBondContact O-N 2.99Å; S319-Q322 PolarHBondContact O-N 3.13Å; Q322-A324 VanDerWaalsContact C-N 3.32Å; Q322-A324 PolarHBondContact O-N 2.89Å; Q322-A325 PolarHBondContact O-N 2.97Å; Q322-A325 VanDerWaalsContact O-N 3.08Å; Q322-M326 WeakPolarHBondContact O-CG 3.42Å; Q322-M326 PolarHBondContact O-N 2.83Å
323	F	91.9	Very high	83.8	Confident	1 Å²	1	69.8 Å²	69.8	0%	0.004	38%	0.381	C	S	.	.	H	α-helix	trans	-56.6	-44.7	179.2	-172.7	-113.1	0	0	0	112.3	Y283 E286 A287 V290 S319 I320 A325 M326 R345 M348	Y283-F323 HydrophobicContact CD2-CD2 4.36Å; Y283-F323 AromaticContact CD2-CE2 3.69Å; Y283-F323 HydrophobicContact CD2-CE2 3.69Å; Y283-F323 HydrophobicContact CD2-CZ 4.38Å; Y283-F323 HydrophobicContact CE1-CE2 4.35Å; Y283-F323 HydrophobicContact CE1-CZ 4.44Å; Y283-F323 HydrophobicContact CE2-CD2 4.2Å; Y283-F323 AromaticContact CE2-CE2 3.28Å; Y283-F323 HydrophobicContact CE2-CE2 3.28Å; Y283-F323 AromaticContact CE2-CZ 3.53Å; Y283-F323 HydrophobicContact CE2-CZ 3.53Å; Y283-F323 HydrophobicContact CG-CE2 4.35Å; Y283-F323 AromaticContact CZ-CE2 3.69Å; Y283-F323 AromaticContact CZ-CZ 3.59Å; E286-F323 HydrophobicContact CB-CD2 4.01Å; E286-F323 HydrophobicContact CG-CB 3.89Å; E286-F323 HydrophobicContact CG-CD2 4Å; E286-F323 HydrophobicContact CG-CG 4.41Å; A287-F323 HydrophobicContact CB-CE2 3.77Å; A287-F323 HydrophobicContact CB-CZ 4.05Å; V290-F323 HydrophobicContact CG2-CB 4.17Å; V290-F323 HydrophobicContact CG2-CG 4.37Å; S319-F323 VanDerWaalsContact O-CB 3.32Å; S319-F323 WeakPolarHBondContact O-CB 3.5Å; S319-F323 PolarHBondContact O-N 3.14Å; I320-F323 HydrophobicContact CD1-CD1 4.23Å; F323-A325 PolarHBondContact O-N 2.68Å; F323-M326 PolarHBondContact O-N 3.27Å; F323-M326 VanDerWaalsContact O-N 3.14Å; F323-R345 HydrophobicContact CD1-CG 4.26Å; F323-R345 HydrophobicContact CE1-CB 4.41Å; F323-R345 HydrophobicContact CE1-CG 4.1Å; F323-R345 PolarHBondContact O-NH1 3.37Å; F323-M348 HydrophobicContact CD1-SD 4.35Å; F323-M348 HydrophobicContact CE1-CE 4.42Å; F323-M348 HydrophobicContact CE1-SD 3.85Å
324	A	89.5	Confident	82.2	Confident	49 Å²	49	76.6 Å²	76.6	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-27.2	179.5	0	0	0	0	0	113.4	I320 Q322 R345	I320-A324 WeakPolarHBondContact O-CB 3.44Å; I320-A324 PolarHBondContact O-N 3.09Å; Q322-A324 VanDerWaalsContact C-N 3.32Å; Q322-A324 PolarHBondContact O-N 2.89Å; A324-R345 VanDerWaalsContact C-NH1 3.31Å; A324-R345 PolarHBondContact O-NH1 3.35Å
325	A	88.9	Confident	81.2	Confident	83 Å²	83	72.4 Å²	72.4	69%	0.686	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-6.3	178.1	0	0	0	0	0	114.2	Q321 Q322 F323	Q321-A325 PolarHBondContact O-N 3.41Å; Q322-A325 PolarHBondContact O-N 2.97Å; Q322-A325 VanDerWaalsContact O-N 3.08Å; F323-A325 PolarHBondContact O-N 2.68Å
326	M	88.5	Confident	80.5	Confident	43 Å²	43	73.2 Å²	73.2	21%	0.212	42%	0.415	C	S	.	.	S	Bend	trans	-84.9	138.8	-179.4	-64.8	174.1	78	0	0	111.9	M282 Y283 E286 Q322 F323 R345	M282-M326 HydrophobicContact CB-CE 3.83Å; Y283-M326 HydrophobicContact CD2-CB 4.39Å; E286-M326 HydrophobicContact CB-SD 4.06Å; E286-M326 HydrophobicContact CG-SD 4.23Å; Q322-M326 WeakPolarHBondContact O-CG 3.42Å; Q322-M326 PolarHBondContact O-N 2.83Å; F323-M326 PolarHBondContact O-N 3.27Å; F323-M326 VanDerWaalsContact O-N 3.14Å; M326-R345 PolarHBondContact O-NH1 2.93Å; M326-R345 PolarHBondContact O-NH2 2.97Å; M326-R345 VanDerWaalsContact O-NH2 3.16Å
327	D	79.4	Confident	80	Confident	127 Å²	127	73.2 Å²	73.2	68%	0.679	42%	0.415	S	S	*	.			trans	-73.9	134	176.3	-70.7	-37.5	0	0	0	111.9	A329	D327-A329 VanDerWaalsContact C-N 3.33Å
328	E	69.6	Low	79.5	Confident	104 Å²	104	72.8 Å²	72.8	49%	0.486	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-76.4	-18.9	177.6	-64.6	-173.3	172.3	0	0	112.8	Y283 D330 T331 R345	Y283-E328 HydrophobicContact CE2-CG 4.35Å; E328-D330 PolarHBondContact O-N 3.36Å; E328-D330 VanDerWaalsContact O-N 3.09Å; E328-T331 WeakPolarHBondContact O-CB 3.4Å; E328-T331 WeakPolarHBondContact O-CG2 3.39Å; E328-T331 PolarHBondContact O-N 3.1Å; E328-T331 PolarHBondContact O-OG1 3.26Å; E328-R345 IonicContact OE1-CZ 3.35Å; E328-R345 IonicContact OE1-NE 2.66Å; E328-R345 PolarHBondContact OE1-NE 2.83Å; E328-R345 IonicContact OE1-NH2 3.18Å; E328-R345 PolarHBondContact OE1-NH2 3.06Å
329	A	61.2	Low	79.1	Confident	83 Å²	83	72.8 Å²	72.8	69%	0.686	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-61.5	-24.1	-175	0	0	0	0	0	113.5	D327 T331	D327-A329 VanDerWaalsContact C-N 3.33Å; A329-T331 PolarHBondContact O-N 3.36Å
330	D	54.2	Low	78.9	Confident	119 Å²	119	73.8 Å²	73.8	64%	0.636	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-75.8	2.3	177.1	-73.7	-17	0	0	0	113.6	N281 E328 T332	N281-D330 PolarHBondContact ND2-O 2.67Å; E328-D330 PolarHBondContact O-N 3.36Å; E328-D330 VanDerWaalsContact O-N 3.09Å; D330-T332 VanDerWaalsContact C-N 3.31Å; D330-T332 PolarHBondContact O-N 3.34Å
331	T	58.1	Low	78.7	Confident	43 Å²	43	77.8 Å²	77.8	26%	0.264	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-86.1	15.1	178.2	64.8	0	0	0	0	114.6	Y283 E328 A329 S333	Y283-T331 HydrophobicContact CD1-CG2 3.29Å; Y283-T331 HydrophobicContact CE1-CG2 3.52Å; Y283-T331 HydrophobicContact CG-CG2 3.84Å; E328-T331 WeakPolarHBondContact O-CB 3.4Å; E328-T331 WeakPolarHBondContact O-CG2 3.39Å; E328-T331 PolarHBondContact O-N 3.1Å; E328-T331 PolarHBondContact O-OG1 3.26Å; A329-T331 PolarHBondContact O-N 3.36Å; T331-S333 PolarHBondContact O-N 3.29Å
332	T	55	Low	78.7	Confident	127 Å²	127	74.1 Å²	74.1	78%	0.779	41%	0.409	S	S	*	.			trans	-70.1	63.9	167.5	46.6	0	0	0	0	110.6	D330 T334	D330-T332 VanDerWaalsContact C-N 3.31Å; D330-T332 PolarHBondContact O-N 3.34Å; T332-T334 PolarHBondContact O-N 3.08Å
333	S	60.7	Low	78.7	Confident	27 Å²	27	70 Å²	70	19%	0.189	39%	0.391	C	S	.	.			trans	-63.7	123.3	165.6	58.7	0	0	0	0	107.9	T331 N335 E338	T331-S333 PolarHBondContact O-N 3.29Å; S333-N335 PolarHBondContact O-N 3.36Å; S333-E338 WeakPolarHBondContact CB-OE2 3.44Å
334	T	64.1	Low	78.7	Confident	145 Å²	145	73.6 Å²	73.6	89%	0.89	41%	0.414	S	S	*	.	S	Bend	trans	-63.9	-20.4	172.8	51.2	0	0	0	0	112	T332 E336	T332-T334 PolarHBondContact O-N 3.08Å; T334-E336 PolarHBondContact O-N 3.42Å
335	N	77.1	Confident	78.8	Confident	52 Å²	52	72.6 Å²	72.6	28%	0.278	40%	0.4	S	S	.	.			trans	-81	114.9	-179.8	-162.1	-6.7	0	0	0	111.5	S333 I337 E338	S333-N335 PolarHBondContact O-N 3.36Å; N335-I337 VanDerWaalsContact CG-CG2 3.49Å; N335-I337 WeakPolarHBondContact ND2-CG2 3.34Å; N335-I337 PolarHBondContact O-N 3.34Å; N335-I337 VanDerWaalsContact OD1-CG2 3.28Å; N335-I337 WeakPolarHBondContact OD1-CG2 3.47Å; N335-E338 HydrophobicContact CB-CG 4.19Å; N335-E338 PolarHBondContact O-N 3.34Å; N335-E338 VanDerWaalsContact O-N 3.16Å
336	E	82.2	Confident	79	Confident	95 Å²	95	72.5 Å²	72.5	44%	0.444	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-62.6	-27.4	-177	-54.9	-156.3	117.1	0	0	113.6	Y202 T334 E338 R339	Y202-E336 WeakPolarHBondContact CD2-O 3.33Å; T334-E336 PolarHBondContact O-N 3.42Å; E336-E338 PolarHBondContact O-N 2.88Å; E336-R339 IonicContact OE1-CZ 3.89Å; E336-R339 IonicContact OE1-NH1 3.2Å; E336-R339 PolarHBondContact OE1-NH1 3.49Å; E336-R339 IonicContact OE1-NH2 3.02Å
337	I	87.1	Confident	79.3	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-70.1	-16.1	-179.4	-156.8	173.4	0	0	0	112.5	P201 Y234 A235 H238 T243 N335 F340	P201-I337 HydrophobicContact CB-CB 4.45Å; P201-I337 HydrophobicContact CB-CD1 4.3Å; P201-I337 HydrophobicContact CB-CG1 4.49Å; Y234-I337 HydrophobicContact CD1-CD1 4.32Å; Y234-I337 HydrophobicContact CE1-CD1 4.32Å; A235-I337 HydrophobicContact CB-CD1 4.31Å; H238-I337 HydrophobicContact CB-CD1 3.79Å; T243-I337 HydrophobicContact CG2-CG1 4.14Å; T243-I337 PolarHBondContact OG1-O 2.94Å; N335-I337 VanDerWaalsContact CG-CG2 3.49Å; N335-I337 WeakPolarHBondContact ND2-CG2 3.34Å; N335-I337 PolarHBondContact O-N 3.34Å; N335-I337 VanDerWaalsContact OD1-CG2 3.28Å; N335-I337 WeakPolarHBondContact OD1-CG2 3.47Å; I337-F340 VanDerWaalsContact O-CD2 3.23Å; I337-F340 WeakPolarHBondContact O-CD2 3.43Å
338	E	87.5	Confident	80	Confident	33 Å²	33	65.2 Å²	65.2	15%	0.154	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-91.6	2.4	-176	-68.1	-174.3	171.7	0	0	113.7	S240 Y242 H284 S333 N335 E336 F340	S240-E338 VanDerWaalsContact OG-CG 3.25Å; S240-E338 WeakPolarHBondContact OG-CG 3.45Å; S240-E338 PolarHBondContact OG-OE1 3.19Å; Y242-E338 HydrophobicContact CD1-CB 4.18Å; Y242-E338 HydrophobicContact CD1-CG 4.36Å; Y242-E338 WeakPolarHBondContact CE1-O 3.32Å; H284-E338 IonicContact CE1-OE2 2.62Å; H284-E338 IonicContact ND1-OE2 3.64Å; S333-E338 WeakPolarHBondContact CB-OE2 3.44Å; N335-E338 HydrophobicContact CB-CG 4.19Å; N335-E338 PolarHBondContact O-N 3.34Å; N335-E338 VanDerWaalsContact O-N 3.16Å; E336-E338 PolarHBondContact O-N 2.88Å; E338-F340 PolarHBondContact O-N 2.9Å; E338-F340 VanDerWaalsContact O-N 3.15Å
339	R	88	Confident	81.3	Confident	128 Å²	128	61.8 Å²	61.8	48%	0.483	33%	0.333	S	S	.	.			trans	-73.1	-2.7	-177	-66.2	-178.9	178.1	139.6	1.7	114.7	Y202 E336 H341	Y202-R339 HydrophobicContact CD2-CB 4.38Å; Y202-R339 HydrophobicContact CE2-CB 4.2Å; E336-R339 IonicContact OE1-CZ 3.89Å; E336-R339 IonicContact OE1-NH1 3.2Å; E336-R339 PolarHBondContact OE1-NH1 3.49Å; E336-R339 IonicContact OE1-NH2 3.02Å; R339-H341 PolarHBondContact O-ND1 3.5Å
340	F	92.2	Very high	82.9	Confident	25 Å²	25	57.8 Å²	57.8	11%	0.11	30%	0.3	C	S	.	.			trans	-80.6	142.5	-177.5	-63.1	-79.9	0	0	0	112.1	Y202 C205 R206 L209 Y242 T243 L246 I337 E338	Y202-F340 HydrophobicContact CD2-CE1 4.32Å; Y202-F340 AromaticContact CD2-CE2 3.78Å; Y202-F340 HydrophobicContact CD2-CE2 3.78Å; Y202-F340 AromaticContact CD2-CZ 3.57Å; Y202-F340 HydrophobicContact CD2-CZ 3.57Å; Y202-F340 AromaticContact CE2-CE1 3.9Å; Y202-F340 HydrophobicContact CE2-CE1 3.9Å; Y202-F340 HydrophobicContact CE2-CE2 4.12Å; Y202-F340 AromaticContact CE2-CZ 3.62Å; Y202-F340 HydrophobicContact CE2-CZ 3.62Å; Y202-F340 HydrophobicContact CG-CZ 4.36Å; Y202-F340 WeakPolarHBondContact O-CZ 3.3Å; C205-F340 HydrophobicContact CB-CE2 3.69Å; C205-F340 HydrophobicContact CB-CZ 3.83Å; R206-F340 HydrophobicContact CB-CE1 3.92Å; R206-F340 HydrophobicContact CB-CZ 3.98Å; L209-F340 HydrophobicContact CD1-CD1 4.14Å; L209-F340 HydrophobicContact CD1-CE1 4.27Å; Y242-F340 WeakPolarHBondContact CE1-O 3.25Å; Y242-F340 PolarHBondContact OH-O 3.35Å; T243-F340 HydrophobicContact CG2-CD2 4.22Å; L246-F340 HydrophobicContact CD1-CB 3.7Å; I337-F340 VanDerWaalsContact O-CD2 3.23Å; I337-F340 WeakPolarHBondContact O-CD2 3.43Å; E338-F340 PolarHBondContact O-N 2.9Å; E338-F340 VanDerWaalsContact O-N 3.15Å
341	H	91.7	Very high	85	Confident	98 Å²	98	53.3 Å²	53.3	45%	0.454	28%	0.276	S	S	.	.			trans	-131.4	142.8	175	-63.7	82.8	0	0	0	108.6	R339	R339-H341 PolarHBondContact O-ND1 3.5Å
342	W	93.6	Very high	86.9	Confident	60 Å²	60	51.5 Å²	51.5	23%	0.227	27%	0.265	C	S	.	.	S	Bend	trans	-68.8	-52.7	179.2	172.6	38.3	0	0	0	112.1	L246 F291 V294 M348 L351	L246-W342 HydrophobicContact CD2-CB 4.49Å; F291-W342 HydrophobicContact CB-CD2 4.18Å; F291-W342 HydrophobicContact CB-CE3 3.53Å; F291-W342 HydrophobicContact CB-CZ3 3.75Å; F291-W342 HydrophobicContact CD1-CB 4.04Å; F291-W342 AromaticContact CD1-CD2 3.77Å; F291-W342 HydrophobicContact CD1-CD2 3.77Å; F291-W342 HydrophobicContact CD1-CE3 4.03Å; F291-W342 AromaticContact CD1-CG 3.79Å; F291-W342 HydrophobicContact CD1-CG 3.79Å; F291-W342 AromaticContact CD2-CD2 3.61Å; F291-W342 HydrophobicContact CD2-CD2 3.61Å; F291-W342 AromaticContact CD2-CE2 3.54Å; F291-W342 AromaticContact CD2-CE3 3.62Å; F291-W342 HydrophobicContact CD2-CE3 3.62Å; F291-W342 HydrophobicContact CD2-CG 4.39Å; F291-W342 AromaticContact CD2-CH2 3.52Å; F291-W342 HydrophobicContact CD2-CH2 3.52Å; F291-W342 AromaticContact CD2-CZ2 3.51Å; F291-W342 HydrophobicContact CD2-CZ2 3.51Å; F291-W342 AromaticContact CD2-CZ3 3.58Å; F291-W342 HydrophobicContact CD2-CZ3 3.58Å; F291-W342 HydrophobicContact CE1-CB 4.21Å; F291-W342 AromaticContact CE1-CD1 3.82Å; F291-W342 AromaticContact CE1-CD2 3.97Å; F291-W342 HydrophobicContact CE1-CD2 3.97Å; F291-W342 AromaticContact CE1-CG 3.74Å; F291-W342 HydrophobicContact CE1-CG 3.74Å; F291-W342 AromaticContact CE2-CD2 3.83Å; F291-W342 HydrophobicContact CE2-CD2 3.83Å; F291-W342 AromaticContact CE2-CE2 3.38Å; F291-W342 HydrophobicContact CE2-CE3 4.31Å; F291-W342 HydrophobicContact CE2-CG 4.37Å; F291-W342 HydrophobicContact CE2-CH2 4Å; F291-W342 AromaticContact CE2-CZ2 3.49Å; F291-W342 HydrophobicContact CE2-CZ2 3.49Å; F291-W342 VanDerWaalsContact CE2-CZ2 3.49Å; F291-W342 HydrophobicContact CE2-CZ3 4.39Å; F291-W342 AromaticContact CE2-NE1 3.71Å; F291-W342 AromaticContact CG-CD2 3.6Å; F291-W342 HydrophobicContact CG-CD2 3.6Å; F291-W342 AromaticContact CG-CE3 3.47Å; F291-W342 HydrophobicContact CG-CE3 3.47Å; F291-W342 VanDerWaalsContact CG-CE3 3.47Å; F291-W342 HydrophobicContact CG-CG 4.14Å; F291-W342 HydrophobicContact CG-CH2 4.23Å; F291-W342 HydrophobicContact CG-CZ2 4.35Å; F291-W342 AromaticContact CG-CZ3 3.81Å; F291-W342 HydrophobicContact CG-CZ3 3.81Å; F291-W342 AromaticContact CZ-CD1 3.81Å; F291-W342 HydrophobicContact CZ-CD2 4.02Å; F291-W342 AromaticContact CZ-CE2 3.74Å; F291-W342 HydrophobicContact CZ-CG 4.06Å; F291-W342 HydrophobicContact CZ-CZ2 4.29Å; F291-W342 AromaticContact CZ-NE1 3.6Å; V294-W342 HydrophobicContact CB-CH2 4.15Å; V294-W342 HydrophobicContact CG1-CH2 4.02Å; V294-W342 HydrophobicContact CG2-CH2 4.36Å; W342-M348 HydrophobicContact CE3-CE 4.08Å; W342-L351 HydrophobicContact CH2-CD2 3.59Å; W342-L351 HydrophobicContact CZ2-CD2 4.05Å; W342-L351 HydrophobicContact CZ3-CD2 4.46Å
343	M	92.6	Very high	88.9	Confident	28 Å²	28	48.8 Å²	48.8	14%	0.138	24%	0.241	C	C	.	.	S	Bend	trans	-158.5	163.2	175.6	61.2	174.2	51.7	0	0	110.8	H347 M348 L351 L391	M343-H347 HydrophobicContact SD-CB 4.13Å; M343-M348 HydrophobicContact CG-CE 3.9Å; M343-M348 HydrophobicContact CG-CG 3.44Å; M343-M348 VanDerWaalsContact CG-CG 3.44Å; M343-M348 WeakPolarHBondContact O-CE 3.4Å; M343-M348 HydrophobicContact SD-CB 4.43Å; M343-M348 HydrophobicContact SD-CG 3.79Å; M343-L351 HydrophobicContact CE-CD2 4.01Å; M343-L351 HydrophobicContact SD-CD2 4Å; M343-L391 HydrophobicContact CE-CD2 4.26Å
344	P	91.8	Very high	90.7	Very high	76 Å²	76	48 Å²	48	49%	0.494	23%	0.234	S	C	.	.			trans	-59.2	146.8	174.6	-24	34.9	0	0	0	112.5	E346 H347 M348	P344-E346 PolarHBondContact O-N 3.08Å; P344-E346 VanDerWaalsContact O-N 3.13Å; P344-H347 WeakPolarHBondContact O-CB 3.33Å; P344-H347 PolarHBondContact O-N 3.41Å; P344-H347 VanDerWaalsContact O-N 3.07Å; P344-M348 PolarHBondContact O-N 3.48Å; P344-M348 VanDerWaalsContact O-N 3.09Å
345	R	91.7	Very high	92.2	Very high	28 Å²	28	41.3 Å²	41.3	11%	0.106	19%	0.193	C	C	.	.	H	α-helix	trans	-49.6	-41.4	178.6	-173.8	-173.6	-61	-129	-6	112.5	F323 A324 M326 E328 H347 M348 V349	F323-R345 HydrophobicContact CD1-CG 4.26Å; F323-R345 HydrophobicContact CE1-CB 4.41Å; F323-R345 HydrophobicContact CE1-CG 4.1Å; F323-R345 PolarHBondContact O-NH1 3.37Å; A324-R345 VanDerWaalsContact C-NH1 3.31Å; A324-R345 PolarHBondContact O-NH1 3.35Å; M326-R345 PolarHBondContact O-NH1 2.93Å; M326-R345 PolarHBondContact O-NH2 2.97Å; M326-R345 VanDerWaalsContact O-NH2 3.16Å; E328-R345 IonicContact OE1-CZ 3.35Å; E328-R345 IonicContact OE1-NE 2.66Å; E328-R345 PolarHBondContact OE1-NE 2.83Å; E328-R345 IonicContact OE1-NH2 3.18Å; E328-R345 PolarHBondContact OE1-NH2 3.06Å; R345-H347 VanDerWaalsContact C-N 3.3Å; R345-H347 PolarHBondContact O-N 3.34Å; R345-M348 WeakPolarHBondContact O-CB 3.46Å; R345-M348 PolarHBondContact O-N 3.22Å; R345-M348 VanDerWaalsContact O-N 3.1Å; R345-V349 PolarHBondContact O-N 2.86Å
346	E	92	Very high	93.2	Very high	82 Å²	82	39 Å²	39	38%	0.383	18%	0.181	S	C	.	.	H	α-helix	trans	-76.3	-27.2	-172.2	-36	-46.9	-159.6	0	0	111.7	P344 I350 L383	P344-E346 PolarHBondContact O-N 3.08Å; P344-E346 VanDerWaalsContact O-N 3.13Å; E346-I350 WeakPolarHBondContact O-CG1 3.35Å; E346-I350 PolarHBondContact O-N 3.32Å; E346-L383 HydrophobicContact CB-CD1 3.69Å; E346-L383 HydrophobicContact CB-CD2 4.19Å; E346-L383 HydrophobicContact CG-CD2 4.42Å
347	H	94.9	Very high	93.9	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.037	16%	0.16	C	C	.	.	H	α-helix	trans	-71.4	-37.3	170.7	-67.9	-167.6	0	0	0	110.8	M343 P344 R345 V349 I350 L351 D387 F395	M343-H347 HydrophobicContact SD-CB 4.13Å; P344-H347 WeakPolarHBondContact O-CB 3.33Å; P344-H347 PolarHBondContact O-N 3.41Å; P344-H347 VanDerWaalsContact O-N 3.07Å; R345-H347 VanDerWaalsContact C-N 3.3Å; R345-H347 PolarHBondContact O-N 3.34Å; H347-V349 VanDerWaalsContact C-N 3.34Å; H347-V349 PolarHBondContact O-N 3.02Å; H347-I350 PolarHBondContact O-N 3.12Å; H347-L351 WeakPolarHBondContact O-CB 3.32Å; H347-L351 PolarHBondContact O-N 3.33Å; H347-D387 IonicContact CD2-OD2 2.93Å; H347-D387 IonicContact CE1-OD2 3.7Å; H347-D387 PolarHBondContact CE1-OD2 3.48Å; H347-D387 VanDerWaalsContact CE1-OD2 3.25Å; H347-D387 IonicContact NE2-OD2 2.92Å; H347-D387 PolarHBondContact NE2-OD2 2.93Å; H347-F395 HydrophobicContact CB-CE2 4.06Å
348	M	95.5	Very high	94.3	Very high	9 Å²	9	37.2 Å²	37.2	4%	0.044	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-43.1	173.6	-59.9	-170	-173.1	0	0	111.5	V290 I320 F323 W342 M343 P344 R345 I350 L351 V352	V290-M348 HydrophobicContact CG1-SD 3.96Å; I320-M348 HydrophobicContact CD1-CB 3.91Å; F323-M348 HydrophobicContact CD1-SD 4.35Å; F323-M348 HydrophobicContact CE1-CE 4.42Å; F323-M348 HydrophobicContact CE1-SD 3.85Å; W342-M348 HydrophobicContact CE3-CE 4.08Å; M343-M348 HydrophobicContact CG-CE 3.9Å; M343-M348 HydrophobicContact CG-CG 3.44Å; M343-M348 VanDerWaalsContact CG-CG 3.44Å; M343-M348 WeakPolarHBondContact O-CE 3.4Å; M343-M348 HydrophobicContact SD-CB 4.43Å; M343-M348 HydrophobicContact SD-CG 3.79Å; P344-M348 PolarHBondContact O-N 3.48Å; P344-M348 VanDerWaalsContact O-N 3.09Å; R345-M348 WeakPolarHBondContact O-CB 3.46Å; R345-M348 PolarHBondContact O-N 3.22Å; R345-M348 VanDerWaalsContact O-N 3.1Å; M348-I350 VanDerWaalsContact C-N 3.35Å; M348-I350 PolarHBondContact O-N 3.22Å; M348-L351 PolarHBondContact O-N 3.36Å; M348-V352 WeakPolarHBondContact O-CG2 3.42Å; M348-V352 PolarHBondContact O-N 2.64Å
349	V	95.5	Very high	94.7	Very high	31 Å²	31	35.8 Å²	35.8	19%	0.188	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-46.3	177.5	173.4	0	0	0	0	111.1	I320 R345 H347 L351 V352 Y353	I320-V349 HydrophobicContact CD1-CG2 4.37Å; I320-V349 HydrophobicContact CG1-CG2 4.13Å; R345-V349 PolarHBondContact O-N 2.86Å; H347-V349 VanDerWaalsContact C-N 3.34Å; H347-V349 PolarHBondContact O-N 3.02Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 3.02Å; V349-V352 PolarHBondContact O-N 3.33Å; V349-Y353 HydrophobicContact CG1-CD2 3.98Å; V349-Y353 HydrophobicContact CG1-CE2 3.62Å; V349-Y353 WeakPolarHBondContact O-CD2 3.49Å; V349-Y353 PolarHBondContact O-N 2.87Å; V349-Y353 VanDerWaalsContact O-N 3.1Å
350	I	96.6	Very high	95	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-43.9	176.2	-67.9	163.4	0	0	0	110.9	E346 H347 M348 V352 Y353 L354 Q379 I380 L383 L392 F395	E346-I350 WeakPolarHBondContact O-CG1 3.35Å; E346-I350 PolarHBondContact O-N 3.32Å; H347-I350 PolarHBondContact O-N 3.12Å; M348-I350 VanDerWaalsContact C-N 3.35Å; M348-I350 PolarHBondContact O-N 3.22Å; I350-V352 VanDerWaalsContact C-N 3.35Å; I350-V352 PolarHBondContact O-N 3.45Å; I350-Y353 PolarHBondContact O-N 3.32Å; I350-L354 PolarHBondContact O-N 3.18Å; I350-Q379 HydrophobicContact CD1-CG 4.03Å; I350-Q379 HydrophobicContact CG1-CB 4.14Å; I350-Q379 HydrophobicContact CG1-CG 3.79Å; I350-I380 HydrophobicContact CD1-CG1 3.65Å; I350-I380 HydrophobicContact CG1-CG1 4.17Å; I350-I380 HydrophobicContact CG2-CD1 3.92Å; I350-I380 HydrophobicContact CG2-CG1 3.98Å; I350-L383 HydrophobicContact CD1-CD1 3.64Å; I350-L392 HydrophobicContact CD1-CD2 3.78Å; I350-F395 HydrophobicContact CB-CD2 4.2Å; I350-F395 HydrophobicContact CG2-CB 3.78Å; I350-F395 HydrophobicContact CG2-CD2 3.61Å; I350-F395 HydrophobicContact CG2-CE2 4.34Å; I350-F395 HydrophobicContact CG2-CG 3.83Å
351	L	97	Very high	95	Very high	24 Å²	24	30.2 Å²	30.2	13%	0.126	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-41.3	178.8	-179.1	57	0	0	0	112	V294 W342 M343 H347 M348 V349 Y353 L354 V355 F395	V294-L351 HydrophobicContact CG1-CD2 3.9Å; V294-L351 HydrophobicContact CG1-CG 4.2Å; W342-L351 HydrophobicContact CH2-CD2 3.59Å; W342-L351 HydrophobicContact CZ2-CD2 4.05Å; W342-L351 HydrophobicContact CZ3-CD2 4.46Å; M343-L351 HydrophobicContact CE-CD2 4.01Å; M343-L351 HydrophobicContact SD-CD2 4Å; H347-L351 WeakPolarHBondContact O-CB 3.32Å; H347-L351 PolarHBondContact O-N 3.33Å; M348-L351 PolarHBondContact O-N 3.36Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 3.02Å; L351-Y353 VanDerWaalsContact C-N 3.33Å; L351-Y353 PolarHBondContact O-N 3.03Å; L351-L354 HydrophobicContact CD1-CD2 4.49Å; L351-L354 PolarHBondContact O-N 2.82Å; L351-V355 HydrophobicContact CD1-CG2 4.25Å; L351-V355 WeakPolarHBondContact O-CG2 3.46Å; L351-V355 PolarHBondContact O-N 3.4Å; L351-F395 HydrophobicContact CB-CE1 4.39Å; L351-F395 HydrophobicContact CB-CZ 4.14Å; L351-F395 HydrophobicContact CD1-CE1 4.01Å; L351-F395 HydrophobicContact CD1-CZ 4.5Å
352	V	97.5	Very high	94.9	Very high	6 Å²	6	28.3 Å²	28.3	4%	0.036	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-41.3	175.2	173.8	0	0	0	0	111	V294 L316 I320 M348 V349 I350 T356	V294-V352 HydrophobicContact CG2-CG2 4.48Å; L316-V352 HydrophobicContact CD1-CG2 3.92Å; L316-V352 HydrophobicContact CD2-CG1 4.3Å; L316-V352 HydrophobicContact CD2-CG2 4.08Å; L316-V352 HydrophobicContact CG-CG1 4.15Å; L316-V352 HydrophobicContact CG-CG2 3.94Å; I320-V352 HydrophobicContact CB-CG2 4.2Å; I320-V352 HydrophobicContact CD1-CG2 4.48Å; I320-V352 HydrophobicContact CG1-CG2 4.12Å; I320-V352 HydrophobicContact CG2-CG1 4.17Å; I320-V352 HydrophobicContact CG2-CG2 4.38Å; M348-V352 WeakPolarHBondContact O-CG2 3.42Å; M348-V352 PolarHBondContact O-N 2.64Å; V349-V352 PolarHBondContact O-N 3.33Å; I350-V352 VanDerWaalsContact C-N 3.35Å; I350-V352 PolarHBondContact O-N 3.45Å; V352-T356 WeakPolarHBondContact O-CB 3.33Å; V352-T356 PolarHBondContact O-N 2.91Å; V352-T356 PolarHBondContact O-OG1 2.76Å
353	Y	97.7	Very high	94.6	Very high	70 Å²	70	26 Å²	26	28%	0.275	13%	0.131	S	C	.	.	H	α-helix	trans	-62.8	-44.5	173.1	-75.3	-60.7	0	0	0	112	V349 I350 L351 V355 T356 V357 K375 A376	V349-Y353 HydrophobicContact CG1-CD2 3.98Å; V349-Y353 HydrophobicContact CG1-CE2 3.62Å; V349-Y353 WeakPolarHBondContact O-CD2 3.49Å; V349-Y353 PolarHBondContact O-N 2.87Å; V349-Y353 VanDerWaalsContact O-N 3.1Å; I350-Y353 PolarHBondContact O-N 3.32Å; L351-Y353 VanDerWaalsContact C-N 3.33Å; L351-Y353 PolarHBondContact O-N 3.03Å; Y353-V355 PolarHBondContact O-N 3.43Å; Y353-T356 WeakPolarHBondContact O-CA 3.45Å; Y353-T356 VanDerWaalsContact O-CB 3.3Å; Y353-T356 WeakPolarHBondContact O-CB 3.31Å; Y353-T356 PolarHBondContact O-N 3.06Å; Y353-T356 VanDerWaalsContact O-N 3.13Å; Y353-V357 WeakPolarHBondContact O-CG2 3.48Å; Y353-V357 PolarHBondContact O-N 3.4Å; Y353-K375 HydrophobicContact CD1-CB 4.44Å; Y353-K375 HydrophobicContact CE1-CB 4.06Å; Y353-K375 HydrophobicContact CE1-CD 3.92Å; Y353-K375 HydrophobicContact CE2-CB 4.43Å; Y353-A376 HydrophobicContact CD2-CB 4.39Å; Y353-A376 HydrophobicContact CG-CB 4.23Å
354	L	97.8	Very high	94.4	Very high	11 Å²	11	24.9 Å²	24.9	6%	0.058	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-48.6	177.7	175.4	59.6	0	0	0	111.6	I350 L351 T356 V357 M358 F395 L399	I350-L354 PolarHBondContact O-N 3.18Å; L351-L354 HydrophobicContact CD1-CD2 4.49Å; L351-L354 PolarHBondContact O-N 2.82Å; L354-T356 PolarHBondContact O-N 3.1Å; L354-V357 WeakPolarHBondContact O-CB 3.43Å; L354-V357 PolarHBondContact O-N 3.25Å; L354-V357 VanDerWaalsContact O-N 3.09Å; L354-M358 HydrophobicContact CG-SD 4.4Å; L354-M358 WeakPolarHBondContact O-CG 3.39Å; L354-M358 PolarHBondContact O-N 2.99Å; L354-F395 HydrophobicContact CD2-CD1 4.09Å; L354-L399 HydrophobicContact CB-CD2 4.31Å; L354-L399 HydrophobicContact CD1-CD2 3.82Å; L354-L399 HydrophobicContact CD1-CG 4.07Å
355	V	97.3	Very high	94.3	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.024	12%	0.12	C	C	.	.	H	α-helix	trans	-60.6	-36.4	175.9	172	0	0	0	0	111.3	V294 V297 L301 L313 L351 Y353 M358 Q359	V294-V355 HydrophobicContact CG1-CG2 4.47Å; V297-V355 HydrophobicContact CB-CG1 4.02Å; V297-V355 HydrophobicContact CG1-CG1 3.29Å; L301-V355 HydrophobicContact CD1-CG1 3.99Å; L313-V355 HydrophobicContact CD1-CG1 4.3Å; L351-V355 HydrophobicContact CD1-CG2 4.25Å; L351-V355 WeakPolarHBondContact O-CG2 3.46Å; L351-V355 PolarHBondContact O-N 3.4Å; Y353-V355 PolarHBondContact O-N 3.43Å; V355-M358 PolarHBondContact O-N 3.31Å; V355-Q359 PolarHBondContact O-N 3.39Å
356	T	97.3	Very high	94.3	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-64.8	-40.7	174.6	-55.2	0	0	0	0	112.1	L313 H317 V352 Y353 L354 S360	L313-T356 HydrophobicContact CD2-CG2 4.46Å; H317-T356 PolarHBondContact NE2-OG1 3.12Å; V352-T356 WeakPolarHBondContact O-CB 3.33Å; V352-T356 PolarHBondContact O-N 2.91Å; V352-T356 PolarHBondContact O-OG1 2.76Å; Y353-T356 WeakPolarHBondContact O-CA 3.45Å; Y353-T356 VanDerWaalsContact O-CB 3.3Å; Y353-T356 WeakPolarHBondContact O-CB 3.31Å; Y353-T356 PolarHBondContact O-N 3.06Å; Y353-T356 VanDerWaalsContact O-N 3.13Å; L354-T356 PolarHBondContact O-N 3.1Å; T356-S360 VanDerWaalsContact O-CB 3.28Å; T356-S360 WeakPolarHBondContact O-CB 3.44Å; T356-S360 PolarHBondContact O-N 3.04Å; T356-S360 PolarHBondContact O-OG 3.35Å
357	V	97.6	Very high	94.3	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-48.9	174.1	172.4	0	0	0	0	109.6	Y353 L354 Q359 S360 M361 A369 A373 L399 H402	Y353-V357 WeakPolarHBondContact O-CG2 3.48Å; Y353-V357 PolarHBondContact O-N 3.4Å; L354-V357 WeakPolarHBondContact O-CB 3.43Å; L354-V357 PolarHBondContact O-N 3.25Å; L354-V357 VanDerWaalsContact O-N 3.09Å; V357-Q359 PolarHBondContact O-N 3.42Å; V357-S360 PolarHBondContact O-N 3.38Å; V357-M361 HydrophobicContact CG1-CG 4.16Å; V357-M361 VanDerWaalsContact O-CB 3.3Å; V357-M361 WeakPolarHBondContact O-CB 3.32Å; V357-M361 WeakPolarHBondContact O-CG 3.46Å; V357-M361 PolarHBondContact O-N 2.91Å; V357-A369 HydrophobicContact CG1-CB 4.42Å; V357-A373 HydrophobicContact CG2-CB 3.8Å; V357-L399 HydrophobicContact CG2-CD2 4.16Å; V357-H402 HydrophobicContact CG1-CB 3.76Å
358	M	95.5	Very high	94.2	Very high	56 Å²	56	26.3 Å²	26.3	28%	0.276	13%	0.129	S	C	.	.	H	α-helix	trans	-57.4	-48.5	178.9	-65.8	175.2	70	0	0	112.3	L301 L354 V355 M361 Q362	L301-M358 HydrophobicContact CD1-CB 3.86Å; L354-M358 HydrophobicContact CG-SD 4.4Å; L354-M358 WeakPolarHBondContact O-CG 3.39Å; L354-M358 PolarHBondContact O-N 2.99Å; V355-M358 PolarHBondContact O-N 3.31Å; M358-M361 PolarHBondContact O-N 3.04Å; M358-Q362 WeakPolarHBondContact O-CG 3.43Å; M358-Q362 PolarHBondContact O-N 3.06Å; M358-Q362 VanDerWaalsContact O-N 3.11Å
359	Q	95.3	Very high	94.2	Very high	4 Å²	4	26 Å²	26	2%	0.019	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-45.4	177.7	-170.3	-80.4	-35.2	0	0	112	L301 A306 A309 L313 V355 V357 M361 Q362 A363	L301-Q359 HydrophobicContact CD1-CB 4.34Å; L301-Q359 HydrophobicContact CD2-CB 3.76Å; L301-Q359 HydrophobicContact CD2-CG 3.98Å; A306-Q359 PolarHBondContact O-NE2 2.89Å; A309-Q359 HydrophobicContact CB-CG 4.26Å; L313-Q359 HydrophobicContact CD2-CB 3.81Å; L313-Q359 HydrophobicContact CD2-CG 3.85Å; V355-Q359 PolarHBondContact O-N 3.39Å; V357-Q359 PolarHBondContact O-N 3.42Å; Q359-M361 VanDerWaalsContact C-N 3.31Å; Q359-M361 PolarHBondContact O-N 3.47Å; Q359-Q362 PolarHBondContact O-N 3.34Å; Q359-A363 WeakPolarHBondContact O-CB 3.42Å; Q359-A363 PolarHBondContact O-N 3.21Å
360	S	93.9	Very high	94.2	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.3	-35.6	-178.7	-59.7	0	0	0	0	111.8	T356 V357 G364 M365	T356-S360 VanDerWaalsContact O-CB 3.28Å; T356-S360 WeakPolarHBondContact O-CB 3.44Å; T356-S360 PolarHBondContact O-N 3.04Å; T356-S360 PolarHBondContact O-OG 3.35Å; V357-S360 PolarHBondContact O-N 3.38Å; S360-G364 PolarHBondContact O-N 2.71Å; S360-G364 VanDerWaalsContact O-N 3.17Å; S360-M365 PolarHBondContact O-N 3.26Å
361	M	92.6	Very high	94.1	Very high	35 Å²	35	35.7 Å²	35.7	17%	0.172	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-48.6	173.8	-78.5	-69.2	-64.5	0	0	111.6	V357 M358 Q359 A363 G364 L366 A369 H402 M405	V357-M361 HydrophobicContact CG1-CG 4.16Å; V357-M361 VanDerWaalsContact O-CB 3.3Å; V357-M361 WeakPolarHBondContact O-CB 3.32Å; V357-M361 WeakPolarHBondContact O-CG 3.46Å; V357-M361 PolarHBondContact O-N 2.91Å; M358-M361 PolarHBondContact O-N 3.04Å; Q359-M361 VanDerWaalsContact C-N 3.31Å; Q359-M361 PolarHBondContact O-N 3.47Å; M361-A363 PolarHBondContact O-N 3.23Å; M361-G364 PolarHBondContact O-N 2.99Å; M361-G364 VanDerWaalsContact O-N 3.17Å; M361-L366 HydrophobicContact CE-CD2 4.4Å; M361-L366 HydrophobicContact SD-CD2 3.64Å; M361-A369 HydrophobicContact CG-CB 3.94Å; M361-A369 HydrophobicContact SD-CB 4.08Å; M361-H402 WeakPolarHBondContact CE-O 3.46Å; M361-M405 HydrophobicContact CE-CB 3.9Å
362	Q	90	Very high	94.1	Very high	58 Å²	58	35.3 Å²	35.3	27%	0.271	16%	0.163	S	C	.	.	H	α-helix	trans	-65.1	-37.7	179.1	-70.1	-175.7	-1.9	0	0	112.5	L301 A306 M358 Q359 G364	L301-Q362 PolarHBondContact O-NE2 3.03Å; A306-Q362 HydrophobicContact CB-CB 3.65Å; M358-Q362 WeakPolarHBondContact O-CG 3.43Å; M358-Q362 PolarHBondContact O-N 3.06Å; M358-Q362 VanDerWaalsContact O-N 3.11Å; Q359-Q362 PolarHBondContact O-N 3.34Å; Q362-G364 PolarHBondContact O-N 3.22Å
363	A	87.6	Confident	94.1	Very high	11 Å²	11	35 Å²	35	9%	0.091	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.3	176	0	0	0	0	0	114.2	A306 Q359 M361 M365	A306-A363 HydrophobicContact CB-CB 4.43Å; Q359-A363 WeakPolarHBondContact O-CB 3.42Å; Q359-A363 PolarHBondContact O-N 3.21Å; M361-A363 PolarHBondContact O-N 3.23Å; A363-M365 VanDerWaalsContact C-N 3.32Å; A363-M365 HydrophobicContact CB-CE 3.82Å; A363-M365 PolarHBondContact O-N 2.93Å
364	G	86.9	Confident	94.1	Very high	5 Å²	5	35.6 Å²	35.6	5%	0.052	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	9.1	-178.5	0	0	0	0	0	115.6	S360 M361 Q362 L366	S360-G364 PolarHBondContact O-N 2.71Å; S360-G364 VanDerWaalsContact O-N 3.17Å; M361-G364 PolarHBondContact O-N 2.99Å; M361-G364 VanDerWaalsContact O-N 3.17Å; Q362-G364 PolarHBondContact O-N 3.22Å; G364-L366 PolarHBondContact O-N 2.99Å
365	M	90.3	Very high	94	Very high	68 Å²	68	40.9 Å²	40.9	34%	0.335	19%	0.189	S	C	.	.			trans	-81.2	62.3	175.8	-65.6	-175.7	-76	0	0	111.6	S360 A363 D367 R368 A369	S360-M365 PolarHBondContact O-N 3.26Å; A363-M365 VanDerWaalsContact C-N 3.32Å; A363-M365 HydrophobicContact CB-CE 3.82Å; A363-M365 PolarHBondContact O-N 2.93Å; M365-D367 VanDerWaalsContact C-N 3.35Å; M365-D367 PolarHBondContact O-N 3.43Å; M365-R368 HydrophobicContact CB-CB 4.13Å; M365-R368 WeakPolarHBondContact O-CB 3.41Å; M365-R368 PolarHBondContact O-N 2.88Å; M365-R368 VanDerWaalsContact O-N 3.09Å; M365-A369 PolarHBondContact O-N 3.01Å
366	L	91.9	Very high	94	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-34.5	-169.2	-51.6	-179.7	0	0	0	113.7	M361 G364 R368 A369 K370 V409 M410 P626	M361-L366 HydrophobicContact CE-CD2 4.4Å; M361-L366 HydrophobicContact SD-CD2 3.64Å; G364-L366 PolarHBondContact O-N 2.99Å; L366-R368 VanDerWaalsContact C-N 3.29Å; L366-R368 PolarHBondContact O-N 3.41Å; L366-A369 WeakPolarHBondContact O-CB 3.37Å; L366-A369 PolarHBondContact O-N 3.05Å; L366-K370 WeakPolarHBondContact O-CB 3.35Å; L366-K370 PolarHBondContact O-N 3.27Å; L366-V409 HydrophobicContact CD1-CB 3.9Å; L366-V409 HydrophobicContact CD1-CG1 3.41Å; L366-V409 VanDerWaalsContact CD1-CG1 3.41Å; L366-M410 HydrophobicContact CB-CG 4.23Å; L366-M410 HydrophobicContact CB-SD 4.1Å; L366-M410 HydrophobicContact CD1-CG 3.74Å; L366-P626 HydrophobicContact CB-CG 3.79Å; L366-P626 HydrophobicContact CD1-CG 4.15Å; L366-P626 HydrophobicContact CG-CG 4.22Å
367	D	91.7	Very high	94	Very high	75 Å²	75	41.9 Å²	41.9	40%	0.401	19%	0.194	S	C	.	.	H	α-helix	trans	-63.4	-36.9	175.5	-70	-55.9	0	0	0	112.4	M365 R371	M365-D367 VanDerWaalsContact C-N 3.35Å; M365-D367 PolarHBondContact O-N 3.43Å; D367-R371 WeakPolarHBondContact O-CG 3.3Å; D367-R371 PolarHBondContact O-N 3.44Å; D367-R371 VanDerWaalsContact O-N 3.14Å; D367-R371 PolarHBondContact O-NH1 2.89Å
368	R	93.1	Very high	93.9	Very high	74 Å²	74	45.9 Å²	45.9	28%	0.279	22%	0.215	S	C	.	.	H	α-helix	trans	-70.6	-41	175.1	-177.4	-178.5	177.4	168.4	0.5	110.8	M365 L366 S372	M365-R368 HydrophobicContact CB-CB 4.13Å; M365-R368 WeakPolarHBondContact O-CB 3.41Å; M365-R368 PolarHBondContact O-N 2.88Å; M365-R368 VanDerWaalsContact O-N 3.09Å; L366-R368 VanDerWaalsContact C-N 3.29Å; L366-R368 PolarHBondContact O-N 3.41Å; R368-S372 WeakPolarHBondContact O-CB 3.33Å; R368-S372 PolarHBondContact O-N 3.37Å; R368-S372 VanDerWaalsContact O-N 3.07Å; R368-S372 PolarHBondContact O-OG 3.28Å
369	A	95.1	Very high	93.9	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-58.8	-49.3	174.9	0	0	0	0	0	110.6	V357 M361 M365 L366 R371 S372 A373	V357-A369 HydrophobicContact CG1-CB 4.42Å; M361-A369 HydrophobicContact CG-CB 3.94Å; M361-A369 HydrophobicContact SD-CB 4.08Å; M365-A369 PolarHBondContact O-N 3.01Å; L366-A369 WeakPolarHBondContact O-CB 3.37Å; L366-A369 PolarHBondContact O-N 3.05Å; A369-R371 PolarHBondContact O-N 3.28Å; A369-S372 PolarHBondContact O-N 3.07Å; A369-A373 WeakPolarHBondContact O-CB 3.49Å; A369-A373 PolarHBondContact O-N 2.98Å
370	K	95	Very high	93.9	Very high	93 Å²	93	45.9 Å²	45.9	40%	0.404	21%	0.214	S	C	.	.	H	α-helix	trans	-54.6	-54.5	177.1	179.3	179.3	172.3	-178.5	0	112.2	L366 S372 A373 E374	L366-K370 WeakPolarHBondContact O-CB 3.35Å; L366-K370 PolarHBondContact O-N 3.27Å; K370-S372 VanDerWaalsContact C-N 3.26Å; K370-S372 PolarHBondContact O-N 2.83Å; K370-A373 PolarHBondContact O-N 3.21Å; K370-E374 WeakPolarHBondContact CE-OE1 3.42Å; K370-E374 WeakPolarHBondContact CG-OE1 3.32Å; K370-E374 WeakPolarHBondContact O-CG 3.43Å; K370-E374 PolarHBondContact O-N 3.36Å
371	R	96.3	Very high	93.9	Very high	142 Å²	142	51.5 Å²	51.5	54%	0.536	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-35.1	179.3	-72.1	-171.5	-64.4	-88.9	2.3	113.2	D367 A369 K375	D367-R371 WeakPolarHBondContact O-CG 3.3Å; D367-R371 PolarHBondContact O-N 3.44Å; D367-R371 VanDerWaalsContact O-N 3.14Å; D367-R371 PolarHBondContact O-NH1 2.89Å; A369-R371 PolarHBondContact O-N 3.28Å; R371-K375 WeakPolarHBondContact O-CG 3.34Å; R371-K375 PolarHBondContact O-N 2.72Å
372	S	96.7	Very high	93.9	Very high	15 Å²	15	56 Å²	56	11%	0.105	26%	0.259	C	S	.	.	H	α-helix	trans	-73.6	-38.5	179.1	-53.6	0	0	0	0	111.3	R368 A369 K370 K375 A376	R368-S372 WeakPolarHBondContact O-CB 3.33Å; R368-S372 PolarHBondContact O-N 3.37Å; R368-S372 VanDerWaalsContact O-N 3.07Å; R368-S372 PolarHBondContact O-OG 3.28Å; A369-S372 PolarHBondContact O-N 3.07Å; K370-S372 VanDerWaalsContact C-N 3.26Å; K370-S372 PolarHBondContact O-N 2.83Å; S372-K375 PolarHBondContact O-N 2.97Å; S372-A376 PolarHBondContact O-N 3.29Å; S372-A376 VanDerWaalsContact O-N 3.14Å
373	A	97.1	Very high	94.1	Very high	1 Å²	1	55 Å²	55	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-43	175.7	0	0	0	0	0	111.9	V357 A369 K370 K375 A376 L377 L399 T403	V357-A373 HydrophobicContact CG2-CB 3.8Å; A369-A373 WeakPolarHBondContact O-CB 3.49Å; A369-A373 PolarHBondContact O-N 2.98Å; K370-A373 PolarHBondContact O-N 3.21Å; A373-K375 VanDerWaalsContact C-N 3.33Å; A373-K375 PolarHBondContact O-N 2.88Å; A373-A376 WeakPolarHBondContact O-CB 3.47Å; A373-A376 PolarHBondContact O-N 3.36Å; A373-A376 VanDerWaalsContact O-N 3.11Å; A373-L377 WeakPolarHBondContact O-CG 3.29Å; A373-L377 PolarHBondContact O-N 3.48Å; A373-L399 HydrophobicContact CB-CD2 4.32Å; A373-T403 HydrophobicContact CB-CG2 3.31Å
374	E	96.7	Very high	94.2	Very high	81 Å²	81	57.5 Å²	57.5	38%	0.379	27%	0.272	S	S	.	.	H	α-helix	trans	-57.3	-45.1	175.9	-73.3	166.9	175.4	0	0	111.6	K370 A376 L377 I378	K370-E374 WeakPolarHBondContact CE-OE1 3.42Å; K370-E374 WeakPolarHBondContact CG-OE1 3.32Å; K370-E374 WeakPolarHBondContact O-CG 3.43Å; K370-E374 PolarHBondContact O-N 3.36Å; E374-A376 VanDerWaalsContact C-N 3.33Å; E374-A376 PolarHBondContact O-N 3.32Å; E374-L377 PolarHBondContact O-N 3.46Å; E374-I378 WeakPolarHBondContact O-CD1 3.49Å; E374-I378 VanDerWaalsContact O-CG1 3.29Å; E374-I378 WeakPolarHBondContact O-CG1 3.34Å; E374-I378 PolarHBondContact O-N 2.85Å
375	K	96.7	Very high	94.3	Very high	123 Å²	123	62.2 Å²	62.2	54%	0.535	30%	0.3	S	S	.	.	H	α-helix	trans	-60.8	-41.2	175	-72.2	179.2	179.1	-171.8	0	112.6	Y353 R371 S372 A373 Q379	Y353-K375 HydrophobicContact CD1-CB 4.44Å; Y353-K375 HydrophobicContact CE1-CB 4.06Å; Y353-K375 HydrophobicContact CE1-CD 3.92Å; Y353-K375 HydrophobicContact CE2-CB 4.43Å; R371-K375 WeakPolarHBondContact O-CG 3.34Å; R371-K375 PolarHBondContact O-N 2.72Å; S372-K375 PolarHBondContact O-N 2.97Å; A373-K375 VanDerWaalsContact C-N 3.33Å; A373-K375 PolarHBondContact O-N 2.88Å; K375-Q379 PolarHBondContact O-N 2.83Å; K375-Q379 VanDerWaalsContact O-N 3.16Å
376	A	97.4	Very high	94.2	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-42.9	179.6	0	0	0	0	0	112.1	Y353 S372 A373 E374 Q379 I380 L399	Y353-A376 HydrophobicContact CD2-CB 4.39Å; Y353-A376 HydrophobicContact CG-CB 4.23Å; S372-A376 PolarHBondContact O-N 3.29Å; S372-A376 VanDerWaalsContact O-N 3.14Å; A373-A376 WeakPolarHBondContact O-CB 3.47Å; A373-A376 PolarHBondContact O-N 3.36Å; A373-A376 VanDerWaalsContact O-N 3.11Å; E374-A376 VanDerWaalsContact C-N 3.33Å; E374-A376 PolarHBondContact O-N 3.32Å; A376-Q379 PolarHBondContact O-N 3.4Å; A376-I380 WeakPolarHBondContact O-CG1 3.27Å; A376-I380 PolarHBondContact O-N 3.41Å; A376-L399 HydrophobicContact CB-CD1 3.51Å; A376-L399 HydrophobicContact CB-CD2 3.94Å; A376-L399 HydrophobicContact CB-CG 4.39Å
377	L	96.7	Very high	93.8	Very high	27 Å²	27	68.9 Å²	68.9	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-45.1	177.9	-70.5	169.9	0	0	0	111.4	A373 E374 Q379 I380 E381 L399	A373-L377 WeakPolarHBondContact O-CG 3.29Å; A373-L377 PolarHBondContact O-N 3.48Å; E374-L377 PolarHBondContact O-N 3.46Å; L377-Q379 VanDerWaalsContact C-N 3.26Å; L377-Q379 PolarHBondContact O-N 3.17Å; L377-I380 PolarHBondContact O-N 3.03Å; L377-I380 VanDerWaalsContact O-N 3.15Å; L377-E381 WeakPolarHBondContact O-CG 3.39Å; L377-E381 PolarHBondContact O-N 2.91Å; L377-L399 HydrophobicContact CD2-CB 4.1Å; L377-L399 HydrophobicContact CD2-CD1 4.07Å; L377-L399 HydrophobicContact CG-CD1 4.31Å
378	I	96.1	Very high	93.4	Very high	86 Å²	86	72 Å²	72	44%	0.441	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-38.9	174.6	-67.7	165	0	0	0	111.3	E374 K382	E374-I378 WeakPolarHBondContact O-CD1 3.49Å; E374-I378 VanDerWaalsContact O-CG1 3.29Å; E374-I378 WeakPolarHBondContact O-CG1 3.34Å; E374-I378 PolarHBondContact O-N 2.85Å; I378-K382 HydrophobicContact CG2-CD 4.42Å; I378-K382 WeakPolarHBondContact O-CG 3.36Å; I378-K382 PolarHBondContact O-N 3.29Å
379	Q	94.5	Very high	93.1	Very high	55 Å²	55	70 Å²	70	26%	0.257	35%	0.348	S	S	.	.	H	α-helix	trans	-68.3	-40.7	177.9	-172	65.6	9.2	0	0	111.7	I350 K375 A376 L377 K382 L383	I350-Q379 HydrophobicContact CD1-CG 4.03Å; I350-Q379 HydrophobicContact CG1-CB 4.14Å; I350-Q379 HydrophobicContact CG1-CG 3.79Å; K375-Q379 PolarHBondContact O-N 2.83Å; K375-Q379 VanDerWaalsContact O-N 3.16Å; A376-Q379 PolarHBondContact O-N 3.4Å; L377-Q379 VanDerWaalsContact C-N 3.26Å; L377-Q379 PolarHBondContact O-N 3.17Å; Q379-K382 PolarHBondContact O-N 3.3Å; Q379-L383 HydrophobicContact CG-CD1 4.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.32Å; Q379-L383 PolarHBondContact O-N 3.02Å; Q379-L383 VanDerWaalsContact O-N 3.1Å
380	I	95.5	Very high	92.8	Very high	4 Å²	4	74.4 Å²	74.4	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-45	175.6	-69.9	168	0	0	0	110.7	I350 A376 L377 K382 L383 S384 F395 H396 L399	I350-I380 HydrophobicContact CD1-CG1 3.65Å; I350-I380 HydrophobicContact CG1-CG1 4.17Å; I350-I380 HydrophobicContact CG2-CD1 3.92Å; I350-I380 HydrophobicContact CG2-CG1 3.98Å; A376-I380 WeakPolarHBondContact O-CG1 3.27Å; A376-I380 PolarHBondContact O-N 3.41Å; L377-I380 PolarHBondContact O-N 3.03Å; L377-I380 VanDerWaalsContact O-N 3.15Å; I380-K382 VanDerWaalsContact C-N 3.28Å; I380-K382 PolarHBondContact O-N 3.13Å; I380-L383 PolarHBondContact O-N 3Å; I380-S384 VanDerWaalsContact O-CB 3.32Å; I380-S384 WeakPolarHBondContact O-CB 3.44Å; I380-S384 PolarHBondContact O-N 3.22Å; I380-S384 PolarHBondContact O-OG 2.92Å; I380-F395 HydrophobicContact CD1-CB 3.97Å; I380-H396 HydrophobicContact CD1-CB 4.21Å; I380-H396 HydrophobicContact CG2-CB 4.21Å; I380-L399 HydrophobicContact CD1-CD1 3.52Å
381	E	93.6	Very high	92.7	Very high	118 Å²	118	72.7 Å²	72.7	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-60.4	-36.4	178.4	-74.1	173.6	-176.2	0	0	112.7	L377 S384	L377-E381 WeakPolarHBondContact O-CG 3.39Å; L377-E381 PolarHBondContact O-N 2.91Å; E381-S384 PolarHBondContact O-OG 3.38Å; E381-S384 VanDerWaalsContact O-OG 3.06Å
382	K	94.1	Very high	92.5	Very high	131 Å²	131	66.2 Å²	66.2	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-69.8	-41.2	175.6	-72	174.6	-178.3	-178.5	0	112.4	I378 Q379 I380	I378-K382 HydrophobicContact CG2-CD 4.42Å; I378-K382 WeakPolarHBondContact O-CG 3.36Å; I378-K382 PolarHBondContact O-N 3.29Å; Q379-K382 PolarHBondContact O-N 3.3Å; I380-K382 VanDerWaalsContact C-N 3.28Å; I380-K382 PolarHBondContact O-N 3.13Å
383	L	93.3	Very high	92.3	Very high	36 Å²	36	67.1 Å²	67.1	19%	0.188	35%	0.352	C	S	.	.	H	α-helix	trans	-76	-34.1	-178.2	-69.3	176.5	0	0	0	112.4	E346 I350 Q379 I380 V385 F386 D387 L392	E346-L383 HydrophobicContact CB-CD1 3.69Å; E346-L383 HydrophobicContact CB-CD2 4.19Å; E346-L383 HydrophobicContact CG-CD2 4.42Å; I350-L383 HydrophobicContact CD1-CD1 3.64Å; Q379-L383 HydrophobicContact CG-CD1 4.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.32Å; Q379-L383 PolarHBondContact O-N 3.02Å; Q379-L383 VanDerWaalsContact O-N 3.1Å; I380-L383 PolarHBondContact O-N 3Å; L383-V385 PolarHBondContact O-N 3.33Å; L383-V385 VanDerWaalsContact O-N 3.07Å; L383-F386 PolarHBondContact O-N 3.27Å; L383-D387 WeakPolarHBondContact O-CB 3.16Å; L383-D387 PolarHBondContact O-N 3.45Å; L383-L392 HydrophobicContact CB-CD1 4.08Å; L383-L392 HydrophobicContact CD1-CD2 4.4Å
384	S	89.9	Confident	92.2	Very high	64 Å²	64	69.1 Å²	69.1	45%	0.448	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.4	-177.5	65.2	0	0	0	0	114.1	I380 E381 F386	I380-S384 VanDerWaalsContact O-CB 3.32Å; I380-S384 WeakPolarHBondContact O-CB 3.44Å; I380-S384 PolarHBondContact O-N 3.22Å; I380-S384 PolarHBondContact O-OG 2.92Å; E381-S384 PolarHBondContact O-OG 3.38Å; E381-S384 VanDerWaalsContact O-OG 3.06Å; S384-F386 VanDerWaalsContact C-N 3.28Å
385	V	89.5	Confident	92.2	Very high	104 Å²	104	65.8 Å²	65.8	63%	0.63	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-34.4	172.3	-179.7	0	0	0	0	111.6	L383	L383-V385 PolarHBondContact O-N 3.33Å; L383-V385 VanDerWaalsContact O-N 3.07Å
386	F	86.5	Confident	92.1	Very high	164 Å²	164	61.8 Å²	61.8	72%	0.719	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-23.9	-173.3	-54.7	-74.3	0	0	0	113.4	L383 S384	L383-F386 PolarHBondContact O-N 3.27Å; S384-F386 VanDerWaalsContact C-N 3.28Å
387	D	84.5	Confident	92	Very high	50 Å²	50	61.9 Å²	61.9	27%	0.267	33%	0.333	S	S	.	.			trans	-112.8	115.4	-174.6	-174.6	0.1	0	0	0	111	H347 L383 S389 L392	H347-D387 IonicContact CD2-OD2 2.93Å; H347-D387 IonicContact CE1-OD2 3.7Å; H347-D387 PolarHBondContact CE1-OD2 3.48Å; H347-D387 VanDerWaalsContact CE1-OD2 3.25Å; H347-D387 IonicContact NE2-OD2 2.92Å; H347-D387 PolarHBondContact NE2-OD2 2.93Å; L383-D387 WeakPolarHBondContact O-CB 3.16Å; L383-D387 PolarHBondContact O-N 3.45Å; D387-S389 VanDerWaalsContact C-N 3.32Å; D387-S389 WeakPolarHBondContact OD1-CA 3.2Å; D387-S389 WeakPolarHBondContact OD1-CB 3.16Å; D387-S389 PolarHBondContact OD1-N 3.07Å; D387-L392 HydrophobicContact CB-CD1 3.7Å; D387-L392 WeakPolarHBondContact OD2-CD1 3.5Å
388	T	83.1	Confident	92	Very high	140 Å²	140	61.2 Å²	61.2	86%	0.859	33%	0.33	S	S	*	.			trans	-95.3	19.6	177.4	63.1	0	0	0	0	112.5
389	S	87.7	Confident	92	Very high	32 Å²	32	57.1 Å²	57.1	22%	0.224	31%	0.309	C	S	.	.			trans	-61.9	130.7	-177.7	177.1	0	0	0	0	111.5	D387 L391 L392	D387-S389 VanDerWaalsContact C-N 3.32Å; D387-S389 WeakPolarHBondContact OD1-CA 3.2Å; D387-S389 WeakPolarHBondContact OD1-CB 3.16Å; D387-S389 PolarHBondContact OD1-N 3.07Å; S389-L391 PolarHBondContact O-N 3.39Å; S389-L391 VanDerWaalsContact O-N 3.08Å; S389-L391 WeakPolarHBondContact OG-CB 3Å; S389-L391 PolarHBondContact OG-N 3.46Å; S389-L392 PolarHBondContact O-N 3.2Å; S389-L392 VanDerWaalsContact O-N 3.1Å
390	P	89.2	Confident	92.1	Very high	97 Å²	97	54.8 Å²	54.8	63%	0.63	30%	0.299	S	S	*	.	H	α-helix	trans	-61.1	-20	175.4	26.2	-34.6	0	0	0	112.7	T393 V394	P390-T393 WeakPolarHBondContact O-CB 3.44Å; P390-T393 PolarHBondContact O-N 3.16Å; P390-V394 WeakPolarHBondContact O-CG2 3.45Å; P390-V394 PolarHBondContact O-N 3.34Å; P390-V394 VanDerWaalsContact O-N 3.14Å
391	L	91.3	Very high	92.1	Very high	56 Å²	56	55.5 Å²	55.5	29%	0.293	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-37.7	176.4	-174.7	59.8	0	0	0	112.1	M343 S389 T393 V394 F395	M343-L391 HydrophobicContact CE-CD2 4.26Å; S389-L391 PolarHBondContact O-N 3.39Å; S389-L391 VanDerWaalsContact O-N 3.08Å; S389-L391 WeakPolarHBondContact OG-CB 3Å; S389-L391 PolarHBondContact OG-N 3.46Å; L391-T393 VanDerWaalsContact C-N 3.32Å; L391-T393 PolarHBondContact O-N 2.89Å; L391-V394 WeakPolarHBondContact O-CB 3.47Å; L391-V394 PolarHBondContact O-N 3.13Å; L391-V394 VanDerWaalsContact O-N 3.15Å; L391-F395 HydrophobicContact CD1-CD1 4.45Å; L391-F395 HydrophobicContact CD1-CE1 3.83Å; L391-F395 HydrophobicContact CD1-CE2 4.18Å; L391-F395 HydrophobicContact CD1-CZ 3.69Å; L391-F395 HydrophobicContact CD2-CE2 3.93Å; L391-F395 HydrophobicContact CD2-CZ 3.82Å; L391-F395 HydrophobicContact CG-CD2 4.21Å; L391-F395 HydrophobicContact CG-CE1 4.2Å; L391-F395 HydrophobicContact CG-CE2 3.61Å; L391-F395 HydrophobicContact CG-CZ 3.6Å; L391-F395 WeakPolarHBondContact O-CG 3.37Å; L391-F395 PolarHBondContact O-N 2.88Å
392	L	93	Very high	92.2	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-40.4	175.9	-71.4	179.4	0	0	0	111.3	I350 L383 D387 S389 V394 F395 H396	I350-L392 HydrophobicContact CD1-CD2 3.78Å; L383-L392 HydrophobicContact CB-CD1 4.08Å; L383-L392 HydrophobicContact CD1-CD2 4.4Å; D387-L392 HydrophobicContact CB-CD1 3.7Å; D387-L392 WeakPolarHBondContact OD2-CD1 3.5Å; S389-L392 PolarHBondContact O-N 3.2Å; S389-L392 VanDerWaalsContact O-N 3.1Å; L392-V394 VanDerWaalsContact C-N 3.31Å; L392-V394 PolarHBondContact O-N 3.36Å; L392-F395 HydrophobicContact CD2-CD2 4.41Å; L392-F395 PolarHBondContact O-N 3.14Å; L392-H396 WeakPolarHBondContact O-CB 3.33Å; L392-H396 PolarHBondContact O-N 3.16Å
393	T	93.1	Very high	92.3	Very high	34 Å²	34	45.9 Å²	45.9	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-42.7	173.4	-51.6	0	0	0	0	111.3	P390 L391 H396 L397 I426 L433	P390-T393 WeakPolarHBondContact O-CB 3.44Å; P390-T393 PolarHBondContact O-N 3.16Å; L391-T393 VanDerWaalsContact C-N 3.32Å; L391-T393 PolarHBondContact O-N 2.89Å; T393-H396 PolarHBondContact O-N 3.09Å; T393-L397 WeakPolarHBondContact O-CB 3.4Å; T393-L397 PolarHBondContact O-N 3.34Å; T393-I426 HydrophobicContact CG2-CG2 3.46Å; T393-I426 VanDerWaalsContact CG2-CG2 3.46Å; T393-L433 HydrophobicContact CG2-CD2 3.79Å
394	V	94	Very high	92.5	Very high	44 Å²	44	44.2 Å²	44.2	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-40.4	177.6	174.2	0	0	0	0	111.7	P390 L391 L392 S398 L433	P390-V394 WeakPolarHBondContact O-CG2 3.45Å; P390-V394 PolarHBondContact O-N 3.34Å; P390-V394 VanDerWaalsContact O-N 3.14Å; L391-V394 WeakPolarHBondContact O-CB 3.47Å; L391-V394 PolarHBondContact O-N 3.13Å; L391-V394 VanDerWaalsContact O-N 3.15Å; L392-V394 VanDerWaalsContact C-N 3.31Å; L392-V394 PolarHBondContact O-N 3.36Å; V394-S398 WeakPolarHBondContact O-CB 3.37Å; V394-S398 PolarHBondContact O-N 3.06Å; V394-S398 PolarHBondContact O-OG 3.1Å; V394-L433 HydrophobicContact CG2-CD1 4.08Å
395	F	96	Very high	92.8	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.048	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-45.4	175.1	-66.9	-30.1	0	0	0	112.1	H347 I350 L351 L354 I380 L391 L392 L397 S398 L399	H347-F395 HydrophobicContact CB-CE2 4.06Å; I350-F395 HydrophobicContact CB-CD2 4.2Å; I350-F395 HydrophobicContact CG2-CB 3.78Å; I350-F395 HydrophobicContact CG2-CD2 3.61Å; I350-F395 HydrophobicContact CG2-CE2 4.34Å; I350-F395 HydrophobicContact CG2-CG 3.83Å; L351-F395 HydrophobicContact CB-CE1 4.39Å; L351-F395 HydrophobicContact CB-CZ 4.14Å; L351-F395 HydrophobicContact CD1-CE1 4.01Å; L351-F395 HydrophobicContact CD1-CZ 4.5Å; L354-F395 HydrophobicContact CD2-CD1 4.09Å; I380-F395 HydrophobicContact CD1-CB 3.97Å; L391-F395 HydrophobicContact CD1-CD1 4.45Å; L391-F395 HydrophobicContact CD1-CE1 3.83Å; L391-F395 HydrophobicContact CD1-CE2 4.18Å; L391-F395 HydrophobicContact CD1-CZ 3.69Å; L391-F395 HydrophobicContact CD2-CE2 3.93Å; L391-F395 HydrophobicContact CD2-CZ 3.82Å; L391-F395 HydrophobicContact CG-CD2 4.21Å; L391-F395 HydrophobicContact CG-CE1 4.2Å; L391-F395 HydrophobicContact CG-CE2 3.61Å; L391-F395 HydrophobicContact CG-CZ 3.6Å; L391-F395 WeakPolarHBondContact O-CG 3.37Å; L391-F395 PolarHBondContact O-N 2.88Å; L392-F395 HydrophobicContact CD2-CD2 4.41Å; L392-F395 PolarHBondContact O-N 3.14Å; F395-L397 PolarHBondContact O-N 3.26Å; F395-S398 PolarHBondContact O-N 3Å; F395-L399 WeakPolarHBondContact O-CG 3.32Å; F395-L399 PolarHBondContact O-N 3.19Å
396	H	95.7	Very high	93.1	Very high	39 Å²	39	39.1 Å²	39.1	18%	0.181	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-51.9	177.2	-167.6	164.1	0	0	0	110.3	I380 L392 T393 S398 L399 L400 I426	I380-H396 HydrophobicContact CD1-CB 4.21Å; I380-H396 HydrophobicContact CG2-CB 4.21Å; L392-H396 WeakPolarHBondContact O-CB 3.33Å; L392-H396 PolarHBondContact O-N 3.16Å; T393-H396 PolarHBondContact O-N 3.09Å; H396-S398 VanDerWaalsContact C-N 3.35Å; H396-S398 PolarHBondContact O-N 2.71Å; H396-L399 PolarHBondContact O-N 2.97Å; H396-L400 WeakPolarHBondContact O-CG 3.49Å; H396-L400 PolarHBondContact O-N 2.9Å; H396-I426 HydrophobicContact CB-CD1 4.47Å
397	L	95.1	Very high	93.5	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-45	179.2	-177.2	63.7	0	0	0	112	T393 F395 L399 L400 E401 A423 C427 L433 R437	T393-L397 WeakPolarHBondContact O-CB 3.4Å; T393-L397 PolarHBondContact O-N 3.34Å; F395-L397 PolarHBondContact O-N 3.26Å; L397-L399 VanDerWaalsContact C-N 3.29Å; L397-L399 PolarHBondContact O-N 3.35Å; L397-L400 PolarHBondContact O-N 3.08Å; L397-E401 WeakPolarHBondContact O-CG 3.34Å; L397-E401 PolarHBondContact O-N 2.85Å; L397-A423 HydrophobicContact CD1-CB 3.55Å; L397-C427 WeakPolarHBondContact CD2-SG 3.5Å; L397-L433 HydrophobicContact CD2-CD1 4.44Å; L397-L433 HydrophobicContact CD2-CD2 3.87Å; L397-L433 HydrophobicContact CD2-CG 4.12Å; L397-R437 HydrophobicContact CD2-CB 3.95Å; L397-R437 HydrophobicContact CD2-CG 3.52Å
398	S	95.5	Very high	94.1	Very high	13 Å²	13	32.8 Å²	32.8	9%	0.091	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-35.2	179.9	-55.2	0	0	0	0	112.1	V394 F395 H396 H402 R437	V394-S398 WeakPolarHBondContact O-CB 3.37Å; V394-S398 PolarHBondContact O-N 3.06Å; V394-S398 PolarHBondContact O-OG 3.1Å; F395-S398 PolarHBondContact O-N 3Å; H396-S398 VanDerWaalsContact C-N 3.35Å; H396-S398 PolarHBondContact O-N 2.71Å; S398-H402 PolarHBondContact O-N 3.42Å; S398-H402 PolarHBondContact O-ND1 2.83Å; S398-R437 PolarHBondContact OG-NH2 3.14Å
399	L	97.5	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.9	-41.9	173.9	-72.7	163.7	0	0	0	111.9	L354 V357 A373 A376 L377 I380 F395 H396 L397 H402 T403	L354-L399 HydrophobicContact CB-CD2 4.31Å; L354-L399 HydrophobicContact CD1-CD2 3.82Å; L354-L399 HydrophobicContact CD1-CG 4.07Å; V357-L399 HydrophobicContact CG2-CD2 4.16Å; A373-L399 HydrophobicContact CB-CD2 4.32Å; A376-L399 HydrophobicContact CB-CD1 3.51Å; A376-L399 HydrophobicContact CB-CD2 3.94Å; A376-L399 HydrophobicContact CB-CG 4.39Å; L377-L399 HydrophobicContact CD2-CB 4.1Å; L377-L399 HydrophobicContact CD2-CD1 4.07Å; L377-L399 HydrophobicContact CG-CD1 4.31Å; I380-L399 HydrophobicContact CD1-CD1 3.52Å; F395-L399 WeakPolarHBondContact O-CG 3.32Å; F395-L399 PolarHBondContact O-N 3.19Å; H396-L399 PolarHBondContact O-N 2.97Å; L397-L399 VanDerWaalsContact C-N 3.29Å; L397-L399 PolarHBondContact O-N 3.35Å; L399-H402 PolarHBondContact O-N 3.43Å; L399-T403 WeakPolarHBondContact O-CB 3.4Å; L399-T403 WeakPolarHBondContact O-CG2 3.35Å; L399-T403 PolarHBondContact O-N 2.93Å; L399-T403 PolarHBondContact O-OG1 3.35Å
400	L	96.6	Very high	94.8	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-42.8	175.8	-69.2	171.8	0	0	0	111.7	H396 L397 H402 T403 A404 D419 Q422 A423 I426	H396-L400 WeakPolarHBondContact O-CG 3.49Å; H396-L400 PolarHBondContact O-N 2.9Å; L397-L400 PolarHBondContact O-N 3.08Å; L400-H402 VanDerWaalsContact C-N 3.33Å; L400-H402 PolarHBondContact O-N 3.05Å; L400-T403 VanDerWaalsContact CA-OG1 3.28Å; L400-T403 WeakPolarHBondContact CA-OG1 3.39Å; L400-T403 PolarHBondContact O-N 2.9Å; L400-T403 PolarHBondContact O-OG1 3.14Å; L400-T403 VanDerWaalsContact O-OG1 3.13Å; L400-A404 WeakPolarHBondContact O-CB 3.41Å; L400-A404 PolarHBondContact O-N 3.47Å; L400-D419 HydrophobicContact CD2-CB 4.2Å; L400-Q422 HydrophobicContact CD1-CB 4.08Å; L400-Q422 HydrophobicContact CD1-CG 3.66Å; L400-Q422 HydrophobicContact CD2-CG 4.39Å; L400-A423 HydrophobicContact CB-CB 4.2Å; L400-A423 HydrophobicContact CD1-CB 4.27Å; L400-I426 HydrophobicContact CD1-CD1 3.58Å
401	E	95.7	Very high	95	Very high	18 Å²	18	23.4 Å²	23.4	8%	0.084	12%	0.123	C	C	.	.	H	α-helix	trans	-56	-47.5	175.6	-69.6	169.4	175.3	0	0	111.3	L397 M405 R437 L444	L397-E401 WeakPolarHBondContact O-CG 3.34Å; L397-E401 PolarHBondContact O-N 2.85Å; E401-M405 WeakPolarHBondContact O-CE 3.28Å; E401-M405 WeakPolarHBondContact O-CG 3.08Å; E401-M405 PolarHBondContact O-N 3.34Å; E401-R437 VanDerWaalsContact CD-NH1 3.27Å; E401-R437 WeakPolarHBondContact OE1-CD 3.41Å; E401-R437 IonicContact OE1-CZ 2.59Å; E401-R437 IonicContact OE1-NE 3.9Å; E401-R437 IonicContact OE1-NH1 3.07Å; E401-R437 PolarHBondContact OE1-NH1 3.11Å; E401-R437 IonicContact OE2-CZ 2.63Å; E401-R437 IonicContact OE2-NH1 3.21Å; E401-R437 PolarHBondContact OE2-NH1 3.17Å; E401-L444 HydrophobicContact CB-CD1 4.19Å; E401-L444 HydrophobicContact CG-CD1 3.99Å
402	H	95.9	Very high	95.2	Very high	33 Å²	33	23.3 Å²	23.3	15%	0.153	12%	0.124	C	C	.	.	H	α-helix	trans	-73	-39.1	-179	-71.6	82.9	0	0	0	113.4	V357 M361 S398 L399 L400 M405 G406	V357-H402 HydrophobicContact CG1-CB 3.76Å; M361-H402 WeakPolarHBondContact CE-O 3.46Å; S398-H402 PolarHBondContact O-N 3.42Å; S398-H402 PolarHBondContact O-ND1 2.83Å; L399-H402 PolarHBondContact O-N 3.43Å; L400-H402 VanDerWaalsContact C-N 3.33Å; L400-H402 PolarHBondContact O-N 3.05Å; H402-M405 PolarHBondContact O-N 2.94Å; H402-G406 PolarHBondContact O-N 3.39Å
403	T	96.1	Very high	95.4	Very high	15 Å²	15	23.5 Å²	23.5	9%	0.092	13%	0.125	C	C	.	.	H	α-helix	trans	-68.8	-39.7	178.2	46.8	0	0	0	0	111.8	A373 L399 L400 G406 R407 D419	A373-T403 HydrophobicContact CB-CG2 3.31Å; L399-T403 WeakPolarHBondContact O-CB 3.4Å; L399-T403 WeakPolarHBondContact O-CG2 3.35Å; L399-T403 PolarHBondContact O-N 2.93Å; L399-T403 PolarHBondContact O-OG1 3.35Å; L400-T403 VanDerWaalsContact CA-OG1 3.28Å; L400-T403 WeakPolarHBondContact CA-OG1 3.39Å; L400-T403 PolarHBondContact O-N 2.9Å; L400-T403 PolarHBondContact O-OG1 3.14Å; L400-T403 VanDerWaalsContact O-OG1 3.13Å; T403-G406 PolarHBondContact O-N 3.16Å; T403-R407 WeakPolarHBondContact O-CB 3.43Å; T403-R407 VanDerWaalsContact O-CG 3.3Å; T403-R407 WeakPolarHBondContact O-CG 3.5Å; T403-R407 PolarHBondContact O-N 2.83Å; T403-D419 PolarHBondContact OG1-OD2 2.88Å
404	A	96.9	Very high	95.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.9	-51.8	171.5	0	0	0	0	0	110.9	L400 G406 R407 L408 D419 I420	L400-A404 WeakPolarHBondContact O-CB 3.41Å; L400-A404 PolarHBondContact O-N 3.47Å; A404-G406 VanDerWaalsContact C-N 3.3Å; A404-G406 PolarHBondContact O-N 2.92Å; A404-R407 PolarHBondContact O-N 2.5Å; A404-L408 WeakPolarHBondContact O-CG 3.3Å; A404-L408 PolarHBondContact O-N 3.18Å; A404-D419 HydrophobicContact CB-CB 3.92Å; A404-I420 HydrophobicContact CB-CG1 3.99Å
405	M	96	Very high	95.7	Very high	56 Å²	56	21.2 Å²	21.2	28%	0.276	11%	0.113	S	C	.	.	H	α-helix	trans	-57.2	-42.6	175.9	-72.5	-173.6	-73.5	0	0	112.4	M361 E401 H402 L408 V409 L444 L447	M361-M405 HydrophobicContact CE-CB 3.9Å; E401-M405 WeakPolarHBondContact O-CE 3.28Å; E401-M405 WeakPolarHBondContact O-CG 3.08Å; E401-M405 PolarHBondContact O-N 3.34Å; H402-M405 PolarHBondContact O-N 2.94Å; M405-L408 PolarHBondContact O-N 3.26Å; M405-V409 WeakPolarHBondContact O-CG2 3.27Å; M405-V409 PolarHBondContact O-N 2.92Å; M405-L444 HydrophobicContact CG-CD2 3.5Å; M405-L444 HydrophobicContact SD-CD2 4.28Å; M405-L447 HydrophobicContact CG-CD1 4.49Å
406	G	94.9	Very high	95.8	Very high	5 Å²	5	20.7 Å²	20.7	5%	0.052	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-43.8	177.9	0	0	0	0	0	112.4	H402 T403 A404 V409 M410	H402-G406 PolarHBondContact O-N 3.39Å; T403-G406 PolarHBondContact O-N 3.16Å; A404-G406 VanDerWaalsContact C-N 3.3Å; A404-G406 PolarHBondContact O-N 2.92Å; G406-V409 WeakPolarHBondContact O-CB 3.41Å; G406-V409 PolarHBondContact O-N 3.39Å; G406-M410 VanDerWaalsContact O-CG 3.29Å; G406-M410 WeakPolarHBondContact O-CG 3.46Å; G406-M410 PolarHBondContact O-N 3.37Å
407	R	96.1	Very high	95.8	Very high	59 Å²	59	18.9 Å²	18.9	22%	0.223	10%	0.103	C	C	.	.	H	α-helix	trans	-66.9	-35.9	178.8	-72.7	175.1	-176.2	174.4	13.6	112.7	T403 A404 V409 M410 G411 V412 A415 A416 D419	T403-R407 WeakPolarHBondContact O-CB 3.43Å; T403-R407 VanDerWaalsContact O-CG 3.3Å; T403-R407 WeakPolarHBondContact O-CG 3.5Å; T403-R407 PolarHBondContact O-N 2.83Å; A404-R407 PolarHBondContact O-N 2.5Å; R407-V409 VanDerWaalsContact C-N 3.31Å; R407-V409 PolarHBondContact O-N 3.39Å; R407-M410 PolarHBondContact O-N 3.37Å; R407-G411 PolarHBondContact O-N 3.44Å; R407-V412 HydrophobicContact CB-CB 4.5Å; R407-V412 PolarHBondContact O-N 2.96Å; R407-A415 PolarHBondContact NH1-O 2.93Å; R407-A416 HydrophobicContact CB-CB 3.78Å; R407-D419 VanDerWaalsContact CD-OD2 3.29Å; R407-D419 WeakPolarHBondContact CD-OD2 3.25Å; R407-D419 IonicContact CZ-OD1 3.46Å; R407-D419 IonicContact CZ-OD2 3.35Å; R407-D419 IonicContact NE-OD2 3.95Å; R407-D419 PolarHBondContact NE-OD2 3.04Å; R407-D419 IonicContact NH1-OD1 2.62Å; R407-D419 PolarHBondContact NH1-OD1 3.42Å; R407-D419 IonicContact NH1-OD2 3.49Å; R407-D419 PolarHBondContact NH1-OD2 3.5Å; R407-D419 IonicContact NH2-OD1 3.48Å; R407-D419 IonicContact NH2-OD2 2.89Å
408	L	95.9	Very high	95.9	Very high	23 Å²	23	23 Å²	23	12%	0.12	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-43.2	172.6	-69.9	177.9	0	0	0	111.5	A404 M405 G411 A416 L447 Y448	A404-L408 WeakPolarHBondContact O-CG 3.3Å; A404-L408 PolarHBondContact O-N 3.18Å; M405-L408 PolarHBondContact O-N 3.26Å; L408-G411 PolarHBondContact O-N 3.19Å; L408-A416 HydrophobicContact CD2-CB 3.58Å; L408-A416 HydrophobicContact CG-CB 3.84Å; L408-L447 HydrophobicContact CD1-CB 3.77Å; L408-Y448 HydrophobicContact CD2-CD2 3.88Å; L408-Y448 HydrophobicContact CD2-CG 4.46Å
409	V	92.7	Very high	95.9	Very high	27 Å²	27	23.1 Å²	23.1	16%	0.164	12%	0.121	C	C	.	.	H	α-helix	trans	-66.7	-41.8	177	172	0	0	0	0	111.9	L366 M405 G406 R407 G411 D627	L366-V409 HydrophobicContact CD1-CB 3.9Å; L366-V409 HydrophobicContact CD1-CG1 3.41Å; L366-V409 VanDerWaalsContact CD1-CG1 3.41Å; M405-V409 WeakPolarHBondContact O-CG2 3.27Å; M405-V409 PolarHBondContact O-N 2.92Å; G406-V409 WeakPolarHBondContact O-CB 3.41Å; G406-V409 PolarHBondContact O-N 3.39Å; R407-V409 VanDerWaalsContact C-N 3.31Å; R407-V409 PolarHBondContact O-N 3.39Å; V409-G411 PolarHBondContact O-N 3.36Å; V409-D627 HydrophobicContact CG1-CB 4.13Å; V409-D627 WeakPolarHBondContact CG1-OD2 3.48Å
410	M	93.8	Very high	95.9	Very high	39 Å²	39	23.3 Å²	23.3	19%	0.192	12%	0.122	C	C	.	.	H	α-helix	trans	-68.2	-11.2	176.6	-65.4	175.1	73.6	0	0	113.3	L366 G406 R407 V412 P626	L366-M410 HydrophobicContact CB-CG 4.23Å; L366-M410 HydrophobicContact CB-SD 4.1Å; L366-M410 HydrophobicContact CD1-CG 3.74Å; G406-M410 VanDerWaalsContact O-CG 3.29Å; G406-M410 WeakPolarHBondContact O-CG 3.46Å; G406-M410 PolarHBondContact O-N 3.37Å; R407-M410 PolarHBondContact O-N 3.37Å; M410-V412 HydrophobicContact CB-CG2 4.16Å; M410-P626 VanDerWaalsContact CA-O 3.31Å; M410-P626 WeakPolarHBondContact CA-O 3.3Å; M410-P626 HydrophobicContact CE-CB 4.18Å; M410-P626 HydrophobicContact CG-CB 4.26Å; M410-P626 HydrophobicContact CG-CG 4.43Å; M410-P626 WeakPolarHBondContact CG-O 3.23Å
411	G	93.8	Very high	95.8	Very high	6 Å²	6	23 Å²	23	6%	0.062	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	39.9	-175.1	0	0	0	0	0	113.2	R407 L408 V409 Q413 E668	R407-G411 PolarHBondContact O-N 3.44Å; L408-G411 PolarHBondContact O-N 3.19Å; V409-G411 PolarHBondContact O-N 3.36Å; G411-Q413 PolarHBondContact O-OE1 3.13Å; G411-E668 WeakPolarHBondContact O-CG 3.5Å
412	V	95.7	Very high	95.8	Very high	53 Å²	53	25 Å²	25	32%	0.321	13%	0.13	S	C	.	.			trans	-111	65.9	171.2	-166.4	0	0	0	0	108.3	R407 M410 T414 A415 A416	R407-V412 HydrophobicContact CB-CB 4.5Å; R407-V412 PolarHBondContact O-N 2.96Å; M410-V412 HydrophobicContact CB-CG2 4.16Å; V412-T414 VanDerWaalsContact C-N 3.31Å; V412-T414 PolarHBondContact O-N 3.09Å; V412-A415 HydrophobicContact CG1-CB 3.74Å; V412-A415 PolarHBondContact O-N 3.36Å; V412-A416 PolarHBondContact O-N 2.88Å
413	Q	96.8	Very high	95.7	Very high	10 Å²	10	23.4 Å²	23.4	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-35.2	-170.5	-72.7	84.8	-10.9	0	0	112.9	G411 A416 A417 Y448 M452 E668 H669 A672	G411-Q413 PolarHBondContact O-OE1 3.13Å; Q413-A416 PolarHBondContact O-N 3.49Å; Q413-A417 WeakPolarHBondContact O-CB 3.44Å; Q413-A417 PolarHBondContact O-N 3.3Å; Q413-Y448 HydrophobicContact CB-CE2 4.03Å; Q413-Y448 WeakPolarHBondContact O-CE2 3.45Å; Q413-M452 HydrophobicContact CB-SD 3.87Å; Q413-M452 HydrophobicContact CG-SD 3.77Å; Q413-E668 HydrophobicContact CB-CG 4.37Å; Q413-E668 PolarHBondContact N-OE1 3.24Å; Q413-H669 PolarHBondContact NE2-NE2 2.86Å; Q413-A672 HydrophobicContact CB-CB 3.81Å
414	T	97.3	Very high	95.5	Very high	11 Å²	11	23.1 Å²	23.1	7%	0.067	12%	0.12	C	C	.	.	H	α-helix	trans	-62.7	-49.4	179.9	-47.8	0	0	0	0	110.7	V412 A416 A417 Q418 E668 R671 A672 A675	V412-T414 VanDerWaalsContact C-N 3.31Å; V412-T414 PolarHBondContact O-N 3.09Å; T414-A416 VanDerWaalsContact C-N 3.31Å; T414-A416 PolarHBondContact O-N 3.48Å; T414-A417 PolarHBondContact O-N 3.25Å; T414-Q418 WeakPolarHBondContact O-CG 3.39Å; T414-Q418 PolarHBondContact O-N 2.99Å; T414-E668 WeakPolarHBondContact CB-OE1 3.03Å; T414-E668 PolarHBondContact N-OE1 3.33Å; T414-E668 PolarHBondContact OG1-OE1 2.76Å; T414-R671 WeakPolarHBondContact OG1-CB 3.31Å; T414-A672 PolarHBondContact OG1-N 3.42Å; T414-A675 HydrophobicContact CG2-CB 4.12Å
415	A	96.4	Very high	95.2	Very high	19 Å²	19	26.9 Å²	26.9	16%	0.157	14%	0.135	C	C	.	.	H	α-helix	trans	-70.9	-29.2	-179.8	0	0	0	0	0	112	R407 V412 D419	R407-A415 PolarHBondContact NH1-O 2.93Å; V412-A415 HydrophobicContact CG1-CB 3.74Å; V412-A415 PolarHBondContact O-N 3.36Å; A415-D419 PolarHBondContact O-N 3.26Å; A415-D419 VanDerWaalsContact O-N 3.14Å
416	A	97.2	Very high	95	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.1	-43.9	171.3	0	0	0	0	0	111.6	R407 L408 V412 Q413 T414 Q418 D419 I420	R407-A416 HydrophobicContact CB-CB 3.78Å; L408-A416 HydrophobicContact CD2-CB 3.58Å; L408-A416 HydrophobicContact CG-CB 3.84Å; V412-A416 PolarHBondContact O-N 2.88Å; Q413-A416 PolarHBondContact O-N 3.49Å; T414-A416 VanDerWaalsContact C-N 3.31Å; T414-A416 PolarHBondContact O-N 3.48Å; A416-Q418 VanDerWaalsContact C-N 3.31Å; A416-Q418 PolarHBondContact O-N 2.96Å; A416-D419 PolarHBondContact O-N 2.91Å; A416-I420 VanDerWaalsContact O-CG1 3.3Å; A416-I420 WeakPolarHBondContact O-CG1 3.47Å; A416-I420 PolarHBondContact O-N 3.24Å
417	A	96.7	Very high	94.8	Very high	2 Å²	2	25 Å²	25	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-40.3	176.3	0	0	0	0	0	111.8	Q413 T414 I420 G421 Y448 E677	Q413-A417 WeakPolarHBondContact O-CB 3.44Å; Q413-A417 PolarHBondContact O-N 3.3Å; T414-A417 PolarHBondContact O-N 3.25Å; A417-I420 PolarHBondContact O-N 2.91Å; A417-G421 PolarHBondContact O-N 3.14Å; A417-Y448 HydrophobicContact CB-CD2 4.28Å; A417-Y448 HydrophobicContact CB-CE2 3.75Å; A417-E677 HydrophobicContact CB-CB 3.87Å; A417-E677 WeakPolarHBondContact O-CB 3.26Å
418	Q	96.2	Very high	94.3	Very high	89 Å²	89	27 Å²	27	42%	0.416	14%	0.136	S	C	.	.	H	α-helix	trans	-61.4	-43.1	174.5	-72.2	171.9	-12.6	0	0	112.9	T414 A416 I420 G421 Q422	T414-Q418 WeakPolarHBondContact O-CG 3.39Å; T414-Q418 PolarHBondContact O-N 2.99Å; A416-Q418 VanDerWaalsContact C-N 3.31Å; A416-Q418 PolarHBondContact O-N 2.96Å; Q418-I420 VanDerWaalsContact C-N 3.33Å; Q418-I420 PolarHBondContact O-N 3.16Å; Q418-G421 PolarHBondContact O-N 3.02Å; Q418-Q422 WeakPolarHBondContact O-CB 3.28Å; Q418-Q422 PolarHBondContact O-N 3.29Å
419	D	96.6	Very high	94	Very high	14 Å²	14	29.5 Å²	29.5	8%	0.075	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-40.4	175.6	-72.3	-14.8	0	0	0	111.4	L400 T403 A404 R407 A415 A416 Q422 A423	L400-D419 HydrophobicContact CD2-CB 4.2Å; T403-D419 PolarHBondContact OG1-OD2 2.88Å; A404-D419 HydrophobicContact CB-CB 3.92Å; R407-D419 VanDerWaalsContact CD-OD2 3.29Å; R407-D419 WeakPolarHBondContact CD-OD2 3.25Å; R407-D419 IonicContact CZ-OD1 3.46Å; R407-D419 IonicContact CZ-OD2 3.35Å; R407-D419 IonicContact NE-OD2 3.95Å; R407-D419 PolarHBondContact NE-OD2 3.04Å; R407-D419 IonicContact NH1-OD1 2.62Å; R407-D419 PolarHBondContact NH1-OD1 3.42Å; R407-D419 IonicContact NH1-OD2 3.49Å; R407-D419 PolarHBondContact NH1-OD2 3.5Å; R407-D419 IonicContact NH2-OD1 3.48Å; R407-D419 IonicContact NH2-OD2 2.89Å; A415-D419 PolarHBondContact O-N 3.26Å; A415-D419 VanDerWaalsContact O-N 3.14Å; A416-D419 PolarHBondContact O-N 2.91Å; D419-Q422 PolarHBondContact O-N 3.04Å; D419-A423 WeakPolarHBondContact O-CB 3.42Å; D419-A423 PolarHBondContact O-N 2.91Å
420	I	96.6	Very high	93.8	Very high	4 Å²	4	31 Å²	31	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-44.5	176.1	-65	167.9	0	0	0	110.4	A404 A416 A417 Q418 Q422 A423 Y424 L441 L444 I445 L680	A404-I420 HydrophobicContact CB-CG1 3.99Å; A416-I420 VanDerWaalsContact O-CG1 3.3Å; A416-I420 WeakPolarHBondContact O-CG1 3.47Å; A416-I420 PolarHBondContact O-N 3.24Å; A417-I420 PolarHBondContact O-N 2.91Å; Q418-I420 VanDerWaalsContact C-N 3.33Å; Q418-I420 PolarHBondContact O-N 3.16Å; I420-Q422 VanDerWaalsContact C-N 3.32Å; I420-Q422 PolarHBondContact O-N 2.56Å; I420-A423 PolarHBondContact O-N 3.24Å; I420-Y424 PolarHBondContact O-N 3.1Å; I420-L441 HydrophobicContact CG2-CD1 4.07Å; I420-L444 HydrophobicContact CD1-CB 4.04Å; I420-L444 HydrophobicContact CG1-CB 4.02Å; I420-I445 HydrophobicContact CG2-CD1 4.48Å; I420-I445 HydrophobicContact CG2-CG1 3.65Å; I420-L680 HydrophobicContact CG2-CD1 4.12Å
421	G	94.6	Very high	93.3	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-36.4	175.2	0	0	0	0	0	112.8	A417 Q418 R425	A417-G421 PolarHBondContact O-N 3.14Å; Q418-G421 PolarHBondContact O-N 3.02Å; G421-R425 WeakPolarHBondContact O-CG 3.32Å; G421-R425 PolarHBondContact O-N 3.08Å; G421-R425 VanDerWaalsContact O-N 3.11Å; G421-R425 PolarHBondContact O-NE 3.14Å
422	Q	94.6	Very high	92.7	Very high	59 Å²	59	38.2 Å²	38.2	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-68.8	-44	173.4	-175.9	62.8	9.3	0	0	112.1	L400 Q418 D419 I420 Y424 R425 I426	L400-Q422 HydrophobicContact CD1-CB 4.08Å; L400-Q422 HydrophobicContact CD1-CG 3.66Å; L400-Q422 HydrophobicContact CD2-CG 4.39Å; Q418-Q422 WeakPolarHBondContact O-CB 3.28Å; Q418-Q422 PolarHBondContact O-N 3.29Å; D419-Q422 PolarHBondContact O-N 3.04Å; I420-Q422 VanDerWaalsContact C-N 3.32Å; I420-Q422 PolarHBondContact O-N 2.56Å; Q422-Y424 VanDerWaalsContact C-N 3.29Å; Q422-Y424 PolarHBondContact O-N 2.86Å; Q422-R425 PolarHBondContact O-N 3.36Å; Q422-I426 HydrophobicContact CG-CD1 4.18Å; Q422-I426 WeakPolarHBondContact O-CG1 3.12Å; Q422-I426 PolarHBondContact O-N 3.15Å
423	A	94.3	Very high	92.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-43.7	175.5	0	0	0	0	0	111.1	L397 L400 D419 I420 I426 C427 L441	L397-A423 HydrophobicContact CD1-CB 3.55Å; L400-A423 HydrophobicContact CB-CB 4.2Å; L400-A423 HydrophobicContact CD1-CB 4.27Å; D419-A423 WeakPolarHBondContact O-CB 3.42Å; D419-A423 PolarHBondContact O-N 2.91Å; I420-A423 PolarHBondContact O-N 3.24Å; A423-I426 PolarHBondContact O-N 3.4Å; A423-C427 PolarHBondContact O-N 3Å; A423-C427 PolarHBondContact O-SG 3.47Å; A423-C427 VanDerWaalsContact O-SG 3.34Å; A423-L441 HydrophobicContact CB-CD1 4.24Å
424	Y	91.7	Very high	91.6	Very high	8 Å²	8	37.9 Å²	37.9	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-51.8	173.2	-179.7	-79.3	0	0	0	111.9	I420 Q422 I426 C427 Q428 M434 L441 W683 L688	I420-Y424 PolarHBondContact O-N 3.1Å; Q422-Y424 VanDerWaalsContact C-N 3.29Å; Q422-Y424 PolarHBondContact O-N 2.86Å; Y424-I426 VanDerWaalsContact C-N 3.29Å; Y424-I426 PolarHBondContact O-N 2.57Å; Y424-C427 WeakPolarHBondContact O-CB 3.3Å; Y424-C427 PolarHBondContact O-N 2.82Å; Y424-C427 VanDerWaalsContact O-N 3.1Å; Y424-Q428 HydrophobicContact CD1-CB 4.43Å; Y424-Q428 HydrophobicContact CE1-CB 4.08Å; Y424-Q428 HydrophobicContact CE1-CG 4.37Å; Y424-Q428 PolarHBondContact O-N 3.46Å; Y424-M434 HydrophobicContact CD2-CE 4.39Å; Y424-M434 HydrophobicContact CE2-CE 3.91Å; Y424-L441 HydrophobicContact CD2-CD2 3.64Å; Y424-L441 HydrophobicContact CG-CD2 4.25Å; Y424-W683 HydrophobicContact CD2-CE3 4.43Å; Y424-W683 HydrophobicContact CD2-CH2 4.05Å; Y424-W683 HydrophobicContact CD2-CZ2 4.47Å; Y424-W683 HydrophobicContact CD2-CZ3 4.01Å; Y424-W683 HydrophobicContact CE2-CD2 4.16Å; Y424-W683 AromaticContact CE2-CE2 3.81Å; Y424-W683 HydrophobicContact CE2-CE3 4.13Å; Y424-W683 AromaticContact CE2-CH2 3.49Å; Y424-W683 HydrophobicContact CE2-CH2 3.49Å; Y424-W683 VanDerWaalsContact CE2-CH2 3.49Å; Y424-W683 AromaticContact CE2-CZ2 3.51Å; Y424-W683 HydrophobicContact CE2-CZ2 3.51Å; Y424-W683 AromaticContact CE2-CZ3 3.8Å; Y424-W683 HydrophobicContact CE2-CZ3 3.8Å; Y424-L688 HydrophobicContact CD1-CD1 3.69Å; Y424-L688 HydrophobicContact CD1-CD2 4.31Å; Y424-L688 HydrophobicContact CD1-CG 4.45Å; Y424-L688 HydrophobicContact CD2-CD1 4.43Å; Y424-L688 HydrophobicContact CE1-CB 3.85Å; Y424-L688 HydrophobicContact CE1-CD1 3.42Å; Y424-L688 VanDerWaalsContact CE1-CD1 3.42Å; Y424-L688 HydrophobicContact CE1-CD2 3.98Å; Y424-L688 HydrophobicContact CE1-CG 3.9Å; Y424-L688 HydrophobicContact CE2-CD1 4.18Å; Y424-L688 HydrophobicContact CG-CD1 4.22Å
425	R	91.8	Very high	90.9	Very high	80 Å²	80	43.4 Å²	43.4	30%	0.302	24%	0.24	S	C	.	.	H	α-helix	trans	-58.7	-40.5	-178.4	-76.8	-176.7	-74.2	179.2	-5.8	112.3	G421 Q422 Q428 A429	G421-R425 WeakPolarHBondContact O-CG 3.32Å; G421-R425 PolarHBondContact O-N 3.08Å; G421-R425 VanDerWaalsContact O-N 3.11Å; G421-R425 PolarHBondContact O-NE 3.14Å; Q422-R425 PolarHBondContact O-N 3.36Å; R425-Q428 PolarHBondContact O-N 3.1Å; R425-A429 PolarHBondContact O-N 3.08Å
426	I	91.3	Very high	90.4	Very high	19 Å²	19	50 Å²	50	10%	0.097	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-44.8	175.9	-68.5	170	0	0	0	111	T393 H396 L400 Q422 A423 Y424 A429 N430	T393-I426 HydrophobicContact CG2-CG2 3.46Å; T393-I426 VanDerWaalsContact CG2-CG2 3.46Å; H396-I426 HydrophobicContact CB-CD1 4.47Å; L400-I426 HydrophobicContact CD1-CD1 3.58Å; Q422-I426 HydrophobicContact CG-CD1 4.18Å; Q422-I426 WeakPolarHBondContact O-CG1 3.12Å; Q422-I426 PolarHBondContact O-N 3.15Å; A423-I426 PolarHBondContact O-N 3.4Å; Y424-I426 VanDerWaalsContact C-N 3.29Å; Y424-I426 PolarHBondContact O-N 2.57Å; I426-A429 PolarHBondContact O-N 3.24Å; I426-N430 PolarHBondContact O-N 3.27Å; I426-N430 PolarHBondContact O-ND2 2.94Å
427	C	90.2	Very high	90.1	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-64.5	-42.4	176.7	-70.5	0	0	0	0	111.8	L397 A423 Y424 A429 N430 M434	L397-C427 WeakPolarHBondContact CD2-SG 3.5Å; A423-C427 PolarHBondContact O-N 3Å; A423-C427 PolarHBondContact O-SG 3.47Å; A423-C427 VanDerWaalsContact O-SG 3.34Å; Y424-C427 WeakPolarHBondContact O-CB 3.3Å; Y424-C427 PolarHBondContact O-N 2.82Å; Y424-C427 VanDerWaalsContact O-N 3.1Å; C427-A429 VanDerWaalsContact C-N 3.31Å; C427-A429 PolarHBondContact O-N 2.88Å; C427-N430 CarbonylContact O-C 3.58Å; C427-N430 WeakPolarHBondContact O-CA 3.42Å; C427-N430 PolarHBondContact O-N 3.44Å; C427-M434 HydrophobicContact CB-CB 4.25Å; C427-M434 HydrophobicContact CB-CG 4.45Å; C427-M434 HydrophobicContact CB-SD 3.37Å; C427-M434 WeakPolarHBondContact CB-SD 3.34Å; C427-M434 WeakPolarHBondContact O-CB 3.14Å
428	Q	87.1	Confident	89.9	Confident	101 Å²	101	53.3 Å²	53.3	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-60.6	-39.7	177.9	-170.2	-177.2	32.5	0	0	112.2	Y424 R425 N430	Y424-Q428 HydrophobicContact CD1-CB 4.43Å; Y424-Q428 HydrophobicContact CE1-CB 4.08Å; Y424-Q428 HydrophobicContact CE1-CG 4.37Å; Y424-Q428 PolarHBondContact O-N 3.46Å; R425-Q428 PolarHBondContact O-N 3.1Å; Q428-N430 PolarHBondContact O-N 2.83Å
429	A	87.9	Confident	89.7	Confident	77 Å²	77	49.7 Å²	49.7	64%	0.636	26%	0.264	S	S	*	.	H	α-helix	trans	-66.1	-17.4	174.1	0	0	0	0	0	113.2	R425 I426 C427	R425-A429 PolarHBondContact O-N 3.08Å; I426-A429 PolarHBondContact O-N 3.24Å; C427-A429 VanDerWaalsContact C-N 3.31Å; C427-A429 PolarHBondContact O-N 2.88Å
430	N	88.4	Confident	89.6	Confident	59 Å²	59	51.6 Å²	51.6	32%	0.316	27%	0.272	S	S	.	.			trans	-128.9	81	-175.9	-65.1	-85.6	0	0	0	111.2	I426 C427 Q428 A432 L433 M434	I426-N430 PolarHBondContact O-N 3.27Å; I426-N430 PolarHBondContact O-ND2 2.94Å; C427-N430 CarbonylContact O-C 3.58Å; C427-N430 WeakPolarHBondContact O-CA 3.42Å; C427-N430 PolarHBondContact O-N 3.44Å; Q428-N430 PolarHBondContact O-N 2.83Å; N430-A432 VanDerWaalsContact C-N 3.27Å; N430-A432 PolarHBondContact O-N 3.25Å; N430-A432 VanDerWaalsContact O-N 3.1Å; N430-L433 HydrophobicContact CB-CB 3.91Å; N430-L433 WeakPolarHBondContact O-CA 3.41Å; N430-L433 WeakPolarHBondContact O-CB 3.31Å; N430-L433 PolarHBondContact O-N 2.61Å; N430-M434 PolarHBondContact O-N 2.89Å
431	P	84.5	Confident	89.6	Confident	102 Å²	102	51.7 Å²	51.7	66%	0.662	27%	0.273	S	S	*	.	H	α-helix	trans	-55.5	-35.9	-172.1	-28.4	35.2	0	0	0	115.1	L433 M434 Y435	P431-L433 VanDerWaalsContact C-N 3.32Å; P431-L433 PolarHBondContact O-N 3.09Å; P431-M434 WeakPolarHBondContact O-CB 3.47Å; P431-M434 PolarHBondContact O-N 2.71Å; P431-Y435 PolarHBondContact O-N 3Å
432	A	81.8	Confident	89.6	Confident	94 Å²	94	51.7 Å²	51.7	78%	0.777	27%	0.273	S	S	*	.	H	α-helix	trans	-65.3	-35.4	176.5	0	0	0	0	0	112.5	N430	N430-A432 VanDerWaalsContact C-N 3.27Å; N430-A432 PolarHBondContact O-N 3.25Å; N430-A432 VanDerWaalsContact O-N 3.1Å
433	L	83.5	Confident	89.8	Confident	24 Å²	24	49.1 Å²	49.1	13%	0.126	26%	0.261	C	S	.	.	H	α-helix	trans	-76.5	-38	176.2	-175	61.8	0	0	0	111.1	T393 V394 L397 N430 P431 Y435 K436 R437	T393-L433 HydrophobicContact CG2-CD2 3.79Å; V394-L433 HydrophobicContact CG2-CD1 4.08Å; L397-L433 HydrophobicContact CD2-CD1 4.44Å; L397-L433 HydrophobicContact CD2-CD2 3.87Å; L397-L433 HydrophobicContact CD2-CG 4.12Å; N430-L433 HydrophobicContact CB-CB 3.91Å; N430-L433 WeakPolarHBondContact O-CA 3.41Å; N430-L433 WeakPolarHBondContact O-CB 3.31Å; N430-L433 PolarHBondContact O-N 2.61Å; P431-L433 VanDerWaalsContact C-N 3.32Å; P431-L433 PolarHBondContact O-N 3.09Å; L433-Y435 PolarHBondContact O-N 3.39Å; L433-K436 PolarHBondContact O-N 3.28Å; L433-K436 VanDerWaalsContact O-N 3.16Å; L433-R437 HydrophobicContact CD1-CG 3.67Å; L433-R437 HydrophobicContact CG-CG 4.01Å; L433-R437 WeakPolarHBondContact O-CB 3.41Å; L433-R437 WeakPolarHBondContact O-CG 3.39Å; L433-R437 PolarHBondContact O-N 3.38Å
434	M	84.3	Confident	89.9	Confident	32 Å²	32	49.4 Å²	49.4	16%	0.158	26%	0.262	C	S	.	.	H	α-helix	trans	-51.3	-52.8	177.7	-174.4	59.7	165	0	0	111.3	Y424 C427 N430 P431 K436 R437 L438 W683	Y424-M434 HydrophobicContact CD2-CE 4.39Å; Y424-M434 HydrophobicContact CE2-CE 3.91Å; C427-M434 HydrophobicContact CB-CB 4.25Å; C427-M434 HydrophobicContact CB-CG 4.45Å; C427-M434 HydrophobicContact CB-SD 3.37Å; C427-M434 WeakPolarHBondContact CB-SD 3.34Å; C427-M434 WeakPolarHBondContact O-CB 3.14Å; N430-M434 PolarHBondContact O-N 2.89Å; P431-M434 WeakPolarHBondContact O-CB 3.47Å; P431-M434 PolarHBondContact O-N 2.71Å; M434-K436 VanDerWaalsContact C-N 3.28Å; M434-K436 PolarHBondContact O-N 3.18Å; M434-R437 PolarHBondContact O-N 3.01Å; M434-R437 VanDerWaalsContact O-N 3.14Å; M434-L438 HydrophobicContact CE-CD1 3.57Å; M434-L438 WeakPolarHBondContact O-CB 3.27Å; M434-L438 PolarHBondContact O-N 3.27Å; M434-L438 HydrophobicContact SD-CD1 4.03Å; M434-W683 HydrophobicContact CE-CH2 4.1Å; M434-W683 HydrophobicContact CE-CZ2 4.35Å
435	Y	82.2	Confident	90.2	Very high	126 Å²	126	49.1 Å²	49.1	49%	0.494	26%	0.261	S	S	.	.	H	α-helix	trans	-57	-40.4	-178.6	-177	-97.9	0	0	0	113	P431 L433 P472 Q473	P431-Y435 PolarHBondContact O-N 3Å; L433-Y435 PolarHBondContact O-N 3.39Å; Y435-P472 PolarHBondContact OH-O 3.4Å; Y435-Q473 WeakPolarHBondContact OH-CA 3.39Å
436	K	86.3	Confident	90.5	Very high	158 Å²	158	45.3 Å²	45.3	69%	0.687	25%	0.247	S	C	*	.	H	α-helix	trans	-75.6	-28.4	-179	-172.9	174.6	179.3	178.3	0	113.2	L433 M434 Q440	L433-K436 PolarHBondContact O-N 3.28Å; L433-K436 VanDerWaalsContact O-N 3.16Å; M434-K436 VanDerWaalsContact C-N 3.28Å; M434-K436 PolarHBondContact O-N 3.18Å; K436-Q440 PolarHBondContact O-OE1 2.86Å
437	R	91.4	Very high	90.8	Very high	46 Å²	46	45.5 Å²	45.5	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-104.1	-6.3	-171.4	-68.2	-73.9	-172.6	166.7	0.8	114	L397 S398 E401 L433 M434 Q440 L441	L397-R437 HydrophobicContact CD2-CB 3.95Å; L397-R437 HydrophobicContact CD2-CG 3.52Å; S398-R437 PolarHBondContact OG-NH2 3.14Å; E401-R437 VanDerWaalsContact CD-NH1 3.27Å; E401-R437 WeakPolarHBondContact OE1-CD 3.41Å; E401-R437 IonicContact OE1-CZ 2.59Å; E401-R437 IonicContact OE1-NE 3.9Å; E401-R437 IonicContact OE1-NH1 3.07Å; E401-R437 PolarHBondContact OE1-NH1 3.11Å; E401-R437 IonicContact OE2-CZ 2.63Å; E401-R437 IonicContact OE2-NH1 3.21Å; E401-R437 PolarHBondContact OE2-NH1 3.17Å; L433-R437 HydrophobicContact CD1-CG 3.67Å; L433-R437 HydrophobicContact CG-CG 4.01Å; L433-R437 WeakPolarHBondContact O-CB 3.41Å; L433-R437 WeakPolarHBondContact O-CG 3.39Å; L433-R437 PolarHBondContact O-N 3.38Å; M434-R437 PolarHBondContact O-N 3.01Å; M434-R437 VanDerWaalsContact O-N 3.14Å; R437-Q440 PolarHBondContact O-N 2.97Å; R437-Q440 PolarHBondContact O-OE1 3.47Å; R437-L441 PolarHBondContact O-N 3.5Å
438	L	91.8	Very high	91.2	Very high	26 Å²	26	45.6 Å²	45.6	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-55.9	-45.6	-179.1	-161.3	63.1	0	0	0	113.1	M434 Q440 L441 H442 L468 W683	M434-L438 HydrophobicContact CE-CD1 3.57Å; M434-L438 WeakPolarHBondContact O-CB 3.27Å; M434-L438 PolarHBondContact O-N 3.27Å; M434-L438 HydrophobicContact SD-CD1 4.03Å; L438-Q440 VanDerWaalsContact C-N 3.34Å; L438-Q440 PolarHBondContact O-N 3.16Å; L438-L441 PolarHBondContact O-N 3.3Å; L438-H442 PolarHBondContact O-CD2 2.83Å; L438-H442 VanDerWaalsContact O-CD2 3.25Å; L438-H442 PolarHBondContact O-N 3.44Å; L438-L468 HydrophobicContact CB-CD1 4.05Å; L438-L468 HydrophobicContact CD2-CD1 3.6Å; L438-L468 HydrophobicContact CD2-CD2 3.79Å; L438-L468 HydrophobicContact CD2-CG 4.33Å; L438-L468 HydrophobicContact CG-CD1 3.51Å; L438-W683 HydrophobicContact CD1-CH2 3.79Å
439	P	93.3	Very high	91.8	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-40.8	177.8	-24.4	35.5	0	0	0	113.7	L441 T443 L468 I469 L508	P439-L441 VanDerWaalsContact C-N 3.34Å; P439-T443 WeakPolarHBondContact O-CB 3.33Å; P439-T443 PolarHBondContact O-N 3.36Å; P439-T443 PolarHBondContact O-OG1 3.29Å; P439-L468 HydrophobicContact CG-CB 3.98Å; P439-I469 HydrophobicContact CB-CD1 3.99Å; P439-I469 HydrophobicContact CB-CG1 3.6Å; P439-I469 HydrophobicContact CG-CG1 3.84Å; P439-L508 HydrophobicContact CB-CD2 3.96Å
440	Q	94.8	Very high	92.2	Very high	54 Å²	54	38.6 Å²	38.6	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-64.7	-41.3	177.4	-68	75.6	8.3	0	0	110.6	K436 R437 L438 T443 L444 L508	K436-Q440 PolarHBondContact O-OE1 2.86Å; R437-Q440 PolarHBondContact O-N 2.97Å; R437-Q440 PolarHBondContact O-OE1 3.47Å; L438-Q440 VanDerWaalsContact C-N 3.34Å; L438-Q440 PolarHBondContact O-N 3.16Å; Q440-T443 WeakPolarHBondContact O-CB 3.48Å; Q440-T443 PolarHBondContact O-N 3.22Å; Q440-L444 WeakPolarHBondContact O-CG 3.47Å; Q440-L444 PolarHBondContact O-N 2.86Å; Q440-L508 HydrophobicContact CG-CD2 3.75Å
441	L	95.1	Very high	92.5	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-48.4	179.2	-171.9	59.9	0	0	0	112.1	I420 A423 Y424 R437 L438 P439 T443 L444 I445 W683	I420-L441 HydrophobicContact CG2-CD1 4.07Å; A423-L441 HydrophobicContact CB-CD1 4.24Å; Y424-L441 HydrophobicContact CD2-CD2 3.64Å; Y424-L441 HydrophobicContact CG-CD2 4.25Å; R437-L441 PolarHBondContact O-N 3.5Å; L438-L441 PolarHBondContact O-N 3.3Å; P439-L441 VanDerWaalsContact C-N 3.34Å; L441-T443 PolarHBondContact O-N 3.13Å; L441-L444 WeakPolarHBondContact O-CB 3.41Å; L441-L444 PolarHBondContact O-N 3.48Å; L441-L444 VanDerWaalsContact O-N 3.12Å; L441-I445 HydrophobicContact CG-CD1 4.35Å; L441-I445 WeakPolarHBondContact O-CG1 3.44Å; L441-I445 PolarHBondContact O-N 3.29Å; L441-W683 HydrophobicContact CD2-CZ3 4.43Å
442	H	95.9	Very high	93.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-32.5	174	-75.2	-73.4	0	0	0	112.5	L438 I445 G446 Q461 Y464 A465 W683 L684	L438-H442 PolarHBondContact O-CD2 2.83Å; L438-H442 VanDerWaalsContact O-CD2 3.25Å; L438-H442 PolarHBondContact O-N 3.44Å; H442-I445 PolarHBondContact O-N 3.1Å; H442-G446 PolarHBondContact O-N 2.89Å; H442-Q461 PolarHBondContact ND1-OE1 3.04Å; H442-Y464 AromaticContact CD2-CD1 3.65Å; H442-Y464 AromaticContact CD2-CE1 3.84Å; H442-Y464 AromaticContact CE1-CD1 3.56Å; H442-Y464 AromaticContact CE1-CE1 3.68Å; H442-Y464 AromaticContact CG-CD1 3.83Å; H442-Y464 AromaticContact ND1-CD1 3.76Å; H442-Y464 AromaticContact NE2-CD1 3.5Å; H442-Y464 WeakPolarHBondContact NE2-CD1 3.39Å; H442-Y464 AromaticContact NE2-CE1 3.33Å; H442-Y464 VanDerWaalsContact NE2-CE1 3.33Å; H442-Y464 WeakPolarHBondContact NE2-CE1 3.45Å; H442-A465 HydrophobicContact CB-CB 3.84Å; H442-W683 AromaticContact CE1-CE3 3.69Å; H442-W683 AromaticContact CE1-CH2 3.65Å; H442-W683 AromaticContact CE1-CZ3 3.23Å; H442-W683 WeakPolarHBondContact CE1-CZ3 3.44Å; H442-W683 AromaticContact NE2-CH2 3.5Å; H442-W683 WeakPolarHBondContact NE2-CH2 3.3Å; H442-W683 AromaticContact NE2-CZ3 3.48Å; H442-W683 WeakPolarHBondContact NE2-CZ3 3.5Å; H442-L684 PolarHBondContact CE1-O 3.09Å; H442-L684 PolarHBondContact NE2-O 3.13Å
443	T	97.6	Very high	93.7	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-62.2	-44.9	172.8	-55.7	0	0	0	0	111	P439 Q440 L441 G446 L447 F462 L508 I512	P439-T443 WeakPolarHBondContact O-CB 3.33Å; P439-T443 PolarHBondContact O-N 3.36Å; P439-T443 PolarHBondContact O-OG1 3.29Å; Q440-T443 WeakPolarHBondContact O-CB 3.48Å; Q440-T443 PolarHBondContact O-N 3.22Å; L441-T443 PolarHBondContact O-N 3.13Å; T443-G446 PolarHBondContact O-N 2.88Å; T443-L447 HydrophobicContact CG2-CD1 4.29Å; T443-L447 VanDerWaalsContact O-CG 3.27Å; T443-L447 WeakPolarHBondContact O-CG 3.41Å; T443-L447 PolarHBondContact O-N 3.44Å; T443-F462 HydrophobicContact CG2-CE1 4.33Å; T443-L508 HydrophobicContact CG2-CD1 4.06Å; T443-I512 HydrophobicContact CG2-CG1 3.84Å; T443-I512 WeakPolarHBondContact OG1-CD1 3.35Å; T443-I512 WeakPolarHBondContact OG1-CG1 3.46Å
444	L	98	Very high	94.3	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-42.3	177	-66.8	173.8	0	0	0	112.4	E401 M405 I420 Q440 L441 G446 L447 Y448	E401-L444 HydrophobicContact CB-CD1 4.19Å; E401-L444 HydrophobicContact CG-CD1 3.99Å; M405-L444 HydrophobicContact CG-CD2 3.5Å; M405-L444 HydrophobicContact SD-CD2 4.28Å; I420-L444 HydrophobicContact CD1-CB 4.04Å; I420-L444 HydrophobicContact CG1-CB 4.02Å; Q440-L444 WeakPolarHBondContact O-CG 3.47Å; Q440-L444 PolarHBondContact O-N 2.86Å; L441-L444 WeakPolarHBondContact O-CB 3.41Å; L441-L444 PolarHBondContact O-N 3.48Å; L441-L444 VanDerWaalsContact O-N 3.12Å; L444-G446 VanDerWaalsContact C-N 3.33Å; L444-L447 PolarHBondContact O-N 2.88Å; L444-Y448 WeakPolarHBondContact O-CB 3.3Å; L444-Y448 PolarHBondContact O-N 3.27Å
445	I	97.7	Very high	94.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-42.7	175.5	-61.8	166.9	0	0	0	110.2	I420 L441 H442 Y448 A449 Q461 L680 I681 W683	I420-I445 HydrophobicContact CG2-CD1 4.48Å; I420-I445 HydrophobicContact CG2-CG1 3.65Å; L441-I445 HydrophobicContact CG-CD1 4.35Å; L441-I445 WeakPolarHBondContact O-CG1 3.44Å; L441-I445 PolarHBondContact O-N 3.29Å; H442-I445 PolarHBondContact O-N 3.1Å; I445-Y448 PolarHBondContact O-N 3.43Å; I445-A449 WeakPolarHBondContact O-CB 3.25Å; I445-A449 PolarHBondContact O-N 3.47Å; I445-Q461 HydrophobicContact CB-CG 4.42Å; I445-Q461 HydrophobicContact CG2-CG 3.85Å; I445-L680 HydrophobicContact CD1-CB 4.48Å; I445-L680 WeakPolarHBondContact CG2-O 3.35Å; I445-I681 HydrophobicContact CG2-CG2 4.31Å; I445-W683 HydrophobicContact CD1-CE3 3.84Å; I445-W683 HydrophobicContact CD1-CZ3 3.96Å
446	G	97.9	Very high	95.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-42.6	175.4	0	0	0	0	0	112.9	H442 T443 L444 A449 M450	H442-G446 PolarHBondContact O-N 2.89Å; T443-G446 PolarHBondContact O-N 2.88Å; L444-G446 VanDerWaalsContact C-N 3.33Å; G446-A449 PolarHBondContact O-N 3.47Å; G446-M450 VanDerWaalsContact O-CB 3.3Å; G446-M450 WeakPolarHBondContact O-CB 3.48Å; G446-M450 PolarHBondContact O-N 3.22Å
447	L	98.1	Very high	96.2	Very high	23 Å²	23	26.9 Å²	26.9	12%	0.12	14%	0.14	C	C	.	.	H	α-helix	trans	-63.6	-41.8	174.6	-70.6	171.9	0	0	0	111.8	M405 L408 T443 L444 M450 S451 F462 N515	M405-L447 HydrophobicContact CG-CD1 4.49Å; L408-L447 HydrophobicContact CD1-CB 3.77Å; T443-L447 HydrophobicContact CG2-CD1 4.29Å; T443-L447 VanDerWaalsContact O-CG 3.27Å; T443-L447 WeakPolarHBondContact O-CG 3.41Å; T443-L447 PolarHBondContact O-N 3.44Å; L444-L447 PolarHBondContact O-N 2.88Å; L447-M450 HydrophobicContact CD2-CE 3.95Å; L447-M450 PolarHBondContact O-N 3.13Å; L447-S451 PolarHBondContact O-N 3.49Å; L447-F462 HydrophobicContact CD2-CE1 4.43Å; L447-F462 HydrophobicContact CD2-CZ 4.07Å; L447-F462 HydrophobicContact CG-CE1 4.25Å; L447-F462 HydrophobicContact CG-CZ 4.24Å; L447-N515 HydrophobicContact CD2-CB 4.3Å; L447-N515 WeakPolarHBondContact CD2-OD1 3.46Å
448	Y	98.4	Very high	96.5	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-50.9	173.7	169.4	-100.4	0	0	0	111.5	L408 Q413 A417 L444 I445 M450 S451 M452 H678 I681	L408-Y448 HydrophobicContact CD2-CD2 3.88Å; L408-Y448 HydrophobicContact CD2-CG 4.46Å; Q413-Y448 HydrophobicContact CB-CE2 4.03Å; Q413-Y448 WeakPolarHBondContact O-CE2 3.45Å; A417-Y448 HydrophobicContact CB-CD2 4.28Å; A417-Y448 HydrophobicContact CB-CE2 3.75Å; L444-Y448 WeakPolarHBondContact O-CB 3.3Å; L444-Y448 PolarHBondContact O-N 3.27Å; I445-Y448 PolarHBondContact O-N 3.43Å; Y448-M450 VanDerWaalsContact C-N 3.27Å; Y448-M450 PolarHBondContact O-N 2.98Å; Y448-S451 WeakPolarHBondContact O-CA 3.45Å; Y448-S451 WeakPolarHBondContact O-CB 3.4Å; Y448-S451 PolarHBondContact O-N 2.94Å; Y448-S451 PolarHBondContact O-OG 3.28Å; Y448-M452 HydrophobicContact CD1-CG 4.45Å; Y448-M452 HydrophobicContact CD2-CG 4.23Å; Y448-M452 HydrophobicContact CE1-CG 4Å; Y448-M452 HydrophobicContact CE2-CG 3.77Å; Y448-M452 HydrophobicContact CE2-SD 4.18Å; Y448-M452 WeakPolarHBondContact O-CG 3.4Å; Y448-M452 PolarHBondContact O-N 3.15Å; Y448-H678 AromaticContact CE1-ND1 3.65Å; Y448-H678 AromaticContact CZ-ND1 3.65Å; Y448-H678 PolarHBondContact OH-ND1 3.16Å; Y448-I681 HydrophobicContact CD1-CG2 3.51Å; Y448-I681 HydrophobicContact CE1-CG2 3.58Å
449	A	98	Very high	96.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.7	-41.1	177.3	0	0	0	0	0	111.8	I445 G446 S451 M452 N453 C454 Q457 A458 I681	I445-A449 WeakPolarHBondContact O-CB 3.25Å; I445-A449 PolarHBondContact O-N 3.47Å; G446-A449 PolarHBondContact O-N 3.47Å; A449-S451 PolarHBondContact O-N 3.46Å; A449-M452 CarbonylContact O-C 3.46Å; A449-M452 PolarHBondContact O-N 3.45Å; A449-N453 PolarHBondContact O-N 3.41Å; A449-C454 HydrophobicContact CB-CB 4.26Å; A449-C454 WeakPolarHBondContact O-CB 3.35Å; A449-C454 PolarHBondContact O-N 3.19Å; A449-Q457 HydrophobicContact CB-CB 4.15Å; A449-A458 HydrophobicContact CB-CB 3.95Å; A449-I681 HydrophobicContact CB-CB 4.3Å; A449-I681 HydrophobicContact CB-CG2 3.9Å
450	M	97.1	Very high	96.8	Very high	31 Å²	31	27.5 Å²	27.5	15%	0.153	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-42.3	174.7	-174.2	179.9	68.2	0	0	111.5	G446 L447 Y448 M452 N453 M455 A458 N515 V519	G446-M450 VanDerWaalsContact O-CB 3.3Å; G446-M450 WeakPolarHBondContact O-CB 3.48Å; G446-M450 PolarHBondContact O-N 3.22Å; L447-M450 HydrophobicContact CD2-CE 3.95Å; L447-M450 PolarHBondContact O-N 3.13Å; Y448-M450 VanDerWaalsContact C-N 3.27Å; Y448-M450 PolarHBondContact O-N 2.98Å; M450-M452 VanDerWaalsContact C-N 3.3Å; M450-M452 PolarHBondContact O-N 2.99Å; M450-N453 PolarHBondContact O-N 3.25Å; M450-N453 VanDerWaalsContact O-N 3.15Å; M450-M455 HydrophobicContact CG-CE 4.07Å; M450-M455 VanDerWaalsContact O-CE 3.31Å; M450-M455 WeakPolarHBondContact O-CE 3.44Å; M450-A458 HydrophobicContact CB-CB 3.97Å; M450-N515 WeakPolarHBondContact CE-OD1 3.29Å; M450-V519 HydrophobicContact CG-CG2 4.08Å; M450-V519 HydrophobicContact SD-CG2 3.94Å
451	S	95.5	Very high	96.9	Very high	36 Å²	36	25 Å²	25	25%	0.252	13%	0.134	S	C	.	.	H	α-helix	trans	-65.1	-33.7	176.7	79.5	0	0	0	0	112.8	L447 Y448 A449 N453 H669	L447-S451 PolarHBondContact O-N 3.49Å; Y448-S451 WeakPolarHBondContact O-CA 3.45Å; Y448-S451 WeakPolarHBondContact O-CB 3.4Å; Y448-S451 PolarHBondContact O-N 2.94Å; Y448-S451 PolarHBondContact O-OG 3.28Å; A449-S451 PolarHBondContact O-N 3.46Å; S451-N453 PolarHBondContact O-N 2.96Å; S451-H669 PolarHBondContact O-CE1 2.93Å; S451-H669 PolarHBondContact O-NE2 3.5Å
452	M	96	Very high	97	Very high	13 Å²	13	24.7 Å²	24.7	6%	0.064	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	3.7	175.9	-66.4	-59.8	-63.9	0	0	113.4	Q413 Y448 A449 M450 C454 H669 A672 I673	Q413-M452 HydrophobicContact CB-SD 3.87Å; Q413-M452 HydrophobicContact CG-SD 3.77Å; Y448-M452 HydrophobicContact CD1-CG 4.45Å; Y448-M452 HydrophobicContact CD2-CG 4.23Å; Y448-M452 HydrophobicContact CE1-CG 4Å; Y448-M452 HydrophobicContact CE2-CG 3.77Å; Y448-M452 HydrophobicContact CE2-SD 4.18Å; Y448-M452 WeakPolarHBondContact O-CG 3.4Å; Y448-M452 PolarHBondContact O-N 3.15Å; A449-M452 CarbonylContact O-C 3.46Å; A449-M452 PolarHBondContact O-N 3.45Å; M450-M452 VanDerWaalsContact C-N 3.3Å; M450-M452 PolarHBondContact O-N 2.99Å; M452-C454 PolarHBondContact O-N 3.15Å; M452-H669 HydrophobicContact CE-CB 4.12Å; M452-A672 HydrophobicContact CE-CB 3.9Å; M452-A672 HydrophobicContact SD-CB 3.94Å; M452-I673 HydrophobicContact CE-CD1 4.13Å; M452-I673 HydrophobicContact CE-CG1 3.6Å
453	N	95.1	Very high	96.9	Very high	99 Å²	99	26.6 Å²	26.6	53%	0.529	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	19.6	-175.1	-159.6	46.1	0	0	0	114.6	A449 M450 S451 M455 R522	A449-N453 PolarHBondContact O-N 3.41Å; M450-N453 PolarHBondContact O-N 3.25Å; M450-N453 VanDerWaalsContact O-N 3.15Å; S451-N453 PolarHBondContact O-N 2.96Å; N453-M455 VanDerWaalsContact C-N 3.33Å; N453-M455 PolarHBondContact O-N 2.98Å; N453-M455 VanDerWaalsContact O-N 3.14Å; N453-R522 PolarHBondContact OD1-NH2 3.12Å
454	C	96.8	Very high	96.7	Very high	29 Å²	29	27.2 Å²	27.2	20%	0.196	14%	0.143	C	C	.	.			trans	-86.3	69	174.7	-59.7	0	0	0	0	110.3	A449 M452 N456 Q457 A458 I681	A449-C454 HydrophobicContact CB-CB 4.26Å; A449-C454 WeakPolarHBondContact O-CB 3.35Å; A449-C454 PolarHBondContact O-N 3.19Å; M452-C454 PolarHBondContact O-N 3.15Å; C454-N456 PolarHBondContact O-N 3.39Å; C454-Q457 HydrophobicContact CB-CB 4.21Å; C454-Q457 PolarHBondContact O-N 2.86Å; C454-A458 PolarHBondContact O-N 2.99Å; C454-I681 HydrophobicContact CB-CD1 4.38Å
455	M	97.2	Very high	96.5	Very high	20 Å²	20	27 Å²	27	10%	0.099	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-36.1	-169.1	-65.7	-65.9	132.1	0	0	114.2	M450 N453 A458 E459 V519 R522 K523	M450-M455 HydrophobicContact CG-CE 4.07Å; M450-M455 VanDerWaalsContact O-CE 3.31Å; M450-M455 WeakPolarHBondContact O-CE 3.44Å; N453-M455 VanDerWaalsContact C-N 3.33Å; N453-M455 PolarHBondContact O-N 2.98Å; N453-M455 VanDerWaalsContact O-N 3.14Å; M455-A458 PolarHBondContact O-N 3.08Å; M455-E459 WeakPolarHBondContact O-CB 3.38Å; M455-E459 PolarHBondContact O-N 3.34Å; M455-V519 HydrophobicContact CB-CG1 4.22Å; M455-V519 WeakPolarHBondContact O-CG1 3.45Å; M455-V519 HydrophobicContact SD-CB 4.42Å; M455-V519 HydrophobicContact SD-CG1 4.11Å; M455-V519 HydrophobicContact SD-CG2 4.18Å; M455-R522 VanDerWaalsContact CE-CZ 3.43Å; M455-R522 HydrophobicContact SD-CB 3.95Å; M455-K523 HydrophobicContact CB-CD 4.15Å; M455-K523 HydrophobicContact CB-CG 3.97Å
456	N	97.1	Very high	96.3	Very high	92 Å²	92	26.9 Å²	26.9	49%	0.492	14%	0.141	S	C	.	.	H	α-helix	trans	-67.1	-42.6	178.7	-69	-32.1	0	0	0	111.5	C454 E459 N460 K523	C454-N456 PolarHBondContact O-N 3.39Å; N456-E459 PolarHBondContact O-N 3.47Å; N456-N460 PolarHBondContact O-N 2.88Å; N456-N460 PolarHBondContact O-ND2 3.39Å; N456-K523 PolarHBondContact OD1-NZ 3.37Å
457	Q	97.3	Very high	95.9	Very high	59 Å²	59	32.3 Å²	32.3	28%	0.276	16%	0.162	S	C	.	.	H	α-helix	trans	-66.2	-45	176.1	-68.6	77.2	1.2	0	0	110.2	A449 C454 E459 N460 Q461 I681	A449-Q457 HydrophobicContact CB-CB 4.15Å; C454-Q457 HydrophobicContact CB-CB 4.21Å; C454-Q457 PolarHBondContact O-N 2.86Å; Q457-E459 VanDerWaalsContact C-N 3.34Å; Q457-E459 PolarHBondContact O-N 3.26Å; Q457-N460 PolarHBondContact O-N 3.27Å; Q457-Q461 WeakPolarHBondContact O-CB 3.39Å; Q457-Q461 WeakPolarHBondContact O-CG 3.4Å; Q457-Q461 PolarHBondContact O-N 3.48Å; Q457-I681 HydrophobicContact CB-CB 4.16Å; Q457-I681 HydrophobicContact CB-CG1 4.46Å; Q457-I681 HydrophobicContact CG-CB 4.33Å; Q457-I681 HydrophobicContact CG-CD1 4.21Å; Q457-I681 HydrophobicContact CG-CG1 4.11Å
458	A	97.8	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.1	-47.5	176.1	0	0	0	0	0	112.1	A449 M450 C454 M455 N460 Q461 F462 V519	A449-A458 HydrophobicContact CB-CB 3.95Å; M450-A458 HydrophobicContact CB-CB 3.97Å; C454-A458 PolarHBondContact O-N 2.99Å; M455-A458 PolarHBondContact O-N 3.08Å; A458-N460 PolarHBondContact O-N 3.03Å; A458-Q461 PolarHBondContact O-N 3.26Å; A458-F462 HydrophobicContact CB-CE2 4.28Å; A458-F462 WeakPolarHBondContact O-CD2 3.41Å; A458-F462 WeakPolarHBondContact O-CG 3.39Å; A458-F462 PolarHBondContact O-N 3.1Å; A458-V519 HydrophobicContact CB-CG2 4.03Å
459	E	96.4	Very high	95.1	Very high	17 Å²	17	34.4 Å²	34.4	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-47.4	175.7	179.3	178	169	0	0	112.3	M455 N456 Q457 Q461 F462 K463 L516 V519 H520 K523	M455-E459 WeakPolarHBondContact O-CB 3.38Å; M455-E459 PolarHBondContact O-N 3.34Å; N456-E459 PolarHBondContact O-N 3.47Å; Q457-E459 VanDerWaalsContact C-N 3.34Å; Q457-E459 PolarHBondContact O-N 3.26Å; E459-Q461 VanDerWaalsContact C-N 3.34Å; E459-Q461 PolarHBondContact O-N 3.25Å; E459-F462 PolarHBondContact O-N 3.27Å; E459-K463 HydrophobicContact CG-CD 3.96Å; E459-K463 HydrophobicContact CG-CG 4.46Å; E459-K463 WeakPolarHBondContact O-CB 3.41Å; E459-K463 WeakPolarHBondContact O-CG 3.45Å; E459-K463 PolarHBondContact O-N 2.99Å; E459-K463 WeakPolarHBondContact OE1-CE 3.46Å; E459-K463 IonicContact OE1-NZ 2.66Å; E459-K463 PolarHBondContact OE1-NZ 3.1Å; E459-L516 HydrophobicContact CB-CD1 4.31Å; E459-L516 HydrophobicContact CG-CD1 3.9Å; E459-V519 HydrophobicContact CB-CG1 4.04Å; E459-H520 IonicContact OE1-CE1 3.71Å; E459-K523 WeakPolarHBondContact OE2-CD 3.37Å; E459-K523 WeakPolarHBondContact OE2-CE 3.4Å; E459-K523 IonicContact OE2-NZ 3.21Å; E459-K523 PolarHBondContact OE2-NZ 2.83Å
460	N	95.8	Very high	94.5	Very high	82 Å²	82	35.4 Å²	35.4	44%	0.439	18%	0.181	S	C	.	.	H	α-helix	trans	-60.7	-43.7	179.2	-71.8	-20.7	0	0	0	112	N456 Q457 A458 Y464 L684	N456-N460 PolarHBondContact O-N 2.88Å; N456-N460 PolarHBondContact O-ND2 3.39Å; Q457-N460 PolarHBondContact O-N 3.27Å; A458-N460 PolarHBondContact O-N 3.03Å; N460-Y464 VanDerWaalsContact O-CB 3.29Å; N460-Y464 WeakPolarHBondContact O-CB 3.28Å; N460-Y464 PolarHBondContact O-N 3.1Å; N460-L684 HydrophobicContact CB-CD1 4.36Å; N460-L684 HydrophobicContact CB-CD2 4.34Å
461	Q	97.1	Very high	93.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-45.5	179	-67.1	-69.1	-14.4	0	0	111.6	H442 I445 Q457 A458 E459 Y464 A465 I681 W683 L684	H442-Q461 PolarHBondContact ND1-OE1 3.04Å; I445-Q461 HydrophobicContact CB-CG 4.42Å; I445-Q461 HydrophobicContact CG2-CG 3.85Å; Q457-Q461 WeakPolarHBondContact O-CB 3.39Å; Q457-Q461 WeakPolarHBondContact O-CG 3.4Å; Q457-Q461 PolarHBondContact O-N 3.48Å; A458-Q461 PolarHBondContact O-N 3.26Å; E459-Q461 VanDerWaalsContact C-N 3.34Å; E459-Q461 PolarHBondContact O-N 3.25Å; Q461-Y464 PolarHBondContact O-N 3.18Å; Q461-A465 WeakPolarHBondContact O-CB 3.37Å; Q461-A465 PolarHBondContact O-N 3.21Å; Q461-I681 PolarHBondContact NE2-O 3.02Å; Q461-W683 PolarHBondContact NE2-O 2.81Å; Q461-L684 HydrophobicContact CG-CD2 4.41Å
462	F	96.9	Very high	91.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-44.7	177	-68.4	-38.7	0	0	0	112.7	T443 L447 A458 E459 Y464 A465 L466 I512 N515 L516 V519	T443-F462 HydrophobicContact CG2-CE1 4.33Å; L447-F462 HydrophobicContact CD2-CE1 4.43Å; L447-F462 HydrophobicContact CD2-CZ 4.07Å; L447-F462 HydrophobicContact CG-CE1 4.25Å; L447-F462 HydrophobicContact CG-CZ 4.24Å; A458-F462 HydrophobicContact CB-CE2 4.28Å; A458-F462 WeakPolarHBondContact O-CD2 3.41Å; A458-F462 WeakPolarHBondContact O-CG 3.39Å; A458-F462 PolarHBondContact O-N 3.1Å; E459-F462 PolarHBondContact O-N 3.27Å; F462-Y464 VanDerWaalsContact C-N 3.3Å; F462-Y464 PolarHBondContact O-N 3.1Å; F462-A465 PolarHBondContact O-N 3.39Å; F462-L466 WeakPolarHBondContact O-CG 3.49Å; F462-L466 PolarHBondContact O-N 3.13Å; F462-I512 HydrophobicContact CB-CG2 3.62Å; F462-I512 HydrophobicContact CD1-CG2 3.83Å; F462-I512 HydrophobicContact CG-CG2 3.98Å; F462-N515 HydrophobicContact CE1-CB 4.27Å; F462-N515 HydrophobicContact CE2-CB 3.87Å; F462-N515 HydrophobicContact CZ-CB 3.7Å; F462-L516 HydrophobicContact CB-CB 4.23Å; F462-L516 HydrophobicContact CB-CD1 4.26Å; F462-L516 HydrophobicContact CD2-CB 4.24Å; F462-L516 HydrophobicContact CD2-CD1 4.46Å; F462-V519 HydrophobicContact CD2-CG2 4.31Å; F462-V519 HydrophobicContact CE2-CG2 3.97Å
463	K	93.9	Very high	89.2	Confident	41 Å²	41	40.3 Å²	40.3	18%	0.178	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-39.5	175.5	-75.4	-179.6	172.8	176.4	0	111.4	E459 L466 R467 L516	E459-K463 HydrophobicContact CG-CD 3.96Å; E459-K463 HydrophobicContact CG-CG 4.46Å; E459-K463 WeakPolarHBondContact O-CB 3.41Å; E459-K463 WeakPolarHBondContact O-CG 3.45Å; E459-K463 PolarHBondContact O-N 2.99Å; E459-K463 WeakPolarHBondContact OE1-CE 3.46Å; E459-K463 IonicContact OE1-NZ 2.66Å; E459-K463 PolarHBondContact OE1-NZ 3.1Å; K463-L466 PolarHBondContact O-N 3.43Å; K463-R467 WeakPolarHBondContact O-CG 3.45Å; K463-R467 PolarHBondContact O-N 2.94Å; K463-R467 VanDerWaalsContact O-N 3.09Å; K463-L516 HydrophobicContact CG-CD2 4.19Å
464	Y	92.9	Very high	86.3	Confident	18 Å²	18	43 Å²	43	7%	0.071	22%	0.217	C	C	.	.	H	α-helix	trans	-67.4	-44.4	176.2	-168.8	-100.8	0	0	0	111.9	H442 N460 Q461 F462 L466 R467 L468 L489 L684	H442-Y464 AromaticContact CD2-CD1 3.65Å; H442-Y464 AromaticContact CD2-CE1 3.84Å; H442-Y464 AromaticContact CE1-CD1 3.56Å; H442-Y464 AromaticContact CE1-CE1 3.68Å; H442-Y464 AromaticContact CG-CD1 3.83Å; H442-Y464 AromaticContact ND1-CD1 3.76Å; H442-Y464 AromaticContact NE2-CD1 3.5Å; H442-Y464 WeakPolarHBondContact NE2-CD1 3.39Å; H442-Y464 AromaticContact NE2-CE1 3.33Å; H442-Y464 VanDerWaalsContact NE2-CE1 3.33Å; H442-Y464 WeakPolarHBondContact NE2-CE1 3.45Å; N460-Y464 VanDerWaalsContact O-CB 3.29Å; N460-Y464 WeakPolarHBondContact O-CB 3.28Å; N460-Y464 PolarHBondContact O-N 3.1Å; Q461-Y464 PolarHBondContact O-N 3.18Å; F462-Y464 VanDerWaalsContact C-N 3.3Å; F462-Y464 PolarHBondContact O-N 3.1Å; Y464-L466 VanDerWaalsContact C-N 3.3Å; Y464-L466 PolarHBondContact O-N 3.49Å; Y464-R467 WeakPolarHBondContact O-CB 3.45Å; Y464-R467 PolarHBondContact O-N 3.33Å; Y464-R467 VanDerWaalsContact O-N 3.13Å; Y464-L468 HydrophobicContact CD1-CD1 3.73Å; Y464-L468 HydrophobicContact CD1-CG 4.06Å; Y464-L468 HydrophobicContact CE1-CD1 3.54Å; Y464-L468 HydrophobicContact CE1-CD2 3.98Å; Y464-L468 HydrophobicContact CE1-CG 3.82Å; Y464-L468 WeakPolarHBondContact O-CG 3.28Å; Y464-L468 PolarHBondContact O-N 3.48Å; Y464-L489 HydrophobicContact CE2-CD2 4.43Å; Y464-L684 HydrophobicContact CD2-CB 4.43Å; Y464-L684 WeakPolarHBondContact CE1-O 3.29Å; Y464-L684 HydrophobicContact CG-CB 4.49Å; Y464-L684 HydrophobicContact CG-CD2 4.24Å; Y464-L684 VanDerWaalsContact CZ-O 3.22Å; Y464-L684 PolarHBondContact OH-O 2.93Å
465	A	93.7	Very high	83.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55.5	-44.2	174.1	0	0	0	0	0	112.2	H442 Q461 F462 L468 I469 I512	H442-A465 HydrophobicContact CB-CB 3.84Å; Q461-A465 WeakPolarHBondContact O-CB 3.37Å; Q461-A465 PolarHBondContact O-N 3.21Å; F462-A465 PolarHBondContact O-N 3.39Å; A465-L468 WeakPolarHBondContact O-CB 3.5Å; A465-L468 PolarHBondContact O-N 3.31Å; A465-I469 WeakPolarHBondContact O-CG1 3.36Å; A465-I469 PolarHBondContact O-N 3.34Å; A465-I469 VanDerWaalsContact O-N 3.1Å; A465-I512 HydrophobicContact CB-CD1 3.82Å
466	L	93	Very high	80.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-40.8	176.8	-73.5	164.7	0	0	0	112.6	F462 K463 Y464 L468 I469 A470 S498 C499 I512 L516	F462-L466 WeakPolarHBondContact O-CG 3.49Å; F462-L466 PolarHBondContact O-N 3.13Å; K463-L466 PolarHBondContact O-N 3.43Å; Y464-L466 VanDerWaalsContact C-N 3.3Å; Y464-L466 PolarHBondContact O-N 3.49Å; L466-L468 VanDerWaalsContact C-N 3.34Å; L466-L468 PolarHBondContact O-N 3.28Å; L466-I469 PolarHBondContact O-N 2.88Å; L466-A470 WeakPolarHBondContact O-CB 3.08Å; L466-A470 PolarHBondContact O-N 3.45Å; L466-S498 WeakPolarHBondContact CB-O 3.26Å; L466-S498 WeakPolarHBondContact CD1-O 3.47Å; L466-C499 HydrophobicContact CB-CB 4.35Å; L466-I512 HydrophobicContact CD1-CG2 3.82Å; L466-I512 HydrophobicContact CD2-CB 4.18Å; L466-I512 HydrophobicContact CD2-CD1 4.36Å; L466-I512 HydrophobicContact CD2-CG2 4.12Å; L466-I512 HydrophobicContact CG-CB 4.29Å; L466-I512 HydrophobicContact CG-CG2 3.68Å; L466-L516 HydrophobicContact CD1-CD2 4.09Å
467	R	90.4	Very high	76.9	Confident	115 Å²	115	48.2 Å²	48.2	43%	0.434	26%	0.262	S	S	.	.	H	α-helix	trans	-63.4	-38.9	175.1	-71.2	172.7	-166.4	153.1	2.9	112.2	K463 Y464 I469 A470 G471 C499	K463-R467 WeakPolarHBondContact O-CG 3.45Å; K463-R467 PolarHBondContact O-N 2.94Å; K463-R467 VanDerWaalsContact O-N 3.09Å; Y464-R467 WeakPolarHBondContact O-CB 3.45Å; Y464-R467 PolarHBondContact O-N 3.33Å; Y464-R467 VanDerWaalsContact O-N 3.13Å; R467-I469 VanDerWaalsContact C-N 3.31Å; R467-I469 PolarHBondContact O-N 3.26Å; R467-A470 PolarHBondContact O-N 2.85Å; R467-G471 PolarHBondContact O-N 2.93Å; R467-C499 HydrophobicContact CG-CB 4.18Å
468	L	89.3	Confident	73.5	Confident	38 Å²	38	52.1 Å²	52.1	20%	0.199	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-37	175.3	-68.7	173	0	0	0	112.2	L438 P439 Y464 A465 L466	L438-L468 HydrophobicContact CB-CD1 4.05Å; L438-L468 HydrophobicContact CD2-CD1 3.6Å; L438-L468 HydrophobicContact CD2-CD2 3.79Å; L438-L468 HydrophobicContact CD2-CG 4.33Å; L438-L468 HydrophobicContact CG-CD1 3.51Å; P439-L468 HydrophobicContact CG-CB 3.98Å; Y464-L468 HydrophobicContact CD1-CD1 3.73Å; Y464-L468 HydrophobicContact CD1-CG 4.06Å; Y464-L468 HydrophobicContact CE1-CD1 3.54Å; Y464-L468 HydrophobicContact CE1-CD2 3.98Å; Y464-L468 HydrophobicContact CE1-CG 3.82Å; Y464-L468 WeakPolarHBondContact O-CG 3.28Å; Y464-L468 PolarHBondContact O-N 3.48Å; A465-L468 WeakPolarHBondContact O-CB 3.5Å; A465-L468 PolarHBondContact O-N 3.31Å; L466-L468 VanDerWaalsContact C-N 3.34Å; L466-L468 PolarHBondContact O-N 3.28Å
469	I	89.9	Confident	70.1	Confident	32 Å²	32	63.1 Å²	63.1	16%	0.164	34%	0.336	C	S	.	.	H	α-helix	trans	-70.4	-39	174.5	-61	165.4	0	0	0	110.8	P439 A465 L466 R467 G471 Q500 L508 I512	P439-I469 HydrophobicContact CB-CD1 3.99Å; P439-I469 HydrophobicContact CB-CG1 3.6Å; P439-I469 HydrophobicContact CG-CG1 3.84Å; A465-I469 WeakPolarHBondContact O-CG1 3.36Å; A465-I469 PolarHBondContact O-N 3.34Å; A465-I469 VanDerWaalsContact O-N 3.1Å; L466-I469 PolarHBondContact O-N 2.88Å; R467-I469 VanDerWaalsContact C-N 3.31Å; R467-I469 PolarHBondContact O-N 3.26Å; I469-G471 VanDerWaalsContact C-N 3.34Å; I469-Q500 VanDerWaalsContact CG2-NE2 3.31Å; I469-L508 HydrophobicContact CD1-CD2 4.04Å; I469-L508 HydrophobicContact CD1-CG 4.21Å; I469-I512 HydrophobicContact CD1-CD1 3.7Å
470	A	84.5	Confident	66.8	Low	22 Å²	22	68 Å²	68	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-70.6	-28.3	179.1	0	0	0	0	0	113.5	L466 R467 L491 Q500	L466-A470 WeakPolarHBondContact O-CB 3.08Å; L466-A470 PolarHBondContact O-N 3.45Å; R467-A470 PolarHBondContact O-N 2.85Å; A470-L491 HydrophobicContact CB-CD2 4.4Å; A470-Q500 HydrophobicContact CB-CG 3.93Å
471	G	73.3	Confident	63.7	Low	11 Å²	11	70.7 Å²	70.7	11%	0.113	39%	0.387	C	S	.	.	S	Bend	trans	-54.1	145.7	-179.6	0	0	0	0	0	111.9	R467 I469 Q473	R467-G471 PolarHBondContact O-N 2.93Å; I469-G471 VanDerWaalsContact C-N 3.34Å; G471-Q473 PolarHBondContact O-N 2.83Å
472	P	56.5	Low	60.3	Low	64 Å²	64	76.9 Å²	76.9	42%	0.416	42%	0.42	S	S	.	.			trans	-58.1	115.6	172.9	23.4	-30.3	0	0	0	108.1	Y435 Q474	Y435-P472 PolarHBondContact OH-O 3.4Å; P472-Q474 HydrophobicContact CB-CB 4.06Å; P472-Q474 HydrophobicContact CB-CG 3.9Å; P472-Q474 PolarHBondContact O-N 3Å
473	Q	48.1	Very low	57.4	Low	108 Å²	108	82.5 Å²	82.5	51%	0.505	46%	0.459	S	S	.	.			trans	-68.3	35.6	170.7	-70.1	179.4	-17	0	0	111.9	R219 Y435 G471	R219-Q473 VanDerWaalsContact NH2-CB 3.34Å; Y435-Q473 WeakPolarHBondContact OH-CA 3.39Å; G471-Q473 PolarHBondContact O-N 2.83Å
474	Q	34.9	Very low	54.3	Low	154 Å²	154	86.8 Å²	86.8	72%	0.72	48%	0.484	S	S	*	.			trans	-85.7	127.9	-165.2	-86.5	-169.1	-2.9	0	0	112.2	P472	P472-Q474 HydrophobicContact CB-CB 4.06Å; P472-Q474 HydrophobicContact CB-CG 3.9Å; P472-Q474 PolarHBondContact O-N 3Å
475	V	32.7	Very low	51.4	Low	118 Å²	118	92.9 Å²	92.9	72%	0.715	52%	0.518	S	S	*	.			trans	71.3	89.6	157.8	-165	0	0	0	0	116.2	G477	V475-G477 VanDerWaalsContact C-N 3.33Å; V475-G477 PolarHBondContact O-N 2.74Å
476	T	31.3	Very low	48.5	Very low	87 Å²	87	101.3 Å²	101.3	53%	0.534	55%	0.554	S	S	.	*			trans	-48.3	98.1	143.5	48	0	0	0	0	109.9	R183	R183-T476 PolarHBondContact NH1-OG1 3.03Å; R183-T476 PolarHBondContact NH2-OG1 3.09Å
477	G	29.9	Very low	45.7	Very low	47 Å²	47	107.5 Å²	107.5	49%	0.485	59%	0.588	S	S	.	*			trans	-168.7	93.6	174.7	0	0	0	0	0	107.8	V475 R479	V475-G477 VanDerWaalsContact C-N 3.33Å; V475-G477 PolarHBondContact O-N 2.74Å; G477-R479 PolarHBondContact O-N 3.25Å
478	C	25.6	Very low	43.2	Very low	141 Å²	141	106.7 Å²	106.7	95%	0.953	59%	0.591	S	S	*	*			trans	-57.6	90.4	168.1	-172.4	0	0	0	0	108.3
479	R	25.1	Very low	40.9	Very low	231 Å²	231	109.6 Å²	109.6	87%	0.872	61%	0.607	S	S	*	*			trans	-114.7	114.1	163	-81.7	-172.5	177.3	179.6	0.4	106.6	G477	G477-R479 PolarHBondContact O-N 3.25Å
480	T	28.6	Very low	38.6	Very low	119 Å²	119	111.9 Å²	111.9	73%	0.73	63%	0.625	S	S	*	*			trans	-11.8	123.4	160.9	50.9	0	0	0	0	113.9	N482	T480-N482 PolarHBondContact O-N 3.33Å
481	T	29.4	Very low	36.6	Very low	139 Å²	139	113.3 Å²	113.3	85%	0.853	63%	0.63	S	S	*	*			trans	-36.9	94.1	169	53.3	0	0	0	0	112.3
482	N	26.6	Very low	35.2	Very low	129 Å²	129	118.5 Å²	118.5	69%	0.69	66%	0.659	S	S	*	*			trans	-97.6	128.2	155.4	-87.2	-8	0	0	0	106.2	T480 N484	T480-N482 PolarHBondContact O-N 3.33Å; N482-N484 PolarHBondContact O-N 3.29Å
483	S	35.5	Very low	34.7	Very low	118 Å²	118	122.2 Å²	122.2	83%	0.825	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	30.2	-169.1	50.3	0	0	0	0	116.3
484	N	29	Very low	34.8	Very low	132 Å²	132	118.8 Å²	118.8	71%	0.706	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	9.1	-178.2	-80.6	-2.5	0	0	0	114.8	N482 K486	N482-N484 PolarHBondContact O-N 3.29Å; N484-K486 PolarHBondContact O-N 3.47Å
485	D	32.3	Very low	35.9	Very low	145 Å²	145	119.4 Å²	119.4	78%	0.775	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-73.8	33.8	172.5	-75.4	-20.9	0	0	0	114	N487	D485-N487 PolarHBondContact O-N 3.42Å
486	K	32.3	Very low	37.5	Very low	177 Å²	177	118 Å²	118	77%	0.77	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-70.6	-7.2	164.8	-72.8	-175	176.3	179.4	0	112.7	N484	N484-K486 PolarHBondContact O-N 3.47Å
487	N	34.5	Very low	39.2	Very low	131 Å²	131	115.3 Å²	115.3	70%	0.701	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-81.6	-13.9	-177.8	-76.1	-11.5	0	0	0	114.8	D485 L489 S490	D485-N487 PolarHBondContact O-N 3.42Å; N487-L489 PolarHBondContact O-N 2.87Å; N487-S490 WeakPolarHBondContact O-CB 3.42Å; N487-S490 PolarHBondContact O-N 3.4Å
488	L	38.7	Very low	41.4	Very low	98 Å²	98	113.1 Å²	113.1	51%	0.513	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-63.6	-23.3	175.2	-145.3	83.4	0	0	0	112
489	L	40.8	Very low	43.6	Very low	99 Å²	99	107.3 Å²	107.3	52%	0.518	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-96.9	1.8	-178.4	-67.8	167.8	0	0	0	114.1	Y464 N487 L491	Y464-L489 HydrophobicContact CE2-CD2 4.43Å; N487-L489 PolarHBondContact O-N 2.87Å; L489-L491 PolarHBondContact O-N 3.24Å
490	S	41.1	Very low	45.8	Very low	80 Å²	80	96.8 Å²	96.8	56%	0.559	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-70.3	8.8	-179.7	-179.8	0	0	0	0	114.5	N487 T492	N487-S490 WeakPolarHBondContact O-CB 3.42Å; N487-S490 PolarHBondContact O-N 3.4Å; S490-T492 PolarHBondContact O-N 3.24Å; S490-T492 VanDerWaalsContact O-N 3.12Å
491	L	42.4	Very low	47.5	Very low	52 Å²	52	94.5 Å²	94.5	27%	0.272	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-73.8	14.5	171.2	-86.4	138.6	0	0	0	113.6	A470 L489 N493 C494	A470-L491 HydrophobicContact CB-CD2 4.4Å; L489-L491 PolarHBondContact O-N 3.24Å; L491-N493 PolarHBondContact O-N 3.49Å; L491-C494 PolarHBondContact O-N 3.45Å
492	T	44.7	Very low	49.5	Very low	120 Å²	120	91.6 Å²	91.6	74%	0.736	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-56.3	-14.9	174.9	33.1	0	0	0	0	114.8	S490	S490-T492 PolarHBondContact O-N 3.24Å; S490-T492 VanDerWaalsContact O-N 3.12Å
493	N	44.9	Very low	51.8	Low	142 Å²	142	85.6 Å²	85.6	76%	0.759	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-93.8	8.9	179.5	-73.1	2.1	0	0	0	114.8	L491 N495	L491-N493 PolarHBondContact O-N 3.49Å; N493-N495 PolarHBondContact O-N 3.04Å; N493-N495 VanDerWaalsContact O-N 3.08Å
494	C	51.4	Low	53.9	Low	35 Å²	35	80 Å²	80	24%	0.236	43%	0.434	C	S	.	.			trans	-74.3	98.5	172.3	-78.5	0	0	0	0	110.8	L491 R496	L491-C494 PolarHBondContact O-N 3.45Å; C494-R496 PolarHBondContact O-N 3.42Å; C494-R496 VanDerWaalsContact O-N 3.1Å
495	N	57.8	Low	56.4	Low	168 Å²	168	80.9 Å²	80.9	90%	0.898	43%	0.428	S	S	*	.			trans	-67.8	1.9	173.8	-71.8	-16.4	0	0	0	114.5	N493	N493-N495 PolarHBondContact O-N 3.04Å; N493-N495 VanDerWaalsContact O-N 3.08Å
496	R	65	Low	59	Low	89 Å²	89	76.9 Å²	76.9	34%	0.336	41%	0.406	S	S	.	.	S	Bend	trans	-88.9	144	-179.1	-73.2	-155.6	-163.3	-173.8	5.5	111.8	C494 S498 C499 Q500 P501 D502 E535 C539	C494-R496 PolarHBondContact O-N 3.42Å; C494-R496 VanDerWaalsContact O-N 3.1Å; R496-S498 VanDerWaalsContact C-N 3.28Å; R496-S498 PolarHBondContact O-N 3.19Å; R496-C499 PolarHBondContact O-N 3.39Å; R496-Q500 WeakPolarHBondContact CD-O 3.5Å; R496-P501 PolarHBondContact NE-O 2.9Å; R496-P501 VanDerWaalsContact NE-O 3.1Å; R496-P501 PolarHBondContact NH2-O 3.26Å; R496-D502 PolarHBondContact NH1-O 2.85Å; R496-E535 WeakPolarHBondContact CA-OE1 3.16Å; R496-E535 VanDerWaalsContact CB-OE1 3.28Å; R496-E535 WeakPolarHBondContact CB-OE1 3.42Å; R496-C539 PolarHBondContact NH1-SG 2.95Å
497	A	67.3	Low	61.9	Low	30 Å²	30	69.7 Å²	69.7	25%	0.248	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-35.4	179.4	0	0	0	0	0	112	C499 A531 L532 E535	A497-C499 PolarHBondContact O-N 2.99Å; A497-A531 HydrophobicContact CB-CB 3.99Å; A497-L532 HydrophobicContact CB-CB 3.99Å; A497-L532 HydrophobicContact CB-CD1 4.08Å; A497-E535 PolarHBondContact N-OE1 3.06Å
498	S	76.4	Confident	64.7	Low	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-4.1	174.2	59.6	0	0	0	0	114.6	L466 R496 Q500 E535	L466-S498 WeakPolarHBondContact CB-O 3.26Å; L466-S498 WeakPolarHBondContact CD1-O 3.47Å; R496-S498 VanDerWaalsContact C-N 3.28Å; R496-S498 PolarHBondContact O-N 3.19Å; S498-Q500 PolarHBondContact O-N 3.01Å; S498-Q500 PolarHBondContact OG-N 3.38Å; S498-E535 WeakPolarHBondContact CB-OE2 3.42Å; S498-E535 PolarHBondContact N-OE2 3.49Å; S498-E535 PolarHBondContact OG-OE2 3.21Å
499	C	71.8	Confident	67.4	Low	20 Å²	20	60.2 Å²	60.2	14%	0.135	33%	0.328	C	S	.	.	S	Bend	trans	57.7	12.4	-171.4	-56.5	0	0	0	0	114.4	L466 R467 R496 A497	L466-C499 HydrophobicContact CB-CB 4.35Å; R467-C499 HydrophobicContact CG-CB 4.18Å; R496-C499 PolarHBondContact O-N 3.39Å; A497-C499 PolarHBondContact O-N 2.99Å
500	Q	71.3	Confident	70	Confident	9 Å²	9	55.5 Å²	55.5	4%	0.042	30%	0.303	C	S	.	.			trans	-110.3	137.9	179.6	-74.1	178.7	-20.4	0	0	110.6	I469 A470 R496 S498 D502 G503 S509	I469-Q500 VanDerWaalsContact CG2-NE2 3.31Å; A470-Q500 HydrophobicContact CB-CG 3.93Å; R496-Q500 WeakPolarHBondContact CD-O 3.5Å; S498-Q500 PolarHBondContact O-N 3.01Å; S498-Q500 PolarHBondContact OG-N 3.38Å; Q500-D502 VanDerWaalsContact C-N 3.27Å; Q500-D502 PolarHBondContact O-N 3.08Å; Q500-G503 PolarHBondContact O-N 3.41Å; Q500-G503 VanDerWaalsContact OE1-C 3.3Å; Q500-G503 PolarHBondContact OE1-O 3.11Å; Q500-G503 VanDerWaalsContact OE1-O 3.08Å; Q500-S509 PolarHBondContact NE2-OG 3.28Å
501	P	64.5	Low	72.6	Confident	71 Å²	71	54.4 Å²	54.4	46%	0.461	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-33.6	-176	21.9	-31.8	0	0	0	113.3	R496	R496-P501 PolarHBondContact NE-O 2.9Å; R496-P501 VanDerWaalsContact NE-O 3.1Å; R496-P501 PolarHBondContact NH2-O 3.26Å
502	D	70.5	Confident	75.2	Confident	79 Å²	79	51.9 Å²	51.9	42%	0.422	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	7.7	-178.1	-69.4	-35.3	0	0	0	114	R496 Q500 R505 C539	R496-D502 PolarHBondContact NH1-O 2.85Å; Q500-D502 VanDerWaalsContact C-N 3.27Å; Q500-D502 PolarHBondContact O-N 3.08Å; D502-R505 IonicContact OD1-NH2 3.41Å; D502-R505 IonicContact OD2-CZ 2.75Å; D502-R505 IonicContact OD2-NE 3.24Å; D502-R505 IonicContact OD2-NH1 3.66Å; D502-R505 IonicContact OD2-NH2 2.74Å; D502-R505 PolarHBondContact OD2-NH2 3.34Å; D502-C539 WeakPolarHBondContact O-CB 3.47Å
503	G	75.4	Confident	77.7	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.021	24%	0.243	C	C	.	.			trans	76.7	-179.4	-173.8	0	0	0	0	0	113.6	Q500 R505	Q500-G503 PolarHBondContact O-N 3.41Å; Q500-G503 VanDerWaalsContact OE1-C 3.3Å; Q500-G503 PolarHBondContact OE1-O 3.11Å; Q500-G503 VanDerWaalsContact OE1-O 3.08Å; G503-R505 PolarHBondContact O-N 2.92Å
504	P	80.3	Confident	80.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.			trans	-68.4	115.1	-174.4	28	-34.8	0	0	0	112.4	V510 V536 G540	P504-V510 HydrophobicContact CB-CG2 3.86Å; P504-V510 HydrophobicContact CG-CG2 4.33Å; P504-V536 HydrophobicContact CG-CG2 4.1Å; P504-G540 VanDerWaalsContact O-CA 3.27Å; P504-G540 WeakPolarHBondContact O-CA 3.48Å
505	R	80.3	Confident	82.3	Confident	152 Å²	152	39 Å²	39	57%	0.574	20%	0.202	S	C	*	.			trans	-104.4	-14	-177.6	-70.2	-168.9	172	-172.4	1.8	115.5	D502 G503 H542 V543	D502-R505 IonicContact OD1-NH2 3.41Å; D502-R505 IonicContact OD2-CZ 2.75Å; D502-R505 IonicContact OD2-NE 3.24Å; D502-R505 IonicContact OD2-NH1 3.66Å; D502-R505 IonicContact OD2-NH2 2.74Å; D502-R505 PolarHBondContact OD2-NH2 3.34Å; G503-R505 PolarHBondContact O-N 2.92Å; R505-H542 PolarHBondContact O-NE2 3.06Å; R505-V543 VanDerWaalsContact O-CG2 3.28Å; R505-V543 WeakPolarHBondContact O-CG2 3.22Å
506	D	88.9	Confident	84.2	Confident	60 Å²	60	31 Å²	31	32%	0.321	16%	0.159	S	C	.	.	S	Bend	trans	-129.6	163.3	-176.7	71.7	89.6	0	0	0	112.1	L508 S509 V510	D506-L508 VanDerWaalsContact C-N 3.26Å; D506-L508 PolarHBondContact O-N 3.38Å; D506-L508 WeakPolarHBondContact OD1-CA 3.44Å; D506-L508 VanDerWaalsContact OD1-CB 3.25Å; D506-L508 WeakPolarHBondContact OD1-CB 3.36Å; D506-L508 PolarHBondContact OD1-N 3.45Å; D506-S509 PolarHBondContact O-N 3.22Å; D506-S509 PolarHBondContact OD1-N 3.45Å; D506-S509 VanDerWaalsContact OD2-CB 3.3Å; D506-S509 WeakPolarHBondContact OD2-CB 3.25Å; D506-S509 PolarHBondContact OD2-OG 3.32Å; D506-V510 PolarHBondContact O-N 3.08Å
507	S	92.1	Very high	85.7	Confident	27 Å²	27	26.8 Å²	26.8	19%	0.189	14%	0.143	C	C	.	.	H	α-helix	trans	-58.9	-33.6	-177	-62.4	0	0	0	0	113.8	R259 L511	R259-S507 PolarHBondContact NH1-OG 3.13Å; R259-S507 PolarHBondContact NH2-OG 3.08Å; S507-L511 VanDerWaalsContact O-CB 3.31Å; S507-L511 WeakPolarHBondContact O-CB 3.45Å; S507-L511 PolarHBondContact O-N 2.86Å
508	L	93.4	Very high	87.1	Confident	29 Å²	29	27.1 Å²	27.1	15%	0.152	14%	0.14	C	C	.	.	H	α-helix	trans	-73.5	-44.8	178.7	178.5	65.1	0	0	0	110.3	P439 Q440 T443 I469 D506 V510 L511 I512	P439-L508 HydrophobicContact CB-CD2 3.96Å; Q440-L508 HydrophobicContact CG-CD2 3.75Å; T443-L508 HydrophobicContact CG2-CD1 4.06Å; I469-L508 HydrophobicContact CD1-CD2 4.04Å; I469-L508 HydrophobicContact CD1-CG 4.21Å; D506-L508 VanDerWaalsContact C-N 3.26Å; D506-L508 PolarHBondContact O-N 3.38Å; D506-L508 WeakPolarHBondContact OD1-CA 3.44Å; D506-L508 VanDerWaalsContact OD1-CB 3.25Å; D506-L508 WeakPolarHBondContact OD1-CB 3.36Å; D506-L508 PolarHBondContact OD1-N 3.45Å; L508-V510 VanDerWaalsContact C-N 3.33Å; L508-V510 PolarHBondContact O-N 3.32Å; L508-L511 HydrophobicContact CD1-CD2 4.45Å; L508-L511 WeakPolarHBondContact O-CB 3.47Å; L508-L511 PolarHBondContact O-N 3.24Å; L508-L511 VanDerWaalsContact O-N 3.17Å; L508-I512 HydrophobicContact CD1-CD1 4.18Å; L508-I512 HydrophobicContact CD1-CG1 4.23Å; L508-I512 HydrophobicContact CD2-CD1 4.47Å; L508-I512 HydrophobicContact CG-CD1 3.81Å; L508-I512 HydrophobicContact CG-CG1 4.33Å; L508-I512 VanDerWaalsContact O-CG1 3.25Å; L508-I512 WeakPolarHBondContact O-CG1 3.4Å; L508-I512 PolarHBondContact O-N 2.76Å
509	S	94.4	Very high	88.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-57.6	-45.7	175.5	-64.5	0	0	0	0	111.8	Q500 D506 I512 C513	Q500-S509 PolarHBondContact NE2-OG 3.28Å; D506-S509 PolarHBondContact O-N 3.22Å; D506-S509 PolarHBondContact OD1-N 3.45Å; D506-S509 VanDerWaalsContact OD2-CB 3.3Å; D506-S509 WeakPolarHBondContact OD2-CB 3.25Å; D506-S509 PolarHBondContact OD2-OG 3.32Å; S509-I512 PolarHBondContact O-N 2.97Å; S509-C513 WeakPolarHBondContact O-CB 3.45Å; S509-C513 PolarHBondContact O-N 2.87Å; S509-C513 PolarHBondContact O-SG 2.71Å
510	V	95.4	Very high	89.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-46.7	174.9	172.4	0	0	0	0	111.1	P504 D506 L508 I512 C513 L514 V536 V543 L544 L550	P504-V510 HydrophobicContact CB-CG2 3.86Å; P504-V510 HydrophobicContact CG-CG2 4.33Å; D506-V510 PolarHBondContact O-N 3.08Å; L508-V510 VanDerWaalsContact C-N 3.33Å; L508-V510 PolarHBondContact O-N 3.32Å; V510-I512 VanDerWaalsContact C-N 3.33Å; V510-I512 PolarHBondContact O-N 2.87Å; V510-C513 PolarHBondContact O-N 3.39Å; V510-L514 HydrophobicContact CG1-CD1 4.06Å; V510-L514 HydrophobicContact CG1-CG 4.3Å; V510-L514 VanDerWaalsContact O-CG 3.31Å; V510-L514 WeakPolarHBondContact O-CG 3.35Å; V510-L514 PolarHBondContact O-N 2.8Å; V510-V536 HydrophobicContact CG1-CG1 4.23Å; V510-V543 HydrophobicContact CB-CG1 4.33Å; V510-V543 HydrophobicContact CG2-CB 3.9Å; V510-V543 HydrophobicContact CG2-CG1 3.83Å; V510-V543 HydrophobicContact CG2-CG2 4.17Å; V510-L544 HydrophobicContact CG1-CD2 3.76Å; V510-L550 HydrophobicContact CG1-CD1 4.39Å; V510-L550 HydrophobicContact CG1-CD2 4.47Å
511	L	96.1	Very high	90.4	Very high	57 Å²	57	26.2 Å²	26.2	30%	0.298	13%	0.134	S	C	.	.	H	α-helix	trans	-57.7	-44.7	177.2	178.5	66.5	0	0	0	112	S507 L508 L514 N515 L550	S507-L511 VanDerWaalsContact O-CB 3.31Å; S507-L511 WeakPolarHBondContact O-CB 3.45Å; S507-L511 PolarHBondContact O-N 2.86Å; L508-L511 HydrophobicContact CD1-CD2 4.45Å; L508-L511 WeakPolarHBondContact O-CB 3.47Å; L508-L511 PolarHBondContact O-N 3.24Å; L508-L511 VanDerWaalsContact O-N 3.17Å; L511-L514 PolarHBondContact O-N 3.2Å; L511-N515 WeakPolarHBondContact CD1-ND2 3.44Å; L511-N515 PolarHBondContact O-N 3.4Å; L511-N515 VanDerWaalsContact O-N 3.12Å; L511-N515 PolarHBondContact O-ND2 3.09Å; L511-L550 HydrophobicContact CB-CD2 4.36Å; L511-L550 HydrophobicContact CD1-CD2 4.49Å
512	I	97	Very high	91.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.3	-47.6	178	-63.9	160.5	0	0	0	110.1	T443 F462 A465 L466 I469 L508 S509 V510 L514 N515 L516	T443-I512 HydrophobicContact CG2-CG1 3.84Å; T443-I512 WeakPolarHBondContact OG1-CD1 3.35Å; T443-I512 WeakPolarHBondContact OG1-CG1 3.46Å; F462-I512 HydrophobicContact CB-CG2 3.62Å; F462-I512 HydrophobicContact CD1-CG2 3.83Å; F462-I512 HydrophobicContact CG-CG2 3.98Å; A465-I512 HydrophobicContact CB-CD1 3.82Å; L466-I512 HydrophobicContact CD1-CG2 3.82Å; L466-I512 HydrophobicContact CD2-CB 4.18Å; L466-I512 HydrophobicContact CD2-CD1 4.36Å; L466-I512 HydrophobicContact CD2-CG2 4.12Å; L466-I512 HydrophobicContact CG-CB 4.29Å; L466-I512 HydrophobicContact CG-CG2 3.68Å; I469-I512 HydrophobicContact CD1-CD1 3.7Å; L508-I512 HydrophobicContact CD1-CD1 4.18Å; L508-I512 HydrophobicContact CD1-CG1 4.23Å; L508-I512 HydrophobicContact CD2-CD1 4.47Å; L508-I512 HydrophobicContact CG-CD1 3.81Å; L508-I512 HydrophobicContact CG-CG1 4.33Å; L508-I512 VanDerWaalsContact O-CG1 3.25Å; L508-I512 WeakPolarHBondContact O-CG1 3.4Å; L508-I512 PolarHBondContact O-N 2.76Å; S509-I512 PolarHBondContact O-N 2.97Å; V510-I512 VanDerWaalsContact C-N 3.33Å; V510-I512 PolarHBondContact O-N 2.87Å; I512-L514 VanDerWaalsContact C-N 3.33Å; I512-L514 PolarHBondContact O-N 3.47Å; I512-N515 PolarHBondContact O-N 2.74Å; I512-L516 VanDerWaalsContact O-CB 3.28Å; I512-L516 WeakPolarHBondContact O-CB 3.48Å; I512-L516 PolarHBondContact O-N 3.33Å
513	C	96.8	Very high	93	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.4	-41.4	178.8	-69	0	0	0	0	112.3	S509 V510 L516 A517 L532 V536	S509-C513 WeakPolarHBondContact O-CB 3.45Å; S509-C513 PolarHBondContact O-N 2.87Å; S509-C513 PolarHBondContact O-SG 2.71Å; V510-C513 PolarHBondContact O-N 3.39Å; C513-L516 PolarHBondContact O-N 3.17Å; C513-A517 WeakPolarHBondContact O-CB 3.31Å; C513-A517 PolarHBondContact O-N 3.13Å; C513-L532 HydrophobicContact CB-CD1 3.97Å; C513-L532 HydrophobicContact CB-CD2 4.4Å; C513-L532 HydrophobicContact CB-CG 4.14Å; C513-L532 WeakPolarHBondContact O-CD2 3.41Å; C513-V536 HydrophobicContact CB-CG2 3.45Å; C513-V536 VanDerWaalsContact CB-CG2 3.45Å
514	L	97.3	Very high	93.8	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-64.8	-41.3	177.4	-68.7	179.8	0	0	0	112.4	V510 L511 I512 A517 L518 L533 V536 A553 A554 V557	V510-L514 HydrophobicContact CG1-CD1 4.06Å; V510-L514 HydrophobicContact CG1-CG 4.3Å; V510-L514 VanDerWaalsContact O-CG 3.31Å; V510-L514 WeakPolarHBondContact O-CG 3.35Å; V510-L514 PolarHBondContact O-N 2.8Å; L511-L514 PolarHBondContact O-N 3.2Å; I512-L514 VanDerWaalsContact C-N 3.33Å; I512-L514 PolarHBondContact O-N 3.47Å; L514-A517 PolarHBondContact O-N 2.73Å; L514-L518 PolarHBondContact O-N 2.88Å; L514-L533 HydrophobicContact CD2-CD2 4.03Å; L514-V536 HydrophobicContact CD2-CG1 4.22Å; L514-A553 HydrophobicContact CD1-CB 3.99Å; L514-A554 HydrophobicContact CD1-CB 4.13Å; L514-A554 HydrophobicContact CD2-CB 3.92Å; L514-V557 HydrophobicContact CB-CG2 4.32Å; L514-V557 HydrophobicContact CD2-CB 4.28Å; L514-V557 HydrophobicContact CD2-CG2 4.31Å
515	N	97.5	Very high	94.4	Very high	21 Å²	21	33.3 Å²	33.3	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-70.8	-37.6	176	-75.1	-79.7	0	0	0	112.1	L447 M450 F462 L511 I512 A517 L518 V519	L447-N515 HydrophobicContact CD2-CB 4.3Å; L447-N515 WeakPolarHBondContact CD2-OD1 3.46Å; M450-N515 WeakPolarHBondContact CE-OD1 3.29Å; F462-N515 HydrophobicContact CE1-CB 4.27Å; F462-N515 HydrophobicContact CE2-CB 3.87Å; F462-N515 HydrophobicContact CZ-CB 3.7Å; L511-N515 WeakPolarHBondContact CD1-ND2 3.44Å; L511-N515 PolarHBondContact O-N 3.4Å; L511-N515 VanDerWaalsContact O-N 3.12Å; L511-N515 PolarHBondContact O-ND2 3.09Å; I512-N515 PolarHBondContact O-N 2.74Å; N515-A517 VanDerWaalsContact C-N 3.33Å; N515-A517 PolarHBondContact O-N 3.36Å; N515-L518 WeakPolarHBondContact O-CB 3.48Å; N515-L518 PolarHBondContact O-N 3.49Å; N515-V519 WeakPolarHBondContact O-CG2 3.42Å; N515-V519 PolarHBondContact O-N 3.13Å
516	L	97	Very high	94.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-38.1	174.2	178.6	60.6	0	0	0	111.6	E459 F462 K463 L466 I512 C513 L518 V519 H520 L532	E459-L516 HydrophobicContact CB-CD1 4.31Å; E459-L516 HydrophobicContact CG-CD1 3.9Å; F462-L516 HydrophobicContact CB-CB 4.23Å; F462-L516 HydrophobicContact CB-CD1 4.26Å; F462-L516 HydrophobicContact CD2-CB 4.24Å; F462-L516 HydrophobicContact CD2-CD1 4.46Å; K463-L516 HydrophobicContact CG-CD2 4.19Å; L466-L516 HydrophobicContact CD1-CD2 4.09Å; I512-L516 VanDerWaalsContact O-CB 3.28Å; I512-L516 WeakPolarHBondContact O-CB 3.48Å; I512-L516 PolarHBondContact O-N 3.33Å; C513-L516 PolarHBondContact O-N 3.17Å; L516-L518 PolarHBondContact O-N 3.14Å; L516-V519 WeakPolarHBondContact O-CB 3.38Å; L516-V519 PolarHBondContact O-N 3.17Å; L516-H520 PolarHBondContact O-CD2 2.95Å; L516-H520 VanDerWaalsContact O-CD2 3.3Å; L516-H520 PolarHBondContact O-N 2.89Å; L516-L532 HydrophobicContact CB-CD2 3.82Å; L516-L532 HydrophobicContact CD2-CD2 3.78Å; L516-L532 HydrophobicContact CG-CD2 3.67Å
517	A	96.9	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.6	-43	172	0	0	0	0	0	111.7	C513 L514 N515 V519 H520 I521 L532 L533 V557	C513-A517 WeakPolarHBondContact O-CB 3.31Å; C513-A517 PolarHBondContact O-N 3.13Å; L514-A517 PolarHBondContact O-N 2.73Å; N515-A517 VanDerWaalsContact C-N 3.33Å; N515-A517 PolarHBondContact O-N 3.36Å; A517-V519 VanDerWaalsContact C-N 3.31Å; A517-V519 PolarHBondContact O-N 3.15Å; A517-H520 PolarHBondContact O-N 3.41Å; A517-I521 WeakPolarHBondContact O-CG1 3.41Å; A517-I521 PolarHBondContact O-N 2.9Å; A517-L532 HydrophobicContact CB-CD2 4.17Å; A517-L533 HydrophobicContact CB-CD1 4.42Å; A517-L533 HydrophobicContact CB-CD2 3.93Å; A517-L533 HydrophobicContact CB-CG 4.03Å; A517-V557 HydrophobicContact CB-CG1 3.84Å
518	L	96.5	Very high	95	Very high	37 Å²	37	33.7 Å²	33.7	19%	0.194	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-38.7	173.6	-69	174.1	0	0	0	112.4	L514 N515 L516 I521 R522 V557 F560	L514-L518 PolarHBondContact O-N 2.88Å; N515-L518 WeakPolarHBondContact O-CB 3.48Å; N515-L518 PolarHBondContact O-N 3.49Å; L516-L518 PolarHBondContact O-N 3.14Å; L518-I521 PolarHBondContact O-N 2.97Å; L518-R522 VanDerWaalsContact O-CG 3.32Å; L518-R522 WeakPolarHBondContact O-CG 3.32Å; L518-R522 PolarHBondContact O-N 3.5Å; L518-R522 VanDerWaalsContact O-N 3.08Å; L518-V557 HydrophobicContact CD1-CG2 4.23Å; L518-V557 HydrophobicContact CD2-CG1 4.23Å; L518-V557 HydrophobicContact CD2-CG2 4.04Å; L518-V557 HydrophobicContact CG-CG1 4.36Å; L518-V557 HydrophobicContact CG-CG2 3.98Å; L518-F560 HydrophobicContact CD2-CD1 3.98Å
519	V	97.1	Very high	95	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-45.6	173.3	173.2	0	0	0	0	110.8	M450 M455 A458 E459 F462 N515 L516 A517 I521 R522 K523	M450-V519 HydrophobicContact CG-CG2 4.08Å; M450-V519 HydrophobicContact SD-CG2 3.94Å; M455-V519 HydrophobicContact CB-CG1 4.22Å; M455-V519 WeakPolarHBondContact O-CG1 3.45Å; M455-V519 HydrophobicContact SD-CB 4.42Å; M455-V519 HydrophobicContact SD-CG1 4.11Å; M455-V519 HydrophobicContact SD-CG2 4.18Å; A458-V519 HydrophobicContact CB-CG2 4.03Å; E459-V519 HydrophobicContact CB-CG1 4.04Å; F462-V519 HydrophobicContact CD2-CG2 4.31Å; F462-V519 HydrophobicContact CE2-CG2 3.97Å; N515-V519 WeakPolarHBondContact O-CG2 3.42Å; N515-V519 PolarHBondContact O-N 3.13Å; L516-V519 WeakPolarHBondContact O-CB 3.38Å; L516-V519 PolarHBondContact O-N 3.17Å; A517-V519 VanDerWaalsContact C-N 3.31Å; A517-V519 PolarHBondContact O-N 3.15Å; V519-I521 PolarHBondContact O-N 3.5Å; V519-R522 PolarHBondContact O-N 3.25Å; V519-K523 HydrophobicContact CG1-CD 4.1Å; V519-K523 HydrophobicContact CG1-CG 4.47Å; V519-K523 WeakPolarHBondContact O-CG 3.27Å; V519-K523 PolarHBondContact O-N 3.03Å
520	H	96.4	Very high	95	Very high	5 Å²	5	36.8 Å²	36.8	2%	0.023	19%	0.19	C	C	.	.	H	α-helix	trans	-61.4	-41.3	177.6	-73.5	-45.8	0	0	0	112.6	E459 L516 A517 R522 K523 G524 N525 E528 C529	E459-H520 IonicContact OE1-CE1 3.71Å; L516-H520 PolarHBondContact O-CD2 2.95Å; L516-H520 VanDerWaalsContact O-CD2 3.3Å; L516-H520 PolarHBondContact O-N 2.89Å; A517-H520 PolarHBondContact O-N 3.41Å; H520-R522 VanDerWaalsContact C-N 3.35Å; H520-R522 PolarHBondContact O-N 2.88Å; H520-K523 PolarHBondContact O-N 3.03Å; H520-G524 PolarHBondContact O-N 3.43Å; H520-N525 HydrophobicContact CB-CB 4.08Å; H520-N525 PolarHBondContact O-N 3.22Å; H520-E528 IonicContact CE1-OE2 3.79Å; H520-E528 PolarHBondContact CE1-OE2 2.74Å; H520-E528 IonicContact ND1-OE2 3.66Å; H520-E528 PolarHBondContact ND1-OE2 3.43Å; H520-E528 IonicContact NE2-OE2 3.61Å; H520-C529 HydrophobicContact CB-CB 3.86Å
521	I	95.3	Very high	94.9	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-47.3	173.6	-66.6	167	0	0	0	110.4	A517 L518 V519 K523 G524 C529 F560 Q561 Y564	A517-I521 WeakPolarHBondContact O-CG1 3.41Å; A517-I521 PolarHBondContact O-N 2.9Å; L518-I521 PolarHBondContact O-N 2.97Å; V519-I521 PolarHBondContact O-N 3.5Å; I521-K523 PolarHBondContact O-N 3.39Å; I521-G524 PolarHBondContact O-N 3.33Å; I521-C529 HydrophobicContact CG1-CB 4.42Å; I521-C529 VanDerWaalsContact CG1-SG 3.56Å; I521-F560 HydrophobicContact CD1-CD1 3.88Å; I521-F560 HydrophobicContact CG2-CD1 3.91Å; I521-F560 HydrophobicContact CG2-CE1 3.76Å; I521-Q561 HydrophobicContact CD1-CB 4Å; I521-Y564 HydrophobicContact CG2-CD1 4.34Å; I521-Y564 HydrophobicContact CG2-CD2 3.87Å; I521-Y564 HydrophobicContact CG2-CE2 4.47Å; I521-Y564 HydrophobicContact CG2-CG 3.8Å
522	R	94.5	Very high	94.8	Very high	142 Å²	142	36 Å²	36	54%	0.536	19%	0.192	S	C	.	.	H	α-helix	trans	-65.7	-25.6	179.4	-70	176.6	71.5	136	-0.4	113.7	N453 M455 L518 V519 H520	N453-R522 PolarHBondContact OD1-NH2 3.12Å; M455-R522 VanDerWaalsContact CE-CZ 3.43Å; M455-R522 HydrophobicContact SD-CB 3.95Å; L518-R522 VanDerWaalsContact O-CG 3.32Å; L518-R522 WeakPolarHBondContact O-CG 3.32Å; L518-R522 PolarHBondContact O-N 3.5Å; L518-R522 VanDerWaalsContact O-N 3.08Å; V519-R522 PolarHBondContact O-N 3.25Å; H520-R522 VanDerWaalsContact C-N 3.35Å; H520-R522 PolarHBondContact O-N 2.88Å
523	K	94.9	Very high	94.6	Very high	75 Å²	75	36.1 Å²	36.1	33%	0.326	19%	0.192	S	C	.	.	H	α-helix	trans	-85.3	-13.4	173.5	-70.9	-175.5	60.7	164.3	0	113.6	M455 N456 E459 V519 H520 I521	M455-K523 HydrophobicContact CB-CD 4.15Å; M455-K523 HydrophobicContact CB-CG 3.97Å; N456-K523 PolarHBondContact OD1-NZ 3.37Å; E459-K523 WeakPolarHBondContact OE2-CD 3.37Å; E459-K523 WeakPolarHBondContact OE2-CE 3.4Å; E459-K523 IonicContact OE2-NZ 3.21Å; E459-K523 PolarHBondContact OE2-NZ 2.83Å; V519-K523 HydrophobicContact CG1-CD 4.1Å; V519-K523 HydrophobicContact CG1-CG 4.47Å; V519-K523 WeakPolarHBondContact O-CG 3.27Å; V519-K523 PolarHBondContact O-N 3.03Å; H520-K523 PolarHBondContact O-N 3.03Å; I521-K523 PolarHBondContact O-N 3.39Å
524	G	93	Very high	94.5	Very high	33 Å²	33	40 Å²	40	34%	0.34	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	14	-172.8	0	0	0	0	0	114.5	H520 I521 T526	H520-G524 PolarHBondContact O-N 3.43Å; I521-G524 PolarHBondContact O-N 3.33Å; G524-T526 VanDerWaalsContact C-N 3.31Å; G524-T526 PolarHBondContact O-N 3.34Å
525	N	92.3	Very high	94.2	Very high	51 Å²	51	41 Å²	41	27%	0.273	22%	0.218	S	C	.	.			trans	-83.7	68.8	179.5	-66.4	10	0	0	0	110.8	H520 V527 E528 C529	H520-N525 HydrophobicContact CB-CB 4.08Å; H520-N525 PolarHBondContact O-N 3.22Å; N525-V527 PolarHBondContact O-N 3.31Å; N525-E528 HydrophobicContact CB-CB 4.32Å; N525-E528 PolarHBondContact ND2-OE2 2.73Å; N525-E528 PolarHBondContact O-N 3.09Å; N525-C529 WeakPolarHBondContact O-CB 3.48Å; N525-C529 PolarHBondContact O-N 2.99Å; N525-C529 VanDerWaalsContact O-N 3.1Å
526	T	90.2	Very high	94.1	Very high	55 Å²	55	40 Å²	40	34%	0.337	21%	0.212	S	C	.	.	H	α-helix	trans	-62	-41.3	-174.5	53.1	0	0	0	0	113.2	G524 E528 C529 E530 Y564 E565	G524-T526 VanDerWaalsContact C-N 3.31Å; G524-T526 PolarHBondContact O-N 3.34Å; T526-E528 PolarHBondContact O-N 2.9Å; T526-C529 WeakPolarHBondContact O-CB 3.41Å; T526-C529 PolarHBondContact O-N 2.86Å; T526-E530 WeakPolarHBondContact O-CB 3.44Å; T526-E530 PolarHBondContact O-N 3.46Å; T526-Y564 HydrophobicContact CG2-CD1 4.24Å; T526-Y564 HydrophobicContact CG2-CE1 4.21Å; T526-E565 HydrophobicContact CG2-CG 4.46Å
527	V	92	Very high	93.9	Very high	113 Å²	113	42.2 Å²	42.2	69%	0.685	22%	0.222	S	C	*	.	H	α-helix	trans	-62.3	-45.5	-179.1	-179.2	0	0	0	0	111.9	N525 E530 A531	N525-V527 PolarHBondContact O-N 3.31Å; V527-E530 PolarHBondContact O-N 3.34Å; V527-A531 WeakPolarHBondContact O-CB 3.38Å; V527-A531 PolarHBondContact O-N 3.48Å
528	E	91.5	Very high	93.7	Very high	79 Å²	79	45.9 Å²	45.9	37%	0.369	25%	0.248	S	C	.	.	H	α-helix	trans	-67.4	-39.1	177.8	-64.7	-176.8	150.1	0	0	111.3	H520 N525 T526 L532	H520-E528 IonicContact CE1-OE2 3.79Å; H520-E528 PolarHBondContact CE1-OE2 2.74Å; H520-E528 IonicContact ND1-OE2 3.66Å; H520-E528 PolarHBondContact ND1-OE2 3.43Å; H520-E528 IonicContact NE2-OE2 3.61Å; N525-E528 HydrophobicContact CB-CB 4.32Å; N525-E528 PolarHBondContact ND2-OE2 2.73Å; N525-E528 PolarHBondContact O-N 3.09Å; T526-E528 PolarHBondContact O-N 2.9Å; E528-L532 VanDerWaalsContact O-CB 3.3Å; E528-L532 WeakPolarHBondContact O-CB 3.42Å; E528-L532 PolarHBondContact O-N 2.82Å
529	C	94.2	Very high	93.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-47.6	175.4	-177.1	0	0	0	0	111.8	H520 I521 N525 T526 L532 L533	H520-C529 HydrophobicContact CB-CB 3.86Å; I521-C529 HydrophobicContact CG1-CB 4.42Å; I521-C529 VanDerWaalsContact CG1-SG 3.56Å; N525-C529 WeakPolarHBondContact O-CB 3.48Å; N525-C529 PolarHBondContact O-N 2.99Å; N525-C529 VanDerWaalsContact O-N 3.1Å; T526-C529 WeakPolarHBondContact O-CB 3.41Å; T526-C529 PolarHBondContact O-N 2.86Å; C529-L532 PolarHBondContact O-N 2.75Å; C529-L533 WeakPolarHBondContact O-CB 3.38Å; C529-L533 WeakPolarHBondContact O-CG 3.24Å; C529-L533 PolarHBondContact O-N 3.17Å
530	E	93.9	Very high	93	Very high	94 Å²	94	45.9 Å²	45.9	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-45.8	180	-171	-178.1	176.8	0	0	111.1	T526 V527 L532 L533 N534	T526-E530 WeakPolarHBondContact O-CB 3.44Å; T526-E530 PolarHBondContact O-N 3.46Å; V527-E530 PolarHBondContact O-N 3.34Å; E530-L532 VanDerWaalsContact C-N 3.33Å; E530-L532 PolarHBondContact O-N 2.97Å; E530-L533 PolarHBondContact O-N 2.91Å; E530-N534 WeakPolarHBondContact O-CB 3.45Å; E530-N534 VanDerWaalsContact O-CG 3.22Å; E530-N534 PolarHBondContact O-N 2.9Å; E530-N534 PolarHBondContact O-ND2 3.41Å
531	A	92.7	Very high	92.7	Very high	41 Å²	41	49 Å²	49	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-57.9	-45.5	175.9	0	0	0	0	0	111.7	A497 V527 N534 E535	A497-A531 HydrophobicContact CB-CB 3.99Å; V527-A531 WeakPolarHBondContact O-CB 3.38Å; V527-A531 PolarHBondContact O-N 3.48Å; A531-N534 PolarHBondContact O-N 3.46Å; A531-E535 WeakPolarHBondContact O-CG 3.31Å; A531-E535 PolarHBondContact O-N 3.13Å
532	L	93.3	Very high	92.5	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-43.6	179.8	-172.6	63.2	0	0	0	112.5	A497 C513 L516 A517 E528 C529 E530 E535 V536	A497-L532 HydrophobicContact CB-CB 3.99Å; A497-L532 HydrophobicContact CB-CD1 4.08Å; C513-L532 HydrophobicContact CB-CD1 3.97Å; C513-L532 HydrophobicContact CB-CD2 4.4Å; C513-L532 HydrophobicContact CB-CG 4.14Å; C513-L532 WeakPolarHBondContact O-CD2 3.41Å; L516-L532 HydrophobicContact CB-CD2 3.82Å; L516-L532 HydrophobicContact CD2-CD2 3.78Å; L516-L532 HydrophobicContact CG-CD2 3.67Å; A517-L532 HydrophobicContact CB-CD2 4.17Å; E528-L532 VanDerWaalsContact O-CB 3.3Å; E528-L532 WeakPolarHBondContact O-CB 3.42Å; E528-L532 PolarHBondContact O-N 2.82Å; C529-L532 PolarHBondContact O-N 2.75Å; E530-L532 VanDerWaalsContact C-N 3.33Å; E530-L532 PolarHBondContact O-N 2.97Å; L532-E535 WeakPolarHBondContact O-CB 3.45Å; L532-E535 PolarHBondContact O-N 3.38Å; L532-V536 WeakPolarHBondContact O-CG2 3.26Å; L532-V536 PolarHBondContact O-N 2.95Å
533	L	94.2	Very high	92.3	Very high	2 Å²	2	47 Å²	47	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-68.4	-38.7	177.8	-71.2	173.4	0	0	0	111.6	L514 A517 C529 E530 E535 V536 F537 V557 Q561	L514-L533 HydrophobicContact CD2-CD2 4.03Å; A517-L533 HydrophobicContact CB-CD1 4.42Å; A517-L533 HydrophobicContact CB-CD2 3.93Å; A517-L533 HydrophobicContact CB-CG 4.03Å; C529-L533 WeakPolarHBondContact O-CB 3.38Å; C529-L533 WeakPolarHBondContact O-CG 3.24Å; C529-L533 PolarHBondContact O-N 3.17Å; E530-L533 PolarHBondContact O-N 2.91Å; L533-E535 VanDerWaalsContact C-N 3.27Å; L533-E535 PolarHBondContact O-N 3.41Å; L533-V536 PolarHBondContact O-N 2.75Å; L533-V536 VanDerWaalsContact O-N 3.13Å; L533-F537 VanDerWaalsContact O-CD2 3.32Å; L533-F537 WeakPolarHBondContact O-CD2 3.4Å; L533-F537 PolarHBondContact O-N 3.19Å; L533-V557 HydrophobicContact CD1-CG1 4.17Å; L533-V557 HydrophobicContact CD2-CB 4.47Å; L533-V557 HydrophobicContact CD2-CG1 3.82Å; L533-Q561 HydrophobicContact CD1-CB 4.12Å; L533-Q561 HydrophobicContact CD1-CG 4.39Å
534	N	93.2	Very high	92.2	Very high	82 Å²	82	43.7 Å²	43.7	44%	0.439	25%	0.249	S	C	.	.	H	α-helix	trans	-59.2	-40.1	172.9	-74.8	-23.9	0	0	0	111.3	E530 A531 S538	E530-N534 WeakPolarHBondContact O-CB 3.45Å; E530-N534 VanDerWaalsContact O-CG 3.22Å; E530-N534 PolarHBondContact O-N 2.9Å; E530-N534 PolarHBondContact O-ND2 3.41Å; A531-N534 PolarHBondContact O-N 3.46Å; N534-S538 VanDerWaalsContact O-CB 3.23Å; N534-S538 WeakPolarHBondContact O-CB 3.48Å; N534-S538 PolarHBondContact O-N 2.8Å; N534-S538 PolarHBondContact O-OG 3.12Å
535	E	92.5	Very high	92.2	Very high	25 Å²	25	48.8 Å²	48.8	12%	0.117	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-41.1	172.9	-73	179.2	-159.2	0	0	112.8	R496 A497 S498 A531 L532 L533 C539 G540	R496-E535 WeakPolarHBondContact CA-OE1 3.16Å; R496-E535 VanDerWaalsContact CB-OE1 3.28Å; R496-E535 WeakPolarHBondContact CB-OE1 3.42Å; A497-E535 PolarHBondContact N-OE1 3.06Å; S498-E535 WeakPolarHBondContact CB-OE2 3.42Å; S498-E535 PolarHBondContact N-OE2 3.49Å; S498-E535 PolarHBondContact OG-OE2 3.21Å; A531-E535 WeakPolarHBondContact O-CG 3.31Å; A531-E535 PolarHBondContact O-N 3.13Å; L532-E535 WeakPolarHBondContact O-CB 3.45Å; L532-E535 PolarHBondContact O-N 3.38Å; L533-E535 VanDerWaalsContact C-N 3.27Å; L533-E535 PolarHBondContact O-N 3.41Å; E535-C539 WeakPolarHBondContact O-CA 3.36Å; E535-C539 VanDerWaalsContact O-CB 3.3Å; E535-C539 WeakPolarHBondContact O-CB 3.23Å; E535-C539 PolarHBondContact O-N 3.3Å; E535-G540 PolarHBondContact O-N 2.78Å
536	V	94.3	Very high	92	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-46.6	176.5	170.5	0	0	0	0	111.4	P504 V510 C513 L514 L532 L533 G540 L544	P504-V536 HydrophobicContact CG-CG2 4.1Å; V510-V536 HydrophobicContact CG1-CG1 4.23Å; C513-V536 HydrophobicContact CB-CG2 3.45Å; C513-V536 VanDerWaalsContact CB-CG2 3.45Å; L514-V536 HydrophobicContact CD2-CG1 4.22Å; L532-V536 WeakPolarHBondContact O-CG2 3.26Å; L532-V536 PolarHBondContact O-N 2.95Å; L533-V536 PolarHBondContact O-N 2.75Å; L533-V536 VanDerWaalsContact O-N 3.13Å; V536-G540 CarbonylContact O-C 3.53Å; V536-G540 WeakPolarHBondContact O-CA 3.46Å; V536-G540 PolarHBondContact O-N 3.2Å; V536-L544 HydrophobicContact CG1-CD1 4.14Å
537	F	93.9	Very high	92.1	Very high	46 Å²	46	45.3 Å²	45.3	20%	0.202	25%	0.249	C	C	.	.	H	α-helix	trans	-77.9	-20.2	-177.9	-80.6	-84.1	0	0	0	114	L533 L544 A554 K558	L533-F537 VanDerWaalsContact O-CD2 3.32Å; L533-F537 WeakPolarHBondContact O-CD2 3.4Å; L533-F537 PolarHBondContact O-N 3.19Å; F537-L544 HydrophobicContact CD1-CD1 4.18Å; F537-L544 HydrophobicContact CE1-CD1 4.29Å; F537-A554 HydrophobicContact CE1-CB 4.42Å; F537-A554 HydrophobicContact CE2-CB 4.18Å; F537-A554 HydrophobicContact CZ-CB 3.77Å; F537-K558 HydrophobicContact CD2-CD 4.13Å; F537-K558 HydrophobicContact CE1-CD 4.42Å; F537-K558 HydrophobicContact CE2-CB 4.11Å; F537-K558 HydrophobicContact CE2-CD 3.58Å; F537-K558 HydrophobicContact CE2-CG 4.43Å; F537-K558 HydrophobicContact CZ-CB 4.24Å; F537-K558 HydrophobicContact CZ-CD 3.74Å
538	S	91.7	Very high	92.2	Very high	77 Å²	77	40.5 Å²	40.5	54%	0.538	22%	0.221	S	C	.	.	H	α-helix	trans	-95.6	-52.2	176.7	59.8	0	0	0	0	112.8	N534	N534-S538 VanDerWaalsContact O-CB 3.23Å; N534-S538 WeakPolarHBondContact O-CB 3.48Å; N534-S538 PolarHBondContact O-N 2.8Å; N534-S538 PolarHBondContact O-OG 3.12Å
539	C	89.4	Confident	92.2	Very high	38 Å²	38	38.1 Å²	38.1	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-90	-26.6	-176.4	-59.2	0	0	0	0	113.3	R496 D502 E535 H542	R496-C539 PolarHBondContact NH1-SG 2.95Å; D502-C539 WeakPolarHBondContact O-CB 3.47Å; E535-C539 WeakPolarHBondContact O-CA 3.36Å; E535-C539 VanDerWaalsContact O-CB 3.3Å; E535-C539 WeakPolarHBondContact O-CB 3.23Å; E535-C539 PolarHBondContact O-N 3.3Å; C539-H542 PolarHBondContact O-CE1 2.66Å; C539-H542 VanDerWaalsContact O-CE1 3.27Å; C539-H542 PolarHBondContact O-ND1 3.38Å
540	G	89	Confident	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-96.4	8.1	-178.4	0	0	0	0	0	114.9	P504 E535 V536 H542 V543 L544	P504-G540 VanDerWaalsContact O-CA 3.27Å; P504-G540 WeakPolarHBondContact O-CA 3.48Å; E535-G540 PolarHBondContact O-N 2.78Å; V536-G540 CarbonylContact O-C 3.53Å; V536-G540 WeakPolarHBondContact O-CA 3.46Å; V536-G540 PolarHBondContact O-N 3.2Å; G540-H542 VanDerWaalsContact C-N 3.31Å; G540-H542 PolarHBondContact O-N 2.64Å; G540-V543 WeakPolarHBondContact O-CB 3.43Å; G540-V543 PolarHBondContact O-N 3.46Å; G540-L544 PolarHBondContact O-N 3.07Å
541	I	90.9	Very high	92.3	Very high	70 Å²	70	38.3 Å²	38.3	36%	0.359	21%	0.211	S	C	.	.	H	α-helix	trans	-57.8	-40.2	-171.9	-169.6	61	0	0	0	113.1	V543 L544 E545	I541-V543 VanDerWaalsContact C-N 3.26Å; I541-V543 PolarHBondContact O-N 2.97Å; I541-L544 PolarHBondContact O-N 3.13Å; I541-L544 VanDerWaalsContact O-N 3.16Å; I541-E545 HydrophobicContact CD1-CG 4.44Å; I541-E545 HydrophobicContact CG1-CG 4.36Å; I541-E545 WeakPolarHBondContact O-CG 3.28Å; I541-E545 PolarHBondContact O-N 3.49Å
542	H	90.2	Very high	92.5	Very high	97 Å²	97	36.4 Å²	36.4	45%	0.449	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-31.8	177.9	62.4	-72	0	0	0	112.6	R505 C539 G540 G546	R505-H542 PolarHBondContact O-NE2 3.06Å; C539-H542 PolarHBondContact O-CE1 2.66Å; C539-H542 VanDerWaalsContact O-CE1 3.27Å; C539-H542 PolarHBondContact O-ND1 3.38Å; G540-H542 VanDerWaalsContact C-N 3.31Å; G540-H542 PolarHBondContact O-N 2.64Å; H542-G546 PolarHBondContact O-N 3.26Å; H542-G546 VanDerWaalsContact O-N 3.14Å
543	V	91.4	Very high	92.6	Very high	9 Å²	9	37.7 Å²	37.7	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-72.8	-40.8	176.2	-174.3	0	0	0	0	110.7	R505 V510 G540 I541 G546 C547 L550	R505-V543 VanDerWaalsContact O-CG2 3.28Å; R505-V543 WeakPolarHBondContact O-CG2 3.22Å; V510-V543 HydrophobicContact CB-CG1 4.33Å; V510-V543 HydrophobicContact CG2-CB 3.9Å; V510-V543 HydrophobicContact CG2-CG1 3.83Å; V510-V543 HydrophobicContact CG2-CG2 4.17Å; G540-V543 WeakPolarHBondContact O-CB 3.43Å; G540-V543 PolarHBondContact O-N 3.46Å; I541-V543 VanDerWaalsContact C-N 3.26Å; I541-V543 PolarHBondContact O-N 2.97Å; V543-G546 PolarHBondContact O-N 2.92Å; V543-C547 PolarHBondContact O-N 3.44Å; V543-C547 VanDerWaalsContact O-N 3.16Å; V543-L550 HydrophobicContact CG1-CD1 3.94Å
544	L	93.4	Very high	92.8	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-67	-45.7	178.4	-61.5	179.9	0	0	0	111	V510 V536 F537 G540 I541 G546 C547 L550 R551 A554	V510-L544 HydrophobicContact CG1-CD2 3.76Å; V536-L544 HydrophobicContact CG1-CD1 4.14Å; F537-L544 HydrophobicContact CD1-CD1 4.18Å; F537-L544 HydrophobicContact CE1-CD1 4.29Å; G540-L544 PolarHBondContact O-N 3.07Å; I541-L544 PolarHBondContact O-N 3.13Å; I541-L544 VanDerWaalsContact O-N 3.16Å; L544-G546 PolarHBondContact O-N 3.44Å; L544-C547 CarbonylContact O-C 3.58Å; L544-C547 PolarHBondContact O-N 2.9Å; L544-C547 VanDerWaalsContact O-N 3.16Å; L544-C547 VanDerWaalsContact O-O 3.12Å; L544-L550 HydrophobicContact CD2-CB 4.09Å; L544-R551 HydrophobicContact CB-CB 4.41Å; L544-A554 HydrophobicContact CD1-CB 4.09Å; L544-A554 HydrophobicContact CD2-CB 3.82Å
545	E	91.3	Very high	92.9	Very high	141 Å²	141	34.5 Å²	34.5	66%	0.659	19%	0.188	S	C	*	.	H	α-helix	trans	-61.2	-35	175.7	-72.1	-179.9	168.4	0	0	112	I541	I541-E545 HydrophobicContact CD1-CG 4.44Å; I541-E545 HydrophobicContact CG1-CG 4.36Å; I541-E545 WeakPolarHBondContact O-CG 3.28Å; I541-E545 PolarHBondContact O-N 3.49Å
546	G	89.6	Confident	93.2	Very high	22 Å²	22	34.7 Å²	34.7	23%	0.227	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.5	177.3	0	0	0	0	0	115.6	S303 H542 V543 L544	S303-G546 WeakPolarHBondContact CA-O 3.41Å; H542-G546 PolarHBondContact O-N 3.26Å; H542-G546 VanDerWaalsContact O-N 3.14Å; V543-G546 PolarHBondContact O-N 2.92Å; L544-G546 PolarHBondContact O-N 3.44Å
547	C	92.7	Very high	93.3	Very high	10 Å²	10	34.9 Å²	34.9	7%	0.068	19%	0.189	C	C	.	.			trans	-147.5	104.1	-178.2	-173.4	0	0	0	0	112.1	S303 V543 L544 C549 L550 R551	S303-C547 WeakPolarHBondContact O-CA 3.45Å; V543-C547 PolarHBondContact O-N 3.44Å; V543-C547 VanDerWaalsContact O-N 3.16Å; L544-C547 CarbonylContact O-C 3.58Å; L544-C547 PolarHBondContact O-N 2.9Å; L544-C547 VanDerWaalsContact O-N 3.16Å; L544-C547 VanDerWaalsContact O-O 3.12Å; C547-C549 VanDerWaalsContact C-N 3.3Å; C547-C549 PolarHBondContact O-N 3.1Å; C547-L550 HydrophobicContact CB-CB 4.12Å; C547-L550 HydrophobicContact CB-CD1 4.08Å; C547-L550 HydrophobicContact CB-CG 4.24Å; C547-L550 PolarHBondContact O-N 3.06Å; C547-L550 VanDerWaalsContact O-N 3.13Å; C547-R551 PolarHBondContact O-N 3.37Å
548	C	92.6	Very high	93.5	Very high	13 Å²	13	35.1 Å²	35.1	9%	0.088	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-34.3	-175.7	62.5	0	0	0	0	113.3	S303 G304 R551 A552	S303-C548 PolarHBondContact O-N 3.16Å; S303-C548 PolarHBondContact O-SG 3.33Å; S303-C548 VanDerWaalsContact O-SG 3.36Å; G304-C548 PolarHBondContact O-SG 3.12Å; C548-R551 PolarHBondContact O-N 3.43Å; C548-A552 WeakPolarHBondContact O-CB 3.36Å; C548-A552 PolarHBondContact O-N 3.37Å
549	C	92.8	Very high	93.7	Very high	28 Å²	28	31.4 Å²	31.4	19%	0.189	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-45.7	174.5	-69.7	0	0	0	0	112.2	G304 C547 A553	G304-C549 PolarHBondContact O-SG 3.45Å; C547-C549 VanDerWaalsContact C-N 3.3Å; C547-C549 PolarHBondContact O-N 3.1Å; C549-A553 WeakPolarHBondContact O-CB 3.13Å; C549-A553 PolarHBondContact O-N 3.02Å
550	L	94.6	Very high	94	Very high	18 Å²	18	31.8 Å²	31.8	9%	0.094	16%	0.162	C	C	.	.	H	α-helix	trans	-71.1	-37	179.3	-71.2	177.6	0	0	0	111.4	V510 L511 V543 L544 C547 A553 A554	V510-L550 HydrophobicContact CG1-CD1 4.39Å; V510-L550 HydrophobicContact CG1-CD2 4.47Å; L511-L550 HydrophobicContact CB-CD2 4.36Å; L511-L550 HydrophobicContact CD1-CD2 4.49Å; V543-L550 HydrophobicContact CG1-CD1 3.94Å; L544-L550 HydrophobicContact CD2-CB 4.09Å; C547-L550 HydrophobicContact CB-CB 4.12Å; C547-L550 HydrophobicContact CB-CD1 4.08Å; C547-L550 HydrophobicContact CB-CG 4.24Å; C547-L550 PolarHBondContact O-N 3.06Å; C547-L550 VanDerWaalsContact O-N 3.13Å; L550-A553 PolarHBondContact O-N 3.41Å; L550-A554 VanDerWaalsContact O-CB 3.32Å; L550-A554 WeakPolarHBondContact O-CB 3.13Å; L550-A554 PolarHBondContact O-N 3.28Å
551	R	95.8	Very high	94.3	Very high	81 Å²	81	32.3 Å²	32.3	31%	0.306	16%	0.164	S	C	.	.	H	α-helix	trans	-59.3	-51.6	172.5	-173.6	174	61.4	-176	-3.7	111.6	L544 C547 C548 A553 A554 D555 L581	L544-R551 HydrophobicContact CB-CB 4.41Å; C547-R551 PolarHBondContact O-N 3.37Å; C548-R551 PolarHBondContact O-N 3.43Å; R551-A553 VanDerWaalsContact C-N 3.29Å; R551-A553 PolarHBondContact O-N 3.04Å; R551-A554 WeakPolarHBondContact O-CB 3.04Å; R551-A554 PolarHBondContact O-N 3.33Å; R551-A554 VanDerWaalsContact O-N 3.1Å; R551-D555 PolarHBondContact O-N 3.44Å; R551-L581 HydrophobicContact CB-CD1 4.41Å; R551-L581 HydrophobicContact CG-CD1 3.87Å
552	A	95.6	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-40.4	178.1	0	0	0	0	0	111.7	C548 Y556 L581 L587 L590	C548-A552 WeakPolarHBondContact O-CB 3.36Å; C548-A552 PolarHBondContact O-N 3.37Å; A552-Y556 WeakPolarHBondContact O-CB 3.44Å; A552-Y556 PolarHBondContact O-N 3.18Å; A552-L581 HydrophobicContact CB-CB 3.75Å; A552-L581 HydrophobicContact CB-CD1 4Å; A552-L587 HydrophobicContact CB-CD1 4.06Å; A552-L590 HydrophobicContact CB-CD2 3.42Å; A552-L590 VanDerWaalsContact CB-CD2 3.42Å
553	A	96	Very high	94.8	Very high	28 Å²	28	25.6 Å²	25.6	23%	0.231	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-40.3	174.8	0	0	0	0	0	112.2	L514 C549 L550 R551 Y556 V557	L514-A553 HydrophobicContact CD1-CB 3.99Å; C549-A553 WeakPolarHBondContact O-CB 3.13Å; C549-A553 PolarHBondContact O-N 3.02Å; L550-A553 PolarHBondContact O-N 3.41Å; R551-A553 VanDerWaalsContact C-N 3.29Å; R551-A553 PolarHBondContact O-N 3.04Å; A553-Y556 WeakPolarHBondContact O-CB 3.41Å; A553-Y556 PolarHBondContact O-N 3.4Å; A553-V557 VanDerWaalsContact O-CG2 3.31Å; A553-V557 WeakPolarHBondContact O-CG2 3.36Å; A553-V557 PolarHBondContact O-N 3.22Å
554	A	97.1	Very high	94.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.4	-44.7	177.4	0	0	0	0	0	111.9	L514 F537 L544 L550 R551 Y556 V557 K558	L514-A554 HydrophobicContact CD1-CB 4.13Å; L514-A554 HydrophobicContact CD2-CB 3.92Å; F537-A554 HydrophobicContact CE1-CB 4.42Å; F537-A554 HydrophobicContact CE2-CB 4.18Å; F537-A554 HydrophobicContact CZ-CB 3.77Å; L544-A554 HydrophobicContact CD1-CB 4.09Å; L544-A554 HydrophobicContact CD2-CB 3.82Å; L550-A554 VanDerWaalsContact O-CB 3.32Å; L550-A554 WeakPolarHBondContact O-CB 3.13Å; L550-A554 PolarHBondContact O-N 3.28Å; R551-A554 WeakPolarHBondContact O-CB 3.04Å; R551-A554 PolarHBondContact O-N 3.33Å; R551-A554 VanDerWaalsContact O-N 3.1Å; A554-Y556 VanDerWaalsContact C-N 3.31Å; A554-Y556 PolarHBondContact O-N 2.97Å; A554-V557 PolarHBondContact O-N 3.43Å; A554-K558 WeakPolarHBondContact O-CB 3.48Å; A554-K558 PolarHBondContact O-N 3.31Å
555	D	97.1	Very high	94.9	Very high	17 Å²	17	33.8 Å²	33.8	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-41	174.1	-70.3	-40.2	0	0	0	111.2	R551 K558 A559 L581	R551-D555 PolarHBondContact O-N 3.44Å; D555-K558 PolarHBondContact O-N 2.65Å; D555-A559 WeakPolarHBondContact O-CB 3.36Å; D555-A559 PolarHBondContact O-N 3.08Å; D555-L581 WeakPolarHBondContact OD2-CD1 3.44Å
556	Y	97.6	Very high	95	Very high	29 Å²	29	32.7 Å²	32.7	11%	0.114	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-45	175.9	178.7	-102.2	0	0	0	112.8	A552 A553 A554 K558 A559 F560 L575 T578 L590 A594	A552-Y556 WeakPolarHBondContact O-CB 3.44Å; A552-Y556 PolarHBondContact O-N 3.18Å; A553-Y556 WeakPolarHBondContact O-CB 3.41Å; A553-Y556 PolarHBondContact O-N 3.4Å; A554-Y556 VanDerWaalsContact C-N 3.31Å; A554-Y556 PolarHBondContact O-N 2.97Å; Y556-K558 VanDerWaalsContact C-N 3.33Å; Y556-K558 PolarHBondContact O-N 2.95Å; Y556-A559 WeakPolarHBondContact O-CB 3.49Å; Y556-A559 PolarHBondContact O-N 3.09Å; Y556-F560 WeakPolarHBondContact O-CB 3.35Å; Y556-F560 PolarHBondContact O-N 3.49Å; Y556-L575 HydrophobicContact CD2-CD2 4.14Å; Y556-L575 HydrophobicContact CE2-CD2 4.31Å; Y556-T578 WeakPolarHBondContact CA-OG1 3.28Å; Y556-T578 HydrophobicContact CD2-CG2 4.16Å; Y556-T578 HydrophobicContact CG-CG2 4.42Å; Y556-T578 PolarHBondContact N-OG1 3.39Å; Y556-T578 VanDerWaalsContact N-OG1 3.17Å; Y556-L590 HydrophobicContact CD1-CD1 4.01Å; Y556-L590 HydrophobicContact CD2-CD1 4.13Å; Y556-L590 HydrophobicContact CG-CD1 3.68Å; Y556-A594 HydrophobicContact CD2-CB 4.44Å
557	V	97.3	Very high	95.2	Very high	4 Å²	4	36 Å²	36	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-38.7	178.8	177	0	0	0	0	110.7	L514 A517 L518 L533 A553 A554 F560 Q561	L514-V557 HydrophobicContact CB-CG2 4.32Å; L514-V557 HydrophobicContact CD2-CB 4.28Å; L514-V557 HydrophobicContact CD2-CG2 4.31Å; A517-V557 HydrophobicContact CB-CG1 3.84Å; L518-V557 HydrophobicContact CD1-CG2 4.23Å; L518-V557 HydrophobicContact CD2-CG1 4.23Å; L518-V557 HydrophobicContact CD2-CG2 4.04Å; L518-V557 HydrophobicContact CG-CG1 4.36Å; L518-V557 HydrophobicContact CG-CG2 3.98Å; L533-V557 HydrophobicContact CD1-CG1 4.17Å; L533-V557 HydrophobicContact CD2-CB 4.47Å; L533-V557 HydrophobicContact CD2-CG1 3.82Å; A553-V557 VanDerWaalsContact O-CG2 3.31Å; A553-V557 WeakPolarHBondContact O-CG2 3.36Å; A553-V557 PolarHBondContact O-N 3.22Å; A554-V557 PolarHBondContact O-N 3.43Å; V557-F560 PolarHBondContact O-N 3.17Å; V557-Q561 PolarHBondContact O-N 3.01Å
558	K	96.9	Very high	95.3	Very high	51 Å²	51	36.8 Å²	36.8	22%	0.222	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-39	175.4	-167.6	162.5	-176	171.9	0	112.5	F537 A554 D555 Y556 F560 Q561 A562 F574	F537-K558 HydrophobicContact CD2-CD 4.13Å; F537-K558 HydrophobicContact CE1-CD 4.42Å; F537-K558 HydrophobicContact CE2-CB 4.11Å; F537-K558 HydrophobicContact CE2-CD 3.58Å; F537-K558 HydrophobicContact CE2-CG 4.43Å; F537-K558 HydrophobicContact CZ-CB 4.24Å; F537-K558 HydrophobicContact CZ-CD 3.74Å; A554-K558 WeakPolarHBondContact O-CB 3.48Å; A554-K558 PolarHBondContact O-N 3.31Å; D555-K558 PolarHBondContact O-N 2.65Å; Y556-K558 VanDerWaalsContact C-N 3.33Å; Y556-K558 PolarHBondContact O-N 2.95Å; K558-F560 VanDerWaalsContact C-N 3.32Å; K558-Q561 PolarHBondContact O-N 3.01Å; K558-A562 WeakPolarHBondContact O-CB 3.48Å; K558-A562 PolarHBondContact O-N 3.33Å; K558-F574 HydrophobicContact CB-CD1 4.48Å; K558-F574 HydrophobicContact CB-CG 4.45Å; K558-F574 HydrophobicContact CD-CD1 4.31Å; K558-F574 HydrophobicContact CD-CE1 3.74Å; K558-F574 HydrophobicContact CD-CE2 4.01Å; K558-F574 HydrophobicContact CD-CZ 3.59Å; K558-F574 VanDerWaalsContact CE-CZ 3.47Å; K558-F574 HydrophobicContact CG-CD1 4.4Å; K558-F574 HydrophobicContact CG-CD2 4.07Å; K558-F574 HydrophobicContact CG-CE1 4.23Å; K558-F574 HydrophobicContact CG-CE2 3.89Å; K558-F574 HydrophobicContact CG-CG 4.35Å; K558-F574 HydrophobicContact CG-CZ 3.99Å
559	A	97.3	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.3	-45.9	168.2	0	0	0	0	0	111.8	D555 Y556 A562 F563 F574 L575	D555-A559 WeakPolarHBondContact O-CB 3.36Å; D555-A559 PolarHBondContact O-N 3.08Å; Y556-A559 WeakPolarHBondContact O-CB 3.49Å; Y556-A559 PolarHBondContact O-N 3.09Å; A559-A562 PolarHBondContact O-N 3.29Å; A559-F563 WeakPolarHBondContact O-CB 3.32Å; A559-F563 PolarHBondContact O-N 3.25Å; A559-F574 HydrophobicContact CB-CB 3.59Å; A559-L575 HydrophobicContact CB-CD2 3.71Å; A559-L575 HydrophobicContact CB-CG 3.6Å
560	F	95.5	Very high	95.5	Very high	46 Å²	46	42.7 Å²	42.7	20%	0.202	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-37.2	-177.7	-161.5	-107.8	0	0	0	112.3	L518 I521 Y556 V557 K558 F563 Y564 T597 W633	L518-F560 HydrophobicContact CD2-CD1 3.98Å; I521-F560 HydrophobicContact CD1-CD1 3.88Å; I521-F560 HydrophobicContact CG2-CD1 3.91Å; I521-F560 HydrophobicContact CG2-CE1 3.76Å; Y556-F560 WeakPolarHBondContact O-CB 3.35Å; Y556-F560 PolarHBondContact O-N 3.49Å; V557-F560 PolarHBondContact O-N 3.17Å; K558-F560 VanDerWaalsContact C-N 3.32Å; F560-F563 HydrophobicContact CD2-CD1 4.35Å; F560-F563 HydrophobicContact CE2-CD1 4.28Å; F560-F563 PolarHBondContact O-N 3.5Å; F560-Y564 WeakPolarHBondContact O-CB 3.45Å; F560-Y564 PolarHBondContact O-N 3.36Å; F560-T597 HydrophobicContact CD2-CG2 4.39Å; F560-W633 HydrophobicContact CE2-CH2 4.48Å
561	Q	95.9	Very high	95.7	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-53.6	169.9	-176.5	-158	-4	0	0	110.9	I521 L533 V557 K558 F563 Y564 E565	I521-Q561 HydrophobicContact CD1-CB 4Å; L533-Q561 HydrophobicContact CD1-CB 4.12Å; L533-Q561 HydrophobicContact CD1-CG 4.39Å; V557-Q561 PolarHBondContact O-N 3.01Å; K558-Q561 PolarHBondContact O-N 3.01Å; Q561-F563 PolarHBondContact O-N 3.16Å; Q561-Y564 PolarHBondContact O-N 3.32Å; Q561-Y564 VanDerWaalsContact O-N 3.1Å; Q561-E565 WeakPolarHBondContact CG-OE1 3.48Å; Q561-E565 PolarHBondContact NE2-OE1 3.41Å; Q561-E565 WeakPolarHBondContact O-CG 3.39Å; Q561-E565 PolarHBondContact O-N 3.46Å
562	A	95.8	Very high	95.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-36.8	179.9	0	0	0	0	0	112	K558 A559 E565 N566 R567 D570 A571	K558-A562 WeakPolarHBondContact O-CB 3.48Å; K558-A562 PolarHBondContact O-N 3.33Å; A559-A562 PolarHBondContact O-N 3.29Å; A562-E565 CarbonylContact O-C 3.1Å; A562-E565 PolarHBondContact O-N 3.1Å; A562-N566 PolarHBondContact O-N 2.63Å; A562-R567 HydrophobicContact CB-CB 4.23Å; A562-R567 WeakPolarHBondContact O-CA 3.44Å; A562-R567 PolarHBondContact O-N 2.95Å; A562-D570 HydrophobicContact CB-CB 4.1Å; A562-A571 HydrophobicContact CB-CB 4.01Å
563	F	95.5	Very high	95.8	Very high	26 Å²	26	44.1 Å²	44.1	11%	0.114	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-47.3	173.6	172.7	-116.3	0	0	0	111.9	A559 F560 Q561 E565 N566 L568 A571 T597 Q600 I601	A559-F563 WeakPolarHBondContact O-CB 3.32Å; A559-F563 PolarHBondContact O-N 3.25Å; F560-F563 HydrophobicContact CD2-CD1 4.35Å; F560-F563 HydrophobicContact CE2-CD1 4.28Å; F560-F563 PolarHBondContact O-N 3.5Å; Q561-F563 PolarHBondContact O-N 3.16Å; F563-E565 VanDerWaalsContact C-N 3.32Å; F563-E565 PolarHBondContact O-N 3.49Å; F563-N566 PolarHBondContact O-N 3.21Å; F563-N566 VanDerWaalsContact O-N 3.08Å; F563-L568 HydrophobicContact CD2-CD2 4.13Å; F563-A571 HydrophobicContact CB-CB 4.03Å; F563-T597 HydrophobicContact CB-CG2 4.49Å; F563-T597 HydrophobicContact CD1-CG2 4.23Å; F563-T597 HydrophobicContact CG-CG2 4.22Å; F563-Q600 HydrophobicContact CE2-CG 4.43Å; F563-Q600 HydrophobicContact CZ-CB 4.34Å; F563-Q600 HydrophobicContact CZ-CG 3.77Å; F563-I601 HydrophobicContact CD2-CD1 4.01Å; F563-I601 HydrophobicContact CD2-CG1 3.4Å; F563-I601 HydrophobicContact CE2-CG1 3.62Å; F563-I601 HydrophobicContact CG-CG1 4.38Å
564	Y	92	Very high	95.9	Very high	127 Å²	127	45.3 Å²	45.3	50%	0.498	22%	0.217	S	C	.	.	H	α-helix	trans	-64.5	-35	178.2	-170.2	-94.2	0	0	0	112.6	I521 T526 F560 Q561 N566	I521-Y564 HydrophobicContact CG2-CD1 4.34Å; I521-Y564 HydrophobicContact CG2-CD2 3.87Å; I521-Y564 HydrophobicContact CG2-CE2 4.47Å; I521-Y564 HydrophobicContact CG2-CG 3.8Å; T526-Y564 HydrophobicContact CG2-CD1 4.24Å; T526-Y564 HydrophobicContact CG2-CE1 4.21Å; F560-Y564 WeakPolarHBondContact O-CB 3.45Å; F560-Y564 PolarHBondContact O-N 3.36Å; Q561-Y564 PolarHBondContact O-N 3.32Å; Q561-Y564 VanDerWaalsContact O-N 3.1Å; Y564-N566 PolarHBondContact O-N 3.04Å
565	E	93.3	Very high	95.9	Very high	58 Å²	58	45.3 Å²	45.3	27%	0.271	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	6.7	174.2	-68.2	171.2	-173.7	0	0	113.8	T526 Q561 A562 F563 R567	T526-E565 HydrophobicContact CG2-CG 4.46Å; Q561-E565 WeakPolarHBondContact CG-OE1 3.48Å; Q561-E565 PolarHBondContact NE2-OE1 3.41Å; Q561-E565 WeakPolarHBondContact O-CG 3.39Å; Q561-E565 PolarHBondContact O-N 3.46Å; A562-E565 CarbonylContact O-C 3.1Å; A562-E565 PolarHBondContact O-N 3.1Å; F563-E565 VanDerWaalsContact C-N 3.32Å; F563-E565 PolarHBondContact O-N 3.49Å; E565-R567 HydrophobicContact CB-CG 4.48Å; E565-R567 PolarHBondContact O-N 2.93Å; E565-R567 IonicContact OE2-CZ 2.98Å; E565-R567 VanDerWaalsContact OE2-CZ 3.24Å; E565-R567 IonicContact OE2-NE 2.96Å; E565-R567 PolarHBondContact OE2-NE 3.3Å; E565-R567 IonicContact OE2-NH2 2.69Å; E565-R567 PolarHBondContact OE2-NH2 3.03Å
566	N	93.6	Very high	95.9	Very high	119 Å²	119	52 Å²	52	64%	0.636	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	20.8	-178.7	-162.1	47.1	0	0	0	114.9	A562 F563 Y564 L568	A562-N566 PolarHBondContact O-N 2.63Å; F563-N566 PolarHBondContact O-N 3.21Å; F563-N566 VanDerWaalsContact O-N 3.08Å; Y564-N566 PolarHBondContact O-N 3.04Å; N566-L568 VanDerWaalsContact C-N 3.3Å; N566-L568 PolarHBondContact O-N 3.23Å; N566-L568 VanDerWaalsContact O-N 3.13Å
567	R	94.7	Very high	95.8	Very high	90 Å²	90	53.5 Å²	53.5	34%	0.34	25%	0.248	S	C	.	.			trans	-85.6	68.8	170.9	-64.8	-173	-67.1	117.6	-5.5	110.2	A562 E565 T569 D570 A571	A562-R567 HydrophobicContact CB-CB 4.23Å; A562-R567 WeakPolarHBondContact O-CA 3.44Å; A562-R567 PolarHBondContact O-N 2.95Å; E565-R567 HydrophobicContact CB-CG 4.48Å; E565-R567 PolarHBondContact O-N 2.93Å; E565-R567 IonicContact OE2-CZ 2.98Å; E565-R567 VanDerWaalsContact OE2-CZ 3.24Å; E565-R567 IonicContact OE2-NE 2.96Å; E565-R567 PolarHBondContact OE2-NE 3.3Å; E565-R567 IonicContact OE2-NH2 2.69Å; E565-R567 PolarHBondContact OE2-NH2 3.03Å; R567-T569 VanDerWaalsContact C-N 3.34Å; R567-T569 PolarHBondContact O-N 3.45Å; R567-D570 HydrophobicContact CB-CB 4.34Å; R567-D570 IonicContact CZ-OD2 2.63Å; R567-D570 IonicContact NH1-OD2 2.78Å; R567-D570 PolarHBondContact NH1-OD2 3.28Å; R567-D570 PolarHBondContact O-N 3.22Å; R567-A571 PolarHBondContact O-N 3.35Å
568	L	94.9	Very high	95.7	Very high	28 Å²	28	53.3 Å²	53.3	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-34.8	-168.7	-54.8	-174.8	0	0	0	114.1	F563 N566 A571 K572 I601 E605	F563-L568 HydrophobicContact CD2-CD2 4.13Å; N566-L568 VanDerWaalsContact C-N 3.3Å; N566-L568 PolarHBondContact O-N 3.23Å; N566-L568 VanDerWaalsContact O-N 3.13Å; L568-A571 PolarHBondContact O-N 3.21Å; L568-K572 WeakPolarHBondContact O-CG 3.35Å; L568-K572 PolarHBondContact O-N 2.71Å; L568-I601 HydrophobicContact CB-CG2 4.05Å; L568-I601 HydrophobicContact CD1-CG2 4.31Å; L568-I601 HydrophobicContact CD2-CG1 4.45Å; L568-I601 HydrophobicContact CD2-CG2 4.2Å; L568-I601 HydrophobicContact CG-CG2 4.41Å; L568-E605 HydrophobicContact CD1-CG 4.06Å
569	T	94.8	Very high	95.6	Very high	105 Å²	105	51.7 Å²	51.7	64%	0.644	24%	0.242	S	C	*	.	H	α-helix	trans	-63	-48.3	177.1	-54.2	0	0	0	0	111.1	R567 K572 L573	R567-T569 VanDerWaalsContact C-N 3.34Å; R567-T569 PolarHBondContact O-N 3.45Å; T569-K572 PolarHBondContact O-N 2.63Å; T569-L573 WeakPolarHBondContact O-CG 3.41Å; T569-L573 PolarHBondContact O-N 3.4Å; T569-L573 VanDerWaalsContact O-N 3.15Å
570	D	95.6	Very high	95.5	Very high	59 Å²	59	56.4 Å²	56.4	32%	0.316	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-43.3	178.7	-62.1	-15.4	0	0	0	110.7	A562 R567 K572 L573 F574	A562-D570 HydrophobicContact CB-CB 4.1Å; R567-D570 HydrophobicContact CB-CB 4.34Å; R567-D570 IonicContact CZ-OD2 2.63Å; R567-D570 IonicContact NH1-OD2 2.78Å; R567-D570 PolarHBondContact NH1-OD2 3.28Å; R567-D570 PolarHBondContact O-N 3.22Å; D570-K572 VanDerWaalsContact C-N 3.32Å; D570-K572 PolarHBondContact O-N 3.36Å; D570-L573 WeakPolarHBondContact O-CB 3.45Å; D570-L573 PolarHBondContact O-N 3.02Å; D570-L573 VanDerWaalsContact O-N 3.11Å; D570-F574 WeakPolarHBondContact O-CD2 3.38Å; D570-F574 PolarHBondContact O-N 2.97Å; D570-F574 VanDerWaalsContact O-N 3.09Å
571	A	97	Very high	95.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-55.6	-47.4	176.7	0	0	0	0	0	111.6	A562 F563 R567 L568 L573 F574 L575 I601	A562-A571 HydrophobicContact CB-CB 4.01Å; F563-A571 HydrophobicContact CB-CB 4.03Å; R567-A571 PolarHBondContact O-N 3.35Å; L568-A571 PolarHBondContact O-N 3.21Å; A571-L573 VanDerWaalsContact C-N 3.34Å; A571-L573 PolarHBondContact O-N 3.13Å; A571-F574 PolarHBondContact O-N 2.88Å; A571-L575 WeakPolarHBondContact O-CB 3.49Å; A571-L575 WeakPolarHBondContact O-CD1 3.46Å; A571-L575 WeakPolarHBondContact O-CG 3.5Å; A571-L575 PolarHBondContact O-N 3.24Å; A571-I601 HydrophobicContact CB-CD1 3.81Å
572	K	96.8	Very high	95.2	Very high	33 Å²	33	53.9 Å²	53.9	14%	0.143	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-38.1	176.6	-77.2	173.6	171.5	169.5	0	113.2	L568 T569 D570 R576 I601 E605	L568-K572 WeakPolarHBondContact O-CG 3.35Å; L568-K572 PolarHBondContact O-N 2.71Å; T569-K572 PolarHBondContact O-N 2.63Å; D570-K572 VanDerWaalsContact C-N 3.32Å; D570-K572 PolarHBondContact O-N 3.36Å; K572-R576 VanDerWaalsContact O-CG 3.29Å; K572-R576 WeakPolarHBondContact O-CG 3.44Å; K572-R576 PolarHBondContact O-N 3.5Å; K572-I601 HydrophobicContact CD-CG2 4.32Å; K572-I601 VanDerWaalsContact CE-CG2 3.48Å; K572-I601 HydrophobicContact CG-CD1 4.27Å; K572-I601 HydrophobicContact CG-CG2 4.23Å; K572-E605 IonicContact NZ-OE1 3.66Å; K572-E605 PolarHBondContact NZ-OE1 3.09Å; K572-E605 IonicContact NZ-OE2 3.85Å; K572-E605 PolarHBondContact NZ-OE2 3.33Å
573	L	97.3	Very high	94.9	Very high	97 Å²	97	58.4 Å²	58.4	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-50.8	178	-69.8	173	0	0	0	110.8	T569 D570 A571 L575 R576 E577	T569-L573 WeakPolarHBondContact O-CG 3.41Å; T569-L573 PolarHBondContact O-N 3.4Å; T569-L573 VanDerWaalsContact O-N 3.15Å; D570-L573 WeakPolarHBondContact O-CB 3.45Å; D570-L573 PolarHBondContact O-N 3.02Å; D570-L573 VanDerWaalsContact O-N 3.11Å; A571-L573 VanDerWaalsContact C-N 3.34Å; A571-L573 PolarHBondContact O-N 3.13Å; L573-L575 PolarHBondContact O-N 3.33Å; L573-R576 PolarHBondContact O-N 2.91Å; L573-E577 PolarHBondContact O-N 2.97Å
574	F	97.5	Very high	94.6	Very high	53 Å²	53	61.6 Å²	61.6	23%	0.232	29%	0.288	C	S	.	.	H	α-helix	trans	-67.2	-33.5	178.7	-72.7	-65.8	0	0	0	113.1	K558 A559 D570 A571 E577 T578	K558-F574 HydrophobicContact CB-CD1 4.48Å; K558-F574 HydrophobicContact CB-CG 4.45Å; K558-F574 HydrophobicContact CD-CD1 4.31Å; K558-F574 HydrophobicContact CD-CE1 3.74Å; K558-F574 HydrophobicContact CD-CE2 4.01Å; K558-F574 HydrophobicContact CD-CZ 3.59Å; K558-F574 VanDerWaalsContact CE-CZ 3.47Å; K558-F574 HydrophobicContact CG-CD1 4.4Å; K558-F574 HydrophobicContact CG-CD2 4.07Å; K558-F574 HydrophobicContact CG-CE1 4.23Å; K558-F574 HydrophobicContact CG-CE2 3.89Å; K558-F574 HydrophobicContact CG-CG 4.35Å; K558-F574 HydrophobicContact CG-CZ 3.99Å; A559-F574 HydrophobicContact CB-CB 3.59Å; D570-F574 WeakPolarHBondContact O-CD2 3.38Å; D570-F574 PolarHBondContact O-N 2.97Å; D570-F574 VanDerWaalsContact O-N 3.09Å; A571-F574 PolarHBondContact O-N 2.88Å; F574-E577 PolarHBondContact O-N 3.1Å; F574-T578 WeakPolarHBondContact O-CB 3.32Å; F574-T578 PolarHBondContact O-N 3.47Å; F574-T578 PolarHBondContact O-OG1 2.88Å
575	L	97.7	Very high	94.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.9	-38.6	174.9	-71	165.9	0	0	0	112.3	Y556 A559 A571 L573 E577 T578 V579 A594 T597 M598 I601	Y556-L575 HydrophobicContact CD2-CD2 4.14Å; Y556-L575 HydrophobicContact CE2-CD2 4.31Å; A559-L575 HydrophobicContact CB-CD2 3.71Å; A559-L575 HydrophobicContact CB-CG 3.6Å; A571-L575 WeakPolarHBondContact O-CB 3.49Å; A571-L575 WeakPolarHBondContact O-CD1 3.46Å; A571-L575 WeakPolarHBondContact O-CG 3.5Å; A571-L575 PolarHBondContact O-N 3.24Å; L573-L575 PolarHBondContact O-N 3.33Å; L575-E577 VanDerWaalsContact C-N 3.32Å; L575-T578 WeakPolarHBondContact O-CB 3.37Å; L575-T578 PolarHBondContact O-N 3.48Å; L575-V579 WeakPolarHBondContact O-CG2 3.14Å; L575-V579 PolarHBondContact O-N 2.95Å; L575-A594 HydrophobicContact CD2-CB 3.97Å; L575-T597 HydrophobicContact CD1-CG2 3.73Å; L575-T597 HydrophobicContact CD2-CG2 4.13Å; L575-M598 HydrophobicContact CB-CG 3.64Å; L575-M598 HydrophobicContact CB-SD 3.96Å; L575-M598 HydrophobicContact CD1-CB 4.44Å; L575-M598 HydrophobicContact CD1-CG 3.51Å; L575-M598 HydrophobicContact CG-CG 4.1Å; L575-I601 HydrophobicContact CD1-CD1 3.53Å
576	R	96.2	Very high	94.1	Very high	157 Å²	157	57.4 Å²	57.4	59%	0.592	27%	0.273	S	S	*	.	H	α-helix	trans	-63.2	-41.6	174.4	-75	171.8	-179.5	166.9	0.5	111.3	K572 L573 V579 R580	K572-R576 VanDerWaalsContact O-CG 3.29Å; K572-R576 WeakPolarHBondContact O-CG 3.44Å; K572-R576 PolarHBondContact O-N 3.5Å; L573-R576 PolarHBondContact O-N 2.91Å; R576-V579 PolarHBondContact O-N 3.45Å; R576-R580 WeakPolarHBondContact O-CB 2.96Å; R576-R580 PolarHBondContact O-N 3.11Å
577	E	95.7	Very high	93.9	Very high	60 Å²	60	52.5 Å²	52.5	28%	0.28	25%	0.246	S	C	.	.	H	α-helix	trans	-64.6	-43.3	175.2	-176.6	59.8	-169.6	0	0	111.7	L573 F574 L575 V579 R580 L581	L573-E577 PolarHBondContact O-N 2.97Å; F574-E577 PolarHBondContact O-N 3.1Å; L575-E577 VanDerWaalsContact C-N 3.32Å; E577-V579 VanDerWaalsContact C-N 3.31Å; E577-V579 PolarHBondContact O-N 3.44Å; E577-R580 WeakPolarHBondContact O-CB 3.42Å; E577-R580 PolarHBondContact O-N 2.88Å; E577-R580 VanDerWaalsContact O-N 3.15Å; E577-R580 IonicContact OE1-CZ 3.01Å; E577-R580 IonicContact OE1-NE 3.28Å; E577-R580 PolarHBondContact OE1-NE 3.4Å; E577-R580 IonicContact OE1-NH2 2.79Å; E577-R580 PolarHBondContact OE1-NH2 3.08Å; E577-R580 IonicContact OE2-CZ 3.38Å; E577-R580 IonicContact OE2-NE 3.62Å; E577-R580 PolarHBondContact OE2-NE 3.15Å; E577-R580 IonicContact OE2-NH2 3.51Å; E577-L581 HydrophobicContact CG-CD1 4.18Å; E577-L581 WeakPolarHBondContact O-CG 3.07Å; E577-L581 PolarHBondContact O-N 2.89Å
578	T	96.5	Very high	93.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.9	-45.9	173.4	-57.7	0	0	0	0	111.7	Y556 F574 L575 G582 L590 A594	Y556-T578 WeakPolarHBondContact CA-OG1 3.28Å; Y556-T578 HydrophobicContact CD2-CG2 4.16Å; Y556-T578 HydrophobicContact CG-CG2 4.42Å; Y556-T578 PolarHBondContact N-OG1 3.39Å; Y556-T578 VanDerWaalsContact N-OG1 3.17Å; F574-T578 WeakPolarHBondContact O-CB 3.32Å; F574-T578 PolarHBondContact O-N 3.47Å; F574-T578 PolarHBondContact O-OG1 2.88Å; L575-T578 WeakPolarHBondContact O-CB 3.37Å; L575-T578 PolarHBondContact O-N 3.48Å; T578-G582 PolarHBondContact O-N 3.22Å; T578-L590 HydrophobicContact CG2-CD1 4.22Å; T578-L590 HydrophobicContact CG2-CD2 3.87Å; T578-L590 HydrophobicContact CG2-CG 3.63Å; T578-A594 HydrophobicContact CG2-CB 4Å
579	V	94.9	Very high	93.5	Very high	17 Å²	17	54.8 Å²	54.8	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-38.8	178.2	172	0	0	0	0	111.7	L575 R576 E577 G582 N583 A594 F595 M598	L575-V579 WeakPolarHBondContact O-CG2 3.14Å; L575-V579 PolarHBondContact O-N 2.95Å; R576-V579 PolarHBondContact O-N 3.45Å; E577-V579 VanDerWaalsContact C-N 3.31Å; E577-V579 PolarHBondContact O-N 3.44Å; V579-G582 PolarHBondContact O-N 3.45Å; V579-N583 WeakPolarHBondContact O-CB 3.21Å; V579-N583 PolarHBondContact O-N 3.34Å; V579-N583 PolarHBondContact O-ND2 3.27Å; V579-A594 HydrophobicContact CG2-CB 3.6Å; V579-F595 HydrophobicContact CG1-CE1 4.41Å; V579-F595 HydrophobicContact CG1-CZ 4.03Å; V579-F595 HydrophobicContact CG2-CE1 4.46Å; V579-M598 HydrophobicContact CG2-CE 3.75Å
580	R	95.2	Very high	93.4	Very high	100 Å²	100	51.2 Å²	51.2	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-57.9	-53	175.9	-169.8	-168.9	71.3	72.2	1.8	110.2	R576 E577 N583 E584	R576-R580 WeakPolarHBondContact O-CB 2.96Å; R576-R580 PolarHBondContact O-N 3.11Å; E577-R580 WeakPolarHBondContact O-CB 3.42Å; E577-R580 PolarHBondContact O-N 2.88Å; E577-R580 VanDerWaalsContact O-N 3.15Å; E577-R580 IonicContact OE1-CZ 3.01Å; E577-R580 IonicContact OE1-NE 3.28Å; E577-R580 PolarHBondContact OE1-NE 3.4Å; E577-R580 IonicContact OE1-NH2 2.79Å; E577-R580 PolarHBondContact OE1-NH2 3.08Å; E577-R580 IonicContact OE2-CZ 3.38Å; E577-R580 IonicContact OE2-NE 3.62Å; E577-R580 PolarHBondContact OE2-NE 3.15Å; E577-R580 IonicContact OE2-NH2 3.51Å; R580-N583 PolarHBondContact O-N 2.99Å; R580-E584 IonicContact CZ-OE1 3.88Å; R580-E584 VanDerWaalsContact NH1-CD 3.32Å; R580-E584 IonicContact NH1-OE1 2.71Å; R580-E584 PolarHBondContact NH1-OE1 3.49Å; R580-E584 IonicContact NH1-OE2 3.03Å; R580-E584 PolarHBondContact NH1-OE2 3.48Å; R580-E584 WeakPolarHBondContact O-CG 3.41Å; R580-E584 PolarHBondContact O-N 3.21Å
581	L	92.9	Very high	93.2	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-40.2	176.9	-66.8	176.1	0	0	0	112.4	R551 A552 D555 E577 N583 E584 E585	R551-L581 HydrophobicContact CB-CD1 4.41Å; R551-L581 HydrophobicContact CG-CD1 3.87Å; A552-L581 HydrophobicContact CB-CB 3.75Å; A552-L581 HydrophobicContact CB-CD1 4Å; D555-L581 WeakPolarHBondContact OD2-CD1 3.44Å; E577-L581 HydrophobicContact CG-CD1 4.18Å; E577-L581 WeakPolarHBondContact O-CG 3.07Å; E577-L581 PolarHBondContact O-N 2.89Å; L581-N583 VanDerWaalsContact C-N 3.3Å; L581-N583 PolarHBondContact O-N 3.23Å; L581-E584 PolarHBondContact O-N 3.15Å; L581-E585 PolarHBondContact O-N 3.37Å
582	G	90.9	Very high	93.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-32	178	0	0	0	0	0	113.3	T578 V579 E586 L587	T578-G582 PolarHBondContact O-N 3.22Å; V579-G582 PolarHBondContact O-N 3.45Å; G582-E586 CarbonylContact O-C 3.35Å; G582-E586 VanDerWaalsContact O-CA 3.29Å; G582-E586 WeakPolarHBondContact O-CA 3.31Å; G582-E586 PolarHBondContact O-N 2.89Å; G582-L587 PolarHBondContact O-N 3.35Å
583	N	90	Very high	93	Very high	96 Å²	96	47.8 Å²	47.8	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-77.7	-31.2	176.3	-71	-19.6	0	0	0	113	V579 R580 L581 E585	V579-N583 WeakPolarHBondContact O-CB 3.21Å; V579-N583 PolarHBondContact O-N 3.34Å; V579-N583 PolarHBondContact O-ND2 3.27Å; R580-N583 PolarHBondContact O-N 2.99Å; L581-N583 VanDerWaalsContact C-N 3.3Å; L581-N583 PolarHBondContact O-N 3.23Å; N583-E585 VanDerWaalsContact C-N 3.33Å; N583-E585 PolarHBondContact O-N 2.9Å
584	E	88.9	Confident	93	Very high	92 Å²	92	43.1 Å²	43.1	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-59.9	-43.7	176	-74.8	177.4	167.6	0	0	111.5	R580 L581	R580-E584 IonicContact CZ-OE1 3.88Å; R580-E584 VanDerWaalsContact NH1-CD 3.32Å; R580-E584 IonicContact NH1-OE1 2.71Å; R580-E584 PolarHBondContact NH1-OE1 3.49Å; R580-E584 IonicContact NH1-OE2 3.03Å; R580-E584 PolarHBondContact NH1-OE2 3.48Å; R580-E584 WeakPolarHBondContact O-CG 3.41Å; R580-E584 PolarHBondContact O-N 3.21Å; L581-E584 PolarHBondContact O-N 3.15Å
585	E	87.8	Confident	92.9	Very high	21 Å²	21	42.5 Å²	42.5	10%	0.098	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	18	-174.3	-67.5	-65.4	162.4	0	0	114.2	Q305 A306 K307 L581 N583 L587	Q305-E585 VanDerWaalsContact CA-CD 3.47Å; Q305-E585 WeakPolarHBondContact CA-OE2 3.21Å; Q305-E585 HydrophobicContact CG-CG 4.44Å; Q305-E585 WeakPolarHBondContact CG-OE1 3.48Å; A306-E585 PolarHBondContact N-OE2 2.94Å; K307-E585 WeakPolarHBondContact CB-OE2 3.48Å; K307-E585 PolarHBondContact N-OE2 3.38Å; L581-E585 PolarHBondContact O-N 3.37Å; N583-E585 VanDerWaalsContact C-N 3.33Å; N583-E585 PolarHBondContact O-N 2.9Å; E585-L587 VanDerWaalsContact C-N 3.31Å; E585-L587 HydrophobicContact CB-CD2 4.45Å; E585-L587 HydrophobicContact CB-CG 4.33Å; E585-L587 PolarHBondContact O-N 3.44Å
586	E	87.8	Confident	92.9	Very high	77 Å²	77	42.5 Å²	42.5	36%	0.36	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	40.4	176.3	-70.2	171.6	-167.1	0	0	114	K307 G582 H588	K307-E586 HydrophobicContact CD-CG 4.02Å; K307-E586 WeakPolarHBondContact CD-OE1 3.38Å; K307-E586 WeakPolarHBondContact CE-OE1 3.2Å; K307-E586 IonicContact NZ-OE1 2.64Å; K307-E586 PolarHBondContact NZ-OE1 3Å; G582-E586 CarbonylContact O-C 3.35Å; G582-E586 VanDerWaalsContact O-CA 3.29Å; G582-E586 WeakPolarHBondContact O-CA 3.31Å; G582-E586 PolarHBondContact O-N 2.89Å; E586-H588 PolarHBondContact O-CD2 3Å; E586-H588 PolarHBondContact O-N 2.91Å
587	L	89.4	Confident	92.9	Very high	15 Å²	15	35 Å²	35	8%	0.079	16%	0.162	C	C	.	.			trans	-76.2	63.6	175.8	-51.2	-179.7	0	0	0	111.2	A552 G582 E585 R589 L590 S591	A552-L587 HydrophobicContact CB-CD1 4.06Å; G582-L587 PolarHBondContact O-N 3.35Å; E585-L587 VanDerWaalsContact C-N 3.31Å; E585-L587 HydrophobicContact CB-CD2 4.45Å; E585-L587 HydrophobicContact CB-CG 4.33Å; E585-L587 PolarHBondContact O-N 3.44Å; L587-R589 VanDerWaalsContact C-N 3.27Å; L587-R589 PolarHBondContact O-N 3.15Å; L587-R589 VanDerWaalsContact O-N 3.12Å; L587-L590 HydrophobicContact CB-CB 4.22Å; L587-L590 HydrophobicContact CD1-CD2 4.4Å; L587-L590 PolarHBondContact O-N 3.36Å; L587-S591 PolarHBondContact O-N 3.35Å; L587-S591 PolarHBondContact O-OG 3.45Å
588	H	89.5	Confident	92.9	Very high	78 Å²	78	33 Å²	33	36%	0.361	15%	0.153	S	C	.	.	H	α-helix	trans	-52.9	-39.4	-169.9	-65	-51.9	0	0	0	114.3	E586 A592 I621 L625	E586-H588 PolarHBondContact O-CD2 3Å; E586-H588 PolarHBondContact O-N 2.91Å; H588-A592 VanDerWaalsContact O-CB 3.3Å; H588-A592 WeakPolarHBondContact O-CB 3.42Å; H588-A592 PolarHBondContact O-N 2.98Å; H588-I621 HydrophobicContact CB-CG2 4.08Å; H588-L625 HydrophobicContact CB-CD1 4.04Å; H588-L625 HydrophobicContact CB-CD2 4.08Å
589	R	91.1	Very high	92.9	Very high	88 Å²	88	33 Å²	33	33%	0.332	15%	0.153	S	C	.	.	H	α-helix	trans	-61.9	-46.6	177.3	-71	-177.2	64.5	-124.5	-3.9	111.8	L587 A592 S593 L625 D627 I630	L587-R589 VanDerWaalsContact C-N 3.27Å; L587-R589 PolarHBondContact O-N 3.15Å; L587-R589 VanDerWaalsContact O-N 3.12Å; R589-A592 PolarHBondContact O-N 2.94Å; R589-S593 PolarHBondContact O-N 3.13Å; R589-S593 PolarHBondContact O-OG 3.35Å; R589-S593 VanDerWaalsContact O-OG 3.12Å; R589-L625 HydrophobicContact CG-CD1 3.86Å; R589-D627 IonicContact CZ-OD2 2.75Å; R589-D627 IonicContact NE-OD2 3.3Å; R589-D627 PolarHBondContact NE-OD2 2.94Å; R589-D627 IonicContact NH2-OD2 3.59Å; R589-D627 PolarHBondContact NH2-OD2 3.44Å; R589-I630 HydrophobicContact CB-CD1 4.17Å; R589-I630 WeakPolarHBondContact O-CD1 3.38Å
590	L	92.2	Very high	92.9	Very high	31 Å²	31	34.5 Å²	34.5	16%	0.162	16%	0.159	C	C	.	.	H	α-helix	trans	-71.1	-40.4	-177.2	-168.9	64.5	0	0	0	111.2	A552 Y556 T578 L587 A592 S593 A594	A552-L590 HydrophobicContact CB-CD2 3.42Å; A552-L590 VanDerWaalsContact CB-CD2 3.42Å; Y556-L590 HydrophobicContact CD1-CD1 4.01Å; Y556-L590 HydrophobicContact CD2-CD1 4.13Å; Y556-L590 HydrophobicContact CG-CD1 3.68Å; T578-L590 HydrophobicContact CG2-CD1 4.22Å; T578-L590 HydrophobicContact CG2-CD2 3.87Å; T578-L590 HydrophobicContact CG2-CG 3.63Å; L587-L590 HydrophobicContact CB-CB 4.22Å; L587-L590 HydrophobicContact CD1-CD2 4.4Å; L587-L590 PolarHBondContact O-N 3.36Å; L590-A592 VanDerWaalsContact C-N 3.34Å; L590-A592 PolarHBondContact O-N 3.39Å; L590-S593 PolarHBondContact O-N 2.59Å; L590-A594 WeakPolarHBondContact O-CB 3.19Å; L590-A594 PolarHBondContact O-N 2.99Å
591	S	92.8	Very high	93	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-42.2	172.3	-60.4	0	0	0	0	111.8	L587 A594 F595	L587-S591 PolarHBondContact O-N 3.35Å; L587-S591 PolarHBondContact O-OG 3.45Å; S591-A594 PolarHBondContact O-N 3.33Å; S591-F595 WeakPolarHBondContact O-CD2 3.31Å; S591-F595 PolarHBondContact O-N 3.42Å
592	A	94	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-49.6	175.4	0	0	0	0	0	111.3	H588 R589 L590 A594 F595 I596 I621 I630	H588-A592 VanDerWaalsContact O-CB 3.3Å; H588-A592 WeakPolarHBondContact O-CB 3.42Å; H588-A592 PolarHBondContact O-N 2.98Å; R589-A592 PolarHBondContact O-N 2.94Å; L590-A592 VanDerWaalsContact C-N 3.34Å; L590-A592 PolarHBondContact O-N 3.39Å; A592-A594 VanDerWaalsContact C-N 3.29Å; A592-A594 PolarHBondContact O-N 2.87Å; A592-F595 PolarHBondContact O-N 2.89Å; A592-I596 WeakPolarHBondContact O-CG1 3.49Å; A592-I596 PolarHBondContact O-N 3.16Å; A592-I621 HydrophobicContact CB-CB 4.24Å; A592-I621 HydrophobicContact CB-CG2 3.98Å; A592-I630 HydrophobicContact CB-CD1 4.44Å; A592-I630 HydrophobicContact CB-CG2 4.01Å
593	S	95.2	Very high	93.2	Very high	17 Å²	17	32.5 Å²	32.5	12%	0.119	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-42.2	175.3	-61.9	0	0	0	0	112.2	R589 L590 I596 T597 I630	R589-S593 PolarHBondContact O-N 3.13Å; R589-S593 PolarHBondContact O-OG 3.35Å; R589-S593 VanDerWaalsContact O-OG 3.12Å; L590-S593 PolarHBondContact O-N 2.59Å; S593-I596 PolarHBondContact O-N 3.01Å; S593-T597 PolarHBondContact O-N 3.07Å; S593-T597 PolarHBondContact O-OG1 3.25Å; S593-I630 WeakPolarHBondContact OG-CD1 3.39Å
594	A	96.2	Very high	93.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-40.4	177.6	0	0	0	0	0	112.7	Y556 L575 T578 V579 L590 S591 A592 I596 T597 M598	Y556-A594 HydrophobicContact CD2-CB 4.44Å; L575-A594 HydrophobicContact CD2-CB 3.97Å; T578-A594 HydrophobicContact CG2-CB 4Å; V579-A594 HydrophobicContact CG2-CB 3.6Å; L590-A594 WeakPolarHBondContact O-CB 3.19Å; L590-A594 PolarHBondContact O-N 2.99Å; S591-A594 PolarHBondContact O-N 3.33Å; A592-A594 VanDerWaalsContact C-N 3.29Å; A592-A594 PolarHBondContact O-N 2.87Å; A594-I596 VanDerWaalsContact C-N 3.35Å; A594-T597 PolarHBondContact O-N 3.4Å; A594-M598 WeakPolarHBondContact O-CB 3.46Å; A594-M598 WeakPolarHBondContact O-CG 3.43Å; A594-M598 PolarHBondContact O-N 2.92Å
595	F	96.5	Very high	93.6	Very high	39 Å²	39	31.8 Å²	31.8	17%	0.171	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-38.9	173.6	-75.3	-52.4	0	0	0	112.6	V579 S591 A592 M598 G599 M614 A618 I621	V579-F595 HydrophobicContact CG1-CE1 4.41Å; V579-F595 HydrophobicContact CG1-CZ 4.03Å; V579-F595 HydrophobicContact CG2-CE1 4.46Å; S591-F595 WeakPolarHBondContact O-CD2 3.31Å; S591-F595 PolarHBondContact O-N 3.42Å; A592-F595 PolarHBondContact O-N 2.89Å; F595-M598 HydrophobicContact CD1-CE 3.55Å; F595-M598 HydrophobicContact CE1-CE 3.96Å; F595-M598 HydrophobicContact CG-CE 4.39Å; F595-M598 PolarHBondContact O-N 3.44Å; F595-G599 PolarHBondContact O-N 2.93Å; F595-M614 HydrophobicContact CD1-SD 3.76Å; F595-M614 HydrophobicContact CE1-SD 4.11Å; F595-A618 HydrophobicContact CB-CB 3.73Å; F595-I621 HydrophobicContact CD2-CD1 4.05Å; F595-I621 HydrophobicContact CE2-CD1 4.01Å
596	I	96.5	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-47.6	176.3	-59.8	170.8	0	0	0	110.3	A592 S593 A594 M598 G599 Q600 A618 I630 W633 A634 L637	A592-I596 WeakPolarHBondContact O-CG1 3.49Å; A592-I596 PolarHBondContact O-N 3.16Å; S593-I596 PolarHBondContact O-N 3.01Å; A594-I596 VanDerWaalsContact C-N 3.35Å; I596-M598 PolarHBondContact O-N 3.18Å; I596-G599 PolarHBondContact O-N 3.06Å; I596-Q600 PolarHBondContact O-N 3.27Å; I596-A618 HydrophobicContact CD1-CB 4.31Å; I596-A618 HydrophobicContact CG1-CB 3.46Å; I596-A618 VanDerWaalsContact CG1-CB 3.46Å; I596-I630 HydrophobicContact CD1-CG2 3.56Å; I596-W633 HydrophobicContact CB-CD2 4.16Å; I596-W633 HydrophobicContact CB-CE3 3.96Å; I596-W633 HydrophobicContact CB-CH2 4.22Å; I596-W633 HydrophobicContact CB-CZ2 4.37Å; I596-W633 HydrophobicContact CB-CZ3 3.99Å; I596-W633 HydrophobicContact CD1-CB 4.49Å; I596-W633 HydrophobicContact CD1-CD2 4.29Å; I596-W633 HydrophobicContact CD1-CE3 3.88Å; I596-W633 HydrophobicContact CG2-CD2 3.34Å; I596-W633 HydrophobicContact CG2-CE3 3.67Å; I596-W633 HydrophobicContact CG2-CG 3.78Å; I596-W633 HydrophobicContact CG2-CH2 4.04Å; I596-W633 HydrophobicContact CG2-CZ2 3.71Å; I596-W633 HydrophobicContact CG2-CZ3 4.01Å; I596-A634 HydrophobicContact CD1-CB 3.85Å; I596-A634 HydrophobicContact CG1-CB 4.25Å; I596-L637 HydrophobicContact CG2-CD1 3.52Å
597	T	96.2	Very high	94.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-44.8	177.3	-46.9	0	0	0	0	111.8	F560 F563 L575 S593 A594 G599 Q600 I601 W633	F560-T597 HydrophobicContact CD2-CG2 4.39Å; F563-T597 HydrophobicContact CB-CG2 4.49Å; F563-T597 HydrophobicContact CD1-CG2 4.23Å; F563-T597 HydrophobicContact CG-CG2 4.22Å; L575-T597 HydrophobicContact CD1-CG2 3.73Å; L575-T597 HydrophobicContact CD2-CG2 4.13Å; S593-T597 PolarHBondContact O-N 3.07Å; S593-T597 PolarHBondContact O-OG1 3.25Å; A594-T597 PolarHBondContact O-N 3.4Å; T597-G599 VanDerWaalsContact C-N 3.32Å; T597-G599 PolarHBondContact O-N 3.46Å; T597-Q600 PolarHBondContact O-N 2.93Å; T597-I601 HydrophobicContact CG2-CD1 4.41Å; T597-I601 WeakPolarHBondContact O-CG1 3.4Å; T597-I601 PolarHBondContact O-N 3.17Å; T597-W633 VanDerWaalsContact OG1-CH2 3.28Å; T597-W633 WeakPolarHBondContact OG1-CH2 3.13Å
598	M	96.7	Very high	94.3	Very high	17 Å²	17	40 Å²	40	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-40.5	176.2	-75.6	-170.6	-72.1	0	0	112	L575 V579 A594 F595 I596 Q600 I601 H602	L575-M598 HydrophobicContact CB-CG 3.64Å; L575-M598 HydrophobicContact CB-SD 3.96Å; L575-M598 HydrophobicContact CD1-CB 4.44Å; L575-M598 HydrophobicContact CD1-CG 3.51Å; L575-M598 HydrophobicContact CG-CG 4.1Å; V579-M598 HydrophobicContact CG2-CE 3.75Å; A594-M598 WeakPolarHBondContact O-CB 3.46Å; A594-M598 WeakPolarHBondContact O-CG 3.43Å; A594-M598 PolarHBondContact O-N 2.92Å; F595-M598 HydrophobicContact CD1-CE 3.55Å; F595-M598 HydrophobicContact CE1-CE 3.96Å; F595-M598 HydrophobicContact CG-CE 4.39Å; F595-M598 PolarHBondContact O-N 3.44Å; I596-M598 PolarHBondContact O-N 3.18Å; M598-Q600 VanDerWaalsContact C-N 3.35Å; M598-I601 PolarHBondContact O-N 3.04Å; M598-H602 PolarHBondContact O-CD2 2.92Å; M598-H602 VanDerWaalsContact O-CD2 3.25Å; M598-H602 PolarHBondContact O-N 2.84Å
599	G	96.1	Very high	94.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-47	174	0	0	0	0	0	112	F595 I596 T597 I601 H602 L603	F595-G599 PolarHBondContact O-N 2.93Å; I596-G599 PolarHBondContact O-N 3.06Å; T597-G599 VanDerWaalsContact C-N 3.32Å; T597-G599 PolarHBondContact O-N 3.46Å; G599-I601 PolarHBondContact O-N 2.8Å; G599-H602 PolarHBondContact O-N 3.09Å; G599-L603 WeakPolarHBondContact O-CG 3.49Å; G599-L603 PolarHBondContact O-N 3.34Å
600	Q	95.8	Very high	94.7	Very high	49 Å²	49	38.1 Å²	38.1	23%	0.229	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-40.1	176.7	-168.7	172.5	-15	0	0	112.6	F563 I596 T597 M598 H602 L603 N604 L637	F563-Q600 HydrophobicContact CE2-CG 4.43Å; F563-Q600 HydrophobicContact CZ-CB 4.34Å; F563-Q600 HydrophobicContact CZ-CG 3.77Å; I596-Q600 PolarHBondContact O-N 3.27Å; T597-Q600 PolarHBondContact O-N 2.93Å; M598-Q600 VanDerWaalsContact C-N 3.35Å; Q600-H602 VanDerWaalsContact C-N 3.35Å; Q600-H602 PolarHBondContact O-N 3.41Å; Q600-L603 PolarHBondContact O-N 3.49Å; Q600-N604 PolarHBondContact O-N 3.09Å; Q600-N604 PolarHBondContact O-OD1 2.98Å; Q600-L637 HydrophobicContact CB-CD1 4.01Å; Q600-L637 HydrophobicContact CG-CD2 4.48Å
601	I	96	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-45.5	174.5	-65.9	166	0	0	0	110.9	F563 L568 A571 K572 L575 T597 M598 G599 L603 N604 E605	F563-I601 HydrophobicContact CD2-CD1 4.01Å; F563-I601 HydrophobicContact CD2-CG1 3.4Å; F563-I601 HydrophobicContact CE2-CG1 3.62Å; F563-I601 HydrophobicContact CG-CG1 4.38Å; L568-I601 HydrophobicContact CB-CG2 4.05Å; L568-I601 HydrophobicContact CD1-CG2 4.31Å; L568-I601 HydrophobicContact CD2-CG1 4.45Å; L568-I601 HydrophobicContact CD2-CG2 4.2Å; L568-I601 HydrophobicContact CG-CG2 4.41Å; A571-I601 HydrophobicContact CB-CD1 3.81Å; K572-I601 HydrophobicContact CD-CG2 4.32Å; K572-I601 VanDerWaalsContact CE-CG2 3.48Å; K572-I601 HydrophobicContact CG-CD1 4.27Å; K572-I601 HydrophobicContact CG-CG2 4.23Å; L575-I601 HydrophobicContact CD1-CD1 3.53Å; T597-I601 HydrophobicContact CG2-CD1 4.41Å; T597-I601 WeakPolarHBondContact O-CG1 3.4Å; T597-I601 PolarHBondContact O-N 3.17Å; M598-I601 PolarHBondContact O-N 3.04Å; G599-I601 PolarHBondContact O-N 2.8Å; I601-L603 VanDerWaalsContact C-N 3.3Å; I601-L603 PolarHBondContact O-N 2.89Å; I601-N604 WeakPolarHBondContact O-CB 3.43Å; I601-N604 PolarHBondContact O-N 3.42Å; I601-N604 VanDerWaalsContact O-N 3.16Å; I601-E605 WeakPolarHBondContact O-CG 3.45Å; I601-E605 PolarHBondContact O-N 3.03Å
602	H	95.6	Very high	95	Very high	29 Å²	29	38.5 Å²	38.5	13%	0.134	20%	0.203	C	C	.	.	H	α-helix	trans	-64.3	-34.2	178.2	-79.5	-57.7	0	0	0	113.1	M598 G599 Q600 E605 Q606 N607	M598-H602 PolarHBondContact O-CD2 2.92Å; M598-H602 VanDerWaalsContact O-CD2 3.25Å; M598-H602 PolarHBondContact O-N 2.84Å; G599-H602 PolarHBondContact O-N 3.09Å; Q600-H602 VanDerWaalsContact C-N 3.35Å; Q600-H602 PolarHBondContact O-N 3.41Å; H602-E605 IonicContact ND1-OE2 3.58Å; H602-E605 PolarHBondContact ND1-OE2 2.99Å; H602-E605 CarbonylContact O-C 3.49Å; H602-E605 PolarHBondContact O-N 3.49Å; H602-Q606 PolarHBondContact O-N 3.24Å; H602-N607 CarbonylContact O-C 3.6Å; H602-N607 PolarHBondContact O-N 3Å
603	L	94	Very high	95.1	Very high	32 Å²	32	44.1 Å²	44.1	17%	0.168	23%	0.228	C	C	.	.	H	α-helix	trans	-65.7	-40.3	172.2	-65.3	174.8	0	0	0	112	G599 Q600 I601 E605 Q606 T608 I615 V641 L644	G599-L603 WeakPolarHBondContact O-CG 3.49Å; G599-L603 PolarHBondContact O-N 3.34Å; Q600-L603 PolarHBondContact O-N 3.49Å; I601-L603 VanDerWaalsContact C-N 3.3Å; I601-L603 PolarHBondContact O-N 2.89Å; L603-E605 PolarHBondContact O-N 3.22Å; L603-Q606 PolarHBondContact O-N 3.45Å; L603-T608 HydrophobicContact CD2-CG2 4.36Å; L603-I615 HydrophobicContact CD1-CD1 3.75Å; L603-V641 HydrophobicContact CD1-CG2 3.54Å; L603-V641 HydrophobicContact CD2-CG2 3.59Å; L603-V641 HydrophobicContact CG-CG2 4.16Å; L603-L644 HydrophobicContact CD2-CD1 4.49Å
604	N	92.6	Very high	95.1	Very high	90 Å²	90	44.9 Å²	44.9	48%	0.481	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-31.9	174.9	-68.3	-1.6	0	0	0	112.2	Q600 I601 Q606	Q600-N604 PolarHBondContact O-N 3.09Å; Q600-N604 PolarHBondContact O-OD1 2.98Å; I601-N604 WeakPolarHBondContact O-CB 3.43Å; I601-N604 PolarHBondContact O-N 3.42Å; I601-N604 VanDerWaalsContact O-N 3.16Å; N604-Q606 PolarHBondContact O-N 3.34Å
605	E	93.5	Very high	95.1	Very high	83 Å²	83	44.9 Å²	44.9	39%	0.388	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	7.4	174.1	-67.3	175.3	166.8	0	0	113.8	L568 K572 I601 H602 L603 N607	L568-E605 HydrophobicContact CD1-CG 4.06Å; K572-E605 IonicContact NZ-OE1 3.66Å; K572-E605 PolarHBondContact NZ-OE1 3.09Å; K572-E605 IonicContact NZ-OE2 3.85Å; K572-E605 PolarHBondContact NZ-OE2 3.33Å; I601-E605 WeakPolarHBondContact O-CG 3.45Å; I601-E605 PolarHBondContact O-N 3.03Å; H602-E605 IonicContact ND1-OE2 3.58Å; H602-E605 PolarHBondContact ND1-OE2 2.99Å; H602-E605 CarbonylContact O-C 3.49Å; H602-E605 PolarHBondContact O-N 3.49Å; L603-E605 PolarHBondContact O-N 3.22Å; E605-N607 PolarHBondContact O-N 2.94Å; E605-N607 VanDerWaalsContact O-N 3.17Å
606	Q	91.9	Very high	95.1	Very high	173 Å²	173	44.8 Å²	44.8	81%	0.808	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.2	15.7	-177	-51.9	179.9	-5.5	0	0	114.7	H602 L603 N604 T608	H602-Q606 PolarHBondContact O-N 3.24Å; L603-Q606 PolarHBondContact O-N 3.45Å; N604-Q606 PolarHBondContact O-N 3.34Å; Q606-T608 PolarHBondContact O-N 3.03Å
607	N	94.3	Very high	95	Very high	72 Å²	72	46.8 Å²	46.8	39%	0.385	25%	0.25	S	S	.	.			trans	-90.5	75.7	171.9	-171.1	-13	0	0	0	110.4	H602 E605 A609 E610 G611	H602-N607 CarbonylContact O-C 3.6Å; H602-N607 PolarHBondContact O-N 3Å; E605-N607 PolarHBondContact O-N 2.94Å; E605-N607 VanDerWaalsContact O-N 3.17Å; N607-A609 PolarHBondContact O-N 3.2Å; N607-E610 PolarHBondContact O-N 3.47Å; N607-E610 PolarHBondContact OD1-N 3.39Å; N607-E610 VanDerWaalsContact OD1-N 3.16Å; N607-G611 PolarHBondContact O-N 3.08Å
608	T	93.7	Very high	94.9	Very high	40 Å²	40	46.8 Å²	46.8	25%	0.245	25%	0.25	C	S	.	.	H	α-helix	trans	-61.2	-31.8	-178	-49.1	0	0	0	0	112.9	L603 Q606 H612 V641 L644 R645	L603-T608 HydrophobicContact CD2-CG2 4.36Å; Q606-T608 PolarHBondContact O-N 3.03Å; T608-H612 VanDerWaalsContact O-CB 3.26Å; T608-H612 WeakPolarHBondContact O-CB 3.4Å; T608-H612 PolarHBondContact O-N 2.85Å; T608-V641 HydrophobicContact CG2-CG1 3.99Å; T608-L644 HydrophobicContact CG2-CB 4.42Å; T608-R645 HydrophobicContact CG2-CG 3.89Å
609	A	94.5	Very high	94.9	Very high	75 Å²	75	46.4 Å²	46.4	62%	0.62	25%	0.249	S	C	*	.	H	α-helix	trans	-66.6	-50.3	-178.8	0	0	0	0	0	112	N607 K613	N607-A609 PolarHBondContact O-N 3.2Å; A609-K613 PolarHBondContact O-N 3.47Å; A609-K613 VanDerWaalsContact O-N 3.12Å
610	E	94.5	Very high	94.8	Very high	51 Å²	51	51.6 Å²	51.6	24%	0.238	27%	0.272	C	S	.	.	H	α-helix	trans	-72.6	-35.8	178.5	-162	62.9	-159.5	0	0	111.3	N607 H612 K613 M614	N607-E610 PolarHBondContact O-N 3.47Å; N607-E610 PolarHBondContact OD1-N 3.39Å; N607-E610 VanDerWaalsContact OD1-N 3.16Å; E610-H612 PolarHBondContact O-N 2.96Å; E610-K613 PolarHBondContact O-N 3.16Å; E610-K613 IonicContact OE1-NZ 3.43Å; E610-K613 PolarHBondContact OE1-NZ 3.13Å; E610-K613 IonicContact OE2-NZ 3.81Å; E610-K613 PolarHBondContact OE2-NZ 2.92Å; E610-M614 HydrophobicContact CG-CE 4.43Å; E610-M614 HydrophobicContact CG-CG 4.5Å; E610-M614 WeakPolarHBondContact O-CG 3.41Å; E610-M614 PolarHBondContact O-N 3Å; E610-M614 WeakPolarHBondContact OE1-CE 3.18Å
611	G	94.8	Very high	94.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.3	-50.7	172.6	0	0	0	0	0	112	N607 K613 M614 I615	N607-G611 PolarHBondContact O-N 3.08Å; G611-K613 PolarHBondContact O-N 3.32Å; G611-M614 PolarHBondContact O-N 3.46Å; G611-I615 WeakPolarHBondContact O-CD1 3.46Å; G611-I615 VanDerWaalsContact O-CG1 3.24Å; G611-I615 WeakPolarHBondContact O-CG1 3.46Å; G611-I615 PolarHBondContact O-N 3.46Å; G611-I615 VanDerWaalsContact O-N 3.09Å
612	H	95.9	Very high	94.4	Very high	42 Å²	42	51.1 Å²	51.1	19%	0.194	27%	0.271	C	S	.	.	H	α-helix	trans	-57.7	-49.3	175.9	-178.2	67.6	0	0	0	112	T608 E610 M614 I615 S616 V641 E650	T608-H612 VanDerWaalsContact O-CB 3.26Å; T608-H612 WeakPolarHBondContact O-CB 3.4Å; T608-H612 PolarHBondContact O-N 2.85Å; E610-H612 PolarHBondContact O-N 2.96Å; H612-M614 VanDerWaalsContact C-N 3.34Å; H612-M614 PolarHBondContact O-N 3.48Å; H612-I615 PolarHBondContact O-N 3.29Å; H612-S616 PolarHBondContact CE1-OG 2.9Å; H612-S616 VanDerWaalsContact CE1-OG 3.29Å; H612-S616 PolarHBondContact NE2-OG 3.36Å; H612-S616 WeakPolarHBondContact O-CB 3.44Å; H612-S616 PolarHBondContact O-N 3.19Å; H612-S616 PolarHBondContact O-OG 3Å; H612-S616 VanDerWaalsContact O-OG 3.05Å; H612-V641 HydrophobicContact CB-CG1 3.71Å; H612-E650 IonicContact CE1-OE1 2.71Å; H612-E650 PolarHBondContact CE1-OE1 3.21Å
613	K	96.3	Very high	94.2	Very high	118 Å²	118	54 Å²	54	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-58.1	-44.5	-179	177.9	-178.8	160.3	-146.7	0	112.4	A609 E610 G611 A617	A609-K613 PolarHBondContact O-N 3.47Å; A609-K613 VanDerWaalsContact O-N 3.12Å; E610-K613 PolarHBondContact O-N 3.16Å; E610-K613 IonicContact OE1-NZ 3.43Å; E610-K613 PolarHBondContact OE1-NZ 3.13Å; E610-K613 IonicContact OE2-NZ 3.81Å; E610-K613 PolarHBondContact OE2-NZ 2.92Å; G611-K613 PolarHBondContact O-N 3.32Å; K613-A617 PolarHBondContact O-N 3.1Å
614	M	95.9	Very high	94.1	Very high	32 Å²	32	61.3 Å²	61.3	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-45	179.5	-69.9	-66.9	152.6	0	0	111.9	F595 E610 G611 H612 A617 A618	F595-M614 HydrophobicContact CD1-SD 3.76Å; F595-M614 HydrophobicContact CE1-SD 4.11Å; E610-M614 HydrophobicContact CG-CE 4.43Å; E610-M614 HydrophobicContact CG-CG 4.5Å; E610-M614 WeakPolarHBondContact O-CG 3.41Å; E610-M614 PolarHBondContact O-N 3Å; E610-M614 WeakPolarHBondContact OE1-CE 3.18Å; G611-M614 PolarHBondContact O-N 3.46Å; H612-M614 VanDerWaalsContact C-N 3.34Å; H612-M614 PolarHBondContact O-N 3.48Å; M614-A617 WeakPolarHBondContact O-CB 3.5Å; M614-A617 PolarHBondContact O-N 3.35Å; M614-A618 PolarHBondContact O-N 2.62Å
615	I	96.6	Very high	93.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-70.5	-36.2	-179.9	-54.3	158.5	0	0	0	110.8	L603 G611 H612 A617 A618 I619 A634 L637 L638 V641	L603-I615 HydrophobicContact CD1-CD1 3.75Å; G611-I615 WeakPolarHBondContact O-CD1 3.46Å; G611-I615 VanDerWaalsContact O-CG1 3.24Å; G611-I615 WeakPolarHBondContact O-CG1 3.46Å; G611-I615 PolarHBondContact O-N 3.46Å; G611-I615 VanDerWaalsContact O-N 3.09Å; H612-I615 PolarHBondContact O-N 3.29Å; I615-A617 VanDerWaalsContact C-N 3.31Å; I615-A617 PolarHBondContact O-N 2.66Å; I615-A618 WeakPolarHBondContact O-CB 3.37Å; I615-A618 PolarHBondContact O-N 3.47Å; I615-A618 VanDerWaalsContact O-N 3.11Å; I615-I619 PolarHBondContact O-N 3.44Å; I615-A634 HydrophobicContact CG2-CB 4.37Å; I615-L637 HydrophobicContact CD1-CB 3.7Å; I615-L637 HydrophobicContact CD1-CD1 3.96Å; I615-L637 HydrophobicContact CD1-CG 4.5Å; I615-L637 HydrophobicContact CG1-CB 4.45Å; I615-L637 HydrophobicContact CG1-CD1 4.25Å; I615-L637 HydrophobicContact CG2-CB 4.25Å; I615-L638 HydrophobicContact CB-CD2 4.02Å; I615-L638 HydrophobicContact CB-CG 4.33Å; I615-L638 HydrophobicContact CG2-CD1 4.1Å; I615-L638 HydrophobicContact CG2-CD2 3.79Å; I615-L638 HydrophobicContact CG2-CG 3.54Å; I615-V641 HydrophobicContact CD1-CG2 3.95Å
616	S	95.5	Very high	93.7	Very high	37 Å²	37	55.2 Å²	55.2	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-36.6	173.6	-72.2	0	0	0	0	112.3	H612 I619 H620	H612-S616 PolarHBondContact CE1-OG 2.9Å; H612-S616 VanDerWaalsContact CE1-OG 3.29Å; H612-S616 PolarHBondContact NE2-OG 3.36Å; H612-S616 WeakPolarHBondContact O-CB 3.44Å; H612-S616 PolarHBondContact O-N 3.19Å; H612-S616 PolarHBondContact O-OG 3Å; H612-S616 VanDerWaalsContact O-OG 3.05Å; S616-I619 VanDerWaalsContact O-CG2 3.28Å; S616-I619 WeakPolarHBondContact O-CG2 3.22Å; S616-H620 PolarHBondContact O-N 3.37Å
617	A	94.6	Very high	93.8	Very high	43 Å²	43	47.3 Å²	47.3	36%	0.355	25%	0.248	S	C	.	.	H	α-helix	trans	-66.6	-41.6	170.5	0	0	0	0	0	111.6	K613 M614 I615 H620 I621	K613-A617 PolarHBondContact O-N 3.1Å; M614-A617 WeakPolarHBondContact O-CB 3.5Å; M614-A617 PolarHBondContact O-N 3.35Å; I615-A617 VanDerWaalsContact C-N 3.31Å; I615-A617 PolarHBondContact O-N 2.66Å; A617-H620 WeakPolarHBondContact O-CB 3.45Å; A617-H620 PolarHBondContact O-N 3.11Å; A617-I621 PolarHBondContact O-N 3.34Å
618	A	95.4	Very high	93.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-46.8	179.1	0	0	0	0	0	113.1	F595 I596 M614 I615 H620 I621 A622	F595-A618 HydrophobicContact CB-CB 3.73Å; I596-A618 HydrophobicContact CD1-CB 4.31Å; I596-A618 HydrophobicContact CG1-CB 3.46Å; I596-A618 VanDerWaalsContact CG1-CB 3.46Å; M614-A618 PolarHBondContact O-N 2.62Å; I615-A618 WeakPolarHBondContact O-CB 3.37Å; I615-A618 PolarHBondContact O-N 3.47Å; I615-A618 VanDerWaalsContact O-N 3.11Å; A618-H620 VanDerWaalsContact C-N 3.25Å; A618-H620 PolarHBondContact O-N 3.2Å; A618-I621 PolarHBondContact O-N 2.93Å; A618-I621 VanDerWaalsContact O-N 3.14Å; A618-A622 WeakPolarHBondContact O-CB 3.45Å; A618-A622 PolarHBondContact O-N 3.08Å
619	I	95.4	Very high	93.6	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.046	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-32.5	179.8	-169.5	63.5	0	0	0	111.6	I615 S616 I621 A622 N623 A634 T635 L638 W654	I615-I619 PolarHBondContact O-N 3.44Å; S616-I619 VanDerWaalsContact O-CG2 3.28Å; S616-I619 WeakPolarHBondContact O-CG2 3.22Å; I619-I621 VanDerWaalsContact C-N 3.27Å; I619-I621 PolarHBondContact O-N 3.42Å; I619-A622 HydrophobicContact CD1-CB 4.38Å; I619-A622 PolarHBondContact O-N 2.92Å; I619-N623 WeakPolarHBondContact O-CB 3.21Å; I619-N623 VanDerWaalsContact O-CG 3.27Å; I619-N623 PolarHBondContact O-N 3.39Å; I619-N623 PolarHBondContact O-ND2 2.93Å; I619-A634 HydrophobicContact CB-CB 4.19Å; I619-A634 HydrophobicContact CD1-CB 3.87Å; I619-T635 HydrophobicContact CD1-CG2 3.99Å; I619-L638 HydrophobicContact CB-CD1 3.85Å; I619-L638 HydrophobicContact CG1-CD1 4.11Å; I619-L638 HydrophobicContact CG2-CD1 3.7Å; I619-W654 HydrophobicContact CG1-CH2 4.21Å; I619-W654 HydrophobicContact CG1-CZ3 4.11Å; I619-W654 HydrophobicContact CG2-CH2 4.34Å
620	H	93.6	Very high	93.6	Very high	108 Å²	108	41.5 Å²	41.5	50%	0.5	21%	0.214	S	C	.	.	H	α-helix	trans	-62	-38.2	175.7	-171.5	72.7	0	0	0	112	S616 A617 A618 R624	S616-H620 PolarHBondContact O-N 3.37Å; A617-H620 WeakPolarHBondContact O-CB 3.45Å; A617-H620 PolarHBondContact O-N 3.11Å; A618-H620 VanDerWaalsContact C-N 3.25Å; A618-H620 PolarHBondContact O-N 3.2Å; H620-R624 PolarHBondContact CE1-NH2 3.48Å; H620-R624 PolarHBondContact NE2-NH2 3.44Å
621	I	91.6	Very high	93.7	Very high	39 Å²	39	40.2 Å²	40.2	20%	0.2	21%	0.208	C	C	.	.	H	α-helix	trans	-73.8	-47.5	173.8	-59.6	168.8	0	0	0	109.8	H588 A592 F595 A617 A618 I619 N623 R624 L625	H588-I621 HydrophobicContact CB-CG2 4.08Å; A592-I621 HydrophobicContact CB-CB 4.24Å; A592-I621 HydrophobicContact CB-CG2 3.98Å; F595-I621 HydrophobicContact CD2-CD1 4.05Å; F595-I621 HydrophobicContact CE2-CD1 4.01Å; A617-I621 PolarHBondContact O-N 3.34Å; A618-I621 PolarHBondContact O-N 2.93Å; A618-I621 VanDerWaalsContact O-N 3.14Å; I619-I621 VanDerWaalsContact C-N 3.27Å; I619-I621 PolarHBondContact O-N 3.42Å; I621-N623 VanDerWaalsContact C-N 3.29Å; I621-N623 PolarHBondContact O-N 3.5Å; I621-R624 WeakPolarHBondContact O-CB 3.32Å; I621-R624 PolarHBondContact O-N 3.47Å; I621-L625 HydrophobicContact CG2-CD1 3.8Å; I621-L625 HydrophobicContact CG2-CG 4.46Å; I621-L625 PolarHBondContact O-N 3.22Å
622	A	91.9	Very high	93.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-35.1	-177.1	0	0	0	0	0	113.2	A618 I619 R624 L625 I630 Q631	A618-A622 WeakPolarHBondContact O-CB 3.45Å; A618-A622 PolarHBondContact O-N 3.08Å; I619-A622 HydrophobicContact CD1-CB 4.38Å; I619-A622 PolarHBondContact O-N 2.92Å; A622-R624 PolarHBondContact O-N 3.12Å; A622-L625 PolarHBondContact O-N 2.97Å; A622-L625 VanDerWaalsContact O-N 3.11Å; A622-I630 HydrophobicContact CB-CB 4.48Å; A622-I630 HydrophobicContact CB-CG2 3.6Å; A622-Q631 HydrophobicContact CB-CG 4.08Å; A622-Q631 PolarHBondContact O-NE2 3.4Å
623	N	92	Very high	93.7	Very high	91 Å²	91	43.3 Å²	43.3	49%	0.487	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.7	176.6	-74.2	-14.3	0	0	0	113.7	I619 I621	I619-N623 WeakPolarHBondContact O-CB 3.21Å; I619-N623 VanDerWaalsContact O-CG 3.27Å; I619-N623 PolarHBondContact O-N 3.39Å; I619-N623 PolarHBondContact O-ND2 2.93Å; I621-N623 VanDerWaalsContact C-N 3.29Å; I621-N623 PolarHBondContact O-N 3.5Å
624	R	91	Very high	93.7	Very high	184 Å²	184	37.7 Å²	37.7	69%	0.694	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-6.3	174.4	-59.8	177.7	-176.7	-160.7	-0.2	112.6	H620 I621 A622	H620-R624 PolarHBondContact CE1-NH2 3.48Å; H620-R624 PolarHBondContact NE2-NH2 3.44Å; I621-R624 WeakPolarHBondContact O-CB 3.32Å; I621-R624 PolarHBondContact O-N 3.47Å; A622-R624 PolarHBondContact O-N 3.12Å
625	L	89.2	Confident	93.7	Very high	13 Å²	13	36.1 Å²	36.1	7%	0.068	19%	0.189	C	C	.	.	S	Bend	trans	-110.5	132.5	-179.2	-61.9	171.5	0	0	0	108.7	H588 R589 I621 A622 D627 Q631	H588-L625 HydrophobicContact CB-CD1 4.04Å; H588-L625 HydrophobicContact CB-CD2 4.08Å; R589-L625 HydrophobicContact CG-CD1 3.86Å; I621-L625 HydrophobicContact CG2-CD1 3.8Å; I621-L625 HydrophobicContact CG2-CG 4.46Å; I621-L625 PolarHBondContact O-N 3.22Å; A622-L625 PolarHBondContact O-N 2.97Å; A622-L625 VanDerWaalsContact O-N 3.11Å; L625-D627 HydrophobicContact CB-CB 4.39Å; L625-D627 PolarHBondContact O-N 2.92Å; L625-Q631 PolarHBondContact O-NE2 2.83Å
626	P	90.1	Very high	93.7	Very high	33 Å²	33	37.7 Å²	37.7	21%	0.214	20%	0.202	C	C	.	.			trans	-76.7	65.7	169.3	33.7	-35.6	0	0	0	109.4	L366 M410	L366-P626 HydrophobicContact CB-CG 3.79Å; L366-P626 HydrophobicContact CD1-CG 4.15Å; L366-P626 HydrophobicContact CG-CG 4.22Å; M410-P626 VanDerWaalsContact CA-O 3.31Å; M410-P626 WeakPolarHBondContact CA-O 3.3Å; M410-P626 HydrophobicContact CE-CB 4.18Å; M410-P626 HydrophobicContact CG-CB 4.26Å; M410-P626 HydrophobicContact CG-CG 4.43Å; M410-P626 WeakPolarHBondContact CG-O 3.23Å
627	D	92.5	Very high	93.7	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.037	20%	0.197	C	C	.	.			trans	-126.3	97.4	176.8	-173.4	-38.7	0	0	0	109	V409 R589 L625 G629 I630 Q631	V409-D627 HydrophobicContact CG1-CB 4.13Å; V409-D627 WeakPolarHBondContact CG1-OD2 3.48Å; R589-D627 IonicContact CZ-OD2 2.75Å; R589-D627 IonicContact NE-OD2 3.3Å; R589-D627 PolarHBondContact NE-OD2 2.94Å; R589-D627 IonicContact NH2-OD2 3.59Å; R589-D627 PolarHBondContact NH2-OD2 3.44Å; L625-D627 HydrophobicContact CB-CB 4.39Å; L625-D627 PolarHBondContact O-N 2.92Å; D627-G629 PolarHBondContact O-N 3.49Å; D627-G629 PolarHBondContact OD1-N 3.5Å; D627-I630 HydrophobicContact CB-CB 4.41Å; D627-I630 HydrophobicContact CB-CD1 4.34Å; D627-I630 HydrophobicContact CB-CG1 4.47Å; D627-I630 PolarHBondContact OD1-N 3.46Å; D627-I630 VanDerWaalsContact OD2-CD1 3.29Å; D627-I630 WeakPolarHBondContact OD2-CD1 3.28Å; D627-Q631 VanDerWaalsContact O-CG 3.23Å; D627-Q631 WeakPolarHBondContact O-CG 3.3Å; D627-Q631 PolarHBondContact O-N 3.34Å
628	I	92.8	Very high	93.8	Very high	18 Å²	18	35.2 Å²	35.2	9%	0.092	18%	0.18	C	C	.	.	H	α-helix	trans	-65.4	-29.6	-175.9	-168.3	60.8	0	0	0	112.1	L632 F661 V665	I628-L632 WeakPolarHBondContact O-CB 3.38Å; I628-L632 PolarHBondContact O-N 2.93Å; I628-F661 HydrophobicContact CD1-CB 3.73Å; I628-F661 HydrophobicContact CD1-CD1 3.19Å; I628-F661 HydrophobicContact CD1-CE1 3.92Å; I628-F661 HydrophobicContact CD1-CG 3.71Å; I628-V665 HydrophobicContact CG1-CG2 3.52Å; I628-V665 HydrophobicContact CG2-CG2 4.1Å
629	G	92.6	Very high	93.9	Very high	39 Å²	39	38 Å²	38	40%	0.402	19%	0.191	S	C	.	.	H	α-helix	trans	-69.9	-47.3	-176.3	0	0	0	0	0	111.4	D627 Q631 L632 W633	D627-G629 PolarHBondContact O-N 3.49Å; D627-G629 PolarHBondContact OD1-N 3.5Å; G629-Q631 VanDerWaalsContact C-N 3.34Å; G629-L632 PolarHBondContact O-N 3.35Å; G629-W633 WeakPolarHBondContact O-CB 3.46Å; G629-W633 PolarHBondContact O-N 3.08Å
630	I	94.1	Very high	93.8	Very high	7 Å²	7	39 Å²	39	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-41.3	176.2	-64.3	178.6	0	0	0	110.3	R589 A592 S593 I596 A622 D627 W633 A634	R589-I630 HydrophobicContact CB-CD1 4.17Å; R589-I630 WeakPolarHBondContact O-CD1 3.38Å; A592-I630 HydrophobicContact CB-CD1 4.44Å; A592-I630 HydrophobicContact CB-CG2 4.01Å; S593-I630 WeakPolarHBondContact OG-CD1 3.39Å; I596-I630 HydrophobicContact CD1-CG2 3.56Å; A622-I630 HydrophobicContact CB-CB 4.48Å; A622-I630 HydrophobicContact CB-CG2 3.6Å; D627-I630 HydrophobicContact CB-CB 4.41Å; D627-I630 HydrophobicContact CB-CD1 4.34Å; D627-I630 HydrophobicContact CB-CG1 4.47Å; D627-I630 PolarHBondContact OD1-N 3.46Å; D627-I630 VanDerWaalsContact OD2-CD1 3.29Å; D627-I630 WeakPolarHBondContact OD2-CD1 3.28Å; I630-W633 PolarHBondContact O-N 3.46Å; I630-A634 WeakPolarHBondContact O-CB 3.33Å; I630-A634 PolarHBondContact O-N 3.46Å
631	Q	95.3	Very high	93.8	Very high	25 Å²	25	33.9 Å²	33.9	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-46	176.5	-72.5	171.3	-10.1	0	0	112.1	A622 L625 D627 G629 W633 T635 F661	A622-Q631 HydrophobicContact CB-CG 4.08Å; A622-Q631 PolarHBondContact O-NE2 3.4Å; L625-Q631 PolarHBondContact O-NE2 2.83Å; D627-Q631 VanDerWaalsContact O-CG 3.23Å; D627-Q631 WeakPolarHBondContact O-CG 3.3Å; D627-Q631 PolarHBondContact O-N 3.34Å; G629-Q631 VanDerWaalsContact C-N 3.34Å; Q631-W633 PolarHBondContact O-N 3.23Å; Q631-T635 WeakPolarHBondContact O-CB 3.44Å; Q631-T635 VanDerWaalsContact O-CG2 3.27Å; Q631-T635 WeakPolarHBondContact O-CG2 3.3Å; Q631-T635 PolarHBondContact O-N 3.15Å; Q631-T635 VanDerWaalsContact O-N 3.07Å; Q631-T635 PolarHBondContact O-OG1 3.37Å; Q631-F661 HydrophobicContact CB-CD2 4.02Å; Q631-F661 HydrophobicContact CB-CE1 4.3Å; Q631-F661 HydrophobicContact CB-CE2 3.66Å; Q631-F661 HydrophobicContact CB-CG 4.49Å; Q631-F661 HydrophobicContact CB-CZ 3.8Å; Q631-F661 HydrophobicContact CG-CE2 4.41Å; Q631-F661 HydrophobicContact CG-CZ 4.15Å
632	L	95.3	Very high	94	Very high	42 Å²	42	32.1 Å²	32.1	22%	0.22	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-42.4	177.2	-177.4	66.3	0	0	0	111.8	I628 G629 T635 A636 H658 F661 S662 V665	I628-L632 WeakPolarHBondContact O-CB 3.38Å; I628-L632 PolarHBondContact O-N 2.93Å; G629-L632 PolarHBondContact O-N 3.35Å; L632-T635 PolarHBondContact O-OG1 3.1Å; L632-A636 WeakPolarHBondContact O-CB 3.47Å; L632-A636 PolarHBondContact O-N 2.93Å; L632-A636 VanDerWaalsContact O-N 3.1Å; L632-H658 WeakPolarHBondContact CD1-ND1 3.33Å; L632-H658 PolarHBondContact O-ND1 3.33Å; L632-F661 HydrophobicContact CB-CB 4.41Å; L632-F661 HydrophobicContact CD1-CB 3.94Å; L632-S662 VanDerWaalsContact CD1-OG 3.3Å; L632-S662 WeakPolarHBondContact CD1-OG 3.48Å; L632-V665 HydrophobicContact CD2-CG2 4.41Å
633	W	95.4	Very high	94.1	Very high	64 Å²	64	36.7 Å²	36.7	24%	0.242	20%	0.197	C	C	.	.	H	α-helix	trans	-68.4	-47.8	-180	-172.7	17.6	0	0	0	112.4	F560 I596 T597 G629 I630 Q631 T635 A636 L637	F560-W633 HydrophobicContact CE2-CH2 4.48Å; I596-W633 HydrophobicContact CB-CD2 4.16Å; I596-W633 HydrophobicContact CB-CE3 3.96Å; I596-W633 HydrophobicContact CB-CH2 4.22Å; I596-W633 HydrophobicContact CB-CZ2 4.37Å; I596-W633 HydrophobicContact CB-CZ3 3.99Å; I596-W633 HydrophobicContact CD1-CB 4.49Å; I596-W633 HydrophobicContact CD1-CD2 4.29Å; I596-W633 HydrophobicContact CD1-CE3 3.88Å; I596-W633 HydrophobicContact CG2-CD2 3.34Å; I596-W633 HydrophobicContact CG2-CE3 3.67Å; I596-W633 HydrophobicContact CG2-CG 3.78Å; I596-W633 HydrophobicContact CG2-CH2 4.04Å; I596-W633 HydrophobicContact CG2-CZ2 3.71Å; I596-W633 HydrophobicContact CG2-CZ3 4.01Å; T597-W633 VanDerWaalsContact OG1-CH2 3.28Å; T597-W633 WeakPolarHBondContact OG1-CH2 3.13Å; G629-W633 WeakPolarHBondContact O-CB 3.46Å; G629-W633 PolarHBondContact O-N 3.08Å; I630-W633 PolarHBondContact O-N 3.46Å; Q631-W633 PolarHBondContact O-N 3.23Å; W633-T635 PolarHBondContact O-N 3.46Å; W633-A636 WeakPolarHBondContact O-CB 3.31Å; W633-A636 PolarHBondContact O-N 2.9Å; W633-L637 PolarHBondContact O-N 3.48Å; W633-L637 VanDerWaalsContact O-N 3.16Å
634	A	96.6	Very high	94.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-44.5	179.1	0	0	0	0	0	112	I596 I615 I619 I630 A636 L637 L638	I596-A634 HydrophobicContact CD1-CB 3.85Å; I596-A634 HydrophobicContact CG1-CB 4.25Å; I615-A634 HydrophobicContact CG2-CB 4.37Å; I619-A634 HydrophobicContact CB-CB 4.19Å; I619-A634 HydrophobicContact CD1-CB 3.87Å; I630-A634 WeakPolarHBondContact O-CB 3.33Å; I630-A634 PolarHBondContact O-N 3.46Å; A634-A636 VanDerWaalsContact C-N 3.34Å; A634-A636 PolarHBondContact O-N 3.46Å; A634-L637 PolarHBondContact O-N 3.36Å; A634-L638 WeakPolarHBondContact O-CG 3.25Å; A634-L638 PolarHBondContact O-N 3.03Å
635	T	96.8	Very high	94.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-35.9	177.9	53.1	0	0	0	0	112.6	I619 Q631 L632 W633 L638 K639 W654 E657 F661	I619-T635 HydrophobicContact CD1-CG2 3.99Å; Q631-T635 WeakPolarHBondContact O-CB 3.44Å; Q631-T635 VanDerWaalsContact O-CG2 3.27Å; Q631-T635 WeakPolarHBondContact O-CG2 3.3Å; Q631-T635 PolarHBondContact O-N 3.15Å; Q631-T635 VanDerWaalsContact O-N 3.07Å; Q631-T635 PolarHBondContact O-OG1 3.37Å; L632-T635 PolarHBondContact O-OG1 3.1Å; W633-T635 PolarHBondContact O-N 3.46Å; T635-L638 PolarHBondContact O-N 2.98Å; T635-K639 WeakPolarHBondContact O-CB 3.44Å; T635-K639 PolarHBondContact O-N 2.96Å; T635-W654 HydrophobicContact CG2-CE3 4.13Å; T635-W654 HydrophobicContact CG2-CZ3 4.4Å; T635-E657 HydrophobicContact CG2-CB 4.21Å; T635-E657 HydrophobicContact CG2-CG 3.81Å; T635-F661 HydrophobicContact CG2-CD2 4.1Å; T635-F661 HydrophobicContact CG2-CE2 3.92Å
636	A	96.2	Very high	94.3	Very high	32 Å²	32	37.5 Å²	37.5	26%	0.264	22%	0.219	S	C	.	.	H	α-helix	trans	-60.8	-44.7	174.7	0	0	0	0	0	112	L632 W633 A634 G640	L632-A636 WeakPolarHBondContact O-CB 3.47Å; L632-A636 PolarHBondContact O-N 2.93Å; L632-A636 VanDerWaalsContact O-N 3.1Å; W633-A636 WeakPolarHBondContact O-CB 3.31Å; W633-A636 PolarHBondContact O-N 2.9Å; A634-A636 VanDerWaalsContact C-N 3.34Å; A634-A636 PolarHBondContact O-N 3.46Å; A636-G640 PolarHBondContact O-N 2.97Å
637	L	96.2	Very high	94.5	Very high	29 Å²	29	38.5 Å²	38.5	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-70.7	-43.3	177.7	-63.9	-174.1	0	0	0	111.9	I596 Q600 I615 W633 A634 K639 G640 V641	I596-L637 HydrophobicContact CG2-CD1 3.52Å; Q600-L637 HydrophobicContact CB-CD1 4.01Å; Q600-L637 HydrophobicContact CG-CD2 4.48Å; I615-L637 HydrophobicContact CD1-CB 3.7Å; I615-L637 HydrophobicContact CD1-CD1 3.96Å; I615-L637 HydrophobicContact CD1-CG 4.5Å; I615-L637 HydrophobicContact CG1-CB 4.45Å; I615-L637 HydrophobicContact CG1-CD1 4.25Å; I615-L637 HydrophobicContact CG2-CB 4.25Å; W633-L637 PolarHBondContact O-N 3.48Å; W633-L637 VanDerWaalsContact O-N 3.16Å; A634-L637 PolarHBondContact O-N 3.36Å; L637-K639 VanDerWaalsContact C-N 3.3Å; L637-K639 PolarHBondContact O-N 3.12Å; L637-G640 CarbonylContact O-C 3.46Å; L637-G640 WeakPolarHBondContact O-CA 3.42Å; L637-G640 PolarHBondContact O-N 2.97Å; L637-V641 WeakPolarHBondContact O-CG2 3.45Å; L637-V641 PolarHBondContact O-N 2.89Å
638	L	96.8	Very high	94.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.7	-39.1	178.8	-74	166.6	0	0	0	112.6	I615 I619 A634 T635 G640 V641 A642 W654	I615-L638 HydrophobicContact CB-CD2 4.02Å; I615-L638 HydrophobicContact CB-CG 4.33Å; I615-L638 HydrophobicContact CG2-CD1 4.1Å; I615-L638 HydrophobicContact CG2-CD2 3.79Å; I615-L638 HydrophobicContact CG2-CG 3.54Å; I619-L638 HydrophobicContact CB-CD1 3.85Å; I619-L638 HydrophobicContact CG1-CD1 4.11Å; I619-L638 HydrophobicContact CG2-CD1 3.7Å; A634-L638 WeakPolarHBondContact O-CG 3.25Å; A634-L638 PolarHBondContact O-N 3.03Å; T635-L638 PolarHBondContact O-N 2.98Å; L638-G640 VanDerWaalsContact C-N 3.33Å; L638-G640 PolarHBondContact O-N 2.86Å; L638-V641 PolarHBondContact O-N 3.2Å; L638-A642 WeakPolarHBondContact O-CB 3.19Å; L638-A642 PolarHBondContact O-N 3.29Å; L638-W654 HydrophobicContact CB-CB 4.38Å; L638-W654 HydrophobicContact CB-CD2 3.76Å; L638-W654 HydrophobicContact CB-CE3 4.42Å; L638-W654 HydrophobicContact CB-CG 3.69Å; L638-W654 HydrophobicContact CD1-CD2 4.04Å; L638-W654 HydrophobicContact CD1-CE3 4.1Å; L638-W654 HydrophobicContact CD1-CH2 3.78Å; L638-W654 HydrophobicContact CD1-CZ2 3.71Å; L638-W654 HydrophobicContact CD1-CZ3 3.97Å; L638-W654 HydrophobicContact CG-CD2 4.49Å
639	K	95.7	Very high	94.7	Very high	57 Å²	57	49.8 Å²	49.8	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-55.6	-48.2	169.5	-178.9	-171.5	68.5	-178.2	0	111.2	T635 L637 A642 N643 E651 W654 F655	T635-K639 WeakPolarHBondContact O-CB 3.44Å; T635-K639 PolarHBondContact O-N 2.96Å; L637-K639 VanDerWaalsContact C-N 3.3Å; L637-K639 PolarHBondContact O-N 3.12Å; K639-A642 PolarHBondContact O-N 3.05Å; K639-N643 PolarHBondContact O-N 3.11Å; K639-N643 VanDerWaalsContact O-N 3.13Å; K639-E651 HydrophobicContact CG-CG 4.25Å; K639-W654 HydrophobicContact CB-CB 3.96Å; K639-F655 HydrophobicContact CD-CB 4.17Å; K639-F655 HydrophobicContact CD-CD2 3.99Å; K639-F655 HydrophobicContact CG-CB 4.49Å
640	G	94.2	Very high	94.8	Very high	32 Å²	32	49.4 Å²	49.4	33%	0.33	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-41.1	177.3	0	0	0	0	0	113.5	A636 L637 L638 N643 L644	A636-G640 PolarHBondContact O-N 2.97Å; L637-G640 CarbonylContact O-C 3.46Å; L637-G640 WeakPolarHBondContact O-CA 3.42Å; L637-G640 PolarHBondContact O-N 2.97Å; L638-G640 VanDerWaalsContact C-N 3.33Å; L638-G640 PolarHBondContact O-N 2.86Å; G640-N643 PolarHBondContact O-N 3.42Å; G640-L644 WeakPolarHBondContact O-CG 3.41Å; G640-L644 PolarHBondContact O-N 3.27Å
641	V	94.6	Very high	94.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-42.1	176.3	175.7	0	0	0	0	112	L603 T608 H612 I615 L637 L638 N643 L644 R645	L603-V641 HydrophobicContact CD1-CG2 3.54Å; L603-V641 HydrophobicContact CD2-CG2 3.59Å; L603-V641 HydrophobicContact CG-CG2 4.16Å; T608-V641 HydrophobicContact CG2-CG1 3.99Å; H612-V641 HydrophobicContact CB-CG1 3.71Å; I615-V641 HydrophobicContact CD1-CG2 3.95Å; L637-V641 WeakPolarHBondContact O-CG2 3.45Å; L637-V641 PolarHBondContact O-N 2.89Å; L638-V641 PolarHBondContact O-N 3.2Å; V641-N643 VanDerWaalsContact C-N 3.35Å; V641-L644 PolarHBondContact O-N 3.3Å; V641-R645 WeakPolarHBondContact O-CG 3.35Å; V641-R645 PolarHBondContact O-N 3.48Å
642	A	94.2	Very high	94.9	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-43.1	177.9	0	0	0	0	0	111.5	L638 K639 L644 R645 G646 D647 E650 E651	L638-A642 WeakPolarHBondContact O-CB 3.19Å; L638-A642 PolarHBondContact O-N 3.29Å; K639-A642 PolarHBondContact O-N 3.05Å; A642-L644 PolarHBondContact O-N 2.89Å; A642-R645 CarbonylContact O-C 3.59Å; A642-R645 PolarHBondContact O-N 3.05Å; A642-R645 VanDerWaalsContact O-N 3.14Å; A642-G646 PolarHBondContact O-N 3.43Å; A642-G646 VanDerWaalsContact O-N 3.09Å; A642-D647 PolarHBondContact O-N 3.45Å; A642-E650 HydrophobicContact CB-CB 4Å; A642-E650 HydrophobicContact CB-CG 3.94Å; A642-E651 HydrophobicContact CB-CB 3.84Å
643	N	94.4	Very high	95	Very high	97 Å²	97	60.8 Å²	60.8	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-46	172.9	-179.5	40.3	0	0	0	111.9	K639 G640 V641 R645 G646	K639-N643 PolarHBondContact O-N 3.11Å; K639-N643 VanDerWaalsContact O-N 3.13Å; G640-N643 PolarHBondContact O-N 3.42Å; V641-N643 VanDerWaalsContact C-N 3.35Å; N643-R645 PolarHBondContact O-N 2.88Å; N643-G646 PolarHBondContact O-N 3.3Å; N643-G646 VanDerWaalsContact O-N 3.07Å
644	L	92.7	Very high	95	Very high	115 Å²	115	58.7 Å²	58.7	60%	0.602	31%	0.312	S	S	*	.	H	α-helix	trans	-61.8	-26.7	176.4	-71.9	172.8	0	0	0	113.7	L603 T608 G640 V641 A642	L603-L644 HydrophobicContact CD2-CD1 4.49Å; T608-L644 HydrophobicContact CG2-CB 4.42Å; G640-L644 WeakPolarHBondContact O-CG 3.41Å; G640-L644 PolarHBondContact O-N 3.27Å; V641-L644 PolarHBondContact O-N 3.3Å; A642-L644 PolarHBondContact O-N 2.89Å
645	R	92.6	Very high	95	Very high	128 Å²	128	64 Å²	64	48%	0.483	34%	0.335	S	S	.	.	H	α-helix	trans	-89.9	-7.8	177.7	-69.4	172.1	64.5	-148	-8.1	113.2	T608 V641 A642 N643 D647 E650	T608-R645 HydrophobicContact CG2-CG 3.89Å; V641-R645 WeakPolarHBondContact O-CG 3.35Å; V641-R645 PolarHBondContact O-N 3.48Å; A642-R645 CarbonylContact O-C 3.59Å; A642-R645 PolarHBondContact O-N 3.05Å; A642-R645 VanDerWaalsContact O-N 3.14Å; N643-R645 PolarHBondContact O-N 2.88Å; R645-D647 VanDerWaalsContact C-N 3.26Å; R645-D647 PolarHBondContact O-N 3.46Å; R645-E650 IonicContact CZ-OE2 3.79Å; R645-E650 IonicContact NH1-OE2 3.62Å; R645-E650 PolarHBondContact NH1-OE2 3.44Å
646	G	91.6	Very high	95.1	Very high	61 Å²	61	68 Å²	68	63%	0.629	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	18.9	-173.7	0	0	0	0	0	114.1	A642 N643 T648	A642-G646 PolarHBondContact O-N 3.43Å; A642-G646 VanDerWaalsContact O-N 3.09Å; N643-G646 PolarHBondContact O-N 3.3Å; N643-G646 VanDerWaalsContact O-N 3.07Å; G646-T648 PolarHBondContact O-N 3.34Å
647	D	94.2	Very high	95	Very high	55 Å²	55	68.8 Å²	68.8	29%	0.294	36%	0.358	S	S	.	.			trans	-88.8	88.9	178.1	-168.8	-24.4	0	0	0	110.4	A642 R645 Q649 E650 E651	A642-D647 PolarHBondContact O-N 3.45Å; R645-D647 VanDerWaalsContact C-N 3.26Å; R645-D647 PolarHBondContact O-N 3.46Å; D647-Q649 VanDerWaalsContact C-N 3.27Å; D647-Q649 PolarHBondContact O-N 3.18Å; D647-Q649 PolarHBondContact OD1-N 3.37Å; D647-E650 HydrophobicContact CB-CB 4Å; D647-E650 VanDerWaalsContact CG-CB 3.41Å; D647-E650 PolarHBondContact O-N 3.36Å; D647-E650 PolarHBondContact OD1-N 2.93Å; D647-E651 WeakPolarHBondContact O-CB 3.42Å; D647-E651 PolarHBondContact O-N 2.87Å
648	T	94.4	Very high	95.1	Very high	98 Å²	98	69.1 Å²	69.1	60%	0.601	36%	0.359	S	S	*	.	H	α-helix	trans	-64	-29	-178.6	49.1	0	0	0	0	113.5	G646 T652	G646-T648 PolarHBondContact O-N 3.34Å; T648-T652 WeakPolarHBondContact O-CB 3.37Å; T648-T652 PolarHBondContact O-N 2.84Å; T648-T652 VanDerWaalsContact O-N 3.11Å; T648-T652 PolarHBondContact O-OG1 3.01Å
649	Q	95.3	Very high	95.1	Very high	163 Å²	163	71.8 Å²	71.8	76%	0.762	37%	0.373	S	S	*	.	H	α-helix	trans	-73.1	-47.2	178.2	-65.8	-173.7	6	0	0	110.5	D647 E651 T652 R653	D647-Q649 VanDerWaalsContact C-N 3.27Å; D647-Q649 PolarHBondContact O-N 3.18Å; D647-Q649 PolarHBondContact OD1-N 3.37Å; Q649-E651 VanDerWaalsContact C-N 3.34Å; Q649-T652 PolarHBondContact O-N 2.8Å; Q649-R653 PolarHBondContact O-N 2.8Å; Q649-R653 VanDerWaalsContact O-N 3.1Å
650	E	94	Very high	95.1	Very high	31 Å²	31	75 Å²	75	15%	0.145	38%	0.384	C	S	.	.	H	α-helix	trans	-64.6	-40.2	177.4	-173	174.2	-167.4	0	0	111.2	H612 A642 R645 D647 R653 W654	H612-E650 IonicContact CE1-OE1 2.71Å; H612-E650 PolarHBondContact CE1-OE1 3.21Å; A642-E650 HydrophobicContact CB-CB 4Å; A642-E650 HydrophobicContact CB-CG 3.94Å; R645-E650 IonicContact CZ-OE2 3.79Å; R645-E650 IonicContact NH1-OE2 3.62Å; R645-E650 PolarHBondContact NH1-OE2 3.44Å; D647-E650 HydrophobicContact CB-CB 4Å; D647-E650 VanDerWaalsContact CG-CB 3.41Å; D647-E650 PolarHBondContact O-N 3.36Å; D647-E650 PolarHBondContact OD1-N 2.93Å; E650-R653 WeakPolarHBondContact O-CB 3.36Å; E650-R653 PolarHBondContact O-N 2.82Å; E650-W654 VanDerWaalsContact CG-CD1 3.44Å; E650-W654 PolarHBondContact O-N 2.75Å; E650-W654 PolarHBondContact OE1-NE1 2.83Å
651	E	95.6	Very high	95.2	Very high	60 Å²	60	73.7 Å²	73.7	28%	0.28	37%	0.369	S	S	.	.	H	α-helix	trans	-60.3	-48.1	175.8	-175.7	-177.5	-173.6	0	0	111.8	K639 A642 D647 Q649 R653 W654 F655	K639-E651 HydrophobicContact CG-CG 4.25Å; A642-E651 HydrophobicContact CB-CB 3.84Å; D647-E651 WeakPolarHBondContact O-CB 3.42Å; D647-E651 PolarHBondContact O-N 2.87Å; Q649-E651 VanDerWaalsContact C-N 3.34Å; E651-R653 VanDerWaalsContact C-N 3.29Å; E651-R653 PolarHBondContact O-N 3.2Å; E651-W654 PolarHBondContact O-N 3.44Å; E651-F655 VanDerWaalsContact O-CB 3.27Å; E651-F655 WeakPolarHBondContact O-CB 3.43Å; E651-F655 PolarHBondContact O-N 2.99Å
652	T	96.3	Very high	95.3	Very high	87 Å²	87	75 Å²	75	53%	0.534	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-39.4	179	-58.2	0	0	0	0	111.6	T648 Q649 T656	T648-T652 WeakPolarHBondContact O-CB 3.37Å; T648-T652 PolarHBondContact O-N 2.84Å; T648-T652 VanDerWaalsContact O-N 3.11Å; T648-T652 PolarHBondContact O-OG1 3.01Å; Q649-T652 PolarHBondContact O-N 2.8Å; T652-T656 PolarHBondContact O-N 2.93Å; T652-T656 PolarHBondContact O-OG1 2.88Å
653	R	96.7	Very high	95.4	Very high	166 Å²	166	80.8 Å²	80.8	63%	0.626	40%	0.403	S	S	*	.	H	α-helix	trans	-61.9	-52.3	175.8	178.6	-174.4	176.1	-176.7	-0.3	111.3	Q649 E650 E651 F655 T656 E657	Q649-R653 PolarHBondContact O-N 2.8Å; Q649-R653 VanDerWaalsContact O-N 3.1Å; E650-R653 WeakPolarHBondContact O-CB 3.36Å; E650-R653 PolarHBondContact O-N 2.82Å; E651-R653 VanDerWaalsContact C-N 3.29Å; E651-R653 PolarHBondContact O-N 3.2Å; R653-F655 VanDerWaalsContact C-N 3.32Å; R653-F655 PolarHBondContact O-N 2.85Å; R653-T656 PolarHBondContact O-N 3.22Å; R653-E657 PolarHBondContact O-N 3.08Å
654	W	96.1	Very high	95.5	Very high	21 Å²	21	80.2 Å²	80.2	8%	0.08	40%	0.399	C	S	.	.	H	α-helix	trans	-69.4	-31.6	-178.8	-66.2	127	0	0	0	112.7	I619 T635 L638 K639 E650 E651 E657 H658	I619-W654 HydrophobicContact CG1-CH2 4.21Å; I619-W654 HydrophobicContact CG1-CZ3 4.11Å; I619-W654 HydrophobicContact CG2-CH2 4.34Å; T635-W654 HydrophobicContact CG2-CE3 4.13Å; T635-W654 HydrophobicContact CG2-CZ3 4.4Å; L638-W654 HydrophobicContact CB-CB 4.38Å; L638-W654 HydrophobicContact CB-CD2 3.76Å; L638-W654 HydrophobicContact CB-CE3 4.42Å; L638-W654 HydrophobicContact CB-CG 3.69Å; L638-W654 HydrophobicContact CD1-CD2 4.04Å; L638-W654 HydrophobicContact CD1-CE3 4.1Å; L638-W654 HydrophobicContact CD1-CH2 3.78Å; L638-W654 HydrophobicContact CD1-CZ2 3.71Å; L638-W654 HydrophobicContact CD1-CZ3 3.97Å; L638-W654 HydrophobicContact CG-CD2 4.49Å; K639-W654 HydrophobicContact CB-CB 3.96Å; E650-W654 VanDerWaalsContact CG-CD1 3.44Å; E650-W654 PolarHBondContact O-N 2.75Å; E650-W654 PolarHBondContact OE1-NE1 2.83Å; E651-W654 PolarHBondContact O-N 3.44Å; W654-E657 PolarHBondContact O-N 3.3Å; W654-H658 WeakPolarHBondContact O-CB 3.3Å; W654-H658 PolarHBondContact O-N 3.01Å
655	F	97.3	Very high	95.5	Very high	110 Å²	110	75.9 Å²	75.9	48%	0.482	38%	0.377	S	S	.	.	H	α-helix	trans	-59.2	-48.5	170.8	177.6	-92.7	0	0	0	111.5	K639 E651 R653 E657 H658 D659	K639-F655 HydrophobicContact CD-CB 4.17Å; K639-F655 HydrophobicContact CD-CD2 3.99Å; K639-F655 HydrophobicContact CG-CB 4.49Å; E651-F655 VanDerWaalsContact O-CB 3.27Å; E651-F655 WeakPolarHBondContact O-CB 3.43Å; E651-F655 PolarHBondContact O-N 2.99Å; R653-F655 VanDerWaalsContact C-N 3.32Å; R653-F655 PolarHBondContact O-N 2.85Å; F655-E657 VanDerWaalsContact C-N 3.33Å; F655-E657 PolarHBondContact O-N 3.04Å; F655-H658 PolarHBondContact O-N 3.4Å; F655-D659 VanDerWaalsContact O-CB 3.3Å; F655-D659 WeakPolarHBondContact O-CB 3.28Å; F655-D659 PolarHBondContact O-N 2.95Å
656	T	97.3	Very high	95.7	Very high	84 Å²	84	74.7 Å²	74.7	52%	0.515	38%	0.379	S	S	.	.	H	α-helix	trans	-60.3	-43.7	179.6	-56.7	0	0	0	0	111.6	T652 R653 R660	T652-T656 PolarHBondContact O-N 2.93Å; T652-T656 PolarHBondContact O-OG1 2.88Å; R653-T656 PolarHBondContact O-N 3.22Å; T656-R660 WeakPolarHBondContact O-CB 3.13Å; T656-R660 PolarHBondContact O-N 3.33Å
657	E	95.5	Very high	95.9	Very high	49 Å²	49	77.2 Å²	77.2	23%	0.229	37%	0.374	C	S	.	.	H	α-helix	trans	-69.6	-42	179.9	-167.8	64.6	-168.9	0	0	112.1	T635 R653 W654 F655 R660 F661	T635-E657 HydrophobicContact CG2-CB 4.21Å; T635-E657 HydrophobicContact CG2-CG 3.81Å; R653-E657 PolarHBondContact O-N 3.08Å; W654-E657 PolarHBondContact O-N 3.3Å; F655-E657 VanDerWaalsContact C-N 3.33Å; F655-E657 PolarHBondContact O-N 3.04Å; E657-R660 WeakPolarHBondContact O-CB 3.39Å; E657-R660 PolarHBondContact O-N 2.91Å; E657-R660 IonicContact OE1-CZ 3.92Å; E657-R660 VanDerWaalsContact OE1-CZ 3.22Å; E657-R660 IonicContact OE1-NE 3.94Å; E657-R660 PolarHBondContact OE1-NE 3.32Å; E657-R660 IonicContact OE1-NH2 3.22Å; E657-R660 PolarHBondContact OE1-NH2 3.47Å; E657-R660 IonicContact OE2-CZ 3.4Å; E657-R660 IonicContact OE2-NE 2.96Å; E657-R660 IonicContact OE2-NH2 3.18Å; E657-F661 HydrophobicContact CG-CD2 4.08Å; E657-F661 HydrophobicContact CG-CE2 3.51Å; E657-F661 HydrophobicContact CG-CZ 4.15Å; E657-F661 WeakPolarHBondContact O-CD2 3.4Å; E657-F661 WeakPolarHBondContact O-CG 3.41Å; E657-F661 PolarHBondContact O-N 3.17Å; E657-F661 VanDerWaalsContact O-N 3.08Å; E657-F661 VanDerWaalsContact OE1-CE2 3.3Å; E657-F661 WeakPolarHBondContact OE1-CE2 3.48Å; E657-F661 WeakPolarHBondContact OE1-CZ 3.47Å
658	H	96.7	Very high	96	Very high	37 Å²	37	75.2 Å²	75.2	17%	0.171	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-42.9	175	178.2	74.4	0	0	0	112.1	L632 W654 F655 F661 S662	L632-H658 WeakPolarHBondContact CD1-ND1 3.33Å; L632-H658 PolarHBondContact O-ND1 3.33Å; W654-H658 WeakPolarHBondContact O-CB 3.3Å; W654-H658 PolarHBondContact O-N 3.01Å; F655-H658 PolarHBondContact O-N 3.4Å; H658-F661 PolarHBondContact O-N 3.36Å; H658-S662 VanDerWaalsContact O-CB 3.32Å; H658-S662 WeakPolarHBondContact O-CB 3.43Å; H658-S662 PolarHBondContact O-N 3.41Å; H658-S662 PolarHBondContact O-OG 2.93Å
659	D	97.6	Very high	96.1	Very high	55 Å²	55	72.6 Å²	72.6	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-42.8	175.7	177.1	65.3	0	0	0	111.4	F655 F661 S662 K663	F655-D659 VanDerWaalsContact O-CB 3.3Å; F655-D659 WeakPolarHBondContact O-CB 3.28Å; F655-D659 PolarHBondContact O-N 2.95Å; D659-F661 PolarHBondContact O-N 3.34Å; D659-S662 PolarHBondContact O-N 2.92Å; D659-K663 WeakPolarHBondContact O-CG 3.24Å; D659-K663 PolarHBondContact O-N 2.86Å; D659-K663 WeakPolarHBondContact OD1-CE 3.37Å; D659-K663 IonicContact OD1-NZ 3.64Å; D659-K663 WeakPolarHBondContact OD2-CE 2.79Å; D659-K663 IonicContact OD2-NZ 2.66Å; D659-K663 PolarHBondContact OD2-NZ 2.98Å
660	R	96.5	Very high	96.2	Very high	125 Å²	125	70.7 Å²	70.7	47%	0.472	34%	0.337	S	S	.	.	H	α-helix	trans	-56.6	-51.3	174.7	-173.2	-175.9	76.6	147.4	2.9	111.6	T656 E657 K663 I664	T656-R660 WeakPolarHBondContact O-CB 3.13Å; T656-R660 PolarHBondContact O-N 3.33Å; E657-R660 WeakPolarHBondContact O-CB 3.39Å; E657-R660 PolarHBondContact O-N 2.91Å; E657-R660 IonicContact OE1-CZ 3.92Å; E657-R660 VanDerWaalsContact OE1-CZ 3.22Å; E657-R660 IonicContact OE1-NE 3.94Å; E657-R660 PolarHBondContact OE1-NE 3.32Å; E657-R660 IonicContact OE1-NH2 3.22Å; E657-R660 PolarHBondContact OE1-NH2 3.47Å; E657-R660 IonicContact OE2-CZ 3.4Å; E657-R660 IonicContact OE2-NE 2.96Å; E657-R660 IonicContact OE2-NH2 3.18Å; R660-K663 PolarHBondContact O-N 3.33Å; R660-I664 HydrophobicContact CG-CD1 4.42Å; R660-I664 WeakPolarHBondContact O-CG1 3.35Å; R660-I664 PolarHBondContact O-N 3.41Å
661	F	95.6	Very high	96.4	Very high	5 Å²	5	75.2 Å²	75.2	2%	0.022	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-39.5	179.3	-65.6	-43.6	0	0	0	112.5	I628 Q631 L632 T635 E657 H658 D659 K663 I664 V665	I628-F661 HydrophobicContact CD1-CB 3.73Å; I628-F661 HydrophobicContact CD1-CD1 3.19Å; I628-F661 HydrophobicContact CD1-CE1 3.92Å; I628-F661 HydrophobicContact CD1-CG 3.71Å; Q631-F661 HydrophobicContact CB-CD2 4.02Å; Q631-F661 HydrophobicContact CB-CE1 4.3Å; Q631-F661 HydrophobicContact CB-CE2 3.66Å; Q631-F661 HydrophobicContact CB-CG 4.49Å; Q631-F661 HydrophobicContact CB-CZ 3.8Å; Q631-F661 HydrophobicContact CG-CE2 4.41Å; Q631-F661 HydrophobicContact CG-CZ 4.15Å; L632-F661 HydrophobicContact CB-CB 4.41Å; L632-F661 HydrophobicContact CD1-CB 3.94Å; T635-F661 HydrophobicContact CG2-CD2 4.1Å; T635-F661 HydrophobicContact CG2-CE2 3.92Å; E657-F661 HydrophobicContact CG-CD2 4.08Å; E657-F661 HydrophobicContact CG-CE2 3.51Å; E657-F661 HydrophobicContact CG-CZ 4.15Å; E657-F661 WeakPolarHBondContact O-CD2 3.4Å; E657-F661 WeakPolarHBondContact O-CG 3.41Å; E657-F661 PolarHBondContact O-N 3.17Å; E657-F661 VanDerWaalsContact O-N 3.08Å; E657-F661 VanDerWaalsContact OE1-CE2 3.3Å; E657-F661 WeakPolarHBondContact OE1-CE2 3.48Å; E657-F661 WeakPolarHBondContact OE1-CZ 3.47Å; H658-F661 PolarHBondContact O-N 3.36Å; D659-F661 PolarHBondContact O-N 3.34Å; F661-K663 PolarHBondContact O-N 2.96Å; F661-I664 PolarHBondContact O-N 3.18Å; F661-V665 WeakPolarHBondContact O-CG2 3.45Å; F661-V665 PolarHBondContact O-N 3.2Å
662	S	96.2	Very high	96.4	Very high	26 Å²	26	72.3 Å²	72.3	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-45.5	177	-61.7	0	0	0	0	111.7	L632 H658 D659 I664 V665 I666	L632-S662 VanDerWaalsContact CD1-OG 3.3Å; L632-S662 WeakPolarHBondContact CD1-OG 3.48Å; H658-S662 VanDerWaalsContact O-CB 3.32Å; H658-S662 WeakPolarHBondContact O-CB 3.43Å; H658-S662 PolarHBondContact O-N 3.41Å; H658-S662 PolarHBondContact O-OG 2.93Å; D659-S662 PolarHBondContact O-N 2.92Å; S662-I664 VanDerWaalsContact C-N 3.35Å; S662-I664 PolarHBondContact O-N 2.93Å; S662-V665 PolarHBondContact O-N 3.41Å; S662-I666 WeakPolarHBondContact O-CB 3.32Å; S662-I666 VanDerWaalsContact O-CG1 3.24Å; S662-I666 WeakPolarHBondContact O-CG1 3.39Å; S662-I666 PolarHBondContact O-N 2.66Å
663	K	96.9	Very high	96.4	Very high	124 Å²	124	72.9 Å²	72.9	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-41.9	176.9	-76	170.2	176.1	164.7	0	112.5	D659 R660 F661 H667	D659-K663 WeakPolarHBondContact O-CG 3.24Å; D659-K663 PolarHBondContact O-N 2.86Å; D659-K663 WeakPolarHBondContact OD1-CE 3.37Å; D659-K663 IonicContact OD1-NZ 3.64Å; D659-K663 WeakPolarHBondContact OD2-CE 2.79Å; D659-K663 IonicContact OD2-NZ 2.66Å; D659-K663 PolarHBondContact OD2-NZ 2.98Å; R660-K663 PolarHBondContact O-N 3.33Å; F661-K663 PolarHBondContact O-N 2.96Å; K663-H667 VanDerWaalsContact O-CB 3.27Å; K663-H667 WeakPolarHBondContact O-CB 3.39Å; K663-H667 PolarHBondContact O-N 3.44Å
664	I	95.3	Very high	96.3	Very high	84 Å²	84	69.9 Å²	69.9	43%	0.431	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-49.5	177	-67.4	166.4	0	0	0	110.4	R660 F661 S662 H667 E668	R660-I664 HydrophobicContact CG-CD1 4.42Å; R660-I664 WeakPolarHBondContact O-CG1 3.35Å; R660-I664 PolarHBondContact O-N 3.41Å; F661-I664 PolarHBondContact O-N 3.18Å; S662-I664 VanDerWaalsContact C-N 3.35Å; S662-I664 PolarHBondContact O-N 2.93Å; I664-H667 PolarHBondContact O-N 3.26Å; I664-E668 WeakPolarHBondContact O-CB 3.39Å; I664-E668 PolarHBondContact O-N 3.42Å
665	V	94.7	Very high	96.2	Very high	24 Å²	24	69.5 Å²	69.5	15%	0.145	34%	0.343	C	S	.	.	H	α-helix	trans	-63.8	-45.1	-179.1	173.4	0	0	0	0	111.7	I628 L632 F661 S662 E668 H669	I628-V665 HydrophobicContact CG1-CG2 3.52Å; I628-V665 HydrophobicContact CG2-CG2 4.1Å; L632-V665 HydrophobicContact CD2-CG2 4.41Å; F661-V665 WeakPolarHBondContact O-CG2 3.45Å; F661-V665 PolarHBondContact O-N 3.2Å; S662-V665 PolarHBondContact O-N 3.41Å; V665-E668 PolarHBondContact O-N 2.94Å; V665-H669 WeakPolarHBondContact O-CB 3.37Å; V665-H669 PolarHBondContact O-CD2 3.43Å; V665-H669 PolarHBondContact O-N 2.89Å
666	I	95.4	Very high	96	Very high	103 Å²	103	67.2 Å²	67.2	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-48	179.2	-68.6	165.6	0	0	0	110.5	S662 E668 H669 M670	S662-I666 WeakPolarHBondContact O-CB 3.32Å; S662-I666 VanDerWaalsContact O-CG1 3.24Å; S662-I666 WeakPolarHBondContact O-CG1 3.39Å; S662-I666 PolarHBondContact O-N 2.66Å; I666-E668 VanDerWaalsContact C-N 3.33Å; I666-E668 PolarHBondContact O-N 2.97Å; I666-H669 PolarHBondContact O-N 2.94Å; I666-M670 HydrophobicContact CG2-SD 4.29Å; I666-M670 WeakPolarHBondContact O-CG 3.43Å; I666-M670 PolarHBondContact O-N 3.4Å
667	H	96.7	Very high	95.9	Very high	114 Å²	114	64.2 Å²	64.2	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-43.4	179.1	174.9	-103.9	0	0	0	111.7	K663 I664 M670 R671	K663-H667 VanDerWaalsContact O-CB 3.27Å; K663-H667 WeakPolarHBondContact O-CB 3.39Å; K663-H667 PolarHBondContact O-N 3.44Å; I664-H667 PolarHBondContact O-N 3.26Å; H667-M670 PolarHBondContact O-N 3.22Å; H667-R671 WeakPolarHBondContact CE1-CD 3.49Å; H667-R671 WeakPolarHBondContact O-CG 3.49Å; H667-R671 PolarHBondContact O-N 3.44Å; H667-R671 VanDerWaalsContact O-N 3.09Å
668	E	96.4	Very high	95.9	Very high	14 Å²	14	63.5 Å²	63.5	7%	0.065	32%	0.316	C	S	.	.	H	α-helix	trans	-69.6	-37	178.7	-171.7	61.2	-164.7	0	0	112.4	G411 Q413 T414 I664 V665 I666 M670 R671 A672	G411-E668 WeakPolarHBondContact O-CG 3.5Å; Q413-E668 HydrophobicContact CB-CG 4.37Å; Q413-E668 PolarHBondContact N-OE1 3.24Å; T414-E668 WeakPolarHBondContact CB-OE1 3.03Å; T414-E668 PolarHBondContact N-OE1 3.33Å; T414-E668 PolarHBondContact OG1-OE1 2.76Å; I664-E668 WeakPolarHBondContact O-CB 3.39Å; I664-E668 PolarHBondContact O-N 3.42Å; V665-E668 PolarHBondContact O-N 2.94Å; I666-E668 VanDerWaalsContact C-N 3.33Å; I666-E668 PolarHBondContact O-N 2.97Å; E668-M670 PolarHBondContact O-N 2.97Å; E668-R671 PolarHBondContact O-N 3.14Å; E668-R671 IonicContact OE2-CZ 3.61Å; E668-R671 IonicContact OE2-NH1 2.61Å; E668-R671 PolarHBondContact OE2-NH1 2.98Å; E668-A672 VanDerWaalsContact O-CB 3.31Å; E668-A672 WeakPolarHBondContact O-CB 3.23Å; E668-A672 PolarHBondContact O-N 3.39Å
669	H	96.6	Very high	95.8	Very high	42 Å²	42	63.5 Å²	63.5	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-43.3	172	-83.9	-152.9	0	0	0	111.8	Q413 S451 M452 V665 I666 R671 A672 I673	Q413-H669 PolarHBondContact NE2-NE2 2.86Å; S451-H669 PolarHBondContact O-CE1 2.93Å; S451-H669 PolarHBondContact O-NE2 3.5Å; M452-H669 HydrophobicContact CE-CB 4.12Å; V665-H669 WeakPolarHBondContact O-CB 3.37Å; V665-H669 PolarHBondContact O-CD2 3.43Å; V665-H669 PolarHBondContact O-N 2.89Å; I666-H669 PolarHBondContact O-N 2.94Å; H669-R671 VanDerWaalsContact C-N 3.33Å; H669-R671 PolarHBondContact O-N 2.89Å; H669-A672 PolarHBondContact O-N 2.83Å; H669-I673 WeakPolarHBondContact O-CD1 3.25Å; H669-I673 VanDerWaalsContact O-CG1 3.26Å; H669-I673 WeakPolarHBondContact O-CG1 3.46Å; H669-I673 PolarHBondContact O-N 3.43Å
670	M	97.1	Very high	95.7	Very high	123 Å²	123	61 Å²	61	61%	0.606	31%	0.307	S	S	*	.	H	α-helix	trans	-61.1	-42.1	176.8	-71.2	-179.4	70	0	0	111.9	I666 H667 E668 S674	I666-M670 HydrophobicContact CG2-SD 4.29Å; I666-M670 WeakPolarHBondContact O-CG 3.43Å; I666-M670 PolarHBondContact O-N 3.4Å; H667-M670 PolarHBondContact O-N 3.22Å; E668-M670 PolarHBondContact O-N 2.97Å; M670-S674 PolarHBondContact O-N 2.99Å; M670-S674 PolarHBondContact O-OG 2.94Å
671	R	97.5	Very high	95.6	Very high	126 Å²	126	55.5 Å²	55.5	48%	0.475	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-42.7	175.6	-71.5	-179.6	67.3	-145.2	7	112.1	T414 H667 E668 H669 S674 A675	T414-R671 WeakPolarHBondContact OG1-CB 3.31Å; H667-R671 WeakPolarHBondContact CE1-CD 3.49Å; H667-R671 WeakPolarHBondContact O-CG 3.49Å; H667-R671 PolarHBondContact O-N 3.44Å; H667-R671 VanDerWaalsContact O-N 3.09Å; E668-R671 PolarHBondContact O-N 3.14Å; E668-R671 IonicContact OE2-CZ 3.61Å; E668-R671 IonicContact OE2-NH1 2.61Å; E668-R671 PolarHBondContact OE2-NH1 2.98Å; H669-R671 VanDerWaalsContact C-N 3.33Å; H669-R671 PolarHBondContact O-N 2.89Å; R671-S674 PolarHBondContact O-N 2.63Å; R671-A675 PolarHBondContact O-N 3.48Å; R671-A675 VanDerWaalsContact O-N 3.15Å
672	A	96.7	Very high	95.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-43.4	179.8	0	0	0	0	0	111.5	Q413 T414 M452 E668 H669 S674 A675 H678	Q413-A672 HydrophobicContact CB-CB 3.81Å; T414-A672 PolarHBondContact OG1-N 3.42Å; M452-A672 HydrophobicContact CE-CB 3.9Å; M452-A672 HydrophobicContact SD-CB 3.94Å; E668-A672 VanDerWaalsContact O-CB 3.31Å; E668-A672 WeakPolarHBondContact O-CB 3.23Å; E668-A672 PolarHBondContact O-N 3.39Å; H669-A672 PolarHBondContact O-N 2.83Å; A672-S674 PolarHBondContact O-N 3.34Å; A672-A675 WeakPolarHBondContact O-CB 3.41Å; A672-A675 PolarHBondContact O-N 2.79Å; A672-A675 VanDerWaalsContact O-N 3.13Å; A672-H678 WeakPolarHBondContact O-CB 3.41Å
673	I	96.2	Very high	95.3	Very high	99 Å²	99	62 Å²	62	51%	0.508	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-33.6	175.6	-68	163.3	0	0	0	111.6	M452 H669 A675	M452-I673 HydrophobicContact CE-CD1 4.13Å; M452-I673 HydrophobicContact CE-CG1 3.6Å; H669-I673 WeakPolarHBondContact O-CD1 3.25Å; H669-I673 VanDerWaalsContact O-CG1 3.26Å; H669-I673 WeakPolarHBondContact O-CG1 3.46Å; H669-I673 PolarHBondContact O-N 3.43Å; I673-A675 VanDerWaalsContact C-N 3.3Å
674	S	95	Very high	94.8	Very high	103 Å²	103	58.7 Å²	58.7	72%	0.72	30%	0.301	S	S	*	.	H	α-helix	trans	-79.4	-12.5	179.6	-52.5	0	0	0	0	113.3	M670 R671 A672	M670-S674 PolarHBondContact O-N 2.99Å; M670-S674 PolarHBondContact O-OG 2.94Å; R671-S674 PolarHBondContact O-N 2.63Å; A672-S674 PolarHBondContact O-N 3.34Å
675	A	94.1	Very high	94.2	Very high	12 Å²	12	59.9 Å²	59.9	10%	0.099	31%	0.309	C	S	.	.	S	Bend	trans	-80.1	140.5	179.7	0	0	0	0	0	110.8	T414 R671 A672 I673 E677 H678	T414-A675 HydrophobicContact CG2-CB 4.12Å; R671-A675 PolarHBondContact O-N 3.48Å; R671-A675 VanDerWaalsContact O-N 3.15Å; A672-A675 WeakPolarHBondContact O-CB 3.41Å; A672-A675 PolarHBondContact O-N 2.79Å; A672-A675 VanDerWaalsContact O-N 3.13Å; I673-A675 VanDerWaalsContact C-N 3.3Å; A675-E677 PolarHBondContact O-N 3.26Å; A675-H678 VanDerWaalsContact O-CB 3.25Å; A675-H678 WeakPolarHBondContact O-CB 3.28Å; A675-H678 PolarHBondContact O-N 3.32Å
676	P	93.2	Very high	93.3	Very high	62 Å²	62	60.4 Å²	60.4	40%	0.403	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-60.7	-31.1	-178.2	23.6	-32.3	0	0	0	112.4	H678 S679 L691	P676-H678 PolarHBondContact O-N 3.1Å; P676-S679 WeakPolarHBondContact O-CB 3.48Å; P676-S679 PolarHBondContact O-N 3.08Å; P676-S679 PolarHBondContact O-OG 3.48Å; P676-L691 HydrophobicContact CB-CD2 4.13Å; P676-L691 VanDerWaalsContact O-CD2 3.25Å; P676-L691 WeakPolarHBondContact O-CD2 3.42Å
677	E	94.8	Very high	92.1	Very high	22 Å²	22	61.2 Å²	61.2	10%	0.103	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-66	-15.8	178	-60.2	86.7	173	0	0	113.5	A417 A675 S679 L680 L691	A417-E677 HydrophobicContact CB-CB 3.87Å; A417-E677 WeakPolarHBondContact O-CB 3.26Å; A675-E677 PolarHBondContact O-N 3.26Å; E677-S679 PolarHBondContact O-N 2.87Å; E677-L680 HydrophobicContact CB-CD1 4.2Å; E677-L680 VanDerWaalsContact O-CB 3.27Å; E677-L680 WeakPolarHBondContact O-CB 3.4Å; E677-L680 VanDerWaalsContact O-CG 3.29Å; E677-L680 WeakPolarHBondContact O-CG 3.4Å; E677-L680 PolarHBondContact O-N 2.9Å; E677-L680 VanDerWaalsContact O-N 3.16Å; E677-L691 HydrophobicContact CG-CD2 4.48Å
678	H	95.7	Very high	90.5	Very high	34 Å²	34	57.5 Å²	57.5	16%	0.157	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-58.3	-35.1	173.4	-171.4	63.9	0	0	0	111.9	Y448 A672 A675 P676 L680 I681	Y448-H678 AromaticContact CE1-ND1 3.65Å; Y448-H678 AromaticContact CZ-ND1 3.65Å; Y448-H678 PolarHBondContact OH-ND1 3.16Å; A672-H678 WeakPolarHBondContact O-CB 3.41Å; A675-H678 VanDerWaalsContact O-CB 3.25Å; A675-H678 WeakPolarHBondContact O-CB 3.28Å; A675-H678 PolarHBondContact O-N 3.32Å; P676-H678 PolarHBondContact O-N 3.1Å; H678-L680 PolarHBondContact O-N 3.13Å; H678-I681 WeakPolarHBondContact O-CG1 3.49Å; H678-I681 PolarHBondContact O-N 3.13Å
679	S	94.3	Very high	89	Confident	36 Å²	36	59 Å²	59	25%	0.252	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-58.5	-19.7	179.5	64.5	0	0	0	0	113.7	P676 E677 I681 E682	P676-S679 WeakPolarHBondContact O-CB 3.48Å; P676-S679 PolarHBondContact O-N 3.08Å; P676-S679 PolarHBondContact O-OG 3.48Å; E677-S679 PolarHBondContact O-N 2.87Å; S679-I681 PolarHBondContact O-N 3.35Å; S679-I681 VanDerWaalsContact O-N 3.12Å; S679-E682 PolarHBondContact O-N 2.94Å; S679-E682 VanDerWaalsContact O-N 3.11Å
680	L	94.4	Very high	87.2	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-59.8	-23.7	178	-68.2	173.8	0	0	0	113.3	I420 I445 E677 H678 E682 W683 L688 L691	I420-L680 HydrophobicContact CG2-CD1 4.12Å; I445-L680 HydrophobicContact CD1-CB 4.48Å; I445-L680 WeakPolarHBondContact CG2-O 3.35Å; E677-L680 HydrophobicContact CB-CD1 4.2Å; E677-L680 VanDerWaalsContact O-CB 3.27Å; E677-L680 WeakPolarHBondContact O-CB 3.4Å; E677-L680 VanDerWaalsContact O-CG 3.29Å; E677-L680 WeakPolarHBondContact O-CG 3.4Å; E677-L680 PolarHBondContact O-N 2.9Å; E677-L680 VanDerWaalsContact O-N 3.16Å; H678-L680 PolarHBondContact O-N 3.13Å; L680-E682 PolarHBondContact O-N 3.13Å; L680-W683 PolarHBondContact O-N 3.26Å; L680-W683 VanDerWaalsContact O-N 3.11Å; L680-L688 HydrophobicContact CD2-CD1 3.64Å; L680-L691 HydrophobicContact CD2-CD1 4.38Å
681	I	95.4	Very high	85.6	Confident	8 Å²	8	61.7 Å²	61.7	4%	0.041	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-63.3	-23.6	178.1	69.5	-177	0	0	0	113	I445 Y448 A449 C454 Q457 Q461 H678 S679	I445-I681 HydrophobicContact CG2-CG2 4.31Å; Y448-I681 HydrophobicContact CD1-CG2 3.51Å; Y448-I681 HydrophobicContact CE1-CG2 3.58Å; A449-I681 HydrophobicContact CB-CB 4.3Å; A449-I681 HydrophobicContact CB-CG2 3.9Å; C454-I681 HydrophobicContact CB-CD1 4.38Å; Q457-I681 HydrophobicContact CB-CB 4.16Å; Q457-I681 HydrophobicContact CB-CG1 4.46Å; Q457-I681 HydrophobicContact CG-CB 4.33Å; Q457-I681 HydrophobicContact CG-CD1 4.21Å; Q457-I681 HydrophobicContact CG-CG1 4.11Å; Q461-I681 PolarHBondContact NE2-O 3.02Å; H678-I681 WeakPolarHBondContact O-CG1 3.49Å; H678-I681 PolarHBondContact O-N 3.13Å; S679-I681 PolarHBondContact O-N 3.35Å; S679-I681 VanDerWaalsContact O-N 3.12Å
682	E	93.5	Very high	83.2	Confident	150 Å²	150	62.1 Å²	62.1	70%	0.701	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-90.1	-15.8	178.6	-56.2	-172.4	157.6	0	0	112.4	S679 L680 L684	S679-E682 PolarHBondContact O-N 2.94Å; S679-E682 VanDerWaalsContact O-N 3.11Å; L680-E682 PolarHBondContact O-N 3.13Å; E682-L684 PolarHBondContact O-N 3.05Å
683	W	91.9	Very high	80.8	Confident	17 Å²	17	67.1 Å²	67.1	6%	0.064	38%	0.377	C	S	.	.			trans	-81	118.4	-178.8	174.9	79.1	0	0	0	111.2	Y424 M434 L438 L441 H442 I445 Q461 L680 G686 P689	Y424-W683 HydrophobicContact CD2-CE3 4.43Å; Y424-W683 HydrophobicContact CD2-CH2 4.05Å; Y424-W683 HydrophobicContact CD2-CZ2 4.47Å; Y424-W683 HydrophobicContact CD2-CZ3 4.01Å; Y424-W683 HydrophobicContact CE2-CD2 4.16Å; Y424-W683 AromaticContact CE2-CE2 3.81Å; Y424-W683 HydrophobicContact CE2-CE3 4.13Å; Y424-W683 AromaticContact CE2-CH2 3.49Å; Y424-W683 HydrophobicContact CE2-CH2 3.49Å; Y424-W683 VanDerWaalsContact CE2-CH2 3.49Å; Y424-W683 AromaticContact CE2-CZ2 3.51Å; Y424-W683 HydrophobicContact CE2-CZ2 3.51Å; Y424-W683 AromaticContact CE2-CZ3 3.8Å; Y424-W683 HydrophobicContact CE2-CZ3 3.8Å; M434-W683 HydrophobicContact CE-CH2 4.1Å; M434-W683 HydrophobicContact CE-CZ2 4.35Å; L438-W683 HydrophobicContact CD1-CH2 3.79Å; L441-W683 HydrophobicContact CD2-CZ3 4.43Å; H442-W683 AromaticContact CE1-CE3 3.69Å; H442-W683 AromaticContact CE1-CH2 3.65Å; H442-W683 AromaticContact CE1-CZ3 3.23Å; H442-W683 WeakPolarHBondContact CE1-CZ3 3.44Å; H442-W683 AromaticContact NE2-CH2 3.5Å; H442-W683 WeakPolarHBondContact NE2-CH2 3.3Å; H442-W683 AromaticContact NE2-CZ3 3.48Å; H442-W683 WeakPolarHBondContact NE2-CZ3 3.5Å; I445-W683 HydrophobicContact CD1-CE3 3.84Å; I445-W683 HydrophobicContact CD1-CZ3 3.96Å; Q461-W683 PolarHBondContact NE2-O 2.81Å; L680-W683 PolarHBondContact O-N 3.26Å; L680-W683 VanDerWaalsContact O-N 3.11Å; W683-G686 PolarHBondContact NE1-O 3.36Å; W683-P689 HydrophobicContact CB-CG 4.23Å
684	L	87.2	Confident	78	Confident	55 Å²	55	66.4 Å²	66.4	29%	0.288	38%	0.379	S	S	.	.	S	Bend	trans	-113.5	-46	172.1	-65.3	175.3	0	0	0	111.4	H442 N460 Q461 Y464 E682	H442-L684 PolarHBondContact CE1-O 3.09Å; H442-L684 PolarHBondContact NE2-O 3.13Å; N460-L684 HydrophobicContact CB-CD1 4.36Å; N460-L684 HydrophobicContact CB-CD2 4.34Å; Q461-L684 HydrophobicContact CG-CD2 4.41Å; Y464-L684 HydrophobicContact CD2-CB 4.43Å; Y464-L684 WeakPolarHBondContact CE1-O 3.29Å; Y464-L684 HydrophobicContact CG-CB 4.49Å; Y464-L684 HydrophobicContact CG-CD2 4.24Å; Y464-L684 VanDerWaalsContact CZ-O 3.22Å; Y464-L684 PolarHBondContact OH-O 2.93Å; E682-L684 PolarHBondContact O-N 3.05Å
685	D	82	Confident	75	Confident	109 Å²	109	69.4 Å²	69.4	58%	0.583	38%	0.382	S	S	*	.	S	Bend	trans	-148.5	160	-179.9	-162.2	-4.5	0	0	0	109.2
686	G	76.3	Confident	71.9	Confident	35 Å²	35	75.1 Å²	75.1	36%	0.361	42%	0.415	S	S	.	.	S	Bend	trans	93.9	-173.2	179.6	0	0	0	0	0	114.9	W683	W683-G686 PolarHBondContact NE1-O 3.36Å
687	P	69	Low	69	Low	120 Å²	120	78.6 Å²	78.6	78%	0.779	44%	0.435	S	S	*	.	S	Bend	trans	-64.3	148	-177.8	27.9	-33.7	0	0	0	111.2
688	L	64.2	Low	65.8	Low	37 Å²	37	81.6 Å²	81.6	19%	0.194	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-53.8	134.5	177.3	-176.2	70.4	0	0	0	110.6	Y424 L680 E690 L691	Y424-L688 HydrophobicContact CD1-CD1 3.69Å; Y424-L688 HydrophobicContact CD1-CD2 4.31Å; Y424-L688 HydrophobicContact CD1-CG 4.45Å; Y424-L688 HydrophobicContact CD2-CD1 4.43Å; Y424-L688 HydrophobicContact CE1-CB 3.85Å; Y424-L688 HydrophobicContact CE1-CD1 3.42Å; Y424-L688 VanDerWaalsContact CE1-CD1 3.42Å; Y424-L688 HydrophobicContact CE1-CD2 3.98Å; Y424-L688 HydrophobicContact CE1-CG 3.9Å; Y424-L688 HydrophobicContact CE2-CD1 4.18Å; Y424-L688 HydrophobicContact CG-CD1 4.22Å; L680-L688 HydrophobicContact CD2-CD1 3.64Å; L688-E690 PolarHBondContact O-N 3.27Å; L688-L691 HydrophobicContact CD1-CD1 3.81Å; L688-L691 HydrophobicContact CD1-CG 4.1Å; L688-L691 HydrophobicContact CD2-CB 4.12Å; L688-L691 HydrophobicContact CD2-CD1 3.84Å; L688-L691 HydrophobicContact CD2-CG 3.89Å; L688-L691 HydrophobicContact CG-CD1 4.21Å; L688-L691 HydrophobicContact CG-CG 4.1Å
689	P	64.5	Low	62.6	Low	45 Å²	45	84.6 Å²	84.6	29%	0.292	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-56.2	131.1	164.3	-17.5	29.5	0	0	0	108.4	W683 L691	W683-P689 HydrophobicContact CB-CG 4.23Å; P689-L691 VanDerWaalsContact C-N 3.34Å; P689-L691 PolarHBondContact O-N 3.07Å
690	E	58.8	Low	59.5	Low	195 Å²	195	89.8 Å²	89.8	91%	0.911	52%	0.519	S	S	*	.			trans	-47.4	92.7	-175.3	-75.8	-177.1	169.2	0	0	112.6	L688 Q692	L688-E690 PolarHBondContact O-N 3.27Å; E690-Q692 PolarHBondContact O-N 3.21Å
691	L	64	Low	56.4	Low	26 Å²	26	94 Å²	94	14%	0.136	55%	0.549	C	S	.	.			trans	-77.7	104.8	168.8	-65.3	-177.6	0	0	0	104.4	P676 E677 L680 L688 P689	P676-L691 HydrophobicContact CB-CD2 4.13Å; P676-L691 VanDerWaalsContact O-CD2 3.25Å; P676-L691 WeakPolarHBondContact O-CD2 3.42Å; E677-L691 HydrophobicContact CG-CD2 4.48Å; L680-L691 HydrophobicContact CD2-CD1 4.38Å; L688-L691 HydrophobicContact CD1-CD1 3.81Å; L688-L691 HydrophobicContact CD1-CG 4.1Å; L688-L691 HydrophobicContact CD2-CB 4.12Å; L688-L691 HydrophobicContact CD2-CD1 3.84Å; L688-L691 HydrophobicContact CD2-CG 3.89Å; L688-L691 HydrophobicContact CG-CD1 4.21Å; L688-L691 HydrophobicContact CG-CG 4.1Å; P689-L691 VanDerWaalsContact C-N 3.34Å; P689-L691 PolarHBondContact O-N 3.07Å
692	Q	47.1	Very low	53.2	Low	135 Å²	135	100.3 Å²	100.3	63%	0.631	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-48.5	134.8	171	-74.2	-177.6	-9.9	0	0	108.4	E690	E690-Q692 PolarHBondContact O-N 3.21Å
693	P	44.3	Very low	50.5	Low	105 Å²	105	99.2 Å²	99.2	68%	0.682	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-54.6	143.8	177.1	22.3	-31.1	0	0	0	108.8	H695	P693-H695 PolarHBondContact O-N 3.3Å; P693-H695 VanDerWaalsContact O-N 3.09Å
694	P	38.1	Very low	47.5	Very low	84 Å²	84	105.7 Å²	105.7	55%	0.545	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-53.3	126.5	-178.4	22.6	-32.2	0	0	0	107.1	T696	P694-T696 VanDerWaalsContact C-N 3.31Å; P694-T696 PolarHBondContact O-N 3.4Å
695	H	31.8	Very low	44.7	Very low	167 Å²	167	110.8 Å²	110.8	77%	0.773	65%	0.649	S	S	*	*			trans	-48.9	100.6	176.4	-69.8	-75.8	0	0	0	108.2	P693 V697	P693-H695 PolarHBondContact O-N 3.3Å; P693-H695 VanDerWaalsContact O-N 3.09Å; H695-V697 PolarHBondContact O-N 3.4Å
696	T	30	Very low	42.4	Very low	131 Å²	131	117.3 Å²	117.3	80%	0.804	68%	0.683	S	S	*	*			trans	-54.2	115.1	151.4	21.6	0	0	0	0	103.4	P694 A698	P694-T696 VanDerWaalsContact C-N 3.31Å; P694-T696 PolarHBondContact O-N 3.4Å; T696-A698 PolarHBondContact O-N 2.79Å
697	V	31.5	Very low	40.7	Very low	136 Å²	136	121.5 Å²	121.5	82%	0.824	70%	0.699	S	S	*	*			trans	-39.9	110.1	174.2	175.5	0	0	0	0	106.1	H695 S699	H695-V697 PolarHBondContact O-N 3.4Å; V697-S699 PolarHBondContact O-N 2.89Å
698	A	27.3	Very low	39.2	Very low	84 Å²	84	121.5 Å²	121.5	69%	0.694	69%	0.694	S	S	*	*			trans	-55.5	110.6	-180	0	0	0	0	0	105.3	T696 T700	T696-A698 PolarHBondContact O-N 2.79Å; A698-T700 VanDerWaalsContact C-N 3.34Å; A698-T700 PolarHBondContact O-N 2.88Å
699	S	28.8	Very low	37.8	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	72%	0.722	S	S	*	*			trans	-52.7	108.7	165.4	47.3	0	0	0	0	105.1	V697 S701	V697-S699 PolarHBondContact O-N 2.89Å; S699-S701 PolarHBondContact O-N 3.25Å; S699-S701 PolarHBondContact O-OG 2.96Å
700	T	29.8	Very low	36.2	Very low	145 Å²	145	131 Å²	131	89%	0.89	75%	0.747	S	S	*	*			trans	-56.9	93.1	172.6	45.9	0	0	0	0	107	A698	A698-T700 VanDerWaalsContact C-N 3.34Å; A698-T700 PolarHBondContact O-N 2.88Å
701	S	28.6	Very low	34.8	Very low	92 Å²	92	127 Å²	127	64%	0.643	74%	0.737	S	S	*	*			trans	-111.5	83.2	167.4	38.4	0	0	0	0	103.5	S699	S699-S701 PolarHBondContact O-N 3.25Å; S699-S701 PolarHBondContact O-OG 2.96Å
702	D	28.8	Very low	32.9	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	78%	0.777	S	S	*	*			trans	-171.6	83.2	153.4	-90.6	-21.4	0	0	0	108
703	T	35.5	Very low	31.9	Very low	128 Å²	128	133.6 Å²	133.6	79%	0.785	79%	0.788	S	S	*	*			trans	-139.4	86.8	146.9	-0.4	0	0	0	0	106.4	L705	T703-L705 PolarHBondContact O-N 2.93Å; T703-L705 VanDerWaalsContact O-N 3.1Å
704	N	30.2	Very low	30.9	Very low	152 Å²	152	135.8 Å²	135.8	81%	0.813	80%	0.796	S	S	*	*			trans	-55.6	109.3	160	-76.1	-41	0	0	0	108.1
705	L	28.2	Very low	30.3	Very low	163 Å²	163	140.2 Å²	140.2	85%	0.853	82%	0.817	S	S	*	*			trans	-120.8	77.3	159.5	-90	165.4	0	0	0	107.2	T703	T703-L705 PolarHBondContact O-N 2.93Å; T703-L705 VanDerWaalsContact O-N 3.1Å
706	L	33.2	Very low	30.2	Very low	246 Å²	246	137.7 Å²	137.7	100%	1.288	82%	0.821	S	S	*	*			trans	-167.4	0	140.2	-99.6	164.9	0	0	0	108.9

Retrieved 706 of 706 residues in 307.1 ms (Link to these results)

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