A0A087Y496_POEFO Loading...

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AlphaFold DB , UniProt , Accession A0A087Y496, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 728 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	23.2	Very low	26.4	Very low	241 Å²	241	169.2 Å²	169.2	100%	1.187	84%	0.839	S	S	*	*				0	147.2	0	-81.9	-173.9	170.7	0	0	108.3
2	P	44.6	Very low	26.2	Very low	99 Å²	99	171.1 Å²	171.1	64%	0.643	84%	0.843	S	S	*	*			cis	-140.7	165.7	-38.8	38.1	-21.4	0	0	0	114.1
3	K	27.8	Very low	25.9	Very low	185 Å²	185	166.2 Å²	166.2	80%	0.804	84%	0.836	S	S	*	*			trans	65.8	142.6	139.8	-73.5	171.4	-173	-174.1	0	118.4
4	N	25.8	Very low	26.1	Very low	148 Å²	148	166.4 Å²	166.4	79%	0.791	84%	0.841	S	S	*	*			cis	-166.4	156.4	35.4	-113.8	-11.5	0	0	0	112.4
5	T	27.1	Very low	25.9	Very low	116 Å²	116	166.2 Å²	166.2	71%	0.712	84%	0.836	S	S	*	*			trans	-76.8	157.2	177.9	-37.1	0	0	0	0	114.7	V7	T5-V7 HydrophobicContact CG2-CG2 4.25Å
6	K	24.8	Very low	26	Very low	201 Å²	201	163.1 Å²	163.1	87%	0.874	83%	0.831	S	S	*	*			trans	180	112.2	143.4	-97.4	172.7	-174.4	-171.2	0	106.4
7	V	24.2	Very low	26.2	Very low	123 Å²	123	161.1 Å²	161.1	75%	0.745	83%	0.828	S	S	*	*				48.8	105	63.5	-169.7	0	0	0	0	115	T5	T5-V7 HydrophobicContact CG2-CG2 4.25Å
8	T	25	Very low	26.4	Very low	132 Å²	132	159.1 Å²	159.1	81%	0.81	82%	0.824	S	S	*	*			trans	-154.9	99.6	152.2	37.3	0	0	0	0	106.5
9	Q	23.2	Very low	26.8	Very low	183 Å²	183	158.6 Å²	158.6	86%	0.855	82%	0.818	S	S	*	*				73	105.1	90.6	-152.9	168.4	9.7	0	0	112.7
10	R	21.8	Very low	27.1	Very low	245 Å²	245	154.1 Å²	154.1	93%	0.925	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.5	119.6	171.3	-111.2	176	174.7	171.8	-2.7	108.2
11	E	22.7	Very low	27.5	Very low	188 Å²	188	152.1 Å²	152.1	88%	0.879	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.8	136.6	159.7	-94.1	178.8	152.5	0	0	109.6
12	H	23.7	Very low	28.1	Very low	192 Å²	192	143.6 Å²	143.6	89%	0.889	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.1	123.4	168.9	-88.8	-7.8	0	0	0	109.4
13	S	22.7	Very low	27.7	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	76%	0.757	S	S	*	*			trans	-119.9	115.1	160.3	55.3	0	0	0	0	109.1	E15	S13-E15 PolarHBondContact O-N 3.47Å
14	N	28.2	Very low	28.3	Very low	168 Å²	168	140.1 Å²	140.1	90%	0.898	75%	0.747	S	S	*	*			trans	-73.9	105.4	165.2	-85.5	-21.3	0	0	0	108.4
15	E	24.2	Very low	28.8	Very low	164 Å²	164	139.6 Å²	139.6	77%	0.766	74%	0.744	S	S	*	*			trans	-139	144.5	159.9	-81.5	-168.7	155.7	0	0	109.8	S13 V17	S13-E15 PolarHBondContact O-N 3.47Å; E15-V17 PolarHBondContact O-N 2.94Å
16	P	26.7	Very low	29.1	Very low	117 Å²	117	138 Å²	138	76%	0.76	74%	0.737	S	S	*	*			trans	-70.9	116.9	179.5	29	-31.9	0	0	0	109.7	T18	P16-T18 PolarHBondContact O-N 3.3Å
17	V	28.8	Very low	29.6	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	74%	0.736	S	S	*	*			trans	-73.4	94.2	175.6	-176.2	0	0	0	0	108.7	E15 E19	E15-V17 PolarHBondContact O-N 2.94Å; V17-E19 HydrophobicContact CG1-CG 4.02Å; V17-E19 PolarHBondContact O-N 3.35Å
18	T	29.8	Very low	30	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	74%	0.738	S	S	*	*			trans	-81.8	100.6	159	52.4	0	0	0	0	107.6	P16 S20	P16-T18 PolarHBondContact O-N 3.3Å; T18-S20 PolarHBondContact O-N 3.39Å
19	E	35.5	Very low	30	Very low	151 Å²	151	140.9 Å²	140.9	71%	0.706	74%	0.74	S	S	*	*			trans	-64.7	123.4	171.1	-72.9	-177.3	157.7	0	0	109.5	V17	V17-E19 HydrophobicContact CG1-CG 4.02Å; V17-E19 PolarHBondContact O-N 3.35Å
20	S	31.6	Very low	30.3	Very low	67 Å²	67	137.3 Å²	137.3	47%	0.469	73%	0.733	S	S	.	*			trans	-84.8	150.3	177.6	171.1	0	0	0	0	110.6	T18 A22 D23	T18-S20 PolarHBondContact O-N 3.39Å; S20-A22 PolarHBondContact O-N 3.39Å; S20-A22 PolarHBondContact OG-N 3.49Å; S20-D23 PolarHBondContact O-N 3.44Å
21	V	36.4	Very low	30.6	Very low	114 Å²	114	134.3 Å²	134.3	69%	0.691	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-23.6	176.7	178.3	0	0	0	0	112.8
22	A	34.9	Very low	30.7	Very low	62 Å²	62	132.7 Å²	132.7	51%	0.512	73%	0.729	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-31.9	175.6	0	0	0	0	0	113.7	S20 L24 L25	S20-A22 PolarHBondContact O-N 3.39Å; S20-A22 PolarHBondContact OG-N 3.49Å; A22-L24 VanDerWaalsContact C-N 3.3Å; A22-L24 PolarHBondContact O-N 3.28Å; A22-L25 PolarHBondContact O-N 3.01Å
23	D	37.6	Very low	30.8	Very low	95 Å²	95	134.3 Å²	134.3	51%	0.508	73%	0.729	S	S	.	*	G	3₁₀ helix	trans	-71	-29.9	179.1	-68.8	-36.5	0	0	0	111.3	S20 L25 S26	S20-D23 PolarHBondContact O-N 3.44Å; D23-L25 PolarHBondContact O-N 3.14Å; D23-S26 PolarHBondContact O-N 3.08Å; D23-S26 PolarHBondContact O-OG 3.46Å
24	L	40.1	Very low	31	Very low	115 Å²	115	138.9 Å²	138.9	60%	0.602	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-64.7	-20.4	172.7	-72.1	169.8	0	0	0	113.8	A22	A22-L24 VanDerWaalsContact C-N 3.3Å; A22-L24 PolarHBondContact O-N 3.28Å
25	L	35.3	Very low	30.9	Very low	137 Å²	137	136.2 Å²	136.2	72%	0.717	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-94.6	-5.7	-179.2	-65.7	172.4	0	0	0	113.4	A22 D23	A22-L25 PolarHBondContact O-N 3.01Å; D23-L25 PolarHBondContact O-N 3.14Å
26	S	33.2	Very low	30.9	Very low	82 Å²	82	134.2 Å²	134.2	57%	0.573	73%	0.734	S	S	*	*	S	Bend	trans	-100.2	-7.6	-167.8	70.5	0	0	0	0	115.8	D23 E28	D23-S26 PolarHBondContact O-N 3.08Å; D23-S26 PolarHBondContact O-OG 3.46Å; S26-E28 PolarHBondContact O-N 3.11Å
27	L	35.7	Very low	30.8	Very low	164 Å²	164	138.1 Å²	138.1	86%	0.859	74%	0.742	S	S	*	*			trans	-98.9	72.6	179.6	-69.3	171.6	0	0	0	111.4
28	E	32.8	Very low	30.6	Very low	168 Å²	168	140.8 Å²	140.8	79%	0.785	75%	0.748	S	S	*	*			trans	-113.3	91.6	169.7	-164.2	157.4	-153.5	0	0	110.1	S26	S26-E28 PolarHBondContact O-N 3.11Å
29	H	25.2	Very low	30.4	Very low	185 Å²	185	140.1 Å²	140.1	86%	0.856	75%	0.749	S	S	*	*			trans	-143.9	116.9	155.9	-88.9	-49	0	0	0	110.1
30	P	30.1	Very low	30.1	Very low	109 Å²	109	141.7 Å²	141.7	71%	0.708	76%	0.759	S	S	*	*			trans	-81	122.2	171.9	30.5	-28.3	0	0	0	109.7
31	M	26.7	Very low	29.8	Very low	181 Å²	181	141.6 Å²	141.6	89%	0.892	77%	0.768	S	S	*	*			trans	-91.6	100.7	164.1	-83.9	-80.8	-71	0	0	108.5	Y33	M31-Y33 PolarHBondContact O-N 3.49Å
32	D	24.7	Very low	29.2	Very low	154 Å²	154	144.2 Å²	144.2	82%	0.824	78%	0.777	S	S	*	*			trans	-66.3	118.9	170.9	-87.2	-40.9	0	0	0	110.6
33	Y	26.7	Very low	28.8	Very low	226 Å²	226	146.6 Å²	146.6	89%	0.886	79%	0.79	S	S	*	*			trans	-115.1	78.6	168.7	-155.8	-89.2	0	0	0	110.6	M31	M31-Y33 PolarHBondContact O-N 3.49Å
34	K	26.1	Very low	28.7	Very low	204 Å²	204	148.2 Å²	148.2	89%	0.887	81%	0.805	S	S	*	*			trans	-157	78.9	162.4	-103.9	-172.2	-171.9	178.2	0	111.7
35	S	25.9	Very low	28	Very low	113 Å²	113	146 Å²	146	79%	0.79	81%	0.811	S	S	*	*			trans	-176.5	111.2	143	55.9	0	0	0	0	110
36	S	24.4	Very low	27.6	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	82%	0.818	S	S	*	*			trans	174.4	81.5	142.2	-78.7	0	0	0	0	108.9
37	Q	25.4	Very low	27.3	Very low	200 Å²	200	148.2 Å²	148.2	94%	0.935	83%	0.832	S	S	*	*			trans	-95.2	103.6	148.3	-81.2	-168.2	-12	0	0	106.3
38	M	24.5	Very low	26.9	Very low	183 Å²	183	144.8 Å²	144.8	90%	0.901	83%	0.827	S	S	*	*			trans	-105.1	116.9	161.2	-110.5	-178	73.9	0	0	108
39	S	26.7	Very low	27	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	83%	0.831	S	S	*	*			trans	-64.7	133.2	171.9	-44.9	0	0	0	0	110.8
40	M	27.3	Very low	26.9	Very low	185 Å²	185	137.9 Å²	137.9	91%	0.911	83%	0.827	S	S	*	*			trans	-154.7	120.1	147.2	-96.7	-115.6	-96.2	0	0	108.6
41	G	25.4	Very low	26.6	Very low	64 Å²	64	144.2 Å²	144.2	66%	0.66	84%	0.837	S	S	*	*			trans	-88.1	144.7	167.2	0	0	0	0	0	110.8
42	L	24.7	Very low	26.5	Very low	170 Å²	170	141 Å²	141	89%	0.89	83%	0.832	S	S	*	*				174.2	132.2	119.6	-113.7	86.3	0	0	0	111.8
43	S	26.2	Very low	26.7	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	83%	0.833	S	S	*	*			trans	66.8	153.7	143.1	-78.4	0	0	0	0	124.5
44	P	36	Very low	26.6	Very low	128 Å²	128	138.2 Å²	138.2	83%	0.831	83%	0.831	S	S	*	*			trans	-109.5	150.1	-150.6	38.7	-27.6	0	0	0	114.3
45	G	25.8	Very low	26.8	Very low	69 Å²	69	133.9 Å²	133.9	71%	0.711	82%	0.823	S	S	*	*			trans	165.8	131.2	163.6	0	0	0	0	0	116.1
46	S	26.4	Very low	26.9	Very low	125 Å²	125	136.5 Å²	136.5	87%	0.874	82%	0.823	S	S	*	*			trans	88.7	109.8	160.7	72.1	0	0	0	0	120.4
47	T	26.6	Very low	27.2	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	82%	0.82	S	S	*	*			trans	-59.5	152.4	150.4	37	0	0	0	0	110.3
48	A	27.4	Very low	27.7	Very low	93 Å²	93	136.5 Å²	136.5	77%	0.769	82%	0.815	S	S	*	*			cis	-164.7	-159.9	31.6	0	0	0	0	0	110.5
49	P	34.4	Very low	28.2	Very low	132 Å²	132	132.2 Å²	132.2	86%	0.857	81%	0.809	S	S	*	*				-107.7	144.9	-106.1	34.2	-16.1	0	0	0	114.3
50	G	23.6	Very low	28.8	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	81%	0.809	S	S	*	*			trans	-144.4	105.6	177.5	0	0	0	0	0	112.6
51	R	24.6	Very low	30	Very low	242 Å²	242	131.2 Å²	131.2	91%	0.913	79%	0.793	S	S	*	*			trans	37.9	101.7	157.3	-103.9	171.3	173.9	160.8	-2.7	116.6	L53	R51-L53 PolarHBondContact O-N 3.06Å
52	S	23.1	Very low	31.9	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	80%	0.804	S	S	*	*			trans	-58.3	99.9	156.9	52.2	0	0	0	0	109.5	L54	S52-L54 PolarHBondContact O-N 3.36Å
53	L	28.9	Very low	34.5	Very low	162 Å²	162	126.2 Å²	126.2	85%	0.848	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-58.5	117.6	150.1	-82.8	152.3	0	0	0	105.8	R51	R51-L53 PolarHBondContact O-N 3.06Å
54	L	26.3	Very low	37.2	Very low	160 Å²	160	123.4 Å²	123.4	84%	0.838	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-52.3	127.4	171.4	-70.5	161.3	0	0	0	107.7	S52 E56	S52-L54 PolarHBondContact O-N 3.36Å; L54-E56 PolarHBondContact O-N 3.29Å
55	P	29.3	Very low	39.7	Very low	113 Å²	113	119.7 Å²	119.7	73%	0.734	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-62.3	135.5	169.5	-11.4	25.6	0	0	0	108.3	Q57	P55-Q57 PolarHBondContact O-N 3.44Å
56	E	28.6	Very low	42.7	Very low	169 Å²	169	117.5 Å²	117.5	79%	0.79	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-46.7	125.7	164.7	-82.5	169.7	136.3	0	0	109.5	L54 D58	L54-E56 PolarHBondContact O-N 3.29Å; E56-D58 PolarHBondContact O-N 3.09Å; E56-D58 VanDerWaalsContact O-N 3.09Å
57	Q	29.3	Very low	45.6	Very low	164 Å²	164	116.4 Å²	116.4	77%	0.766	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-70.8	4.5	-176.9	-101.3	171.9	-30.6	0	0	114.1	P55 A59	P55-Q57 PolarHBondContact O-N 3.44Å; Q57-A59 VanDerWaalsContact C-N 3.34Å; Q57-A59 PolarHBondContact O-N 3.24Å
58	D	36.5	Very low	48.6	Very low	157 Å²	157	114.5 Å²	114.5	84%	0.84	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-88	3.3	-172.2	-69.9	-36.9	0	0	0	114.7	E56	E56-D58 PolarHBondContact O-N 3.09Å; E56-D58 VanDerWaalsContact O-N 3.09Å
59	A	35.8	Very low	51.6	Low	93 Å²	93	113.7 Å²	113.7	77%	0.769	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-97.3	10.6	179.4	0	0	0	0	0	114.9	Q57	Q57-A59 VanDerWaalsContact C-N 3.34Å; Q57-A59 PolarHBondContact O-N 3.24Å
60	E	39.3	Very low	54.3	Low	167 Å²	167	111.5 Å²	111.5	78%	0.78	63%	0.627	S	S	*	*	S	Bend	trans	-86.7	-14.5	-163	-92.1	-165.2	156.7	0	0	118.2
61	D	51.3	Low	57.6	Low	108 Å²	108	108.1 Å²	108.1	58%	0.578	59%	0.591	S	S	*	*	S	Bend	trans	-109.3	-8	-171.1	-101	-24.5	0	0	0	117.3	R63 R328	D61-R63 PolarHBondContact O-N 3.45Å; D61-R328 IonicContact OD2-NH2 3.37Å
62	G	65	Low	60.8	Low	86 Å²	86	96.6 Å²	96.6	89%	0.887	55%	0.548	S	S	*	.			trans	56.7	3.5	176.8	0	0	0	0	0	116.7
63	R	81	Confident	64.3	Low	43 Å²	43	92 Å²	92	16%	0.162	51%	0.514	C	S	.	.			trans	-75.4	134.6	178.6	-168	-180	-173.8	106.8	8.1	108.7	D61 R128 S324 Y325 D490	D61-R63 PolarHBondContact O-N 3.45Å; R63-R128 PolarHBondContact NH1-O 2.91Å; R63-S324 VanDerWaalsContact CZ-OG 3.28Å; R63-S324 PolarHBondContact NE-O 2.95Å; R63-S324 PolarHBondContact NE-OG 3.16Å; R63-S324 PolarHBondContact NH2-OG 3.24Å; R63-Y325 HydrophobicContact CG-CD1 3.77Å; R63-Y325 HydrophobicContact CG-CE1 3.8Å; R63-Y325 VanDerWaalsContact NE-CD1 3.31Å; R63-Y325 VanDerWaalsContact NE-CE1 3.25Å; R63-D490 IonicContact CZ-OD2 2.84Å; R63-D490 IonicContact NH1-OD1 3.69Å; R63-D490 PolarHBondContact NH1-OD1 3Å; R63-D490 IonicContact NH1-OD2 3.87Å; R63-D490 PolarHBondContact NH1-OD2 3.08Å; R63-D490 IonicContact NH2-OD2 3.14Å; R63-D490 PolarHBondContact NH2-OD2 3.08Å
64	P	82.4	Confident	67.4	Low	52 Å²	52	85.1 Å²	85.1	34%	0.338	48%	0.478	S	S	.	.			trans	-61.9	146.7	177.3	28	-35.8	0	0	0	110.4	I249 Y325	P64-I249 HydrophobicContact CB-CD1 3.96Å; P64-I249 HydrophobicContact CB-CG1 4.33Å; P64-I249 HydrophobicContact CG-CD1 4.16Å; P64-I249 HydrophobicContact CG-CG1 4.46Å; P64-Y325 HydrophobicContact CG-CD1 4.12Å; P64-Y325 HydrophobicContact CG-CE1 3.9Å; P64-Y325 WeakPolarHBondContact O-CD1 3.34Å
65	A	87.7	Confident	70.6	Confident	50 Å²	50	77.6 Å²	77.6	41%	0.413	44%	0.438	S	S	.	.			trans	-113.4	160	175.6	0	0	0	0	0	110.5	Y325	A65-Y325 WeakPolarHBondContact CA-O 3.48Å
66	W	90.1	Very high	73.7	Confident	24 Å²	24	72.2 Å²	72.2	9%	0.091	40%	0.404	C	S	.	.			trans	-61.9	143.3	167.5	-63.9	106.6	0	0	0	110.1	E71 Y72 A75 I249 F322	W66-E71 HydrophobicContact CE3-CB 4.49Å; W66-E71 HydrophobicContact CE3-CG 3.96Å; W66-E71 HydrophobicContact CZ3-CG 4.22Å; W66-Y72 AromaticContact CD1-CD2 3.93Å; W66-Y72 AromaticContact CE2-CD2 3.89Å; W66-Y72 HydrophobicContact CZ2-CD2 4.33Å; W66-Y72 AromaticContact NE1-CD2 3.46Å; W66-A75 HydrophobicContact CH2-CB 3.64Å; W66-A75 HydrophobicContact CZ2-CB 4.29Å; W66-A75 HydrophobicContact CZ3-CB 4.09Å; W66-I249 HydrophobicContact CE3-CB 4.3Å; W66-I249 HydrophobicContact CH2-CB 3.99Å; W66-I249 HydrophobicContact CH2-CG2 3.93Å; W66-I249 HydrophobicContact CZ2-CB 4.36Å; W66-I249 HydrophobicContact CZ2-CG2 3.97Å; W66-I249 HydrophobicContact CZ3-CB 3.95Å; W66-I249 HydrophobicContact CZ3-CG2 4.4Å; W66-F322 HydrophobicContact CH2-CD1 4.09Å; W66-F322 HydrophobicContact CH2-CE1 4.25Å; W66-F322 HydrophobicContact CZ2-CB 4.3Å; W66-F322 AromaticContact CZ2-CD1 3.7Å; W66-F322 HydrophobicContact CZ2-CD1 3.7Å; W66-F322 HydrophobicContact CZ2-CE1 4.32Å; W66-F322 HydrophobicContact CZ2-CG 4.23Å; W66-F322 PolarHBondContact NE1-O 3.33Å; W66-F322 VanDerWaalsContact NE1-O 3.12Å
67	N	86.6	Confident	76.8	Confident	102 Å²	102	64.5 Å²	64.5	55%	0.545	37%	0.368	S	S	.	.	S	Bend	trans	-69.8	-48	179.1	-53.2	-63	0	0	0	109.6	E71	N67-E71 VanDerWaalsContact CB-OE2 3.28Å; N67-E71 WeakPolarHBondContact CB-OE2 3.47Å; N67-E71 PolarHBondContact N-OE2 2.94Å; N67-E71 PolarHBondContact ND2-OE1 2.97Å; N67-E71 PolarHBondContact ND2-OE2 3.16Å
68	N	89	Confident	79.9	Confident	99 Å²	99	56.9 Å²	56.9	53%	0.529	33%	0.333	S	S	.	.			trans	-132.1	155	-177.6	-65.8	-3.8	0	0	0	111.4	L70 E71 Y72	N68-L70 VanDerWaalsContact C-N 3.3Å; N68-L70 PolarHBondContact O-N 3.12Å; N68-E71 WeakPolarHBondContact O-CB 3.33Å; N68-E71 PolarHBondContact O-N 3.48Å; N68-Y72 PolarHBondContact O-N 3.25Å
69	K	90.6	Very high	82.6	Confident	77 Å²	77	49.9 Å²	49.9	34%	0.335	30%	0.296	S	S	.	.	H	α-helix	trans	-61.2	-37.5	175.7	-173.9	170.9	-177.6	174.7	0	112.4	E71 Y72 I73 D335	K69-E71 VanDerWaalsContact C-N 3.32Å; K69-E71 PolarHBondContact O-N 3.38Å; K69-Y72 WeakPolarHBondContact O-CB 3.45Å; K69-Y72 PolarHBondContact O-N 2.94Å; K69-I73 HydrophobicContact CG-CG1 4.4Å; K69-I73 WeakPolarHBondContact O-CG1 3.42Å; K69-I73 PolarHBondContact O-N 3.45Å; K69-D335 WeakPolarHBondContact CE-OD1 3.44Å; K69-D335 IonicContact NZ-OD1 2.98Å; K69-D335 PolarHBondContact NZ-OD1 3.36Å; K69-D335 VanDerWaalsContact NZ-OD1 3.14Å
70	L	90.9	Very high	85.3	Confident	85 Å²	85	45.6 Å²	45.6	45%	0.445	26%	0.26	S	S	.	.	H	α-helix	trans	-60.2	-41.3	176.8	-178.1	63.6	0	0	0	112	N68 Y72 I73 L74 Y257	N68-L70 VanDerWaalsContact C-N 3.3Å; N68-L70 PolarHBondContact O-N 3.12Å; L70-Y72 VanDerWaalsContact C-N 3.29Å; L70-Y72 PolarHBondContact O-N 3.28Å; L70-I73 PolarHBondContact O-N 3.33Å; L70-L74 HydrophobicContact CD1-CD1 4.13Å; L70-L74 HydrophobicContact CD1-CD2 4.48Å; L70-L74 HydrophobicContact CD1-CG 4.03Å; L70-L74 HydrophobicContact CG-CD1 3.92Å; L70-L74 HydrophobicContact CG-CG 4.23Å; L70-L74 WeakPolarHBondContact O-CB 3.48Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.44Å; L70-L74 PolarHBondContact O-N 3.3Å; L70-Y257 HydrophobicContact CD2-CE1 3.92Å; L70-Y257 HydrophobicContact CG-CE1 4.19Å
71	E	92.6	Very high	87.8	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-41.6	177.9	-169.1	177.5	-174	0	0	111.2	W66 N67 N68 K69 A75 G253 Y257	W66-E71 HydrophobicContact CE3-CB 4.49Å; W66-E71 HydrophobicContact CE3-CG 3.96Å; W66-E71 HydrophobicContact CZ3-CG 4.22Å; N67-E71 VanDerWaalsContact CB-OE2 3.28Å; N67-E71 WeakPolarHBondContact CB-OE2 3.47Å; N67-E71 PolarHBondContact N-OE2 2.94Å; N67-E71 PolarHBondContact ND2-OE1 2.97Å; N67-E71 PolarHBondContact ND2-OE2 3.16Å; N68-E71 WeakPolarHBondContact O-CB 3.33Å; N68-E71 PolarHBondContact O-N 3.48Å; K69-E71 VanDerWaalsContact C-N 3.32Å; K69-E71 PolarHBondContact O-N 3.38Å; E71-A75 VanDerWaalsContact O-CB 3.3Å; E71-A75 WeakPolarHBondContact O-CB 3.34Å; E71-A75 PolarHBondContact O-N 3.09Å; E71-G253 VanDerWaalsContact OE1-C 3.27Å; E71-G253 WeakPolarHBondContact OE1-CA 3.42Å; E71-Y257 HydrophobicContact CB-CE2 4.25Å; E71-Y257 HydrophobicContact CG-CE2 4.07Å
72	Y	93.4	Very high	89.5	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-48.5	174.3	165.8	-113.4	0	0	0	112.4	W66 N68 K69 L70 L74 A75 Q76 L121 F322 N326 D335	W66-Y72 AromaticContact CD1-CD2 3.93Å; W66-Y72 AromaticContact CE2-CD2 3.89Å; W66-Y72 HydrophobicContact CZ2-CD2 4.33Å; W66-Y72 AromaticContact NE1-CD2 3.46Å; N68-Y72 PolarHBondContact O-N 3.25Å; K69-Y72 WeakPolarHBondContact O-CB 3.45Å; K69-Y72 PolarHBondContact O-N 2.94Å; L70-Y72 VanDerWaalsContact C-N 3.29Å; L70-Y72 PolarHBondContact O-N 3.28Å; Y72-L74 PolarHBondContact O-N 3.36Å; Y72-A75 WeakPolarHBondContact O-CB 3.5Å; Y72-A75 PolarHBondContact O-N 3Å; Y72-Q76 PolarHBondContact O-N 2.84Å; Y72-L121 VanDerWaalsContact OH-CD2 3.26Å; Y72-L121 WeakPolarHBondContact OH-CD2 3.24Å; Y72-F322 HydrophobicContact CE2-CB 4.25Å; Y72-N326 WeakPolarHBondContact CE1-ND2 3.2Å; Y72-D335 HydrophobicContact CE1-CB 4.28Å; Y72-D335 WeakPolarHBondContact CE1-OD2 3.41Å
73	I	94.8	Very high	90.4	Very high	17 Å²	17	28.8 Å²	28.8	9%	0.087	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-43.9	179.6	-64.9	-62.7	0	0	0	111	K69 L70 A75 Q76 V77 D335 L338	K69-I73 HydrophobicContact CG-CG1 4.4Å; K69-I73 WeakPolarHBondContact O-CG1 3.42Å; K69-I73 PolarHBondContact O-N 3.45Å; L70-I73 PolarHBondContact O-N 3.33Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.33Å; I73-Q76 PolarHBondContact O-N 2.96Å; I73-V77 HydrophobicContact CG2-CG2 4.18Å; I73-V77 WeakPolarHBondContact O-CB 3.33Å; I73-V77 VanDerWaalsContact O-CG2 3.29Å; I73-V77 WeakPolarHBondContact O-CG2 3.31Å; I73-V77 PolarHBondContact O-N 3.27Å; I73-D335 HydrophobicContact CD1-CB 3.83Å; I73-L338 HydrophobicContact CG2-CD2 4.22Å
74	L	94.4	Very high	90.6	Very high	17 Å²	17	27.1 Å²	27.1	9%	0.089	15%	0.152	C	C	.	.	H	α-helix	trans	-64.8	-35.5	176.6	-68	177.9	0	0	0	112.1	L70 Y72 G78 M256 Y257 L261	L70-L74 HydrophobicContact CD1-CD1 4.13Å; L70-L74 HydrophobicContact CD1-CD2 4.48Å; L70-L74 HydrophobicContact CD1-CG 4.03Å; L70-L74 HydrophobicContact CG-CD1 3.92Å; L70-L74 HydrophobicContact CG-CG 4.23Å; L70-L74 WeakPolarHBondContact O-CB 3.48Å; L70-L74 VanDerWaalsContact O-CG 3.29Å; L70-L74 WeakPolarHBondContact O-CG 3.44Å; L70-L74 PolarHBondContact O-N 3.3Å; Y72-L74 PolarHBondContact O-N 3.36Å; L74-G78 PolarHBondContact O-N 3.07Å; L74-M256 WeakPolarHBondContact O-CE 3.43Å; L74-Y257 HydrophobicContact CD1-CD1 3.49Å; L74-Y257 VanDerWaalsContact CD1-CD1 3.49Å; L74-Y257 HydrophobicContact CD1-CE1 3.76Å; L74-Y257 HydrophobicContact CD1-CG 4.24Å; L74-L261 HydrophobicContact CD2-CD2 3.95Å; L74-L261 HydrophobicContact CD2-CG 4.36Å
75	A	93.8	Very high	91	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-64.8	-43	173.3	0	0	0	0	0	112.1	W66 E71 Y72 I73 F79 M256	W66-A75 HydrophobicContact CH2-CB 3.64Å; W66-A75 HydrophobicContact CZ2-CB 4.29Å; W66-A75 HydrophobicContact CZ3-CB 4.09Å; E71-A75 VanDerWaalsContact O-CB 3.3Å; E71-A75 WeakPolarHBondContact O-CB 3.34Å; E71-A75 PolarHBondContact O-N 3.09Å; Y72-A75 WeakPolarHBondContact O-CB 3.5Å; Y72-A75 PolarHBondContact O-N 3Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.33Å; A75-F79 PolarHBondContact O-N 3.42Å; A75-M256 HydrophobicContact CB-CG 4.04Å
76	Q	94.7	Very high	90.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-68.3	-44.3	177.4	-167.1	64.5	51.1	0	0	111.5	Y72 I73 F79 S80 F117 V339	Y72-Q76 PolarHBondContact O-N 2.84Å; I73-Q76 PolarHBondContact O-N 2.96Å; Q76-F79 PolarHBondContact O-N 3.42Å; Q76-S80 WeakPolarHBondContact O-CB 3.46Å; Q76-S80 PolarHBondContact O-N 3.01Å; Q76-S80 PolarHBondContact O-OG 3.43Å; Q76-F117 HydrophobicContact CG-CZ 3.88Å; Q76-V339 HydrophobicContact CB-CG2 4.08Å; Q76-V339 HydrophobicContact CG-CB 4.39Å; Q76-V339 HydrophobicContact CG-CG1 3.96Å; Q76-V339 HydrophobicContact CG-CG2 3.78Å
77	V	94.8	Very high	90.6	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.042	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-46.1	175.3	168	0	0	0	0	110.7	I73 F79 S80 V81 Y264 V339 I342	I73-V77 HydrophobicContact CG2-CG2 4.18Å; I73-V77 WeakPolarHBondContact O-CB 3.33Å; I73-V77 VanDerWaalsContact O-CG2 3.29Å; I73-V77 WeakPolarHBondContact O-CG2 3.31Å; I73-V77 PolarHBondContact O-N 3.27Å; V77-F79 VanDerWaalsContact C-N 3.28Å; V77-F79 PolarHBondContact O-N 2.89Å; V77-S80 PolarHBondContact O-N 2.88Å; V77-V81 HydrophobicContact CG1-CG2 4.1Å; V77-V81 WeakPolarHBondContact O-CA 3.48Å; V77-V81 VanDerWaalsContact O-CB 3.22Å; V77-V81 WeakPolarHBondContact O-CB 3.42Å; V77-V81 WeakPolarHBondContact O-CG2 3.39Å; V77-V81 PolarHBondContact O-N 3.03Å; V77-Y264 HydrophobicContact CG1-CE2 4.4Å; V77-Y264 WeakPolarHBondContact CG1-OH 3.19Å; V77-V339 HydrophobicContact CG2-CG2 4.18Å; V77-I342 HydrophobicContact CG1-CG2 3.9Å; V77-I342 HydrophobicContact CG2-CD1 3.89Å; V77-I342 HydrophobicContact CG2-CG2 4.14Å
78	G	93.5	Very high	90.6	Very high	4 Å²	4	19.3 Å²	19.3	4%	0.041	10%	0.099	C	C	.	.	H	α-helix	trans	-76.3	-13.7	-179.3	0	0	0	0	0	114.4	L74 M256 G475 S476	L74-G78 PolarHBondContact O-N 3.07Å; G78-M256 VanDerWaalsContact CA-CE 3.41Å; G78-G475 CarbonylContact O-C 3.56Å; G78-G475 VanDerWaalsContact O-CA 3.27Å; G78-G475 WeakPolarHBondContact O-CA 3.31Å; G78-S476 PolarHBondContact O-N 3.09Å; G78-S476 VanDerWaalsContact O-N 3.15Å
79	F	93.8	Very high	90.8	Very high	11 Å²	11	14.6 Å²	14.6	5%	0.048	7%	0.073	C	C	.	.	H	α-helix	trans	-78.9	-44.9	166.4	175.1	-125.6	0	0	0	111.9	A75 Q76 V77 F316 V319 F322 S476 G479	A75-F79 PolarHBondContact O-N 3.42Å; Q76-F79 PolarHBondContact O-N 3.42Å; V77-F79 VanDerWaalsContact C-N 3.28Å; V77-F79 PolarHBondContact O-N 2.89Å; F79-F316 HydrophobicContact CZ-CB 4.23Å; F79-F316 HydrophobicContact CZ-CG 4.5Å; F79-V319 HydrophobicContact CD1-CG2 4.27Å; F79-V319 HydrophobicContact CE1-CG2 3.78Å; F79-F322 HydrophobicContact CB-CE2 3.77Å; F79-F322 HydrophobicContact CD1-CE2 4.3Å; F79-F322 HydrophobicContact CG-CE2 4.09Å; F79-S476 WeakPolarHBondContact CD2-O 3.36Å; F79-G479 VanDerWaalsContact CD2-CA 3.44Å
80	S	91.4	Very high	90.8	Very high	2 Å²	2	11 Å²	11	1%	0.014	6%	0.058	C	C	.	.	H	α-helix	trans	-72.2	-43	179.8	-61.8	0	0	0	0	112.5	Q76 V77 G82 A311	Q76-S80 WeakPolarHBondContact O-CB 3.46Å; Q76-S80 PolarHBondContact O-N 3.01Å; Q76-S80 PolarHBondContact O-OG 3.43Å; V77-S80 PolarHBondContact O-N 2.88Å; S80-G82 PolarHBondContact O-N 3.28Å; S80-A311 CarbonylContact C-O 3.5Å; S80-A311 WeakPolarHBondContact CA-O 3.3Å; S80-A311 VanDerWaalsContact CB-O 3.22Å; S80-A311 WeakPolarHBondContact CB-O 3.42Å
81	V	91.4	Very high	90.7	Very high	5 Å²	5	8.2 Å²	8.2	3%	0.03	4%	0.042	C	C	.	.	S	Bend	trans	-86	102.3	176	-179	0	0	0	0	108.8	V77 N343 T346 L472	V77-V81 HydrophobicContact CG1-CG2 4.1Å; V77-V81 WeakPolarHBondContact O-CA 3.48Å; V77-V81 VanDerWaalsContact O-CB 3.22Å; V77-V81 WeakPolarHBondContact O-CB 3.42Å; V77-V81 WeakPolarHBondContact O-CG2 3.39Å; V77-V81 PolarHBondContact O-N 3.03Å; V81-N343 HydrophobicContact CG2-CB 4.3Å; V81-T346 HydrophobicContact CG1-CG2 3.55Å; V81-T346 HydrophobicContact CG2-CG2 4.43Å; V81-L472 HydrophobicContact CG1-CD2 4.04Å
82	G	87.1	Confident	90.6	Very high	4 Å²	4	8.6 Å²	8.6	4%	0.041	4%	0.044	C	C	.	.			trans	-126.1	-167.6	-176.6	0	0	0	0	0	113.4	S80 G84 N85 S476	S80-G82 PolarHBondContact O-N 3.28Å; G82-G84 PolarHBondContact O-N 3.16Å; G82-N85 PolarHBondContact N-OD1 2.85Å; G82-N85 PolarHBondContact O-N 3.34Å; G82-N85 VanDerWaalsContact O-N 3.1Å; G82-N85 PolarHBondContact O-OD1 3.31Å; G82-S476 VanDerWaalsContact CA-OG 3.23Å; G82-S476 WeakPolarHBondContact CA-OG 3.46Å
83	L	85.1	Confident	90.5	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-53.9	-33.6	174.3	-74.6	170.2	0	0	0	113.4	N85 V86 W87 Y160 I164 L469 L472	L83-N85 VanDerWaalsContact C-N 3.26Å; L83-N85 PolarHBondContact O-N 3.07Å; L83-V86 PolarHBondContact O-N 2.98Å; L83-V86 VanDerWaalsContact O-N 3.16Å; L83-W87 HydrophobicContact CB-CH2 3.36Å; L83-W87 HydrophobicContact CB-CZ2 3.46Å; L83-W87 VanDerWaalsContact CB-CZ2 3.46Å; L83-W87 HydrophobicContact CB-CZ3 3.97Å; L83-W87 HydrophobicContact CD1-CH2 3.62Å; L83-W87 HydrophobicContact CD1-CZ2 4.15Å; L83-W87 HydrophobicContact CD2-CE3 4.35Å; L83-W87 HydrophobicContact CD2-CH2 3.31Å; L83-W87 HydrophobicContact CD2-CZ2 4.3Å; L83-W87 HydrophobicContact CD2-CZ3 3.35Å; L83-W87 HydrophobicContact CG-CH2 3.55Å; L83-W87 HydrophobicContact CG-CZ2 4.13Å; L83-W87 HydrophobicContact CG-CZ3 4.09Å; L83-W87 PolarHBondContact O-N 2.98Å; L83-Y160 HydrophobicContact CD1-CD2 4.36Å; L83-I164 HydrophobicContact CD1-CG1 4.21Å; L83-L469 HydrophobicContact CD2-CB 4.19Å; L83-L469 HydrophobicContact CD2-CD2 4.03Å; L83-L469 WeakPolarHBondContact CD2-O 3.42Å; L83-L472 HydrophobicContact CD2-CB 4.32Å
84	G	85.3	Confident	90.1	Very high	7 Å²	7	8.7 Å²	8.7	7%	0.072	4%	0.044	C	C	.	.	I	π-helix	trans	-61.4	-28.9	177.8	0	0	0	0	0	114.1	G82 V86 R88 F89	G82-G84 PolarHBondContact O-N 3.16Å; G84-V86 VanDerWaalsContact C-N 3.32Å; G84-R88 WeakPolarHBondContact O-CA 3.4Å; G84-R88 WeakPolarHBondContact O-CB 3.21Å; G84-R88 PolarHBondContact O-N 2.84Å; G84-R88 VanDerWaalsContact O-N 3.14Å; G84-F89 PolarHBondContact O-N 3.46Å
85	N	89.9	Confident	89.8	Confident	3 Å²	3	11.6 Å²	11.6	2%	0.016	6%	0.056	C	C	.	.	I	π-helix	trans	-72.7	-26.6	178.2	-57.2	73.4	0	0	0	112.2	G82 L83 P90 N343 S347 A350	G82-N85 PolarHBondContact N-OD1 2.85Å; G82-N85 PolarHBondContact O-N 3.34Å; G82-N85 VanDerWaalsContact O-N 3.1Å; G82-N85 PolarHBondContact O-OD1 3.31Å; L83-N85 VanDerWaalsContact C-N 3.26Å; L83-N85 PolarHBondContact O-N 3.07Å; N85-P90 WeakPolarHBondContact O-CD 3.48Å; N85-N343 PolarHBondContact ND2-OD1 3.34Å; N85-S347 PolarHBondContact ND2-OG 3.41Å; N85-A350 WeakPolarHBondContact O-CB 3.49Å
86	V	86.1	Confident	89.6	Confident	7 Å²	7	11.7 Å²	11.7	4%	0.042	6%	0.056	C	C	.	.	I	π-helix	trans	-91.8	-34.2	-173.5	177.4	0	0	0	0	113.2	L83 G84 P90 A350 F465 M468 L469 L472	L83-V86 PolarHBondContact O-N 2.98Å; L83-V86 VanDerWaalsContact O-N 3.16Å; G84-V86 VanDerWaalsContact C-N 3.32Å; V86-P90 WeakPolarHBondContact O-CG 3.24Å; V86-A350 HydrophobicContact CG2-CB 4.43Å; V86-F465 HydrophobicContact CG1-CE2 4.5Å; V86-M468 HydrophobicContact CG1-CE 4.24Å; V86-L469 HydrophobicContact CB-CD2 4.39Å; V86-L469 HydrophobicContact CG1-CD2 3.99Å; V86-L472 HydrophobicContact CG2-CD1 3.41Å; V86-L472 VanDerWaalsContact CG2-CD1 3.41Å
87	W	82.9	Confident	89.2	Confident	16 Å²	16	11.9 Å²	11.9	6%	0.061	6%	0.058	C	C	.	.	I	π-helix	trans	-118.3	-39.8	177.5	62.3	70.2	0	0	0	114.5	L83 Y91 I163 L443 A444 L469	L83-W87 HydrophobicContact CB-CH2 3.36Å; L83-W87 HydrophobicContact CB-CZ2 3.46Å; L83-W87 VanDerWaalsContact CB-CZ2 3.46Å; L83-W87 HydrophobicContact CB-CZ3 3.97Å; L83-W87 HydrophobicContact CD1-CH2 3.62Å; L83-W87 HydrophobicContact CD1-CZ2 4.15Å; L83-W87 HydrophobicContact CD2-CE3 4.35Å; L83-W87 HydrophobicContact CD2-CH2 3.31Å; L83-W87 HydrophobicContact CD2-CZ2 4.3Å; L83-W87 HydrophobicContact CD2-CZ3 3.35Å; L83-W87 HydrophobicContact CG-CH2 3.55Å; L83-W87 HydrophobicContact CG-CZ2 4.13Å; L83-W87 HydrophobicContact CG-CZ3 4.09Å; L83-W87 PolarHBondContact O-N 2.98Å; W87-Y91 WeakPolarHBondContact O-CB 3.39Å; W87-Y91 PolarHBondContact O-N 3.49Å; W87-Y91 VanDerWaalsContact O-N 3.14Å; W87-I163 HydrophobicContact CH2-CB 4.19Å; W87-I163 HydrophobicContact CH2-CD1 4.33Å; W87-I163 HydrophobicContact CH2-CG2 3.18Å; W87-I163 HydrophobicContact CZ2-CD1 3.79Å; W87-I163 HydrophobicContact CZ2-CG2 3.74Å; W87-I163 HydrophobicContact CZ3-CG2 4.02Å; W87-L443 HydrophobicContact CB-CB 4.39Å; W87-L443 HydrophobicContact CB-CD2 4.18Å; W87-L443 VanDerWaalsContact O-CD2 3.29Å; W87-L443 WeakPolarHBondContact O-CD2 3.46Å; W87-A444 HydrophobicContact CB-CB 4.49Å; W87-A444 HydrophobicContact CE3-CB 3.91Å; W87-L469 HydrophobicContact CE3-CD2 4.25Å; W87-L469 HydrophobicContact CZ3-CD1 4.41Å; W87-L469 HydrophobicContact CZ3-CD2 4.04Å
88	R	88.1	Confident	88.9	Confident	39 Å²	39	11.7 Å²	11.7	15%	0.147	6%	0.058	C	C	.	.	I	π-helix	trans	-74.6	-48.6	-171.8	-173.1	178.5	-178.8	160.1	5.4	110.4	G84 Y91 L92 Q307 D527	G84-R88 WeakPolarHBondContact O-CA 3.4Å; G84-R88 WeakPolarHBondContact O-CB 3.21Å; G84-R88 PolarHBondContact O-N 2.84Å; G84-R88 VanDerWaalsContact O-N 3.14Å; R88-Y91 PolarHBondContact O-N 2.92Å; R88-L92 HydrophobicContact CG-CD1 3.99Å; R88-L92 HydrophobicContact CG-CG 4.29Å; R88-L92 WeakPolarHBondContact O-CB 3.15Å; R88-L92 VanDerWaalsContact O-CG 3.25Å; R88-L92 WeakPolarHBondContact O-CG 3.39Å; R88-L92 PolarHBondContact O-N 2.99Å; R88-Q307 VanDerWaalsContact CD-OE1 3.28Å; R88-D527 IonicContact NH1-OD1 3.49Å; R88-D527 PolarHBondContact NH1-OD1 3.15Å
89	F	92.4	Very high	88.6	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61	-47.3	-180	-172.8	-76	0	0	0	112.6	G84 Y91 L92 C93 Y101 L102 Y105 Q307 T351	G84-F89 PolarHBondContact O-N 3.46Å; F89-Y91 PolarHBondContact O-N 2.96Å; F89-L92 PolarHBondContact O-N 3.28Å; F89-C93 WeakPolarHBondContact O-CB 3.26Å; F89-C93 PolarHBondContact O-N 3.14Å; F89-Y101 HydrophobicContact CD2-CE1 4.38Å; F89-Y101 HydrophobicContact CE2-CE1 4.07Å; F89-Y101 HydrophobicContact CZ-CE1 4.2Å; F89-L102 HydrophobicContact CE1-CD2 3.75Å; F89-L102 HydrophobicContact CZ-CD2 3.69Å; F89-Y105 HydrophobicContact CD2-CD2 4.41Å; F89-Y105 HydrophobicContact CD2-CE2 4.14Å; F89-Y105 AromaticContact CE2-CD1 3.76Å; F89-Y105 HydrophobicContact CE2-CD1 3.76Å; F89-Y105 AromaticContact CE2-CD2 3.7Å; F89-Y105 HydrophobicContact CE2-CD2 3.7Å; F89-Y105 AromaticContact CE2-CE1 3.75Å; F89-Y105 HydrophobicContact CE2-CE1 3.75Å; F89-Y105 AromaticContact CE2-CE2 3.68Å; F89-Y105 HydrophobicContact CE2-CE2 3.68Å; F89-Y105 AromaticContact CE2-CG 3.72Å; F89-Y105 HydrophobicContact CE2-CG 3.72Å; F89-Y105 AromaticContact CE2-CZ 3.69Å; F89-Y105 HydrophobicContact CZ-CD1 4.15Å; F89-Y105 HydrophobicContact CZ-CE1 4.39Å; F89-Y105 HydrophobicContact CZ-CG 4.28Å; F89-Q307 HydrophobicContact CD2-CG 3.78Å; F89-T351 WeakPolarHBondContact CD1-OG1 3.35Å; F89-T351 WeakPolarHBondContact CE1-OG1 3.25Å
90	P	91.4	Very high	88.4	Confident	1 Å²	1	11.6 Å²	11.6	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-63.3	-39.6	175.8	-23.2	34.6	0	0	0	113.3	N85 V86 C93 Q94 T351 V354 F355 L443	N85-P90 WeakPolarHBondContact O-CD 3.48Å; V86-P90 WeakPolarHBondContact O-CG 3.24Å; P90-C93 WeakPolarHBondContact O-CB 3.4Å; P90-C93 PolarHBondContact O-N 2.84Å; P90-Q94 PolarHBondContact O-N 3.37Å; P90-T351 HydrophobicContact CB-CG2 4.12Å; P90-T351 HydrophobicContact CG-CG2 4.43Å; P90-V354 HydrophobicContact CB-CB 3.97Å; P90-V354 HydrophobicContact CB-CG1 3.73Å; P90-V354 HydrophobicContact CB-CG2 3.99Å; P90-V354 HydrophobicContact CG-CB 4.2Å; P90-V354 HydrophobicContact CG-CG1 4.41Å; P90-V354 HydrophobicContact CG-CG2 3.72Å; P90-F355 HydrophobicContact CB-CE2 4.45Å; P90-L443 HydrophobicContact CB-CD2 4.24Å
91	Y	88.8	Confident	88.5	Confident	27 Å²	27	11.5 Å²	11.5	11%	0.106	6%	0.059	C	C	.	.	H	α-helix	trans	-60.3	-48.2	174.1	166.3	-105.5	0	0	0	111.9	W87 R88 F89 C93 Q94 K95 A437 V438 Q439	W87-Y91 WeakPolarHBondContact O-CB 3.39Å; W87-Y91 PolarHBondContact O-N 3.49Å; W87-Y91 VanDerWaalsContact O-N 3.14Å; R88-Y91 PolarHBondContact O-N 2.92Å; F89-Y91 PolarHBondContact O-N 2.96Å; Y91-C93 VanDerWaalsContact C-N 3.29Å; Y91-C93 PolarHBondContact O-N 2.77Å; Y91-Q94 PolarHBondContact O-N 3.5Å; Y91-K95 HydrophobicContact CE1-CD 4.23Å; Y91-K95 WeakPolarHBondContact O-CB 3.43Å; Y91-K95 PolarHBondContact O-N 2.97Å; Y91-A437 HydrophobicContact CD2-CB 4.46Å; Y91-A437 HydrophobicContact CE2-CB 4.32Å; Y91-V438 VanDerWaalsContact CD2-O 3.27Å; Y91-V438 WeakPolarHBondContact CD2-O 3.46Å; Y91-Q439 HydrophobicContact CE1-CG 4.29Å; Y91-Q439 HydrophobicContact CE2-CB 4.04Å; Y91-Q439 HydrophobicContact CE2-CG 4.23Å; Y91-Q439 WeakPolarHBondContact OH-CG 3.31Å
92	L	89.9	Confident	88.6	Confident	11 Å²	11	12.4 Å²	12.4	6%	0.058	6%	0.063	C	C	.	.	H	α-helix	trans	-63.3	-37.6	177.2	-68.6	177.7	0	0	0	111.5	R88 F89 N96 Y101 E303 Q307	R88-L92 HydrophobicContact CG-CD1 3.99Å; R88-L92 HydrophobicContact CG-CG 4.29Å; R88-L92 WeakPolarHBondContact O-CB 3.15Å; R88-L92 VanDerWaalsContact O-CG 3.25Å; R88-L92 WeakPolarHBondContact O-CG 3.39Å; R88-L92 PolarHBondContact O-N 2.99Å; F89-L92 PolarHBondContact O-N 3.28Å; L92-N96 WeakPolarHBondContact O-CB 3.26Å; L92-N96 PolarHBondContact O-N 3.19Å; L92-N96 PolarHBondContact O-ND2 3.19Å; L92-Y101 HydrophobicContact CB-CE1 4.08Å; L92-Y101 HydrophobicContact CB-CE2 4.15Å; L92-Y101 WeakPolarHBondContact CD1-OH 3.47Å; L92-E303 HydrophobicContact CD2-CB 4.3Å; L92-E303 VanDerWaalsContact CD2-OE2 3.3Å; L92-E303 WeakPolarHBondContact CD2-OE2 3.26Å; L92-Q307 HydrophobicContact CD1-CB 4.06Å; L92-Q307 HydrophobicContact CD1-CG 4.24Å
93	C	90.9	Very high	88.9	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.4	-50.8	173.4	-170.9	0	0	0	0	110.7	F89 P90 Y91 N96 G98 Y101 T351 F355	F89-C93 WeakPolarHBondContact O-CB 3.26Å; F89-C93 PolarHBondContact O-N 3.14Å; P90-C93 WeakPolarHBondContact O-CB 3.4Å; P90-C93 PolarHBondContact O-N 2.84Å; Y91-C93 VanDerWaalsContact C-N 3.29Å; Y91-C93 PolarHBondContact O-N 2.77Å; C93-N96 PolarHBondContact O-N 3.5Å; C93-G98 WeakPolarHBondContact O-CA 3.29Å; C93-G98 PolarHBondContact O-N 3.34Å; C93-G98 PolarHBondContact SG-O 3.09Å; C93-Y101 HydrophobicContact CB-CD1 4.03Å; C93-T351 HydrophobicContact CB-CG2 4.3Å; C93-F355 HydrophobicContact CB-CE2 4.43Å
94	Q	87.3	Confident	89.3	Confident	20 Å²	20	15.9 Å²	15.9	9%	0.093	8%	0.084	C	C	.	.	H	α-helix	trans	-61.8	-49.2	179.1	-166.2	179.9	5.2	0	0	112.1	P90 Y91 N96 F355 L434 A437	P90-Q94 PolarHBondContact O-N 3.37Å; Y91-Q94 PolarHBondContact O-N 3.5Å; Q94-N96 VanDerWaalsContact C-N 3.34Å; Q94-N96 PolarHBondContact O-N 2.87Å; Q94-F355 HydrophobicContact CB-CE1 4.38Å; Q94-F355 HydrophobicContact CB-CZ 3.72Å; Q94-F355 HydrophobicContact CG-CE1 4.3Å; Q94-F355 HydrophobicContact CG-CZ 4.14Å; Q94-L434 PolarHBondContact NE2-O 2.93Å; Q94-A437 HydrophobicContact CG-CB 4.23Å
95	K	87.8	Confident	89.8	Confident	78 Å²	78	15.6 Å²	15.6	34%	0.339	8%	0.08	S	C	.	.	H	α-helix	trans	-61	-40.8	-178.8	-176.1	-169.4	175.8	-168.2	0	112.4	Y91 G97 E303	Y91-K95 HydrophobicContact CE1-CD 4.23Å; Y91-K95 WeakPolarHBondContact O-CB 3.43Å; Y91-K95 PolarHBondContact O-N 2.97Å; K95-G97 PolarHBondContact O-N 3.4Å; K95-E303 IonicContact NZ-OE1 3.4Å; K95-E303 PolarHBondContact NZ-OE1 3.3Å; K95-E303 IonicContact NZ-OE2 3.97Å
96	N	89.8	Confident	90	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	32.4	-170.3	-62.5	-37.7	0	0	0	113.7	L92 C93 Q94 Y101 V300 E303	L92-N96 WeakPolarHBondContact O-CB 3.26Å; L92-N96 PolarHBondContact O-N 3.19Å; L92-N96 PolarHBondContact O-ND2 3.19Å; C93-N96 PolarHBondContact O-N 3.5Å; Q94-N96 VanDerWaalsContact C-N 3.34Å; Q94-N96 PolarHBondContact O-N 2.87Å; N96-Y101 HydrophobicContact CB-CD2 3.64Å; N96-Y101 HydrophobicContact CB-CE2 4.5Å; N96-Y101 HydrophobicContact CB-CG 4.15Å; N96-V300 HydrophobicContact CB-CG1 4.04Å; N96-V300 HydrophobicContact CB-CG2 3.9Å; N96-E303 PolarHBondContact ND2-OE2 3.46Å; N96-E303 PolarHBondContact OD1-OE2 3Å
97	G	85.8	Confident	90.5	Very high	4 Å²	4	22.2 Å²	22.2	4%	0.041	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	26.9	170.8	0	0	0	0	0	115.4	K95 G99 A100 K291	K95-G97 PolarHBondContact O-N 3.4Å; G97-G99 PolarHBondContact O-N 3.1Å; G97-A100 WeakPolarHBondContact O-CB 3.29Å; G97-A100 PolarHBondContact O-N 3.21Å; G97-K291 PolarHBondContact O-N 3.09Å; G97-K291 VanDerWaalsContact O-N 3.16Å
98	G	87.6	Confident	91.1	Very high	3 Å²	3	21.8 Å²	21.8	3%	0.031	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	-123.4	176.7	0	0	0	0	0	111.3	C93 A100 Y101 M287	C93-G98 WeakPolarHBondContact O-CA 3.29Å; C93-G98 PolarHBondContact O-N 3.34Å; C93-G98 PolarHBondContact SG-O 3.09Å; G98-A100 PolarHBondContact O-N 3.15Å; G98-Y101 WeakPolarHBondContact O-CB 3.34Å; G98-Y101 PolarHBondContact O-N 2.94Å; G98-M287 CarbonylContact C-O 3.22Å
99	G	86.7	Confident	91.5	Very high	12 Å²	12	20.1 Å²	20.1	12%	0.124	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-21.6	-176.7	0	0	0	0	0	113.6	G97 Y101 L102 M287	G97-G99 PolarHBondContact O-N 3.1Å; G99-Y101 VanDerWaalsContact C-N 3.27Å; G99-Y101 PolarHBondContact O-N 2.9Å; G99-L102 WeakPolarHBondContact O-CB 3.13Å; G99-L102 PolarHBondContact O-N 3.45Å; G99-M287 WeakPolarHBondContact CA-O 3.29Å; G99-M287 PolarHBondContact N-O 3.41Å
100	A	91.6	Very high	91.7	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-35.4	173.4	0	0	0	0	0	112.1	G97 G98 L102 V103 P104 P290 M295	G97-A100 WeakPolarHBondContact O-CB 3.29Å; G97-A100 PolarHBondContact O-N 3.21Å; G98-A100 PolarHBondContact O-N 3.15Å; A100-L102 VanDerWaalsContact C-N 3.3Å; A100-L102 PolarHBondContact O-N 3.35Å; A100-V103 PolarHBondContact O-N 3.44Å; A100-P104 WeakPolarHBondContact O-CD 3.27Å; A100-P290 HydrophobicContact CB-CB 4.22Å; A100-M295 HydrophobicContact CB-CG 3.92Å; A100-M295 HydrophobicContact CB-SD 4.14Å
101	Y	93.4	Very high	91.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.4	-29.7	178.6	175.5	-102.2	0	0	0	113.5	F89 L92 C93 N96 G98 G99 V103 P104 Y105 V300 A304 Q307	F89-Y101 HydrophobicContact CD2-CE1 4.38Å; F89-Y101 HydrophobicContact CE2-CE1 4.07Å; F89-Y101 HydrophobicContact CZ-CE1 4.2Å; L92-Y101 HydrophobicContact CB-CE1 4.08Å; L92-Y101 HydrophobicContact CB-CE2 4.15Å; L92-Y101 WeakPolarHBondContact CD1-OH 3.47Å; C93-Y101 HydrophobicContact CB-CD1 4.03Å; N96-Y101 HydrophobicContact CB-CD2 3.64Å; N96-Y101 HydrophobicContact CB-CE2 4.5Å; N96-Y101 HydrophobicContact CB-CG 4.15Å; G98-Y101 WeakPolarHBondContact O-CB 3.34Å; G98-Y101 PolarHBondContact O-N 2.94Å; G99-Y101 VanDerWaalsContact C-N 3.27Å; G99-Y101 PolarHBondContact O-N 2.9Å; Y101-V103 PolarHBondContact O-N 3.34Å; Y101-P104 WeakPolarHBondContact O-CD 3.32Å; Y101-Y105 PolarHBondContact O-N 3.5Å; Y101-V300 HydrophobicContact CD2-CG1 4.14Å; Y101-A304 HydrophobicContact CE2-CB 3.83Å; Y101-Q307 WeakPolarHBondContact OH-CB 3.35Å
102	L	92.3	Very high	92.2	Very high	24 Å²	24	24.7 Å²	24.7	13%	0.126	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-29.2	-179.4	-60.2	179.2	0	0	0	112	F89 G99 A100 F106 M287	F89-L102 HydrophobicContact CE1-CD2 3.75Å; F89-L102 HydrophobicContact CZ-CD2 3.69Å; G99-L102 WeakPolarHBondContact O-CB 3.13Å; G99-L102 PolarHBondContact O-N 3.45Å; A100-L102 VanDerWaalsContact C-N 3.3Å; A100-L102 PolarHBondContact O-N 3.35Å; L102-F106 VanDerWaalsContact O-CB 3.26Å; L102-F106 WeakPolarHBondContact O-CB 3.48Å; L102-F106 PolarHBondContact O-N 2.86Å; L102-M287 HydrophobicContact CD1-CE 4.15Å
103	V	93.1	Very high	92.4	Very high	77 Å²	77	24.1 Å²	24.1	47%	0.467	13%	0.126	S	C	.	.	H	α-helix	trans	-70.7	-56	-178.6	176.1	0	0	0	0	111.6	A100 Y101 Y105 F106 I107 M295	A100-V103 PolarHBondContact O-N 3.44Å; Y101-V103 PolarHBondContact O-N 3.34Å; V103-Y105 VanDerWaalsContact C-N 3.28Å; V103-Y105 PolarHBondContact O-N 3.04Å; V103-F106 PolarHBondContact O-N 2.89Å; V103-I107 HydrophobicContact CG1-CD1 3.79Å; V103-I107 VanDerWaalsContact O-CG1 3.32Å; V103-I107 WeakPolarHBondContact O-CG1 3.42Å; V103-I107 PolarHBondContact O-N 3.18Å; V103-M295 HydrophobicContact CB-SD 4.38Å
104	P	94.2	Very high	92.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-54.2	-42.5	171.7	-27.9	35	0	0	0	113.1	A100 Y101 I107 L108 M295 V300 W301 A304	A100-P104 WeakPolarHBondContact O-CD 3.27Å; Y101-P104 WeakPolarHBondContact O-CD 3.32Å; P104-I107 PolarHBondContact O-N 3.27Å; P104-L108 WeakPolarHBondContact O-CB 3.26Å; P104-L108 VanDerWaalsContact O-CG 3.28Å; P104-L108 WeakPolarHBondContact O-CG 3.46Å; P104-L108 PolarHBondContact O-N 3.39Å; P104-M295 HydrophobicContact CG-CG 4.34Å; P104-M295 HydrophobicContact CG-SD 4.36Å; P104-V300 HydrophobicContact CG-CG1 4.2Å; P104-W301 HydrophobicContact CB-CD2 3.96Å; P104-W301 HydrophobicContact CB-CE3 3.87Å; P104-W301 HydrophobicContact CB-CH2 4.13Å; P104-W301 HydrophobicContact CB-CZ2 4.21Å; P104-W301 HydrophobicContact CB-CZ3 3.95Å; P104-W301 HydrophobicContact CG-CD2 4.41Å; P104-W301 HydrophobicContact CG-CH2 4.33Å; P104-W301 HydrophobicContact CG-CZ2 4.04Å; P104-A304 HydrophobicContact CB-CB 4.21Å
105	Y	95.3	Very high	93.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-48.7	178.3	-178.7	-92	0	0	0	111.9	F89 Y101 V103 L108 L109 Q307 V308 N343 F344	F89-Y105 HydrophobicContact CD2-CD2 4.41Å; F89-Y105 HydrophobicContact CD2-CE2 4.14Å; F89-Y105 AromaticContact CE2-CD1 3.76Å; F89-Y105 HydrophobicContact CE2-CD1 3.76Å; F89-Y105 AromaticContact CE2-CD2 3.7Å; F89-Y105 HydrophobicContact CE2-CD2 3.7Å; F89-Y105 AromaticContact CE2-CE1 3.75Å; F89-Y105 HydrophobicContact CE2-CE1 3.75Å; F89-Y105 AromaticContact CE2-CE2 3.68Å; F89-Y105 HydrophobicContact CE2-CE2 3.68Å; F89-Y105 AromaticContact CE2-CG 3.72Å; F89-Y105 HydrophobicContact CE2-CG 3.72Å; F89-Y105 AromaticContact CE2-CZ 3.69Å; F89-Y105 HydrophobicContact CZ-CD1 4.15Å; F89-Y105 HydrophobicContact CZ-CE1 4.39Å; F89-Y105 HydrophobicContact CZ-CG 4.28Å; Y101-Y105 PolarHBondContact O-N 3.5Å; V103-Y105 VanDerWaalsContact C-N 3.28Å; V103-Y105 PolarHBondContact O-N 3.04Å; Y105-L108 PolarHBondContact O-N 3.41Å; Y105-L109 HydrophobicContact CE1-CD2 4.28Å; Y105-L109 WeakPolarHBondContact O-CB 3.28Å; Y105-L109 PolarHBondContact O-N 3.32Å; Y105-Q307 HydrophobicContact CD2-CB 4.4Å; Y105-Q307 HydrophobicContact CD2-CG 4.25Å; Y105-Q307 HydrophobicContact CE2-CB 4.18Å; Y105-Q307 HydrophobicContact CE2-CG 3.78Å; Y105-V308 HydrophobicContact CD2-CG2 3.77Å; Y105-V308 HydrophobicContact CE2-CB 4.45Å; Y105-V308 HydrophobicContact CE2-CG2 3.47Å; Y105-V308 VanDerWaalsContact CE2-CG2 3.47Å; Y105-N343 PolarHBondContact OH-ND2 3.27Å; Y105-F344 HydrophobicContact CD1-CD2 4.04Å; Y105-F344 HydrophobicContact CD1-CE2 4.1Å; Y105-F344 AromaticContact CE1-CD2 3.75Å; Y105-F344 HydrophobicContact CE1-CD2 3.75Å; Y105-F344 HydrophobicContact CE1-CE2 4.29Å
106	F	95.5	Very high	93.6	Very high	89 Å²	89	20.8 Å²	20.8	39%	0.39	11%	0.113	S	C	.	.	H	α-helix	trans	-64.5	-42.1	179.6	-177.8	-106.8	0	0	0	112.2	L102 V103 L108 L109 L110 F344	L102-F106 VanDerWaalsContact O-CB 3.26Å; L102-F106 WeakPolarHBondContact O-CB 3.48Å; L102-F106 PolarHBondContact O-N 2.86Å; V103-F106 PolarHBondContact O-N 2.89Å; F106-L108 PolarHBondContact O-N 3.14Å; F106-L109 PolarHBondContact O-N 2.95Å; F106-L110 HydrophobicContact CD1-CD1 4.08Å; F106-L110 HydrophobicContact CE1-CD1 3.47Å; F106-L110 VanDerWaalsContact CE1-CD1 3.47Å; F106-L110 HydrophobicContact CE1-CG 4.24Å; F106-L110 HydrophobicContact CE2-CD1 4.39Å; F106-L110 HydrophobicContact CE2-CD2 4.49Å; F106-L110 HydrophobicContact CE2-CG 4.4Å; F106-L110 HydrophobicContact CZ-CD1 3.66Å; F106-L110 HydrophobicContact CZ-CD2 4.36Å; F106-L110 HydrophobicContact CZ-CG 4.14Å; F106-L110 WeakPolarHBondContact O-CG 3.33Å; F106-L110 PolarHBondContact O-N 2.69Å; F106-F344 HydrophobicContact CB-CE2 4.45Å; F106-F344 HydrophobicContact CB-CZ 4.4Å; F106-F344 HydrophobicContact CD2-CD1 4.43Å; F106-F344 AromaticContact CD2-CE1 3.8Å; F106-F344 HydrophobicContact CD2-CE1 3.8Å; F106-F344 HydrophobicContact CD2-CE2 4.06Å; F106-F344 AromaticContact CD2-CZ 3.55Å; F106-F344 HydrophobicContact CD2-CZ 3.55Å; F106-F344 HydrophobicContact CE2-CE1 4.02Å; F106-F344 HydrophobicContact CE2-CZ 4.23Å; F106-F344 HydrophobicContact CG-CZ 4.31Å
107	I	95.8	Very high	93.9	Very high	61 Å²	61	20.6 Å²	20.6	31%	0.313	11%	0.112	S	C	.	.	H	α-helix	trans	-59.8	-48.6	176.1	-69.4	168.5	0	0	0	110.4	V103 P104 L110 L111 W301	V103-I107 HydrophobicContact CG1-CD1 3.79Å; V103-I107 VanDerWaalsContact O-CG1 3.32Å; V103-I107 WeakPolarHBondContact O-CG1 3.42Å; V103-I107 PolarHBondContact O-N 3.18Å; P104-I107 PolarHBondContact O-N 3.27Å; I107-L110 PolarHBondContact O-N 2.85Å; I107-L111 HydrophobicContact CG2-CD1 3.65Å; I107-L111 HydrophobicContact CG2-CG 4.28Å; I107-L111 WeakPolarHBondContact O-CB 3.3Å; I107-L111 VanDerWaalsContact O-CG 3.31Å; I107-L111 WeakPolarHBondContact O-CG 3.41Å; I107-L111 PolarHBondContact O-N 3.12Å; I107-W301 HydrophobicContact CB-CZ3 4.44Å; I107-W301 HydrophobicContact CD1-CH2 4.05Å; I107-W301 HydrophobicContact CG2-CZ3 4.21Å
108	L	95.8	Very high	94.5	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-67	-37.2	179	-68.9	168.8	0	0	0	111.7	P104 Y105 F106 L110 L111 I112 G113 W301 A304 A305 V308 I582	P104-L108 WeakPolarHBondContact O-CB 3.26Å; P104-L108 VanDerWaalsContact O-CG 3.28Å; P104-L108 WeakPolarHBondContact O-CG 3.46Å; P104-L108 PolarHBondContact O-N 3.39Å; Y105-L108 PolarHBondContact O-N 3.41Å; F106-L108 PolarHBondContact O-N 3.14Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 3.27Å; L108-L111 PolarHBondContact O-N 3.47Å; L108-I112 HydrophobicContact CB-CD1 4.18Å; L108-I112 HydrophobicContact CB-CG1 4.08Å; L108-I112 HydrophobicContact CD2-CD1 3.94Å; L108-I112 HydrophobicContact CD2-CG1 4.26Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 2.92Å; L108-G113 PolarHBondContact O-N 3.37Å; L108-W301 HydrophobicContact CD1-CE3 4.08Å; L108-W301 WeakPolarHBondContact CD1-O 3.44Å; L108-W301 HydrophobicContact CD2-CE3 4.45Å; L108-W301 HydrophobicContact CG-CE3 4.21Å; L108-W301 HydrophobicContact CG-CZ3 4.39Å; L108-A304 HydrophobicContact CD1-CB 3.77Å; L108-A305 HydrophobicContact CD1-CB 3.9Å; L108-V308 HydrophobicContact CB-CG2 4.3Å; L108-I582 HydrophobicContact CD2-CG2 4.04Å
109	L	96.4	Very high	94.9	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.026	11%	0.109	C	C	.	.	I	π-helix	trans	-57.5	-42.7	173.7	-178.5	64.9	0	0	0	111.5	Y105 F106 G113 I114 V308 L312 F344	Y105-L109 HydrophobicContact CE1-CD2 4.28Å; Y105-L109 WeakPolarHBondContact O-CB 3.28Å; Y105-L109 PolarHBondContact O-N 3.32Å; F106-L109 PolarHBondContact O-N 2.95Å; L109-G113 CarbonylContact O-C 3.51Å; L109-G113 VanDerWaalsContact O-CA 3.28Å; L109-G113 WeakPolarHBondContact O-CA 3.46Å; L109-G113 PolarHBondContact O-N 2.93Å; L109-I114 PolarHBondContact O-N 3.36Å; L109-V308 HydrophobicContact CB-CG2 4.44Å; L109-V308 HydrophobicContact CD1-CG1 4.35Å; L109-L312 HydrophobicContact CD1-CD1 3.82Å; L109-L312 HydrophobicContact CD1-CG 4.47Å; L109-F344 HydrophobicContact CD2-CB 3.76Å; L109-F344 HydrophobicContact CD2-CD2 4.19Å; L109-F344 HydrophobicContact CD2-CG 4.04Å
110	L	95.9	Very high	95.3	Very high	70 Å²	70	20 Å²	20	37%	0.366	10%	0.104	S	C	.	.	I	π-helix	trans	-73.2	-41	178.4	-67.2	-177.8	0	0	0	113.5	F106 I107 L108 I114 P115	F106-L110 HydrophobicContact CD1-CD1 4.08Å; F106-L110 HydrophobicContact CE1-CD1 3.47Å; F106-L110 VanDerWaalsContact CE1-CD1 3.47Å; F106-L110 HydrophobicContact CE1-CG 4.24Å; F106-L110 HydrophobicContact CE2-CD1 4.39Å; F106-L110 HydrophobicContact CE2-CD2 4.49Å; F106-L110 HydrophobicContact CE2-CG 4.4Å; F106-L110 HydrophobicContact CZ-CD1 3.66Å; F106-L110 HydrophobicContact CZ-CD2 4.36Å; F106-L110 HydrophobicContact CZ-CG 4.14Å; F106-L110 WeakPolarHBondContact O-CG 3.33Å; F106-L110 PolarHBondContact O-N 2.69Å; I107-L110 PolarHBondContact O-N 2.85Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 3.27Å; L110-I114 HydrophobicContact CD2-CD1 3.83Å; L110-P115 VanDerWaalsContact O-CD 3.3Å; L110-P115 WeakPolarHBondContact O-CD 3.27Å
111	L	95.3	Very high	95.5	Very high	53 Å²	53	19.9 Å²	19.9	28%	0.277	10%	0.103	S	C	.	.	I	π-helix	trans	-85.9	-31	-172.1	-64.8	-178.1	0	0	0	114.2	I107 L108 M574 S579 I582	I107-L111 HydrophobicContact CG2-CD1 3.65Å; I107-L111 HydrophobicContact CG2-CG 4.28Å; I107-L111 WeakPolarHBondContact O-CB 3.3Å; I107-L111 VanDerWaalsContact O-CG 3.31Å; I107-L111 WeakPolarHBondContact O-CG 3.41Å; I107-L111 PolarHBondContact O-N 3.12Å; L108-L111 PolarHBondContact O-N 3.47Å; L111-M574 HydrophobicContact CD2-SD 4.11Å; L111-S579 PolarHBondContact O-OG 2.88Å; L111-S579 VanDerWaalsContact O-OG 3.07Å; L111-I582 HydrophobicContact CB-CD1 3.92Å; L111-I582 HydrophobicContact CD1-CD1 4Å
112	I	94.9	Very high	95.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-123	-41.9	-179.4	58.2	168	0	0	0	112.3	L108 L116 A305 F309 I582 L586	L108-I112 HydrophobicContact CB-CD1 4.18Å; L108-I112 HydrophobicContact CB-CG1 4.08Å; L108-I112 HydrophobicContact CD2-CD1 3.94Å; L108-I112 HydrophobicContact CD2-CG1 4.26Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 2.92Å; I112-L116 HydrophobicContact CB-CD1 4.1Å; I112-L116 WeakPolarHBondContact O-CB 3.42Å; I112-L116 WeakPolarHBondContact O-CD1 3.28Å; I112-L116 WeakPolarHBondContact O-CG 3.43Å; I112-L116 PolarHBondContact O-N 3.4Å; I112-L116 VanDerWaalsContact O-N 3.1Å; I112-A305 HydrophobicContact CD1-CB 4.26Å; I112-F309 HydrophobicContact CD1-CE1 3.79Å; I112-F309 HydrophobicContact CD1-CZ 3.91Å; I112-I582 HydrophobicContact CD1-CG2 4.44Å; I112-I582 HydrophobicContact CG2-CB 3.97Å; I112-I582 HydrophobicContact CG2-CD1 4Å; I112-I582 HydrophobicContact CG2-CG2 3.78Å; I112-L586 HydrophobicContact CD1-CD1 4.12Å
113	G	95.9	Very high	95.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	I	π-helix	trans	-61.2	-67.2	-174.6	0	0	0	0	0	113.4	L108 L109 L116 F117	L108-G113 PolarHBondContact O-N 3.37Å; L109-G113 CarbonylContact O-C 3.51Å; L109-G113 VanDerWaalsContact O-CA 3.28Å; L109-G113 WeakPolarHBondContact O-CA 3.46Å; L109-G113 PolarHBondContact O-N 2.93Å; G113-L116 PolarHBondContact O-N 3.39Å; G113-F117 WeakPolarHBondContact O-CB 3.36Å; G113-F117 PolarHBondContact O-N 2.98Å
114	I	96.4	Very high	95.8	Very high	24 Å²	24	15.3 Å²	15.3	12%	0.123	8%	0.076	C	C	.	.	H	α-helix	trans	-58.9	-47.2	-177.8	-64.8	172.8	0	0	0	111.8	L109 L110 L116 F117 F118 Y571	L109-I114 PolarHBondContact O-N 3.36Å; L110-I114 HydrophobicContact CD2-CD1 3.83Å; I114-L116 PolarHBondContact O-N 3.23Å; I114-F117 PolarHBondContact O-N 3.42Å; I114-F118 WeakPolarHBondContact O-CB 3.18Å; I114-F118 PolarHBondContact O-N 2.68Å; I114-Y571 HydrophobicContact CG2-CE1 4.47Å
115	P	96.8	Very high	95.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.4	-47.1	179	-25.9	36.7	0	0	0	113	L110 F118 L119 F570 Y571 M574 W575	L110-P115 VanDerWaalsContact O-CD 3.3Å; L110-P115 WeakPolarHBondContact O-CD 3.27Å; P115-F118 PolarHBondContact O-N 3Å; P115-L119 PolarHBondContact O-N 3.38Å; P115-F570 HydrophobicContact CG-CE1 4.34Å; P115-Y571 HydrophobicContact CB-CD1 4.29Å; P115-M574 HydrophobicContact CB-CB 3.96Å; P115-M574 HydrophobicContact CB-CG 4.48Å; P115-M574 HydrophobicContact CG-CB 4Å; P115-M574 HydrophobicContact CG-CG 3.99Å; P115-W575 VanDerWaalsContact C-NE1 3.34Å; P115-W575 PolarHBondContact O-NE1 2.94Å
116	L	96.7	Very high	95.6	Very high	4 Å²	4	19 Å²	19	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-72.3	-34.8	-177.2	-63.2	171	0	0	0	111.7	I112 G113 I114 L119 E120 L314 V539 N543 L583	I112-L116 HydrophobicContact CB-CD1 4.1Å; I112-L116 WeakPolarHBondContact O-CB 3.42Å; I112-L116 WeakPolarHBondContact O-CD1 3.28Å; I112-L116 WeakPolarHBondContact O-CG 3.43Å; I112-L116 PolarHBondContact O-N 3.4Å; I112-L116 VanDerWaalsContact O-N 3.1Å; G113-L116 PolarHBondContact O-N 3.39Å; I114-L116 PolarHBondContact O-N 3.23Å; L116-L119 WeakPolarHBondContact O-CB 3.29Å; L116-L119 PolarHBondContact O-N 3.33Å; L116-E120 PolarHBondContact O-N 3.4Å; L116-L314 HydrophobicContact CB-CD1 4.25Å; L116-L314 HydrophobicContact CB-CD2 4.22Å; L116-V539 HydrophobicContact CD1-CG1 3.63Å; L116-N543 HydrophobicContact CD2-CB 3.79Å; L116-L583 HydrophobicContact CD1-CD1 4.06Å
117	F	97.3	Very high	95.4	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.9	-43.9	174.4	-170.2	-116	0	0	0	112.1	Q76 G113 I114 L119 E120 L121 L312 L314 V319 A336 V339	Q76-F117 HydrophobicContact CG-CZ 3.88Å; G113-F117 WeakPolarHBondContact O-CB 3.36Å; G113-F117 PolarHBondContact O-N 2.98Å; I114-F117 PolarHBondContact O-N 3.42Å; F117-L119 VanDerWaalsContact C-N 3.3Å; F117-L119 PolarHBondContact O-N 3.44Å; F117-E120 PolarHBondContact O-N 3.22Å; F117-L121 HydrophobicContact CD1-CD1 3.86Å; F117-L121 HydrophobicContact CE1-CD1 3.52Å; F117-L121 HydrophobicContact CE1-CG 4.38Å; F117-L121 HydrophobicContact CZ-CD1 3.94Å; F117-L121 HydrophobicContact CZ-CG 4.41Å; F117-L121 WeakPolarHBondContact O-CG 3.31Å; F117-L121 PolarHBondContact O-N 3.41Å; F117-L121 VanDerWaalsContact O-N 3.08Å; F117-L312 HydrophobicContact CB-CD1 4.18Å; F117-L312 HydrophobicContact CD2-CB 4.08Å; F117-L312 HydrophobicContact CE2-CB 4.5Å; F117-L312 WeakPolarHBondContact CE2-O 3.45Å; F117-L312 HydrophobicContact CG-CD1 4.45Å; F117-L314 HydrophobicContact CB-CD2 3.89Å; F117-L314 HydrophobicContact CD2-CD2 3.99Å; F117-L314 HydrophobicContact CG-CD2 4.46Å; F117-V319 HydrophobicContact CD2-CG1 3.99Å; F117-V319 HydrophobicContact CD2-CG2 4.28Å; F117-V319 HydrophobicContact CE2-CB 4.33Å; F117-V319 HydrophobicContact CE2-CG1 3.57Å; F117-V319 HydrophobicContact CE2-CG2 3.75Å; F117-V319 HydrophobicContact CZ-CG1 4.25Å; F117-A336 HydrophobicContact CD1-CB 3.96Å; F117-A336 HydrophobicContact CE1-CB 4.42Å; F117-V339 HydrophobicContact CE1-CB 3.93Å; F117-V339 HydrophobicContact CE1-CG1 3.96Å; F117-V339 HydrophobicContact CZ-CB 4.3Å; F117-V339 HydrophobicContact CZ-CG1 3.88Å
118	F	97.1	Very high	95.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.5	-39.9	173.4	176.1	-137.2	0	0	0	111.8	I114 P115 L121 A122 H333 A336 L559 L563 P567 Y571 W575	I114-F118 WeakPolarHBondContact O-CB 3.18Å; I114-F118 PolarHBondContact O-N 2.68Å; P115-F118 PolarHBondContact O-N 3Å; F118-L121 PolarHBondContact O-N 2.86Å; F118-A122 HydrophobicContact CE2-CB 4.33Å; F118-A122 VanDerWaalsContact O-CB 3.24Å; F118-A122 WeakPolarHBondContact O-CB 3.44Å; F118-A122 PolarHBondContact O-N 3.26Å; F118-H333 HydrophobicContact CD2-CB 4.22Å; F118-H333 AromaticContact CE1-CD2 3.97Å; F118-H333 VanDerWaalsContact CE2-CA 3.45Å; F118-H333 HydrophobicContact CE2-CB 3.61Å; F118-H333 HydrophobicContact CZ-CB 3.84Å; F118-A336 HydrophobicContact CB-CB 3.79Å; F118-A336 HydrophobicContact CD2-CB 4.15Å; F118-A336 HydrophobicContact CG-CB 4.36Å; F118-L559 HydrophobicContact CE1-CD1 4.22Å; F118-L559 HydrophobicContact CE2-CD2 4.44Å; F118-L559 HydrophobicContact CZ-CD1 4.12Å; F118-L559 HydrophobicContact CZ-CD2 4.01Å; F118-L563 HydrophobicContact CZ-CD1 4.27Å; F118-P567 HydrophobicContact CE1-CB 4.36Å; F118-P567 HydrophobicContact CE1-CG 4.44Å; F118-P567 HydrophobicContact CZ-CG 4.31Å; F118-Y571 HydrophobicContact CB-CE1 4.4Å; F118-Y571 AromaticContact CD1-CD1 3.76Å; F118-Y571 HydrophobicContact CD1-CD1 3.76Å; F118-Y571 AromaticContact CD1-CE1 3.69Å; F118-Y571 HydrophobicContact CD1-CE1 3.69Å; F118-Y571 HydrophobicContact CD1-CE2 4.49Å; F118-Y571 HydrophobicContact CD1-CG 4.19Å; F118-Y571 HydrophobicContact CE1-CD1 4.37Å; F118-Y571 HydrophobicContact CE1-CD2 4.45Å; F118-Y571 HydrophobicContact CE1-CE1 4.48Å; F118-Y571 HydrophobicContact CE1-CG 4.35Å; F118-Y571 HydrophobicContact CG-CE1 4.44Å; F118-W575 AromaticContact CD1-CH2 3.66Å; F118-W575 HydrophobicContact CD1-CH2 3.66Å; F118-W575 AromaticContact CD1-CZ2 3.41Å; F118-W575 HydrophobicContact CD1-CZ2 3.41Å; F118-W575 VanDerWaalsContact CD1-CZ2 3.41Å; F118-W575 AromaticContact CE1-CH2 3.56Å; F118-W575 HydrophobicContact CE1-CH2 3.56Å; F118-W575 AromaticContact CE1-CZ2 3.85Å; F118-W575 HydrophobicContact CE1-CZ2 3.85Å; F118-W575 HydrophobicContact CG-CZ2 4.23Å
119	L	96.1	Very high	94.9	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.016	9%	0.087	C	C	.	.	H	α-helix	trans	-60.3	-49.7	176.6	-176.2	157.4	0	0	0	111.6	P115 L116 F117 L121 A122 V123 V546 F555 W575	P115-L119 PolarHBondContact O-N 3.38Å; L116-L119 WeakPolarHBondContact O-CB 3.29Å; L116-L119 PolarHBondContact O-N 3.33Å; F117-L119 VanDerWaalsContact C-N 3.3Å; F117-L119 PolarHBondContact O-N 3.44Å; L119-L121 PolarHBondContact O-N 2.76Å; L119-A122 PolarHBondContact O-N 2.98Å; L119-V123 HydrophobicContact CD2-CG2 4.15Å; L119-V123 WeakPolarHBondContact O-CB 3.36Å; L119-V123 WeakPolarHBondContact O-CG2 3.48Å; L119-V123 PolarHBondContact O-N 3.2Å; L119-V546 HydrophobicContact CD1-CB 4.13Å; L119-V546 HydrophobicContact CD1-CG1 4.18Å; L119-V546 HydrophobicContact CD2-CB 4.35Å; L119-V546 HydrophobicContact CD2-CG2 3.95Å; L119-V546 HydrophobicContact CG-CB 4.44Å; L119-V546 HydrophobicContact CG-CG1 4.31Å; L119-F555 HydrophobicContact CG-CE1 4.38Å; L119-W575 HydrophobicContact CB-CZ2 4.02Å; L119-W575 HydrophobicContact CD1-CD2 4.24Å; L119-W575 HydrophobicContact CD1-CG 4.04Å
120	E	95.8	Very high	94.6	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.009	9%	0.086	C	C	.	.	H	α-helix	trans	-61.8	-43.7	178.7	-79.4	-169.4	-135.2	0	0	112.7	L116 F117 G124 L314 G315 V319 I320	L116-E120 PolarHBondContact O-N 3.4Å; F117-E120 PolarHBondContact O-N 3.22Å; E120-G124 PolarHBondContact O-N 2.99Å; E120-L314 VanDerWaalsContact OE1-CA 3.29Å; E120-L314 WeakPolarHBondContact OE1-CA 3.42Å; E120-L314 WeakPolarHBondContact OE1-CD2 3.48Å; E120-G315 PolarHBondContact OE1-N 3.25Å; E120-V319 HydrophobicContact CB-CB 4.43Å; E120-V319 HydrophobicContact CB-CG1 4.07Å; E120-I320 HydrophobicContact CB-CG1 3.99Å; E120-I320 HydrophobicContact CG-CD1 4.31Å; E120-I320 HydrophobicContact CG-CG1 4.15Å
121	L	95.6	Very high	94.3	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-46.4	177.2	-75	177.1	0	0	0	111.9	Y72 F117 F118 L119 Q125 V319 S323 C332 A336	Y72-L121 VanDerWaalsContact OH-CD2 3.26Å; Y72-L121 WeakPolarHBondContact OH-CD2 3.24Å; F117-L121 HydrophobicContact CD1-CD1 3.86Å; F117-L121 HydrophobicContact CE1-CD1 3.52Å; F117-L121 HydrophobicContact CE1-CG 4.38Å; F117-L121 HydrophobicContact CZ-CD1 3.94Å; F117-L121 HydrophobicContact CZ-CG 4.41Å; F117-L121 WeakPolarHBondContact O-CG 3.31Å; F117-L121 PolarHBondContact O-N 3.41Å; F117-L121 VanDerWaalsContact O-N 3.08Å; F118-L121 PolarHBondContact O-N 2.86Å; L119-L121 PolarHBondContact O-N 2.76Å; L121-Q125 VanDerWaalsContact O-CB 3.32Å; L121-Q125 WeakPolarHBondContact O-CB 3.21Å; L121-Q125 PolarHBondContact O-N 3.14Å; L121-V319 HydrophobicContact CD2-CG1 3.4Å; L121-V319 VanDerWaalsContact CD2-CG1 3.4Å; L121-V319 HydrophobicContact CG-CG1 3.64Å; L121-S323 WeakPolarHBondContact O-CB 3.29Å; L121-S323 PolarHBondContact O-OG 3.36Å; L121-C332 HydrophobicContact CB-CB 4.41Å; L121-A336 HydrophobicContact CD1-CB 3.72Å
122	A	95.5	Very high	94.2	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.8	-46.4	179.4	0	0	0	0	0	112.3	F118 L119 Q125 R126 F555 L559	F118-A122 HydrophobicContact CE2-CB 4.33Å; F118-A122 VanDerWaalsContact O-CB 3.24Å; F118-A122 WeakPolarHBondContact O-CB 3.44Å; F118-A122 PolarHBondContact O-N 3.26Å; L119-A122 PolarHBondContact O-N 2.98Å; A122-Q125 PolarHBondContact O-N 2.89Å; A122-R126 VanDerWaalsContact O-CB 3.3Å; A122-R126 WeakPolarHBondContact O-CB 3.5Å; A122-R126 PolarHBondContact O-N 3.22Å; A122-F555 HydrophobicContact CB-CE2 4.47Å; A122-F555 HydrophobicContact CB-CZ 3.78Å; A122-L559 HydrophobicContact CB-CD2 3.54Å
123	V	94.8	Very high	93.9	Very high	5 Å²	5	15.3 Å²	15.3	3%	0.03	7%	0.068	C	C	.	.	H	α-helix	trans	-63.7	-43.8	179.7	174.1	0	0	0	0	110.9	L119 R126 I127 V134 V546 F555	L119-V123 HydrophobicContact CD2-CG2 4.15Å; L119-V123 WeakPolarHBondContact O-CB 3.36Å; L119-V123 WeakPolarHBondContact O-CG2 3.48Å; L119-V123 PolarHBondContact O-N 3.2Å; V123-R126 PolarHBondContact O-N 2.77Å; V123-I127 HydrophobicContact CG1-CD1 3.72Å; V123-I127 PolarHBondContact O-N 3.02Å; V123-I127 VanDerWaalsContact O-N 3.12Å; V123-V134 HydrophobicContact CG1-CB 4.45Å; V123-V134 HydrophobicContact CG1-CG1 3.24Å; V123-V134 HydrophobicContact CG1-CG2 4.44Å; V123-V546 HydrophobicContact CG2-CG2 3.99Å; V123-F555 HydrophobicContact CG2-CE2 3.68Å; V123-F555 HydrophobicContact CG2-CZ 3.73Å
124	G	93.9	Very high	93.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.5	-44.8	176.3	0	0	0	0	0	112.7	E120 R128 S323 S324	E120-G124 PolarHBondContact O-N 2.99Å; G124-R128 WeakPolarHBondContact O-CA 3.46Å; G124-R128 PolarHBondContact O-N 2.87Å; G124-S323 WeakPolarHBondContact CA-OG 3.15Å; G124-S324 WeakPolarHBondContact O-CA 3.35Å
125	Q	94.6	Very high	93.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-68.3	-38.5	178.8	-171.7	177.2	-58.1	0	0	112.9	L121 A122 R128 K327 R328 N330 M562	L121-Q125 VanDerWaalsContact O-CB 3.32Å; L121-Q125 WeakPolarHBondContact O-CB 3.21Å; L121-Q125 PolarHBondContact O-N 3.14Å; A122-Q125 PolarHBondContact O-N 2.89Å; Q125-R128 WeakPolarHBondContact O-CG 3.36Å; Q125-K327 VanDerWaalsContact CG-O 3.27Å; Q125-K327 WeakPolarHBondContact CG-O 3.26Å; Q125-K327 PolarHBondContact NE2-O 2.91Å; Q125-R328 PolarHBondContact NE2-O 3.29Å; Q125-N330 PolarHBondContact NE2-O 2.99Å; Q125-M562 HydrophobicContact CB-CE 3.83Å; Q125-M562 HydrophobicContact CG-CE 3.63Å
126	R	91.7	Very high	93.2	Very high	78 Å²	78	16.3 Å²	16.3	29%	0.294	7%	0.073	S	C	.	.	H	α-helix	trans	-64.8	-50.4	179	-179.4	68.2	178.1	97.4	-8.1	112	A122 V123 D558 M562	A122-R126 VanDerWaalsContact O-CB 3.3Å; A122-R126 WeakPolarHBondContact O-CB 3.5Å; A122-R126 PolarHBondContact O-N 3.22Å; V123-R126 PolarHBondContact O-N 2.77Å; R126-D558 IonicContact CZ-OD1 2.64Å; R126-D558 IonicContact NE-OD1 3.99Å; R126-D558 PolarHBondContact NE-OD1 3.47Å; R126-D558 IonicContact NH2-OD1 2.89Å; R126-D558 PolarHBondContact NH2-OD1 2.64Å; R126-M562 HydrophobicContact CB-CE 4.07Å; R126-M562 HydrophobicContact CB-SD 3.48Å; R126-M562 WeakPolarHBondContact CB-SD 3.36Å; R126-M562 WeakPolarHBondContact CD-SD 3.39Å; R126-M562 HydrophobicContact CG-SD 3.91Å
127	I	90.9	Very high	92.8	Very high	28 Å²	28	20.9 Å²	20.9	14%	0.144	9%	0.091	C	C	.	.	H	α-helix	trans	-87.4	-24.8	-169.9	-60.5	170.3	0	0	0	111.4	V123 R129 V134 Y137 V138	V123-I127 HydrophobicContact CG1-CD1 3.72Å; V123-I127 PolarHBondContact O-N 3.02Å; V123-I127 VanDerWaalsContact O-N 3.12Å; I127-R129 VanDerWaalsContact C-N 3.31Å; I127-R129 HydrophobicContact CG2-CB 4.17Å; I127-R129 HydrophobicContact CG2-CG 4.24Å; I127-R129 PolarHBondContact O-N 3.34Å; I127-V134 HydrophobicContact CB-CG2 4.08Å; I127-V134 HydrophobicContact CD1-CB 4.32Å; I127-V134 HydrophobicContact CD1-CG1 3.99Å; I127-V134 HydrophobicContact CD1-CG2 4.16Å; I127-V134 HydrophobicContact CG2-CG2 4.09Å; I127-Y137 HydrophobicContact CD1-CD1 3.69Å; I127-Y137 HydrophobicContact CD1-CE1 4.41Å; I127-Y137 HydrophobicContact CD1-CG 4.4Å; I127-Y137 HydrophobicContact CG1-CD1 3.82Å; I127-Y137 HydrophobicContact CG1-CE1 4.17Å; I127-Y137 HydrophobicContact CG2-CD1 4.19Å; I127-Y137 HydrophobicContact CG2-CG 4.06Å; I127-V138 HydrophobicContact CD1-CG2 4.01Å
128	R	90.9	Very high	92.4	Very high	39 Å²	39	22 Å²	22	15%	0.147	10%	0.097	C	C	.	.			trans	54.8	41	-179.4	-58.6	-176.8	67.4	98.6	10.1	113.8	R63 G124 Q125 N326 R328	R63-R128 PolarHBondContact NH1-O 2.91Å; G124-R128 WeakPolarHBondContact O-CA 3.46Å; G124-R128 PolarHBondContact O-N 2.87Å; Q125-R128 WeakPolarHBondContact O-CG 3.36Å; R128-N326 PolarHBondContact NH1-O 3.1Å; R128-R328 HydrophobicContact CG-CG 4.48Å
129	R	90	Very high	91.9	Very high	99 Å²	99	26.1 Å²	26.1	37%	0.374	11%	0.114	S	C	.	.	S	Bend	trans	-132.5	161.6	173.9	-67.2	-168.4	175.4	-167.8	-3.2	111.1	I127 V134 D490 L654	I127-R129 VanDerWaalsContact C-N 3.31Å; I127-R129 HydrophobicContact CG2-CB 4.17Å; I127-R129 HydrophobicContact CG2-CG 4.24Å; I127-R129 PolarHBondContact O-N 3.34Å; R129-V134 HydrophobicContact CB-CG2 4.4Å; R129-V134 WeakPolarHBondContact O-CG2 3.49Å; R129-D490 WeakPolarHBondContact CA-OD2 3.39Å; R129-L654 VanDerWaalsContact NH2-CD2 3.34Å
130	G	89.8	Confident	91.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.129	C	C	.	.			trans	-66.8	168.6	168.8	0	0	0	0	0	112.2	I132 G133 V134 D490	G130-I132 PolarHBondContact O-N 3.02Å; G130-G133 WeakPolarHBondContact O-CA 3.45Å; G130-G133 PolarHBondContact O-N 3.49Å; G130-V134 PolarHBondContact O-N 3.36Å; G130-D490 PolarHBondContact N-OD2 3.44Å
131	S	91.4	Very high	91	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-49.2	-48.7	-173	-179.9	0	0	0	0	114	G133 V134 W135 G146	S131-G133 VanDerWaalsContact C-N 3.32Å; S131-G133 PolarHBondContact O-N 2.74Å; S131-V134 WeakPolarHBondContact O-CB 3.4Å; S131-V134 PolarHBondContact O-N 3.18Å; S131-W135 PolarHBondContact O-N 3.48Å; S131-W135 VanDerWaalsContact O-N 3.08Å; S131-W135 PolarHBondContact OG-NE1 2.96Å; S131-G146 WeakPolarHBondContact OG-CA 3.29Å
132	I	91.6	Very high	90.7	Very high	27 Å²	27	31.7 Å²	31.7	14%	0.138	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-42.6	176.4	-63.1	171.8	0	0	0	111.8	G130 N136 V147 L150 P487	G130-I132 PolarHBondContact O-N 3.02Å; I132-N136 WeakPolarHBondContact O-CB 3.41Å; I132-N136 PolarHBondContact O-N 3.22Å; I132-N136 PolarHBondContact O-ND2 2.97Å; I132-V147 HydrophobicContact CD1-CG2 4.08Å; I132-V147 HydrophobicContact CG1-CG2 4.14Å; I132-L150 HydrophobicContact CD1-CD2 4.35Å; I132-P487 HydrophobicContact CB-CB 4.13Å; I132-P487 HydrophobicContact CD1-CB 3.79Å; I132-P487 HydrophobicContact CG1-CB 3.88Å
133	G	88.9	Confident	90.3	Very high	11 Å²	11	31.8 Å²	31.8	11%	0.113	15%	0.146	C	C	.	.	H	α-helix	trans	-68.6	-37.2	-179.7	0	0	0	0	0	112.9	G130 S131 Y137	G130-G133 WeakPolarHBondContact O-CA 3.45Å; G130-G133 PolarHBondContact O-N 3.49Å; S131-G133 VanDerWaalsContact C-N 3.32Å; S131-G133 PolarHBondContact O-N 2.74Å; G133-Y137 WeakPolarHBondContact O-CB 3.36Å; G133-Y137 PolarHBondContact O-N 3.46Å; G133-Y137 VanDerWaalsContact O-N 3.11Å
134	V	92.1	Very high	90.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-54.9	175.8	158.1	0	0	0	0	111.3	V123 I127 R129 G130 S131 N136 Y137 V138 I320	V123-V134 HydrophobicContact CG1-CB 4.45Å; V123-V134 HydrophobicContact CG1-CG1 3.24Å; V123-V134 HydrophobicContact CG1-CG2 4.44Å; I127-V134 HydrophobicContact CB-CG2 4.08Å; I127-V134 HydrophobicContact CD1-CB 4.32Å; I127-V134 HydrophobicContact CD1-CG1 3.99Å; I127-V134 HydrophobicContact CD1-CG2 4.16Å; I127-V134 HydrophobicContact CG2-CG2 4.09Å; R129-V134 HydrophobicContact CB-CG2 4.4Å; R129-V134 WeakPolarHBondContact O-CG2 3.49Å; G130-V134 PolarHBondContact O-N 3.36Å; S131-V134 WeakPolarHBondContact O-CB 3.4Å; S131-V134 PolarHBondContact O-N 3.18Å; V134-N136 VanDerWaalsContact C-N 3.3Å; V134-N136 PolarHBondContact O-N 3.38Å; V134-Y137 WeakPolarHBondContact O-CB 3.42Å; V134-Y137 PolarHBondContact O-N 2.93Å; V134-V138 PolarHBondContact O-N 3.05Å; V134-I320 HydrophobicContact CB-CG2 4.34Å; V134-I320 HydrophobicContact CG2-CG2 3.71Å
135	W	92.9	Very high	90.3	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-68.9	-31.9	-175.6	-60.8	119.8	0	0	0	112.2	S131 Y137 Y139 I145 I320 E542 V546	S131-W135 PolarHBondContact O-N 3.48Å; S131-W135 VanDerWaalsContact O-N 3.08Å; S131-W135 PolarHBondContact OG-NE1 2.96Å; W135-Y137 VanDerWaalsContact C-N 3.3Å; W135-Y137 PolarHBondContact O-N 3.36Å; W135-Y139 CarbonylContact O-C 3.39Å; W135-Y139 PolarHBondContact O-N 2.87Å; W135-Y139 VanDerWaalsContact O-N 3.13Å; W135-I145 HydrophobicContact CB-CB 4.34Å; W135-I145 HydrophobicContact CD2-CB 4.29Å; W135-I145 HydrophobicContact CD2-CD1 4.46Å; W135-I145 HydrophobicContact CD2-CG2 3.96Å; W135-I145 HydrophobicContact CE3-CD1 4.37Å; W135-I145 HydrophobicContact CG-CB 3.91Å; W135-I145 HydrophobicContact CG-CG2 3.95Å; W135-I320 HydrophobicContact CZ2-CD1 4Å; W135-E542 HydrophobicContact CH2-CB 3.51Å; W135-E542 HydrophobicContact CH2-CG 3.66Å; W135-E542 HydrophobicContact CZ2-CB 3.63Å; W135-E542 VanDerWaalsContact CZ2-CD 3.42Å; W135-E542 HydrophobicContact CZ2-CG 3.24Å; W135-E542 VanDerWaalsContact CZ2-OE1 3.31Å; W135-E542 WeakPolarHBondContact CZ2-OE1 3.35Å; W135-E542 HydrophobicContact CZ3-CB 4.34Å; W135-E542 HydrophobicContact CZ3-CG 4.47Å; W135-E542 PolarHBondContact NE1-OE1 2.92Å; W135-V546 HydrophobicContact CH2-CG2 4.02Å; W135-V546 HydrophobicContact CZ3-CG2 3.84Å
136	N	89.8	Confident	90.2	Very high	44 Å²	44	31.7 Å²	31.7	24%	0.235	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-31.9	169.8	-74.7	-31.6	0	0	0	113.5	I132 V134 G143 R642	I132-N136 WeakPolarHBondContact O-CB 3.41Å; I132-N136 PolarHBondContact O-N 3.22Å; I132-N136 PolarHBondContact O-ND2 2.97Å; V134-N136 VanDerWaalsContact C-N 3.3Å; V134-N136 PolarHBondContact O-N 3.38Å; N136-G143 WeakPolarHBondContact OD1-CA 3.09Å; N136-R642 VanDerWaalsContact OD1-CZ 3.3Å; N136-R642 PolarHBondContact OD1-NH1 3.44Å; N136-R642 PolarHBondContact OD1-NH2 3.44Å
137	Y	88.4	Confident	90.3	Very high	100 Å²	100	30 Å²	30	39%	0.392	14%	0.144	S	C	.	.	H	α-helix	trans	-76.8	-42.7	178.8	179.7	-91.6	0	0	0	111.8	I127 G133 V134 W135	I127-Y137 HydrophobicContact CD1-CD1 3.69Å; I127-Y137 HydrophobicContact CD1-CE1 4.41Å; I127-Y137 HydrophobicContact CD1-CG 4.4Å; I127-Y137 HydrophobicContact CG1-CD1 3.82Å; I127-Y137 HydrophobicContact CG1-CE1 4.17Å; I127-Y137 HydrophobicContact CG2-CD1 4.19Å; I127-Y137 HydrophobicContact CG2-CG 4.06Å; G133-Y137 WeakPolarHBondContact O-CB 3.36Å; G133-Y137 PolarHBondContact O-N 3.46Å; G133-Y137 VanDerWaalsContact O-N 3.11Å; V134-Y137 WeakPolarHBondContact O-CB 3.42Å; V134-Y137 PolarHBondContact O-N 2.93Å; W135-Y137 VanDerWaalsContact C-N 3.3Å; W135-Y137 PolarHBondContact O-N 3.36Å
138	V	88.9	Confident	90.5	Very high	22 Å²	22	28.7 Å²	28.7	13%	0.133	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-54.8	178.7	174.1	0	0	0	0	110.6	I127 V134 Y550	I127-V138 HydrophobicContact CD1-CG2 4.01Å; V134-V138 PolarHBondContact O-N 3.05Å; V138-Y550 HydrophobicContact CG1-CD2 4.14Å; V138-Y550 HydrophobicContact CG1-CG 4.39Å
139	Y	87.1	Confident	90.6	Very high	88 Å²	88	26.9 Å²	26.9	35%	0.345	13%	0.13	S	C	.	.			trans	-155	115.4	174.6	-172	-112.9	0	0	0	110.3	W135 Q141 L142 I549	W135-Y139 CarbonylContact O-C 3.39Å; W135-Y139 PolarHBondContact O-N 2.87Å; W135-Y139 VanDerWaalsContact O-N 3.13Å; Y139-Q141 VanDerWaalsContact C-N 3.28Å; Y139-Q141 HydrophobicContact CD1-CB 3.92Å; Y139-Q141 HydrophobicContact CD1-CG 4.47Å; Y139-Q141 HydrophobicContact CE1-CB 3.53Å; Y139-Q141 HydrophobicContact CE1-CG 3.78Å; Y139-Q141 PolarHBondContact O-N 2.98Å; Y139-Q141 VanDerWaalsContact O-N 3.08Å; Y139-Q141 PolarHBondContact OH-OE1 2.99Å; Y139-L142 HydrophobicContact CD1-CB 4.42Å; Y139-L142 HydrophobicContact CD1-CD1 3.84Å; Y139-L142 HydrophobicContact CD1-CG 3.85Å; Y139-L142 HydrophobicContact CG-CD1 4.43Å; Y139-L142 PolarHBondContact O-N 3.37Å; Y139-I549 HydrophobicContact CD2-CG2 4.26Å; Y139-I549 HydrophobicContact CG-CG2 4.11Å
140	P	84.8	Confident	90.8	Very high	52 Å²	52	23.3 Å²	23.3	34%	0.338	12%	0.118	S	C	.	.	G	3₁₀ helix	trans	-52.7	-38.2	-172.6	-29.8	35	0	0	0	114.5	L142 G143 R642	P140-L142 PolarHBondContact O-N 2.86Å; P140-L142 VanDerWaalsContact O-N 3.14Å; P140-G143 PolarHBondContact O-N 3.4Å; P140-R642 VanDerWaalsContact O-CD 3.22Å; P140-R642 WeakPolarHBondContact O-CD 3.49Å; P140-R642 PolarHBondContact O-NH1 3.01Å
141	Q	87.4	Confident	91	Very high	41 Å²	41	26.5 Å²	26.5	19%	0.192	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-68.9	-16.4	-177.8	-54.7	178.5	-21.7	0	0	113.4	Y139 F639 R642	Y139-Q141 VanDerWaalsContact C-N 3.28Å; Y139-Q141 HydrophobicContact CD1-CB 3.92Å; Y139-Q141 HydrophobicContact CD1-CG 4.47Å; Y139-Q141 HydrophobicContact CE1-CB 3.53Å; Y139-Q141 HydrophobicContact CE1-CG 3.78Å; Y139-Q141 PolarHBondContact O-N 2.98Å; Y139-Q141 VanDerWaalsContact O-N 3.08Å; Y139-Q141 PolarHBondContact OH-OE1 2.99Å; Q141-F639 HydrophobicContact CB-CD2 3.91Å; Q141-F639 HydrophobicContact CB-CE2 4.16Å; Q141-F639 WeakPolarHBondContact O-CA 3.41Å; Q141-R642 HydrophobicContact CG-CB 4.28Å
142	L	89.3	Confident	91.1	Very high	29 Å²	29	26.4 Å²	26.4	15%	0.152	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-95.7	12	179.3	-67.1	168.5	0	0	0	113.4	Y139 P140 G144 I145 S545 I549	Y139-L142 HydrophobicContact CD1-CB 4.42Å; Y139-L142 HydrophobicContact CD1-CD1 3.84Å; Y139-L142 HydrophobicContact CD1-CG 3.85Å; Y139-L142 HydrophobicContact CG-CD1 4.43Å; Y139-L142 PolarHBondContact O-N 3.37Å; P140-L142 PolarHBondContact O-N 2.86Å; P140-L142 VanDerWaalsContact O-N 3.14Å; L142-G144 PolarHBondContact O-N 2.79Å; L142-I145 HydrophobicContact CB-CD1 3.96Å; L142-I145 HydrophobicContact CB-CG1 4.48Å; L142-I145 HydrophobicContact CD2-CD1 4.37Å; L142-I145 WeakPolarHBondContact O-CB 3.33Å; L142-I145 WeakPolarHBondContact O-CG1 3.3Å; L142-I145 PolarHBondContact O-N 3.48Å; L142-S545 WeakPolarHBondContact CD1-OG 3.21Å; L142-I549 HydrophobicContact CD1-CD1 3.35Å
143	G	87.8	Confident	91.1	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.01	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20	172.9	0	0	0	0	0	114.8	N136 P140 I145 G146	N136-G143 WeakPolarHBondContact OD1-CA 3.09Å; P140-G143 PolarHBondContact O-N 3.4Å; G143-I145 PolarHBondContact O-N 3.26Å; G143-G146 PolarHBondContact O-N 2.91Å
144	G	92.6	Very high	91.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-26.1	175.4	0	0	0	0	0	113.8	L142 G146 V147 S148	L142-G144 PolarHBondContact O-N 2.79Å; G144-G146 VanDerWaalsContact C-N 3.34Å; G144-G146 PolarHBondContact O-N 3.22Å; G144-V147 PolarHBondContact O-N 3.24Å; G144-S148 WeakPolarHBondContact O-CB 3.26Å; G144-S148 PolarHBondContact O-N 3.12Å
145	I	95	Very high	91.5	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-57.7	-48.3	177.5	-63.8	175.6	0	0	0	110.4	W135 L142 G143 V147 S148 S149 V538 L541 E542 S545 L635	W135-I145 HydrophobicContact CB-CB 4.34Å; W135-I145 HydrophobicContact CD2-CB 4.29Å; W135-I145 HydrophobicContact CD2-CD1 4.46Å; W135-I145 HydrophobicContact CD2-CG2 3.96Å; W135-I145 HydrophobicContact CE3-CD1 4.37Å; W135-I145 HydrophobicContact CG-CB 3.91Å; W135-I145 HydrophobicContact CG-CG2 3.95Å; L142-I145 HydrophobicContact CB-CD1 3.96Å; L142-I145 HydrophobicContact CB-CG1 4.48Å; L142-I145 HydrophobicContact CD2-CD1 4.37Å; L142-I145 WeakPolarHBondContact O-CB 3.33Å; L142-I145 WeakPolarHBondContact O-CG1 3.3Å; L142-I145 PolarHBondContact O-N 3.48Å; G143-I145 PolarHBondContact O-N 3.26Å; I145-V147 VanDerWaalsContact C-N 3.34Å; I145-V147 PolarHBondContact O-N 3.44Å; I145-S148 PolarHBondContact O-N 3.33Å; I145-S149 PolarHBondContact O-N 3.08Å; I145-S149 PolarHBondContact O-OG 2.95Å; I145-V538 HydrophobicContact CG2-CG1 4.15Å; I145-L541 HydrophobicContact CD1-CB 3.85Å; I145-L541 HydrophobicContact CG1-CB 4.14Å; I145-E542 HydrophobicContact CG2-CG 3.44Å; I145-E542 VanDerWaalsContact CG2-CG 3.44Å; I145-S545 VanDerWaalsContact CD1-OG 3.29Å; I145-S545 WeakPolarHBondContact CD1-OG 3.33Å; I145-L635 HydrophobicContact CB-CD2 4.41Å; I145-L635 HydrophobicContact CG1-CD2 4.03Å
146	G	93.3	Very high	91.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-69.2	-29.9	179.6	0	0	0	0	0	113.8	S131 G143 G144 L150	S131-G146 WeakPolarHBondContact OG-CA 3.29Å; G143-G146 PolarHBondContact O-N 2.91Å; G144-G146 VanDerWaalsContact C-N 3.34Å; G144-G146 PolarHBondContact O-N 3.22Å; G146-L150 WeakPolarHBondContact O-CB 3.44Å; G146-L150 PolarHBondContact O-N 2.59Å; G146-L150 VanDerWaalsContact O-N 3.08Å
147	V	93.6	Very high	91.7	Very high	43 Å²	43	25.3 Å²	25.3	26%	0.261	13%	0.13	S	C	.	.	H	α-helix	trans	-74	-37.5	175.1	-176.8	0	0	0	0	110.8	I132 G144 I145 L150 M151 P634	I132-V147 HydrophobicContact CD1-CG2 4.08Å; I132-V147 HydrophobicContact CG1-CG2 4.14Å; G144-V147 PolarHBondContact O-N 3.24Å; I145-V147 VanDerWaalsContact C-N 3.34Å; I145-V147 PolarHBondContact O-N 3.44Å; V147-L150 WeakPolarHBondContact O-CB 3.3Å; V147-L150 PolarHBondContact O-N 2.99Å; V147-M151 WeakPolarHBondContact O-CG 3.22Å; V147-M151 PolarHBondContact O-N 3.42Å; V147-M151 VanDerWaalsContact O-N 3.09Å; V147-P634 HydrophobicContact CB-CB 3.82Å; V147-P634 HydrophobicContact CB-CG 4.46Å; V147-P634 HydrophobicContact CG1-CB 3.68Å; V147-P634 HydrophobicContact CG1-CG 3.89Å
148	S	95.1	Very high	92	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.2	-44.5	173.3	-176.2	0	0	0	0	111.2	G144 I145 L150 M151 V152 V538 A631	G144-S148 WeakPolarHBondContact O-CB 3.26Å; G144-S148 PolarHBondContact O-N 3.12Å; I145-S148 PolarHBondContact O-N 3.33Å; S148-L150 VanDerWaalsContact C-N 3.26Å; S148-L150 PolarHBondContact O-N 3.43Å; S148-M151 PolarHBondContact O-N 3.41Å; S148-M151 VanDerWaalsContact O-N 3.08Å; S148-V152 WeakPolarHBondContact O-CG2 3.42Å; S148-V152 PolarHBondContact O-N 3.05Å; S148-V538 VanDerWaalsContact OG-CG2 3.32Å; S148-V538 WeakPolarHBondContact OG-CG2 3.35Å; S148-A631 WeakPolarHBondContact CB-O 3.15Å; S148-A631 PolarHBondContact OG-O 3.15Å
149	S	93.6	Very high	92.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-54.9	-42.5	172.8	-52.6	0	0	0	0	111.8	I145 V152 C153 G315 V538	I145-S149 PolarHBondContact O-N 3.08Å; I145-S149 PolarHBondContact O-OG 2.95Å; S149-V152 PolarHBondContact O-N 3.37Å; S149-C153 WeakPolarHBondContact O-CB 3.42Å; S149-C153 PolarHBondContact O-N 3.42Å; S149-G315 WeakPolarHBondContact CB-O 3.38Å; S149-G315 PolarHBondContact OG-O 3.07Å; S149-V538 WeakPolarHBondContact OG-CG1 3.42Å
150	L	93.7	Very high	92.4	Very high	24 Å²	24	17.3 Å²	17.3	13%	0.126	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-44.6	176.3	-176.4	73.7	0	0	0	112.2	I132 G146 V147 S148 G154 I484 I488	I132-L150 HydrophobicContact CD1-CD2 4.35Å; G146-L150 WeakPolarHBondContact O-CB 3.44Å; G146-L150 PolarHBondContact O-N 2.59Å; G146-L150 VanDerWaalsContact O-N 3.08Å; V147-L150 WeakPolarHBondContact O-CB 3.3Å; V147-L150 PolarHBondContact O-N 2.99Å; S148-L150 VanDerWaalsContact C-N 3.26Å; S148-L150 PolarHBondContact O-N 3.43Å; L150-G154 PolarHBondContact O-N 2.75Å; L150-I484 VanDerWaalsContact CD1-CA 3.46Å; L150-I484 HydrophobicContact CD1-CB 4.01Å; L150-I484 HydrophobicContact CD1-CG1 4.1Å; L150-I484 HydrophobicContact CD1-CG2 3.94Å; L150-I488 HydrophobicContact CD1-CD1 4.49Å; L150-I488 HydrophobicContact CD2-CD1 4.5Å; L150-I488 HydrophobicContact CD2-CG1 4.46Å
151	M	93.9	Very high	92.9	Very high	67 Å²	67	14.9 Å²	14.9	33%	0.33	8%	0.082	S	C	.	.	H	α-helix	trans	-64.2	-45.5	178.8	-68.3	-60.4	100.2	0	0	111.4	V147 S148 G154 F155 P634	V147-M151 WeakPolarHBondContact O-CG 3.22Å; V147-M151 PolarHBondContact O-N 3.42Å; V147-M151 VanDerWaalsContact O-N 3.09Å; S148-M151 PolarHBondContact O-N 3.41Å; S148-M151 VanDerWaalsContact O-N 3.08Å; M151-G154 WeakPolarHBondContact O-CA 3.39Å; M151-G154 PolarHBondContact O-N 2.83Å; M151-G154 VanDerWaalsContact O-N 3.12Å; M151-F155 PolarHBondContact O-N 2.92Å; M151-P634 HydrophobicContact CG-CG 4.27Å
152	V	93.3	Very high	93.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.6	-44.5	178.2	178.4	0	0	0	0	111.3	S148 S149 G154 F155 V156 A531 P534 L535 A631	S148-V152 WeakPolarHBondContact O-CG2 3.42Å; S148-V152 PolarHBondContact O-N 3.05Å; S149-V152 PolarHBondContact O-N 3.37Å; V152-G154 PolarHBondContact O-N 3.49Å; V152-F155 PolarHBondContact O-N 3.29Å; V152-V156 HydrophobicContact CG1-CG2 4.29Å; V152-V156 WeakPolarHBondContact O-CG2 3.21Å; V152-V156 PolarHBondContact O-N 2.85Å; V152-A531 HydrophobicContact CG1-CB 4.08Å; V152-P534 HydrophobicContact CG2-CB 3.8Å; V152-L535 HydrophobicContact CB-CD2 4.32Å; V152-L535 HydrophobicContact CG1-CD1 4.35Å; V152-L535 HydrophobicContact CG1-CD2 3.49Å; V152-L535 VanDerWaalsContact CG1-CD2 3.49Å; V152-L535 HydrophobicContact CG1-CG 3.7Å; V152-A631 HydrophobicContact CG2-CB 3.97Å
153	C	92.9	Very high	93.5	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-55.1	-41.8	171.4	-91.2	0	0	0	0	112.4	S149 G157 F316 T480 I484	S149-C153 WeakPolarHBondContact O-CB 3.42Å; S149-C153 PolarHBondContact O-N 3.42Å; C153-G157 PolarHBondContact O-N 3.19Å; C153-F316 VanDerWaalsContact SG-CB 3.53Å; C153-F316 PolarHBondContact SG-O 2.97Å; C153-T480 HydrophobicContact CB-CG2 4.17Å; C153-T480 WeakPolarHBondContact O-CG2 3.47Å; C153-I484 HydrophobicContact CB-CD1 4.26Å; C153-I484 HydrophobicContact CB-CG1 3.83Å
154	G	94.1	Very high	93.9	Very high	23 Å²	23	12.1 Å²	12.1	24%	0.237	7%	0.068	C	C	.	.	H	α-helix	trans	-58.4	-52.7	175.3	0	0	0	0	0	111.9	L150 M151 V152 G157 L158	L150-G154 PolarHBondContact O-N 2.75Å; M151-G154 WeakPolarHBondContact O-CA 3.39Å; M151-G154 PolarHBondContact O-N 2.83Å; M151-G154 VanDerWaalsContact O-N 3.12Å; V152-G154 PolarHBondContact O-N 3.49Å; G154-G157 PolarHBondContact O-N 3.01Å; G154-L158 VanDerWaalsContact O-CG 3.27Å; G154-L158 WeakPolarHBondContact O-CG 3.3Å; G154-L158 PolarHBondContact O-N 2.93Å
155	F	94.3	Very high	94.1	Very high	33 Å²	33	12.1 Å²	12.1	15%	0.145	7%	0.068	C	C	.	.	H	α-helix	trans	-61	-46.5	179.3	-65	-30.3	0	0	0	112.7	M151 V152 L158 Y159 F526 L627 V630 A631	M151-F155 PolarHBondContact O-N 2.92Å; V152-F155 PolarHBondContact O-N 3.29Å; F155-L158 WeakPolarHBondContact O-CB 3.18Å; F155-L158 PolarHBondContact O-N 3.1Å; F155-Y159 VanDerWaalsContact O-CD1 3.27Å; F155-Y159 WeakPolarHBondContact O-CD1 3.43Å; F155-F526 HydrophobicContact CB-CD1 4.4Å; F155-F526 HydrophobicContact CD1-CE1 4.1Å; F155-L627 HydrophobicContact CE1-CD2 4.35Å; F155-L627 HydrophobicContact CE2-CD2 4.46Å; F155-L627 HydrophobicContact CZ-CD2 4.21Å; F155-V630 HydrophobicContact CE2-CG1 4.42Å; F155-V630 HydrophobicContact CZ-CB 4.37Å; F155-V630 HydrophobicContact CZ-CG1 3.85Å; F155-A631 HydrophobicContact CD2-CB 4.38Å; F155-A631 HydrophobicContact CE2-CB 4.03Å
156	V	92.4	Very high	94.2	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.012	7%	0.068	C	C	.	.	H	α-helix	trans	-63.8	-44.5	178.5	179.7	0	0	0	0	111.6	V152 L158 Y159 Y160 F310 F316 A531	V152-V156 HydrophobicContact CG1-CG2 4.29Å; V152-V156 WeakPolarHBondContact O-CG2 3.21Å; V152-V156 PolarHBondContact O-N 2.85Å; V156-L158 PolarHBondContact O-N 3.38Å; V156-Y159 VanDerWaalsContact CA-CE1 3.49Å; V156-Y159 HydrophobicContact CB-CE1 4.17Å; V156-Y159 HydrophobicContact CG1-CE1 4.21Å; V156-Y159 HydrophobicContact CG2-CE1 4.15Å; V156-Y159 PolarHBondContact O-N 3.22Å; V156-Y160 HydrophobicContact CG1-CD1 3.51Å; V156-Y160 HydrophobicContact CG1-CE1 3.58Å; V156-Y160 HydrophobicContact CG1-CG 4.12Å; V156-Y160 WeakPolarHBondContact O-CB 3.28Å; V156-Y160 WeakPolarHBondContact O-CD1 3.37Å; V156-Y160 PolarHBondContact O-N 2.89Å; V156-F310 HydrophobicContact CG2-CE1 4.27Å; V156-F316 HydrophobicContact CB-CE1 4Å; V156-F316 HydrophobicContact CG1-CE1 3.94Å; V156-F316 HydrophobicContact CG2-CE1 3.9Å; V156-F316 HydrophobicContact CG2-CZ 4.3Å; V156-A531 HydrophobicContact CG2-CB 3.64Å
157	G	94	Very high	94.3	Very high	3 Å²	3	12.1 Å²	12.1	3%	0.031	7%	0.068	C	C	.	.	H	α-helix	trans	-60.8	-31.6	177.9	0	0	0	0	0	113.6	C153 G154 N161 M477	C153-G157 PolarHBondContact O-N 3.19Å; G154-G157 PolarHBondContact O-N 3.01Å; G157-N161 WeakPolarHBondContact O-CB 3.18Å; G157-N161 PolarHBondContact O-N 3.04Å; G157-M477 WeakPolarHBondContact O-CE 3.2Å
158	L	94.8	Very high	94.5	Very high	16 Å²	16	10.3 Å²	10.3	8%	0.084	6%	0.057	C	C	.	.	H	α-helix	trans	-64.6	-55.3	178	-74.2	172.7	0	0	0	112.1	G154 F155 V156 V162 A507 L510 F514	G154-L158 VanDerWaalsContact O-CG 3.27Å; G154-L158 WeakPolarHBondContact O-CG 3.3Å; G154-L158 PolarHBondContact O-N 2.93Å; F155-L158 WeakPolarHBondContact O-CB 3.18Å; F155-L158 PolarHBondContact O-N 3.1Å; V156-L158 PolarHBondContact O-N 3.38Å; L158-V162 WeakPolarHBondContact O-CG2 3.37Å; L158-A507 HydrophobicContact CD2-CB 3.93Å; L158-A507 VanDerWaalsContact CD2-O 3.25Å; L158-A507 WeakPolarHBondContact CD2-O 3.37Å; L158-L510 HydrophobicContact CD1-CB 4.24Å; L158-L510 HydrophobicContact CD1-CD1 4.4Å; L158-L510 HydrophobicContact CD2-CB 3.78Å; L158-F514 HydrophobicContact CB-CE2 3.88Å; L158-F514 HydrophobicContact CB-CZ 4.45Å
159	Y	92.6	Very high	94.6	Very high	2 Å²	2	11 Å²	11	1%	0.008	6%	0.06	C	C	.	.	H	α-helix	trans	-79.9	-30.4	-175.7	77.9	-94.7	0	0	0	113	F155 V156 N161 V162 I163 V523 F526 D527	F155-Y159 VanDerWaalsContact O-CD1 3.27Å; F155-Y159 WeakPolarHBondContact O-CD1 3.43Å; V156-Y159 VanDerWaalsContact CA-CE1 3.49Å; V156-Y159 HydrophobicContact CB-CE1 4.17Å; V156-Y159 HydrophobicContact CG1-CE1 4.21Å; V156-Y159 HydrophobicContact CG2-CE1 4.15Å; V156-Y159 PolarHBondContact O-N 3.22Å; Y159-N161 VanDerWaalsContact C-N 3.27Å; Y159-N161 PolarHBondContact O-N 3.1Å; Y159-V162 WeakPolarHBondContact O-CB 3.21Å; Y159-V162 PolarHBondContact O-N 3.35Å; Y159-V162 VanDerWaalsContact O-N 3.1Å; Y159-I163 HydrophobicContact CD2-CD1 4.38Å; Y159-I163 PolarHBondContact O-N 3.38Å; Y159-V523 HydrophobicContact CD2-CG1 4.24Å; Y159-F526 HydrophobicContact CD1-CB 3.99Å; Y159-F526 HydrophobicContact CG-CB 4.42Å; Y159-D527 HydrophobicContact CD2-CB 4.45Å; Y159-D527 HydrophobicContact CE2-CB 3.78Å; Y159-D527 WeakPolarHBondContact CE2-OD1 3.38Å; Y159-D527 VanDerWaalsContact CZ-OD1 3.31Å; Y159-D527 PolarHBondContact OH-OD1 3.41Å
160	Y	92.1	Very high	94.8	Very high	24 Å²	24	11.1 Å²	11.1	9%	0.094	6%	0.06	C	C	.	.	H	α-helix	trans	-59.3	-40.6	174.2	-94.1	55.1	0	0	0	111.6	L83 V156 V162 I163 I164	L83-Y160 HydrophobicContact CD1-CD2 4.36Å; V156-Y160 HydrophobicContact CG1-CD1 3.51Å; V156-Y160 HydrophobicContact CG1-CE1 3.58Å; V156-Y160 HydrophobicContact CG1-CG 4.12Å; V156-Y160 WeakPolarHBondContact O-CB 3.28Å; V156-Y160 WeakPolarHBondContact O-CD1 3.37Å; V156-Y160 PolarHBondContact O-N 2.89Å; Y160-V162 PolarHBondContact O-N 3.2Å; Y160-I163 PolarHBondContact O-N 3.32Å; Y160-I163 VanDerWaalsContact O-N 3.13Å; Y160-I164 PolarHBondContact O-N 2.95Å; Y160-I164 VanDerWaalsContact O-N 3.14Å
161	N	95.4	Very high	95	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-70.1	-22.5	179.7	-153.5	50.4	0	0	0	113.1	G157 Y159 I164 G165 W238 V241 M477	G157-N161 WeakPolarHBondContact O-CB 3.18Å; G157-N161 PolarHBondContact O-N 3.04Å; Y159-N161 VanDerWaalsContact C-N 3.27Å; Y159-N161 PolarHBondContact O-N 3.1Å; N161-I164 PolarHBondContact O-N 3.09Å; N161-G165 PolarHBondContact O-N 3.26Å; N161-W238 HydrophobicContact CB-CH2 4.31Å; N161-W238 HydrophobicContact CB-CZ2 3.79Å; N161-W238 PolarHBondContact ND2-N 2.94Å; N161-W238 PolarHBondContact ND2-NE1 3.04Å; N161-W238 VanDerWaalsContact ND2-NE1 3.15Å; N161-V241 WeakPolarHBondContact OD1-CG2 3.3Å; N161-M477 HydrophobicContact CB-CE 3.84Å; N161-M477 HydrophobicContact CB-SD 4.24Å
162	V	95.6	Very high	95.1	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.012	7%	0.073	C	C	.	.	H	α-helix	trans	-66.7	-41.4	170.8	178.8	0	0	0	0	110.3	L158 Y159 Y160 I164 G165 W166 L234 F514 V523	L158-V162 WeakPolarHBondContact O-CG2 3.37Å; Y159-V162 WeakPolarHBondContact O-CB 3.21Å; Y159-V162 PolarHBondContact O-N 3.35Å; Y159-V162 VanDerWaalsContact O-N 3.1Å; Y160-V162 PolarHBondContact O-N 3.2Å; V162-I164 VanDerWaalsContact C-N 3.32Å; V162-I164 PolarHBondContact O-N 2.85Å; V162-G165 CarbonylContact O-C 3.47Å; V162-G165 VanDerWaalsContact O-CA 3.29Å; V162-G165 WeakPolarHBondContact O-CA 3.39Å; V162-G165 PolarHBondContact O-N 3.07Å; V162-W166 HydrophobicContact CG1-CD2 4.35Å; V162-W166 HydrophobicContact CG1-CH2 4.44Å; V162-W166 HydrophobicContact CG1-CZ2 3.73Å; V162-W166 PolarHBondContact O-N 3.42Å; V162-L234 HydrophobicContact CG2-CD1 4.07Å; V162-F514 HydrophobicContact CB-CB 4.28Å; V162-F514 HydrophobicContact CG1-CB 3.97Å; V162-F514 HydrophobicContact CG2-CB 3.47Å; V162-F514 VanDerWaalsContact CG2-CB 3.47Å; V162-F514 HydrophobicContact CG2-CD2 3.69Å; V162-F514 HydrophobicContact CG2-CG 3.84Å; V162-V523 HydrophobicContact CG1-CG2 4.17Å
163	I	94.3	Very high	95.3	Very high	7 Å²	7	17.3 Å²	17.3	4%	0.036	9%	0.085	C	C	.	.	H	α-helix	trans	-67.9	-34.7	178.1	-49.4	170.8	0	0	0	111.5	W87 Y159 Y160 G165 W166 S167 T441 F445	W87-I163 HydrophobicContact CH2-CB 4.19Å; W87-I163 HydrophobicContact CH2-CD1 4.33Å; W87-I163 HydrophobicContact CH2-CG2 3.18Å; W87-I163 HydrophobicContact CZ2-CD1 3.79Å; W87-I163 HydrophobicContact CZ2-CG2 3.74Å; W87-I163 HydrophobicContact CZ3-CG2 4.02Å; Y159-I163 HydrophobicContact CD2-CD1 4.38Å; Y159-I163 PolarHBondContact O-N 3.38Å; Y160-I163 PolarHBondContact O-N 3.32Å; Y160-I163 VanDerWaalsContact O-N 3.13Å; I163-G165 VanDerWaalsContact C-N 3.31Å; I163-W166 HydrophobicContact CB-CE3 4.16Å; I163-W166 HydrophobicContact CG1-CE3 4.01Å; I163-W166 HydrophobicContact CG1-CZ3 3.93Å; I163-W166 HydrophobicContact CG2-CE3 3.99Å; I163-W166 PolarHBondContact O-N 3.28Å; I163-S167 PolarHBondContact O-N 3.49Å; I163-S167 PolarHBondContact O-OG 3.1Å; I163-T441 HydrophobicContact CD1-CG2 4.19Å; I163-T441 HydrophobicContact CG1-CG2 4.44Å; I163-T441 HydrophobicContact CG2-CG2 4.42Å; I163-F445 HydrophobicContact CG2-CE2 3.99Å; I163-F445 HydrophobicContact CG2-CZ 4.22Å
164	I	95.9	Very high	95.5	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-42.9	168.5	-62	172.5	0	0	0	110	L83 Y160 N161 V162 W166 S167 I168 A237 G473 M477	L83-I164 HydrophobicContact CD1-CG1 4.21Å; Y160-I164 PolarHBondContact O-N 2.95Å; Y160-I164 VanDerWaalsContact O-N 3.14Å; N161-I164 PolarHBondContact O-N 3.09Å; V162-I164 VanDerWaalsContact C-N 3.32Å; V162-I164 PolarHBondContact O-N 2.85Å; I164-W166 PolarHBondContact O-N 3.18Å; I164-S167 WeakPolarHBondContact O-CB 3.38Å; I164-S167 PolarHBondContact O-N 2.91Å; I164-S167 VanDerWaalsContact O-N 3.12Å; I164-I168 HydrophobicContact CG2-CD1 4.01Å; I164-I168 HydrophobicContact CG2-CG1 4.38Å; I164-I168 WeakPolarHBondContact O-CG1 3.43Å; I164-I168 PolarHBondContact O-N 3.44Å; I164-A237 HydrophobicContact CB-CB 4.37Å; I164-A237 HydrophobicContact CG2-CB 4.01Å; I164-G473 WeakPolarHBondContact CD1-O 3.26Å; I164-M477 HydrophobicContact CD1-CB 4.42Å; I164-M477 HydrophobicContact CD1-CG 3.45Å; I164-M477 VanDerWaalsContact CD1-CG 3.45Å
165	G	96.8	Very high	95.5	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-55.5	-45.8	172.6	0	0	0	0	0	113.1	N161 V162 I163 S167 I168 F169 S233	N161-G165 PolarHBondContact O-N 3.26Å; V162-G165 CarbonylContact O-C 3.47Å; V162-G165 VanDerWaalsContact O-CA 3.29Å; V162-G165 WeakPolarHBondContact O-CA 3.39Å; V162-G165 PolarHBondContact O-N 3.07Å; I163-G165 VanDerWaalsContact C-N 3.31Å; G165-S167 VanDerWaalsContact C-N 3.33Å; G165-S167 PolarHBondContact O-N 3.39Å; G165-I168 PolarHBondContact O-N 3.04Å; G165-F169 PolarHBondContact O-N 3.47Å; G165-S233 VanDerWaalsContact O-CB 3.27Å; G165-S233 WeakPolarHBondContact O-CB 3.32Å
166	W	96.4	Very high	95.5	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-43.2	173.6	-60.9	-24.4	0	0	0	111.7	V162 I163 I164 I168 F169 Y170 W209 L214 M230 T441 F445 N520 V523	V162-W166 HydrophobicContact CG1-CD2 4.35Å; V162-W166 HydrophobicContact CG1-CH2 4.44Å; V162-W166 HydrophobicContact CG1-CZ2 3.73Å; V162-W166 PolarHBondContact O-N 3.42Å; I163-W166 HydrophobicContact CB-CE3 4.16Å; I163-W166 HydrophobicContact CG1-CE3 4.01Å; I163-W166 HydrophobicContact CG1-CZ3 3.93Å; I163-W166 HydrophobicContact CG2-CE3 3.99Å; I163-W166 PolarHBondContact O-N 3.28Å; I164-W166 PolarHBondContact O-N 3.18Å; W166-I168 VanDerWaalsContact C-N 3.34Å; W166-I168 PolarHBondContact O-N 2.82Å; W166-F169 WeakPolarHBondContact O-CB 3.44Å; W166-F169 PolarHBondContact O-N 3.48Å; W166-Y170 WeakPolarHBondContact O-CD2 3.34Å; W166-Y170 PolarHBondContact O-N 2.96Å; W166-Y170 VanDerWaalsContact O-N 3.08Å; W166-W209 HydrophobicContact CB-CZ3 4.41Å; W166-W209 AromaticContact CD2-CH2 3.73Å; W166-W209 HydrophobicContact CD2-CH2 3.73Å; W166-W209 HydrophobicContact CD2-CZ3 4.4Å; W166-W209 AromaticContact CE3-CH2 3.56Å; W166-W209 HydrophobicContact CE3-CH2 3.56Å; W166-W209 HydrophobicContact CE3-CZ2 4.34Å; W166-W209 HydrophobicContact CG-CH2 4.17Å; W166-W209 HydrophobicContact CG-CZ3 4.38Å; W166-W209 AromaticContact CZ3-CH2 3.97Å; W166-W209 HydrophobicContact CZ3-CH2 3.97Å; W166-W209 HydrophobicContact CZ3-CZ2 4.31Å; W166-L214 HydrophobicContact CZ2-CD2 3.98Å; W166-M230 VanDerWaalsContact CD1-SD 3.56Å; W166-T441 HydrophobicContact CE3-CG2 4.43Å; W166-T441 HydrophobicContact CZ3-CG2 3.85Å; W166-F445 HydrophobicContact CB-CE1 3.94Å; W166-F445 HydrophobicContact CB-CE2 4.23Å; W166-F445 HydrophobicContact CB-CZ 3.62Å; W166-F445 HydrophobicContact CE3-CE2 4.1Å; W166-N520 WeakPolarHBondContact CH2-OD1 3.44Å; W166-V523 HydrophobicContact CH2-CB 4.16Å; W166-V523 HydrophobicContact CH2-CG1 3.99Å; W166-V523 HydrophobicContact CH2-CG2 3.96Å; W166-V523 HydrophobicContact CZ2-CG2 4.17Å; W166-V523 HydrophobicContact CZ3-CG1 4.46Å
167	S	96.3	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.9	-39.1	177.7	-53.8	0	0	0	0	112.4	I163 I164 G165 Y170 F171	I163-S167 PolarHBondContact O-N 3.49Å; I163-S167 PolarHBondContact O-OG 3.1Å; I164-S167 WeakPolarHBondContact O-CB 3.38Å; I164-S167 PolarHBondContact O-N 2.91Å; I164-S167 VanDerWaalsContact O-N 3.12Å; G165-S167 VanDerWaalsContact C-N 3.33Å; G165-S167 PolarHBondContact O-N 3.39Å; S167-Y170 PolarHBondContact O-N 2.81Å; S167-F171 VanDerWaalsContact O-CB 3.3Å; S167-F171 WeakPolarHBondContact O-CB 3.38Å; S167-F171 PolarHBondContact O-N 3.35Å
168	I	97.8	Very high	95.3	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-44	174.5	-70.3	169.5	0	0	0	111	I164 G165 W166 F171 F172 V236 A237 L240 I470	I164-I168 HydrophobicContact CG2-CD1 4.01Å; I164-I168 HydrophobicContact CG2-CG1 4.38Å; I164-I168 WeakPolarHBondContact O-CG1 3.43Å; I164-I168 PolarHBondContact O-N 3.44Å; G165-I168 PolarHBondContact O-N 3.04Å; W166-I168 VanDerWaalsContact C-N 3.34Å; W166-I168 PolarHBondContact O-N 2.82Å; I168-F171 WeakPolarHBondContact O-CB 3.49Å; I168-F171 PolarHBondContact O-N 3.42Å; I168-F172 HydrophobicContact CG2-CD2 3.76Å; I168-F172 HydrophobicContact CG2-CE2 3.55Å; I168-F172 WeakPolarHBondContact O-CD2 3.41Å; I168-F172 PolarHBondContact O-N 3.4Å; I168-F172 VanDerWaalsContact O-N 3.11Å; I168-V236 HydrophobicContact CD1-CB 4.49Å; I168-V236 HydrophobicContact CD1-CG1 4.13Å; I168-V236 HydrophobicContact CG2-CG1 4.28Å; I168-A237 HydrophobicContact CD1-CB 3.81Å; I168-L240 HydrophobicContact CD1-CD1 3.91Å; I168-I470 HydrophobicContact CB-CD1 4.47Å; I168-I470 HydrophobicContact CG1-CD1 3.81Å; I168-I470 HydrophobicContact CG1-CG1 3.97Å
169	F	97.3	Very high	95.4	Very high	16 Å²	16	36.7 Å²	36.7	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-49.5	177.2	176.6	-103.5	0	0	0	111.6	G165 W166 F171 F172 Q173 F208 T213 K229 M230	G165-F169 PolarHBondContact O-N 3.47Å; W166-F169 WeakPolarHBondContact O-CB 3.44Å; W166-F169 PolarHBondContact O-N 3.48Å; F169-F171 PolarHBondContact O-N 2.89Å; F169-F172 PolarHBondContact O-N 3.13Å; F169-Q173 HydrophobicContact CD1-CG 4.44Å; F169-Q173 HydrophobicContact CE1-CG 4.11Å; F169-Q173 HydrophobicContact CE2-CG 4.17Å; F169-Q173 HydrophobicContact CZ-CG 3.97Å; F169-Q173 VanDerWaalsContact O-CG 3.29Å; F169-Q173 WeakPolarHBondContact O-CG 3.31Å; F169-Q173 PolarHBondContact O-N 2.85Å; F169-Q173 VanDerWaalsContact O-N 3.07Å; F169-F208 HydrophobicContact CE1-CE1 4.07Å; F169-F208 AromaticContact CE1-CZ 3.9Å; F169-F208 HydrophobicContact CE1-CZ 3.9Å; F169-F208 HydrophobicContact CZ-CZ 4.39Å; F169-T213 HydrophobicContact CD1-CG2 3.84Å; F169-T213 HydrophobicContact CE1-CG2 3.95Å; F169-K229 HydrophobicContact CE2-CB 4.2Å; F169-K229 HydrophobicContact CE2-CD 4.07Å; F169-K229 HydrophobicContact CZ-CD 4.3Å; F169-M230 HydrophobicContact CB-CE 3.97Å; F169-M230 HydrophobicContact CD1-CE 3.76Å; F169-M230 HydrophobicContact CD2-CE 3.68Å; F169-M230 HydrophobicContact CE1-CE 4.12Å; F169-M230 HydrophobicContact CE2-CE 4.06Å; F169-M230 HydrophobicContact CG-CE 3.51Å; F169-M230 HydrophobicContact CZ-CE 4.26Å
170	Y	97.3	Very high	95.5	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-36.9	177.8	-87.7	-98.7	0	0	0	113	W166 S167 F172 Q173 S174 W181 F208 W209 T213 F445 T449 F466	W166-Y170 WeakPolarHBondContact O-CD2 3.34Å; W166-Y170 PolarHBondContact O-N 2.96Å; W166-Y170 VanDerWaalsContact O-N 3.08Å; S167-Y170 PolarHBondContact O-N 2.81Å; Y170-F172 PolarHBondContact O-N 3.45Å; Y170-Q173 CarbonylContact O-C 3.6Å; Y170-Q173 PolarHBondContact O-N 3.27Å; Y170-S174 PolarHBondContact O-N 2.92Å; Y170-S174 PolarHBondContact O-OG 3.44Å; Y170-W181 HydrophobicContact CD1-CE3 4.07Å; Y170-W181 AromaticContact CD1-CH2 3.73Å; Y170-W181 HydrophobicContact CD1-CH2 3.73Å; Y170-W181 HydrophobicContact CD1-CZ2 4.35Å; Y170-W181 AromaticContact CD1-CZ3 3.57Å; Y170-W181 HydrophobicContact CD1-CZ3 3.57Å; Y170-W181 HydrophobicContact CE1-CD2 4.38Å; Y170-W181 AromaticContact CE1-CE3 3.93Å; Y170-W181 HydrophobicContact CE1-CE3 3.93Å; Y170-W181 HydrophobicContact CE1-CH2 4.37Å; Y170-W181 AromaticContact CE1-CZ3 3.93Å; Y170-W181 HydrophobicContact CE1-CZ3 3.93Å; Y170-F208 HydrophobicContact CD1-CE1 4.32Å; Y170-F208 AromaticContact CE1-CD1 3.86Å; Y170-F208 HydrophobicContact CE1-CD1 3.86Å; Y170-F208 AromaticContact CE1-CE1 3.68Å; Y170-F208 HydrophobicContact CE1-CE1 3.68Å; Y170-F208 HydrophobicContact CE2-CE1 4.27Å; Y170-F208 AromaticContact CZ-CD1 3.74Å; Y170-F208 AromaticContact CZ-CE1 3.64Å; Y170-F208 VanDerWaalsContact OH-CD1 3.31Å; Y170-F208 WeakPolarHBondContact OH-CD1 3.43Å; Y170-W209 AromaticContact CE2-CE3 3.85Å; Y170-W209 HydrophobicContact CE2-CE3 3.85Å; Y170-W209 AromaticContact CE2-CZ3 3.95Å; Y170-W209 HydrophobicContact CE2-CZ3 3.95Å; Y170-T213 HydrophobicContact CE2-CG2 3.88Å; Y170-T213 PolarHBondContact OH-OG1 2.96Å; Y170-F445 HydrophobicContact CD1-CD1 4.41Å; Y170-F445 AromaticContact CD2-CD1 3.57Å; Y170-F445 HydrophobicContact CD2-CD1 3.57Å; Y170-F445 AromaticContact CD2-CE1 3.78Å; Y170-F445 HydrophobicContact CD2-CE1 3.78Å; Y170-F445 HydrophobicContact CE1-CD1 4.38Å; Y170-F445 AromaticContact CE2-CD1 3.54Å; Y170-F445 HydrophobicContact CE2-CD1 3.54Å; Y170-F445 HydrophobicContact CE2-CE1 4.15Å; Y170-F445 HydrophobicContact CE2-CG 4.35Å; Y170-F445 HydrophobicContact CG-CD1 4.02Å; Y170-F445 HydrophobicContact CG-CE1 4.27Å; Y170-F445 AromaticContact CZ-CD1 3.97Å; Y170-T449 HydrophobicContact CD1-CG2 4.23Å; Y170-T449 HydrophobicContact CE1-CG2 4.02Å; Y170-F466 VanDerWaalsContact CB-CE1 3.42Å; Y170-F466 VanDerWaalsContact CB-CZ 3.47Å; Y170-F466 AromaticContact CD1-CE1 3.94Å; Y170-F466 HydrophobicContact CD1-CE1 3.94Å; Y170-F466 AromaticContact CD1-CE2 3.65Å; Y170-F466 HydrophobicContact CD1-CE2 3.65Å; Y170-F466 AromaticContact CD1-CZ 3.27Å; Y170-F466 HydrophobicContact CD1-CZ 3.27Å; Y170-F466 HydrophobicContact CD2-CE1 4.47Å; Y170-F466 HydrophobicContact CE1-CZ 4.14Å; Y170-F466 HydrophobicContact CG-CD1 4.31Å; Y170-F466 AromaticContact CG-CE1 3.71Å; Y170-F466 HydrophobicContact CG-CE1 3.71Å; Y170-F466 HydrophobicContact CG-CE2 4.02Å; Y170-F466 AromaticContact CG-CZ 3.54Å; Y170-F466 HydrophobicContact CG-CZ 3.54Å
171	F	97.4	Very high	95.6	Very high	36 Å²	36	37.6 Å²	37.6	16%	0.158	18%	0.176	C	C	.	.	H	α-helix	trans	-57	-50	174.9	173.2	-100.4	0	0	0	111.2	S167 I168 F169 Q173 S174 F175 V463 F466 F467 I470	S167-F171 VanDerWaalsContact O-CB 3.3Å; S167-F171 WeakPolarHBondContact O-CB 3.38Å; S167-F171 PolarHBondContact O-N 3.35Å; I168-F171 WeakPolarHBondContact O-CB 3.49Å; I168-F171 PolarHBondContact O-N 3.42Å; F169-F171 PolarHBondContact O-N 2.89Å; F171-Q173 VanDerWaalsContact C-N 3.32Å; F171-Q173 PolarHBondContact O-N 3.25Å; F171-S174 WeakPolarHBondContact O-CB 3.46Å; F171-S174 PolarHBondContact O-N 2.83Å; F171-S174 VanDerWaalsContact O-N 3.16Å; F171-F175 HydrophobicContact CD1-CE2 4.11Å; F171-F175 HydrophobicContact CD2-CE2 4.42Å; F171-F175 AromaticContact CE1-CE2 3.73Å; F171-F175 HydrophobicContact CE1-CE2 3.73Å; F171-F175 HydrophobicContact CE1-CZ 4.12Å; F171-F175 HydrophobicContact CE2-CE2 4.07Å; F171-F175 HydrophobicContact CE2-CZ 4.03Å; F171-F175 HydrophobicContact CG-CE2 4.45Å; F171-F175 AromaticContact CZ-CE2 3.71Å; F171-F175 HydrophobicContact CZ-CE2 3.71Å; F171-F175 AromaticContact CZ-CZ 3.67Å; F171-F175 HydrophobicContact CZ-CZ 3.67Å; F171-F175 VanDerWaalsContact O-CD2 3.28Å; F171-F175 WeakPolarHBondContact O-CD2 3.19Å; F171-F175 WeakPolarHBondContact O-CE2 3.29Å; F171-V463 HydrophobicContact CD2-CG1 4.39Å; F171-V463 HydrophobicContact CE2-CG1 3.81Å; F171-F466 HydrophobicContact CB-CB 3.92Å; F171-F467 HydrophobicContact CD2-CB 3.95Å; F171-F467 HydrophobicContact CE2-CB 3.77Å; F171-F467 HydrophobicContact CE2-CD2 4.19Å; F171-F467 HydrophobicContact CE2-CG 4.1Å; F171-I470 HydrophobicContact CB-CD1 3.76Å; F171-I470 HydrophobicContact CD1-CD1 4.43Å; F171-I470 HydrophobicContact CD2-CD1 4.44Å; F171-I470 HydrophobicContact CG-CD1 3.97Å
172	F	96.8	Very high	95.4	Very high	129 Å²	129	39.4 Å²	39.4	57%	0.566	19%	0.191	S	C	*	.	H	α-helix	trans	-66.6	-33.8	177.8	-75.1	-63.6	0	0	0	112.9	I168 F169 Y170 S174	I168-F172 HydrophobicContact CG2-CD2 3.76Å; I168-F172 HydrophobicContact CG2-CE2 3.55Å; I168-F172 WeakPolarHBondContact O-CD2 3.41Å; I168-F172 PolarHBondContact O-N 3.4Å; I168-F172 VanDerWaalsContact O-N 3.11Å; F169-F172 PolarHBondContact O-N 3.13Å; Y170-F172 PolarHBondContact O-N 3.45Å; F172-S174 PolarHBondContact O-N 2.8Å
173	Q	96.1	Very high	95.2	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-73.9	-11.2	175.9	-66.8	-67.8	20.2	0	0	114	F169 Y170 F171 F175 Q176 P180 W181 F208	F169-Q173 HydrophobicContact CD1-CG 4.44Å; F169-Q173 HydrophobicContact CE1-CG 4.11Å; F169-Q173 HydrophobicContact CE2-CG 4.17Å; F169-Q173 HydrophobicContact CZ-CG 3.97Å; F169-Q173 VanDerWaalsContact O-CG 3.29Å; F169-Q173 WeakPolarHBondContact O-CG 3.31Å; F169-Q173 PolarHBondContact O-N 2.85Å; F169-Q173 VanDerWaalsContact O-N 3.07Å; Y170-Q173 CarbonylContact O-C 3.6Å; Y170-Q173 PolarHBondContact O-N 3.27Å; F171-Q173 VanDerWaalsContact C-N 3.32Å; F171-Q173 PolarHBondContact O-N 3.25Å; Q173-F175 VanDerWaalsContact C-N 3.33Å; Q173-F175 PolarHBondContact O-N 3.48Å; Q173-Q176 PolarHBondContact O-NE2 3.23Å; Q173-P180 HydrophobicContact CB-CG 4.34Å; Q173-W181 HydrophobicContact CB-CZ3 4Å; Q173-F208 HydrophobicContact CG-CZ 4.43Å
174	S	97.2	Very high	95.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.3	-179.3	-61.1	0	0	0	0	113.9	Y170 F171 F172 Q176 P459 S462	Y170-S174 PolarHBondContact O-N 2.92Å; Y170-S174 PolarHBondContact O-OG 3.44Å; F171-S174 WeakPolarHBondContact O-CB 3.46Å; F171-S174 PolarHBondContact O-N 2.83Å; F171-S174 VanDerWaalsContact O-N 3.16Å; F172-S174 PolarHBondContact O-N 2.8Å; S174-Q176 PolarHBondContact O-N 3.32Å; S174-Q176 VanDerWaalsContact O-N 3.15Å; S174-P459 WeakPolarHBondContact O-CB 3.24Å; S174-S462 PolarHBondContact OG-OG 3.23Å
175	F	95.8	Very high	94.9	Very high	131 Å²	131	50.1 Å²	50.1	58%	0.575	25%	0.249	S	C	*	.	S	Bend	trans	-83.4	26.2	-176.4	-70.6	-82.4	0	0	0	114.7	F171 Q173 V463	F171-F175 HydrophobicContact CD1-CE2 4.11Å; F171-F175 HydrophobicContact CD2-CE2 4.42Å; F171-F175 AromaticContact CE1-CE2 3.73Å; F171-F175 HydrophobicContact CE1-CE2 3.73Å; F171-F175 HydrophobicContact CE1-CZ 4.12Å; F171-F175 HydrophobicContact CE2-CE2 4.07Å; F171-F175 HydrophobicContact CE2-CZ 4.03Å; F171-F175 HydrophobicContact CG-CE2 4.45Å; F171-F175 AromaticContact CZ-CE2 3.71Å; F171-F175 HydrophobicContact CZ-CE2 3.71Å; F171-F175 AromaticContact CZ-CZ 3.67Å; F171-F175 HydrophobicContact CZ-CZ 3.67Å; F171-F175 VanDerWaalsContact O-CD2 3.28Å; F171-F175 WeakPolarHBondContact O-CD2 3.19Å; F171-F175 WeakPolarHBondContact O-CE2 3.29Å; Q173-F175 VanDerWaalsContact C-N 3.33Å; Q173-F175 PolarHBondContact O-N 3.48Å; F175-V463 HydrophobicContact CD1-CG2 4.19Å; F175-V463 HydrophobicContact CD2-CG2 4.44Å; F175-V463 HydrophobicContact CE1-CG1 4.2Å; F175-V463 HydrophobicContact CE1-CG2 3.98Å; F175-V463 HydrophobicContact CE2-CG2 4.24Å; F175-V463 HydrophobicContact CG-CG2 4.42Å; F175-V463 HydrophobicContact CZ-CG1 3.9Å; F175-V463 HydrophobicContact CZ-CG2 4Å
176	Q	93.9	Very high	94.5	Very high	83 Å²	83	55.1 Å²	55.1	39%	0.388	27%	0.274	S	S	.	.	S	Bend	trans	-136.1	152.7	-179.1	66.3	-157.9	-48.6	0	0	111.9	Q173 S174 P180 P459	Q173-Q176 PolarHBondContact O-NE2 3.23Å; S174-Q176 PolarHBondContact O-N 3.32Å; S174-Q176 VanDerWaalsContact O-N 3.15Å; Q176-P180 HydrophobicContact CG-CG 4.03Å; Q176-P459 WeakPolarHBondContact O-CG 3.26Å
177	Y	91	Very high	93.8	Very high	190 Å²	190	62.5 Å²	62.5	75%	0.745	30%	0.302	S	S	*	.	S	Bend	trans	-129.2	124.7	175.8	-178.1	-94.7	0	0	0	109.4	P459	Y177-P459 HydrophobicContact CD2-CG 3.93Å
178	P	91.7	Very high	93.1	Very high	76 Å²	76	70.9 Å²	70.9	49%	0.494	34%	0.338	S	S	.	.	S	Bend	cis	-67.3	163.2	-3.4	30.1	-35.9	0	0	0	113
179	L	95.3	Very high	92.3	Very high	5 Å²	5	76.3 Å²	76.3	3%	0.026	37%	0.367	C	S	.	.			trans	-65.7	145.6	174.6	-72.8	171.9	0	0	0	110.6	W181 A182 P459	L179-W181 HydrophobicContact CB-CD2 4.46Å; L179-W181 HydrophobicContact CB-CZ2 4.43Å; L179-W181 HydrophobicContact CD1-CZ2 4.06Å; L179-W181 HydrophobicContact CD2-CH2 4.23Å; L179-W181 HydrophobicContact CD2-CZ2 3.89Å; L179-W181 HydrophobicContact CG-CZ2 4.37Å; L179-W181 PolarHBondContact O-N 2.87Å; L179-W181 VanDerWaalsContact O-N 3.08Å; L179-A182 HydrophobicContact CB-CB 4.33Å; L179-A182 VanDerWaalsContact O-CB 3.24Å; L179-A182 WeakPolarHBondContact O-CB 3.41Å; L179-A182 PolarHBondContact O-N 3.38Å; L179-P459 HydrophobicContact CD2-CB 4.45Å; L179-P459 HydrophobicContact CD2-CG 4.44Å
180	P	94.4	Very high	91.4	Very high	43 Å²	43	79 Å²	79	28%	0.279	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.7	-176.5	-28.6	38.5	0	0	0	115.9	Q173 Q176 F208	Q173-P180 HydrophobicContact CB-CG 4.34Å; Q176-P180 HydrophobicContact CG-CG 4.03Å; P180-F208 HydrophobicContact CB-CD2 4.01Å; P180-F208 HydrophobicContact CB-CE2 3.47Å; P180-F208 VanDerWaalsContact CB-CE2 3.47Å; P180-F208 HydrophobicContact CB-CZ 4.05Å; P180-F208 HydrophobicContact CG-CE2 4.48Å
181	W	94.7	Very high	90.5	Very high	2 Å²	2	86.2 Å²	86.2	1%	0.008	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	14.3	-179.5	55.5	78.9	0	0	0	112.6	Y170 Q173 L179 A204 T205 F208 S462 F466	Y170-W181 HydrophobicContact CD1-CE3 4.07Å; Y170-W181 AromaticContact CD1-CH2 3.73Å; Y170-W181 HydrophobicContact CD1-CH2 3.73Å; Y170-W181 HydrophobicContact CD1-CZ2 4.35Å; Y170-W181 AromaticContact CD1-CZ3 3.57Å; Y170-W181 HydrophobicContact CD1-CZ3 3.57Å; Y170-W181 HydrophobicContact CE1-CD2 4.38Å; Y170-W181 AromaticContact CE1-CE3 3.93Å; Y170-W181 HydrophobicContact CE1-CE3 3.93Å; Y170-W181 HydrophobicContact CE1-CH2 4.37Å; Y170-W181 AromaticContact CE1-CZ3 3.93Å; Y170-W181 HydrophobicContact CE1-CZ3 3.93Å; Q173-W181 HydrophobicContact CB-CZ3 4Å; L179-W181 HydrophobicContact CB-CD2 4.46Å; L179-W181 HydrophobicContact CB-CZ2 4.43Å; L179-W181 HydrophobicContact CD1-CZ2 4.06Å; L179-W181 HydrophobicContact CD2-CH2 4.23Å; L179-W181 HydrophobicContact CD2-CZ2 3.89Å; L179-W181 HydrophobicContact CG-CZ2 4.37Å; L179-W181 PolarHBondContact O-N 2.87Å; L179-W181 VanDerWaalsContact O-N 3.08Å; W181-A204 WeakPolarHBondContact O-CB 3.42Å; W181-T205 HydrophobicContact CB-CG2 4Å; W181-T205 HydrophobicContact CG-CG2 4.15Å; W181-T205 WeakPolarHBondContact O-CG2 3.34Å; W181-F208 HydrophobicContact CB-CB 3.74Å; W181-F208 HydrophobicContact CB-CD1 4.1Å; W181-F208 HydrophobicContact CB-CD2 4.38Å; W181-F208 HydrophobicContact CB-CG 3.82Å; W181-F208 HydrophobicContact CD2-CD1 4.48Å; W181-F208 AromaticContact CE3-CD1 3.8Å; W181-F208 HydrophobicContact CE3-CD1 3.8Å; W181-F208 AromaticContact CE3-CE1 3.53Å; W181-F208 HydrophobicContact CE3-CE1 3.53Å; W181-F208 HydrophobicContact CE3-CE2 4.41Å; W181-F208 HydrophobicContact CE3-CG 4.36Å; W181-F208 AromaticContact CE3-CZ 3.86Å; W181-F208 HydrophobicContact CE3-CZ 3.86Å; W181-F208 AromaticContact CZ3-CE1 3.99Å; W181-F208 HydrophobicContact CZ3-CE1 3.99Å; W181-F208 HydrophobicContact CZ3-CZ 4.23Å; W181-S462 VanDerWaalsContact CZ2-OG 3.28Å; W181-S462 WeakPolarHBondContact CZ2-OG 3.31Å; W181-F466 HydrophobicContact CH2-CE2 4.21Å; W181-F466 HydrophobicContact CZ2-CE2 4.24Å
182	A	92.4	Very high	89.5	Confident	38 Å²	38	90.8 Å²	90.8	31%	0.314	47%	0.466	S	S	.	.	S	Bend	trans	-77.2	-34.6	177.4	0	0	0	0	0	112.7	L179 T453	L179-A182 HydrophobicContact CB-CB 4.33Å; L179-A182 VanDerWaalsContact O-CB 3.24Å; L179-A182 WeakPolarHBondContact O-CB 3.41Å; L179-A182 PolarHBondContact O-N 3.38Å; A182-T453 HydrophobicContact CB-CG2 4.39Å
183	E	91.7	Very high	88.7	Confident	148 Å²	148	88 Å²	88	69%	0.692	47%	0.466	S	S	*	.	S	Bend	trans	-135.7	150.3	-172.9	-66.5	179.2	-174.8	0	0	111.2
184	C	91.4	Very high	88.1	Confident	37 Å²	37	89 Å²	89	25%	0.25	47%	0.473	C	S	.	.			trans	-72	137.5	174.4	-76.8	0	0	0	0	111.1	V195 C199	C184-V195 HydrophobicContact CB-CG1 3.59Å; C184-C199 WeakPolarHBondContact CA-SG 3.36Å; C184-C199 HydrophobicContact CB-CB 3.78Å; C184-C199 WeakPolarHBondContact CB-SG 3.06Å; C184-C199 VanDerWaalsContact SG-C 3.57Å; C184-C199 WeakPolarHBondContact SG-CB 3.22Å; C184-C199 CovalentContact SG-SG 2.04Å; C184-C199 PolarHBondContact SG-SG 2.99Å
185	P	91.4	Very high	87.5	Confident	52 Å²	52	91.6 Å²	91.6	34%	0.338	49%	0.489	S	S	.	.			trans	-67.6	146.8	174.9	28.1	-33.4	0	0	0	111.3	E196 Y207	P185-E196 HydrophobicContact CB-CG 4.5Å; P185-E196 HydrophobicContact CG-CB 4.29Å; P185-E196 HydrophobicContact CG-CG 3.93Å; P185-E196 PolarHBondContact O-N 3Å; P185-E196 VanDerWaalsContact O-N 3.08Å; P185-Y207 HydrophobicContact CG-CD1 4.18Å; P185-Y207 HydrophobicContact CG-CE1 3.57Å
186	I	88.6	Confident	87.2	Confident	108 Å²	108	87.2 Å²	87.2	55%	0.554	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	121	-180	-54	174.1	0	0	0	109.3	A193	I186-A193 HydrophobicContact CG2-CB 3.74Å
187	R	82.4	Confident	86.9	Confident	157 Å²	157	86.8 Å²	86.8	59%	0.592	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.1	174.2	-159.4	-178	-125.9	-142.4	-3.3	109.9	I194 E196	R187-I194 PolarHBondContact N-O 3.4Å; R187-I194 PolarHBondContact O-N 3.08Å; R187-E196 HydrophobicContact CB-CG 4.48Å; R187-E196 WeakPolarHBondContact CB-OE1 3.49Å; R187-E196 VanDerWaalsContact CD-OE1 3.3Å; R187-E196 WeakPolarHBondContact CD-OE1 3.47Å; R187-E196 WeakPolarHBondContact CG-OE1 3.45Å; R187-E196 IonicContact NE-OE1 3.63Å; R187-E196 PolarHBondContact NE-OE1 3.01Å; R187-E196 IonicContact NE-OE2 3.74Å
188	K	81.4	Confident	86.8	Confident	177 Å²	177	78.4 Å²	78.4	77%	0.77	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	106.9	173.2	-66.2	-176.3	-179.9	-179.7	0	109.4
189	N	79.7	Confident	86.7	Confident	118 Å²	118	74.8 Å²	74.8	63%	0.631	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	84.3	172.1	-158	7.8	0	0	0	108.7	T191 Q192	N189-T191 PolarHBondContact O-N 3.24Å; N189-Q192 PolarHBondContact N-O 3.01Å; N189-Q192 PolarHBondContact O-N 3.48Å
190	G	79.4	Confident	86.4	Confident	73 Å²	73	81.4 Å²	81.4	75%	0.753	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-122.5	-171.7	0	0	0	0	0	112.4
191	T	77.2	Confident	86	Confident	152 Å²	152	85.7 Å²	85.7	93%	0.933	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.7	178.2	51	0	0	0	0	113.8	N189	N189-T191 PolarHBondContact O-N 3.24Å
192	Q	76.3	Confident	85.6	Confident	131 Å²	131	87.2 Å²	87.2	61%	0.612	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.8	179.7	-71.7	178.9	-16.6	0	0	110.8	N189 I194	N189-Q192 PolarHBondContact N-O 3.01Å; N189-Q192 PolarHBondContact O-N 3.48Å; Q192-I194 HydrophobicContact CB-CD1 4.47Å; Q192-I194 HydrophobicContact CB-CG1 4.28Å
193	A	80.9	Confident	85.5	Confident	70 Å²	70	86.7 Å²	86.7	58%	0.579	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	104.5	173.1	0	0	0	0	0	107.5	I186	I186-A193 HydrophobicContact CG2-CB 3.74Å
194	I	83.1	Confident	85.5	Confident	78 Å²	78	80.5 Å²	80.5	40%	0.4	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130	-176.7	-55.8	170.3	0	0	0	107.3	R187 Q192	R187-I194 PolarHBondContact N-O 3.4Å; R187-I194 PolarHBondContact O-N 3.08Å; Q192-I194 HydrophobicContact CB-CD1 4.47Å; Q192-I194 HydrophobicContact CB-CG1 4.28Å
195	V	85.7	Confident	85.6	Confident	55 Å²	55	79 Å²	79	33%	0.333	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.2	172.6	-177.5	0	0	0	0	108.3	C184 P197 E200	C184-V195 HydrophobicContact CB-CG1 3.59Å; V195-P197 WeakPolarHBondContact O-CD 3.14Å; V195-P197 VanDerWaalsContact O-N 3.1Å; V195-E200 HydrophobicContact CG1-CB 4.44Å
196	E	88.7	Confident	85.6	Confident	39 Å²	39	77.4 Å²	77.4	18%	0.182	42%	0.422	C	S	.	.			trans	-56.2	120.3	178.9	-76.6	-69.2	172.5	0	0	110.1	P185 R187 E198 C199 E200	P185-E196 HydrophobicContact CB-CG 4.5Å; P185-E196 HydrophobicContact CG-CB 4.29Å; P185-E196 HydrophobicContact CG-CG 3.93Å; P185-E196 PolarHBondContact O-N 3Å; P185-E196 VanDerWaalsContact O-N 3.08Å; R187-E196 HydrophobicContact CB-CG 4.48Å; R187-E196 WeakPolarHBondContact CB-OE1 3.49Å; R187-E196 VanDerWaalsContact CD-OE1 3.3Å; R187-E196 WeakPolarHBondContact CD-OE1 3.47Å; R187-E196 WeakPolarHBondContact CG-OE1 3.45Å; R187-E196 IonicContact NE-OE1 3.63Å; R187-E196 PolarHBondContact NE-OE1 3.01Å; R187-E196 IonicContact NE-OE2 3.74Å; E196-E198 VanDerWaalsContact C-N 3.26Å; E196-E198 PolarHBondContact O-N 3.13Å; E196-C199 HydrophobicContact CB-CB 4.22Å; E196-C199 WeakPolarHBondContact O-CA 3.06Å; E196-C199 WeakPolarHBondContact O-CB 3.43Å; E196-C199 PolarHBondContact O-N 3.01Å; E196-E200 PolarHBondContact O-N 3.37Å; E196-E200 VanDerWaalsContact O-N 3.1Å
197	P	87.4	Confident	85.8	Confident	73 Å²	73	73.5 Å²	73.5	47%	0.474	40%	0.4	S	S	.	.	H	α-helix	trans	-66.1	-29.1	-166.9	24.5	-34.7	0	0	0	112.9	V195 C199 K201	V195-P197 WeakPolarHBondContact O-CD 3.14Å; V195-P197 VanDerWaalsContact O-N 3.1Å; P197-C199 VanDerWaalsContact C-N 3.32Å; P197-K201 WeakPolarHBondContact O-CG 3.47Å; P197-K201 PolarHBondContact O-N 2.93Å; P197-K201 VanDerWaalsContact O-N 3.16Å
198	E	89	Confident	86.4	Confident	14 Å²	14	66.6 Å²	66.6	7%	0.065	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-36.8	173	-178	179.2	-155.7	0	0	111.9	E196 S202 Y207 R211 W604 E606	E196-E198 VanDerWaalsContact C-N 3.26Å; E196-E198 PolarHBondContact O-N 3.13Å; E198-S202 WeakPolarHBondContact O-CB 3.39Å; E198-S202 PolarHBondContact O-N 3.08Å; E198-S202 PolarHBondContact O-OG 3.11Å; E198-Y207 HydrophobicContact CB-CD2 4.28Å; E198-Y207 HydrophobicContact CB-CE2 4.39Å; E198-Y207 HydrophobicContact CG-CD2 4.13Å; E198-Y207 WeakPolarHBondContact OE2-CE2 3.24Å; E198-R211 VanDerWaalsContact CD-NE 3.25Å; E198-R211 IonicContact OE1-CZ 3.46Å; E198-R211 IonicContact OE1-NE 3.67Å; E198-R211 PolarHBondContact OE1-NE 3.08Å; E198-R211 IonicContact OE1-NH2 3.34Å; E198-R211 PolarHBondContact OE1-NH2 2.95Å; E198-R211 VanDerWaalsContact OE2-CG 3.27Å; E198-R211 WeakPolarHBondContact OE2-CG 3.48Å; E198-R211 IonicContact OE2-CZ 3.9Å; E198-R211 IonicContact OE2-NE 3.19Å; E198-R211 PolarHBondContact OE2-NE 3.32Å; E198-R211 IonicContact OE2-NH2 2.7Å; E198-W604 HydrophobicContact CG-CZ2 4.46Å; E198-W604 PolarHBondContact OE1-NE1 2.94Å; E198-E606 HydrophobicContact CG-CG 4.47Å
199	C	90.6	Very high	87	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.007	34%	0.338	C	S	.	.	H	α-helix	trans	-73.5	-38.7	179.5	-166.5	0	0	0	0	111.6	C184 E196 P197 S202 S203 A204 Y207	C184-C199 WeakPolarHBondContact CA-SG 3.36Å; C184-C199 HydrophobicContact CB-CB 3.78Å; C184-C199 WeakPolarHBondContact CB-SG 3.06Å; C184-C199 VanDerWaalsContact SG-C 3.57Å; C184-C199 WeakPolarHBondContact SG-CB 3.22Å; C184-C199 CovalentContact SG-SG 2.04Å; C184-C199 PolarHBondContact SG-SG 2.99Å; E196-C199 HydrophobicContact CB-CB 4.22Å; E196-C199 WeakPolarHBondContact O-CA 3.06Å; E196-C199 WeakPolarHBondContact O-CB 3.43Å; E196-C199 PolarHBondContact O-N 3.01Å; P197-C199 VanDerWaalsContact C-N 3.32Å; C199-S202 CarbonylContact O-C 3.53Å; C199-S202 PolarHBondContact O-N 3.45Å; C199-S203 PolarHBondContact O-N 3.17Å; C199-A204 VanDerWaalsContact SG-CA 3.56Å; C199-Y207 HydrophobicContact CB-CD1 4.42Å; C199-Y207 HydrophobicContact CB-CD2 3.91Å; C199-Y207 HydrophobicContact CB-CG 3.82Å
200	E	87.3	Confident	87.6	Confident	143 Å²	143	53.1 Å²	53.1	67%	0.668	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-39.7	176.8	-172.5	176.8	-164.3	0	0	112.3	V195 E196	V195-E200 HydrophobicContact CG1-CB 4.44Å; E196-E200 PolarHBondContact O-N 3.37Å; E196-E200 VanDerWaalsContact O-N 3.1Å
201	K	86.3	Confident	88.2	Confident	133 Å²	133	51.7 Å²	51.7	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-71.3	-28.6	176.5	-73.4	176.3	177.1	178.7	0	114.1	P197 E607	P197-K201 WeakPolarHBondContact O-CG 3.47Å; P197-K201 PolarHBondContact O-N 2.93Å; P197-K201 VanDerWaalsContact O-N 3.16Å; K201-E607 PolarHBondContact NZ-O 3.38Å
202	S	87.4	Confident	89	Confident	34 Å²	34	48.2 Å²	48.2	24%	0.238	26%	0.255	C	S	.	.	S	Bend	trans	-106.7	-107.2	-176.4	62.9	0	0	0	0	110.7	E198 C199 G609	E198-S202 WeakPolarHBondContact O-CB 3.39Å; E198-S202 PolarHBondContact O-N 3.08Å; E198-S202 PolarHBondContact O-OG 3.11Å; C199-S202 CarbonylContact O-C 3.53Å; C199-S202 PolarHBondContact O-N 3.45Å; S202-G609 WeakPolarHBondContact CB-O 3.11Å
203	S	89.3	Confident	89.8	Confident	28 Å²	28	42 Å²	42	20%	0.196	23%	0.226	C	C	.	.			trans	-162.3	160	170.5	49.2	0	0	0	0	109.9	C199 T205 T206 Y207	C199-S203 PolarHBondContact O-N 3.17Å; S203-T205 PolarHBondContact O-N 2.87Å; S203-T205 PolarHBondContact OG-OG1 3.41Å; S203-T206 PolarHBondContact O-N 2.98Å; S203-T206 VanDerWaalsContact OG-CB 3.26Å; S203-T206 WeakPolarHBondContact OG-CB 3.37Å; S203-T206 PolarHBondContact OG-N 3.09Å; S203-T206 PolarHBondContact OG-OG1 3.46Å; S203-Y207 WeakPolarHBondContact O-CB 3.24Å; S203-Y207 PolarHBondContact O-N 3.17Å
204	A	92.2	Very high	90.4	Very high	18 Å²	18	39.1 Å²	39.1	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-54.7	-38.8	178.1	0	0	0	0	0	113.3	W181 C199 F208	W181-A204 WeakPolarHBondContact O-CB 3.42Å; C199-A204 VanDerWaalsContact SG-CA 3.56Å; A204-F208 VanDerWaalsContact O-CB 3.31Å; A204-F208 WeakPolarHBondContact O-CB 3.26Å; A204-F208 PolarHBondContact O-N 3.22Å
205	T	92.6	Very high	90.9	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-71.1	-44.7	177.1	48	0	0	0	0	112.9	W181 S203 F208 W209 E450	W181-T205 HydrophobicContact CB-CG2 4Å; W181-T205 HydrophobicContact CG-CG2 4.15Å; W181-T205 WeakPolarHBondContact O-CG2 3.34Å; S203-T205 PolarHBondContact O-N 2.87Å; S203-T205 PolarHBondContact OG-OG1 3.41Å; T205-F208 PolarHBondContact O-N 3.26Å; T205-W209 PolarHBondContact O-N 3.06Å; T205-E450 HydrophobicContact CG2-CB 3.78Å; T205-E450 HydrophobicContact CG2-CG 4.27Å
206	T	91.4	Very high	91.2	Very high	19 Å²	19	35.5 Å²	35.5	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-44.6	178	-59.2	0	0	0	0	110.8	S203 F208 W209 Y210 I446 W604	S203-T206 PolarHBondContact O-N 2.98Å; S203-T206 VanDerWaalsContact OG-CB 3.26Å; S203-T206 WeakPolarHBondContact OG-CB 3.37Å; S203-T206 PolarHBondContact OG-N 3.09Å; S203-T206 PolarHBondContact OG-OG1 3.46Å; T206-F208 PolarHBondContact O-N 3.44Å; T206-W209 PolarHBondContact O-N 2.91Å; T206-Y210 HydrophobicContact CG2-CD2 3.66Å; T206-Y210 HydrophobicContact CG2-CE2 3.7Å; T206-Y210 WeakPolarHBondContact O-CD2 3.4Å; T206-Y210 PolarHBondContact O-N 2.6Å; T206-I446 VanDerWaalsContact OG1-CG2 3.29Å; T206-I446 WeakPolarHBondContact OG1-CG2 3.48Å; T206-W604 HydrophobicContact CG2-CH2 3.29Å; T206-W604 HydrophobicContact CG2-CZ2 4.15Å; T206-W604 HydrophobicContact CG2-CZ3 3.6Å
207	Y	93.1	Very high	91.4	Very high	27 Å²	27	34.3 Å²	34.3	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-44.6	173.6	179.2	-93.1	0	0	0	111.9	P185 E198 C199 S203 W209 R211 Q212	P185-Y207 HydrophobicContact CG-CD1 4.18Å; P185-Y207 HydrophobicContact CG-CE1 3.57Å; E198-Y207 HydrophobicContact CB-CD2 4.28Å; E198-Y207 HydrophobicContact CB-CE2 4.39Å; E198-Y207 HydrophobicContact CG-CD2 4.13Å; E198-Y207 WeakPolarHBondContact OE2-CE2 3.24Å; C199-Y207 HydrophobicContact CB-CD1 4.42Å; C199-Y207 HydrophobicContact CB-CD2 3.91Å; C199-Y207 HydrophobicContact CB-CG 3.82Å; S203-Y207 WeakPolarHBondContact O-CB 3.24Å; S203-Y207 PolarHBondContact O-N 3.17Å; Y207-W209 VanDerWaalsContact C-N 3.3Å; Y207-W209 PolarHBondContact O-N 2.93Å; Y207-R211 HydrophobicContact CD2-CB 4.25Å; Y207-R211 HydrophobicContact CD2-CG 3.91Å; Y207-R211 HydrophobicContact CE1-CB 4.35Å; Y207-R211 HydrophobicContact CE2-CB 3.95Å; Y207-R211 HydrophobicContact CE2-CG 3.72Å; Y207-R211 WeakPolarHBondContact O-CB 3.37Å; Y207-R211 PolarHBondContact O-N 2.99Å; Y207-Q212 HydrophobicContact CE1-CG 4.11Å
208	F	94.8	Very high	91.5	Very high	12 Å²	12	33.5 Å²	33.5	5%	0.053	17%	0.172	C	C	.	.	I	π-helix	trans	-61.9	-37.8	177.3	-174.9	-93.1	0	0	0	112.3	F169 Y170 Q173 P180 W181 A204 T205 T206 Q212 T213	F169-F208 HydrophobicContact CE1-CE1 4.07Å; F169-F208 AromaticContact CE1-CZ 3.9Å; F169-F208 HydrophobicContact CE1-CZ 3.9Å; F169-F208 HydrophobicContact CZ-CZ 4.39Å; Y170-F208 HydrophobicContact CD1-CE1 4.32Å; Y170-F208 AromaticContact CE1-CD1 3.86Å; Y170-F208 HydrophobicContact CE1-CD1 3.86Å; Y170-F208 AromaticContact CE1-CE1 3.68Å; Y170-F208 HydrophobicContact CE1-CE1 3.68Å; Y170-F208 HydrophobicContact CE2-CE1 4.27Å; Y170-F208 AromaticContact CZ-CD1 3.74Å; Y170-F208 AromaticContact CZ-CE1 3.64Å; Y170-F208 VanDerWaalsContact OH-CD1 3.31Å; Y170-F208 WeakPolarHBondContact OH-CD1 3.43Å; Q173-F208 HydrophobicContact CG-CZ 4.43Å; P180-F208 HydrophobicContact CB-CD2 4.01Å; P180-F208 HydrophobicContact CB-CE2 3.47Å; P180-F208 VanDerWaalsContact CB-CE2 3.47Å; P180-F208 HydrophobicContact CB-CZ 4.05Å; P180-F208 HydrophobicContact CG-CE2 4.48Å; W181-F208 HydrophobicContact CB-CB 3.74Å; W181-F208 HydrophobicContact CB-CD1 4.1Å; W181-F208 HydrophobicContact CB-CD2 4.38Å; W181-F208 HydrophobicContact CB-CG 3.82Å; W181-F208 HydrophobicContact CD2-CD1 4.48Å; W181-F208 AromaticContact CE3-CD1 3.8Å; W181-F208 HydrophobicContact CE3-CD1 3.8Å; W181-F208 AromaticContact CE3-CE1 3.53Å; W181-F208 HydrophobicContact CE3-CE1 3.53Å; W181-F208 HydrophobicContact CE3-CE2 4.41Å; W181-F208 HydrophobicContact CE3-CG 4.36Å; W181-F208 AromaticContact CE3-CZ 3.86Å; W181-F208 HydrophobicContact CE3-CZ 3.86Å; W181-F208 AromaticContact CZ3-CE1 3.99Å; W181-F208 HydrophobicContact CZ3-CE1 3.99Å; W181-F208 HydrophobicContact CZ3-CZ 4.23Å; A204-F208 VanDerWaalsContact O-CB 3.31Å; A204-F208 WeakPolarHBondContact O-CB 3.26Å; A204-F208 PolarHBondContact O-N 3.22Å; T205-F208 PolarHBondContact O-N 3.26Å; T206-F208 PolarHBondContact O-N 3.44Å; F208-Q212 HydrophobicContact CD2-CB 3.65Å; F208-Q212 HydrophobicContact CD2-CG 4.01Å; F208-Q212 HydrophobicContact CE2-CB 3.91Å; F208-Q212 HydrophobicContact CG-CB 4.17Å; F208-Q212 CarbonylContact O-C 3.52Å; F208-Q212 WeakPolarHBondContact O-CB 3.43Å; F208-Q212 PolarHBondContact O-N 3.09Å; F208-T213 WeakPolarHBondContact CE1-OG1 3.49Å; F208-T213 WeakPolarHBondContact O-CB 3.41Å; F208-T213 PolarHBondContact O-N 3.31Å; F208-T213 PolarHBondContact O-OG1 3.48Å
209	W	94.6	Very high	91.5	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.008	18%	0.18	C	C	.	.	I	π-helix	trans	-66.6	-59.5	175.5	176.8	-112	0	0	0	112.4	W166 Y170 T205 T206 Y207 T213 L214 F445 I446	W166-W209 HydrophobicContact CB-CZ3 4.41Å; W166-W209 AromaticContact CD2-CH2 3.73Å; W166-W209 HydrophobicContact CD2-CH2 3.73Å; W166-W209 HydrophobicContact CD2-CZ3 4.4Å; W166-W209 AromaticContact CE3-CH2 3.56Å; W166-W209 HydrophobicContact CE3-CH2 3.56Å; W166-W209 HydrophobicContact CE3-CZ2 4.34Å; W166-W209 HydrophobicContact CG-CH2 4.17Å; W166-W209 HydrophobicContact CG-CZ3 4.38Å; W166-W209 AromaticContact CZ3-CH2 3.97Å; W166-W209 HydrophobicContact CZ3-CH2 3.97Å; W166-W209 HydrophobicContact CZ3-CZ2 4.31Å; Y170-W209 AromaticContact CE2-CE3 3.85Å; Y170-W209 HydrophobicContact CE2-CE3 3.85Å; Y170-W209 AromaticContact CE2-CZ3 3.95Å; Y170-W209 HydrophobicContact CE2-CZ3 3.95Å; T205-W209 PolarHBondContact O-N 3.06Å; T206-W209 PolarHBondContact O-N 2.91Å; Y207-W209 VanDerWaalsContact C-N 3.3Å; Y207-W209 PolarHBondContact O-N 2.93Å; W209-T213 HydrophobicContact CE3-CG2 4.13Å; W209-T213 HydrophobicContact CZ3-CG2 4.17Å; W209-T213 WeakPolarHBondContact O-CB 3.47Å; W209-L214 HydrophobicContact CD2-CD1 4.09Å; W209-L214 HydrophobicContact CD2-CG 4.37Å; W209-L214 HydrophobicContact CH2-CD1 4.4Å; W209-L214 HydrophobicContact CH2-CD2 4.38Å; W209-L214 HydrophobicContact CZ2-CD1 3.7Å; W209-L214 HydrophobicContact CZ2-CD2 4.43Å; W209-L214 HydrophobicContact CZ2-CG 4.29Å; W209-L214 PolarHBondContact O-N 2.89Å; W209-F445 HydrophobicContact CD2-CB 4.02Å; W209-F445 HydrophobicContact CE3-CB 3.53Å; W209-F445 HydrophobicContact CE3-CD1 4.35Å; W209-F445 HydrophobicContact CE3-CD2 4.44Å; W209-F445 AromaticContact CE3-CG 3.88Å; W209-F445 HydrophobicContact CE3-CG 3.88Å; W209-F445 HydrophobicContact CH2-CB 4.16Å; W209-F445 AromaticContact CH2-CD2 3.58Å; W209-F445 HydrophobicContact CH2-CD2 3.58Å; W209-F445 HydrophobicContact CH2-CE2 4.11Å; W209-F445 AromaticContact CH2-CG 3.85Å; W209-F445 HydrophobicContact CH2-CG 3.85Å; W209-F445 HydrophobicContact CZ2-CD2 4.34Å; W209-F445 HydrophobicContact CZ3-CB 3.6Å; W209-F445 AromaticContact CZ3-CD1 3.81Å; W209-F445 HydrophobicContact CZ3-CD1 3.81Å; W209-F445 AromaticContact CZ3-CD2 3.64Å; W209-F445 HydrophobicContact CZ3-CD2 3.64Å; W209-F445 HydrophobicContact CZ3-CE1 4.4Å; W209-F445 HydrophobicContact CZ3-CE2 4.28Å; W209-F445 AromaticContact CZ3-CG 3.39Å; W209-F445 HydrophobicContact CZ3-CG 3.39Å; W209-I446 HydrophobicContact CB-CD1 4.43Å; W209-I446 HydrophobicContact CB-CG1 4.05Å; W209-I446 HydrophobicContact CG-CD1 4.2Å; W209-I446 HydrophobicContact CG-CG1 4.06Å
210	Y	93.3	Very high	91.5	Very high	10 Å²	10	34.7 Å²	34.7	4%	0.039	18%	0.18	C	C	.	.	I	π-helix	trans	-73.4	-33.5	-173.5	-69.8	-70.4	0	0	0	113.4	T206 N215 I216 I446 W604 E611	T206-Y210 HydrophobicContact CG2-CD2 3.66Å; T206-Y210 HydrophobicContact CG2-CE2 3.7Å; T206-Y210 WeakPolarHBondContact O-CD2 3.4Å; T206-Y210 PolarHBondContact O-N 2.6Å; Y210-N215 CarbonylContact O-C 3.54Å; Y210-N215 VanDerWaalsContact O-CA 3.23Å; Y210-N215 WeakPolarHBondContact O-CA 3.21Å; Y210-N215 PolarHBondContact O-N 2.59Å; Y210-I216 HydrophobicContact CD1-CB 4.34Å; Y210-I216 HydrophobicContact CD1-CD1 3.84Å; Y210-I216 HydrophobicContact CD1-CG2 3.82Å; Y210-I216 HydrophobicContact CE1-CD1 4.09Å; Y210-I216 HydrophobicContact CG-CG2 4.3Å; Y210-I216 PolarHBondContact O-N 2.73Å; Y210-I446 HydrophobicContact CE2-CD1 4.03Å; Y210-W604 HydrophobicContact CD1-CB 3.93Å; Y210-W604 HydrophobicContact CD1-CD2 4.12Å; Y210-W604 HydrophobicContact CD1-CE3 4.32Å; Y210-W604 AromaticContact CD1-CG 3.95Å; Y210-W604 HydrophobicContact CD1-CG 3.95Å; Y210-W604 AromaticContact CD2-CD2 3.59Å; Y210-W604 HydrophobicContact CD2-CD2 3.59Å; Y210-W604 AromaticContact CD2-CE2 3.93Å; Y210-W604 AromaticContact CD2-CE3 3.44Å; Y210-W604 HydrophobicContact CD2-CE3 3.44Å; Y210-W604 VanDerWaalsContact CD2-CE3 3.44Å; Y210-W604 HydrophobicContact CD2-CG 4.26Å; Y210-W604 HydrophobicContact CD2-CH2 4Å; Y210-W604 HydrophobicContact CD2-CZ2 4.14Å; Y210-W604 AromaticContact CD2-CZ3 3.66Å; Y210-W604 HydrophobicContact CD2-CZ3 3.66Å; Y210-W604 HydrophobicContact CE1-CB 4.16Å; Y210-W604 HydrophobicContact CE1-CD2 4.45Å; Y210-W604 HydrophobicContact CE1-CE3 4.23Å; Y210-W604 HydrophobicContact CE1-CG 4.44Å; Y210-W604 HydrophobicContact CE2-CD2 4Å; Y210-W604 AromaticContact CE2-CE3 3.37Å; Y210-W604 HydrophobicContact CE2-CE3 3.37Å; Y210-W604 HydrophobicContact CE2-CH2 4.28Å; Y210-W604 AromaticContact CE2-CZ3 3.54Å; Y210-W604 HydrophobicContact CE2-CZ3 3.54Å; Y210-W604 HydrophobicContact CG-CB 4.34Å; Y210-W604 AromaticContact CG-CD2 3.68Å; Y210-W604 HydrophobicContact CG-CD2 3.68Å; Y210-W604 AromaticContact CG-CE3 3.96Å; Y210-W604 HydrophobicContact CG-CE3 3.96Å; Y210-W604 AromaticContact CG-CG 3.85Å; Y210-W604 HydrophobicContact CG-CG 3.85Å; Y210-W604 AromaticContact CZ-CE3 3.8Å; Y210-E611 PolarHBondContact OH-OE1 3.25Å
211	R	92.3	Very high	91.6	Very high	43 Å²	43	32.3 Å²	32.3	16%	0.162	17%	0.172	C	C	.	.	I	π-helix	trans	-102.5	-48.4	-175.5	-60.9	-54.2	-179.1	173.3	5.6	115	E198 Y207 N215 I216 E606	E198-R211 VanDerWaalsContact CD-NE 3.25Å; E198-R211 IonicContact OE1-CZ 3.46Å; E198-R211 IonicContact OE1-NE 3.67Å; E198-R211 PolarHBondContact OE1-NE 3.08Å; E198-R211 IonicContact OE1-NH2 3.34Å; E198-R211 PolarHBondContact OE1-NH2 2.95Å; E198-R211 VanDerWaalsContact OE2-CG 3.27Å; E198-R211 WeakPolarHBondContact OE2-CG 3.48Å; E198-R211 IonicContact OE2-CZ 3.9Å; E198-R211 IonicContact OE2-NE 3.19Å; E198-R211 PolarHBondContact OE2-NE 3.32Å; E198-R211 IonicContact OE2-NH2 2.7Å; Y207-R211 HydrophobicContact CD2-CB 4.25Å; Y207-R211 HydrophobicContact CD2-CG 3.91Å; Y207-R211 HydrophobicContact CE1-CB 4.35Å; Y207-R211 HydrophobicContact CE2-CB 3.95Å; Y207-R211 HydrophobicContact CE2-CG 3.72Å; Y207-R211 WeakPolarHBondContact O-CB 3.37Å; Y207-R211 PolarHBondContact O-N 2.99Å; R211-N215 WeakPolarHBondContact O-CA 3.26Å; R211-N215 PolarHBondContact O-N 2.92Å; R211-I216 PolarHBondContact NH1-O 3.5Å; R211-E606 IonicContact CZ-OE2 2.98Å; R211-E606 IonicContact NH1-OE2 3.03Å; R211-E606 IonicContact NH2-OE2 2.76Å; R211-E606 PolarHBondContact NH2-OE2 2.6Å
212	Q	92.2	Very high	91.6	Very high	78 Å²	78	31 Å²	31	36%	0.364	17%	0.168	S	C	.	.	I	π-helix	trans	-81.5	-36.6	-174.4	-65.9	-65.6	-20.4	0	0	112.9	Y207 F208 K229	Y207-Q212 HydrophobicContact CE1-CG 4.11Å; F208-Q212 HydrophobicContact CD2-CB 3.65Å; F208-Q212 HydrophobicContact CD2-CG 4.01Å; F208-Q212 HydrophobicContact CE2-CB 3.91Å; F208-Q212 HydrophobicContact CG-CB 4.17Å; F208-Q212 CarbonylContact O-C 3.52Å; F208-Q212 WeakPolarHBondContact O-CB 3.43Å; F208-Q212 PolarHBondContact O-N 3.09Å; Q212-K229 PolarHBondContact O-NZ 2.95Å
213	T	94.3	Very high	91.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-86.3	-68.8	-179.2	-53.8	0	0	0	0	110.7	F169 Y170 F208 W209 N227 M230	F169-T213 HydrophobicContact CD1-CG2 3.84Å; F169-T213 HydrophobicContact CE1-CG2 3.95Å; Y170-T213 HydrophobicContact CE2-CG2 3.88Å; Y170-T213 PolarHBondContact OH-OG1 2.96Å; F208-T213 WeakPolarHBondContact CE1-OG1 3.49Å; F208-T213 WeakPolarHBondContact O-CB 3.41Å; F208-T213 PolarHBondContact O-N 3.31Å; F208-T213 PolarHBondContact O-OG1 3.48Å; W209-T213 HydrophobicContact CE3-CG2 4.13Å; W209-T213 HydrophobicContact CZ3-CG2 4.17Å; W209-T213 WeakPolarHBondContact O-CB 3.47Å; T213-N227 PolarHBondContact O-ND2 3.03Å; T213-M230 HydrophobicContact CG2-CE 3.71Å; T213-M230 HydrophobicContact CG2-SD 3.83Å; T213-M230 WeakPolarHBondContact O-CE 3.18Å
214	L	92.9	Very high	90.8	Very high	11 Å²	11	33.4 Å²	33.4	6%	0.058	19%	0.187	C	C	.	.	I	π-helix	trans	-79.4	-38.1	-173.8	-63.5	178.2	0	0	0	112.2	W166 W209 I216 N227 N520	W166-L214 HydrophobicContact CZ2-CD2 3.98Å; W209-L214 HydrophobicContact CD2-CD1 4.09Å; W209-L214 HydrophobicContact CD2-CG 4.37Å; W209-L214 HydrophobicContact CH2-CD1 4.4Å; W209-L214 HydrophobicContact CH2-CD2 4.38Å; W209-L214 HydrophobicContact CZ2-CD1 3.7Å; W209-L214 HydrophobicContact CZ2-CD2 4.43Å; W209-L214 HydrophobicContact CZ2-CG 4.29Å; W209-L214 PolarHBondContact O-N 2.89Å; L214-I216 HydrophobicContact CB-CB 4.36Å; L214-I216 HydrophobicContact CD1-CD1 4.47Å; L214-N227 PolarHBondContact O-ND2 3.26Å; L214-N520 HydrophobicContact CD1-CB 3.94Å
215	N	93.8	Very high	90.8	Very high	52 Å²	52	34.3 Å²	34.3	28%	0.278	20%	0.199	S	C	.	.			trans	53.2	58.5	-166.8	-169.5	10.6	0	0	0	110.4	Y210 R211 R517	Y210-N215 CarbonylContact O-C 3.54Å; Y210-N215 VanDerWaalsContact O-CA 3.23Å; Y210-N215 WeakPolarHBondContact O-CA 3.21Å; Y210-N215 PolarHBondContact O-N 2.59Å; R211-N215 WeakPolarHBondContact O-CA 3.26Å; R211-N215 PolarHBondContact O-N 2.92Å; N215-R517 PolarHBondContact ND2-NE 3.29Å; N215-R517 WeakPolarHBondContact O-CB 3.48Å; N215-R517 WeakPolarHBondContact O-CD 3.31Å; N215-R517 WeakPolarHBondContact O-CG 3.32Å
216	I	92.4	Very high	90.8	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	22%	0.222	C	C	.	.			trans	-71.9	149.1	-167	-154.8	169.3	0	0	0	112.6	Y210 R211 L214 R517 N520 Y521 W604	Y210-I216 HydrophobicContact CD1-CB 4.34Å; Y210-I216 HydrophobicContact CD1-CD1 3.84Å; Y210-I216 HydrophobicContact CD1-CG2 3.82Å; Y210-I216 HydrophobicContact CE1-CD1 4.09Å; Y210-I216 HydrophobicContact CG-CG2 4.3Å; Y210-I216 PolarHBondContact O-N 2.73Å; R211-I216 PolarHBondContact NH1-O 3.5Å; L214-I216 HydrophobicContact CB-CB 4.36Å; L214-I216 HydrophobicContact CD1-CD1 4.47Å; I216-R517 WeakPolarHBondContact CA-O 3.38Å; I216-R517 WeakPolarHBondContact CG1-O 3.41Å; I216-N520 HydrophobicContact CD1-CB 4.1Å; I216-Y521 HydrophobicContact CD1-CD1 4.49Å; I216-Y521 HydrophobicContact CD1-CE1 3.66Å; I216-Y521 HydrophobicContact CD1-CE2 4.19Å; I216-Y521 VanDerWaalsContact CD1-CZ 3.49Å; I216-Y521 WeakPolarHBondContact CD1-OH 3.45Å; I216-Y521 HydrophobicContact CG1-CE1 4.42Å; I216-Y521 HydrophobicContact CG1-CE2 4.06Å; I216-W604 HydrophobicContact CG2-CB 3.8Å; I216-W604 HydrophobicContact CG2-CG 4.05Å
217	T	92.9	Very high	91	Very high	13 Å²	13	38.7 Å²	38.7	8%	0.08	22%	0.221	C	C	.	.			trans	-86.6	159.8	168.8	48.2	0	0	0	0	111.3	T219 E222 R517 S518 Y521	T217-T219 VanDerWaalsContact C-N 3.28Å; T217-T219 PolarHBondContact O-N 3.35Å; T217-T219 PolarHBondContact OG1-O 3.12Å; T217-E222 HydrophobicContact CG2-CB 3.88Å; T217-E222 WeakPolarHBondContact CG2-O 3.44Å; T217-E222 PolarHBondContact OG1-O 2.98Å; T217-R517 HydrophobicContact CG2-CB 3.8Å; T217-S518 WeakPolarHBondContact OG1-CB 3.26Å; T217-Y521 WeakPolarHBondContact O-CE2 3.48Å; T217-Y521 PolarHBondContact O-OH 2.94Å
218	S	88.8	Confident	91	Very high	57 Å²	57	46.6 Å²	46.6	40%	0.399	25%	0.25	S	S	.	.	S	Bend	trans	-70.4	-24.9	177.3	55.4	0	0	0	0	112.9	A603	S218-A603 WeakPolarHBondContact O-CB 3.41Å
219	T	89.4	Confident	91	Very high	37 Å²	37	50.2 Å²	50.2	23%	0.227	27%	0.266	C	S	.	.	S	Bend	trans	-137.6	161.5	-178	63.7	0	0	0	0	111.9	T217 D221	T217-T219 VanDerWaalsContact C-N 3.28Å; T217-T219 PolarHBondContact O-N 3.35Å; T217-T219 PolarHBondContact OG1-O 3.12Å; T219-D221 VanDerWaalsContact C-N 3.32Å
220	I	90.2	Very high	91.1	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.267	C	S	.	.	S	Bend	trans	-73.4	-23.6	175.3	-165.7	171.4	0	0	0	112.9	E222 Y521 F522 M525 Y601 Y616 P617 W619 A620	I220-E222 VanDerWaalsContact C-N 3.29Å; I220-E222 PolarHBondContact O-N 3.36Å; I220-Y521 HydrophobicContact CB-CD2 4.16Å; I220-F522 HydrophobicContact CG1-CE2 4.16Å; I220-F522 HydrophobicContact CG1-CZ 4.28Å; I220-M525 HydrophobicContact CD1-CE 3.77Å; I220-Y601 HydrophobicContact CB-CE1 4.34Å; I220-Y601 HydrophobicContact CB-CE2 4.41Å; I220-Y601 HydrophobicContact CG2-CE1 3.94Å; I220-Y601 PolarHBondContact N-OH 2.05Å; I220-Y601 VanDerWaalsContact N-OH 3.13Å; I220-Y616 HydrophobicContact CD1-CD1 4.36Å; I220-Y616 HydrophobicContact CD1-CE1 4.09Å; I220-P617 HydrophobicContact CG2-CG 3.69Å; I220-W619 HydrophobicContact CD1-CH2 4.32Å; I220-W619 HydrophobicContact CG1-CH2 4.07Å; I220-W619 HydrophobicContact CG1-CZ2 4.32Å; I220-W619 HydrophobicContact CG2-CZ2 4.12Å; I220-A620 HydrophobicContact CD1-CB 4.42Å
221	D	88.8	Confident	91.2	Very high	93 Å²	93	50.8 Å²	50.8	50%	0.497	27%	0.271	S	S	.	.	S	Bend	trans	-66.6	-32.6	178.5	-66.6	-47.2	0	0	0	112.2	T219 T223 P617 W619	T219-D221 VanDerWaalsContact C-N 3.32Å; D221-T223 PolarHBondContact O-N 3.32Å; D221-P617 WeakPolarHBondContact OD1-CG 3.38Å; D221-W619 PolarHBondContact OD1-NE1 3.13Å
222	E	87.9	Confident	91.5	Very high	105 Å²	105	52.8 Å²	52.8	49%	0.491	28%	0.284	S	S	.	.			trans	-83.9	112.1	176.4	-67.2	-179.9	-172.4	0	0	110.3	T217 I220 S518	T217-E222 HydrophobicContact CG2-CB 3.88Å; T217-E222 WeakPolarHBondContact CG2-O 3.44Å; T217-E222 PolarHBondContact OG1-O 2.98Å; I220-E222 VanDerWaalsContact C-N 3.29Å; I220-E222 PolarHBondContact O-N 3.36Å; E222-S518 VanDerWaalsContact O-CB 3.24Å; E222-S518 WeakPolarHBondContact O-CB 3.28Å; E222-S518 PolarHBondContact O-OG 3.41Å
223	T	79.2	Confident	91.7	Very high	78 Å²	78	49.6 Å²	49.6	48%	0.479	27%	0.27	S	S	.	.			trans	-72.9	-33.6	177.8	52.9	0	0	0	0	112.7	D221 G225 R517	D221-T223 PolarHBondContact O-N 3.32Å; T223-G225 PolarHBondContact O-N 2.99Å; T223-R517 PolarHBondContact O-N 2.64Å
224	G	79.9	Confident	91.9	Very high	35 Å²	35	49.6 Å²	49.6	36%	0.361	27%	0.27	S	S	.	.			trans	62.6	3.6	179.1	0	0	0	0	0	115.8	R517	G224-R517 WeakPolarHBondContact O-CD 3.33Å; G224-R517 WeakPolarHBondContact O-CG 3.39Å; G224-R517 PolarHBondContact O-NE 2.89Å
225	G	91.4	Very high	92.1	Very high	38 Å²	38	52.3 Å²	52.3	39%	0.392	29%	0.285	S	S	.	.			trans	79.8	178.8	-177.4	0	0	0	0	0	114.4	T223 Q516 R517	T223-G225 PolarHBondContact O-N 2.99Å; G225-Q516 WeakPolarHBondContact O-CA 3.45Å; G225-R517 PolarHBondContact O-N 3.49Å
226	L	93.8	Very high	92.3	Very high	98 Å²	98	52.1 Å²	52.1	51%	0.513	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-81.1	130.8	-179.7	-67	172.4	0	0	0	111.5	W228 L512 V515 Q516	L226-W228 PolarHBondContact O-N 3.28Å; L226-L512 HydrophobicContact CD2-CB 4.48Å; L226-L512 WeakPolarHBondContact CD2-O 3.29Å; L226-V515 HydrophobicContact CD2-CG2 4.06Å; L226-Q516 HydrophobicContact CD2-CG 3.8Å
227	N	94.9	Very high	92.6	Very high	17 Å²	17	51.9 Å²	51.9	9%	0.091	28%	0.284	C	S	.	.			trans	-82.9	104.8	171.6	-177.4	-24.4	0	0	0	109.9	T213 L214 K229 M230 T231 V515	T213-N227 PolarHBondContact O-ND2 3.03Å; L214-N227 PolarHBondContact O-ND2 3.26Å; N227-K229 VanDerWaalsContact C-N 3.26Å; N227-K229 PolarHBondContact O-N 3.04Å; N227-K229 WeakPolarHBondContact OD1-CB 2.93Å; N227-K229 PolarHBondContact OD1-N 3.28Å; N227-K229 VanDerWaalsContact OD1-N 3.1Å; N227-M230 HydrophobicContact CB-CB 4.21Å; N227-M230 HydrophobicContact CB-CG 4.17Å; N227-M230 PolarHBondContact O-N 3.22Å; N227-T231 PolarHBondContact O-N 3.22Å; N227-T231 PolarHBondContact O-OG1 3.02Å; N227-T231 VanDerWaalsContact O-OG1 3.06Å; N227-V515 WeakPolarHBondContact CB-O 3.32Å; N227-V515 PolarHBondContact N-O 3.04Å
228	W	94.1	Very high	92.8	Very high	192 Å²	192	51.7 Å²	51.7	73%	0.727	28%	0.282	S	S	*	.	H	α-helix	trans	-55	-36.3	-177.3	173.8	-99.5	0	0	0	114.1	L226 M230 T231 L232	L226-W228 PolarHBondContact O-N 3.28Å; W228-M230 VanDerWaalsContact C-N 3.34Å; W228-M230 PolarHBondContact O-N 3.37Å; W228-T231 PolarHBondContact O-N 3.48Å; W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 PolarHBondContact O-N 2.93Å
229	K	94.8	Very high	93.2	Very high	89 Å²	89	53 Å²	53	39%	0.387	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-43.9	178.5	-58.8	177.1	-173.6	173.4	0	110.7	F169 Q212 N227 S233	F169-K229 HydrophobicContact CE2-CB 4.2Å; F169-K229 HydrophobicContact CE2-CD 4.07Å; F169-K229 HydrophobicContact CZ-CD 4.3Å; Q212-K229 PolarHBondContact O-NZ 2.95Å; N227-K229 VanDerWaalsContact C-N 3.26Å; N227-K229 PolarHBondContact O-N 3.04Å; N227-K229 WeakPolarHBondContact OD1-CB 2.93Å; N227-K229 PolarHBondContact OD1-N 3.28Å; N227-K229 VanDerWaalsContact OD1-N 3.1Å; K229-S233 PolarHBondContact O-N 2.78Å; K229-S233 VanDerWaalsContact O-N 3.17Å; K229-S233 PolarHBondContact O-OG 3.34Å
230	M	95.6	Very high	93.5	Very high	6 Å²	6	54.6 Å²	54.6	3%	0.03	29%	0.29	C	S	.	.	H	α-helix	trans	-72.7	-39.1	178.8	-62	-58.1	105.5	0	0	111.4	W166 F169 T213 N227 W228 L232 S233 L234 V515	W166-M230 VanDerWaalsContact CD1-SD 3.56Å; F169-M230 HydrophobicContact CB-CE 3.97Å; F169-M230 HydrophobicContact CD1-CE 3.76Å; F169-M230 HydrophobicContact CD2-CE 3.68Å; F169-M230 HydrophobicContact CE1-CE 4.12Å; F169-M230 HydrophobicContact CE2-CE 4.06Å; F169-M230 HydrophobicContact CG-CE 3.51Å; F169-M230 HydrophobicContact CZ-CE 4.26Å; T213-M230 HydrophobicContact CG2-CE 3.71Å; T213-M230 HydrophobicContact CG2-SD 3.83Å; T213-M230 WeakPolarHBondContact O-CE 3.18Å; N227-M230 HydrophobicContact CB-CB 4.21Å; N227-M230 HydrophobicContact CB-CG 4.17Å; N227-M230 PolarHBondContact O-N 3.22Å; W228-M230 VanDerWaalsContact C-N 3.34Å; W228-M230 PolarHBondContact O-N 3.37Å; M230-L232 PolarHBondContact O-N 3.22Å; M230-S233 PolarHBondContact O-N 3.09Å; M230-L234 WeakPolarHBondContact O-CB 3.35Å; M230-L234 PolarHBondContact O-N 3.25Å; M230-V515 HydrophobicContact CB-CB 3.89Å; M230-V515 HydrophobicContact CB-CG1 3.96Å
231	T	96.6	Very high	93.8	Very high	18 Å²	18	54.6 Å²	54.6	11%	0.11	29%	0.29	C	S	.	.	H	α-helix	trans	-59	-45.6	174.8	-56	0	0	0	0	112.1	N227 W228 S233 L234 L235 F508 L512 V515	N227-T231 PolarHBondContact O-N 3.22Å; N227-T231 PolarHBondContact O-OG1 3.02Å; N227-T231 VanDerWaalsContact O-OG1 3.06Å; W228-T231 PolarHBondContact O-N 3.48Å; T231-S233 VanDerWaalsContact C-N 3.35Å; T231-L234 PolarHBondContact O-N 2.97Å; T231-L235 PolarHBondContact O-N 3.28Å; T231-F508 HydrophobicContact CG2-CZ 4.42Å; T231-L512 HydrophobicContact CG2-CD2 3.83Å; T231-V515 WeakPolarHBondContact OG1-CG2 3.25Å
232	L	97.2	Very high	94.2	Very high	84 Å²	84	51 Å²	51	44%	0.44	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-42.6	176.5	-179.9	62.2	0	0	0	111.3	W228 M230 L234 L235 V236	W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 PolarHBondContact O-N 2.93Å; M230-L232 PolarHBondContact O-N 3.22Å; L232-L234 PolarHBondContact O-N 2.99Å; L232-L235 WeakPolarHBondContact O-CB 3.23Å; L232-L235 PolarHBondContact O-N 2.83Å; L232-V236 WeakPolarHBondContact O-CG2 3.12Å; L232-V236 PolarHBondContact O-N 3.42Å
233	S	97.3	Very high	94.5	Very high	11 Å²	11	51.1 Å²	51.1	8%	0.077	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-38.3	179.7	-52.7	0	0	0	0	112	G165 K229 M230 T231 V236 A237	G165-S233 VanDerWaalsContact O-CB 3.27Å; G165-S233 WeakPolarHBondContact O-CB 3.32Å; K229-S233 PolarHBondContact O-N 2.78Å; K229-S233 VanDerWaalsContact O-N 3.17Å; K229-S233 PolarHBondContact O-OG 3.34Å; M230-S233 PolarHBondContact O-N 3.09Å; T231-S233 VanDerWaalsContact C-N 3.35Å; S233-V236 PolarHBondContact O-N 3.03Å; S233-A237 PolarHBondContact O-N 3.34Å
234	L	97.6	Very high	95.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-39.8	173	179.8	65.2	0	0	0	111.9	V162 M230 T231 L232 A237 W238 F508 G511 V515	V162-L234 HydrophobicContact CG2-CD1 4.07Å; M230-L234 WeakPolarHBondContact O-CB 3.35Å; M230-L234 PolarHBondContact O-N 3.25Å; T231-L234 PolarHBondContact O-N 2.97Å; L232-L234 PolarHBondContact O-N 2.99Å; L234-A237 WeakPolarHBondContact O-CB 3.45Å; L234-A237 PolarHBondContact O-N 3.39Å; L234-W238 PolarHBondContact O-N 3.31Å; L234-F508 HydrophobicContact CD2-CD2 4.28Å; L234-F508 HydrophobicContact CD2-CE2 4.42Å; L234-F508 HydrophobicContact CG-CD2 4.13Å; L234-F508 HydrophobicContact CG-CE2 4.34Å; L234-G511 WeakPolarHBondContact CD2-O 3.27Å; L234-V515 HydrophobicContact CB-CG1 4.04Å; L234-V515 HydrophobicContact CD2-CG1 3.75Å; L234-V515 HydrophobicContact CG-CG1 4.46Å
235	L	97.9	Very high	95.9	Very high	68 Å²	68	46.1 Å²	46.1	36%	0.356	24%	0.239	S	C	.	.	H	α-helix	trans	-60.8	-46.3	175.1	179	64.1	0	0	0	110.7	T231 L232 A237 W238 I239 F508	T231-L235 PolarHBondContact O-N 3.28Å; L232-L235 WeakPolarHBondContact O-CB 3.23Å; L232-L235 PolarHBondContact O-N 2.83Å; L235-A237 VanDerWaalsContact C-N 3.33Å; L235-A237 PolarHBondContact O-N 2.96Å; L235-W238 PolarHBondContact O-N 2.83Å; L235-I239 HydrophobicContact CD1-CD1 4.25Å; L235-I239 HydrophobicContact CG-CD1 3.99Å; L235-I239 VanDerWaalsContact O-CG1 3.29Å; L235-I239 WeakPolarHBondContact O-CG1 3.32Å; L235-I239 PolarHBondContact O-N 3.38Å; L235-F508 HydrophobicContact CB-CD2 4.37Å; L235-F508 HydrophobicContact CB-CE2 3.66Å; L235-F508 HydrophobicContact CB-CZ 4.13Å; L235-F508 HydrophobicContact CD1-CD2 4.23Å; L235-F508 HydrophobicContact CD1-CE1 4.29Å; L235-F508 HydrophobicContact CD1-CE2 3.95Å; L235-F508 HydrophobicContact CD1-CZ 3.98Å; L235-F508 HydrophobicContact CG-CE2 4.41Å
236	V	98.1	Very high	96	Very high	48 Å²	48	47 Å²	47	29%	0.291	23%	0.233	S	C	.	.	H	α-helix	trans	-61.2	-42.8	176	176.9	0	0	0	0	110.8	I168 L232 S233 W238 I239 L240	I168-V236 HydrophobicContact CD1-CB 4.49Å; I168-V236 HydrophobicContact CD1-CG1 4.13Å; I168-V236 HydrophobicContact CG2-CG1 4.28Å; L232-V236 WeakPolarHBondContact O-CG2 3.12Å; L232-V236 PolarHBondContact O-N 3.42Å; S233-V236 PolarHBondContact O-N 3.03Å; V236-W238 PolarHBondContact O-N 3.49Å; V236-I239 PolarHBondContact O-N 2.95Å; V236-L240 HydrophobicContact CG1-CD1 4.25Å; V236-L240 HydrophobicContact CG1-CG 4.43Å; V236-L240 WeakPolarHBondContact O-CG 3.34Å; V236-L240 PolarHBondContact O-N 3.44Å
237	A	97.6	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.9	-49	176.7	0	0	0	0	0	112	I164 I168 S233 L234 L235 I239 L240 V241	I164-A237 HydrophobicContact CB-CB 4.37Å; I164-A237 HydrophobicContact CG2-CB 4.01Å; I168-A237 HydrophobicContact CD1-CB 3.81Å; S233-A237 PolarHBondContact O-N 3.34Å; L234-A237 WeakPolarHBondContact O-CB 3.45Å; L234-A237 PolarHBondContact O-N 3.39Å; L235-A237 VanDerWaalsContact C-N 3.33Å; L235-A237 PolarHBondContact O-N 2.96Å; A237-I239 VanDerWaalsContact C-N 3.34Å; A237-I239 PolarHBondContact O-N 3.17Å; A237-L240 PolarHBondContact O-N 3.42Å; A237-V241 WeakPolarHBondContact O-CG2 3.48Å; A237-V241 PolarHBondContact O-N 2.87Å
238	W	97.6	Very high	95.6	Very high	8 Å²	8	48.3 Å²	48.3	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-33.7	177.2	-81.4	110.1	0	0	0	113.4	N161 L234 L235 V236 V241 C242 M477 M481 C504 A507 F508	N161-W238 HydrophobicContact CB-CH2 4.31Å; N161-W238 HydrophobicContact CB-CZ2 3.79Å; N161-W238 PolarHBondContact ND2-N 2.94Å; N161-W238 PolarHBondContact ND2-NE1 3.04Å; N161-W238 VanDerWaalsContact ND2-NE1 3.15Å; L234-W238 PolarHBondContact O-N 3.31Å; L235-W238 PolarHBondContact O-N 2.83Å; V236-W238 PolarHBondContact O-N 3.49Å; W238-V241 HydrophobicContact CE3-CB 4.49Å; W238-V241 HydrophobicContact CE3-CG1 4.43Å; W238-V241 HydrophobicContact CZ3-CG1 4.33Å; W238-C242 WeakPolarHBondContact O-CB 3.44Å; W238-C242 PolarHBondContact O-N 2.96Å; W238-M477 HydrophobicContact CH2-CE 3.73Å; W238-M477 HydrophobicContact CZ2-CE 4.49Å; W238-M477 HydrophobicContact CZ3-CE 4Å; W238-M481 HydrophobicContact CZ3-SD 4.02Å; W238-C504 HydrophobicContact CE3-CB 4.1Å; W238-A507 HydrophobicContact CD2-CB 4.32Å; W238-A507 HydrophobicContact CE3-CB 4.26Å; W238-A507 HydrophobicContact CH2-CB 3.3Å; W238-A507 HydrophobicContact CZ2-CB 3.33Å; W238-A507 HydrophobicContact CZ3-CB 3.78Å; W238-F508 HydrophobicContact CB-CB 4.42Å; W238-F508 AromaticContact CD1-CD2 3.87Å; W238-F508 HydrophobicContact CG-CB 4.01Å
239	I	97.4	Very high	95.2	Very high	85 Å²	85	39.6 Å²	39.6	44%	0.436	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-46.2	172.7	-70.9	167.4	0	0	0	110.3	L235 V236 A237 C242 L243	L235-I239 HydrophobicContact CD1-CD1 4.25Å; L235-I239 HydrophobicContact CG-CD1 3.99Å; L235-I239 VanDerWaalsContact O-CG1 3.29Å; L235-I239 WeakPolarHBondContact O-CG1 3.32Å; L235-I239 PolarHBondContact O-N 3.38Å; V236-I239 PolarHBondContact O-N 2.95Å; A237-I239 VanDerWaalsContact C-N 3.34Å; A237-I239 PolarHBondContact O-N 3.17Å; I239-C242 PolarHBondContact O-N 3.33Å; I239-L243 HydrophobicContact CG2-CD1 3.91Å; I239-L243 HydrophobicContact CG2-CG 4.32Å; I239-L243 WeakPolarHBondContact O-CB 3.42Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.25Å; I239-L243 PolarHBondContact O-N 3.4Å
240	L	96.4	Very high	94.9	Very high	71 Å²	71	39.8 Å²	39.8	37%	0.372	21%	0.211	S	C	.	.	H	α-helix	trans	-60.4	-47.2	177.8	-70.6	174.6	0	0	0	111.8	I168 V236 A237 C242 L243 A244	I168-L240 HydrophobicContact CD1-CD1 3.91Å; V236-L240 HydrophobicContact CG1-CD1 4.25Å; V236-L240 HydrophobicContact CG1-CG 4.43Å; V236-L240 WeakPolarHBondContact O-CG 3.34Å; V236-L240 PolarHBondContact O-N 3.44Å; A237-L240 PolarHBondContact O-N 3.42Å; L240-C242 PolarHBondContact O-N 3.46Å; L240-L243 PolarHBondContact O-N 3Å; L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 3.24Å
241	V	96.1	Very high	94.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-45	175.9	172.5	0	0	0	0	111	N161 A237 W238 L243 A244 V245 L474 M477 M481	N161-V241 WeakPolarHBondContact OD1-CG2 3.3Å; A237-V241 WeakPolarHBondContact O-CG2 3.48Å; A237-V241 PolarHBondContact O-N 2.87Å; W238-V241 HydrophobicContact CE3-CB 4.49Å; W238-V241 HydrophobicContact CE3-CG1 4.43Å; W238-V241 HydrophobicContact CZ3-CG1 4.33Å; V241-L243 PolarHBondContact O-N 3.01Å; V241-A244 PolarHBondContact O-N 2.95Å; V241-V245 WeakPolarHBondContact O-CG2 3.29Å; V241-V245 PolarHBondContact O-N 3.44Å; V241-V245 VanDerWaalsContact O-N 3.09Å; V241-L474 HydrophobicContact CG2-CD1 4.11Å; V241-M477 HydrophobicContact CG1-CB 4.34Å; V241-M477 HydrophobicContact CG1-CE 4.47Å; V241-M477 HydrophobicContact CG2-CB 3.82Å; V241-M477 HydrophobicContact CG2-CE 4.5Å; V241-M477 HydrophobicContact CG2-CG 4.21Å; V241-M481 HydrophobicContact CG1-CG 3.69Å
242	C	96	Very high	94.4	Very high	18 Å²	18	39.8 Å²	39.8	12%	0.122	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-46.7	178.7	-171.2	0	0	0	0	111.4	W238 I239 L240 A244 V245 I246 C504	W238-C242 WeakPolarHBondContact O-CB 3.44Å; W238-C242 PolarHBondContact O-N 2.96Å; I239-C242 PolarHBondContact O-N 3.33Å; L240-C242 PolarHBondContact O-N 3.46Å; C242-A244 VanDerWaalsContact C-N 3.33Å; C242-A244 PolarHBondContact O-N 3.03Å; C242-V245 PolarHBondContact O-N 3.46Å; C242-I246 WeakPolarHBondContact O-CA 3.43Å; C242-I246 VanDerWaalsContact O-CB 3.29Å; C242-I246 WeakPolarHBondContact O-CB 3.34Å; C242-I246 PolarHBondContact O-N 3.35Å; C242-C504 HydrophobicContact CB-CB 4.16Å
243	L	95.3	Very high	93.9	Very high	107 Å²	107	35.8 Å²	35.8	56%	0.56	19%	0.191	S	C	*	.	H	α-helix	trans	-63.7	-38.7	178.8	-70.2	174.5	0	0	0	111.9	I239 L240 V241 V245 I246 S251	I239-L243 HydrophobicContact CG2-CD1 3.91Å; I239-L243 HydrophobicContact CG2-CG 4.32Å; I239-L243 WeakPolarHBondContact O-CB 3.42Å; I239-L243 VanDerWaalsContact O-CG 3.28Å; I239-L243 WeakPolarHBondContact O-CG 3.25Å; I239-L243 PolarHBondContact O-N 3.4Å; L240-L243 PolarHBondContact O-N 3Å; V241-L243 PolarHBondContact O-N 3.01Å; L243-V245 VanDerWaalsContact C-N 3.35Å; L243-V245 PolarHBondContact O-N 2.6Å; L243-I246 WeakPolarHBondContact O-CG2 3.29Å; L243-S251 PolarHBondContact O-OG 2.86Å
244	A	94.9	Very high	93.6	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-40.1	177.8	0	0	0	0	0	112.2	L240 V241 C242 S251 S252 V255 L474 I478	L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 3.24Å; V241-A244 PolarHBondContact O-N 2.95Å; C242-A244 VanDerWaalsContact C-N 3.33Å; C242-A244 PolarHBondContact O-N 3.03Å; A244-S251 CarbonylContact O-C 3.48Å; A244-S251 VanDerWaalsContact O-CB 3.27Å; A244-S251 WeakPolarHBondContact O-CB 3.48Å; A244-S251 PolarHBondContact O-OG 2.9Å; A244-S252 PolarHBondContact O-N 3.42Å; A244-V255 HydrophobicContact CB-CG1 4.38Å; A244-V255 HydrophobicContact CB-CG2 4.3Å; A244-L474 HydrophobicContact CB-CD1 4.1Å; A244-I478 HydrophobicContact CB-CD1 4.02Å; A244-I478 HydrophobicContact CB-CG1 4.08Å
245	V	93.9	Very high	93.3	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-98.2	-8.7	-171.9	-174.7	0	0	0	0	113.7	V241 C242 L243 K247 G248 I478 M481	V241-V245 WeakPolarHBondContact O-CG2 3.29Å; V241-V245 PolarHBondContact O-N 3.44Å; V241-V245 VanDerWaalsContact O-N 3.09Å; C242-V245 PolarHBondContact O-N 3.46Å; L243-V245 VanDerWaalsContact C-N 3.35Å; L243-V245 PolarHBondContact O-N 2.6Å; V245-K247 VanDerWaalsContact C-N 3.29Å; V245-K247 PolarHBondContact O-N 2.85Å; V245-G248 WeakPolarHBondContact O-CA 3.45Å; V245-G248 PolarHBondContact O-N 3.49Å; V245-I478 HydrophobicContact CG2-CB 4.36Å; V245-I478 HydrophobicContact CG2-CG1 3.95Å; V245-I478 HydrophobicContact CG2-CG2 4.47Å; V245-M481 HydrophobicContact CG1-CB 4.24Å; V245-M481 HydrophobicContact CG2-CB 4.15Å
246	I	93.4	Very high	93	Very high	55 Å²	55	41.3 Å²	41.3	28%	0.282	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-36.3	-168.6	-163.8	168.8	0	0	0	115.3	C242 L243 E497	C242-I246 WeakPolarHBondContact O-CA 3.43Å; C242-I246 VanDerWaalsContact O-CB 3.29Å; C242-I246 WeakPolarHBondContact O-CB 3.34Å; C242-I246 PolarHBondContact O-N 3.35Å; L243-I246 WeakPolarHBondContact O-CG2 3.29Å; I246-E497 HydrophobicContact CG1-CB 4.4Å
247	K	90.5	Very high	92.7	Very high	121 Å²	121	42.5 Å²	42.5	53%	0.526	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	8	176.7	-60.9	-172.7	175.3	177.4	0	113.9	V245 K496	V245-K247 VanDerWaalsContact C-N 3.29Å; V245-K247 PolarHBondContact O-N 2.85Å; K247-K496 PolarHBondContact O-NZ 2.87Å
248	G	88.9	Confident	92.5	Very high	23 Å²	23	47.5 Å²	47.5	24%	0.237	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-145.9	-169.9	0	0	0	0	0	111.6	V245 Q250 S251 S252	V245-G248 WeakPolarHBondContact O-CA 3.45Å; V245-G248 PolarHBondContact O-N 3.49Å; G248-Q250 PolarHBondContact O-N 2.97Å; G248-S251 PolarHBondContact O-N 3.31Å; G248-S252 PolarHBondContact O-N 3.46Å; G248-S252 VanDerWaalsContact O-N 3.09Å; G248-S252 PolarHBondContact O-OG 3.03Å
249	I	87	Confident	92.2	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.046	24%	0.236	C	C	.	.	H	α-helix	trans	-53.5	-29.9	-174.1	64.9	173.9	0	0	0	114.6	P64 W66 S251 G253 Y325	P64-I249 HydrophobicContact CB-CD1 3.96Å; P64-I249 HydrophobicContact CB-CG1 4.33Å; P64-I249 HydrophobicContact CG-CD1 4.16Å; P64-I249 HydrophobicContact CG-CG1 4.46Å; W66-I249 HydrophobicContact CE3-CB 4.3Å; W66-I249 HydrophobicContact CH2-CB 3.99Å; W66-I249 HydrophobicContact CH2-CG2 3.93Å; W66-I249 HydrophobicContact CZ2-CB 4.36Å; W66-I249 HydrophobicContact CZ2-CG2 3.97Å; W66-I249 HydrophobicContact CZ3-CB 3.95Å; W66-I249 HydrophobicContact CZ3-CG2 4.4Å; I249-S251 VanDerWaalsContact C-N 3.33Å; I249-S251 PolarHBondContact O-N 3.04Å; I249-G253 PolarHBondContact O-N 3.25Å; I249-Y325 HydrophobicContact CD1-CD1 3.91Å; I249-Y325 HydrophobicContact CD1-CD2 4.31Å; I249-Y325 HydrophobicContact CD1-CG 3.77Å; I249-Y325 HydrophobicContact CG2-CD2 3.54Å; I249-Y325 HydrophobicContact CG2-CE2 3.67Å; I249-Y325 HydrophobicContact CG2-CG 4.1Å
250	Q	87.5	Confident	92	Very high	92 Å²	92	43.5 Å²	43.5	43%	0.43	22%	0.217	S	C	.	.	H	α-helix	trans	-68	-28.2	-179.9	-68.6	179.6	-18.6	0	0	114.2	G248	G248-Q250 PolarHBondContact O-N 2.97Å
251	S	90.3	Very high	91.8	Very high	24 Å²	24	44.3 Å²	44.3	17%	0.168	22%	0.221	C	C	.	.	H	α-helix	trans	-92	-47.3	174.2	178.3	0	0	0	0	109.7	L243 A244 G248 I249 G253 K254 V255	L243-S251 PolarHBondContact O-OG 2.86Å; A244-S251 CarbonylContact O-C 3.48Å; A244-S251 VanDerWaalsContact O-CB 3.27Å; A244-S251 WeakPolarHBondContact O-CB 3.48Å; A244-S251 PolarHBondContact O-OG 2.9Å; G248-S251 PolarHBondContact O-N 3.31Å; I249-S251 VanDerWaalsContact C-N 3.33Å; I249-S251 PolarHBondContact O-N 3.04Å; S251-G253 PolarHBondContact O-N 2.82Å; S251-K254 PolarHBondContact O-N 3.02Å; S251-V255 PolarHBondContact O-N 3.03Å
252	S	90.6	Very high	91.8	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-53.3	-52.3	-179.2	-59.7	0	0	0	0	111.6	A244 G248 K254 V255 M256	A244-S252 PolarHBondContact O-N 3.42Å; G248-S252 PolarHBondContact O-N 3.46Å; G248-S252 VanDerWaalsContact O-N 3.09Å; G248-S252 PolarHBondContact O-OG 3.03Å; S252-K254 VanDerWaalsContact C-N 3.27Å; S252-K254 PolarHBondContact O-N 3.44Å; S252-V255 WeakPolarHBondContact O-CB 3.33Å; S252-V255 PolarHBondContact O-N 2.78Å; S252-M256 VanDerWaalsContact O-CG 3.26Å; S252-M256 WeakPolarHBondContact O-CG 3.36Å; S252-M256 PolarHBondContact O-N 2.87Å
253	G	87.9	Confident	91.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-30.3	-176.1	0	0	0	0	0	114.2	E71 I249 S251 M256 Y257	E71-G253 VanDerWaalsContact OE1-C 3.27Å; E71-G253 WeakPolarHBondContact OE1-CA 3.42Å; I249-G253 PolarHBondContact O-N 3.25Å; S251-G253 PolarHBondContact O-N 2.82Å; G253-M256 PolarHBondContact O-N 2.9Å; G253-Y257 VanDerWaalsContact O-CD2 3.26Å; G253-Y257 WeakPolarHBondContact O-CD2 3.46Å
254	K	89.7	Confident	91.7	Very high	149 Å²	149	43 Å²	43	65%	0.648	21%	0.208	S	C	*	.	H	α-helix	trans	-67.2	-42.9	171.9	-65.1	-172.3	-177.6	-170.9	0	112.6	S251 S252 M256 Y257	S251-K254 PolarHBondContact O-N 3.02Å; S252-K254 VanDerWaalsContact C-N 3.27Å; S252-K254 PolarHBondContact O-N 3.44Å; K254-M256 VanDerWaalsContact C-N 3.27Å; K254-M256 PolarHBondContact O-N 3.48Å; K254-Y257 PolarHBondContact O-N 3.24Å
255	V	92.1	Very high	91.7	Very high	46 Å²	46	46.6 Å²	46.6	28%	0.279	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-36.7	176.1	176.8	0	0	0	0	110.5	A244 S251 S252 Y257 F258 S259 L474 I478	A244-V255 HydrophobicContact CB-CG1 4.38Å; A244-V255 HydrophobicContact CB-CG2 4.3Å; S251-V255 PolarHBondContact O-N 3.03Å; S252-V255 WeakPolarHBondContact O-CB 3.33Å; S252-V255 PolarHBondContact O-N 2.78Å; V255-Y257 VanDerWaalsContact C-N 3.29Å; V255-Y257 PolarHBondContact O-N 3.47Å; V255-F258 PolarHBondContact O-N 3.36Å; V255-S259 WeakPolarHBondContact O-CB 3.45Å; V255-S259 PolarHBondContact O-N 2.95Å; V255-L474 HydrophobicContact CG1-CD2 3.79Å; V255-I478 HydrophobicContact CB-CD1 4.48Å; V255-I478 HydrophobicContact CG1-CD1 4.13Å
256	M	91.4	Very high	91.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-30.6	-178.4	-67.1	-49.3	-71.1	0	0	113.7	L74 A75 G78 S252 G253 K254 F258 S259 S260 I478	L74-M256 WeakPolarHBondContact O-CE 3.43Å; A75-M256 HydrophobicContact CB-CG 4.04Å; G78-M256 VanDerWaalsContact CA-CE 3.41Å; S252-M256 VanDerWaalsContact O-CG 3.26Å; S252-M256 WeakPolarHBondContact O-CG 3.36Å; S252-M256 PolarHBondContact O-N 2.87Å; G253-M256 PolarHBondContact O-N 2.9Å; K254-M256 VanDerWaalsContact C-N 3.27Å; K254-M256 PolarHBondContact O-N 3.48Å; M256-F258 VanDerWaalsContact C-N 3.31Å; M256-F258 PolarHBondContact O-N 3.01Å; M256-S259 PolarHBondContact O-N 2.84Å; M256-S260 VanDerWaalsContact O-CB 3.22Å; M256-S260 WeakPolarHBondContact O-CB 3.43Å; M256-S260 PolarHBondContact O-N 3.42Å; M256-S260 PolarHBondContact O-OG 2.73Å; M256-I478 HydrophobicContact SD-CB 4.43Å; M256-I478 HydrophobicContact SD-CD1 3.54Å; M256-I478 VanDerWaalsContact SD-CD1 3.54Å; M256-I478 HydrophobicContact SD-CG2 4.36Å
257	Y	91.7	Very high	91.8	Very high	73 Å²	73	44.1 Å²	44.1	29%	0.286	22%	0.217	S	C	.	.	H	α-helix	trans	-54.8	-48.1	176	-79.8	-77.4	0	0	0	112.2	L70 E71 L74 G253 K254 V255 L261	L70-Y257 HydrophobicContact CD2-CE1 3.92Å; L70-Y257 HydrophobicContact CG-CE1 4.19Å; E71-Y257 HydrophobicContact CB-CE2 4.25Å; E71-Y257 HydrophobicContact CG-CE2 4.07Å; L74-Y257 HydrophobicContact CD1-CD1 3.49Å; L74-Y257 VanDerWaalsContact CD1-CD1 3.49Å; L74-Y257 HydrophobicContact CD1-CE1 3.76Å; L74-Y257 HydrophobicContact CD1-CG 4.24Å; G253-Y257 VanDerWaalsContact O-CD2 3.26Å; G253-Y257 WeakPolarHBondContact O-CD2 3.46Å; K254-Y257 PolarHBondContact O-N 3.24Å; V255-Y257 VanDerWaalsContact C-N 3.29Å; V255-Y257 PolarHBondContact O-N 3.47Å; Y257-L261 WeakPolarHBondContact O-CB 3.22Å; Y257-L261 WeakPolarHBondContact O-CD1 3.22Å; Y257-L261 VanDerWaalsContact O-CG 3.24Å; Y257-L261 WeakPolarHBondContact O-CG 3.46Å
258	F	93.6	Very high	92	Very high	106 Å²	106	44.5 Å²	44.5	47%	0.465	22%	0.219	S	C	.	.	H	α-helix	trans	-79.1	-48.8	178	-177.4	-97.3	0	0	0	111.5	V255 M256 S260 L261 F262 F467	V255-F258 PolarHBondContact O-N 3.36Å; M256-F258 VanDerWaalsContact C-N 3.31Å; M256-F258 PolarHBondContact O-N 3.01Å; F258-S260 VanDerWaalsContact C-N 3.28Å; F258-S260 PolarHBondContact O-N 3.37Å; F258-L261 PolarHBondContact O-N 3.21Å; F258-F262 HydrophobicContact CD1-CB 4.44Å; F258-F262 HydrophobicContact CD2-CB 4.46Å; F258-F262 HydrophobicContact CE1-CB 4.05Å; F258-F262 HydrophobicContact CE1-CD1 4.43Å; F258-F262 HydrophobicContact CE1-CG 4.1Å; F258-F262 HydrophobicContact CE2-CB 4.08Å; F258-F262 HydrophobicContact CE2-CD2 4.06Å; F258-F262 HydrophobicContact CE2-CG 4.22Å; F258-F262 HydrophobicContact CZ-CB 3.85Å; F258-F262 HydrophobicContact CZ-CD1 4.31Å; F258-F262 AromaticContact CZ-CD2 3.75Å; F258-F262 HydrophobicContact CZ-CD2 3.75Å; F258-F262 HydrophobicContact CZ-CE2 4.41Å; F258-F262 AromaticContact CZ-CG 3.69Å; F258-F262 HydrophobicContact CZ-CG 3.69Å; F258-F262 VanDerWaalsContact O-CB 3.24Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 3.38Å; F258-F467 AromaticContact CE1-CE1 3.85Å; F258-F467 HydrophobicContact CE1-CE1 3.85Å; F258-F467 AromaticContact CE1-CZ 3.61Å; F258-F467 HydrophobicContact CE1-CZ 3.61Å; F258-F467 AromaticContact CZ-CE1 3.74Å; F258-F467 HydrophobicContact CZ-CE1 3.74Å; F258-F467 AromaticContact CZ-CZ 3.94Å; F258-F467 HydrophobicContact CZ-CZ 3.94Å
259	S	92.1	Very high	92.3	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-31.3	-171.9	-158.6	0	0	0	0	113.4	V255 M256 P263 N471	V255-S259 WeakPolarHBondContact O-CB 3.45Å; V255-S259 PolarHBondContact O-N 2.95Å; M256-S259 PolarHBondContact O-N 2.84Å; S259-P263 WeakPolarHBondContact O-CD 3.5Å; S259-P263 WeakPolarHBondContact O-CG 3.13Å; S259-N471 PolarHBondContact OG-O 3.24Å
260	S	92.2	Very high	92.6	Very high	6 Å²	6	45.2 Å²	45.2	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-86.7	-33.4	178.5	67.3	0	0	0	0	113.3	M256 F258 Y264	M256-S260 VanDerWaalsContact O-CB 3.22Å; M256-S260 WeakPolarHBondContact O-CB 3.43Å; M256-S260 PolarHBondContact O-N 3.42Å; M256-S260 PolarHBondContact O-OG 2.73Å; F258-S260 VanDerWaalsContact C-N 3.28Å; F258-S260 PolarHBondContact O-N 3.37Å; S260-Y264 WeakPolarHBondContact O-CD2 3.48Å; S260-Y264 WeakPolarHBondContact O-CE2 3.42Å
261	L	93.4	Very high	92.9	Very high	88 Å²	88	42.2 Å²	42.2	46%	0.461	21%	0.206	S	C	.	.	H	α-helix	trans	-85.4	-38.2	-176.4	-66	178.5	0	0	0	113.1	L74 Y257 F258 Y264 V265	L74-L261 HydrophobicContact CD2-CD2 3.95Å; L74-L261 HydrophobicContact CD2-CG 4.36Å; Y257-L261 WeakPolarHBondContact O-CB 3.22Å; Y257-L261 WeakPolarHBondContact O-CD1 3.22Å; Y257-L261 VanDerWaalsContact O-CG 3.24Å; Y257-L261 WeakPolarHBondContact O-CG 3.46Å; F258-L261 PolarHBondContact O-N 3.21Å; L261-Y264 WeakPolarHBondContact O-CB 3.45Å; L261-Y264 PolarHBondContact O-N 3.28Å; L261-Y264 VanDerWaalsContact O-N 3.09Å; L261-V265 PolarHBondContact O-N 2.98Å
262	F	95.4	Very high	93.1	Very high	39 Å²	39	44.3 Å²	44.3	17%	0.171	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-42.3	-177.2	178.7	-104.1	0	0	0	113.5	F258 Y264 V265 V266 F467	F258-F262 HydrophobicContact CD1-CB 4.44Å; F258-F262 HydrophobicContact CD2-CB 4.46Å; F258-F262 HydrophobicContact CE1-CB 4.05Å; F258-F262 HydrophobicContact CE1-CD1 4.43Å; F258-F262 HydrophobicContact CE1-CG 4.1Å; F258-F262 HydrophobicContact CE2-CB 4.08Å; F258-F262 HydrophobicContact CE2-CD2 4.06Å; F258-F262 HydrophobicContact CE2-CG 4.22Å; F258-F262 HydrophobicContact CZ-CB 3.85Å; F258-F262 HydrophobicContact CZ-CD1 4.31Å; F258-F262 AromaticContact CZ-CD2 3.75Å; F258-F262 HydrophobicContact CZ-CD2 3.75Å; F258-F262 HydrophobicContact CZ-CE2 4.41Å; F258-F262 AromaticContact CZ-CG 3.69Å; F258-F262 HydrophobicContact CZ-CG 3.69Å; F258-F262 VanDerWaalsContact O-CB 3.24Å; F258-F262 WeakPolarHBondContact O-CB 3.31Å; F258-F262 PolarHBondContact O-N 3.38Å; F262-Y264 VanDerWaalsContact C-N 3.27Å; F262-Y264 PolarHBondContact O-N 3.49Å; F262-V265 WeakPolarHBondContact O-CB 3.22Å; F262-V265 PolarHBondContact O-N 3.31Å; F262-V265 VanDerWaalsContact O-N 3.13Å; F262-V266 HydrophobicContact CD1-CG2 4.1Å; F262-V266 HydrophobicContact CD2-CG2 4.41Å; F262-V266 HydrophobicContact CE1-CG2 3.52Å; F262-V266 HydrophobicContact CE2-CG2 3.88Å; F262-V266 HydrophobicContact CZ-CG2 3.39Å; F262-V266 PolarHBondContact O-N 2.82Å; F262-V266 VanDerWaalsContact O-N 3.09Å; F262-F467 HydrophobicContact CD1-CD1 4.04Å; F262-F467 HydrophobicContact CD1-CE1 4.23Å; F262-F467 HydrophobicContact CE1-CB 4.13Å; F262-F467 AromaticContact CE1-CD1 3.22Å; F262-F467 HydrophobicContact CE1-CD1 3.22Å; F262-F467 AromaticContact CE1-CE1 3.8Å; F262-F467 HydrophobicContact CE1-CE1 3.8Å; F262-F467 AromaticContact CE1-CG 3.87Å; F262-F467 HydrophobicContact CE1-CG 3.87Å; F262-F467 HydrophobicContact CE2-CD1 4.28Å; F262-F467 HydrophobicContact CE2-CE1 4.41Å; F262-F467 AromaticContact CZ-CD1 3.38Å; F262-F467 HydrophobicContact CZ-CD1 3.38Å; F262-F467 AromaticContact CZ-CE1 3.9Å; F262-F467 HydrophobicContact CZ-CE1 3.9Å; F262-F467 HydrophobicContact CZ-CG 4.35Å
263	P	95.1	Very high	93.2	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-56	-37.1	175.1	-29.3	38.1	0	0	0	114.6	S259 V266 L267 M468 N471 L472	S259-P263 WeakPolarHBondContact O-CD 3.5Å; S259-P263 WeakPolarHBondContact O-CG 3.13Å; P263-V266 PolarHBondContact O-N 3.3Å; P263-L267 WeakPolarHBondContact O-CB 3.44Å; P263-L267 VanDerWaalsContact O-CG 3.31Å; P263-L267 WeakPolarHBondContact O-CG 3.48Å; P263-L267 PolarHBondContact O-N 3.4Å; P263-M468 HydrophobicContact CB-CG 3.86Å; P263-M468 HydrophobicContact CG-CG 4.38Å; P263-N471 HydrophobicContact CG-CB 4.18Å; P263-L472 HydrophobicContact CB-CD1 4.24Å; P263-L472 HydrophobicContact CB-CD2 3.56Å; P263-L472 HydrophobicContact CB-CG 3.75Å; P263-L472 HydrophobicContact CG-CD2 3.63Å; P263-L472 HydrophobicContact CG-CG 3.68Å
264	Y	94.4	Very high	93.3	Very high	57 Å²	57	46.7 Å²	46.7	22%	0.224	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-38.8	177.7	-68	-77.3	0	0	0	112.5	V77 S260 L261 F262 V266 L267 F268 I342 T346	V77-Y264 HydrophobicContact CG1-CE2 4.4Å; V77-Y264 WeakPolarHBondContact CG1-OH 3.19Å; S260-Y264 WeakPolarHBondContact O-CD2 3.48Å; S260-Y264 WeakPolarHBondContact O-CE2 3.42Å; L261-Y264 WeakPolarHBondContact O-CB 3.45Å; L261-Y264 PolarHBondContact O-N 3.28Å; L261-Y264 VanDerWaalsContact O-N 3.09Å; F262-Y264 VanDerWaalsContact C-N 3.27Å; F262-Y264 PolarHBondContact O-N 3.49Å; Y264-V266 VanDerWaalsContact C-N 3.33Å; Y264-L267 PolarHBondContact O-N 3.44Å; Y264-F268 WeakPolarHBondContact O-CB 3.34Å; Y264-F268 PolarHBondContact O-N 3.22Å; Y264-I342 WeakPolarHBondContact OH-CG2 3.5Å; Y264-T346 HydrophobicContact CE1-CG2 3.69Å; Y264-T346 WeakPolarHBondContact CE1-OG1 3.33Å; Y264-T346 PolarHBondContact OH-OG1 3.24Å
265	V	95.6	Very high	93.4	Very high	82 Å²	82	44 Å²	44	50%	0.497	22%	0.219	S	C	.	.	H	α-helix	trans	-60.8	-46.7	174.4	179.2	0	0	0	0	109.8	L261 F262 F268 C269	L261-V265 PolarHBondContact O-N 2.98Å; F262-V265 WeakPolarHBondContact O-CB 3.22Å; F262-V265 PolarHBondContact O-N 3.31Å; F262-V265 VanDerWaalsContact O-N 3.13Å; V265-F268 PolarHBondContact O-N 3.05Å; V265-C269 PolarHBondContact O-N 3.4Å; V265-C269 PolarHBondContact O-SG 2.96Å
266	V	95.3	Very high	93.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-46.8	179.6	178.2	0	0	0	0	111.5	F262 P263 Y264 F268 C269 F270 M464 M468	F262-V266 HydrophobicContact CD1-CG2 4.1Å; F262-V266 HydrophobicContact CD2-CG2 4.41Å; F262-V266 HydrophobicContact CE1-CG2 3.52Å; F262-V266 HydrophobicContact CE2-CG2 3.88Å; F262-V266 HydrophobicContact CZ-CG2 3.39Å; F262-V266 PolarHBondContact O-N 2.82Å; F262-V266 VanDerWaalsContact O-N 3.09Å; P263-V266 PolarHBondContact O-N 3.3Å; Y264-V266 VanDerWaalsContact C-N 3.33Å; V266-F268 VanDerWaalsContact C-N 3.29Å; V266-F268 PolarHBondContact O-N 3.14Å; V266-C269 WeakPolarHBondContact O-CB 3.27Å; V266-C269 PolarHBondContact O-N 3.31Å; V266-F270 HydrophobicContact CG1-CD2 3.53Å; V266-F270 HydrophobicContact CG1-CE2 3.64Å; V266-F270 WeakPolarHBondContact O-CD2 3.48Å; V266-F270 PolarHBondContact O-N 3.18Å; V266-M464 HydrophobicContact CB-CE 4.38Å; V266-M464 HydrophobicContact CG1-CB 4.26Å; V266-M464 HydrophobicContact CG1-CE 4.36Å; V266-M464 HydrophobicContact CG2-CE 3.87Å; V266-M468 HydrophobicContact CB-CB 4.01Å; V266-M468 HydrophobicContact CB-CG 4.26Å; V266-M468 HydrophobicContact CB-SD 3.82Å; V266-M468 HydrophobicContact CG1-CB 3.83Å; V266-M468 HydrophobicContact CG1-CE 4.41Å; V266-M468 HydrophobicContact CG1-CG 4.26Å; V266-M468 HydrophobicContact CG1-SD 3.61Å; V266-M468 HydrophobicContact CG2-CB 4.14Å
267	L	94.2	Very high	93.4	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-41.9	176.3	-73.4	176.2	0	0	0	111.7	P263 Y264 F270 L271 T346 L349 A350 V353 M468	P263-L267 WeakPolarHBondContact O-CB 3.44Å; P263-L267 VanDerWaalsContact O-CG 3.31Å; P263-L267 WeakPolarHBondContact O-CG 3.48Å; P263-L267 PolarHBondContact O-N 3.4Å; Y264-L267 PolarHBondContact O-N 3.44Å; L267-F270 PolarHBondContact O-N 3.34Å; L267-L271 WeakPolarHBondContact O-CB 3.33Å; L267-L271 PolarHBondContact O-N 3Å; L267-T346 HydrophobicContact CD1-CG2 4.28Å; L267-L349 HydrophobicContact CB-CD2 4.24Å; L267-L349 HydrophobicContact CD1-CD2 4.44Å; L267-A350 HydrophobicContact CD1-CB 4.41Å; L267-A350 HydrophobicContact CD2-CB 4.3Å; L267-V353 WeakPolarHBondContact O-CG2 3.44Å; L267-M468 HydrophobicContact CD2-CE 4.28Å; L267-M468 HydrophobicContact CD2-SD 3.85Å; L267-M468 HydrophobicContact CG-SD 3.84Å
268	F	94.6	Very high	93.3	Very high	129 Å²	129	54.5 Å²	54.5	57%	0.566	27%	0.267	S	S	*	.	H	α-helix	trans	-65.1	-43.9	175.9	-178.2	-100.6	0	0	0	112.3	Y264 V265 V266 F270 L271 V272	Y264-F268 WeakPolarHBondContact O-CB 3.34Å; Y264-F268 PolarHBondContact O-N 3.22Å; V265-F268 PolarHBondContact O-N 3.05Å; V266-F268 VanDerWaalsContact C-N 3.29Å; V266-F268 PolarHBondContact O-N 3.14Å; F268-F270 PolarHBondContact O-N 2.59Å; F268-L271 WeakPolarHBondContact O-CB 3.25Å; F268-L271 PolarHBondContact O-N 3.1Å; F268-V272 HydrophobicContact CD1-CG2 4.46Å; F268-V272 HydrophobicContact CE1-CG2 4.03Å; F268-V272 HydrophobicContact CE2-CG2 4.37Å; F268-V272 HydrophobicContact CZ-CG2 3.98Å; F268-V272 WeakPolarHBondContact O-CG2 3.35Å; F268-V272 PolarHBondContact O-N 3.49Å
269	C	94.9	Very high	93	Very high	43 Å²	43	50.4 Å²	50.4	29%	0.291	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-45.1	174.2	-72.5	0	0	0	0	112.1	V265 V266 L271 V272 R273 W461 M464	V265-C269 PolarHBondContact O-N 3.4Å; V265-C269 PolarHBondContact O-SG 2.96Å; V266-C269 WeakPolarHBondContact O-CB 3.27Å; V266-C269 PolarHBondContact O-N 3.31Å; C269-L271 VanDerWaalsContact C-N 3.32Å; C269-V272 PolarHBondContact O-N 2.85Å; C269-R273 WeakPolarHBondContact O-CB 3.34Å; C269-R273 PolarHBondContact O-N 3.29Å; C269-W461 HydrophobicContact CB-CZ3 4.36Å; C269-M464 HydrophobicContact CB-CE 4.09Å
270	F	93.6	Very high	92.9	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-33.5	176.7	-91.4	-79.1	0	0	0	112.4	V266 L267 F268 G274 V353 M452 F455 W461 M464 F465	V266-F270 HydrophobicContact CG1-CD2 3.53Å; V266-F270 HydrophobicContact CG1-CE2 3.64Å; V266-F270 WeakPolarHBondContact O-CD2 3.48Å; V266-F270 PolarHBondContact O-N 3.18Å; L267-F270 PolarHBondContact O-N 3.34Å; F268-F270 PolarHBondContact O-N 2.59Å; F270-G274 WeakPolarHBondContact O-CA 3.33Å; F270-G274 PolarHBondContact O-N 3.13Å; F270-V353 HydrophobicContact CB-CG1 3.66Å; F270-M452 HydrophobicContact CE1-CG 4.5Å; F270-M452 HydrophobicContact CE1-SD 4.33Å; F270-M452 HydrophobicContact CZ-SD 4.1Å; F270-F455 HydrophobicContact CD1-CE2 4.41Å; F270-F455 HydrophobicContact CE1-CE2 4.12Å; F270-W461 HydrophobicContact CD1-CE3 4.17Å; F270-W461 HydrophobicContact CD2-CE3 4.43Å; F270-W461 HydrophobicContact CE1-CB 4.37Å; F270-W461 AromaticContact CE1-CE3 3.84Å; F270-W461 HydrophobicContact CE1-CE3 3.84Å; F270-W461 HydrophobicContact CE2-CE3 4.12Å; F270-W461 HydrophobicContact CG-CE3 4.46Å; F270-W461 HydrophobicContact CZ-CB 4.11Å; F270-W461 AromaticContact CZ-CE3 3.81Å; F270-W461 HydrophobicContact CZ-CE3 3.81Å; F270-W461 WeakPolarHBondContact CZ-O 3.15Å; F270-M464 HydrophobicContact CE2-CB 4.42Å; F270-F465 HydrophobicContact CE2-CB 3.97Å; F270-F465 HydrophobicContact CE2-CD2 4.41Å; F270-F465 HydrophobicContact CZ-CB 3.81Å; F270-F465 HydrophobicContact CZ-CD2 4.38Å; F270-F465 HydrophobicContact CZ-CG 4.5Å
271	L	93.6	Very high	93	Very high	29 Å²	29	54.9 Å²	54.9	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-54.1	173.9	174.9	57.3	0	0	0	110.9	L267 F268 C269 R273 G274 L275 L349 L352 V353	L267-L271 WeakPolarHBondContact O-CB 3.33Å; L267-L271 PolarHBondContact O-N 3Å; F268-L271 WeakPolarHBondContact O-CB 3.25Å; F268-L271 PolarHBondContact O-N 3.1Å; C269-L271 VanDerWaalsContact C-N 3.32Å; L271-R273 VanDerWaalsContact C-N 3.29Å; L271-R273 PolarHBondContact O-N 3.09Å; L271-G274 PolarHBondContact O-N 3.26Å; L271-L275 HydrophobicContact CD1-CD1 3.74Å; L271-L275 HydrophobicContact CD1-CD2 4.5Å; L271-L275 HydrophobicContact CD1-CG 3.91Å; L271-L275 HydrophobicContact CG-CD1 4.08Å; L271-L275 WeakPolarHBondContact O-CG 3.05Å; L271-L275 PolarHBondContact O-N 3.41Å; L271-L349 HydrophobicContact CD2-CD1 3.77Å; L271-L352 HydrophobicContact CD1-CD2 3.07Å; L271-L352 HydrophobicContact CG-CD2 4.42Å; L271-V353 HydrophobicContact CB-CG2 3.79Å; L271-V353 HydrophobicContact CD1-CG2 4.41Å
272	V	94.1	Very high	92.9	Very high	67 Å²	67	54 Å²	54	41%	0.406	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-46.2	178.6	174.5	0	0	0	0	110	F268 C269 M276	F268-V272 HydrophobicContact CD1-CG2 4.46Å; F268-V272 HydrophobicContact CE1-CG2 4.03Å; F268-V272 HydrophobicContact CE2-CG2 4.37Å; F268-V272 HydrophobicContact CZ-CG2 3.98Å; F268-V272 WeakPolarHBondContact O-CG2 3.35Å; F268-V272 PolarHBondContact O-N 3.49Å; C269-V272 PolarHBondContact O-N 2.85Å; V272-M276 WeakPolarHBondContact O-CG 3.17Å; V272-M276 PolarHBondContact O-N 3.15Å
273	R	92.4	Very high	92.7	Very high	51 Å²	51	52.1 Å²	52.1	19%	0.192	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-45.3	178	179.3	60.9	-169.9	134.7	1.7	112.2	C269 L271 M276 L277 F455 W461	C269-R273 WeakPolarHBondContact O-CB 3.34Å; C269-R273 PolarHBondContact O-N 3.29Å; L271-R273 VanDerWaalsContact C-N 3.29Å; L271-R273 PolarHBondContact O-N 3.09Å; R273-M276 PolarHBondContact O-N 3.35Å; R273-L277 VanDerWaalsContact NH2-CD2 3.28Å; R273-L277 WeakPolarHBondContact O-CG 3.38Å; R273-L277 PolarHBondContact O-N 3.36Å; R273-F455 HydrophobicContact CG-CD2 4.36Å; R273-F455 HydrophobicContact CG-CE2 4.16Å; R273-W461 HydrophobicContact CB-CH2 3.48Å; R273-W461 VanDerWaalsContact CB-CH2 3.48Å; R273-W461 HydrophobicContact CB-CZ2 3.95Å; R273-W461 HydrophobicContact CB-CZ3 3.89Å; R273-W461 HydrophobicContact CG-CH2 3.69Å; R273-W461 HydrophobicContact CG-CZ2 3.62Å; R273-W461 HydrophobicContact CG-CZ3 4.16Å
274	G	90.1	Very high	92.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-46.6	-179.1	0	0	0	0	0	112	F270 L271 M276 L277 S280	F270-G274 WeakPolarHBondContact O-CA 3.33Å; F270-G274 PolarHBondContact O-N 3.13Å; L271-G274 PolarHBondContact O-N 3.26Å; G274-M276 PolarHBondContact O-N 3.29Å; G274-L277 WeakPolarHBondContact O-CB 3.36Å; G274-L277 PolarHBondContact O-N 2.92Å; G274-S280 WeakPolarHBondContact O-CB 3.46Å; G274-S280 PolarHBondContact O-OG 3.43Å
275	L	92.1	Very high	92.5	Very high	91 Å²	91	53 Å²	53	48%	0.476	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-23.2	177.7	-66.6	174.4	0	0	0	113.6	L271 L277 I284	L271-L275 HydrophobicContact CD1-CD1 3.74Å; L271-L275 HydrophobicContact CD1-CD2 4.5Å; L271-L275 HydrophobicContact CD1-CG 3.91Å; L271-L275 HydrophobicContact CG-CD1 4.08Å; L271-L275 WeakPolarHBondContact O-CG 3.05Å; L271-L275 PolarHBondContact O-N 3.41Å; L275-L277 VanDerWaalsContact C-N 3.3Å; L275-I284 HydrophobicContact CD2-CD1 3.52Å
276	M	92.1	Very high	92.2	Very high	143 Å²	143	49.9 Å²	49.9	70%	0.704	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.8	174.3	-66.8	-173	88.4	0	0	113.5	V272 R273 G274	V272-M276 WeakPolarHBondContact O-CG 3.17Å; V272-M276 PolarHBondContact O-N 3.15Å; R273-M276 PolarHBondContact O-N 3.35Å; G274-M276 PolarHBondContact O-N 3.29Å
277	L	90.6	Very high	92	Very high	14 Å²	14	49.9 Å²	49.9	7%	0.073	26%	0.264	C	S	.	.	S	Bend	trans	-84.9	143.1	178	-62.2	165.6	0	0	0	110.9	R273 G274 L275 S280 F360 F455	R273-L277 VanDerWaalsContact NH2-CD2 3.28Å; R273-L277 WeakPolarHBondContact O-CG 3.38Å; R273-L277 PolarHBondContact O-N 3.36Å; G274-L277 WeakPolarHBondContact O-CB 3.36Å; G274-L277 PolarHBondContact O-N 2.92Å; L275-L277 VanDerWaalsContact C-N 3.3Å; L277-S280 WeakPolarHBondContact O-CB 3.35Å; L277-S280 PolarHBondContact O-N 3.14Å; L277-S280 PolarHBondContact O-OG 3.05Å; L277-F360 HydrophobicContact CB-CB 3.98Å; L277-F360 HydrophobicContact CB-CD2 3.72Å; L277-F360 HydrophobicContact CB-CE2 4.41Å; L277-F360 HydrophobicContact CB-CG 3.92Å; L277-F360 HydrophobicContact CD1-CB 4Å; L277-F360 HydrophobicContact CD1-CD1 3.94Å; L277-F360 HydrophobicContact CD1-CD2 4.27Å; L277-F360 HydrophobicContact CD1-CE1 4.48Å; L277-F360 HydrophobicContact CD1-CG 3.79Å; L277-F360 HydrophobicContact CD2-CD2 4.12Å; L277-F360 HydrophobicContact CD2-CE2 4.02Å; L277-F360 HydrophobicContact CD2-CG 4.42Å; L277-F360 HydrophobicContact CD2-CZ 4.23Å; L277-F360 HydrophobicContact CG-CD2 4.25Å; L277-F360 HydrophobicContact CG-CG 4.26Å; L277-F455 HydrophobicContact CD1-CD1 4.22Å; L277-F455 HydrophobicContact CD1-CE1 3.25Å; L277-F455 HydrophobicContact CD1-CE2 4.48Å; L277-F455 HydrophobicContact CD1-CZ 3.41Å; L277-F455 VanDerWaalsContact CD1-CZ 3.41Å; L277-F455 HydrophobicContact CD2-CD1 4.23Å; L277-F455 HydrophobicContact CD2-CE1 4.03Å; L277-F455 HydrophobicContact CG-CE1 4.27Å
278	K	89.2	Confident	91.8	Very high	184 Å²	184	54.7 Å²	54.7	80%	0.8	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	137.4	173.2	-64.3	-176	177.7	-177.4	0	109.9	S280 F360	K278-S280 VanDerWaalsContact C-N 3.27Å; K278-S280 PolarHBondContact O-N 3.07Å; K278-F360 WeakPolarHBondContact O-CD2 3.27Å
279	G	88.4	Confident	91.6	Very high	19 Å²	19	52.4 Å²	52.4	20%	0.196	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-0.5	179.6	0	0	0	0	0	115.8	V281 D282 G359 N363	G279-V281 VanDerWaalsContact C-N 3.28Å; G279-V281 PolarHBondContact O-N 3.36Å; G279-D282 PolarHBondContact O-N 3.33Å; G279-G359 CarbonylContact O-C 2.97Å; G279-G359 WeakPolarHBondContact O-CA 3.45Å; G279-N363 WeakPolarHBondContact CA-ND2 3.47Å; G279-N363 PolarHBondContact O-ND2 2.72Å
280	S	90.7	Very high	91.3	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-34	176.8	56.4	0	0	0	0	113	G274 L277 K278 D282 G283 I284 A356	G274-S280 WeakPolarHBondContact O-CB 3.46Å; G274-S280 PolarHBondContact O-OG 3.43Å; L277-S280 WeakPolarHBondContact O-CB 3.35Å; L277-S280 PolarHBondContact O-N 3.14Å; L277-S280 PolarHBondContact O-OG 3.05Å; K278-S280 VanDerWaalsContact C-N 3.27Å; K278-S280 PolarHBondContact O-N 3.07Å; S280-D282 VanDerWaalsContact C-N 3.32Å; S280-D282 PolarHBondContact O-N 2.7Å; S280-G283 PolarHBondContact O-N 3.45Å; S280-I284 WeakPolarHBondContact O-CG1 3.19Å; S280-I284 PolarHBondContact O-N 2.78Å; S280-A356 WeakPolarHBondContact CA-O 3.31Å
281	V	92.4	Very high	91.1	Very high	100 Å²	100	57.7 Å²	57.7	61%	0.606	31%	0.307	S	S	*	.	H	α-helix	trans	-64.8	-35	179	-179.5	0	0	0	0	111.6	G279 G283 I284 A285	G279-V281 VanDerWaalsContact C-N 3.28Å; G279-V281 PolarHBondContact O-N 3.36Å; V281-G283 VanDerWaalsContact C-N 3.34Å; V281-G283 PolarHBondContact O-N 2.95Å; V281-I284 PolarHBondContact O-N 3.47Å; V281-A285 VanDerWaalsContact O-CB 3.29Å; V281-A285 WeakPolarHBondContact O-CB 3.48Å; V281-A285 PolarHBondContact O-N 3.4Å
282	D	91.8	Very high	90.9	Very high	68 Å²	68	61.4 Å²	61.4	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-40.2	179.7	-56.1	-41.8	0	0	0	111.3	G279 S280 A285 H286 N363 L430	G279-D282 PolarHBondContact O-N 3.33Å; S280-D282 VanDerWaalsContact C-N 3.32Å; S280-D282 PolarHBondContact O-N 2.7Å; D282-A285 PolarHBondContact O-N 2.84Å; D282-H286 WeakPolarHBondContact O-CB 3.29Å; D282-H286 PolarHBondContact O-N 3.44Å; D282-N363 PolarHBondContact OD2-ND2 3.3Å; D282-L430 HydrophobicContact CB-CD2 4.35Å
283	G	91.8	Very high	90.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.6	-41.8	174.3	0	0	0	0	0	112.6	S280 V281 H286 M287 F355	S280-G283 PolarHBondContact O-N 3.45Å; V281-G283 VanDerWaalsContact C-N 3.34Å; V281-G283 PolarHBondContact O-N 2.95Å; G283-H286 PolarHBondContact O-N 2.84Å; G283-M287 PolarHBondContact O-N 2.95Å; G283-F355 WeakPolarHBondContact CA-O 3.48Å; G283-F355 WeakPolarHBondContact O-CD1 3.41Å
284	I	92.8	Very high	90.5	Very high	27 Å²	27	67.2 Å²	67.2	14%	0.138	35%	0.35	C	S	.	.	H	α-helix	trans	-66.1	-40.7	175.3	-63.5	169.9	0	0	0	110.9	L275 S280 V281 H286 M287 F288 L352 A356	L275-I284 HydrophobicContact CD2-CD1 3.52Å; S280-I284 WeakPolarHBondContact O-CG1 3.19Å; S280-I284 PolarHBondContact O-N 2.78Å; V281-I284 PolarHBondContact O-N 3.47Å; I284-H286 VanDerWaalsContact C-N 3.32Å; I284-H286 PolarHBondContact O-N 3.24Å; I284-M287 VanDerWaalsContact O-CB 3.32Å; I284-M287 WeakPolarHBondContact O-CB 3.34Å; I284-M287 PolarHBondContact O-N 3.49Å; I284-F288 HydrophobicContact CG2-CD2 3.88Å; I284-F288 HydrophobicContact CG2-CE2 3.94Å; I284-F288 WeakPolarHBondContact O-CD2 3.38Å; I284-F288 PolarHBondContact O-N 3.5Å; I284-F288 VanDerWaalsContact O-N 3.09Å; I284-L352 HydrophobicContact CD1-CD2 4.33Å; I284-A356 HydrophobicContact CD1-CB 4.05Å; I284-A356 HydrophobicContact CG1-CB 4.16Å
285	A	92.3	Very high	90.5	Very high	51 Å²	51	69.3 Å²	69.3	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-42.2	175.7	0	0	0	0	0	110.8	V281 D282 M287 F288 T289	V281-A285 VanDerWaalsContact O-CB 3.29Å; V281-A285 WeakPolarHBondContact O-CB 3.48Å; V281-A285 PolarHBondContact O-N 3.4Å; D282-A285 PolarHBondContact O-N 2.84Å; A285-M287 VanDerWaalsContact C-N 3.34Å; A285-M287 PolarHBondContact O-N 3.22Å; A285-F288 PolarHBondContact O-N 2.98Å; A285-T289 PolarHBondContact O-N 3.28Å; A285-T289 PolarHBondContact O-OG1 3.34Å
286	H	89.3	Confident	90.3	Very high	17 Å²	17	72.2 Å²	72.2	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-41.1	173.7	-173.3	96.7	0	0	0	111.6	D282 G283 I284 F288 T289 E431 L434 N435	D282-H286 WeakPolarHBondContact O-CB 3.29Å; D282-H286 PolarHBondContact O-N 3.44Å; G283-H286 PolarHBondContact O-N 2.84Å; I284-H286 VanDerWaalsContact C-N 3.32Å; I284-H286 PolarHBondContact O-N 3.24Å; H286-F288 VanDerWaalsContact C-N 3.31Å; H286-F288 PolarHBondContact O-N 2.74Å; H286-T289 PolarHBondContact O-N 3.5Å; H286-E431 IonicContact CE1-OE1 3.36Å; H286-E431 PolarHBondContact CE1-OE1 3.05Å; H286-E431 IonicContact CE1-OE2 3.67Å; H286-E431 IonicContact ND1-OE1 3.29Å; H286-E431 PolarHBondContact ND1-OE1 3.29Å; H286-E431 IonicContact ND1-OE2 3.29Å; H286-E431 PolarHBondContact ND1-OE2 3.44Å; H286-L434 HydrophobicContact CB-CD1 4.4Å; H286-N435 PolarHBondContact CE1-OD1 3.2Å
287	M	90.6	Very high	90.2	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-56.8	-43	173	-177.5	-170.9	162	0	0	112	G98 G99 L102 G283 I284 A285 T351 F355	G98-M287 CarbonylContact C-O 3.22Å; G99-M287 WeakPolarHBondContact CA-O 3.29Å; G99-M287 PolarHBondContact N-O 3.41Å; L102-M287 HydrophobicContact CD1-CE 4.15Å; G283-M287 PolarHBondContact O-N 2.95Å; I284-M287 VanDerWaalsContact O-CB 3.32Å; I284-M287 WeakPolarHBondContact O-CB 3.34Å; I284-M287 PolarHBondContact O-N 3.49Å; A285-M287 VanDerWaalsContact C-N 3.34Å; A285-M287 PolarHBondContact O-N 3.22Å; M287-T351 HydrophobicContact CE-CG2 3.55Å; M287-T351 HydrophobicContact CG-CG2 4.25Å; M287-T351 HydrophobicContact SD-CG2 3.7Å; M287-F355 HydrophobicContact CB-CB 4.06Å; M287-F355 HydrophobicContact CB-CD1 3.66Å; M287-F355 HydrophobicContact CB-CD2 4.13Å; M287-F355 HydrophobicContact CB-CE1 4.03Å; M287-F355 HydrophobicContact CB-CE2 4.46Å; M287-F355 HydrophobicContact CB-CG 3.68Å; M287-F355 HydrophobicContact CB-CZ 4.39Å; M287-F355 HydrophobicContact CG-CD1 4.4Å; M287-F355 HydrophobicContact CG-CD2 4.03Å; M287-F355 HydrophobicContact CG-CE2 4.21Å; M287-F355 HydrophobicContact CG-CG 4.1Å; M287-F355 HydrophobicContact CG-CZ 4.45Å; M287-F355 HydrophobicContact SD-CB 4.43Å; M287-F355 HydrophobicContact SD-CD2 4.19Å; M287-F355 HydrophobicContact SD-CG 4.39Å
288	F	90.9	Very high	90	Very high	107 Å²	107	72.5 Å²	72.5	47%	0.469	38%	0.383	S	S	.	.	H	α-helix	trans	-90.3	-0.8	-175.9	-74.7	-68.4	0	0	0	114.7	I284 A285 H286 P290	I284-F288 HydrophobicContact CG2-CD2 3.88Å; I284-F288 HydrophobicContact CG2-CE2 3.94Å; I284-F288 WeakPolarHBondContact O-CD2 3.38Å; I284-F288 PolarHBondContact O-N 3.5Å; I284-F288 VanDerWaalsContact O-N 3.09Å; A285-F288 PolarHBondContact O-N 2.98Å; H286-F288 VanDerWaalsContact C-N 3.31Å; H286-F288 PolarHBondContact O-N 2.74Å; F288-P290 WeakPolarHBondContact O-CD 2.93Å
289	T	89.8	Confident	89.9	Confident	81 Å²	81	66.6 Å²	66.6	50%	0.497	36%	0.358	S	S	.	.	S	Bend	trans	-82.9	104.9	176.5	-60.3	0	0	0	0	109.5	A285 H286 K291	A285-T289 PolarHBondContact O-N 3.28Å; A285-T289 PolarHBondContact O-OG1 3.34Å; H286-T289 PolarHBondContact O-N 3.5Å; T289-K291 PolarHBondContact O-N 2.84Å
290	P	89.5	Confident	90.1	Very high	72 Å²	72	65.7 Å²	65.7	47%	0.468	35%	0.349	S	S	.	.			trans	-84.2	119	-168.7	32.7	-29.7	0	0	0	111.2	A100 F288 L292	A100-P290 HydrophobicContact CB-CB 4.22Å; F288-P290 WeakPolarHBondContact O-CD 2.93Å; P290-L292 HydrophobicContact CB-CD2 4.05Å; P290-L292 PolarHBondContact O-N 2.8Å
291	K	88.9	Confident	90.1	Very high	87 Å²	87	69.8 Å²	69.8	38%	0.378	36%	0.364	S	S	.	.			trans	-87.1	79	171.1	-62.2	178.2	-177.7	172.5	0	109.6	G97 T289 E293 K294 E431 N435	G97-K291 PolarHBondContact O-N 3.09Å; G97-K291 VanDerWaalsContact O-N 3.16Å; T289-K291 PolarHBondContact O-N 2.84Å; K291-E293 PolarHBondContact O-N 2.91Å; K291-E293 VanDerWaalsContact O-N 3.12Å; K291-K294 HydrophobicContact CB-CG 4.39Å; K291-K294 WeakPolarHBondContact O-CB 3.42Å; K291-K294 PolarHBondContact O-N 3.49Å; K291-E431 IonicContact NZ-OE1 2.92Å; K291-N435 PolarHBondContact NZ-OD1 2.9Å
292	L	88.7	Confident	90	Very high	107 Å²	107	66.1 Å²	66.1	56%	0.56	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-58.5	-27.9	-170.4	-60.7	177.1	0	0	0	114.2	P290 K294 M295	P290-L292 HydrophobicContact CB-CD2 4.05Å; P290-L292 PolarHBondContact O-N 2.8Å; L292-K294 PolarHBondContact O-N 2.99Å; L292-M295 HydrophobicContact CB-CE 4.02Å; L292-M295 HydrophobicContact CD2-CE 3.39Å; L292-M295 HydrophobicContact CD2-SD 4.37Å; L292-M295 HydrophobicContact CG-CE 4.28Å; L292-M295 WeakPolarHBondContact O-CB 3.36Å; L292-M295 PolarHBondContact O-N 3.47Å; L292-M295 VanDerWaalsContact O-N 3.07Å
293	E	90.6	Very high	89.9	Confident	166 Å²	166	64 Å²	64	78%	0.776	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-57.5	-33.3	176.8	-61.8	-179.7	178.1	0	0	112.2	K291 M295 L296	K291-E293 PolarHBondContact O-N 2.91Å; K291-E293 VanDerWaalsContact O-N 3.12Å; E293-M295 VanDerWaalsContact C-N 3.27Å; E293-M295 PolarHBondContact O-N 3Å; E293-L296 WeakPolarHBondContact O-CB 3.48Å; E293-L296 PolarHBondContact O-N 3.25Å
294	K	88.1	Confident	89.9	Confident	74 Å²	74	64 Å²	64	32%	0.322	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-65.1	-27.1	177.8	-71.8	-61.9	-171	178.6	0	113.4	K291 L292 L296 E297 V300	K291-K294 HydrophobicContact CB-CG 4.39Å; K291-K294 WeakPolarHBondContact O-CB 3.42Å; K291-K294 PolarHBondContact O-N 3.49Å; L292-K294 PolarHBondContact O-N 2.99Å; K294-L296 PolarHBondContact O-N 3.46Å; K294-E297 VanDerWaalsContact CD-OE1 3.26Å; K294-E297 WeakPolarHBondContact CD-OE1 3.41Å; K294-E297 IonicContact NZ-OE1 2.76Å; K294-E297 PolarHBondContact NZ-OE1 3.18Å; K294-E297 IonicContact NZ-OE2 2.81Å; K294-E297 PolarHBondContact NZ-OE2 3.36Å; K294-E297 WeakPolarHBondContact O-CB 3.21Å; K294-E297 PolarHBondContact O-N 3.44Å; K294-E297 VanDerWaalsContact O-N 3.12Å; K294-V300 WeakPolarHBondContact O-CG2 3.26Å
295	M	89.2	Confident	89.9	Confident	44 Å²	44	62.8 Å²	62.8	22%	0.217	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-69.6	-14.9	179.8	-60	-171.6	-58	0	0	113.6	A100 V103 P104 L292 E293 E297 W301	A100-M295 HydrophobicContact CB-CG 3.92Å; A100-M295 HydrophobicContact CB-SD 4.14Å; V103-M295 HydrophobicContact CB-SD 4.38Å; P104-M295 HydrophobicContact CG-CG 4.34Å; P104-M295 HydrophobicContact CG-SD 4.36Å; L292-M295 HydrophobicContact CB-CE 4.02Å; L292-M295 HydrophobicContact CD2-CE 3.39Å; L292-M295 HydrophobicContact CD2-SD 4.37Å; L292-M295 HydrophobicContact CG-CE 4.28Å; L292-M295 WeakPolarHBondContact O-CB 3.36Å; L292-M295 PolarHBondContact O-N 3.47Å; L292-M295 VanDerWaalsContact O-N 3.07Å; E293-M295 VanDerWaalsContact C-N 3.27Å; E293-M295 PolarHBondContact O-N 3Å; M295-E297 VanDerWaalsContact C-N 3.27Å; M295-W301 PolarHBondContact O-NE1 3.27Å
296	L	89.8	Confident	89.7	Confident	152 Å²	152	61.3 Å²	61.3	80%	0.796	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-75.7	-19.6	174.8	-63.5	171.5	0	0	0	112	E293 K294 P298	E293-L296 WeakPolarHBondContact O-CB 3.48Å; E293-L296 PolarHBondContact O-N 3.25Å; K294-L296 PolarHBondContact O-N 3.46Å; L296-P298 WeakPolarHBondContact O-CD 3.28Å
297	E	89.1	Confident	89.9	Confident	69 Å²	69	60.6 Å²	60.6	32%	0.322	30%	0.303	S	S	.	.	S	Bend	trans	-75.1	121.7	179.1	-62.8	175.4	-169.3	0	0	109.7	K294 M295 Q299 V300	K294-E297 VanDerWaalsContact CD-OE1 3.26Å; K294-E297 WeakPolarHBondContact CD-OE1 3.41Å; K294-E297 IonicContact NZ-OE1 2.76Å; K294-E297 PolarHBondContact NZ-OE1 3.18Å; K294-E297 IonicContact NZ-OE2 2.81Å; K294-E297 PolarHBondContact NZ-OE2 3.36Å; K294-E297 WeakPolarHBondContact O-CB 3.21Å; K294-E297 PolarHBondContact O-N 3.44Å; K294-E297 VanDerWaalsContact O-N 3.12Å; M295-E297 VanDerWaalsContact C-N 3.27Å; E297-Q299 PolarHBondContact O-N 3.38Å; E297-Q299 VanDerWaalsContact O-N 3.08Å; E297-V300 HydrophobicContact CB-CG2 4.27Å; E297-V300 PolarHBondContact O-N 3.1Å
298	P	86.9	Confident	90	Very high	94 Å²	94	60.6 Å²	60.6	61%	0.61	30%	0.303	S	S	*	.	H	α-helix	trans	-58.3	-25.8	179.3	-26.4	35.3	0	0	0	113.9	L296 V300 W301 R302	L296-P298 WeakPolarHBondContact O-CD 3.28Å; P298-V300 VanDerWaalsContact C-N 3.29Å; P298-V300 PolarHBondContact O-N 3.32Å; P298-W301 PolarHBondContact O-N 3.23Å; P298-R302 PolarHBondContact O-N 2.92Å
299	Q	87.1	Confident	90.1	Very high	60 Å²	60	55.6 Å²	55.6	28%	0.28	28%	0.281	S	S	.	.	H	α-helix	trans	-56.1	-41.3	175.1	166.6	160	22.2	0	0	112.4	E297 W301 R302 E303	E297-Q299 PolarHBondContact O-N 3.38Å; E297-Q299 VanDerWaalsContact O-N 3.08Å; Q299-W301 VanDerWaalsContact C-N 3.35Å; Q299-W301 PolarHBondContact O-N 3.39Å; Q299-R302 PolarHBondContact O-N 3.44Å; Q299-E303 HydrophobicContact CG-CG 4.32Å; Q299-E303 PolarHBondContact NE2-OE1 3.46Å; Q299-E303 WeakPolarHBondContact O-CB 3.4Å; Q299-E303 WeakPolarHBondContact O-CG 3.29Å; Q299-E303 PolarHBondContact O-N 3.35Å
300	V	91.8	Very high	90.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-43.2	-178	175.4	0	0	0	0	111.3	N96 Y101 P104 K294 E297 P298 A304	N96-V300 HydrophobicContact CB-CG1 4.04Å; N96-V300 HydrophobicContact CB-CG2 3.9Å; Y101-V300 HydrophobicContact CD2-CG1 4.14Å; P104-V300 HydrophobicContact CG-CG1 4.2Å; K294-V300 WeakPolarHBondContact O-CG2 3.26Å; E297-V300 HydrophobicContact CB-CG2 4.27Å; E297-V300 PolarHBondContact O-N 3.1Å; P298-V300 VanDerWaalsContact C-N 3.29Å; P298-V300 PolarHBondContact O-N 3.32Å; V300-A304 VanDerWaalsContact O-CB 3.26Å; V300-A304 WeakPolarHBondContact O-CB 3.16Å; V300-A304 PolarHBondContact O-N 3.11Å
301	W	91.9	Very high	90.2	Very high	90 Å²	90	49.4 Å²	49.4	34%	0.341	24%	0.241	S	C	.	.	H	α-helix	trans	-69.1	-38.7	179.3	-69.7	86.7	0	0	0	112.5	P104 I107 L108 M295 P298 Q299 A304 A305	P104-W301 HydrophobicContact CB-CD2 3.96Å; P104-W301 HydrophobicContact CB-CE3 3.87Å; P104-W301 HydrophobicContact CB-CH2 4.13Å; P104-W301 HydrophobicContact CB-CZ2 4.21Å; P104-W301 HydrophobicContact CB-CZ3 3.95Å; P104-W301 HydrophobicContact CG-CD2 4.41Å; P104-W301 HydrophobicContact CG-CH2 4.33Å; P104-W301 HydrophobicContact CG-CZ2 4.04Å; I107-W301 HydrophobicContact CB-CZ3 4.44Å; I107-W301 HydrophobicContact CD1-CH2 4.05Å; I107-W301 HydrophobicContact CG2-CZ3 4.21Å; L108-W301 HydrophobicContact CD1-CE3 4.08Å; L108-W301 WeakPolarHBondContact CD1-O 3.44Å; L108-W301 HydrophobicContact CD2-CE3 4.45Å; L108-W301 HydrophobicContact CG-CE3 4.21Å; L108-W301 HydrophobicContact CG-CZ3 4.39Å; M295-W301 PolarHBondContact O-NE1 3.27Å; P298-W301 PolarHBondContact O-N 3.23Å; Q299-W301 VanDerWaalsContact C-N 3.35Å; Q299-W301 PolarHBondContact O-N 3.39Å; W301-A304 PolarHBondContact O-N 3.27Å; W301-A305 WeakPolarHBondContact O-CB 3.32Å; W301-A305 PolarHBondContact O-N 3.21Å
302	R	89.1	Confident	90.5	Very high	22 Å²	22	45.3 Å²	45.3	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-44.8	176.3	-174.5	-162.4	62.3	-110.2	-7.7	111.7	P298 Q299 A304 A305 T306 T590 E593	P298-R302 PolarHBondContact O-N 2.92Å; Q299-R302 PolarHBondContact O-N 3.44Å; R302-A304 VanDerWaalsContact C-N 3.33Å; R302-A305 PolarHBondContact O-N 3.37Å; R302-T306 WeakPolarHBondContact O-CB 3.44Å; R302-T306 PolarHBondContact O-N 3.3Å; R302-T306 PolarHBondContact O-OG1 3.07Å; R302-T590 VanDerWaalsContact CD-OG1 3.26Å; R302-T590 WeakPolarHBondContact CD-OG1 3.5Å; R302-T590 WeakPolarHBondContact CG-OG1 3.47Å; R302-E593 IonicContact CZ-OE1 3.23Å; R302-E593 IonicContact CZ-OE2 3.87Å; R302-E593 IonicContact NE-OE2 3.06Å; R302-E593 PolarHBondContact NE-OE2 2.96Å; R302-E593 IonicContact NH1-OE1 2.67Å; R302-E593 PolarHBondContact NH1-OE1 3.33Å; R302-E593 IonicContact NH1-OE2 3.15Å; R302-E593 PolarHBondContact NH1-OE2 3.01Å; R302-E593 IonicContact NH2-OE1 3.4Å; R302-E593 PolarHBondContact NH2-OE1 3.39Å; R302-E593 IonicContact NH2-OE2 3.76Å; R302-E593 PolarHBondContact NH2-OE2 3.06Å
303	E	89.5	Confident	90.6	Very high	25 Å²	25	40.3 Å²	40.3	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-38.7	176.5	-72.2	-176.5	-176.2	0	0	111.1	L92 K95 N96 Q299 Q307	L92-E303 HydrophobicContact CD2-CB 4.3Å; L92-E303 VanDerWaalsContact CD2-OE2 3.3Å; L92-E303 WeakPolarHBondContact CD2-OE2 3.26Å; K95-E303 IonicContact NZ-OE1 3.4Å; K95-E303 PolarHBondContact NZ-OE1 3.3Å; K95-E303 IonicContact NZ-OE2 3.97Å; N96-E303 PolarHBondContact ND2-OE2 3.46Å; N96-E303 PolarHBondContact OD1-OE2 3Å; Q299-E303 HydrophobicContact CG-CG 4.32Å; Q299-E303 PolarHBondContact NE2-OE1 3.46Å; Q299-E303 WeakPolarHBondContact O-CB 3.4Å; Q299-E303 WeakPolarHBondContact O-CG 3.29Å; Q299-E303 PolarHBondContact O-N 3.35Å; E303-Q307 WeakPolarHBondContact O-CB 3.47Å; E303-Q307 PolarHBondContact O-N 3.33Å
304	A	93	Very high	90.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-45.2	173.3	0	0	0	0	0	112.7	Y101 P104 L108 V300 W301 R302 Q307 V308	Y101-A304 HydrophobicContact CE2-CB 3.83Å; P104-A304 HydrophobicContact CB-CB 4.21Å; L108-A304 HydrophobicContact CD1-CB 3.77Å; V300-A304 VanDerWaalsContact O-CB 3.26Å; V300-A304 WeakPolarHBondContact O-CB 3.16Å; V300-A304 PolarHBondContact O-N 3.11Å; W301-A304 PolarHBondContact O-N 3.27Å; R302-A304 VanDerWaalsContact C-N 3.33Å; A304-Q307 WeakPolarHBondContact O-CB 3.46Å; A304-Q307 PolarHBondContact O-N 3.05Å; A304-V308 WeakPolarHBondContact O-CG2 3.16Å; A304-V308 PolarHBondContact O-N 3.29Å
305	A	91.7	Very high	90.9	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-45.9	177.6	0	0	0	0	0	112.1	L108 I112 W301 R302 Q307 V308 F309 L586	L108-A305 HydrophobicContact CD1-CB 3.9Å; I112-A305 HydrophobicContact CD1-CB 4.26Å; W301-A305 WeakPolarHBondContact O-CB 3.32Å; W301-A305 PolarHBondContact O-N 3.21Å; R302-A305 PolarHBondContact O-N 3.37Å; A305-Q307 VanDerWaalsContact C-N 3.27Å; A305-Q307 PolarHBondContact O-N 3.11Å; A305-V308 WeakPolarHBondContact O-CB 3.42Å; A305-V308 PolarHBondContact O-N 3.17Å; A305-F309 WeakPolarHBondContact O-CG 3.46Å; A305-F309 PolarHBondContact O-N 3.33Å; A305-L586 HydrophobicContact CB-CD1 3.43Å; A305-L586 VanDerWaalsContact CB-CD1 3.43Å; A305-L586 HydrophobicContact CB-CD2 3.61Å; A305-L586 HydrophobicContact CB-CG 4.16Å
306	T	88.6	Confident	91	Very high	19 Å²	19	27.1 Å²	27.1	12%	0.117	14%	0.136	C	C	.	.	H	α-helix	trans	-57.4	-44.7	176.2	-56	0	0	0	0	110.1	R302 V308 F309 F310	R302-T306 WeakPolarHBondContact O-CB 3.44Å; R302-T306 PolarHBondContact O-N 3.3Å; R302-T306 PolarHBondContact O-OG1 3.07Å; T306-V308 VanDerWaalsContact C-N 3.33Å; T306-V308 PolarHBondContact O-N 3.33Å; T306-F309 PolarHBondContact O-N 2.98Å; T306-F310 HydrophobicContact CG2-CD2 3.65Å; T306-F310 HydrophobicContact CG2-CE2 3.52Å; T306-F310 VanDerWaalsContact O-CD2 3.28Å; T306-F310 WeakPolarHBondContact O-CD2 3.5Å; T306-F310 PolarHBondContact O-N 3.04Å
307	Q	92.6	Very high	91	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-61.7	-36.8	175.8	-174.6	60.3	28.6	0	0	112.9	R88 F89 L92 Y101 Y105 E303 A304 A305 A311	R88-Q307 VanDerWaalsContact CD-OE1 3.28Å; F89-Q307 HydrophobicContact CD2-CG 3.78Å; L92-Q307 HydrophobicContact CD1-CB 4.06Å; L92-Q307 HydrophobicContact CD1-CG 4.24Å; Y101-Q307 WeakPolarHBondContact OH-CB 3.35Å; Y105-Q307 HydrophobicContact CD2-CB 4.4Å; Y105-Q307 HydrophobicContact CD2-CG 4.25Å; Y105-Q307 HydrophobicContact CE2-CB 4.18Å; Y105-Q307 HydrophobicContact CE2-CG 3.78Å; E303-Q307 WeakPolarHBondContact O-CB 3.47Å; E303-Q307 PolarHBondContact O-N 3.33Å; A304-Q307 WeakPolarHBondContact O-CB 3.46Å; A304-Q307 PolarHBondContact O-N 3.05Å; A305-Q307 VanDerWaalsContact C-N 3.27Å; A305-Q307 PolarHBondContact O-N 3.11Å; Q307-A311 WeakPolarHBondContact O-CB 3.32Å; Q307-A311 PolarHBondContact O-N 3.42Å
308	V	94	Very high	91.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.4	-43.4	173.9	171.9	0	0	0	0	111.1	Y105 L108 L109 A304 A305 T306 A311 L312	Y105-V308 HydrophobicContact CD2-CG2 3.77Å; Y105-V308 HydrophobicContact CE2-CB 4.45Å; Y105-V308 HydrophobicContact CE2-CG2 3.47Å; Y105-V308 VanDerWaalsContact CE2-CG2 3.47Å; L108-V308 HydrophobicContact CB-CG2 4.3Å; L109-V308 HydrophobicContact CB-CG2 4.44Å; L109-V308 HydrophobicContact CD1-CG1 4.35Å; A304-V308 WeakPolarHBondContact O-CG2 3.16Å; A304-V308 PolarHBondContact O-N 3.29Å; A305-V308 WeakPolarHBondContact O-CB 3.42Å; A305-V308 PolarHBondContact O-N 3.17Å; T306-V308 VanDerWaalsContact C-N 3.33Å; T306-V308 PolarHBondContact O-N 3.33Å; V308-A311 PolarHBondContact O-N 2.95Å; V308-L312 HydrophobicContact CG1-CD1 4.21Å; V308-L312 PolarHBondContact O-N 3.47Å
309	F	92.3	Very high	91.5	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.009	5%	0.054	C	C	.	.	H	α-helix	trans	-63.8	-47.1	178.8	-58	-29.5	0	0	0	112.3	I112 A305 T306 G313 L314 T536 L583 L586	I112-F309 HydrophobicContact CD1-CE1 3.79Å; I112-F309 HydrophobicContact CD1-CZ 3.91Å; A305-F309 WeakPolarHBondContact O-CG 3.46Å; A305-F309 PolarHBondContact O-N 3.33Å; T306-F309 PolarHBondContact O-N 2.98Å; F309-G313 WeakPolarHBondContact O-CA 3.26Å; F309-G313 PolarHBondContact O-N 3.3Å; F309-L314 HydrophobicContact CD1-CB 4.31Å; F309-L314 HydrophobicContact CD1-CD1 3.85Å; F309-L314 HydrophobicContact CE1-CD1 4.45Å; F309-L314 PolarHBondContact O-N 2.85Å; F309-T536 HydrophobicContact CE2-CG2 4Å; F309-L583 HydrophobicContact CE1-CD2 4.11Å; F309-L583 HydrophobicContact CE2-CD2 4.3Å; F309-L583 HydrophobicContact CZ-CD2 3.44Å; F309-L583 VanDerWaalsContact CZ-CD2 3.44Å; F309-L586 HydrophobicContact CZ-CD1 4.32Å
310	F	89.6	Confident	91.9	Very high	21 Å²	21	9.2 Å²	9.2	9%	0.092	4%	0.041	C	C	.	.	H	α-helix	trans	-65.3	-40.6	176.8	-82.1	-77.5	0	0	0	112.5	V156 T306 G313 F316 A531 L535	V156-F310 HydrophobicContact CG2-CE1 4.27Å; T306-F310 HydrophobicContact CG2-CD2 3.65Å; T306-F310 HydrophobicContact CG2-CE2 3.52Å; T306-F310 VanDerWaalsContact O-CD2 3.28Å; T306-F310 WeakPolarHBondContact O-CD2 3.5Å; T306-F310 PolarHBondContact O-N 3.04Å; F310-G313 PolarHBondContact O-N 3.28Å; F310-F316 AromaticContact CD1-CZ 3.82Å; F310-F316 HydrophobicContact CD1-CZ 3.82Å; F310-F316 HydrophobicContact CE1-CZ 4.03Å; F310-A531 HydrophobicContact CE1-CB 3.89Å; F310-A531 HydrophobicContact CZ-CB 3.46Å; F310-A531 VanDerWaalsContact CZ-CB 3.46Å; F310-L535 HydrophobicContact CE1-CD1 4.17Å; F310-L535 HydrophobicContact CE2-CD1 4.35Å; F310-L535 HydrophobicContact CZ-CD1 4.09Å
311	A	92.3	Very high	92	Very high	3 Å²	3	9.2 Å²	9.2	3%	0.025	4%	0.041	C	C	.	.	H	α-helix	trans	-72.5	-31	-177.3	0	0	0	0	0	113.3	S80 Q307 V308	S80-A311 CarbonylContact C-O 3.5Å; S80-A311 WeakPolarHBondContact CA-O 3.3Å; S80-A311 VanDerWaalsContact CB-O 3.22Å; S80-A311 WeakPolarHBondContact CB-O 3.42Å; Q307-A311 WeakPolarHBondContact O-CB 3.32Å; Q307-A311 PolarHBondContact O-N 3.42Å; V308-A311 PolarHBondContact O-N 2.95Å
312	L	93.8	Very high	92	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-93.2	-13.9	175.5	-64.8	-178.4	0	0	0	113	L109 F117 V308 L314 N343	L109-L312 HydrophobicContact CD1-CD1 3.82Å; L109-L312 HydrophobicContact CD1-CG 4.47Å; F117-L312 HydrophobicContact CB-CD1 4.18Å; F117-L312 HydrophobicContact CD2-CB 4.08Å; F117-L312 HydrophobicContact CE2-CB 4.5Å; F117-L312 WeakPolarHBondContact CE2-O 3.45Å; F117-L312 HydrophobicContact CG-CD1 4.45Å; V308-L312 HydrophobicContact CG1-CD1 4.21Å; V308-L312 PolarHBondContact O-N 3.47Å; L312-L314 HydrophobicContact CB-CD1 4.25Å; L312-L314 HydrophobicContact CB-CG 3.93Å; L312-L314 HydrophobicContact CD1-CD1 4.32Å; L312-N343 HydrophobicContact CD2-CB 4.31Å
313	G	92.1	Very high	92.3	Very high	2 Å²	2	4 Å²	4	2%	0.021	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	33.4	-176.1	0	0	0	0	0	113.2	F309 F310 F316 V319	F309-G313 WeakPolarHBondContact O-CA 3.26Å; F309-G313 PolarHBondContact O-N 3.3Å; F310-G313 PolarHBondContact O-N 3.28Å; G313-F316 VanDerWaalsContact C-CD2 3.41Å; G313-F316 WeakPolarHBondContact O-CB 3.04Å; G313-F316 WeakPolarHBondContact O-CD2 3.49Å; G313-V319 WeakPolarHBondContact O-CG2 3.1Å
314	L	94.3	Very high	92.5	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.015	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	132.9	-177.3	-65.9	172	0	0	0	111.9	L116 F117 E120 F309 L312 F316 V539	L116-L314 HydrophobicContact CB-CD1 4.25Å; L116-L314 HydrophobicContact CB-CD2 4.22Å; F117-L314 HydrophobicContact CB-CD2 3.89Å; F117-L314 HydrophobicContact CD2-CD2 3.99Å; F117-L314 HydrophobicContact CG-CD2 4.46Å; E120-L314 VanDerWaalsContact OE1-CA 3.29Å; E120-L314 WeakPolarHBondContact OE1-CA 3.42Å; E120-L314 WeakPolarHBondContact OE1-CD2 3.48Å; F309-L314 HydrophobicContact CD1-CB 4.31Å; F309-L314 HydrophobicContact CD1-CD1 3.85Å; F309-L314 HydrophobicContact CE1-CD1 4.45Å; F309-L314 PolarHBondContact O-N 2.85Å; L312-L314 HydrophobicContact CB-CD1 4.25Å; L312-L314 HydrophobicContact CB-CG 3.93Å; L312-L314 HydrophobicContact CD1-CD1 4.32Å; L314-F316 VanDerWaalsContact O-CD2 3.3Å; L314-F316 WeakPolarHBondContact O-CD2 3.35Å; L314-F316 PolarHBondContact O-N 3.47Å; L314-V539 HydrophobicContact CB-CG2 4.06Å
315	G	91.4	Very high	92.4	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	2.3	-178.4	0	0	0	0	0	114.8	E120 S149	E120-G315 PolarHBondContact OE1-N 3.25Å; S149-G315 WeakPolarHBondContact CB-O 3.38Å; S149-G315 PolarHBondContact OG-O 3.07Å
316	F	89.6	Confident	92.4	Very high	7 Å²	7	4.3 Å²	4.3	3%	0.031	2%	0.022	C	C	.	.	S	Bend	trans	-77.9	-28.4	174.6	-74.5	-110.5	0	0	0	110.8	F79 C153 V156 F310 G313 L314 G318 L535	F79-F316 HydrophobicContact CZ-CB 4.23Å; F79-F316 HydrophobicContact CZ-CG 4.5Å; C153-F316 VanDerWaalsContact SG-CB 3.53Å; C153-F316 PolarHBondContact SG-O 2.97Å; V156-F316 HydrophobicContact CB-CE1 4Å; V156-F316 HydrophobicContact CG1-CE1 3.94Å; V156-F316 HydrophobicContact CG2-CE1 3.9Å; V156-F316 HydrophobicContact CG2-CZ 4.3Å; F310-F316 AromaticContact CD1-CZ 3.82Å; F310-F316 HydrophobicContact CD1-CZ 3.82Å; F310-F316 HydrophobicContact CE1-CZ 4.03Å; G313-F316 VanDerWaalsContact C-CD2 3.41Å; G313-F316 WeakPolarHBondContact O-CB 3.04Å; G313-F316 WeakPolarHBondContact O-CD2 3.49Å; L314-F316 VanDerWaalsContact O-CD2 3.3Å; L314-F316 WeakPolarHBondContact O-CD2 3.35Å; L314-F316 PolarHBondContact O-N 3.47Å; F316-G318 PolarHBondContact O-N 2.92Å; F316-L535 HydrophobicContact CD2-CD1 4.35Å; F316-L535 HydrophobicContact CD2-CD2 3.75Å; F316-L535 HydrophobicContact CE2-CD1 3.41Å; F316-L535 VanDerWaalsContact CE2-CD1 3.41Å; F316-L535 HydrophobicContact CE2-CD2 3.65Å; F316-L535 HydrophobicContact CE2-CG 4.19Å; F316-L535 HydrophobicContact CG-CD2 4.41Å; F316-L535 HydrophobicContact CZ-CD1 3.62Å; F316-L535 HydrophobicContact CZ-CD2 4.22Å
317	G	89.9	Confident	92.4	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.046	C	C	.	.	S	Bend	trans	78.1	-2.9	-172.5	0	0	0	0	0	114.4	A321	G317-A321 WeakPolarHBondContact O-CB 3.41Å; G317-A321 PolarHBondContact O-N 3.49Å
318	G	92.1	Very high	92.2	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.7	-40.5	170.1	0	0	0	0	0	112.4	F316 A321 F322	F316-G318 PolarHBondContact O-N 2.92Å; G318-A321 WeakPolarHBondContact O-CB 3.28Å; G318-A321 PolarHBondContact O-N 2.65Å; G318-A321 VanDerWaalsContact O-N 3.17Å; G318-F322 PolarHBondContact O-N 2.93Å
319	V	94.9	Very high	91.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.5	-45.6	175.4	-176.7	0	0	0	0	111.2	F79 F117 E120 L121 G313 A321 F322 S323	F79-V319 HydrophobicContact CD1-CG2 4.27Å; F79-V319 HydrophobicContact CE1-CG2 3.78Å; F117-V319 HydrophobicContact CD2-CG1 3.99Å; F117-V319 HydrophobicContact CD2-CG2 4.28Å; F117-V319 HydrophobicContact CE2-CB 4.33Å; F117-V319 HydrophobicContact CE2-CG1 3.57Å; F117-V319 HydrophobicContact CE2-CG2 3.75Å; F117-V319 HydrophobicContact CZ-CG1 4.25Å; E120-V319 HydrophobicContact CB-CB 4.43Å; E120-V319 HydrophobicContact CB-CG1 4.07Å; L121-V319 HydrophobicContact CD2-CG1 3.4Å; L121-V319 VanDerWaalsContact CD2-CG1 3.4Å; L121-V319 HydrophobicContact CG-CG1 3.64Å; G313-V319 WeakPolarHBondContact O-CG2 3.1Å; V319-A321 VanDerWaalsContact C-N 3.31Å; V319-A321 PolarHBondContact O-N 2.91Å; V319-F322 PolarHBondContact O-N 3.18Å; V319-S323 PolarHBondContact O-N 2.84Å; V319-S323 VanDerWaalsContact O-N 3.08Å; V319-S323 PolarHBondContact O-OG 2.89Å
320	I	95.2	Very high	91.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.9	-42.5	174.3	-59.3	177.9	0	0	0	110.2	E120 V134 W135 S323 S324	E120-I320 HydrophobicContact CB-CG1 3.99Å; E120-I320 HydrophobicContact CG-CD1 4.31Å; E120-I320 HydrophobicContact CG-CG1 4.15Å; V134-I320 HydrophobicContact CB-CG2 4.34Å; V134-I320 HydrophobicContact CG2-CG2 3.71Å; W135-I320 HydrophobicContact CZ2-CD1 4Å; I320-S323 WeakPolarHBondContact CA-OG 3.3Å; I320-S323 PolarHBondContact O-OG 3.22Å; I320-S323 VanDerWaalsContact O-OG 3.05Å; I320-S324 WeakPolarHBondContact O-CB 3.32Å; I320-S324 PolarHBondContact O-N 2.74Å
321	A	93.3	Very high	92.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.3	-45.2	179.7	0	0	0	0	0	112.2	G317 G318 V319 S324 Y325 T482 T486	G317-A321 WeakPolarHBondContact O-CB 3.41Å; G317-A321 PolarHBondContact O-N 3.49Å; G318-A321 WeakPolarHBondContact O-CB 3.28Å; G318-A321 PolarHBondContact O-N 2.65Å; G318-A321 VanDerWaalsContact O-N 3.17Å; V319-A321 VanDerWaalsContact C-N 3.31Å; V319-A321 PolarHBondContact O-N 2.91Å; A321-S324 PolarHBondContact O-N 3.38Å; A321-S324 PolarHBondContact O-OG 3.02Å; A321-Y325 WeakPolarHBondContact O-CD2 3.27Å; A321-Y325 WeakPolarHBondContact O-CE2 3.14Å; A321-T482 HydrophobicContact CB-CG2 3.93Å; A321-T486 HydrophobicContact CB-CG2 4.01Å
322	F	93.8	Very high	92.2	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-65.8	-42.5	178	-73.1	-31.9	0	0	0	113.6	W66 Y72 F79 G318 V319 S324 Y325 I478 G479 T482	W66-F322 HydrophobicContact CH2-CD1 4.09Å; W66-F322 HydrophobicContact CH2-CE1 4.25Å; W66-F322 HydrophobicContact CZ2-CB 4.3Å; W66-F322 AromaticContact CZ2-CD1 3.7Å; W66-F322 HydrophobicContact CZ2-CD1 3.7Å; W66-F322 HydrophobicContact CZ2-CE1 4.32Å; W66-F322 HydrophobicContact CZ2-CG 4.23Å; W66-F322 PolarHBondContact NE1-O 3.33Å; W66-F322 VanDerWaalsContact NE1-O 3.12Å; Y72-F322 HydrophobicContact CE2-CB 4.25Å; F79-F322 HydrophobicContact CB-CE2 3.77Å; F79-F322 HydrophobicContact CD1-CE2 4.3Å; F79-F322 HydrophobicContact CG-CE2 4.09Å; G318-F322 PolarHBondContact O-N 2.93Å; V319-F322 PolarHBondContact O-N 3.18Å; F322-S324 VanDerWaalsContact C-N 3.29Å; F322-S324 PolarHBondContact O-N 3.5Å; F322-Y325 PolarHBondContact O-N 3.22Å; F322-I478 HydrophobicContact CZ-CG2 4.3Å; F322-G479 VanDerWaalsContact CZ-CA 3.44Å; F322-T482 HydrophobicContact CD1-CG2 3.89Å; F322-T482 HydrophobicContact CE1-CG2 3.75Å
323	S	94.4	Very high	92.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.3	-29.8	178.2	53.7	0	0	0	0	112.7	L121 G124 V319 I320 Y325 N326	L121-S323 WeakPolarHBondContact O-CB 3.29Å; L121-S323 PolarHBondContact O-OG 3.36Å; G124-S323 WeakPolarHBondContact CA-OG 3.15Å; V319-S323 PolarHBondContact O-N 2.84Å; V319-S323 VanDerWaalsContact O-N 3.08Å; V319-S323 PolarHBondContact O-OG 2.89Å; I320-S323 WeakPolarHBondContact CA-OG 3.3Å; I320-S323 PolarHBondContact O-OG 3.22Å; I320-S323 VanDerWaalsContact O-OG 3.05Å; S323-Y325 PolarHBondContact O-N 3.15Å; S323-Y325 VanDerWaalsContact O-N 3.15Å; S323-N326 VanDerWaalsContact O-CB 3.27Å; S323-N326 WeakPolarHBondContact O-CB 3.39Å; S323-N326 PolarHBondContact O-N 2.95Å
324	S	93.9	Very high	92.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.9	176.7	77.3	0	0	0	0	114.9	R63 G124 I320 A321 F322	R63-S324 VanDerWaalsContact CZ-OG 3.28Å; R63-S324 PolarHBondContact NE-O 2.95Å; R63-S324 PolarHBondContact NE-OG 3.16Å; R63-S324 PolarHBondContact NH2-OG 3.24Å; G124-S324 WeakPolarHBondContact O-CA 3.35Å; I320-S324 WeakPolarHBondContact O-CB 3.32Å; I320-S324 PolarHBondContact O-N 2.74Å; A321-S324 PolarHBondContact O-N 3.38Å; A321-S324 PolarHBondContact O-OG 3.02Å; F322-S324 VanDerWaalsContact C-N 3.29Å; F322-S324 PolarHBondContact O-N 3.5Å
325	Y	91.4	Very high	92.4	Very high	20 Å²	20	30.5 Å²	30.5	8%	0.078	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-5.3	176.8	-63	-64.2	0	0	0	113	R63 P64 A65 I249 A321 F322 S323 T482 T486	R63-Y325 HydrophobicContact CG-CD1 3.77Å; R63-Y325 HydrophobicContact CG-CE1 3.8Å; R63-Y325 VanDerWaalsContact NE-CD1 3.31Å; R63-Y325 VanDerWaalsContact NE-CE1 3.25Å; P64-Y325 HydrophobicContact CG-CD1 4.12Å; P64-Y325 HydrophobicContact CG-CE1 3.9Å; P64-Y325 WeakPolarHBondContact O-CD1 3.34Å; A65-Y325 WeakPolarHBondContact CA-O 3.48Å; I249-Y325 HydrophobicContact CD1-CD1 3.91Å; I249-Y325 HydrophobicContact CD1-CD2 4.31Å; I249-Y325 HydrophobicContact CD1-CG 3.77Å; I249-Y325 HydrophobicContact CG2-CD2 3.54Å; I249-Y325 HydrophobicContact CG2-CE2 3.67Å; I249-Y325 HydrophobicContact CG2-CG 4.1Å; A321-Y325 WeakPolarHBondContact O-CD2 3.27Å; A321-Y325 WeakPolarHBondContact O-CE2 3.14Å; F322-Y325 PolarHBondContact O-N 3.22Å; S323-Y325 PolarHBondContact O-N 3.15Å; S323-Y325 VanDerWaalsContact O-N 3.15Å; Y325-T482 HydrophobicContact CE2-CG2 4.38Å; Y325-T486 HydrophobicContact CE2-CG2 4.32Å; Y325-T486 WeakPolarHBondContact OH-CG2 3.27Å; Y325-T486 PolarHBondContact OH-OG1 2.7Å
326	N	91.3	Very high	92.6	Very high	14 Å²	14	30.5 Å²	30.5	8%	0.075	14%	0.14	C	C	.	.	S	Bend	trans	-81	165.7	178.9	-153.3	-7.1	0	0	0	111.8	Y72 R128 S323 N330	Y72-N326 WeakPolarHBondContact CE1-ND2 3.2Å; R128-N326 PolarHBondContact NH1-O 3.1Å; S323-N326 VanDerWaalsContact O-CB 3.27Å; S323-N326 WeakPolarHBondContact O-CB 3.39Å; S323-N326 PolarHBondContact O-N 2.95Å; N326-N330 PolarHBondContact ND2-ND2 3.3Å
327	K	89.1	Confident	92.9	Very high	143 Å²	143	31.7 Å²	31.7	62%	0.622	15%	0.151	S	C	*	.			trans	-68.5	154.3	171.4	-59.9	-176.7	178.9	-179.7	0	110.4	Q125 D329 N330	Q125-K327 VanDerWaalsContact CG-O 3.27Å; Q125-K327 WeakPolarHBondContact CG-O 3.26Å; Q125-K327 PolarHBondContact NE2-O 2.91Å; K327-D329 VanDerWaalsContact C-N 3.33Å; K327-D329 WeakPolarHBondContact CB-OD1 3.39Å; K327-D329 PolarHBondContact O-N 3.2Å; K327-N330 PolarHBondContact O-N 2.9Å
328	R	87.8	Confident	93.2	Very high	124 Å²	124	34.4 Å²	34.4	47%	0.468	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-31.6	-175.4	-75.1	-171.3	176.3	153.9	7.1	112.9	D61 Q125 R128 M562	D61-R328 IonicContact OD2-NH2 3.37Å; Q125-R328 PolarHBondContact NE2-O 3.29Å; R128-R328 HydrophobicContact CG-CG 4.48Å; R328-M562 VanDerWaalsContact O-CE 3.31Å; R328-M562 WeakPolarHBondContact O-CE 3.35Å
329	D	87	Confident	93.4	Very high	119 Å²	119	34.5 Å²	34.5	64%	0.636	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	0.6	-178.2	62.7	-26.9	0	0	0	113.9	K327 M562	K327-D329 VanDerWaalsContact C-N 3.33Å; K327-D329 WeakPolarHBondContact CB-OD1 3.39Å; K327-D329 PolarHBondContact O-N 3.2Å; D329-M562 WeakPolarHBondContact CA-O 3.34Å
330	N	91.9	Very high	93.4	Very high	21 Å²	21	34.5 Å²	34.5	11%	0.112	17%	0.165	C	C	.	.	S	Bend	trans	-68.2	140.9	179.5	176.7	78.4	0	0	0	111.4	Q125 N326 K327 C332 D335	Q125-N330 PolarHBondContact NE2-O 2.99Å; N326-N330 PolarHBondContact ND2-ND2 3.3Å; K327-N330 PolarHBondContact O-N 2.9Å; N330-C332 VanDerWaalsContact C-N 3.34Å; N330-C332 PolarHBondContact O-N 3.08Å; N330-D335 PolarHBondContact ND2-OD2 2.86Å
331	N	93.9	Very high	93.5	Very high	55 Å²	55	38.3 Å²	38.3	29%	0.294	19%	0.189	S	C	.	.			trans	-73.7	80.8	-179.5	-170.5	-14.1	0	0	0	112.8	H333 F334 D335	N331-H333 PolarHBondContact O-N 3.2Å; N331-H333 PolarHBondContact OD1-N 3.31Å; N331-F334 HydrophobicContact CB-CB 4.44Å; N331-F334 PolarHBondContact O-N 3.46Å; N331-F334 PolarHBondContact OD1-N 2.86Å; N331-D335 PolarHBondContact O-N 3.48Å
332	C	94.4	Very high	93.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-68.4	-19.8	179.6	60.4	0	0	0	0	113.9	L121 N330 A336	L121-C332 HydrophobicContact CB-CB 4.41Å; N330-C332 VanDerWaalsContact C-N 3.34Å; N330-C332 PolarHBondContact O-N 3.08Å; C332-A336 VanDerWaalsContact O-CB 3.29Å; C332-A336 WeakPolarHBondContact O-CB 3.47Å; C332-A336 PolarHBondContact O-N 3.42Å
333	H	94.6	Very high	93.7	Very high	30 Å²	30	40.5 Å²	40.5	14%	0.139	20%	0.2	C	C	.	.	H	α-helix	trans	-67.3	-48.8	174.5	173	-87.1	0	0	0	111.4	F118 N331 D335 A336 A337 L563 F565 Y571	F118-H333 HydrophobicContact CD2-CB 4.22Å; F118-H333 AromaticContact CE1-CD2 3.97Å; F118-H333 VanDerWaalsContact CE2-CA 3.45Å; F118-H333 HydrophobicContact CE2-CB 3.61Å; F118-H333 HydrophobicContact CZ-CB 3.84Å; N331-H333 PolarHBondContact O-N 3.2Å; N331-H333 PolarHBondContact OD1-N 3.31Å; H333-D335 VanDerWaalsContact C-N 3.32Å; H333-D335 PolarHBondContact O-N 2.86Å; H333-A336 PolarHBondContact O-N 3.07Å; H333-A337 PolarHBondContact O-N 3.5Å; H333-A337 VanDerWaalsContact O-N 3.14Å; H333-L563 HydrophobicContact CB-CD1 4.37Å; H333-F565 HydrophobicContact CB-CZ 4.36Å; H333-Y571 AromaticContact CD2-CE2 3.62Å; H333-Y571 AromaticContact CD2-CZ 3.79Å; H333-Y571 AromaticContact NE2-CE2 3.26Å; H333-Y571 VanDerWaalsContact NE2-CE2 3.26Å; H333-Y571 WeakPolarHBondContact NE2-CE2 3.45Å; H333-Y571 AromaticContact NE2-CZ 3.55Å; H333-Y571 PolarHBondContact NE2-OH 3.32Å; H333-Y571 VanDerWaalsContact NE2-OH 3.15Å
334	F	94.3	Very high	93.7	Very high	106 Å²	106	42.3 Å²	42.3	47%	0.465	21%	0.208	S	C	.	.	H	α-helix	trans	-61.6	-44.1	175.6	178.3	-99.8	0	0	0	111.1	N331 A336 A337 L338	N331-F334 HydrophobicContact CB-CB 4.44Å; N331-F334 PolarHBondContact O-N 3.46Å; N331-F334 PolarHBondContact OD1-N 2.86Å; F334-A336 VanDerWaalsContact C-N 3.31Å; F334-A336 PolarHBondContact O-N 3.07Å; F334-A337 PolarHBondContact O-N 3.29Å; F334-L338 HydrophobicContact CE1-CB 4.38Å; F334-L338 HydrophobicContact CE1-CD2 3.83Å; F334-L338 HydrophobicContact CZ-CD2 4.32Å; F334-L338 VanDerWaalsContact O-CB 3.29Å; F334-L338 WeakPolarHBondContact O-CB 3.37Å; F334-L338 PolarHBondContact O-N 2.86Å
335	D	95.6	Very high	93.8	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-40.2	-179.8	-58.7	-15.2	0	0	0	111.3	K69 Y72 I73 N330 N331 H333 L338 V339	K69-D335 WeakPolarHBondContact CE-OD1 3.44Å; K69-D335 IonicContact NZ-OD1 2.98Å; K69-D335 PolarHBondContact NZ-OD1 3.36Å; K69-D335 VanDerWaalsContact NZ-OD1 3.14Å; Y72-D335 HydrophobicContact CE1-CB 4.28Å; Y72-D335 WeakPolarHBondContact CE1-OD2 3.41Å; I73-D335 HydrophobicContact CD1-CB 3.83Å; N330-D335 PolarHBondContact ND2-OD2 2.86Å; N331-D335 PolarHBondContact O-N 3.48Å; H333-D335 VanDerWaalsContact C-N 3.32Å; H333-D335 PolarHBondContact O-N 2.86Å; D335-L338 PolarHBondContact O-N 3.2Å; D335-V339 WeakPolarHBondContact O-CB 3.35Å; D335-V339 VanDerWaalsContact O-CG2 3.29Å; D335-V339 WeakPolarHBondContact O-CG2 3.46Å; D335-V339 PolarHBondContact O-N 2.87Å
336	A	96	Very high	93.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-47.7	175.5	0	0	0	0	0	112.6	F117 F118 L121 C332 H333 F334 S340	F117-A336 HydrophobicContact CD1-CB 3.96Å; F117-A336 HydrophobicContact CE1-CB 4.42Å; F118-A336 HydrophobicContact CB-CB 3.79Å; F118-A336 HydrophobicContact CD2-CB 4.15Å; F118-A336 HydrophobicContact CG-CB 4.36Å; L121-A336 HydrophobicContact CD1-CB 3.72Å; C332-A336 VanDerWaalsContact O-CB 3.29Å; C332-A336 WeakPolarHBondContact O-CB 3.47Å; C332-A336 PolarHBondContact O-N 3.42Å; H333-A336 PolarHBondContact O-N 3.07Å; F334-A336 VanDerWaalsContact C-N 3.31Å; F334-A336 PolarHBondContact O-N 3.07Å; A336-S340 WeakPolarHBondContact O-CB 3.32Å; A336-S340 PolarHBondContact O-N 3.48Å; A336-S340 PolarHBondContact O-OG 3.35Å
337	A	95.5	Very high	94.1	Very high	32 Å²	32	44.8 Å²	44.8	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-46	178.6	0	0	0	0	0	111.5	H333 F334 S340 V341	H333-A337 PolarHBondContact O-N 3.5Å; H333-A337 VanDerWaalsContact O-N 3.14Å; F334-A337 PolarHBondContact O-N 3.29Å; A337-S340 PolarHBondContact O-N 3.41Å; A337-V341 VanDerWaalsContact O-CG2 3.31Å; A337-V341 WeakPolarHBondContact O-CG2 3.28Å; A337-V341 PolarHBondContact O-N 2.96Å
338	L	96.2	Very high	94.3	Very high	57 Å²	57	40.2 Å²	40.2	30%	0.298	21%	0.207	S	C	.	.	H	α-helix	trans	-59.5	-51.6	-179.1	177.9	63.1	0	0	0	111.7	I73 F334 D335 S340 V341 I342	I73-L338 HydrophobicContact CG2-CD2 4.22Å; F334-L338 HydrophobicContact CE1-CB 4.38Å; F334-L338 HydrophobicContact CE1-CD2 3.83Å; F334-L338 HydrophobicContact CZ-CD2 4.32Å; F334-L338 VanDerWaalsContact O-CB 3.29Å; F334-L338 WeakPolarHBondContact O-CB 3.37Å; F334-L338 PolarHBondContact O-N 2.86Å; D335-L338 PolarHBondContact O-N 3.2Å; L338-S340 VanDerWaalsContact C-N 3.33Å; L338-S340 PolarHBondContact O-N 3.41Å; L338-V341 PolarHBondContact O-N 2.83Å; L338-I342 HydrophobicContact CD1-CD1 3.87Å; L338-I342 HydrophobicContact CD1-CG1 4.27Å; L338-I342 HydrophobicContact CG-CD1 3.87Å; L338-I342 VanDerWaalsContact O-CG1 3.29Å; L338-I342 WeakPolarHBondContact O-CG1 3.25Å; L338-I342 PolarHBondContact O-N 3.09Å
339	V	96.6	Very high	94.6	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-41.3	-179.6	172	0	0	0	0	111.1	Q76 V77 F117 D335 V341 I342 N343	Q76-V339 HydrophobicContact CB-CG2 4.08Å; Q76-V339 HydrophobicContact CG-CB 4.39Å; Q76-V339 HydrophobicContact CG-CG1 3.96Å; Q76-V339 HydrophobicContact CG-CG2 3.78Å; V77-V339 HydrophobicContact CG2-CG2 4.18Å; F117-V339 HydrophobicContact CE1-CB 3.93Å; F117-V339 HydrophobicContact CE1-CG1 3.96Å; F117-V339 HydrophobicContact CZ-CB 4.3Å; F117-V339 HydrophobicContact CZ-CG1 3.88Å; D335-V339 WeakPolarHBondContact O-CB 3.35Å; D335-V339 VanDerWaalsContact O-CG2 3.29Å; D335-V339 WeakPolarHBondContact O-CG2 3.46Å; D335-V339 PolarHBondContact O-N 2.87Å; V339-V341 PolarHBondContact O-N 3.45Å; V339-I342 PolarHBondContact O-N 2.96Å; V339-N343 WeakPolarHBondContact O-CB 3.45Å; V339-N343 PolarHBondContact O-N 3.09Å
340	S	96.3	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-41.3	179.3	-57.7	0	0	0	0	112	A336 A337 L338 N343 F344	A336-S340 WeakPolarHBondContact O-CB 3.32Å; A336-S340 PolarHBondContact O-N 3.48Å; A336-S340 PolarHBondContact O-OG 3.35Å; A337-S340 PolarHBondContact O-N 3.41Å; L338-S340 VanDerWaalsContact C-N 3.33Å; L338-S340 PolarHBondContact O-N 3.41Å; S340-N343 PolarHBondContact O-N 2.99Å; S340-F344 PolarHBondContact O-N 3.43Å
341	V	96.1	Very high	95	Very high	81 Å²	81	29.9 Å²	29.9	49%	0.491	16%	0.161	S	C	.	.	H	α-helix	trans	-67	-45.5	176.3	170.2	0	0	0	0	111	A337 L338 V339 N343 F344 V345	A337-V341 VanDerWaalsContact O-CG2 3.31Å; A337-V341 WeakPolarHBondContact O-CG2 3.28Å; A337-V341 PolarHBondContact O-N 2.96Å; L338-V341 PolarHBondContact O-N 2.83Å; V339-V341 PolarHBondContact O-N 3.45Å; V341-N343 VanDerWaalsContact C-N 3.32Å; V341-N343 PolarHBondContact O-N 3.08Å; V341-F344 PolarHBondContact O-N 3.39Å; V341-V345 HydrophobicContact CG1-CG2 4.31Å; V341-V345 WeakPolarHBondContact O-CG2 3.36Å; V341-V345 PolarHBondContact O-N 3.46Å
342	I	95.9	Very high	95	Very high	47 Å²	47	29 Å²	29	24%	0.241	16%	0.156	C	C	.	.	H	α-helix	trans	-56	-51	175	-70.5	168.9	0	0	0	109.3	V77 Y264 L338 V339 F344 V345 T346	V77-I342 HydrophobicContact CG1-CG2 3.9Å; V77-I342 HydrophobicContact CG2-CD1 3.89Å; V77-I342 HydrophobicContact CG2-CG2 4.14Å; Y264-I342 WeakPolarHBondContact OH-CG2 3.5Å; L338-I342 HydrophobicContact CD1-CD1 3.87Å; L338-I342 HydrophobicContact CD1-CG1 4.27Å; L338-I342 HydrophobicContact CG-CD1 3.87Å; L338-I342 VanDerWaalsContact O-CG1 3.29Å; L338-I342 WeakPolarHBondContact O-CG1 3.25Å; L338-I342 PolarHBondContact O-N 3.09Å; V339-I342 PolarHBondContact O-N 2.96Å; I342-F344 VanDerWaalsContact C-N 3.33Å; I342-F344 PolarHBondContact O-N 3.17Å; I342-V345 PolarHBondContact O-N 2.92Å; I342-T346 WeakPolarHBondContact O-CB 3.39Å; I342-T346 PolarHBondContact O-N 3.12Å; I342-T346 PolarHBondContact O-OG1 2.94Å
343	N	94.9	Very high	94.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57	-43.2	179	175.1	67.8	0	0	0	113	V81 N85 Y105 L312 V339 S340 V341 T346 S347	V81-N343 HydrophobicContact CG2-CB 4.3Å; N85-N343 PolarHBondContact ND2-OD1 3.34Å; Y105-N343 PolarHBondContact OH-ND2 3.27Å; L312-N343 HydrophobicContact CD2-CB 4.31Å; V339-N343 WeakPolarHBondContact O-CB 3.45Å; V339-N343 PolarHBondContact O-N 3.09Å; S340-N343 PolarHBondContact O-N 2.99Å; V341-N343 VanDerWaalsContact C-N 3.32Å; V341-N343 PolarHBondContact O-N 3.08Å; N343-T346 PolarHBondContact O-N 3.2Å; N343-S347 PolarHBondContact O-N 3.09Å; N343-S347 PolarHBondContact O-OG 3Å
344	F	95.1	Very high	94.8	Very high	37 Å²	37	28 Å²	28	16%	0.162	15%	0.152	C	C	.	.	H	α-helix	trans	-63.4	-48.5	176.6	176.1	-121.8	0	0	0	112.5	Y105 F106 L109 S340 V341 I342 T346 S347 I348	Y105-F344 HydrophobicContact CD1-CD2 4.04Å; Y105-F344 HydrophobicContact CD1-CE2 4.1Å; Y105-F344 AromaticContact CE1-CD2 3.75Å; Y105-F344 HydrophobicContact CE1-CD2 3.75Å; Y105-F344 HydrophobicContact CE1-CE2 4.29Å; F106-F344 HydrophobicContact CB-CE2 4.45Å; F106-F344 HydrophobicContact CB-CZ 4.4Å; F106-F344 HydrophobicContact CD2-CD1 4.43Å; F106-F344 AromaticContact CD2-CE1 3.8Å; F106-F344 HydrophobicContact CD2-CE1 3.8Å; F106-F344 HydrophobicContact CD2-CE2 4.06Å; F106-F344 AromaticContact CD2-CZ 3.55Å; F106-F344 HydrophobicContact CD2-CZ 3.55Å; F106-F344 HydrophobicContact CE2-CE1 4.02Å; F106-F344 HydrophobicContact CE2-CZ 4.23Å; F106-F344 HydrophobicContact CG-CZ 4.31Å; L109-F344 HydrophobicContact CD2-CB 3.76Å; L109-F344 HydrophobicContact CD2-CD2 4.19Å; L109-F344 HydrophobicContact CD2-CG 4.04Å; S340-F344 PolarHBondContact O-N 3.43Å; V341-F344 PolarHBondContact O-N 3.39Å; I342-F344 VanDerWaalsContact C-N 3.33Å; I342-F344 PolarHBondContact O-N 3.17Å; F344-T346 VanDerWaalsContact C-N 3.29Å; F344-T346 PolarHBondContact O-N 2.78Å; F344-S347 PolarHBondContact O-N 3.4Å; F344-I348 HydrophobicContact CD1-CD1 4.15Å; F344-I348 HydrophobicContact CD2-CD1 4.14Å; F344-I348 HydrophobicContact CD2-CG1 4.48Å; F344-I348 HydrophobicContact CE1-CD1 3.61Å; F344-I348 HydrophobicContact CE2-CD1 3.64Å; F344-I348 HydrophobicContact CE2-CG1 4.19Å; F344-I348 HydrophobicContact CG-CD1 4.42Å; F344-I348 HydrophobicContact CZ-CD1 3.36Å; F344-I348 HydrophobicContact CZ-CG1 4.39Å; F344-I348 PolarHBondContact O-N 3.32Å
345	V	95	Very high	94.7	Very high	82 Å²	82	23 Å²	23	50%	0.497	13%	0.13	S	C	.	.	H	α-helix	trans	-61.6	-40.7	178	171.6	0	0	0	0	110.5	V341 I342 I348 L349	V341-V345 HydrophobicContact CG1-CG2 4.31Å; V341-V345 WeakPolarHBondContact O-CG2 3.36Å; V341-V345 PolarHBondContact O-N 3.46Å; I342-V345 PolarHBondContact O-N 2.92Å; V345-I348 PolarHBondContact O-N 2.99Å; V345-L349 WeakPolarHBondContact O-CB 3.46Å; V345-L349 PolarHBondContact O-N 2.87Å
346	T	94.4	Very high	94.6	Very high	5 Å²	5	23 Å²	23	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-64.9	-41.4	177.1	-51	0	0	0	0	112.1	V81 Y264 L267 I342 N343 F344 I348 L349 A350	V81-T346 HydrophobicContact CG1-CG2 3.55Å; V81-T346 HydrophobicContact CG2-CG2 4.43Å; Y264-T346 HydrophobicContact CE1-CG2 3.69Å; Y264-T346 WeakPolarHBondContact CE1-OG1 3.33Å; Y264-T346 PolarHBondContact OH-OG1 3.24Å; L267-T346 HydrophobicContact CD1-CG2 4.28Å; I342-T346 WeakPolarHBondContact O-CB 3.39Å; I342-T346 PolarHBondContact O-N 3.12Å; I342-T346 PolarHBondContact O-OG1 2.94Å; N343-T346 PolarHBondContact O-N 3.2Å; F344-T346 VanDerWaalsContact C-N 3.29Å; F344-T346 PolarHBondContact O-N 2.78Å; T346-I348 VanDerWaalsContact C-N 3.35Å; T346-I348 PolarHBondContact O-N 2.9Å; T346-L349 PolarHBondContact O-N 3.45Å; T346-A350 VanDerWaalsContact O-CB 3.3Å; T346-A350 WeakPolarHBondContact O-CB 3.38Å; T346-A350 PolarHBondContact O-N 3.18Å
347	S	94.3	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-44	174.2	-63.9	0	0	0	0	111.7	N85 N343 F344 T351	N85-S347 PolarHBondContact ND2-OG 3.41Å; N343-S347 PolarHBondContact O-N 3.09Å; N343-S347 PolarHBondContact O-OG 3Å; F344-S347 PolarHBondContact O-N 3.4Å; S347-T351 WeakPolarHBondContact O-CB 3.46Å; S347-T351 PolarHBondContact O-N 2.92Å; S347-T351 PolarHBondContact O-OG1 3.29Å
348	I	94.1	Very high	94	Very high	47 Å²	47	22.5 Å²	22.5	24%	0.241	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-47	176.4	-68.3	172.7	0	0	0	110.8	F344 V345 T346 A350 T351 L352	F344-I348 HydrophobicContact CD1-CD1 4.15Å; F344-I348 HydrophobicContact CD2-CD1 4.14Å; F344-I348 HydrophobicContact CD2-CG1 4.48Å; F344-I348 HydrophobicContact CE1-CD1 3.61Å; F344-I348 HydrophobicContact CE2-CD1 3.64Å; F344-I348 HydrophobicContact CE2-CG1 4.19Å; F344-I348 HydrophobicContact CG-CD1 4.42Å; F344-I348 HydrophobicContact CZ-CD1 3.36Å; F344-I348 HydrophobicContact CZ-CG1 4.39Å; F344-I348 PolarHBondContact O-N 3.32Å; V345-I348 PolarHBondContact O-N 2.99Å; T346-I348 VanDerWaalsContact C-N 3.35Å; T346-I348 PolarHBondContact O-N 2.9Å; I348-A350 PolarHBondContact O-N 2.93Å; I348-T351 PolarHBondContact O-N 2.87Å; I348-L352 WeakPolarHBondContact O-CB 3.35Å; I348-L352 PolarHBondContact O-N 2.99Å
349	L	94.1	Very high	93.9	Very high	45 Å²	45	19.8 Å²	19.8	24%	0.236	11%	0.109	C	C	.	.	H	α-helix	trans	-58.9	-49.1	179.5	177.2	64.1	0	0	0	111.4	L267 L271 V345 T346 T351 L352 V353	L267-L349 HydrophobicContact CB-CD2 4.24Å; L267-L349 HydrophobicContact CD1-CD2 4.44Å; L271-L349 HydrophobicContact CD2-CD1 3.77Å; V345-L349 WeakPolarHBondContact O-CB 3.46Å; V345-L349 PolarHBondContact O-N 2.87Å; T346-L349 PolarHBondContact O-N 3.45Å; L349-T351 VanDerWaalsContact C-N 3.33Å; L349-T351 PolarHBondContact O-N 3.46Å; L349-L352 PolarHBondContact O-N 3.26Å; L349-V353 WeakPolarHBondContact O-CG2 3.23Å; L349-V353 PolarHBondContact O-N 3.48Å
350	A	93.5	Very high	93.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-43	177.1	0	0	0	0	0	111.4	N85 V86 L267 T346 I348 L352 V353 V354	N85-A350 WeakPolarHBondContact O-CB 3.49Å; V86-A350 HydrophobicContact CG2-CB 4.43Å; L267-A350 HydrophobicContact CD1-CB 4.41Å; L267-A350 HydrophobicContact CD2-CB 4.3Å; T346-A350 VanDerWaalsContact O-CB 3.3Å; T346-A350 WeakPolarHBondContact O-CB 3.38Å; T346-A350 PolarHBondContact O-N 3.18Å; I348-A350 PolarHBondContact O-N 2.93Å; A350-L352 PolarHBondContact O-N 3.37Å; A350-V353 WeakPolarHBondContact O-CB 3.17Å; A350-V353 PolarHBondContact O-N 3.28Å; A350-V354 WeakPolarHBondContact O-CG2 3.42Å; A350-V354 PolarHBondContact O-N 3.48Å
351	T	93.2	Very high	93.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-43.7	176.1	-53.5	0	0	0	0	111.8	F89 P90 C93 M287 S347 I348 L349 V353 V354 F355	F89-T351 WeakPolarHBondContact CD1-OG1 3.35Å; F89-T351 WeakPolarHBondContact CE1-OG1 3.25Å; P90-T351 HydrophobicContact CB-CG2 4.12Å; P90-T351 HydrophobicContact CG-CG2 4.43Å; C93-T351 HydrophobicContact CB-CG2 4.3Å; M287-T351 HydrophobicContact CE-CG2 3.55Å; M287-T351 HydrophobicContact CG-CG2 4.25Å; M287-T351 HydrophobicContact SD-CG2 3.7Å; S347-T351 WeakPolarHBondContact O-CB 3.46Å; S347-T351 PolarHBondContact O-N 2.92Å; S347-T351 PolarHBondContact O-OG1 3.29Å; I348-T351 PolarHBondContact O-N 2.87Å; L349-T351 VanDerWaalsContact C-N 3.33Å; L349-T351 PolarHBondContact O-N 3.46Å; T351-V353 VanDerWaalsContact C-N 3.33Å; T351-V353 PolarHBondContact O-N 2.86Å; T351-V354 WeakPolarHBondContact O-CB 3.4Å; T351-V354 PolarHBondContact O-N 2.93Å; T351-V354 VanDerWaalsContact O-N 3.15Å; T351-F355 HydrophobicContact CG2-CD2 3.5Å; T351-F355 VanDerWaalsContact CG2-CD2 3.5Å; T351-F355 HydrophobicContact CG2-CE2 3.51Å; T351-F355 WeakPolarHBondContact O-CD2 3.3Å; T351-F355 PolarHBondContact O-N 3.37Å
352	L	94.1	Very high	93.1	Very high	38 Å²	38	18.7 Å²	18.7	20%	0.199	10%	0.098	C	C	.	.	H	α-helix	trans	-62.8	-41.4	178.7	-169.4	150.4	0	0	0	111.5	L271 I284 I348 L349 A350 A356	L271-L352 HydrophobicContact CD1-CD2 3.07Å; L271-L352 HydrophobicContact CG-CD2 4.42Å; I284-L352 HydrophobicContact CD1-CD2 4.33Å; I348-L352 WeakPolarHBondContact O-CB 3.35Å; I348-L352 PolarHBondContact O-N 2.99Å; L349-L352 PolarHBondContact O-N 3.26Å; A350-L352 PolarHBondContact O-N 3.37Å; L352-A356 VanDerWaalsContact O-CB 3.3Å; L352-A356 WeakPolarHBondContact O-CB 3.43Å; L352-A356 PolarHBondContact O-N 2.89Å
353	V	93.7	Very high	92.9	Very high	4 Å²	4	18 Å²	18	2%	0.024	10%	0.095	C	C	.	.	H	α-helix	trans	-59.4	-47.3	172	170.5	0	0	0	0	111.1	L267 F270 L271 L349 A350 T351 A356 V357	L267-V353 WeakPolarHBondContact O-CG2 3.44Å; F270-V353 HydrophobicContact CB-CG1 3.66Å; L271-V353 HydrophobicContact CB-CG2 3.79Å; L271-V353 HydrophobicContact CD1-CG2 4.41Å; L349-V353 WeakPolarHBondContact O-CG2 3.23Å; L349-V353 PolarHBondContact O-N 3.48Å; A350-V353 WeakPolarHBondContact O-CB 3.17Å; A350-V353 PolarHBondContact O-N 3.28Å; T351-V353 VanDerWaalsContact C-N 3.33Å; T351-V353 PolarHBondContact O-N 2.86Å; V353-A356 PolarHBondContact O-N 3.48Å; V353-V357 WeakPolarHBondContact O-CG2 3.2Å; V353-V357 PolarHBondContact O-N 2.96Å; V353-V357 VanDerWaalsContact O-N 3.08Å
354	V	91.8	Very high	92.7	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-52	179.9	171	0	0	0	0	111.6	P90 A350 T351 A356 V357 L358 L443 F448	P90-V354 HydrophobicContact CB-CB 3.97Å; P90-V354 HydrophobicContact CB-CG1 3.73Å; P90-V354 HydrophobicContact CB-CG2 3.99Å; P90-V354 HydrophobicContact CG-CB 4.2Å; P90-V354 HydrophobicContact CG-CG1 4.41Å; P90-V354 HydrophobicContact CG-CG2 3.72Å; A350-V354 WeakPolarHBondContact O-CG2 3.42Å; A350-V354 PolarHBondContact O-N 3.48Å; T351-V354 WeakPolarHBondContact O-CB 3.4Å; T351-V354 PolarHBondContact O-N 2.93Å; T351-V354 VanDerWaalsContact O-N 3.15Å; V354-A356 VanDerWaalsContact C-N 3.32Å; V354-A356 PolarHBondContact O-N 3.35Å; V354-V357 PolarHBondContact O-N 3.35Å; V354-L358 HydrophobicContact CG1-CD1 3.72Å; V354-L358 HydrophobicContact CG1-CG 4.17Å; V354-L358 WeakPolarHBondContact O-CB 3.3Å; V354-L358 VanDerWaalsContact O-CG 3.31Å; V354-L358 WeakPolarHBondContact O-CG 3.42Å; V354-L358 PolarHBondContact O-N 3.3Å; V354-L443 HydrophobicContact CG1-CD1 4.26Å; V354-L443 HydrophobicContact CG1-CD2 4.2Å; V354-F448 HydrophobicContact CB-CE2 3.88Å; V354-F448 HydrophobicContact CB-CZ 3.82Å; V354-F448 HydrophobicContact CG1-CE2 3.68Å; V354-F448 HydrophobicContact CG1-CZ 4.14Å; V354-F448 HydrophobicContact CG2-CE2 3.54Å; V354-F448 HydrophobicContact CG2-CZ 3.4Å
355	F	91.9	Very high	92.3	Very high	3 Å²	3	18.8 Å²	18.8	1%	0.013	10%	0.101	C	C	.	.	H	α-helix	trans	-67.4	-32.2	-179	-84.7	-95.3	0	0	0	112.5	P90 C93 Q94 G283 M287 T351 G359	P90-F355 HydrophobicContact CB-CE2 4.45Å; C93-F355 HydrophobicContact CB-CE2 4.43Å; Q94-F355 HydrophobicContact CB-CE1 4.38Å; Q94-F355 HydrophobicContact CB-CZ 3.72Å; Q94-F355 HydrophobicContact CG-CE1 4.3Å; Q94-F355 HydrophobicContact CG-CZ 4.14Å; G283-F355 WeakPolarHBondContact CA-O 3.48Å; G283-F355 WeakPolarHBondContact O-CD1 3.41Å; M287-F355 HydrophobicContact CB-CB 4.06Å; M287-F355 HydrophobicContact CB-CD1 3.66Å; M287-F355 HydrophobicContact CB-CD2 4.13Å; M287-F355 HydrophobicContact CB-CE1 4.03Å; M287-F355 HydrophobicContact CB-CE2 4.46Å; M287-F355 HydrophobicContact CB-CG 3.68Å; M287-F355 HydrophobicContact CB-CZ 4.39Å; M287-F355 HydrophobicContact CG-CD1 4.4Å; M287-F355 HydrophobicContact CG-CD2 4.03Å; M287-F355 HydrophobicContact CG-CE2 4.21Å; M287-F355 HydrophobicContact CG-CG 4.1Å; M287-F355 HydrophobicContact CG-CZ 4.45Å; M287-F355 HydrophobicContact SD-CB 4.43Å; M287-F355 HydrophobicContact SD-CD2 4.19Å; M287-F355 HydrophobicContact SD-CG 4.39Å; T351-F355 HydrophobicContact CG2-CD2 3.5Å; T351-F355 VanDerWaalsContact CG2-CD2 3.5Å; T351-F355 HydrophobicContact CG2-CE2 3.51Å; T351-F355 WeakPolarHBondContact O-CD2 3.3Å; T351-F355 PolarHBondContact O-N 3.37Å; F355-G359 PolarHBondContact O-N 2.89Å
356	A	93.6	Very high	92.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-43.7	172.2	0	0	0	0	0	112.1	S280 I284 L352 V353 V354 F360	S280-A356 WeakPolarHBondContact CA-O 3.31Å; I284-A356 HydrophobicContact CD1-CB 4.05Å; I284-A356 HydrophobicContact CG1-CB 4.16Å; L352-A356 VanDerWaalsContact O-CB 3.3Å; L352-A356 WeakPolarHBondContact O-CB 3.43Å; L352-A356 PolarHBondContact O-N 2.89Å; V353-A356 PolarHBondContact O-N 3.48Å; V354-A356 VanDerWaalsContact C-N 3.32Å; V354-A356 PolarHBondContact O-N 3.35Å; A356-F360 PolarHBondContact O-N 2.96Å
357	V	91.1	Very high	91.9	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-70.5	-41.2	178.4	174.5	0	0	0	0	111.4	V353 V354 F360 K361 F448 A451 F455	V353-V357 WeakPolarHBondContact O-CG2 3.2Å; V353-V357 PolarHBondContact O-N 2.96Å; V353-V357 VanDerWaalsContact O-N 3.08Å; V354-V357 PolarHBondContact O-N 3.35Å; V357-F360 PolarHBondContact O-N 3.35Å; V357-K361 PolarHBondContact O-N 3.07Å; V357-F448 HydrophobicContact CB-CE1 4.28Å; V357-F448 HydrophobicContact CG1-CD1 4.25Å; V357-F448 HydrophobicContact CG1-CE1 4.23Å; V357-F448 HydrophobicContact CG2-CE1 4.25Å; V357-A451 HydrophobicContact CG1-CB 3.3Å; V357-F455 HydrophobicContact CG2-CZ 4.36Å
358	L	89.1	Confident	91.6	Very high	21 Å²	21	24.8 Å²	24.8	11%	0.11	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-38.7	175.3	-70.7	177.7	0	0	0	112.1	V354 K361 A362 L443 A447	V354-L358 HydrophobicContact CG1-CD1 3.72Å; V354-L358 HydrophobicContact CG1-CG 4.17Å; V354-L358 WeakPolarHBondContact O-CB 3.3Å; V354-L358 VanDerWaalsContact O-CG 3.31Å; V354-L358 WeakPolarHBondContact O-CG 3.42Å; V354-L358 PolarHBondContact O-N 3.3Å; L358-K361 WeakPolarHBondContact O-CB 3.43Å; L358-K361 PolarHBondContact O-N 3.27Å; L358-A362 WeakPolarHBondContact O-CB 3.28Å; L358-A362 PolarHBondContact O-N 3.45Å; L358-L443 HydrophobicContact CD1-CD1 4.09Å; L358-L443 HydrophobicContact CD2-CD1 4.22Å; L358-A447 HydrophobicContact CD2-CB 3.99Å
359	G	92.3	Very high	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-41.4	175.6	0	0	0	0	0	112.9	G279 F355 N363	G279-G359 CarbonylContact O-C 2.97Å; G279-G359 WeakPolarHBondContact O-CA 3.45Å; F355-G359 PolarHBondContact O-N 2.89Å; G359-N363 PolarHBondContact O-N 3.15Å; G359-N363 VanDerWaalsContact O-N 3.11Å; G359-N363 PolarHBondContact O-ND2 3.05Å
360	F	91.8	Very high	91.3	Very high	20 Å²	20	21.6 Å²	21.6	9%	0.088	11%	0.108	C	C	.	.	H	α-helix	trans	-61	-48.1	170.2	165.4	-105.3	0	0	0	111.6	L277 K278 A356 V357 A362 N363 V364 H454 F455	L277-F360 HydrophobicContact CB-CB 3.98Å; L277-F360 HydrophobicContact CB-CD2 3.72Å; L277-F360 HydrophobicContact CB-CE2 4.41Å; L277-F360 HydrophobicContact CB-CG 3.92Å; L277-F360 HydrophobicContact CD1-CB 4Å; L277-F360 HydrophobicContact CD1-CD1 3.94Å; L277-F360 HydrophobicContact CD1-CD2 4.27Å; L277-F360 HydrophobicContact CD1-CE1 4.48Å; L277-F360 HydrophobicContact CD1-CG 3.79Å; L277-F360 HydrophobicContact CD2-CD2 4.12Å; L277-F360 HydrophobicContact CD2-CE2 4.02Å; L277-F360 HydrophobicContact CD2-CG 4.42Å; L277-F360 HydrophobicContact CD2-CZ 4.23Å; L277-F360 HydrophobicContact CG-CD2 4.25Å; L277-F360 HydrophobicContact CG-CG 4.26Å; K278-F360 WeakPolarHBondContact O-CD2 3.27Å; A356-F360 PolarHBondContact O-N 2.96Å; V357-F360 PolarHBondContact O-N 3.35Å; F360-A362 PolarHBondContact O-N 2.98Å; F360-N363 PolarHBondContact O-N 3.2Å; F360-V364 HydrophobicContact CD2-CG2 3.98Å; F360-V364 HydrophobicContact CE1-CG2 4.26Å; F360-V364 HydrophobicContact CE2-CG2 3.52Å; F360-V364 HydrophobicContact CZ-CG2 3.69Å; F360-V364 WeakPolarHBondContact O-CG2 3.43Å; F360-V364 PolarHBondContact O-N 3.24Å; F360-H454 HydrophobicContact CE1-CB 3.76Å; F360-H454 HydrophobicContact CZ-CB 3.81Å; F360-F455 AromaticContact CD1-CE1 3.82Å; F360-F455 HydrophobicContact CD1-CE1 3.82Å; F360-F455 AromaticContact CE1-CD1 3.98Å; F360-F455 HydrophobicContact CE1-CD1 3.98Å; F360-F455 AromaticContact CE1-CE1 3.65Å; F360-F455 HydrophobicContact CE1-CE1 3.65Å; F360-F455 HydrophobicContact CZ-CE1 4.46Å
361	K	90.5	Very high	91.1	Very high	34 Å²	34	25.4 Å²	25.4	15%	0.148	13%	0.131	C	C	.	.	H	α-helix	trans	-56.9	-49.6	178	-175.5	-161.9	171.7	-176.3	0	111.2	V357 L358 N363 V364 M365 E450 A451	V357-K361 PolarHBondContact O-N 3.07Å; L358-K361 WeakPolarHBondContact O-CB 3.43Å; L358-K361 PolarHBondContact O-N 3.27Å; K361-N363 VanDerWaalsContact C-N 3.33Å; K361-N363 PolarHBondContact O-N 3.43Å; K361-V364 PolarHBondContact O-N 3.34Å; K361-M365 HydrophobicContact CG-CE 4.46Å; K361-M365 HydrophobicContact CG-CG 4.34Å; K361-M365 WeakPolarHBondContact O-CG 3.43Å; K361-M365 PolarHBondContact O-N 3.37Å; K361-E450 WeakPolarHBondContact CE-OE2 3.48Å; K361-E450 IonicContact NZ-OE1 2.82Å; K361-E450 IonicContact NZ-OE2 3.73Å; K361-E450 PolarHBondContact NZ-OE2 3.44Å; K361-A451 HydrophobicContact CB-CB 4.23Å
362	A	91.1	Very high	90.8	Very high	4 Å²	4	31 Å²	31	3%	0.033	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-44.1	-178.6	0	0	0	0	0	111.4	L358 F360 M365 N366 L430 E433 L434	L358-A362 WeakPolarHBondContact O-CB 3.28Å; L358-A362 PolarHBondContact O-N 3.45Å; F360-A362 PolarHBondContact O-N 2.98Å; A362-M365 PolarHBondContact O-N 3.2Å; A362-N366 VanDerWaalsContact O-CB 3.23Å; A362-N366 WeakPolarHBondContact O-CB 3.46Å; A362-N366 PolarHBondContact O-N 2.73Å; A362-L430 HydrophobicContact CB-CD1 3.83Å; A362-E433 HydrophobicContact CB-CB 3.9Å; A362-L434 HydrophobicContact CB-CD2 3.81Å; A362-L434 HydrophobicContact CB-CG 3.88Å
363	N	91.6	Very high	90.6	Very high	32 Å²	32	29.1 Å²	29.1	17%	0.171	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-44.3	176.1	-87.5	-73.6	0	0	0	112.6	G279 D282 G359 F360 K361 M365 N366 E367 L430	G279-N363 WeakPolarHBondContact CA-ND2 3.47Å; G279-N363 PolarHBondContact O-ND2 2.72Å; D282-N363 PolarHBondContact OD2-ND2 3.3Å; G359-N363 PolarHBondContact O-N 3.15Å; G359-N363 VanDerWaalsContact O-N 3.11Å; G359-N363 PolarHBondContact O-ND2 3.05Å; F360-N363 PolarHBondContact O-N 3.2Å; K361-N363 VanDerWaalsContact C-N 3.33Å; K361-N363 PolarHBondContact O-N 3.43Å; N363-M365 PolarHBondContact O-N 3.34Å; N363-N366 PolarHBondContact O-N 3Å; N363-E367 WeakPolarHBondContact O-CG 3.39Å; N363-E367 PolarHBondContact O-N 3.16Å; N363-L430 HydrophobicContact CB-CD1 4.46Å
364	V	90.1	Very high	90.3	Very high	24 Å²	24	29.4 Å²	29.4	15%	0.145	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-42.5	177	169.9	0	0	0	0	111.8	F360 K361 E367 K368	F360-V364 HydrophobicContact CD2-CG2 3.98Å; F360-V364 HydrophobicContact CE1-CG2 4.26Å; F360-V364 HydrophobicContact CE2-CG2 3.52Å; F360-V364 HydrophobicContact CZ-CG2 3.69Å; F360-V364 WeakPolarHBondContact O-CG2 3.43Å; F360-V364 PolarHBondContact O-N 3.24Å; K361-V364 PolarHBondContact O-N 3.34Å; V364-E367 PolarHBondContact O-N 2.91Å; V364-K368 WeakPolarHBondContact O-CG 3.31Å; V364-K368 PolarHBondContact O-N 2.88Å; V364-K368 VanDerWaalsContact O-N 3.1Å
365	M	87.8	Confident	90.1	Very high	31 Å²	31	35.4 Å²	35.4	15%	0.153	18%	0.177	C	C	.	.	H	α-helix	trans	-70	-36.7	178.7	-64.4	-54.1	154.5	0	0	111.9	K361 A362 N363 K368 C369 E450 H454	K361-M365 HydrophobicContact CG-CE 4.46Å; K361-M365 HydrophobicContact CG-CG 4.34Å; K361-M365 WeakPolarHBondContact O-CG 3.43Å; K361-M365 PolarHBondContact O-N 3.37Å; A362-M365 PolarHBondContact O-N 3.2Å; N363-M365 PolarHBondContact O-N 3.34Å; M365-K368 PolarHBondContact O-N 2.87Å; M365-K368 HydrophobicContact SD-CD 4Å; M365-C369 PolarHBondContact O-N 3.35Å; M365-E450 HydrophobicContact CE-CG 4.15Å; M365-E450 WeakPolarHBondContact CE-OE1 3.43Å; M365-H454 WeakPolarHBondContact CE-NE2 3.33Å
366	N	90.9	Very high	89.9	Confident	8 Å²	8	38.9 Å²	38.9	4%	0.043	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-43.4	174.5	-166.6	60.6	0	0	0	111.8	A362 N363 K368 C369 V370 A402 C428 L430	A362-N366 VanDerWaalsContact O-CB 3.23Å; A362-N366 WeakPolarHBondContact O-CB 3.46Å; A362-N366 PolarHBondContact O-N 2.73Å; N363-N366 PolarHBondContact O-N 3Å; N366-K368 VanDerWaalsContact C-N 3.35Å; N366-K368 PolarHBondContact O-N 3.25Å; N366-C369 WeakPolarHBondContact O-CB 3.37Å; N366-C369 PolarHBondContact O-N 3.46Å; N366-V370 VanDerWaalsContact O-CG2 3.25Å; N366-V370 WeakPolarHBondContact O-CG2 3.17Å; N366-V370 PolarHBondContact O-N 2.77Å; N366-A402 WeakPolarHBondContact ND2-CB 3.25Å; N366-C428 PolarHBondContact OD1-O 3.34Å; N366-L430 HydrophobicContact CB-CD1 4.24Å
367	E	89.6	Confident	89.6	Confident	121 Å²	121	38.9 Å²	38.9	57%	0.565	19%	0.192	S	C	*	.	H	α-helix	trans	-60.6	-41.9	174.1	-74.9	179.5	178.4	0	0	112	N363 V364 V370 V371	N363-E367 WeakPolarHBondContact O-CG 3.39Å; N363-E367 PolarHBondContact O-N 3.16Å; V364-E367 PolarHBondContact O-N 2.91Å; E367-V370 PolarHBondContact O-N 3.46Å; E367-V371 WeakPolarHBondContact O-CG2 3.3Å; E367-V371 PolarHBondContact O-N 3.49Å
368	K	88.8	Confident	89.3	Confident	83 Å²	83	41.8 Å²	41.8	36%	0.361	21%	0.207	S	C	.	.	H	α-helix	trans	-62.2	-46.7	175.1	-71	178.1	-167.8	168.1	0	112.3	V364 M365 N366 V370 V371 E372 H454	V364-K368 WeakPolarHBondContact O-CG 3.31Å; V364-K368 PolarHBondContact O-N 2.88Å; V364-K368 VanDerWaalsContact O-N 3.1Å; M365-K368 PolarHBondContact O-N 2.87Å; M365-K368 HydrophobicContact SD-CD 4Å; N366-K368 VanDerWaalsContact C-N 3.35Å; N366-K368 PolarHBondContact O-N 3.25Å; K368-V370 VanDerWaalsContact C-N 3.27Å; K368-V370 PolarHBondContact O-N 3.4Å; K368-V371 PolarHBondContact O-N 3.09Å; K368-E372 WeakPolarHBondContact O-CG 3.46Å; K368-E372 PolarHBondContact O-N 3.37Å; K368-H454 PolarHBondContact NZ-CE1 2.96Å; K368-H454 PolarHBondContact NZ-NE2 3.43Å; K368-H454 VanDerWaalsContact NZ-NE2 3.12Å
369	C	90	Very high	89.2	Confident	23 Å²	23	42.3 Å²	42.3	16%	0.155	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-44.8	176	-178.8	0	0	0	0	111.5	M365 N366 N373 C428	M365-C369 PolarHBondContact O-N 3.35Å; N366-C369 WeakPolarHBondContact O-CB 3.37Å; N366-C369 PolarHBondContact O-N 3.46Å; C369-N373 WeakPolarHBondContact O-CB 3.28Å; C369-N373 PolarHBondContact O-N 2.68Å; C369-C428 HydrophobicContact CB-CB 3.85Å; C369-C428 WeakPolarHBondContact CB-SG 3.49Å; C369-C428 PolarHBondContact O-SG 3.17Å; C369-C428 VanDerWaalsContact SG-CA 3.57Å; C369-C428 WeakPolarHBondContact SG-CB 3.5Å; C369-C428 CovalentContact SG-SG 2.05Å; C369-C428 PolarHBondContact SG-SG 3.38Å
370	V	90.8	Very high	88.9	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-44.4	178.5	167.7	0	0	0	0	111.5	N366 E367 K368 A374 L400 A402 Y405 C428	N366-V370 VanDerWaalsContact O-CG2 3.25Å; N366-V370 WeakPolarHBondContact O-CG2 3.17Å; N366-V370 PolarHBondContact O-N 2.77Å; E367-V370 PolarHBondContact O-N 3.46Å; K368-V370 VanDerWaalsContact C-N 3.27Å; K368-V370 PolarHBondContact O-N 3.4Å; V370-A374 VanDerWaalsContact O-CB 3.25Å; V370-A374 WeakPolarHBondContact O-CB 3.29Å; V370-A374 PolarHBondContact O-N 2.91Å; V370-L400 HydrophobicContact CG1-CD2 3.63Å; V370-L400 HydrophobicContact CG1-CG 4.18Å; V370-A402 HydrophobicContact CG2-CB 4.18Å; V370-Y405 HydrophobicContact CB-CG 4.45Å; V370-Y405 HydrophobicContact CG1-CD2 4.45Å; V370-Y405 HydrophobicContact CG1-CG 4.11Å; V370-Y405 HydrophobicContact CG2-CD1 3.99Å; V370-Y405 HydrophobicContact CG2-CG 4.03Å; V370-C428 HydrophobicContact CG2-CB 3.87Å
371	V	89.3	Confident	88.6	Confident	81 Å²	81	45.2 Å²	45.2	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-47.4	178.7	172.4	0	0	0	0	111.4	E367 K368 N373 A374 E375	E367-V371 WeakPolarHBondContact O-CG2 3.3Å; E367-V371 PolarHBondContact O-N 3.49Å; K368-V371 PolarHBondContact O-N 3.09Å; V371-N373 VanDerWaalsContact C-N 3.35Å; V371-N373 PolarHBondContact O-N 2.94Å; V371-A374 WeakPolarHBondContact O-CB 3.47Å; V371-A374 PolarHBondContact O-N 3.41Å; V371-E375 PolarHBondContact O-N 3.22Å
372	E	88.1	Confident	88.4	Confident	116 Å²	116	49.6 Å²	49.6	54%	0.542	26%	0.255	S	S	.	.	H	α-helix	trans	-60.7	-43.8	179.2	-72.8	176.9	-171.9	0	0	111.8	K368 A374 E375 K376	K368-E372 WeakPolarHBondContact O-CG 3.46Å; K368-E372 PolarHBondContact O-N 3.37Å; E372-A374 VanDerWaalsContact C-N 3.35Å; E372-E375 PolarHBondContact O-N 3.35Å; E372-K376 WeakPolarHBondContact O-CG 3.36Å; E372-K376 PolarHBondContact O-N 2.94Å; E372-K376 VanDerWaalsContact O-N 3.08Å
373	N	89.4	Confident	88.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.3	-30.9	177.5	-72.8	-22.3	0	0	0	112.4	C369 V371 K376 I377 Y405 L425 D426 C428	C369-N373 WeakPolarHBondContact O-CB 3.28Å; C369-N373 PolarHBondContact O-N 2.68Å; V371-N373 VanDerWaalsContact C-N 3.35Å; V371-N373 PolarHBondContact O-N 2.94Å; N373-K376 PolarHBondContact O-N 2.96Å; N373-K376 PolarHBondContact OD1-NZ 3.49Å; N373-I377 WeakPolarHBondContact O-CB 3.29Å; N373-I377 WeakPolarHBondContact O-CD1 3.33Å; N373-I377 WeakPolarHBondContact O-CG1 3.32Å; N373-I377 PolarHBondContact O-N 3.18Å; N373-Y405 HydrophobicContact CB-CE2 3.54Å; N373-Y405 VanDerWaalsContact CB-OH 3.25Å; N373-Y405 WeakPolarHBondContact CB-OH 3.41Å; N373-Y405 PolarHBondContact ND2-OH 3.49Å; N373-L425 HydrophobicContact CB-CD2 4.16Å; N373-D426 PolarHBondContact ND2-N 3.32Å; N373-D426 VanDerWaalsContact ND2-N 3.12Å; N373-D426 PolarHBondContact ND2-O 3.46Å; N373-D426 VanDerWaalsContact ND2-O 3.1Å; N373-C428 PolarHBondContact ND2-SG 2.78Å
374	A	87.3	Confident	87.5	Confident	9 Å²	9	55.4 Å²	55.4	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-40.6	171.8	0	0	0	0	0	111.8	V370 V371 E372 I377 L378 F397 L400	V370-A374 VanDerWaalsContact O-CB 3.25Å; V370-A374 WeakPolarHBondContact O-CB 3.29Å; V370-A374 PolarHBondContact O-N 2.91Å; V371-A374 WeakPolarHBondContact O-CB 3.47Å; V371-A374 PolarHBondContact O-N 3.41Å; E372-A374 VanDerWaalsContact C-N 3.35Å; A374-I377 PolarHBondContact O-N 3.31Å; A374-L378 WeakPolarHBondContact O-CB 3.34Å; A374-L378 WeakPolarHBondContact O-CG 3.46Å; A374-L378 PolarHBondContact O-N 2.92Å; A374-F397 HydrophobicContact CB-CD1 4.48Å; A374-L400 HydrophobicContact CB-CD2 3.58Å
375	E	87.9	Confident	87	Confident	130 Å²	130	57.6 Å²	57.6	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-63.6	-43	174.7	-71.5	-177.2	178.1	0	0	112	V371 E372 I377 L378 G379	V371-E375 PolarHBondContact O-N 3.22Å; E372-E375 PolarHBondContact O-N 3.35Å; E375-I377 VanDerWaalsContact C-N 3.35Å; E375-I377 PolarHBondContact O-N 3.48Å; E375-L378 PolarHBondContact O-N 3.35Å; E375-G379 PolarHBondContact O-N 2.73Å
376	K	87.4	Confident	86.7	Confident	75 Å²	75	56.4 Å²	56.4	33%	0.326	31%	0.31	S	S	.	.	H	α-helix	trans	-58.1	-47.2	172.7	-68.4	175.3	-169.7	163.3	0	111.3	E372 N373 L378 G379 Y380 G424 L425	E372-K376 WeakPolarHBondContact O-CG 3.36Å; E372-K376 PolarHBondContact O-N 2.94Å; E372-K376 VanDerWaalsContact O-N 3.08Å; N373-K376 PolarHBondContact O-N 2.96Å; N373-K376 PolarHBondContact OD1-NZ 3.49Å; K376-L378 PolarHBondContact O-N 2.91Å; K376-G379 WeakPolarHBondContact O-CA 3.39Å; K376-G379 PolarHBondContact O-N 3.46Å; K376-G379 VanDerWaalsContact O-N 3.13Å; K376-Y380 HydrophobicContact CB-CE2 4.24Å; K376-Y380 WeakPolarHBondContact O-CD2 3.49Å; K376-Y380 PolarHBondContact O-N 3.34Å; K376-G424 PolarHBondContact NZ-O 3.31Å; K376-L425 HydrophobicContact CB-CD2 4.16Å; K376-L425 HydrophobicContact CD-CD2 4.31Å
377	I	86.7	Confident	86.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.4	-44.4	178.5	-70.5	166.9	0	0	0	110.8	N373 A374 E375 G379 Y380 L381 L386 F397 Y405 M408 I412 L425	N373-I377 WeakPolarHBondContact O-CB 3.29Å; N373-I377 WeakPolarHBondContact O-CD1 3.33Å; N373-I377 WeakPolarHBondContact O-CG1 3.32Å; N373-I377 PolarHBondContact O-N 3.18Å; A374-I377 PolarHBondContact O-N 3.31Å; E375-I377 VanDerWaalsContact C-N 3.35Å; E375-I377 PolarHBondContact O-N 3.48Å; I377-G379 VanDerWaalsContact C-N 3.29Å; I377-G379 PolarHBondContact O-N 2.99Å; I377-Y380 PolarHBondContact O-N 3.4Å; I377-Y380 VanDerWaalsContact O-N 3.11Å; I377-L381 HydrophobicContact CG2-CD1 4.04Å; I377-L381 HydrophobicContact CG2-CG 4.39Å; I377-L381 VanDerWaalsContact O-CG 3.29Å; I377-L381 WeakPolarHBondContact O-CG 3.33Å; I377-L381 PolarHBondContact O-N 3.38Å; I377-L386 HydrophobicContact CG2-CD2 4.27Å; I377-F397 HydrophobicContact CG2-CE1 4.3Å; I377-F397 HydrophobicContact CG2-CZ 4.39Å; I377-Y405 HydrophobicContact CD1-CE2 3.97Å; I377-M408 HydrophobicContact CD1-CE 3.44Å; I377-M408 VanDerWaalsContact CD1-CE 3.44Å; I377-M408 HydrophobicContact CD1-CG 4.49Å; I377-M408 HydrophobicContact CD1-SD 3.97Å; I377-M408 HydrophobicContact CG2-SD 4.1Å; I377-I412 HydrophobicContact CD1-CD1 3.99Å; I377-I412 HydrophobicContact CG1-CD1 4.39Å; I377-L425 HydrophobicContact CD1-CD1 4.16Å; I377-L425 HydrophobicContact CD1-CD2 4.23Å; I377-L425 HydrophobicContact CG1-CD1 4Å; I377-L425 HydrophobicContact CG1-CD2 3.85Å
378	L	85.8	Confident	85.5	Confident	62 Å²	62	62.2 Å²	62.2	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-58.8	-40.5	173.7	-75.5	170	0	0	0	112.1	A374 E375 K376 L381 N382 F397	A374-L378 WeakPolarHBondContact O-CB 3.34Å; A374-L378 WeakPolarHBondContact O-CG 3.46Å; A374-L378 PolarHBondContact O-N 2.92Å; E375-L378 PolarHBondContact O-N 3.35Å; K376-L378 PolarHBondContact O-N 2.91Å; L378-L381 HydrophobicContact CD2-CD1 4.31Å; L378-L381 PolarHBondContact O-N 3.37Å; L378-N382 WeakPolarHBondContact O-CB 3.12Å; L378-N382 VanDerWaalsContact O-CG 3.29Å; L378-N382 PolarHBondContact O-N 3.44Å; L378-N382 PolarHBondContact O-ND2 3.42Å; L378-F397 HydrophobicContact CD1-CB 4.28Å; L378-F397 HydrophobicContact CD1-CD1 4.07Å; L378-F397 HydrophobicContact CD1-CG 4.26Å; L378-F397 HydrophobicContact CD2-CB 4.38Å; L378-F397 HydrophobicContact CD2-CD1 3.88Å; L378-F397 HydrophobicContact CD2-CD2 3.86Å; L378-F397 HydrophobicContact CD2-CE1 4.08Å; L378-F397 HydrophobicContact CD2-CE2 4.06Å; L378-F397 HydrophobicContact CD2-CG 3.77Å; L378-F397 HydrophobicContact CD2-CZ 4.17Å; L378-F397 HydrophobicContact CG-CD1 3.84Å; L378-F397 HydrophobicContact CG-CE1 4.08Å; L378-F397 HydrophobicContact CG-CG 4.18Å
379	G	86.3	Confident	84.8	Confident	32 Å²	32	67.1 Å²	67.1	33%	0.33	36%	0.361	S	S	.	.	H	α-helix	trans	-59	-44.9	171.6	0	0	0	0	0	112.9	E375 K376 I377 N382 T383	E375-G379 PolarHBondContact O-N 2.73Å; K376-G379 WeakPolarHBondContact O-CA 3.39Å; K376-G379 PolarHBondContact O-N 3.46Å; K376-G379 VanDerWaalsContact O-N 3.13Å; I377-G379 VanDerWaalsContact C-N 3.29Å; I377-G379 PolarHBondContact O-N 2.99Å; G379-N382 PolarHBondContact O-N 3.33Å; G379-T383 WeakPolarHBondContact O-CG2 3.43Å; G379-T383 PolarHBondContact O-N 3.31Å; G379-T383 PolarHBondContact O-OG1 3.45Å
380	Y	86	Confident	84.1	Confident	65 Å²	65	67.5 Å²	67.5	26%	0.255	36%	0.361	S	S	.	.	H	α-helix	trans	-69	-32	177.8	-64.9	-46.5	0	0	0	113.8	K376 I377 T383 G384 V385 L386 L423	K376-Y380 HydrophobicContact CB-CE2 4.24Å; K376-Y380 WeakPolarHBondContact O-CD2 3.49Å; K376-Y380 PolarHBondContact O-N 3.34Å; I377-Y380 PolarHBondContact O-N 3.4Å; I377-Y380 VanDerWaalsContact O-N 3.11Å; Y380-T383 WeakPolarHBondContact CA-OG1 3.4Å; Y380-T383 PolarHBondContact O-OG1 3.21Å; Y380-G384 PolarHBondContact O-N 2.87Å; Y380-V385 HydrophobicContact CD1-CB 4.31Å; Y380-V385 HydrophobicContact CD1-CG1 4.39Å; Y380-V385 PolarHBondContact O-N 2.91Å; Y380-L386 PolarHBondContact O-N 3.33Å; Y380-L423 HydrophobicContact CD1-CD2 4.46Å; Y380-L423 HydrophobicContact CD2-CD2 3.88Å; Y380-L423 HydrophobicContact CE1-CD2 4.41Å; Y380-L423 HydrophobicContact CE2-CB 4.27Å; Y380-L423 HydrophobicContact CE2-CD2 3.81Å; Y380-L423 HydrophobicContact CG-CD2 4.22Å; Y380-L423 PolarHBondContact OH-O 3.5Å
381	L	85.3	Confident	83.6	Confident	17 Å²	17	68.5 Å²	68.5	9%	0.089	37%	0.367	C	S	.	.	H	α-helix	trans	-68.7	-40.9	172.8	-67.8	164.6	0	0	0	111.6	I377 L378 T383 G384 L386 R388 I391 F397	I377-L381 HydrophobicContact CG2-CD1 4.04Å; I377-L381 HydrophobicContact CG2-CG 4.39Å; I377-L381 VanDerWaalsContact O-CG 3.29Å; I377-L381 WeakPolarHBondContact O-CG 3.33Å; I377-L381 PolarHBondContact O-N 3.38Å; L378-L381 HydrophobicContact CD2-CD1 4.31Å; L378-L381 PolarHBondContact O-N 3.37Å; L381-T383 VanDerWaalsContact C-N 3.33Å; L381-G384 PolarHBondContact O-N 3.43Å; L381-L386 HydrophobicContact CD2-CB 3.87Å; L381-L386 HydrophobicContact CD2-CD2 4.39Å; L381-L386 HydrophobicContact CG-CB 4.35Å; L381-R388 HydrophobicContact CD2-CG 4Å; L381-I391 HydrophobicContact CD1-CD1 3.4Å; L381-I391 HydrophobicContact CD2-CD1 3.66Å; L381-I391 HydrophobicContact CG-CD1 4.14Å; L381-F397 HydrophobicContact CD1-CE2 4.27Å; L381-F397 HydrophobicContact CD1-CZ 3.92Å
382	N	85.9	Confident	83.1	Confident	125 Å²	125	66.2 Å²	66.2	67%	0.668	35%	0.353	S	S	*	.	H	α-helix	trans	-70.5	-30.8	179.8	-73.8	-22	0	0	0	112.5	L378 G379 G384	L378-N382 WeakPolarHBondContact O-CB 3.12Å; L378-N382 VanDerWaalsContact O-CG 3.29Å; L378-N382 PolarHBondContact O-N 3.44Å; L378-N382 PolarHBondContact O-ND2 3.42Å; G379-N382 PolarHBondContact O-N 3.33Å; N382-G384 VanDerWaalsContact C-N 3.34Å
383	T	85.6	Confident	82.3	Confident	100 Å²	100	66.9 Å²	66.9	61%	0.613	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.2	175.8	50.9	0	0	0	0	113.4	G379 Y380 L381 V385	G379-T383 WeakPolarHBondContact O-CG2 3.43Å; G379-T383 PolarHBondContact O-N 3.31Å; G379-T383 PolarHBondContact O-OG1 3.45Å; Y380-T383 WeakPolarHBondContact CA-OG1 3.4Å; Y380-T383 PolarHBondContact O-OG1 3.21Å; L381-T383 VanDerWaalsContact C-N 3.33Å; T383-V385 VanDerWaalsContact C-N 3.29Å; T383-V385 PolarHBondContact O-N 3.47Å
384	G	78.2	Confident	81.8	Confident	58 Å²	58	72.3 Å²	72.3	60%	0.598	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	9.6	178.5	0	0	0	0	0	115	Y380 L381 N382 L386	Y380-G384 PolarHBondContact O-N 2.87Å; L381-G384 PolarHBondContact O-N 3.43Å; N382-G384 VanDerWaalsContact C-N 3.34Å; G384-L386 VanDerWaalsContact C-N 3.33Å
385	V	79.9	Confident	81.4	Confident	70 Å²	70	72.7 Å²	72.7	42%	0.424	40%	0.396	S	S	.	.	S	Bend	trans	-70	-34.7	175.5	177.5	0	0	0	0	111	Y380 T383 K416 L423	Y380-V385 HydrophobicContact CD1-CB 4.31Å; Y380-V385 HydrophobicContact CD1-CG1 4.39Å; Y380-V385 PolarHBondContact O-N 2.91Å; T383-V385 VanDerWaalsContact C-N 3.29Å; T383-V385 PolarHBondContact O-N 3.47Å; V385-K416 PolarHBondContact O-NZ 3.46Å; V385-L423 HydrophobicContact CG1-CD2 4.34Å
386	L	80.6	Confident	80.9	Confident	6 Å²	6	71.1 Å²	71.1	3%	0.031	39%	0.392	C	S	.	.	S	Bend	trans	-111.7	139.2	173	-125.7	83.2	0	0	0	110.4	I377 Y380 L381 G384 I412 L423	I377-L386 HydrophobicContact CG2-CD2 4.27Å; Y380-L386 PolarHBondContact O-N 3.33Å; L381-L386 HydrophobicContact CD2-CB 3.87Å; L381-L386 HydrophobicContact CD2-CD2 4.39Å; L381-L386 HydrophobicContact CG-CB 4.35Å; G384-L386 VanDerWaalsContact C-N 3.33Å; L386-I412 HydrophobicContact CD1-CG2 4.44Å; L386-I412 HydrophobicContact CD2-CD1 3.76Å; L386-I412 HydrophobicContact CD2-CG1 4.05Å; L386-L423 HydrophobicContact CD1-CD1 4.33Å
387	S	79.4	Confident	80.5	Confident	68 Å²	68	70.4 Å²	70.4	48%	0.476	39%	0.389	S	S	.	.			trans	-88.8	139.4	173.5	-53.6	0	0	0	0	110.3	E389 L390	S387-E389 PolarHBondContact O-N 2.95Å; S387-E389 VanDerWaalsContact O-N 3.09Å; S387-L390 PolarHBondContact O-N 2.84Å; S387-L390 VanDerWaalsContact O-N 3.08Å
388	R	76.8	Confident	79.9	Confident	184 Å²	184	74.3 Å²	74.3	69%	0.694	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-60.9	-18.3	177.4	-72.4	-176.6	-176.7	-175.7	0.8	113.7	L381 L390 I391	L381-R388 HydrophobicContact CD2-CG 4Å; R388-L390 PolarHBondContact O-N 2.96Å; R388-I391 PolarHBondContact O-N 2.81Å
389	E	73.4	Confident	79.3	Confident	186 Å²	186	79 Å²	79	87%	0.869	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-67.8	-19.7	175.7	-63.5	-177.6	174.7	0	0	113.5	S387 I391	S387-E389 PolarHBondContact O-N 2.95Å; S387-E389 VanDerWaalsContact O-N 3.09Å; E389-I391 PolarHBondContact O-N 2.8Å
390	L	76.6	Confident	79.1	Confident	30 Å²	30	79.3 Å²	79.3	16%	0.157	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-76.3	-10.5	176.3	-85.3	72.5	0	0	0	112.8	S387 R388 P392 V411 V415	S387-L390 PolarHBondContact O-N 2.84Å; S387-L390 VanDerWaalsContact O-N 3.08Å; R388-L390 PolarHBondContact O-N 2.96Å; L390-P392 WeakPolarHBondContact O-CD 3.41Å; L390-V411 WeakPolarHBondContact O-CG1 3.09Å; L390-V415 HydrophobicContact CD2-CB 4.07Å; L390-V415 HydrophobicContact CD2-CG1 3.85Å; L390-V415 HydrophobicContact CG-CG1 4.31Å
391	I	78.9	Confident	79	Confident	25 Å²	25	79.7 Å²	79.7	13%	0.128	44%	0.44	C	S	.	.	S	Bend	trans	-95.9	122.2	-176.2	-60.4	157.9	0	0	0	108.6	L381 R388 E389 S393 I395 F397 M408	L381-I391 HydrophobicContact CD1-CD1 3.4Å; L381-I391 HydrophobicContact CD2-CD1 3.66Å; L381-I391 HydrophobicContact CG-CD1 4.14Å; R388-I391 PolarHBondContact O-N 2.81Å; E389-I391 PolarHBondContact O-N 2.8Å; I391-S393 PolarHBondContact O-N 3.06Å; I391-I395 HydrophobicContact CG2-CB 4.14Å; I391-I395 HydrophobicContact CG2-CG2 4.44Å; I391-F397 HydrophobicContact CD1-CE2 3.93Å; I391-F397 HydrophobicContact CD1-CZ 3.73Å; I391-F397 HydrophobicContact CG1-CZ 4.43Å; I391-F397 HydrophobicContact CG2-CE2 4.42Å; I391-F397 HydrophobicContact CG2-CZ 4.43Å; I391-M408 HydrophobicContact CG1-SD 4.4Å
392	P	78.6	Confident	78.9	Confident	32 Å²	32	80.7 Å²	80.7	21%	0.208	45%	0.451	C	S	.	.			trans	-51.9	135	172.8	-26.1	31.7	0	0	0	112.3	L390 H394 I395	L390-P392 WeakPolarHBondContact O-CD 3.41Å; P392-H394 WeakPolarHBondContact CB-CE1 3.37Å; P392-H394 WeakPolarHBondContact CB-ND1 3.32Å; P392-H394 PolarHBondContact O-N 3.19Å; P392-I395 HydrophobicContact CB-CD1 3.91Å; P392-I395 HydrophobicContact CB-CG1 4.1Å; P392-I395 HydrophobicContact CG-CD1 3.79Å; P392-I395 PolarHBondContact O-N 3.5Å; P392-I395 VanDerWaalsContact O-N 3.08Å
393	S	72.1	Confident	78.8	Confident	131 Å²	131	81.4 Å²	81.4	92%	0.916	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.9	-171	50.1	0	0	0	0	115.3	I391	I391-S393 PolarHBondContact O-N 3.06Å
394	H	78.8	Confident	78.8	Confident	113 Å²	113	78 Å²	78	52%	0.523	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.5	177.8	62.4	-77.6	0	0	0	113.7	P392 D404 E407	P392-H394 WeakPolarHBondContact CB-CE1 3.37Å; P392-H394 WeakPolarHBondContact CB-ND1 3.32Å; P392-H394 PolarHBondContact O-N 3.19Å; H394-D404 IonicContact CD2-OD1 2.84Å; H394-E407 IonicContact CE1-OE2 2.84Å; H394-E407 PolarHBondContact CE1-OE2 3.27Å; H394-E407 IonicContact NE2-OE2 2.66Å; H394-E407 PolarHBondContact NE2-OE2 3.21Å
395	I	79.1	Confident	79.3	Confident	17 Å²	17	75.3 Å²	75.3	9%	0.087	40%	0.4	C	S	.	.			trans	-84.2	124.4	-172.8	-61.5	-178.1	0	0	0	110.5	I391 P392 L400 D404 M408	I391-I395 HydrophobicContact CG2-CB 4.14Å; I391-I395 HydrophobicContact CG2-CG2 4.44Å; P392-I395 HydrophobicContact CB-CD1 3.91Å; P392-I395 HydrophobicContact CB-CG1 4.1Å; P392-I395 HydrophobicContact CG-CD1 3.79Å; P392-I395 PolarHBondContact O-N 3.5Å; P392-I395 VanDerWaalsContact O-N 3.08Å; I395-L400 HydrophobicContact CG2-CD1 3.42Å; I395-L400 VanDerWaalsContact CG2-CD1 3.42Å; I395-D404 HydrophobicContact CD1-CB 4.14Å; I395-D404 WeakPolarHBondContact CD1-O 3.33Å; I395-D404 HydrophobicContact CG1-CB 4.14Å; I395-D404 HydrophobicContact CG2-CB 4.44Å; I395-M408 HydrophobicContact CD1-CB 4.2Å
396	N	78.2	Confident	79.6	Confident	97 Å²	97	75.1 Å²	75.1	52%	0.519	40%	0.401	S	S	.	.			trans	-116.5	119.4	174	-175.4	-12.9	0	0	0	110.1	S398 H399	N396-S398 PolarHBondContact ND2-OG 3.38Å; N396-S398 VanDerWaalsContact ND2-OG 3.15Å; N396-S398 PolarHBondContact O-N 3.08Å; N396-S398 PolarHBondContact OD1-N 3.42Å; N396-S398 VanDerWaalsContact OD1-N 3.08Å; N396-S398 PolarHBondContact OD1-OG 2.85Å; N396-H399 CarbonylContact O-C 3.6Å; N396-H399 PolarHBondContact O-N 2.84Å; N396-H399 VanDerWaalsContact O-N 3.13Å
397	F	77.7	Confident	79.9	Confident	60 Å²	60	78.6 Å²	78.6	26%	0.263	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.1	-178.7	-69.3	-81.6	0	0	0	114.9	A374 I377 L378 L381 I391 M408	A374-F397 HydrophobicContact CB-CD1 4.48Å; I377-F397 HydrophobicContact CG2-CE1 4.3Å; I377-F397 HydrophobicContact CG2-CZ 4.39Å; L378-F397 HydrophobicContact CD1-CB 4.28Å; L378-F397 HydrophobicContact CD1-CD1 4.07Å; L378-F397 HydrophobicContact CD1-CG 4.26Å; L378-F397 HydrophobicContact CD2-CB 4.38Å; L378-F397 HydrophobicContact CD2-CD1 3.88Å; L378-F397 HydrophobicContact CD2-CD2 3.86Å; L378-F397 HydrophobicContact CD2-CE1 4.08Å; L378-F397 HydrophobicContact CD2-CE2 4.06Å; L378-F397 HydrophobicContact CD2-CG 3.77Å; L378-F397 HydrophobicContact CD2-CZ 4.17Å; L378-F397 HydrophobicContact CG-CD1 3.84Å; L378-F397 HydrophobicContact CG-CE1 4.08Å; L378-F397 HydrophobicContact CG-CG 4.18Å; L381-F397 HydrophobicContact CD1-CE2 4.27Å; L381-F397 HydrophobicContact CD1-CZ 3.92Å; I391-F397 HydrophobicContact CD1-CE2 3.93Å; I391-F397 HydrophobicContact CD1-CZ 3.73Å; I391-F397 HydrophobicContact CG1-CZ 4.43Å; I391-F397 HydrophobicContact CG2-CE2 4.42Å; I391-F397 HydrophobicContact CG2-CZ 4.43Å; F397-M408 HydrophobicContact CE1-CE 4.46Å; F397-M408 HydrophobicContact CE1-SD 4.26Å; F397-M408 HydrophobicContact CZ-SD 4.29Å
398	S	74.4	Confident	80.2	Confident	82 Å²	82	75.4 Å²	75.4	57%	0.573	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-26.1	175.6	56.4	0	0	0	0	114.1	N396	N396-S398 PolarHBondContact ND2-OG 3.38Å; N396-S398 VanDerWaalsContact ND2-OG 3.15Å; N396-S398 PolarHBondContact O-N 3.08Å; N396-S398 PolarHBondContact OD1-N 3.42Å; N396-S398 VanDerWaalsContact OD1-N 3.08Å; N396-S398 PolarHBondContact OD1-OG 2.85Å
399	H	74.3	Confident	80.7	Confident	162 Å²	162	68 Å²	68	75%	0.75	37%	0.367	S	S	*	.	S	Bend	trans	-138.3	72.2	178.5	-75.3	-77.1	0	0	0	108.8	N396	N396-H399 CarbonylContact O-C 3.6Å; N396-H399 PolarHBondContact O-N 2.84Å; N396-H399 VanDerWaalsContact O-N 3.13Å
400	L	82.2	Confident	81.4	Confident	37 Å²	37	60.5 Å²	60.5	19%	0.194	34%	0.34	C	S	.	.			trans	-86.6	125.4	-179	-160.1	76.1	0	0	0	110.5	V370 A374 I395 D404 Y405 M408	V370-L400 HydrophobicContact CG1-CD2 3.63Å; V370-L400 HydrophobicContact CG1-CG 4.18Å; A374-L400 HydrophobicContact CB-CD2 3.58Å; I395-L400 HydrophobicContact CG2-CD1 3.42Å; I395-L400 VanDerWaalsContact CG2-CD1 3.42Å; L400-D404 HydrophobicContact CD1-CB 4.06Å; L400-Y405 HydrophobicContact CD2-CD2 4.41Å; L400-M408 HydrophobicContact CD2-CE 4.46Å
401	T	82.9	Confident	81.9	Confident	73 Å²	73	61.8 Å²	61.8	45%	0.448	35%	0.349	S	S	.	.			trans	-92.9	160.3	170.1	72.2	0	0	0	0	111.2	Q403 D404 Y405	T401-Q403 PolarHBondContact O-N 3.14Å; T401-D404 WeakPolarHBondContact CB-OD2 3.49Å; T401-D404 PolarHBondContact N-OD2 2.85Å; T401-D404 VanDerWaalsContact N-OD2 3.08Å; T401-D404 PolarHBondContact O-N 3.36Å; T401-D404 PolarHBondContact OG1-N 2.86Å; T401-D404 PolarHBondContact OG1-OD2 3.15Å; T401-Y405 PolarHBondContact O-N 3.38Å
402	A	82.9	Confident	82.2	Confident	39 Å²	39	60.6 Å²	60.6	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-30.6	175.2	0	0	0	0	0	112.8	N366 V370 S406	N366-A402 WeakPolarHBondContact ND2-CB 3.25Å; V370-A402 HydrophobicContact CG2-CB 4.18Å; A402-S406 PolarHBondContact O-N 2.6Å
403	Q	84.2	Confident	82.6	Confident	139 Å²	139	64.3 Å²	64.3	65%	0.65	36%	0.356	S	S	*	.	H	α-helix	trans	-70.1	-44.7	176.6	-172.6	173.6	-13.3	0	0	111.5	T401 Y405 S406 E407	T401-Q403 PolarHBondContact O-N 3.14Å; Q403-Y405 VanDerWaalsContact C-N 3.25Å; Q403-Y405 PolarHBondContact O-N 3.33Å; Q403-S406 PolarHBondContact O-N 2.88Å; Q403-S406 VanDerWaalsContact O-N 3.15Å; Q403-E407 PolarHBondContact O-N 3.14Å; Q403-E407 VanDerWaalsContact O-N 3.08Å
404	D	86.3	Confident	83.2	Confident	30 Å²	30	62.9 Å²	62.9	16%	0.16	34%	0.342	C	S	.	.	H	α-helix	trans	-59.1	-40.5	175.2	-58.6	-43.7	0	0	0	111.2	H394 I395 L400 T401 M408	H394-D404 IonicContact CD2-OD1 2.84Å; I395-D404 HydrophobicContact CD1-CB 4.14Å; I395-D404 WeakPolarHBondContact CD1-O 3.33Å; I395-D404 HydrophobicContact CG1-CB 4.14Å; I395-D404 HydrophobicContact CG2-CB 4.44Å; L400-D404 HydrophobicContact CD1-CB 4.06Å; T401-D404 WeakPolarHBondContact CB-OD2 3.49Å; T401-D404 PolarHBondContact N-OD2 2.85Å; T401-D404 VanDerWaalsContact N-OD2 3.08Å; T401-D404 PolarHBondContact O-N 3.36Å; T401-D404 PolarHBondContact OG1-N 2.86Å; T401-D404 PolarHBondContact OG1-OD2 3.15Å; D404-M408 WeakPolarHBondContact O-CB 3.44Å; D404-M408 PolarHBondContact O-N 3.14Å
405	Y	88.3	Confident	83.6	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-44.2	175.4	179.5	-99.7	0	0	0	112.4	V370 N373 I377 L400 T401 Q403 E407 M408 Y409 D426 C428	V370-Y405 HydrophobicContact CB-CG 4.45Å; V370-Y405 HydrophobicContact CG1-CD2 4.45Å; V370-Y405 HydrophobicContact CG1-CG 4.11Å; V370-Y405 HydrophobicContact CG2-CD1 3.99Å; V370-Y405 HydrophobicContact CG2-CG 4.03Å; N373-Y405 HydrophobicContact CB-CE2 3.54Å; N373-Y405 VanDerWaalsContact CB-OH 3.25Å; N373-Y405 WeakPolarHBondContact CB-OH 3.41Å; N373-Y405 PolarHBondContact ND2-OH 3.49Å; I377-Y405 HydrophobicContact CD1-CE2 3.97Å; L400-Y405 HydrophobicContact CD2-CD2 4.41Å; T401-Y405 PolarHBondContact O-N 3.38Å; Q403-Y405 VanDerWaalsContact C-N 3.25Å; Q403-Y405 PolarHBondContact O-N 3.33Å; Y405-E407 VanDerWaalsContact C-N 3.31Å; Y405-E407 PolarHBondContact O-N 2.65Å; Y405-M408 HydrophobicContact CD2-CE 3.73Å; Y405-M408 HydrophobicContact CE2-CE 4.22Å; Y405-M408 PolarHBondContact O-N 3.13Å; Y405-Y409 HydrophobicContact CE1-CD2 4.15Å; Y405-Y409 HydrophobicContact CE1-CG 4.47Å; Y405-Y409 VanDerWaalsContact O-CB 3.23Å; Y405-Y409 WeakPolarHBondContact O-CB 3.34Å; Y405-Y409 PolarHBondContact O-N 3.19Å; Y405-D426 WeakPolarHBondContact CE1-O 3.46Å; Y405-D426 PolarHBondContact OH-O 3.36Å; Y405-C428 HydrophobicContact CD1-CB 3.99Å; Y405-C428 HydrophobicContact CE1-CB 3.81Å
406	S	86.7	Confident	83.7	Confident	65 Å²	65	64.1 Å²	64.1	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-40.5	179.4	-170.2	0	0	0	0	112.1	A402 Q403 G410	A402-S406 PolarHBondContact O-N 2.6Å; Q403-S406 PolarHBondContact O-N 2.88Å; Q403-S406 VanDerWaalsContact O-N 3.15Å; S406-G410 PolarHBondContact O-N 3.27Å
407	E	85.9	Confident	83.8	Confident	80 Å²	80	66.7 Å²	66.7	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-49.9	174	-70.4	179.3	-173.1	0	0	111.3	H394 Q403 Y405 Y409 G410 V411	H394-E407 IonicContact CE1-OE2 2.84Å; H394-E407 PolarHBondContact CE1-OE2 3.27Å; H394-E407 IonicContact NE2-OE2 2.66Å; H394-E407 PolarHBondContact NE2-OE2 3.21Å; Q403-E407 PolarHBondContact O-N 3.14Å; Q403-E407 VanDerWaalsContact O-N 3.08Å; Y405-E407 VanDerWaalsContact C-N 3.31Å; Y405-E407 PolarHBondContact O-N 2.65Å; E407-Y409 VanDerWaalsContact C-N 3.34Å; E407-Y409 PolarHBondContact O-N 2.75Å; E407-G410 PolarHBondContact O-N 2.97Å; E407-V411 WeakPolarHBondContact O-CG2 3.45Å; E407-V411 PolarHBondContact O-N 3.5Å
408	M	86.5	Confident	83.8	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-60.3	-43.9	177.8	179.6	174	56.3	0	0	111.7	I377 I391 I395 F397 L400 D404 Y405 G410 V411 I412	I377-M408 HydrophobicContact CD1-CE 3.44Å; I377-M408 VanDerWaalsContact CD1-CE 3.44Å; I377-M408 HydrophobicContact CD1-CG 4.49Å; I377-M408 HydrophobicContact CD1-SD 3.97Å; I377-M408 HydrophobicContact CG2-SD 4.1Å; I391-M408 HydrophobicContact CG1-SD 4.4Å; I395-M408 HydrophobicContact CD1-CB 4.2Å; F397-M408 HydrophobicContact CE1-CE 4.46Å; F397-M408 HydrophobicContact CE1-SD 4.26Å; F397-M408 HydrophobicContact CZ-SD 4.29Å; L400-M408 HydrophobicContact CD2-CE 4.46Å; D404-M408 WeakPolarHBondContact O-CB 3.44Å; D404-M408 PolarHBondContact O-N 3.14Å; Y405-M408 HydrophobicContact CD2-CE 3.73Å; Y405-M408 HydrophobicContact CE2-CE 4.22Å; Y405-M408 PolarHBondContact O-N 3.13Å; M408-G410 PolarHBondContact O-N 3Å; M408-V411 PolarHBondContact O-N 3.23Å; M408-I412 HydrophobicContact CG-CD1 3.67Å; M408-I412 HydrophobicContact CG-CG1 4.4Å; M408-I412 WeakPolarHBondContact O-CB 3.42Å; M408-I412 WeakPolarHBondContact O-CG1 3.31Å; M408-I412 PolarHBondContact O-N 3.2Å; M408-I412 HydrophobicContact SD-CD1 4.48Å
409	Y	87.5	Confident	84	Confident	28 Å²	28	69.9 Å²	69.9	11%	0.11	38%	0.378	C	S	.	.	H	α-helix	trans	-59.2	-46.6	176.2	180	-86.7	0	0	0	111.2	Y405 E407 V411 I412 K413 F420 L425 P427	Y405-Y409 HydrophobicContact CE1-CD2 4.15Å; Y405-Y409 HydrophobicContact CE1-CG 4.47Å; Y405-Y409 VanDerWaalsContact O-CB 3.23Å; Y405-Y409 WeakPolarHBondContact O-CB 3.34Å; Y405-Y409 PolarHBondContact O-N 3.19Å; E407-Y409 VanDerWaalsContact C-N 3.34Å; E407-Y409 PolarHBondContact O-N 2.75Å; Y409-V411 PolarHBondContact O-N 2.87Å; Y409-I412 PolarHBondContact O-N 2.98Å; Y409-K413 HydrophobicContact CE1-CD 3.93Å; Y409-K413 VanDerWaalsContact O-CB 3.23Å; Y409-K413 WeakPolarHBondContact O-CB 3.34Å; Y409-K413 PolarHBondContact O-N 3.32Å; Y409-F420 HydrophobicContact CD2-CZ 4.18Å; Y409-F420 HydrophobicContact CE1-CZ 4.23Å; Y409-F420 HydrophobicContact CE2-CE1 4.29Å; Y409-F420 HydrophobicContact CE2-CE2 4.47Å; Y409-F420 AromaticContact CE2-CZ 3.52Å; Y409-F420 HydrophobicContact CE2-CZ 3.52Å; Y409-F420 AromaticContact CZ-CE1 3.98Å; Y409-F420 AromaticContact CZ-CZ 3.52Å; Y409-L425 HydrophobicContact CD2-CB 4.36Å; Y409-L425 HydrophobicContact CE2-CB 4.14Å; Y409-L425 WeakPolarHBondContact CE2-O 3.34Å; Y409-P427 HydrophobicContact CE1-CB 3.93Å; Y409-P427 HydrophobicContact CE2-CB 4.23Å
410	G	87	Confident	84.4	Confident	30 Å²	30	63.4 Å²	63.4	31%	0.309	35%	0.348	S	S	.	.	H	α-helix	trans	-58.2	-48	176.7	0	0	0	0	0	112.3	S406 E407 M408 K413 T414	S406-G410 PolarHBondContact O-N 3.27Å; E407-G410 PolarHBondContact O-N 2.97Å; M408-G410 PolarHBondContact O-N 3Å; G410-K413 PolarHBondContact O-N 3.39Å; G410-T414 PolarHBondContact O-N 3.12Å; G410-T414 PolarHBondContact O-OG1 3.45Å; G410-T414 VanDerWaalsContact O-OG1 3.1Å
411	V	87	Confident	84.2	Confident	56 Å²	56	65.1 Å²	65.1	34%	0.339	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-48.6	178.1	174.6	0	0	0	0	111.3	L390 E407 M408 Y409 K413 T414 V415	L390-V411 WeakPolarHBondContact O-CG1 3.09Å; E407-V411 WeakPolarHBondContact O-CG2 3.45Å; E407-V411 PolarHBondContact O-N 3.5Å; M408-V411 PolarHBondContact O-N 3.23Å; Y409-V411 PolarHBondContact O-N 2.87Å; V411-K413 VanDerWaalsContact C-N 3.3Å; V411-K413 PolarHBondContact O-N 3.44Å; V411-T414 PolarHBondContact O-N 3.27Å; V411-V415 HydrophobicContact CG1-CG2 4.31Å; V411-V415 VanDerWaalsContact O-CG2 3.3Å; V411-V415 WeakPolarHBondContact O-CG2 3.46Å; V411-V415 PolarHBondContact O-N 2.93Å
412	I	85.3	Confident	84	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-42.5	-180	-65.8	167.8	0	0	0	110.4	I377 L386 M408 Y409 V415 K416 F420 L423 L425	I377-I412 HydrophobicContact CD1-CD1 3.99Å; I377-I412 HydrophobicContact CG1-CD1 4.39Å; L386-I412 HydrophobicContact CD1-CG2 4.44Å; L386-I412 HydrophobicContact CD2-CD1 3.76Å; L386-I412 HydrophobicContact CD2-CG1 4.05Å; M408-I412 HydrophobicContact CG-CD1 3.67Å; M408-I412 HydrophobicContact CG-CG1 4.4Å; M408-I412 WeakPolarHBondContact O-CB 3.42Å; M408-I412 WeakPolarHBondContact O-CG1 3.31Å; M408-I412 PolarHBondContact O-N 3.2Å; M408-I412 HydrophobicContact SD-CD1 4.48Å; Y409-I412 PolarHBondContact O-N 2.98Å; I412-V415 PolarHBondContact O-N 3Å; I412-K416 WeakPolarHBondContact O-CB 3.47Å; I412-K416 PolarHBondContact O-N 3.36Å; I412-F420 HydrophobicContact CG2-CD2 4.04Å; I412-F420 HydrophobicContact CG2-CE2 3.95Å; I412-L423 HydrophobicContact CG2-CD1 3.98Å; I412-L425 HydrophobicContact CG2-CD1 4.34Å
413	K	86.6	Confident	83.9	Confident	110 Å²	110	68.2 Å²	68.2	48%	0.478	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-44.1	178.6	-174.9	175.3	178.7	177.3	0	112.3	Y409 G410 V411 E417 F420	Y409-K413 HydrophobicContact CE1-CD 3.93Å; Y409-K413 VanDerWaalsContact O-CB 3.23Å; Y409-K413 WeakPolarHBondContact O-CB 3.34Å; Y409-K413 PolarHBondContact O-N 3.32Å; G410-K413 PolarHBondContact O-N 3.39Å; V411-K413 VanDerWaalsContact C-N 3.3Å; V411-K413 PolarHBondContact O-N 3.44Å; K413-E417 PolarHBondContact O-N 3.36Å; K413-F420 HydrophobicContact CB-CD2 4.1Å; K413-F420 HydrophobicContact CB-CE1 4.45Å; K413-F420 HydrophobicContact CB-CE2 3.83Å; K413-F420 HydrophobicContact CB-CZ 4.03Å; K413-F420 HydrophobicContact CD-CE1 4.38Å; K413-F420 HydrophobicContact CG-CD1 4.25Å; K413-F420 HydrophobicContact CG-CD2 4.46Å; K413-F420 HydrophobicContact CG-CE1 4.19Å; K413-F420 HydrophobicContact CG-CE2 4.39Å; K413-F420 HydrophobicContact CG-CG 4.38Å; K413-F420 HydrophobicContact CG-CZ 4.27Å
414	T	85.9	Confident	83.9	Confident	102 Å²	102	63.6 Å²	63.6	63%	0.626	37%	0.367	S	S	*	.	H	α-helix	trans	-69.7	-37.4	178.8	-57.4	0	0	0	0	112.5	G410 V411	G410-T414 PolarHBondContact O-N 3.12Å; G410-T414 PolarHBondContact O-OG1 3.45Å; G410-T414 VanDerWaalsContact O-OG1 3.1Å; V411-T414 PolarHBondContact O-N 3.27Å
415	V	85.8	Confident	83.9	Confident	88 Å²	88	62.8 Å²	62.8	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-80.5	-33.8	-175.9	176.1	0	0	0	0	112.6	L390 V411 I412	L390-V415 HydrophobicContact CD2-CB 4.07Å; L390-V415 HydrophobicContact CD2-CG1 3.85Å; L390-V415 HydrophobicContact CG-CG1 4.31Å; V411-V415 HydrophobicContact CG1-CG2 4.31Å; V411-V415 VanDerWaalsContact O-CG2 3.3Å; V411-V415 WeakPolarHBondContact O-CG2 3.46Å; V411-V415 PolarHBondContact O-N 2.93Å; I412-V415 PolarHBondContact O-N 3Å
416	K	81.4	Confident	83.8	Confident	68 Å²	68	66.8 Å²	66.8	30%	0.296	38%	0.384	S	S	.	.	H	α-helix	trans	-103.2	8.8	-173.2	-72.4	-76.7	-172	167.9	0	114.3	V385 I412 D418 S419 F420	V385-K416 PolarHBondContact O-NZ 3.46Å; I412-K416 WeakPolarHBondContact O-CB 3.47Å; I412-K416 PolarHBondContact O-N 3.36Å; K416-D418 PolarHBondContact O-N 3.38Å; K416-S419 WeakPolarHBondContact CD-OG 3.29Å; K416-S419 WeakPolarHBondContact O-CA 3.44Å; K416-S419 PolarHBondContact O-N 3.38Å; K416-S419 PolarHBondContact O-OG 3.1Å; K416-F420 PolarHBondContact O-N 3.06Å; K416-F420 VanDerWaalsContact O-N 3.12Å
417	E	81.6	Confident	83.7	Confident	150 Å²	150	65.9 Å²	65.9	70%	0.701	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-8.2	-71.2	-176.9	-89.4	-178.8	154.4	0	0	115.1	K413 S419 F420	K413-E417 PolarHBondContact O-N 3.36Å; E417-S419 PolarHBondContact O-N 2.95Å; E417-F420 PolarHBondContact O-N 3.46Å
418	D	77.7	Confident	83.8	Confident	168 Å²	168	62.6 Å²	62.6	90%	0.898	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-66.9	-27.5	-175.2	-62.6	-35.6	0	0	0	115.6	K416	K416-D418 PolarHBondContact O-N 3.38Å
419	S	79.1	Confident	83.9	Confident	42 Å²	42	66.3 Å²	66.3	29%	0.294	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-104.1	-3.4	-177	60.6	0	0	0	0	113.7	K416 E417 G421 Q422	K416-S419 WeakPolarHBondContact CD-OG 3.29Å; K416-S419 WeakPolarHBondContact O-CA 3.44Å; K416-S419 PolarHBondContact O-N 3.38Å; K416-S419 PolarHBondContact O-OG 3.1Å; E417-S419 PolarHBondContact O-N 2.95Å; S419-G421 PolarHBondContact O-N 3.43Å; S419-Q422 PolarHBondContact O-N 2.99Å
420	F	82.1	Confident	83.9	Confident	25 Å²	25	67 Å²	67	11%	0.11	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-62.2	-40.5	-174.1	-176.4	-101	0	0	0	113	Y409 I412 K413 K416 E417 Q422 L423 L425	Y409-F420 HydrophobicContact CD2-CZ 4.18Å; Y409-F420 HydrophobicContact CE1-CZ 4.23Å; Y409-F420 HydrophobicContact CE2-CE1 4.29Å; Y409-F420 HydrophobicContact CE2-CE2 4.47Å; Y409-F420 AromaticContact CE2-CZ 3.52Å; Y409-F420 HydrophobicContact CE2-CZ 3.52Å; Y409-F420 AromaticContact CZ-CE1 3.98Å; Y409-F420 AromaticContact CZ-CZ 3.52Å; I412-F420 HydrophobicContact CG2-CD2 4.04Å; I412-F420 HydrophobicContact CG2-CE2 3.95Å; K413-F420 HydrophobicContact CB-CD2 4.1Å; K413-F420 HydrophobicContact CB-CE1 4.45Å; K413-F420 HydrophobicContact CB-CE2 3.83Å; K413-F420 HydrophobicContact CB-CZ 4.03Å; K413-F420 HydrophobicContact CD-CE1 4.38Å; K413-F420 HydrophobicContact CG-CD1 4.25Å; K413-F420 HydrophobicContact CG-CD2 4.46Å; K413-F420 HydrophobicContact CG-CE1 4.19Å; K413-F420 HydrophobicContact CG-CE2 4.39Å; K413-F420 HydrophobicContact CG-CG 4.38Å; K413-F420 HydrophobicContact CG-CZ 4.27Å; K416-F420 PolarHBondContact O-N 3.06Å; K416-F420 VanDerWaalsContact O-N 3.12Å; E417-F420 PolarHBondContact O-N 3.46Å; F420-Q422 PolarHBondContact O-N 2.91Å; F420-Q422 VanDerWaalsContact O-N 3.11Å; F420-L423 HydrophobicContact CD2-CD1 4.23Å; F420-L423 WeakPolarHBondContact O-CB 3.18Å; F420-L423 PolarHBondContact O-N 2.98Å; F420-L425 HydrophobicContact CE2-CD1 4.43Å; F420-L425 HydrophobicContact CZ-CB 4.41Å
421	G	76.6	Confident	83.8	Confident	73 Å²	73	69.1 Å²	69.1	75%	0.753	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-61.9	-20.1	179.5	0	0	0	0	0	114.4	S419	S419-G421 PolarHBondContact O-N 3.43Å
422	Q	80.3	Confident	83.7	Confident	166 Å²	166	70.3 Å²	70.3	78%	0.776	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-82.1	-14.9	177.7	-60.4	179	8.8	0	0	113	S419 F420	S419-Q422 PolarHBondContact O-N 2.99Å; F420-Q422 PolarHBondContact O-N 2.91Å; F420-Q422 VanDerWaalsContact O-N 3.11Å
423	L	81.1	Confident	83.8	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.058	41%	0.405	C	S	.	.	S	Bend	trans	-81.6	-17	-178.4	-64.2	168.6	0	0	0	113	Y380 V385 L386 I412 F420 L425	Y380-L423 HydrophobicContact CD1-CD2 4.46Å; Y380-L423 HydrophobicContact CD2-CD2 3.88Å; Y380-L423 HydrophobicContact CE1-CD2 4.41Å; Y380-L423 HydrophobicContact CE2-CB 4.27Å; Y380-L423 HydrophobicContact CE2-CD2 3.81Å; Y380-L423 HydrophobicContact CG-CD2 4.22Å; Y380-L423 PolarHBondContact OH-O 3.5Å; V385-L423 HydrophobicContact CG1-CD2 4.34Å; L386-L423 HydrophobicContact CD1-CD1 4.33Å; I412-L423 HydrophobicContact CG2-CD1 3.98Å; F420-L423 HydrophobicContact CD2-CD1 4.23Å; F420-L423 WeakPolarHBondContact O-CB 3.18Å; F420-L423 PolarHBondContact O-N 2.98Å; L423-L425 VanDerWaalsContact C-N 3.27Å; L423-L425 HydrophobicContact CB-CD1 4.2Å; L423-L425 HydrophobicContact CB-CG 4.03Å; L423-L425 HydrophobicContact CD1-CD1 4.45Å; L423-L425 PolarHBondContact O-N 2.89Å
424	G	83.4	Confident	83.7	Confident	43 Å²	43	68.1 Å²	68.1	44%	0.443	39%	0.385	S	S	.	.			trans	55.8	39.9	178	0	0	0	0	0	113.8	K376	K376-G424 PolarHBondContact NZ-O 3.31Å
425	L	85.9	Confident	83.5	Confident	12 Å²	12	66.4 Å²	66.4	6%	0.063	37%	0.372	C	S	.	.			trans	-94.9	128.3	177.1	-62.1	175.9	0	0	0	110.1	N373 K376 I377 Y409 I412 F420 L423	N373-L425 HydrophobicContact CB-CD2 4.16Å; K376-L425 HydrophobicContact CB-CD2 4.16Å; K376-L425 HydrophobicContact CD-CD2 4.31Å; I377-L425 HydrophobicContact CD1-CD1 4.16Å; I377-L425 HydrophobicContact CD1-CD2 4.23Å; I377-L425 HydrophobicContact CG1-CD1 4Å; I377-L425 HydrophobicContact CG1-CD2 3.85Å; Y409-L425 HydrophobicContact CD2-CB 4.36Å; Y409-L425 HydrophobicContact CE2-CB 4.14Å; Y409-L425 WeakPolarHBondContact CE2-O 3.34Å; I412-L425 HydrophobicContact CG2-CD1 4.34Å; F420-L425 HydrophobicContact CE2-CD1 4.43Å; F420-L425 HydrophobicContact CZ-CB 4.41Å; L423-L425 VanDerWaalsContact C-N 3.27Å; L423-L425 HydrophobicContact CB-CD1 4.2Å; L423-L425 HydrophobicContact CB-CG 4.03Å; L423-L425 HydrophobicContact CD1-CD1 4.45Å; L423-L425 PolarHBondContact O-N 2.89Å
426	D	86.1	Confident	83.2	Confident	85 Å²	85	68.3 Å²	68.3	46%	0.455	37%	0.374	S	S	.	.			trans	-93	143.9	178.9	-57.8	-63.8	0	0	0	110.9	N373 Y405 C428	N373-D426 PolarHBondContact ND2-N 3.32Å; N373-D426 VanDerWaalsContact ND2-N 3.12Å; N373-D426 PolarHBondContact ND2-O 3.46Å; N373-D426 VanDerWaalsContact ND2-O 3.1Å; Y405-D426 WeakPolarHBondContact CE1-O 3.46Å; Y405-D426 PolarHBondContact OH-O 3.36Å; D426-C428 PolarHBondContact O-N 3.14Å; D426-C428 VanDerWaalsContact O-N 3.14Å; D426-C428 PolarHBondContact O-SG 3.48Å
427	P	84.7	Confident	82.4	Confident	46 Å²	46	67.2 Å²	67.2	30%	0.299	38%	0.377	S	S	.	.			trans	-68.4	-12.8	-174.5	28.8	-36.3	0	0	0	114.6	Y409 I429	Y409-P427 HydrophobicContact CE1-CB 3.93Å; Y409-P427 HydrophobicContact CE2-CB 4.23Å; P427-I429 HydrophobicContact CB-CD1 3.97Å; P427-I429 HydrophobicContact CB-CG1 4.03Å; P427-I429 HydrophobicContact CG-CD1 4.38Å; P427-I429 PolarHBondContact O-N 3.13Å
428	C	88.1	Confident	81.8	Confident	12 Å²	12	61.9 Å²	61.9	8%	0.081	35%	0.354	C	S	.	.			trans	41.6	62.6	-179.4	-51.5	0	0	0	0	113	N366 C369 V370 N373 Y405 D426	N366-C428 PolarHBondContact OD1-O 3.34Å; C369-C428 HydrophobicContact CB-CB 3.85Å; C369-C428 WeakPolarHBondContact CB-SG 3.49Å; C369-C428 PolarHBondContact O-SG 3.17Å; C369-C428 VanDerWaalsContact SG-CA 3.57Å; C369-C428 WeakPolarHBondContact SG-CB 3.5Å; C369-C428 CovalentContact SG-SG 2.05Å; C369-C428 PolarHBondContact SG-SG 3.38Å; V370-C428 HydrophobicContact CG2-CB 3.87Å; N373-C428 PolarHBondContact ND2-SG 2.78Å; Y405-C428 HydrophobicContact CD1-CB 3.99Å; Y405-C428 HydrophobicContact CE1-CB 3.81Å; D426-C428 PolarHBondContact O-N 3.14Å; D426-C428 VanDerWaalsContact O-N 3.14Å; D426-C428 PolarHBondContact O-SG 3.48Å
429	I	88.1	Confident	81.3	Confident	77 Å²	77	58 Å²	58	40%	0.395	33%	0.331	S	S	.	.			trans	-98.9	123.7	-179.3	-60.6	170.6	0	0	0	109.2	P427 E431 D432 E433	P427-I429 HydrophobicContact CB-CD1 3.97Å; P427-I429 HydrophobicContact CB-CG1 4.03Å; P427-I429 HydrophobicContact CG-CD1 4.38Å; P427-I429 PolarHBondContact O-N 3.13Å; I429-E431 VanDerWaalsContact C-N 3.3Å; I429-E431 HydrophobicContact CG2-CB 4.12Å; I429-E431 PolarHBondContact O-N 2.85Å; I429-D432 HydrophobicContact CB-CB 4.42Å; I429-D432 WeakPolarHBondContact O-CB 3.43Å; I429-D432 PolarHBondContact O-N 3.24Å; I429-D432 VanDerWaalsContact O-N 3.12Å; I429-E433 PolarHBondContact O-N 3.34Å
430	L	87.9	Confident	81	Confident	42 Å²	42	57.2 Å²	57.2	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-58.9	-39.5	-179.2	-178.3	65.5	0	0	0	113.1	D282 A362 N363 N366 D432 E433 L434	D282-L430 HydrophobicContact CB-CD2 4.35Å; A362-L430 HydrophobicContact CB-CD1 3.83Å; N363-L430 HydrophobicContact CB-CD1 4.46Å; N366-L430 HydrophobicContact CB-CD1 4.24Å; L430-D432 VanDerWaalsContact C-N 3.26Å; L430-D432 PolarHBondContact O-N 3.15Å; L430-E433 PolarHBondContact O-N 3.07Å; L430-L434 HydrophobicContact CD2-CD1 4.44Å; L430-L434 HydrophobicContact CG-CD1 4.01Å; L430-L434 HydrophobicContact CG-CG 4.48Å; L430-L434 PolarHBondContact O-N 3.46Å
431	E	85.1	Confident	80.9	Confident	76 Å²	76	57.2 Å²	57.2	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-30.5	179.7	-176.4	59.7	-161.2	0	0	111.9	H286 K291 I429 L434 N435	H286-E431 IonicContact CE1-OE1 3.36Å; H286-E431 PolarHBondContact CE1-OE1 3.05Å; H286-E431 IonicContact CE1-OE2 3.67Å; H286-E431 IonicContact ND1-OE1 3.29Å; H286-E431 PolarHBondContact ND1-OE1 3.29Å; H286-E431 IonicContact ND1-OE2 3.29Å; H286-E431 PolarHBondContact ND1-OE2 3.44Å; K291-E431 IonicContact NZ-OE1 2.92Å; I429-E431 VanDerWaalsContact C-N 3.3Å; I429-E431 HydrophobicContact CG2-CB 4.12Å; I429-E431 PolarHBondContact O-N 2.85Å; E431-L434 PolarHBondContact O-N 3.33Å; E431-N435 WeakPolarHBondContact CG-ND2 3.27Å; E431-N435 VanDerWaalsContact O-CB 3.31Å; E431-N435 WeakPolarHBondContact O-CB 3.23Å; E431-N435 VanDerWaalsContact O-CG 3.27Å; E431-N435 PolarHBondContact O-N 3Å; E431-N435 PolarHBondContact O-ND2 3.47Å; E431-N435 PolarHBondContact OE1-ND2 3.36Å
432	D	85.6	Confident	81.3	Confident	81 Å²	81	54 Å²	54	43%	0.433	30%	0.298	S	S	.	.	H	α-helix	trans	-69.8	-40.9	175.1	-68.3	-19.3	0	0	0	110.7	I429 L430 N435 K436	I429-D432 HydrophobicContact CB-CB 4.42Å; I429-D432 WeakPolarHBondContact O-CB 3.43Å; I429-D432 PolarHBondContact O-N 3.24Å; I429-D432 VanDerWaalsContact O-N 3.12Å; L430-D432 VanDerWaalsContact C-N 3.26Å; L430-D432 PolarHBondContact O-N 3.15Å; D432-N435 PolarHBondContact O-N 3.43Å; D432-K436 WeakPolarHBondContact O-CG 3.44Å; D432-K436 PolarHBondContact O-N 3.39Å; D432-K436 VanDerWaalsContact O-N 3.13Å
433	E	86.3	Confident	81.6	Confident	50 Å²	50	46.1 Å²	46.1	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-37.2	174.1	-63.6	-55.2	143.9	0	0	112.5	A362 I429 L430 K436	A362-E433 HydrophobicContact CB-CB 3.9Å; I429-E433 PolarHBondContact O-N 3.34Å; L430-E433 PolarHBondContact O-N 3.07Å; E433-K436 PolarHBondContact O-N 2.89Å; E433-K436 IonicContact OE1-NZ 3.19Å; E433-K436 PolarHBondContact OE1-NZ 3.49Å; E433-K436 WeakPolarHBondContact OE2-CD 3.24Å; E433-K436 IonicContact OE2-NZ 3.65Å; E433-K436 PolarHBondContact OE2-NZ 3.23Å
434	L	84.7	Confident	81.9	Confident	13 Å²	13	45.7 Å²	45.7	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-31.8	174.7	-75.4	167.3	0	0	0	112.7	Q94 H286 A362 L430 E431	Q94-L434 PolarHBondContact NE2-O 2.93Å; H286-L434 HydrophobicContact CB-CD1 4.4Å; A362-L434 HydrophobicContact CB-CD2 3.81Å; A362-L434 HydrophobicContact CB-CG 3.88Å; L430-L434 HydrophobicContact CD2-CD1 4.44Å; L430-L434 HydrophobicContact CG-CD1 4.01Å; L430-L434 HydrophobicContact CG-CG 4.48Å; L430-L434 PolarHBondContact O-N 3.46Å; E431-L434 PolarHBondContact O-N 3.33Å
435	N	82.6	Confident	82.3	Confident	67 Å²	67	43.6 Å²	43.6	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-82.2	-10.6	177.7	-75.5	-53.7	0	0	0	113.4	H286 K291 E431 D432 A437	H286-N435 PolarHBondContact CE1-OD1 3.2Å; K291-N435 PolarHBondContact NZ-OD1 2.9Å; E431-N435 WeakPolarHBondContact CG-ND2 3.27Å; E431-N435 VanDerWaalsContact O-CB 3.31Å; E431-N435 WeakPolarHBondContact O-CB 3.23Å; E431-N435 VanDerWaalsContact O-CG 3.27Å; E431-N435 PolarHBondContact O-N 3Å; E431-N435 PolarHBondContact O-ND2 3.47Å; E431-N435 PolarHBondContact OE1-ND2 3.36Å; D432-N435 PolarHBondContact O-N 3.43Å; N435-A437 VanDerWaalsContact C-N 3.26Å; N435-A437 PolarHBondContact O-N 2.97Å
436	K	80	Confident	82.6	Confident	128 Å²	128	43.6 Å²	43.6	56%	0.557	24%	0.237	S	C	*	.			trans	-67.2	84.4	170.4	-76.4	175.7	-167.9	170.6	0	110.2	D432 E433	D432-K436 WeakPolarHBondContact O-CG 3.44Å; D432-K436 PolarHBondContact O-N 3.39Å; D432-K436 VanDerWaalsContact O-N 3.13Å; E433-K436 PolarHBondContact O-N 2.89Å; E433-K436 IonicContact OE1-NZ 3.19Å; E433-K436 PolarHBondContact OE1-NZ 3.49Å; E433-K436 WeakPolarHBondContact OE2-CD 3.24Å; E433-K436 IonicContact OE2-NZ 3.65Å; E433-K436 PolarHBondContact OE2-NZ 3.23Å
437	A	62.7	Low	82.7	Confident	44 Å²	44	39.6 Å²	39.6	36%	0.364	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-77.1	123.8	173.5	0	0	0	0	0	110	Y91 Q94 N435	Y91-A437 HydrophobicContact CD2-CB 4.46Å; Y91-A437 HydrophobicContact CE2-CB 4.32Å; Q94-A437 HydrophobicContact CG-CB 4.23Å; N435-A437 VanDerWaalsContact C-N 3.26Å; N435-A437 PolarHBondContact O-N 2.97Å
438	V	69.7	Low	83	Confident	38 Å²	38	37.6 Å²	37.6	23%	0.23	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-88	125.5	171.2	-171.7	0	0	0	0	108.9	Y91 A447	Y91-V438 VanDerWaalsContact CD2-O 3.27Å; Y91-V438 WeakPolarHBondContact CD2-O 3.46Å; V438-A447 HydrophobicContact CG2-CB 3.98Å
439	Q	67	Low	83.2	Confident	88 Å²	88	37.1 Å²	37.1	41%	0.411	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-74.2	137.8	-174	-174.7	167.7	-0.3	0	0	112.7	Y91 T441 G442 N602	Y91-Q439 HydrophobicContact CE1-CG 4.29Å; Y91-Q439 HydrophobicContact CE2-CB 4.04Å; Y91-Q439 HydrophobicContact CE2-CG 4.23Å; Y91-Q439 WeakPolarHBondContact OH-CG 3.31Å; Q439-T441 PolarHBondContact O-N 3.47Å; Q439-G442 PolarHBondContact O-N 3.12Å; Q439-G442 VanDerWaalsContact O-N 3.1Å; Q439-N602 PolarHBondContact OE1-ND2 3.47Å
440	G	73.6	Confident	83.3	Confident	25 Å²	25	34.8 Å²	34.8	26%	0.258	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-122.4	166.6	0	0	0	0	0	113.9	G442 L443	G440-G442 VanDerWaalsContact C-N 3.28Å; G440-G442 PolarHBondContact O-N 2.97Å; G440-L443 PolarHBondContact O-N 3.28Å
441	T	80.3	Confident	83.4	Confident	25 Å²	25	32.8 Å²	32.8	15%	0.153	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-23	-177.8	53.6	0	0	0	0	113.4	I163 W166 Q439 L443 A444 F445	I163-T441 HydrophobicContact CD1-CG2 4.19Å; I163-T441 HydrophobicContact CG1-CG2 4.44Å; I163-T441 HydrophobicContact CG2-CG2 4.42Å; W166-T441 HydrophobicContact CE3-CG2 4.43Å; W166-T441 HydrophobicContact CZ3-CG2 3.85Å; Q439-T441 PolarHBondContact O-N 3.47Å; T441-L443 PolarHBondContact O-N 3.34Å; T441-A444 PolarHBondContact O-N 3.12Å; T441-A444 VanDerWaalsContact O-N 3.13Å; T441-F445 VanDerWaalsContact O-CD2 3.28Å; T441-F445 WeakPolarHBondContact O-CD2 3.41Å; T441-F445 PolarHBondContact O-N 3.07Å; T441-F445 VanDerWaalsContact O-N 3.09Å
442	G	84.4	Confident	83.7	Confident	4 Å²	4	29.1 Å²	29.1	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-26.8	177.9	0	0	0	0	0	112.9	Q439 G440 A444 I446 A447	Q439-G442 PolarHBondContact O-N 3.12Å; Q439-G442 VanDerWaalsContact O-N 3.1Å; G440-G442 VanDerWaalsContact C-N 3.28Å; G440-G442 PolarHBondContact O-N 2.97Å; G442-A444 VanDerWaalsContact C-N 3.33Å; G442-A444 PolarHBondContact O-N 3.08Å; G442-I446 WeakPolarHBondContact O-CA 3.43Å; G442-I446 WeakPolarHBondContact O-CB 3.42Å; G442-I446 PolarHBondContact O-N 3.31Å; G442-A447 PolarHBondContact O-N 3.34Å; G442-A447 VanDerWaalsContact O-N 3.11Å
443	L	86	Confident	84	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	15%	0.148	C	C	.	.	I	π-helix	trans	-58.1	-46.4	174.2	-179.7	62.8	0	0	0	111.2	W87 P90 V354 L358 G440 T441 A447 F448	W87-L443 HydrophobicContact CB-CB 4.39Å; W87-L443 HydrophobicContact CB-CD2 4.18Å; W87-L443 VanDerWaalsContact O-CD2 3.29Å; W87-L443 WeakPolarHBondContact O-CD2 3.46Å; P90-L443 HydrophobicContact CB-CD2 4.24Å; V354-L443 HydrophobicContact CG1-CD1 4.26Å; V354-L443 HydrophobicContact CG1-CD2 4.2Å; L358-L443 HydrophobicContact CD1-CD1 4.09Å; L358-L443 HydrophobicContact CD2-CD1 4.22Å; G440-L443 PolarHBondContact O-N 3.28Å; T441-L443 PolarHBondContact O-N 3.34Å; L443-A447 HydrophobicContact CD1-CB 4.19Å; L443-A447 PolarHBondContact O-N 3.05Å; L443-F448 HydrophobicContact CD1-CD2 4.39Å; L443-F448 HydrophobicContact CD1-CE2 4.48Å; L443-F448 HydrophobicContact CG-CD2 4.34Å; L443-F448 HydrophobicContact CG-CE2 4.43Å; L443-F448 WeakPolarHBondContact O-CD2 3.46Å; L443-F448 PolarHBondContact O-N 3.15Å
444	A	87.9	Confident	84.1	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.008	15%	0.153	C	C	.	.	I	π-helix	trans	-77.8	-43.6	-179.5	0	0	0	0	0	113	W87 T441 G442 F448 F465 L469	W87-A444 HydrophobicContact CB-CB 4.49Å; W87-A444 HydrophobicContact CE3-CB 3.91Å; T441-A444 PolarHBondContact O-N 3.12Å; T441-A444 VanDerWaalsContact O-N 3.13Å; G442-A444 VanDerWaalsContact C-N 3.33Å; G442-A444 PolarHBondContact O-N 3.08Å; A444-F448 WeakPolarHBondContact O-CB 3.34Å; A444-F465 HydrophobicContact CB-CE1 4.42Å; A444-F465 HydrophobicContact CB-CZ 4.19Å; A444-L469 HydrophobicContact CB-CD1 4.29Å
445	F	92.2	Very high	84.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	I	π-helix	trans	-91	-15.6	-171.5	-64.7	-74	0	0	0	114.7	I163 W166 Y170 W209 T441 T449 F466	I163-F445 HydrophobicContact CG2-CE2 3.99Å; I163-F445 HydrophobicContact CG2-CZ 4.22Å; W166-F445 HydrophobicContact CB-CE1 3.94Å; W166-F445 HydrophobicContact CB-CE2 4.23Å; W166-F445 HydrophobicContact CB-CZ 3.62Å; W166-F445 HydrophobicContact CE3-CE2 4.1Å; Y170-F445 HydrophobicContact CD1-CD1 4.41Å; Y170-F445 AromaticContact CD2-CD1 3.57Å; Y170-F445 HydrophobicContact CD2-CD1 3.57Å; Y170-F445 AromaticContact CD2-CE1 3.78Å; Y170-F445 HydrophobicContact CD2-CE1 3.78Å; Y170-F445 HydrophobicContact CE1-CD1 4.38Å; Y170-F445 AromaticContact CE2-CD1 3.54Å; Y170-F445 HydrophobicContact CE2-CD1 3.54Å; Y170-F445 HydrophobicContact CE2-CE1 4.15Å; Y170-F445 HydrophobicContact CE2-CG 4.35Å; Y170-F445 HydrophobicContact CG-CD1 4.02Å; Y170-F445 HydrophobicContact CG-CE1 4.27Å; Y170-F445 AromaticContact CZ-CD1 3.97Å; W209-F445 HydrophobicContact CD2-CB 4.02Å; W209-F445 HydrophobicContact CE3-CB 3.53Å; W209-F445 HydrophobicContact CE3-CD1 4.35Å; W209-F445 HydrophobicContact CE3-CD2 4.44Å; W209-F445 AromaticContact CE3-CG 3.88Å; W209-F445 HydrophobicContact CE3-CG 3.88Å; W209-F445 HydrophobicContact CH2-CB 4.16Å; W209-F445 AromaticContact CH2-CD2 3.58Å; W209-F445 HydrophobicContact CH2-CD2 3.58Å; W209-F445 HydrophobicContact CH2-CE2 4.11Å; W209-F445 AromaticContact CH2-CG 3.85Å; W209-F445 HydrophobicContact CH2-CG 3.85Å; W209-F445 HydrophobicContact CZ2-CD2 4.34Å; W209-F445 HydrophobicContact CZ3-CB 3.6Å; W209-F445 AromaticContact CZ3-CD1 3.81Å; W209-F445 HydrophobicContact CZ3-CD1 3.81Å; W209-F445 AromaticContact CZ3-CD2 3.64Å; W209-F445 HydrophobicContact CZ3-CD2 3.64Å; W209-F445 HydrophobicContact CZ3-CE1 4.4Å; W209-F445 HydrophobicContact CZ3-CE2 4.28Å; W209-F445 AromaticContact CZ3-CG 3.39Å; W209-F445 HydrophobicContact CZ3-CG 3.39Å; T441-F445 VanDerWaalsContact O-CD2 3.28Å; T441-F445 WeakPolarHBondContact O-CD2 3.41Å; T441-F445 PolarHBondContact O-N 3.07Å; T441-F445 VanDerWaalsContact O-N 3.09Å; F445-T449 VanDerWaalsContact C-OG1 3.24Å; F445-T449 WeakPolarHBondContact O-CG2 3.34Å; F445-T449 PolarHBondContact O-OG1 3.41Å; F445-F466 AromaticContact CD1-CE1 3.72Å; F445-F466 HydrophobicContact CD1-CE1 3.72Å; F445-F466 HydrophobicContact CD1-CZ 4.28Å; F445-F466 HydrophobicContact CE1-CD1 4.29Å; F445-F466 AromaticContact CE1-CE1 3.63Å; F445-F466 HydrophobicContact CE1-CE1 3.63Å
446	I	91.3	Very high	84.6	Confident	11 Å²	11	28.2 Å²	28.2	6%	0.056	16%	0.159	C	C	.	.	I	π-helix	trans	-116.2	-62.3	178.9	-53.4	173.8	0	0	0	110.5	T206 W209 Y210 G442 T449 E450	T206-I446 VanDerWaalsContact OG1-CG2 3.29Å; T206-I446 WeakPolarHBondContact OG1-CG2 3.48Å; W209-I446 HydrophobicContact CB-CD1 4.43Å; W209-I446 HydrophobicContact CB-CG1 4.05Å; W209-I446 HydrophobicContact CG-CD1 4.2Å; W209-I446 HydrophobicContact CG-CG1 4.06Å; Y210-I446 HydrophobicContact CE2-CD1 4.03Å; G442-I446 WeakPolarHBondContact O-CA 3.43Å; G442-I446 WeakPolarHBondContact O-CB 3.42Å; G442-I446 PolarHBondContact O-N 3.31Å; I446-T449 WeakPolarHBondContact CA-OG1 3.13Å; I446-T449 PolarHBondContact O-OG1 3.23Å; I446-E450 WeakPolarHBondContact O-CB 3.49Å; I446-E450 PolarHBondContact O-N 3.4Å
447	A	89.3	Confident	85.2	Confident	2 Å²	2	25.4 Å²	25.4	2%	0.017	16%	0.16	C	C	.	.	I	π-helix	trans	-69.1	-44.5	-171.7	0	0	0	0	0	112.7	L358 V438 G442 L443 A451	L358-A447 HydrophobicContact CD2-CB 3.99Å; V438-A447 HydrophobicContact CG2-CB 3.98Å; G442-A447 PolarHBondContact O-N 3.34Å; G442-A447 VanDerWaalsContact O-N 3.11Å; L443-A447 HydrophobicContact CD1-CB 4.19Å; L443-A447 PolarHBondContact O-N 3.05Å; A447-A451 PolarHBondContact O-N 3.18Å; A447-A451 VanDerWaalsContact O-N 3.1Å
448	F	89.3	Confident	86.6	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-69.5	-41.9	177.8	-100.7	-93.7	0	0	0	113.2	V354 V357 L443 A444 E450 A451 M452 F465	V354-F448 HydrophobicContact CB-CE2 3.88Å; V354-F448 HydrophobicContact CB-CZ 3.82Å; V354-F448 HydrophobicContact CG1-CE2 3.68Å; V354-F448 HydrophobicContact CG1-CZ 4.14Å; V354-F448 HydrophobicContact CG2-CE2 3.54Å; V354-F448 HydrophobicContact CG2-CZ 3.4Å; V357-F448 HydrophobicContact CB-CE1 4.28Å; V357-F448 HydrophobicContact CG1-CD1 4.25Å; V357-F448 HydrophobicContact CG1-CE1 4.23Å; V357-F448 HydrophobicContact CG2-CE1 4.25Å; L443-F448 HydrophobicContact CD1-CD2 4.39Å; L443-F448 HydrophobicContact CD1-CE2 4.48Å; L443-F448 HydrophobicContact CG-CD2 4.34Å; L443-F448 HydrophobicContact CG-CE2 4.43Å; L443-F448 WeakPolarHBondContact O-CD2 3.46Å; L443-F448 PolarHBondContact O-N 3.15Å; A444-F448 WeakPolarHBondContact O-CB 3.34Å; F448-E450 VanDerWaalsContact C-N 3.26Å; F448-E450 PolarHBondContact O-N 3.43Å; F448-A451 PolarHBondContact O-N 2.78Å; F448-M452 WeakPolarHBondContact O-CG 3.35Å; F448-M452 PolarHBondContact O-N 2.98Å; F448-F465 HydrophobicContact CB-CE1 4.22Å; F448-F465 HydrophobicContact CB-CZ 3.97Å; F448-F465 HydrophobicContact CD1-CD2 4.33Å; F448-F465 AromaticContact CD1-CE2 3.72Å; F448-F465 HydrophobicContact CD1-CE2 3.72Å; F448-F465 AromaticContact CD1-CZ 3.93Å; F448-F465 HydrophobicContact CD1-CZ 3.93Å; F448-F465 AromaticContact CE1-CE2 3.99Å; F448-F465 HydrophobicContact CE1-CE2 3.99Å; F448-F465 HydrophobicContact CG-CE2 4.19Å; F448-F465 AromaticContact CG-CZ 3.93Å; F448-F465 HydrophobicContact CG-CZ 3.93Å
449	T	92.6	Very high	87.9	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-38.7	177.4	51	0	0	0	0	111.3	Y170 F445 I446 M452 T453 F466	Y170-T449 HydrophobicContact CD1-CG2 4.23Å; Y170-T449 HydrophobicContact CE1-CG2 4.02Å; F445-T449 VanDerWaalsContact C-OG1 3.24Å; F445-T449 WeakPolarHBondContact O-CG2 3.34Å; F445-T449 PolarHBondContact O-OG1 3.41Å; I446-T449 WeakPolarHBondContact CA-OG1 3.13Å; I446-T449 PolarHBondContact O-OG1 3.23Å; T449-M452 HydrophobicContact CG2-CE 4.14Å; T449-M452 PolarHBondContact O-N 3.39Å; T449-T453 VanDerWaalsContact O-CG2 3.3Å; T449-T453 WeakPolarHBondContact O-CG2 3.42Å; T449-T453 PolarHBondContact O-N 2.66Å; T449-F466 HydrophobicContact CG2-CE2 3.98Å; T449-F466 HydrophobicContact CG2-CZ 3.5Å; T449-F466 VanDerWaalsContact CG2-CZ 3.5Å
450	E	90.6	Very high	89.2	Confident	28 Å²	28	24.6 Å²	24.6	13%	0.131	15%	0.148	C	C	.	.	H	α-helix	trans	-65.4	-45	175.9	-167.5	-179.8	167.7	0	0	111.8	T205 K361 M365 I446 F448 M452 T453 H454	T205-E450 HydrophobicContact CG2-CB 3.78Å; T205-E450 HydrophobicContact CG2-CG 4.27Å; K361-E450 WeakPolarHBondContact CE-OE2 3.48Å; K361-E450 IonicContact NZ-OE1 2.82Å; K361-E450 IonicContact NZ-OE2 3.73Å; K361-E450 PolarHBondContact NZ-OE2 3.44Å; M365-E450 HydrophobicContact CE-CG 4.15Å; M365-E450 WeakPolarHBondContact CE-OE1 3.43Å; I446-E450 WeakPolarHBondContact O-CB 3.49Å; I446-E450 PolarHBondContact O-N 3.4Å; F448-E450 VanDerWaalsContact C-N 3.26Å; F448-E450 PolarHBondContact O-N 3.43Å; E450-M452 VanDerWaalsContact C-N 3.29Å; E450-M452 PolarHBondContact O-N 2.82Å; E450-T453 PolarHBondContact O-N 2.84Å; E450-T453 PolarHBondContact O-OG1 3.19Å; E450-H454 PolarHBondContact O-CD2 2.94Å
451	A	90	Very high	90.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-37.1	176	0	0	0	0	0	112.3	V357 K361 A447 F448 T453 H454 F455	V357-A451 HydrophobicContact CG1-CB 3.3Å; K361-A451 HydrophobicContact CB-CB 4.23Å; A447-A451 PolarHBondContact O-N 3.18Å; A447-A451 VanDerWaalsContact O-N 3.1Å; F448-A451 PolarHBondContact O-N 2.78Å; A451-T453 VanDerWaalsContact C-N 3.32Å; A451-T453 PolarHBondContact O-N 2.84Å; A451-H454 PolarHBondContact O-N 2.92Å; A451-F455 WeakPolarHBondContact O-CD1 3.4Å
452	M	91	Very high	91	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.6	-26.8	179	-74.3	-172.4	-66.1	0	0	113.6	F270 F448 T449 E450 H454 F455 S458 W461 F465 F466	F270-M452 HydrophobicContact CE1-CG 4.5Å; F270-M452 HydrophobicContact CE1-SD 4.33Å; F270-M452 HydrophobicContact CZ-SD 4.1Å; F448-M452 WeakPolarHBondContact O-CG 3.35Å; F448-M452 PolarHBondContact O-N 2.98Å; T449-M452 HydrophobicContact CG2-CE 4.14Å; T449-M452 PolarHBondContact O-N 3.39Å; E450-M452 VanDerWaalsContact C-N 3.29Å; E450-M452 PolarHBondContact O-N 2.82Å; M452-H454 PolarHBondContact O-N 3.35Å; M452-F455 WeakPolarHBondContact O-CB 3.45Å; M452-F455 PolarHBondContact O-N 3.41Å; M452-F455 VanDerWaalsContact O-N 3.09Å; M452-S458 WeakPolarHBondContact O-CB 3.33Å; M452-W461 HydrophobicContact SD-CB 4.32Å; M452-F465 HydrophobicContact CE-CB 4.21Å; M452-F465 HydrophobicContact CE-CD1 3.7Å; M452-F465 HydrophobicContact CE-CE1 4.33Å; M452-F465 HydrophobicContact CE-CG 4.09Å; M452-F465 HydrophobicContact SD-CB 3.82Å; M452-F465 HydrophobicContact SD-CD1 4.37Å; M452-F465 HydrophobicContact SD-CG 4.14Å; M452-F466 HydrophobicContact CE-CE2 4.22Å
453	T	91.6	Very high	91.6	Very high	31 Å²	31	25.1 Å²	25.1	19%	0.19	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-27.5	176.4	69.9	0	0	0	0	111.8	A182 T449 E450 A451 F455	A182-T453 HydrophobicContact CB-CG2 4.39Å; T449-T453 VanDerWaalsContact O-CG2 3.3Å; T449-T453 WeakPolarHBondContact O-CG2 3.42Å; T449-T453 PolarHBondContact O-N 2.66Å; E450-T453 PolarHBondContact O-N 2.84Å; E450-T453 PolarHBondContact O-OG1 3.19Å; A451-T453 VanDerWaalsContact C-N 3.32Å; A451-T453 PolarHBondContact O-N 2.84Å; T453-F455 VanDerWaalsContact C-N 3.33Å
454	H	89.3	Confident	92.1	Very high	71 Å²	71	26.3 Å²	26.3	33%	0.329	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.9	178	-65.6	-55.3	0	0	0	113.6	F360 M365 K368 E450 A451 M452	F360-H454 HydrophobicContact CE1-CB 3.76Å; F360-H454 HydrophobicContact CZ-CB 3.81Å; M365-H454 WeakPolarHBondContact CE-NE2 3.33Å; K368-H454 PolarHBondContact NZ-CE1 2.96Å; K368-H454 PolarHBondContact NZ-NE2 3.43Å; K368-H454 VanDerWaalsContact NZ-NE2 3.12Å; E450-H454 PolarHBondContact O-CD2 2.94Å; A451-H454 PolarHBondContact O-N 2.92Å; M452-H454 PolarHBondContact O-N 3.35Å
455	F	88.9	Confident	92.5	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.035	15%	0.147	C	C	.	.	S	Bend	trans	-83.7	143.4	175.2	-70.4	5.7	0	0	0	111.4	F270 R273 L277 V357 F360 A451 M452 T453 A457 S458 W461	F270-F455 HydrophobicContact CD1-CE2 4.41Å; F270-F455 HydrophobicContact CE1-CE2 4.12Å; R273-F455 HydrophobicContact CG-CD2 4.36Å; R273-F455 HydrophobicContact CG-CE2 4.16Å; L277-F455 HydrophobicContact CD1-CD1 4.22Å; L277-F455 HydrophobicContact CD1-CE1 3.25Å; L277-F455 HydrophobicContact CD1-CE2 4.48Å; L277-F455 HydrophobicContact CD1-CZ 3.41Å; L277-F455 VanDerWaalsContact CD1-CZ 3.41Å; L277-F455 HydrophobicContact CD2-CD1 4.23Å; L277-F455 HydrophobicContact CD2-CE1 4.03Å; L277-F455 HydrophobicContact CG-CE1 4.27Å; V357-F455 HydrophobicContact CG2-CZ 4.36Å; F360-F455 AromaticContact CD1-CE1 3.82Å; F360-F455 HydrophobicContact CD1-CE1 3.82Å; F360-F455 AromaticContact CE1-CD1 3.98Å; F360-F455 HydrophobicContact CE1-CD1 3.98Å; F360-F455 AromaticContact CE1-CE1 3.65Å; F360-F455 HydrophobicContact CE1-CE1 3.65Å; F360-F455 HydrophobicContact CZ-CE1 4.46Å; A451-F455 WeakPolarHBondContact O-CD1 3.4Å; M452-F455 WeakPolarHBondContact O-CB 3.45Å; M452-F455 PolarHBondContact O-N 3.41Å; M452-F455 VanDerWaalsContact O-N 3.09Å; T453-F455 VanDerWaalsContact C-N 3.33Å; F455-A457 PolarHBondContact O-N 3.23Å; F455-S458 PolarHBondContact O-N 3.02Å; F455-W461 HydrophobicContact CB-CG 4.49Å; F455-W461 HydrophobicContact CD2-CB 4.18Å; F455-W461 AromaticContact CD2-CD1 3.89Å; F455-W461 HydrophobicContact CD2-CD2 4.14Å; F455-W461 AromaticContact CD2-CG 3.79Å; F455-W461 HydrophobicContact CD2-CG 3.79Å
456	P	89.1	Confident	92.7	Very high	82 Å²	82	26.4 Å²	26.4	53%	0.532	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	138.9	166	29.7	-32.9	0	0	0	108.9	W461	P456-W461 PolarHBondContact O-NE1 2.89Å
457	A	91.6	Very high	93	Very high	68 Å²	68	29 Å²	29	56%	0.562	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	47.9	-171	0	0	0	0	0	112.8	F455 P459 F460	F455-A457 PolarHBondContact O-N 3.23Å; A457-P459 VanDerWaalsContact C-N 3.29Å; A457-P459 VanDerWaalsContact O-N 3.14Å; A457-F460 HydrophobicContact CB-CB 4.39Å; A457-F460 WeakPolarHBondContact O-CB 3.41Å; A457-F460 PolarHBondContact O-N 3.45Å
458	S	93.6	Very high	93.3	Very high	11 Å²	11	29 Å²	29	8%	0.077	16%	0.158	C	C	.	.	H	α-helix	trans	-48.6	-36.4	-179.7	57.2	0	0	0	0	115.5	M452 F455 F460 W461 S462	M452-S458 WeakPolarHBondContact O-CB 3.33Å; F455-S458 PolarHBondContact O-N 3.02Å; S458-F460 VanDerWaalsContact C-N 3.33Å; S458-F460 PolarHBondContact O-N 2.92Å; S458-W461 PolarHBondContact O-N 3.05Å; S458-S462 WeakPolarHBondContact O-CB 3.15Å; S458-S462 PolarHBondContact O-N 3.25Å; S458-S462 VanDerWaalsContact O-N 3.1Å
459	P	95.9	Very high	93.6	Very high	27 Å²	27	28.8 Å²	28.8	18%	0.175	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-38.1	175.8	-25	37.4	0	0	0	113.7	S174 Q176 Y177 L179 A457 S462 V463	S174-P459 WeakPolarHBondContact O-CB 3.24Å; Q176-P459 WeakPolarHBondContact O-CG 3.26Å; Y177-P459 HydrophobicContact CD2-CG 3.93Å; L179-P459 HydrophobicContact CD2-CB 4.45Å; L179-P459 HydrophobicContact CD2-CG 4.44Å; A457-P459 VanDerWaalsContact C-N 3.29Å; A457-P459 VanDerWaalsContact O-N 3.14Å; P459-S462 PolarHBondContact O-N 2.87Å; P459-V463 VanDerWaalsContact O-CG2 3.31Å; P459-V463 WeakPolarHBondContact O-CG2 3.49Å; P459-V463 PolarHBondContact O-N 2.94Å
460	F	95.6	Very high	93.7	Very high	116 Å²	116	29.5 Å²	29.5	51%	0.509	16%	0.161	S	C	.	.	H	α-helix	trans	-63	-48.7	-179.3	169.1	-99.4	0	0	0	111.7	A457 S458 S462 V463 M464	A457-F460 HydrophobicContact CB-CB 4.39Å; A457-F460 WeakPolarHBondContact O-CB 3.41Å; A457-F460 PolarHBondContact O-N 3.45Å; S458-F460 VanDerWaalsContact C-N 3.33Å; S458-F460 PolarHBondContact O-N 2.92Å; F460-S462 VanDerWaalsContact C-N 3.33Å; F460-S462 PolarHBondContact O-N 2.78Å; F460-V463 PolarHBondContact O-N 3Å; F460-M464 HydrophobicContact CD1-SD 4.2Å; F460-M464 HydrophobicContact CE1-CG 4.49Å; F460-M464 HydrophobicContact CE1-SD 3.4Å; F460-M464 WeakPolarHBondContact CE1-SD 3.46Å; F460-M464 HydrophobicContact CE2-CG 4.34Å; F460-M464 HydrophobicContact CE2-SD 3.86Å; F460-M464 HydrophobicContact CZ-CG 4.23Å; F460-M464 HydrophobicContact CZ-SD 3.2Å; F460-M464 WeakPolarHBondContact CZ-SD 3.35Å; F460-M464 PolarHBondContact O-N 3.34Å
461	W	95.3	Very high	94	Very high	35 Å²	35	28.6 Å²	28.6	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-40.2	178.4	-64.8	103.8	0	0	0	111.6	C269 F270 R273 M452 F455 P456 S458 M464 F465	C269-W461 HydrophobicContact CB-CZ3 4.36Å; F270-W461 HydrophobicContact CD1-CE3 4.17Å; F270-W461 HydrophobicContact CD2-CE3 4.43Å; F270-W461 HydrophobicContact CE1-CB 4.37Å; F270-W461 AromaticContact CE1-CE3 3.84Å; F270-W461 HydrophobicContact CE1-CE3 3.84Å; F270-W461 HydrophobicContact CE2-CE3 4.12Å; F270-W461 HydrophobicContact CG-CE3 4.46Å; F270-W461 HydrophobicContact CZ-CB 4.11Å; F270-W461 AromaticContact CZ-CE3 3.81Å; F270-W461 HydrophobicContact CZ-CE3 3.81Å; F270-W461 WeakPolarHBondContact CZ-O 3.15Å; R273-W461 HydrophobicContact CB-CH2 3.48Å; R273-W461 VanDerWaalsContact CB-CH2 3.48Å; R273-W461 HydrophobicContact CB-CZ2 3.95Å; R273-W461 HydrophobicContact CB-CZ3 3.89Å; R273-W461 HydrophobicContact CG-CH2 3.69Å; R273-W461 HydrophobicContact CG-CZ2 3.62Å; R273-W461 HydrophobicContact CG-CZ3 4.16Å; M452-W461 HydrophobicContact SD-CB 4.32Å; F455-W461 HydrophobicContact CB-CG 4.49Å; F455-W461 HydrophobicContact CD2-CB 4.18Å; F455-W461 AromaticContact CD2-CD1 3.89Å; F455-W461 HydrophobicContact CD2-CD2 4.14Å; F455-W461 AromaticContact CD2-CG 3.79Å; F455-W461 HydrophobicContact CD2-CG 3.79Å; P456-W461 PolarHBondContact O-NE1 2.89Å; S458-W461 PolarHBondContact O-N 3.05Å; W461-M464 PolarHBondContact O-N 3.45Å; W461-F465 WeakPolarHBondContact O-CB 3.27Å; W461-F465 PolarHBondContact O-N 2.74Å
462	S	96.1	Very high	94.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-46.5	176.2	-169.5	0	0	0	0	112.4	S174 W181 S458 P459 F460 M464 F465 F466	S174-S462 PolarHBondContact OG-OG 3.23Å; W181-S462 VanDerWaalsContact CZ2-OG 3.28Å; W181-S462 WeakPolarHBondContact CZ2-OG 3.31Å; S458-S462 WeakPolarHBondContact O-CB 3.15Å; S458-S462 PolarHBondContact O-N 3.25Å; S458-S462 VanDerWaalsContact O-N 3.1Å; P459-S462 PolarHBondContact O-N 2.87Å; F460-S462 VanDerWaalsContact C-N 3.33Å; F460-S462 PolarHBondContact O-N 2.78Å; S462-M464 PolarHBondContact O-N 3.41Å; S462-F465 PolarHBondContact O-N 3.11Å; S462-F466 VanDerWaalsContact O-CD2 3.24Å; S462-F466 WeakPolarHBondContact O-CD2 3.27Å; S462-F466 PolarHBondContact O-N 3.45Å; S462-F466 WeakPolarHBondContact OG-CD2 3.5Å; S462-F466 WeakPolarHBondContact OG-CE2 3.3Å
463	V	97	Very high	94.4	Very high	30 Å²	30	29.1 Å²	29.1	18%	0.182	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-46.8	176.4	171	0	0	0	0	111	F171 F175 P459 F460 F465 F467	F171-V463 HydrophobicContact CD2-CG1 4.39Å; F171-V463 HydrophobicContact CE2-CG1 3.81Å; F175-V463 HydrophobicContact CD1-CG2 4.19Å; F175-V463 HydrophobicContact CD2-CG2 4.44Å; F175-V463 HydrophobicContact CE1-CG1 4.2Å; F175-V463 HydrophobicContact CE1-CG2 3.98Å; F175-V463 HydrophobicContact CE2-CG2 4.24Å; F175-V463 HydrophobicContact CG-CG2 4.42Å; F175-V463 HydrophobicContact CZ-CG1 3.9Å; F175-V463 HydrophobicContact CZ-CG2 4Å; P459-V463 VanDerWaalsContact O-CG2 3.31Å; P459-V463 WeakPolarHBondContact O-CG2 3.49Å; P459-V463 PolarHBondContact O-N 2.94Å; F460-V463 PolarHBondContact O-N 3Å; V463-F465 PolarHBondContact O-N 2.82Å; V463-F467 WeakPolarHBondContact O-CB 3.33Å; V463-F467 PolarHBondContact O-N 3.05Å
464	M	96	Very high	94.5	Very high	27 Å²	27	28.7 Å²	28.7	13%	0.133	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-44.5	177.5	-74	-173.1	69.1	0	0	112.3	V266 C269 F270 F460 W461 S462 M468	V266-M464 HydrophobicContact CB-CE 4.38Å; V266-M464 HydrophobicContact CG1-CB 4.26Å; V266-M464 HydrophobicContact CG1-CE 4.36Å; V266-M464 HydrophobicContact CG2-CE 3.87Å; C269-M464 HydrophobicContact CB-CE 4.09Å; F270-M464 HydrophobicContact CE2-CB 4.42Å; F460-M464 HydrophobicContact CD1-SD 4.2Å; F460-M464 HydrophobicContact CE1-CG 4.49Å; F460-M464 HydrophobicContact CE1-SD 3.4Å; F460-M464 WeakPolarHBondContact CE1-SD 3.46Å; F460-M464 HydrophobicContact CE2-CG 4.34Å; F460-M464 HydrophobicContact CE2-SD 3.86Å; F460-M464 HydrophobicContact CZ-CG 4.23Å; F460-M464 HydrophobicContact CZ-SD 3.2Å; F460-M464 WeakPolarHBondContact CZ-SD 3.35Å; F460-M464 PolarHBondContact O-N 3.34Å; W461-M464 PolarHBondContact O-N 3.45Å; S462-M464 PolarHBondContact O-N 3.41Å; M464-M468 WeakPolarHBondContact O-CB 3.36Å; M464-M468 PolarHBondContact O-N 3.3Å
465	F	95.7	Very high	94.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-64.1	-52.1	-178.4	-179.9	-106.5	0	0	0	112.1	V86 F270 A444 F448 M452 W461 S462 V463 F467 M468 L469	V86-F465 HydrophobicContact CG1-CE2 4.5Å; F270-F465 HydrophobicContact CE2-CB 3.97Å; F270-F465 HydrophobicContact CE2-CD2 4.41Å; F270-F465 HydrophobicContact CZ-CB 3.81Å; F270-F465 HydrophobicContact CZ-CD2 4.38Å; F270-F465 HydrophobicContact CZ-CG 4.5Å; A444-F465 HydrophobicContact CB-CE1 4.42Å; A444-F465 HydrophobicContact CB-CZ 4.19Å; F448-F465 HydrophobicContact CB-CE1 4.22Å; F448-F465 HydrophobicContact CB-CZ 3.97Å; F448-F465 HydrophobicContact CD1-CD2 4.33Å; F448-F465 AromaticContact CD1-CE2 3.72Å; F448-F465 HydrophobicContact CD1-CE2 3.72Å; F448-F465 AromaticContact CD1-CZ 3.93Å; F448-F465 HydrophobicContact CD1-CZ 3.93Å; F448-F465 AromaticContact CE1-CE2 3.99Å; F448-F465 HydrophobicContact CE1-CE2 3.99Å; F448-F465 HydrophobicContact CG-CE2 4.19Å; F448-F465 AromaticContact CG-CZ 3.93Å; F448-F465 HydrophobicContact CG-CZ 3.93Å; M452-F465 HydrophobicContact CE-CB 4.21Å; M452-F465 HydrophobicContact CE-CD1 3.7Å; M452-F465 HydrophobicContact CE-CE1 4.33Å; M452-F465 HydrophobicContact CE-CG 4.09Å; M452-F465 HydrophobicContact SD-CB 3.82Å; M452-F465 HydrophobicContact SD-CD1 4.37Å; M452-F465 HydrophobicContact SD-CG 4.14Å; W461-F465 WeakPolarHBondContact O-CB 3.27Å; W461-F465 PolarHBondContact O-N 2.74Å; S462-F465 PolarHBondContact O-N 3.11Å; V463-F465 PolarHBondContact O-N 2.82Å; F465-F467 VanDerWaalsContact C-N 3.32Å; F465-F467 PolarHBondContact O-N 3.1Å; F465-M468 HydrophobicContact CD2-CE 3.67Å; F465-M468 HydrophobicContact CE2-CE 3.86Å; F465-M468 WeakPolarHBondContact O-CB 3.35Å; F465-M468 PolarHBondContact O-N 3Å; F465-L469 HydrophobicContact CD1-CD1 4.15Å; F465-L469 HydrophobicContact CE1-CD1 3.59Å; F465-L469 HydrophobicContact CE1-CG 4.3Å; F465-L469 HydrophobicContact CZ-CD1 3.89Å; F465-L469 HydrophobicContact CZ-CD2 4.48Å; F465-L469 HydrophobicContact CZ-CG 4.33Å; F465-L469 PolarHBondContact O-N 3.4Å
466	F	96.9	Very high	94.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-69.6	-31.4	-179.7	-72.6	-65.5	0	0	0	112.4	Y170 F171 W181 F445 T449 M452 S462 L469 I470	Y170-F466 VanDerWaalsContact CB-CE1 3.42Å; Y170-F466 VanDerWaalsContact CB-CZ 3.47Å; Y170-F466 AromaticContact CD1-CE1 3.94Å; Y170-F466 HydrophobicContact CD1-CE1 3.94Å; Y170-F466 AromaticContact CD1-CE2 3.65Å; Y170-F466 HydrophobicContact CD1-CE2 3.65Å; Y170-F466 AromaticContact CD1-CZ 3.27Å; Y170-F466 HydrophobicContact CD1-CZ 3.27Å; Y170-F466 HydrophobicContact CD2-CE1 4.47Å; Y170-F466 HydrophobicContact CE1-CZ 4.14Å; Y170-F466 HydrophobicContact CG-CD1 4.31Å; Y170-F466 AromaticContact CG-CE1 3.71Å; Y170-F466 HydrophobicContact CG-CE1 3.71Å; Y170-F466 HydrophobicContact CG-CE2 4.02Å; Y170-F466 AromaticContact CG-CZ 3.54Å; Y170-F466 HydrophobicContact CG-CZ 3.54Å; F171-F466 HydrophobicContact CB-CB 3.92Å; W181-F466 HydrophobicContact CH2-CE2 4.21Å; W181-F466 HydrophobicContact CZ2-CE2 4.24Å; F445-F466 AromaticContact CD1-CE1 3.72Å; F445-F466 HydrophobicContact CD1-CE1 3.72Å; F445-F466 HydrophobicContact CD1-CZ 4.28Å; F445-F466 HydrophobicContact CE1-CD1 4.29Å; F445-F466 AromaticContact CE1-CE1 3.63Å; F445-F466 HydrophobicContact CE1-CE1 3.63Å; T449-F466 HydrophobicContact CG2-CE2 3.98Å; T449-F466 HydrophobicContact CG2-CZ 3.5Å; T449-F466 VanDerWaalsContact CG2-CZ 3.5Å; M452-F466 HydrophobicContact CE-CE2 4.22Å; S462-F466 VanDerWaalsContact O-CD2 3.24Å; S462-F466 WeakPolarHBondContact O-CD2 3.27Å; S462-F466 PolarHBondContact O-N 3.45Å; S462-F466 WeakPolarHBondContact OG-CD2 3.5Å; S462-F466 WeakPolarHBondContact OG-CE2 3.3Å; F466-L469 HydrophobicContact CD1-CD1 4Å; F466-L469 HydrophobicContact CE1-CD1 4.21Å; F466-L469 PolarHBondContact O-N 3.13Å; F466-I470 VanDerWaalsContact O-CG1 3.26Å; F466-I470 WeakPolarHBondContact O-CG1 3.29Å; F466-I470 PolarHBondContact O-N 3.28Å
467	F	96.9	Very high	95.2	Very high	65 Å²	65	21.5 Å²	21.5	29%	0.285	12%	0.117	S	C	.	.	H	α-helix	trans	-67.5	-37.4	172.4	-168.5	-141.6	0	0	0	112.1	F171 F258 F262 V463 F465 I470 N471	F171-F467 HydrophobicContact CD2-CB 3.95Å; F171-F467 HydrophobicContact CE2-CB 3.77Å; F171-F467 HydrophobicContact CE2-CD2 4.19Å; F171-F467 HydrophobicContact CE2-CG 4.1Å; F258-F467 AromaticContact CE1-CE1 3.85Å; F258-F467 HydrophobicContact CE1-CE1 3.85Å; F258-F467 AromaticContact CE1-CZ 3.61Å; F258-F467 HydrophobicContact CE1-CZ 3.61Å; F258-F467 AromaticContact CZ-CE1 3.74Å; F258-F467 HydrophobicContact CZ-CE1 3.74Å; F258-F467 AromaticContact CZ-CZ 3.94Å; F258-F467 HydrophobicContact CZ-CZ 3.94Å; F262-F467 HydrophobicContact CD1-CD1 4.04Å; F262-F467 HydrophobicContact CD1-CE1 4.23Å; F262-F467 HydrophobicContact CE1-CB 4.13Å; F262-F467 AromaticContact CE1-CD1 3.22Å; F262-F467 HydrophobicContact CE1-CD1 3.22Å; F262-F467 AromaticContact CE1-CE1 3.8Å; F262-F467 HydrophobicContact CE1-CE1 3.8Å; F262-F467 AromaticContact CE1-CG 3.87Å; F262-F467 HydrophobicContact CE1-CG 3.87Å; F262-F467 HydrophobicContact CE2-CD1 4.28Å; F262-F467 HydrophobicContact CE2-CE1 4.41Å; F262-F467 AromaticContact CZ-CD1 3.38Å; F262-F467 HydrophobicContact CZ-CD1 3.38Å; F262-F467 AromaticContact CZ-CE1 3.9Å; F262-F467 HydrophobicContact CZ-CE1 3.9Å; F262-F467 HydrophobicContact CZ-CG 4.35Å; V463-F467 WeakPolarHBondContact O-CB 3.33Å; V463-F467 PolarHBondContact O-N 3.05Å; F465-F467 VanDerWaalsContact C-N 3.32Å; F465-F467 PolarHBondContact O-N 3.1Å; F467-I470 PolarHBondContact O-N 3.46Å; F467-N471 WeakPolarHBondContact CD2-ND2 3.46Å; F467-N471 VanDerWaalsContact CE2-ND2 3.3Å; F467-N471 WeakPolarHBondContact CE2-ND2 3.4Å; F467-N471 PolarHBondContact O-N 3.47Å; F467-N471 VanDerWaalsContact O-N 3.09Å; F467-N471 PolarHBondContact O-ND2 2.57Å
468	M	95.7	Very high	95.4	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-59.3	-47.5	170.2	169.4	-175.2	78.1	0	0	111.3	V86 P263 V266 L267 M464 F465 I470 N471 L472	V86-M468 HydrophobicContact CG1-CE 4.24Å; P263-M468 HydrophobicContact CB-CG 3.86Å; P263-M468 HydrophobicContact CG-CG 4.38Å; V266-M468 HydrophobicContact CB-CB 4.01Å; V266-M468 HydrophobicContact CB-CG 4.26Å; V266-M468 HydrophobicContact CB-SD 3.82Å; V266-M468 HydrophobicContact CG1-CB 3.83Å; V266-M468 HydrophobicContact CG1-CE 4.41Å; V266-M468 HydrophobicContact CG1-CG 4.26Å; V266-M468 HydrophobicContact CG1-SD 3.61Å; V266-M468 HydrophobicContact CG2-CB 4.14Å; L267-M468 HydrophobicContact CD2-CE 4.28Å; L267-M468 HydrophobicContact CD2-SD 3.85Å; L267-M468 HydrophobicContact CG-SD 3.84Å; M464-M468 WeakPolarHBondContact O-CB 3.36Å; M464-M468 PolarHBondContact O-N 3.3Å; F465-M468 HydrophobicContact CD2-CE 3.67Å; F465-M468 HydrophobicContact CE2-CE 3.86Å; F465-M468 WeakPolarHBondContact O-CB 3.35Å; F465-M468 PolarHBondContact O-N 3Å; M468-I470 VanDerWaalsContact C-N 3.32Å; M468-I470 PolarHBondContact O-N 3.42Å; M468-N471 PolarHBondContact O-N 2.97Å; M468-L472 HydrophobicContact CG-CD1 3.89Å; M468-L472 HydrophobicContact CG-CG 4.34Å; M468-L472 WeakPolarHBondContact O-CG 3.42Å; M468-L472 PolarHBondContact O-N 3.47Å
469	L	95.3	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.5	-40.3	178.7	-67.5	-176.4	0	0	0	112.4	L83 V86 W87 A444 F465 F466 L472 G473	L83-L469 HydrophobicContact CD2-CB 4.19Å; L83-L469 HydrophobicContact CD2-CD2 4.03Å; L83-L469 WeakPolarHBondContact CD2-O 3.42Å; V86-L469 HydrophobicContact CB-CD2 4.39Å; V86-L469 HydrophobicContact CG1-CD2 3.99Å; W87-L469 HydrophobicContact CE3-CD2 4.25Å; W87-L469 HydrophobicContact CZ3-CD1 4.41Å; W87-L469 HydrophobicContact CZ3-CD2 4.04Å; A444-L469 HydrophobicContact CB-CD1 4.29Å; F465-L469 HydrophobicContact CD1-CD1 4.15Å; F465-L469 HydrophobicContact CE1-CD1 3.59Å; F465-L469 HydrophobicContact CE1-CG 4.3Å; F465-L469 HydrophobicContact CZ-CD1 3.89Å; F465-L469 HydrophobicContact CZ-CD2 4.48Å; F465-L469 HydrophobicContact CZ-CG 4.33Å; F465-L469 PolarHBondContact O-N 3.4Å; F466-L469 HydrophobicContact CD1-CD1 4Å; F466-L469 HydrophobicContact CE1-CD1 4.21Å; F466-L469 PolarHBondContact O-N 3.13Å; L469-L472 PolarHBondContact O-N 2.97Å; L469-G473 PolarHBondContact O-N 3.36Å
470	I	96.4	Very high	95.3	Very high	16 Å²	16	16.6 Å²	16.6	8%	0.082	8%	0.079	C	C	.	.	H	α-helix	trans	-61	-45.6	175.1	-67.3	164.2	0	0	0	110.9	I168 F171 F466 F467 M468 G473 L474	I168-I470 HydrophobicContact CB-CD1 4.47Å; I168-I470 HydrophobicContact CG1-CD1 3.81Å; I168-I470 HydrophobicContact CG1-CG1 3.97Å; F171-I470 HydrophobicContact CB-CD1 3.76Å; F171-I470 HydrophobicContact CD1-CD1 4.43Å; F171-I470 HydrophobicContact CD2-CD1 4.44Å; F171-I470 HydrophobicContact CG-CD1 3.97Å; F466-I470 VanDerWaalsContact O-CG1 3.26Å; F466-I470 WeakPolarHBondContact O-CG1 3.29Å; F466-I470 PolarHBondContact O-N 3.28Å; F467-I470 PolarHBondContact O-N 3.46Å; M468-I470 VanDerWaalsContact C-N 3.32Å; M468-I470 PolarHBondContact O-N 3.42Å; I470-G473 PolarHBondContact O-N 3.3Å; I470-L474 VanDerWaalsContact O-CB 3.3Å; I470-L474 WeakPolarHBondContact O-CB 3.19Å; I470-L474 PolarHBondContact O-N 3.48Å
471	N	95.4	Very high	95.2	Very high	10 Å²	10	11.3 Å²	11.3	5%	0.053	6%	0.056	C	C	.	.	H	α-helix	trans	-69.2	-38.3	-179.6	-77	-75.8	0	0	0	112.8	S259 P263 F467 M468 L474 G475	S259-N471 PolarHBondContact OG-O 3.24Å; P263-N471 HydrophobicContact CG-CB 4.18Å; F467-N471 WeakPolarHBondContact CD2-ND2 3.46Å; F467-N471 VanDerWaalsContact CE2-ND2 3.3Å; F467-N471 WeakPolarHBondContact CE2-ND2 3.4Å; F467-N471 PolarHBondContact O-N 3.47Å; F467-N471 VanDerWaalsContact O-N 3.09Å; F467-N471 PolarHBondContact O-ND2 2.57Å; M468-N471 PolarHBondContact O-N 2.97Å; N471-L474 PolarHBondContact O-N 2.95Å; N471-G475 PolarHBondContact O-N 3.33Å
472	L	94.5	Very high	95.1	Very high	10 Å²	10	9.9 Å²	9.9	5%	0.052	5%	0.051	C	C	.	.	H	α-helix	trans	-63.6	-44.7	173.3	-74.4	173.1	0	0	0	111.6	V81 L83 V86 P263 M468 L469 G475 S476	V81-L472 HydrophobicContact CG1-CD2 4.04Å; L83-L472 HydrophobicContact CD2-CB 4.32Å; V86-L472 HydrophobicContact CG2-CD1 3.41Å; V86-L472 VanDerWaalsContact CG2-CD1 3.41Å; P263-L472 HydrophobicContact CB-CD1 4.24Å; P263-L472 HydrophobicContact CB-CD2 3.56Å; P263-L472 HydrophobicContact CB-CG 3.75Å; P263-L472 HydrophobicContact CG-CD2 3.63Å; P263-L472 HydrophobicContact CG-CG 3.68Å; M468-L472 HydrophobicContact CG-CD1 3.89Å; M468-L472 HydrophobicContact CG-CG 4.34Å; M468-L472 WeakPolarHBondContact O-CG 3.42Å; M468-L472 PolarHBondContact O-N 3.47Å; L469-L472 PolarHBondContact O-N 2.97Å; L472-G475 PolarHBondContact O-N 3.42Å; L472-S476 PolarHBondContact O-N 3.27Å; L472-S476 PolarHBondContact O-OG 3.04Å
473	G	94.8	Very high	94.9	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.2	-41.1	175.9	0	0	0	0	0	112.6	I164 L469 I470 G475 S476 M477	I164-G473 WeakPolarHBondContact CD1-O 3.26Å; L469-G473 PolarHBondContact O-N 3.36Å; I470-G473 PolarHBondContact O-N 3.3Å; G473-G475 VanDerWaalsContact C-N 3.34Å; G473-G475 PolarHBondContact O-N 2.99Å; G473-S476 PolarHBondContact O-N 3.27Å; G473-M477 WeakPolarHBondContact O-CB 3.41Å; G473-M477 VanDerWaalsContact O-CG 3.31Å; G473-M477 WeakPolarHBondContact O-CG 3.21Å; G473-M477 PolarHBondContact O-N 3.38Å
474	L	94.9	Very high	94.7	Very high	22 Å²	22	9.8 Å²	9.8	12%	0.115	5%	0.05	C	C	.	.	H	α-helix	trans	-61.4	-42	177.9	-174.6	63.6	0	0	0	111.7	V241 A244 V255 I470 N471 M477 I478	V241-L474 HydrophobicContact CG2-CD1 4.11Å; A244-L474 HydrophobicContact CB-CD1 4.1Å; V255-L474 HydrophobicContact CG1-CD2 3.79Å; I470-L474 VanDerWaalsContact O-CB 3.3Å; I470-L474 WeakPolarHBondContact O-CB 3.19Å; I470-L474 PolarHBondContact O-N 3.48Å; N471-L474 PolarHBondContact O-N 2.95Å; L474-M477 PolarHBondContact O-N 2.81Å; L474-I478 HydrophobicContact CG-CD1 4.11Å; L474-I478 VanDerWaalsContact O-CG1 3.25Å; L474-I478 WeakPolarHBondContact O-CG1 3.42Å; L474-I478 PolarHBondContact O-N 3.37Å
475	G	93.5	Very high	94.6	Very high	1 Å²	1	9 Å²	9	1%	0.01	5%	0.047	C	C	.	.	H	α-helix	trans	-57.3	-50.7	175.2	0	0	0	0	0	112.6	G78 N471 L472 G473 M477 I478 G479	G78-G475 CarbonylContact O-C 3.56Å; G78-G475 VanDerWaalsContact O-CA 3.27Å; G78-G475 WeakPolarHBondContact O-CA 3.31Å; N471-G475 PolarHBondContact O-N 3.33Å; L472-G475 PolarHBondContact O-N 3.42Å; G473-G475 VanDerWaalsContact C-N 3.34Å; G473-G475 PolarHBondContact O-N 2.99Å; G475-M477 PolarHBondContact O-N 3.48Å; G475-I478 PolarHBondContact O-N 3.42Å; G475-G479 PolarHBondContact O-N 3.23Å
476	S	93.8	Very high	94.4	Very high	8 Å²	8	9 Å²	9	6%	0.056	5%	0.047	C	C	.	.	H	α-helix	trans	-62.3	-43.1	176.8	-56.8	0	0	0	0	112	G78 F79 G82 L472 G473 I478 G479 T480	G78-S476 PolarHBondContact O-N 3.09Å; G78-S476 VanDerWaalsContact O-N 3.15Å; F79-S476 WeakPolarHBondContact CD2-O 3.36Å; G82-S476 VanDerWaalsContact CA-OG 3.23Å; G82-S476 WeakPolarHBondContact CA-OG 3.46Å; L472-S476 PolarHBondContact O-N 3.27Å; L472-S476 PolarHBondContact O-OG 3.04Å; G473-S476 PolarHBondContact O-N 3.27Å; S476-I478 VanDerWaalsContact C-N 3.33Å; S476-I478 PolarHBondContact O-N 3.42Å; S476-G479 PolarHBondContact O-N 3.29Å; S476-T480 PolarHBondContact O-N 3.26Å; S476-T480 PolarHBondContact O-OG1 2.98Å; S476-T480 VanDerWaalsContact O-OG1 3.12Å
477	M	94.9	Very high	94	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-65.6	-32.6	-179.9	-74.4	-58	-62.6	0	0	113.3	G157 N161 I164 W238 V241 G473 L474 G475 G479 T480 M481	G157-M477 WeakPolarHBondContact O-CE 3.2Å; N161-M477 HydrophobicContact CB-CE 3.84Å; N161-M477 HydrophobicContact CB-SD 4.24Å; I164-M477 HydrophobicContact CD1-CB 4.42Å; I164-M477 HydrophobicContact CD1-CG 3.45Å; I164-M477 VanDerWaalsContact CD1-CG 3.45Å; W238-M477 HydrophobicContact CH2-CE 3.73Å; W238-M477 HydrophobicContact CZ2-CE 4.49Å; W238-M477 HydrophobicContact CZ3-CE 4Å; V241-M477 HydrophobicContact CG1-CB 4.34Å; V241-M477 HydrophobicContact CG1-CE 4.47Å; V241-M477 HydrophobicContact CG2-CB 3.82Å; V241-M477 HydrophobicContact CG2-CE 4.5Å; V241-M477 HydrophobicContact CG2-CG 4.21Å; G473-M477 WeakPolarHBondContact O-CB 3.41Å; G473-M477 VanDerWaalsContact O-CG 3.31Å; G473-M477 WeakPolarHBondContact O-CG 3.21Å; G473-M477 PolarHBondContact O-N 3.38Å; L474-M477 PolarHBondContact O-N 2.81Å; G475-M477 PolarHBondContact O-N 3.48Å; M477-G479 VanDerWaalsContact C-N 3.34Å; M477-T480 PolarHBondContact O-N 3.12Å; M477-M481 VanDerWaalsContact O-CB 3.28Å; M477-M481 WeakPolarHBondContact O-CB 3.26Å; M477-M481 VanDerWaalsContact O-CG 3.31Å; M477-M481 WeakPolarHBondContact O-CG 3.46Å; M477-M481 PolarHBondContact O-N 2.95Å
478	I	94.7	Very high	93.7	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.4	-44.4	173.2	-73.9	164.6	0	0	0	110.5	A244 V245 V255 M256 F322 L474 G475 S476 T482	A244-I478 HydrophobicContact CB-CD1 4.02Å; A244-I478 HydrophobicContact CB-CG1 4.08Å; V245-I478 HydrophobicContact CG2-CB 4.36Å; V245-I478 HydrophobicContact CG2-CG1 3.95Å; V245-I478 HydrophobicContact CG2-CG2 4.47Å; V255-I478 HydrophobicContact CB-CD1 4.48Å; V255-I478 HydrophobicContact CG1-CD1 4.13Å; M256-I478 HydrophobicContact SD-CB 4.43Å; M256-I478 HydrophobicContact SD-CD1 3.54Å; M256-I478 VanDerWaalsContact SD-CD1 3.54Å; M256-I478 HydrophobicContact SD-CG2 4.36Å; F322-I478 HydrophobicContact CZ-CG2 4.3Å; L474-I478 HydrophobicContact CG-CD1 4.11Å; L474-I478 VanDerWaalsContact O-CG1 3.25Å; L474-I478 WeakPolarHBondContact O-CG1 3.42Å; L474-I478 PolarHBondContact O-N 3.37Å; G475-I478 PolarHBondContact O-N 3.42Å; S476-I478 VanDerWaalsContact C-N 3.33Å; S476-I478 PolarHBondContact O-N 3.42Å; I478-T482 WeakPolarHBondContact O-CB 3.35Å; I478-T482 PolarHBondContact O-N 3.09Å; I478-T482 PolarHBondContact O-OG1 3.3Å
479	G	93.2	Very high	93.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-68.9	-42.5	177.3	0	0	0	0	0	113.1	F79 F322 G475 S476 M477 M481 T482 G483	F79-G479 VanDerWaalsContact CD2-CA 3.44Å; F322-G479 VanDerWaalsContact CZ-CA 3.44Å; G475-G479 PolarHBondContact O-N 3.23Å; S476-G479 PolarHBondContact O-N 3.29Å; M477-G479 VanDerWaalsContact C-N 3.34Å; G479-M481 PolarHBondContact O-N 3.28Å; G479-T482 PolarHBondContact O-N 2.69Å; G479-G483 PolarHBondContact O-N 3.47Å
480	T	94.1	Very high	93	Very high	4 Å²	4	12.8 Å²	12.8	3%	0.025	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-46.7	174.9	-56.3	0	0	0	0	111.7	C153 S476 M477 T482 G483 I484	C153-T480 HydrophobicContact CB-CG2 4.17Å; C153-T480 WeakPolarHBondContact O-CG2 3.47Å; S476-T480 PolarHBondContact O-N 3.26Å; S476-T480 PolarHBondContact O-OG1 2.98Å; S476-T480 VanDerWaalsContact O-OG1 3.12Å; M477-T480 PolarHBondContact O-N 3.12Å; T480-T482 VanDerWaalsContact C-N 3.31Å; T480-T482 PolarHBondContact O-N 3.21Å; T480-G483 PolarHBondContact O-N 2.89Å; T480-I484 HydrophobicContact CG2-CD1 4.37Å; T480-I484 WeakPolarHBondContact O-CG1 3.35Å; T480-I484 PolarHBondContact O-N 3.44Å
481	M	94.4	Very high	92.4	Very high	5 Å²	5	14.9 Å²	14.9	3%	0.025	9%	0.089	C	C	.	.	H	α-helix	trans	-65.4	-33.6	176.7	-75.8	-62.5	-65.3	0	0	112.5	W238 V241 V245 M477 G479 I484 T485 C503	W238-M481 HydrophobicContact CZ3-SD 4.02Å; V241-M481 HydrophobicContact CG1-CG 3.69Å; V245-M481 HydrophobicContact CG1-CB 4.24Å; V245-M481 HydrophobicContact CG2-CB 4.15Å; M477-M481 VanDerWaalsContact O-CB 3.28Å; M477-M481 WeakPolarHBondContact O-CB 3.26Å; M477-M481 VanDerWaalsContact O-CG 3.31Å; M477-M481 WeakPolarHBondContact O-CG 3.46Å; M477-M481 PolarHBondContact O-N 2.95Å; G479-M481 PolarHBondContact O-N 3.28Å; M481-I484 PolarHBondContact O-N 3.01Å; M481-T485 HydrophobicContact CE-CG2 4.33Å; M481-T485 WeakPolarHBondContact O-CB 3.34Å; M481-T485 WeakPolarHBondContact O-CG2 3.44Å; M481-T485 PolarHBondContact O-N 3.1Å; M481-T485 PolarHBondContact O-OG1 3.08Å; M481-C503 HydrophobicContact CE-CB 4.08Å
482	T	92.4	Very high	91.8	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.025	11%	0.113	C	C	.	.	H	α-helix	trans	-68.4	-40.9	173.8	-56.4	0	0	0	0	110.8	A321 F322 Y325 I478 G479 T480 I484 T485 T486	A321-T482 HydrophobicContact CB-CG2 3.93Å; F322-T482 HydrophobicContact CD1-CG2 3.89Å; F322-T482 HydrophobicContact CE1-CG2 3.75Å; Y325-T482 HydrophobicContact CE2-CG2 4.38Å; I478-T482 WeakPolarHBondContact O-CB 3.35Å; I478-T482 PolarHBondContact O-N 3.09Å; I478-T482 PolarHBondContact O-OG1 3.3Å; G479-T482 PolarHBondContact O-N 2.69Å; T480-T482 VanDerWaalsContact C-N 3.31Å; T480-T482 PolarHBondContact O-N 3.21Å; T482-I484 PolarHBondContact O-N 3.31Å; T482-T485 PolarHBondContact O-N 2.97Å; T482-T486 WeakPolarHBondContact CG2-OG1 3.39Å; T482-T486 WeakPolarHBondContact O-CB 3.3Å; T482-T486 PolarHBondContact O-N 3.43Å; T482-T486 PolarHBondContact O-OG1 3.16Å; T482-T486 VanDerWaalsContact O-OG1 3.12Å
483	G	91.9	Very high	91	Very high	2 Å²	2	30.6 Å²	30.6	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-29.2	171.9	0	0	0	0	0	113.3	G479 T480 P487	G479-G483 PolarHBondContact O-N 3.47Å; T480-G483 PolarHBondContact O-N 2.89Å; G483-P487 WeakPolarHBondContact O-CD 3.27Å; G483-P487 WeakPolarHBondContact O-CG 3.46Å
484	I	93.8	Very high	90.6	Very high	27 Å²	27	34.5 Å²	34.5	14%	0.138	18%	0.177	C	C	.	.	H	α-helix	trans	-84.1	-51.1	175.8	-63.9	166.3	0	0	0	112.7	L150 C153 T480 M481 T482 I488	L150-I484 VanDerWaalsContact CD1-CA 3.46Å; L150-I484 HydrophobicContact CD1-CB 4.01Å; L150-I484 HydrophobicContact CD1-CG1 4.1Å; L150-I484 HydrophobicContact CD1-CG2 3.94Å; C153-I484 HydrophobicContact CB-CD1 4.26Å; C153-I484 HydrophobicContact CB-CG1 3.83Å; T480-I484 HydrophobicContact CG2-CD1 4.37Å; T480-I484 WeakPolarHBondContact O-CG1 3.35Å; T480-I484 PolarHBondContact O-N 3.44Å; M481-I484 PolarHBondContact O-N 3.01Å; T482-I484 PolarHBondContact O-N 3.31Å; I484-I488 HydrophobicContact CG2-CD1 4.1Å; I484-I488 WeakPolarHBondContact O-CD1 3.16Å; I484-I488 WeakPolarHBondContact O-CG1 3.13Å
485	T	92.6	Very high	90.3	Very high	11 Å²	11	41.9 Å²	41.9	7%	0.067	20%	0.203	C	C	.	.	H	α-helix	trans	-74.5	-39.2	-170.9	53.4	0	0	0	0	112.2	M481 T482 I488 L489	M481-T485 HydrophobicContact CE-CG2 4.33Å; M481-T485 WeakPolarHBondContact O-CB 3.34Å; M481-T485 WeakPolarHBondContact O-CG2 3.44Å; M481-T485 PolarHBondContact O-N 3.1Å; M481-T485 PolarHBondContact O-OG1 3.08Å; T482-T485 PolarHBondContact O-N 2.97Å; T485-I488 PolarHBondContact O-N 3.36Å; T485-L489 WeakPolarHBondContact O-CB 3.37Å; T485-L489 VanDerWaalsContact O-CG 3.26Å; T485-L489 WeakPolarHBondContact O-CG 3.42Å; T485-L489 PolarHBondContact O-N 3.43Å
486	T	91.6	Very high	90	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-48.7	-176.5	-64.3	0	0	0	0	113.2	A321 Y325 T482 I488 L489 D490	A321-T486 HydrophobicContact CB-CG2 4.01Å; Y325-T486 HydrophobicContact CE2-CG2 4.32Å; Y325-T486 WeakPolarHBondContact OH-CG2 3.27Å; Y325-T486 PolarHBondContact OH-OG1 2.7Å; T482-T486 WeakPolarHBondContact CG2-OG1 3.39Å; T482-T486 WeakPolarHBondContact O-CB 3.3Å; T482-T486 PolarHBondContact O-N 3.43Å; T482-T486 PolarHBondContact O-OG1 3.16Å; T482-T486 VanDerWaalsContact O-OG1 3.12Å; T486-I488 VanDerWaalsContact C-N 3.29Å; T486-I488 PolarHBondContact O-N 3.5Å; T486-L489 PolarHBondContact O-N 3.15Å; T486-D490 WeakPolarHBondContact O-CB 3.42Å; T486-D490 PolarHBondContact O-N 2.83Å
487	P	90.3	Very high	90	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.013	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-35.3	176.7	-23.5	34.8	0	0	0	113.4	I132 G483 D490 A491	I132-P487 HydrophobicContact CB-CB 4.13Å; I132-P487 HydrophobicContact CD1-CB 3.79Å; I132-P487 HydrophobicContact CG1-CB 3.88Å; G483-P487 WeakPolarHBondContact O-CD 3.27Å; G483-P487 WeakPolarHBondContact O-CG 3.46Å; P487-D490 PolarHBondContact O-N 2.99Å; P487-A491 WeakPolarHBondContact O-CB 3.12Å; P487-A491 PolarHBondContact O-N 3.23Å
488	I	90.6	Very high	89.8	Confident	34 Å²	34	51.8 Å²	51.8	17%	0.174	25%	0.249	C	C	.	.	H	α-helix	trans	-70.3	-41.2	178.5	-63.2	172.4	0	0	0	110.7	L150 I484 T485 T486 D490 A491 F492 L499	L150-I488 HydrophobicContact CD1-CD1 4.49Å; L150-I488 HydrophobicContact CD2-CD1 4.5Å; L150-I488 HydrophobicContact CD2-CG1 4.46Å; I484-I488 HydrophobicContact CG2-CD1 4.1Å; I484-I488 WeakPolarHBondContact O-CD1 3.16Å; I484-I488 WeakPolarHBondContact O-CG1 3.13Å; T485-I488 PolarHBondContact O-N 3.36Å; T486-I488 VanDerWaalsContact C-N 3.29Å; T486-I488 PolarHBondContact O-N 3.5Å; I488-D490 VanDerWaalsContact C-N 3.32Å; I488-A491 PolarHBondContact O-N 3.07Å; I488-F492 HydrophobicContact CG2-CD2 4.08Å; I488-F492 PolarHBondContact O-N 3.49Å; I488-L499 HydrophobicContact CB-CD2 3.98Å; I488-L499 HydrophobicContact CG2-CD1 3.82Å; I488-L499 HydrophobicContact CG2-CD2 3.69Å; I488-L499 HydrophobicContact CG2-CG 4.42Å
489	L	89.4	Confident	89.8	Confident	44 Å²	44	52.6 Å²	52.6	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-34.6	175.8	-70.2	170.7	0	0	0	112.6	T485 T486 F492 I494 K496 L499	T485-L489 WeakPolarHBondContact O-CB 3.37Å; T485-L489 VanDerWaalsContact O-CG 3.26Å; T485-L489 WeakPolarHBondContact O-CG 3.42Å; T485-L489 PolarHBondContact O-N 3.43Å; T486-L489 PolarHBondContact O-N 3.15Å; L489-F492 CarbonylContact C-O 3.47Å; L489-I494 WeakPolarHBondContact CD2-O 3.45Å; L489-K496 HydrophobicContact CD1-CB 3.91Å; L489-K496 HydrophobicContact CD2-CB 4.15Å; L489-L499 HydrophobicContact CD1-CD2 4.41Å; L489-L499 HydrophobicContact CD2-CB 4.41Å; L489-L499 HydrophobicContact CD2-CD2 3.57Å; L489-L499 HydrophobicContact CG-CD2 3.59Å
490	D	85.9	Confident	89.8	Confident	66 Å²	66	52.8 Å²	52.8	35%	0.353	25%	0.254	S	S	.	.	H	α-helix	trans	-73.7	-29.7	176.3	-74.6	-5.5	0	0	0	111.6	R63 R129 G130 T486 P487 I488	R63-D490 IonicContact CZ-OD2 2.84Å; R63-D490 IonicContact NH1-OD1 3.69Å; R63-D490 PolarHBondContact NH1-OD1 3Å; R63-D490 IonicContact NH1-OD2 3.87Å; R63-D490 PolarHBondContact NH1-OD2 3.08Å; R63-D490 IonicContact NH2-OD2 3.14Å; R63-D490 PolarHBondContact NH2-OD2 3.08Å; R129-D490 WeakPolarHBondContact CA-OD2 3.39Å; G130-D490 PolarHBondContact N-OD2 3.44Å; T486-D490 WeakPolarHBondContact O-CB 3.42Å; T486-D490 PolarHBondContact O-N 2.83Å; P487-D490 PolarHBondContact O-N 2.99Å; I488-D490 VanDerWaalsContact C-N 3.32Å
491	A	82.9	Confident	89.8	Confident	60 Å²	60	55.2 Å²	55.2	50%	0.496	27%	0.269	S	S	.	.	H	α-helix	trans	-82.2	-38.9	176.7	0	0	0	0	0	113.1	P487 I488	P487-A491 WeakPolarHBondContact O-CB 3.12Å; P487-A491 PolarHBondContact O-N 3.23Å; I488-A491 PolarHBondContact O-N 3.07Å
492	F	82.9	Confident	89.9	Confident	128 Å²	128	58.2 Å²	58.2	56%	0.561	29%	0.287	S	S	*	.	S	Bend	trans	-126.3	128.4	-175.6	-57.3	-78.7	0	0	0	111	I488 L489 I494	I488-F492 HydrophobicContact CG2-CD2 4.08Å; I488-F492 PolarHBondContact O-N 3.49Å; L489-F492 CarbonylContact C-O 3.47Å; F492-I494 HydrophobicContact CB-CD1 3.73Å; F492-I494 HydrophobicContact CB-CG1 3.88Å; F492-I494 HydrophobicContact CG-CD1 4.48Å; F492-I494 PolarHBondContact O-N 3.38Å
493	K	79.3	Confident	90	Very high	222 Å²	222	59 Å²	59	97%	0.965	29%	0.293	S	S	*	.			trans	-75.2	72.8	176.9	-64.6	-169.6	-179.4	-171.3	0	111.7
494	I	86.6	Confident	90.2	Very high	81 Å²	81	59.3 Å²	59.3	42%	0.415	29%	0.294	S	S	.	.			trans	-108.4	152.1	179.3	-55.7	171.5	0	0	0	109.2	L489 F492 K496 L499	L489-I494 WeakPolarHBondContact CD2-O 3.45Å; F492-I494 HydrophobicContact CB-CD1 3.73Å; F492-I494 HydrophobicContact CB-CG1 3.88Å; F492-I494 HydrophobicContact CG-CD1 4.48Å; F492-I494 PolarHBondContact O-N 3.38Å; I494-K496 PolarHBondContact O-N 3.47Å; I494-L499 HydrophobicContact CG2-CB 4.37Å
495	R	88.3	Confident	90.3	Very high	178 Å²	178	62.5 Å²	62.5	67%	0.672	31%	0.311	S	S	*	.			trans	-64.6	123.5	171.6	-71.2	-174.9	-76.4	177.3	-3.2	110.1	E497 I498 L499	R495-E497 VanDerWaalsContact C-N 3.27Å; R495-E497 PolarHBondContact O-N 3.44Å; R495-I498 HydrophobicContact CB-CB 4.47Å; R495-I498 HydrophobicContact CB-CD1 4.24Å; R495-I498 HydrophobicContact CB-CG1 4.26Å; R495-I498 VanDerWaalsContact NE-CD1 3.34Å; R495-I498 PolarHBondContact O-N 3.11Å; R495-L499 PolarHBondContact O-N 3.07Å; R495-L499 VanDerWaalsContact O-N 3.1Å
496	K	87.3	Confident	90.5	Very high	70 Å²	70	66.3 Å²	66.3	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-56.7	-37.9	-174.9	62.8	-179.8	178.5	173.2	0	113.4	K247 L489 I494 L499 C500	K247-K496 PolarHBondContact O-NZ 2.87Å; L489-K496 HydrophobicContact CD1-CB 3.91Å; L489-K496 HydrophobicContact CD2-CB 4.15Å; I494-K496 PolarHBondContact O-N 3.47Å; K496-L499 PolarHBondContact O-N 3.34Å; K496-C500 WeakPolarHBondContact O-CB 3.05Å; K496-C500 PolarHBondContact O-N 3.31Å
497	E	92.1	Very high	90.7	Very high	75 Å²	75	66.9 Å²	66.9	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-66.1	-43	-178.1	-58.2	76.6	-169.6	0	0	110.6	I246 R495 V501	I246-E497 HydrophobicContact CG1-CB 4.4Å; R495-E497 VanDerWaalsContact C-N 3.27Å; R495-E497 PolarHBondContact O-N 3.44Å; E497-V501 WeakPolarHBondContact O-CG2 3.18Å; E497-V501 PolarHBondContact O-N 2.95Å; E497-V501 VanDerWaalsContact O-N 3.15Å
498	I	92.4	Very high	91.1	Very high	73 Å²	73	68.5 Å²	68.5	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-68.9	-44.5	179.8	-62.6	-178	0	0	0	110.2	R495 C500 V501 V502	R495-I498 HydrophobicContact CB-CB 4.47Å; R495-I498 HydrophobicContact CB-CD1 4.24Å; R495-I498 HydrophobicContact CB-CG1 4.26Å; R495-I498 VanDerWaalsContact NE-CD1 3.34Å; R495-I498 PolarHBondContact O-N 3.11Å; I498-C500 VanDerWaalsContact C-N 3.33Å; I498-C500 PolarHBondContact O-N 2.78Å; I498-V501 PolarHBondContact O-N 3.29Å; I498-V502 HydrophobicContact CG2-CG2 4.2Å; I498-V502 WeakPolarHBondContact O-CB 3.39Å; I498-V502 VanDerWaalsContact O-CG2 3.29Å; I498-V502 WeakPolarHBondContact O-CG2 3.42Å; I498-V502 PolarHBondContact O-N 3.14Å
499	L	93.8	Very high	91.4	Very high	17 Å²	17	71.8 Å²	71.8	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-58.8	-47	178	179.8	67.3	0	0	0	110.9	I488 L489 I494 R495 K496 V501 V502 C503	I488-L499 HydrophobicContact CB-CD2 3.98Å; I488-L499 HydrophobicContact CG2-CD1 3.82Å; I488-L499 HydrophobicContact CG2-CD2 3.69Å; I488-L499 HydrophobicContact CG2-CG 4.42Å; L489-L499 HydrophobicContact CD1-CD2 4.41Å; L489-L499 HydrophobicContact CD2-CB 4.41Å; L489-L499 HydrophobicContact CD2-CD2 3.57Å; L489-L499 HydrophobicContact CG-CD2 3.59Å; I494-L499 HydrophobicContact CG2-CB 4.37Å; R495-L499 PolarHBondContact O-N 3.07Å; R495-L499 VanDerWaalsContact O-N 3.1Å; K496-L499 PolarHBondContact O-N 3.34Å; L499-V501 PolarHBondContact O-N 2.85Å; L499-V502 PolarHBondContact O-N 2.83Å; L499-C503 WeakPolarHBondContact O-CB 3.27Å; L499-C503 PolarHBondContact O-N 2.85Å; L499-C503 PolarHBondContact O-SG 3.24Å
500	C	93.2	Very high	91.7	Very high	3 Å²	3	74.5 Å²	74.5	2%	0.02	37%	0.373	C	S	.	.	H	α-helix	trans	-56.9	-50.3	178.5	-175.3	0	0	0	0	111.7	K496 I498 V502 C503 C504	K496-C500 WeakPolarHBondContact O-CB 3.05Å; K496-C500 PolarHBondContact O-N 3.31Å; I498-C500 VanDerWaalsContact C-N 3.33Å; I498-C500 PolarHBondContact O-N 2.78Å; C500-V502 PolarHBondContact O-N 3.18Å; C500-C503 PolarHBondContact O-N 3.32Å; C500-C504 PolarHBondContact O-N 3.38Å; C500-C504 PolarHBondContact O-SG 3.02Å
501	V	95.3	Very high	92.1	Very high	56 Å²	56	71.4 Å²	71.4	34%	0.339	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-44.8	-179.3	172.8	0	0	0	0	111.2	E497 I498 L499 C504 I505	E497-V501 WeakPolarHBondContact O-CG2 3.18Å; E497-V501 PolarHBondContact O-N 2.95Å; E497-V501 VanDerWaalsContact O-N 3.15Å; I498-V501 PolarHBondContact O-N 3.29Å; L499-V501 PolarHBondContact O-N 2.85Å; V501-C504 PolarHBondContact O-N 3.42Å; V501-I505 HydrophobicContact CG1-CD1 3.79Å; V501-I505 HydrophobicContact CG1-CG1 4.46Å; V501-I505 VanDerWaalsContact O-CG1 3.3Å; V501-I505 WeakPolarHBondContact O-CG1 3.33Å; V501-I505 PolarHBondContact O-N 3.5Å
502	V	95.3	Very high	92.8	Very high	67 Å²	67	70.5 Å²	70.5	41%	0.406	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-44.6	178.8	171.2	0	0	0	0	111.2	I498 L499 C500 C504 I505 I506	I498-V502 HydrophobicContact CG2-CG2 4.2Å; I498-V502 WeakPolarHBondContact O-CB 3.39Å; I498-V502 VanDerWaalsContact O-CG2 3.29Å; I498-V502 WeakPolarHBondContact O-CG2 3.42Å; I498-V502 PolarHBondContact O-N 3.14Å; L499-V502 PolarHBondContact O-N 2.83Å; C500-V502 PolarHBondContact O-N 3.18Å; V502-C504 PolarHBondContact O-N 3.17Å; V502-I505 PolarHBondContact O-N 3.25Å; V502-I506 HydrophobicContact CG1-CD1 3.8Å; V502-I506 HydrophobicContact CG1-CG1 4.46Å; V502-I506 WeakPolarHBondContact O-CG1 3.28Å; V502-I506 PolarHBondContact O-N 2.98Å
503	C	94.6	Very high	93.3	Very high	22 Å²	22	67 Å²	67	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-59.3	-45.6	175.9	-72.5	0	0	0	0	111.7	M481 L499 C500 I505 I506 A507	M481-C503 HydrophobicContact CE-CB 4.08Å; L499-C503 WeakPolarHBondContact O-CB 3.27Å; L499-C503 PolarHBondContact O-N 2.85Å; L499-C503 PolarHBondContact O-SG 3.24Å; C500-C503 PolarHBondContact O-N 3.32Å; C503-I505 PolarHBondContact O-N 3.46Å; C503-I506 PolarHBondContact O-N 2.94Å; C503-A507 VanDerWaalsContact O-CB 3.27Å; C503-A507 WeakPolarHBondContact O-CB 3.5Å; C503-A507 PolarHBondContact O-N 3.34Å
504	C	96.2	Very high	94.1	Very high	7 Å²	7	56.6 Å²	56.6	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-39.2	177.1	-69.1	0	0	0	0	112.6	W238 C242 C500 V501 V502 A507 F508	W238-C504 HydrophobicContact CE3-CB 4.1Å; C242-C504 HydrophobicContact CB-CB 4.16Å; C500-C504 PolarHBondContact O-N 3.38Å; C500-C504 PolarHBondContact O-SG 3.02Å; V501-C504 PolarHBondContact O-N 3.42Å; V502-C504 PolarHBondContact O-N 3.17Å; C504-A507 PolarHBondContact O-N 2.76Å; C504-F508 WeakPolarHBondContact O-CB 3.49Å; C504-F508 PolarHBondContact O-N 2.62Å
505	I	96.8	Very high	94.5	Very high	95 Å²	95	53 Å²	53	49%	0.487	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-46.7	176.7	-70	167.4	0	0	0	110.6	V501 V502 C503 A507 F508 L509	V501-I505 HydrophobicContact CG1-CD1 3.79Å; V501-I505 HydrophobicContact CG1-CG1 4.46Å; V501-I505 VanDerWaalsContact O-CG1 3.3Å; V501-I505 WeakPolarHBondContact O-CG1 3.33Å; V501-I505 PolarHBondContact O-N 3.5Å; V502-I505 PolarHBondContact O-N 3.25Å; C503-I505 PolarHBondContact O-N 3.46Å; I505-A507 VanDerWaalsContact C-N 3.32Å; I505-A507 PolarHBondContact O-N 3.25Å; I505-F508 PolarHBondContact O-N 3.36Å; I505-L509 HydrophobicContact CG2-CD1 4.2Å; I505-L509 WeakPolarHBondContact O-CG 3.28Å; I505-L509 PolarHBondContact O-N 3.44Å
506	I	96.4	Very high	94.8	Very high	90 Å²	90	46.7 Å²	46.7	46%	0.462	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-45.5	177.1	-67.9	168.6	0	0	0	110	V502 C503 F508 L509 L510	V502-I506 HydrophobicContact CG1-CD1 3.8Å; V502-I506 HydrophobicContact CG1-CG1 4.46Å; V502-I506 WeakPolarHBondContact O-CG1 3.28Å; V502-I506 PolarHBondContact O-N 2.98Å; C503-I506 PolarHBondContact O-N 2.94Å; I506-F508 VanDerWaalsContact C-N 3.35Å; I506-F508 PolarHBondContact O-N 3.12Å; I506-L509 PolarHBondContact O-N 3.01Å; I506-L510 HydrophobicContact CG2-CD1 3.94Å; I506-L510 HydrophobicContact CG2-CG 4.37Å; I506-L510 WeakPolarHBondContact O-CG 3.44Å; I506-L510 PolarHBondContact O-N 2.91Å
507	A	96	Very high	95.1	Very high	14 Å²	14	48 Å²	48	12%	0.116	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-34.5	-179.7	0	0	0	0	0	112.8	L158 W238 C503 C504 I505 G511	L158-A507 HydrophobicContact CD2-CB 3.93Å; L158-A507 VanDerWaalsContact CD2-O 3.25Å; L158-A507 WeakPolarHBondContact CD2-O 3.37Å; W238-A507 HydrophobicContact CD2-CB 4.32Å; W238-A507 HydrophobicContact CE3-CB 4.26Å; W238-A507 HydrophobicContact CH2-CB 3.3Å; W238-A507 HydrophobicContact CZ2-CB 3.33Å; W238-A507 HydrophobicContact CZ3-CB 3.78Å; C503-A507 VanDerWaalsContact O-CB 3.27Å; C503-A507 WeakPolarHBondContact O-CB 3.5Å; C503-A507 PolarHBondContact O-N 3.34Å; C504-A507 PolarHBondContact O-N 2.76Å; I505-A507 VanDerWaalsContact C-N 3.32Å; I505-A507 PolarHBondContact O-N 3.25Å; A507-G511 WeakPolarHBondContact O-CA 3.46Å; A507-G511 PolarHBondContact O-N 2.81Å
508	F	97.3	Very high	95.2	Very high	37 Å²	37	44.4 Å²	44.4	16%	0.162	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-47.2	170.5	170.4	-104.3	0	0	0	111.9	T231 L234 L235 W238 C504 I505 I506 G511 L512	T231-F508 HydrophobicContact CG2-CZ 4.42Å; L234-F508 HydrophobicContact CD2-CD2 4.28Å; L234-F508 HydrophobicContact CD2-CE2 4.42Å; L234-F508 HydrophobicContact CG-CD2 4.13Å; L234-F508 HydrophobicContact CG-CE2 4.34Å; L235-F508 HydrophobicContact CB-CD2 4.37Å; L235-F508 HydrophobicContact CB-CE2 3.66Å; L235-F508 HydrophobicContact CB-CZ 4.13Å; L235-F508 HydrophobicContact CD1-CD2 4.23Å; L235-F508 HydrophobicContact CD1-CE1 4.29Å; L235-F508 HydrophobicContact CD1-CE2 3.95Å; L235-F508 HydrophobicContact CD1-CZ 3.98Å; L235-F508 HydrophobicContact CG-CE2 4.41Å; W238-F508 HydrophobicContact CB-CB 4.42Å; W238-F508 AromaticContact CD1-CD2 3.87Å; W238-F508 HydrophobicContact CG-CB 4.01Å; C504-F508 WeakPolarHBondContact O-CB 3.49Å; C504-F508 PolarHBondContact O-N 2.62Å; I505-F508 PolarHBondContact O-N 3.36Å; I506-F508 VanDerWaalsContact C-N 3.35Å; I506-F508 PolarHBondContact O-N 3.12Å; F508-G511 WeakPolarHBondContact O-CA 3.38Å; F508-G511 PolarHBondContact O-N 3.31Å; F508-G511 VanDerWaalsContact O-N 3.14Å; F508-L512 HydrophobicContact CE1-CD2 4.37Å; F508-L512 HydrophobicContact CE2-CD2 4.2Å; F508-L512 HydrophobicContact CZ-CD2 3.93Å; F508-L512 PolarHBondContact O-N 2.86Å
509	L	97.4	Very high	95.2	Very high	102 Å²	102	41 Å²	41	53%	0.534	21%	0.213	S	C	.	.	H	α-helix	trans	-63.6	-42.8	-179.9	-68.7	174.3	0	0	0	112.1	I505 I506 G511 L512	I505-L509 HydrophobicContact CG2-CD1 4.2Å; I505-L509 WeakPolarHBondContact O-CG 3.28Å; I505-L509 PolarHBondContact O-N 3.44Å; I506-L509 PolarHBondContact O-N 3.01Å; L509-G511 VanDerWaalsContact C-N 3.31Å; L509-L512 HydrophobicContact CD2-CD1 4.32Å; L509-L512 WeakPolarHBondContact O-CB 3.47Å; L509-L512 PolarHBondContact O-N 2.83Å
510	L	95.9	Very high	95.1	Very high	102 Å²	102	40.7 Å²	40.7	53%	0.534	21%	0.212	S	C	.	.	H	α-helix	trans	-66.2	-36.1	173	-66.8	176.1	0	0	0	111.5	L158 I506 L512 L513	L158-L510 HydrophobicContact CD1-CB 4.24Å; L158-L510 HydrophobicContact CD1-CD1 4.4Å; L158-L510 HydrophobicContact CD2-CB 3.78Å; I506-L510 HydrophobicContact CG2-CD1 3.94Å; I506-L510 HydrophobicContact CG2-CG 4.37Å; I506-L510 WeakPolarHBondContact O-CG 3.44Å; I506-L510 PolarHBondContact O-N 2.91Å; L510-L512 PolarHBondContact O-N 3.1Å; L510-L513 PolarHBondContact O-N 3.07Å
511	G	95.4	Very high	95.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.1	-16.6	177.6	0	0	0	0	0	114.5	L234 A507 F508 L509 L513 F514	L234-G511 WeakPolarHBondContact CD2-O 3.27Å; A507-G511 WeakPolarHBondContact O-CA 3.46Å; A507-G511 PolarHBondContact O-N 2.81Å; F508-G511 WeakPolarHBondContact O-CA 3.38Å; F508-G511 PolarHBondContact O-N 3.31Å; F508-G511 VanDerWaalsContact O-N 3.14Å; L509-G511 VanDerWaalsContact C-N 3.31Å; G511-L513 PolarHBondContact O-N 3.07Å; G511-L513 VanDerWaalsContact O-N 3.15Å; G511-F514 PolarHBondContact O-N 3.44Å
512	L	95.8	Very high	95	Very high	42 Å²	42	38.5 Å²	38.5	22%	0.22	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-60.8	-22.1	176.4	-66.8	179.6	0	0	0	113.1	L226 T231 F508 L509 L510 F514 V515	L226-L512 HydrophobicContact CD2-CB 4.48Å; L226-L512 WeakPolarHBondContact CD2-O 3.29Å; T231-L512 HydrophobicContact CG2-CD2 3.83Å; F508-L512 HydrophobicContact CE1-CD2 4.37Å; F508-L512 HydrophobicContact CE2-CD2 4.2Å; F508-L512 HydrophobicContact CZ-CD2 3.93Å; F508-L512 PolarHBondContact O-N 2.86Å; L509-L512 HydrophobicContact CD2-CD1 4.32Å; L509-L512 WeakPolarHBondContact O-CB 3.47Å; L509-L512 PolarHBondContact O-N 2.83Å; L510-L512 PolarHBondContact O-N 3.1Å; L512-F514 VanDerWaalsContact C-N 3.28Å; L512-F514 PolarHBondContact O-N 2.84Å; L512-V515 HydrophobicContact CD2-CG2 4.2Å; L512-V515 WeakPolarHBondContact O-CG2 3.48Å
513	L	94.7	Very high	94.9	Very high	54 Å²	54	35.7 Å²	35.7	28%	0.283	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-58.5	-40.4	173	-178.8	65.3	0	0	0	111.8	L510 G511 V515 Q516 F522 F526	L510-L513 PolarHBondContact O-N 3.07Å; G511-L513 PolarHBondContact O-N 3.07Å; G511-L513 VanDerWaalsContact O-N 3.15Å; L513-V515 PolarHBondContact O-N 3.46Å; L513-Q516 WeakPolarHBondContact O-CG 3.45Å; L513-F522 HydrophobicContact CD1-CD1 4.24Å; L513-F522 HydrophobicContact CD1-CD2 4.45Å; L513-F522 HydrophobicContact CD1-CE1 4.09Å; L513-F522 HydrophobicContact CD1-CE2 4.31Å; L513-F522 HydrophobicContact CD1-CG 4.42Å; L513-F522 HydrophobicContact CD1-CZ 4.13Å; L513-F522 HydrophobicContact CD2-CD1 3.99Å; L513-F522 HydrophobicContact CD2-CE1 4.41Å; L513-F522 HydrophobicContact CD2-CG 4.4Å; L513-F522 HydrophobicContact CG-CD1 4.15Å; L513-F522 HydrophobicContact CG-CE1 4.49Å; L513-F522 HydrophobicContact CG-CG 4.18Å; L513-F526 HydrophobicContact CD2-CE2 4.44Å
514	F	95.1	Very high	94.7	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.018	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-83.6	-10.4	-172.3	-53.7	-67.8	0	0	0	114.4	L158 V162 G511 L512 G519 F522 V523 F526	L158-F514 HydrophobicContact CB-CE2 3.88Å; L158-F514 HydrophobicContact CB-CZ 4.45Å; V162-F514 HydrophobicContact CB-CB 4.28Å; V162-F514 HydrophobicContact CG1-CB 3.97Å; V162-F514 HydrophobicContact CG2-CB 3.47Å; V162-F514 VanDerWaalsContact CG2-CB 3.47Å; V162-F514 HydrophobicContact CG2-CD2 3.69Å; V162-F514 HydrophobicContact CG2-CG 3.84Å; G511-F514 PolarHBondContact O-N 3.44Å; L512-F514 VanDerWaalsContact C-N 3.28Å; L512-F514 PolarHBondContact O-N 2.84Å; F514-G519 CarbonylContact O-C 3.15Å; F514-G519 VanDerWaalsContact O-CA 3.32Å; F514-G519 WeakPolarHBondContact O-CA 3.32Å; F514-F522 HydrophobicContact CD1-CB 3.82Å; F514-F522 HydrophobicContact CE1-CB 4.04Å; F514-V523 HydrophobicContact CB-CG2 3.81Å; F514-V523 HydrophobicContact CD1-CG2 3.65Å; F514-V523 HydrophobicContact CG-CG2 3.98Å; F514-F526 HydrophobicContact CE1-CB 4.39Å; F514-F526 HydrophobicContact CE1-CD1 4.3Å; F514-F526 AromaticContact CE1-CD2 3.71Å; F514-F526 HydrophobicContact CE1-CD2 3.71Å; F514-F526 AromaticContact CE1-CE2 3.96Å; F514-F526 HydrophobicContact CE1-CE2 3.96Å; F514-F526 AromaticContact CE1-CG 3.88Å; F514-F526 HydrophobicContact CE1-CG 3.88Å; F514-F526 HydrophobicContact CE1-CZ 4.36Å; F514-F526 AromaticContact CZ-CD1 3.89Å; F514-F526 HydrophobicContact CZ-CD1 3.89Å; F514-F526 HydrophobicContact CZ-CD2 4.04Å; F514-F526 AromaticContact CZ-CE1 3.9Å; F514-F526 HydrophobicContact CZ-CE1 3.9Å; F514-F526 HydrophobicContact CZ-CE2 4.04Å; F514-F526 AromaticContact CZ-CG 3.95Å; F514-F526 HydrophobicContact CZ-CG 3.95Å; F514-F526 AromaticContact CZ-CZ 3.96Å; F514-F526 HydrophobicContact CZ-CZ 3.96Å
515	V	95.1	Very high	94.5	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.024	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-100.7	7.5	177.6	-59.6	0	0	0	0	112.6	L226 N227 M230 T231 L234 L512 L513	L226-V515 HydrophobicContact CD2-CG2 4.06Å; N227-V515 WeakPolarHBondContact CB-O 3.32Å; N227-V515 PolarHBondContact N-O 3.04Å; M230-V515 HydrophobicContact CB-CB 3.89Å; M230-V515 HydrophobicContact CB-CG1 3.96Å; T231-V515 WeakPolarHBondContact OG1-CG2 3.25Å; L234-V515 HydrophobicContact CB-CG1 4.04Å; L234-V515 HydrophobicContact CD2-CG1 3.75Å; L234-V515 HydrophobicContact CG-CG1 4.46Å; L512-V515 HydrophobicContact CD2-CG2 4.2Å; L512-V515 WeakPolarHBondContact O-CG2 3.48Å; L513-V515 PolarHBondContact O-N 3.46Å
516	Q	94.8	Very high	94.2	Very high	47 Å²	47	32.4 Å²	32.4	22%	0.22	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-66.3	165.5	165.2	-64.7	179.8	2	0	0	110.5	G225 L226 L513 S518 G519	G225-Q516 WeakPolarHBondContact O-CA 3.45Å; L226-Q516 HydrophobicContact CD2-CG 3.8Å; L513-Q516 WeakPolarHBondContact O-CG 3.45Å; Q516-S518 VanDerWaalsContact C-N 3.3Å; Q516-S518 PolarHBondContact O-N 3.05Å; Q516-G519 WeakPolarHBondContact O-CA 3.2Å; Q516-G519 PolarHBondContact O-N 2.93Å
517	R	93.8	Very high	93.8	Very high	97 Å²	97	30.1 Å²	30.1	37%	0.366	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.4	176.3	-65.3	-165.8	-170.1	-176.2	4.4	112.6	N215 I216 T217 T223 G224 G225 G519	N215-R517 PolarHBondContact ND2-NE 3.29Å; N215-R517 WeakPolarHBondContact O-CB 3.48Å; N215-R517 WeakPolarHBondContact O-CD 3.31Å; N215-R517 WeakPolarHBondContact O-CG 3.32Å; I216-R517 WeakPolarHBondContact CA-O 3.38Å; I216-R517 WeakPolarHBondContact CG1-O 3.41Å; T217-R517 HydrophobicContact CG2-CB 3.8Å; T223-R517 PolarHBondContact O-N 2.64Å; G224-R517 WeakPolarHBondContact O-CD 3.33Å; G224-R517 WeakPolarHBondContact O-CG 3.39Å; G224-R517 PolarHBondContact O-NE 2.89Å; G225-R517 PolarHBondContact O-N 3.49Å; R517-G519 PolarHBondContact O-N 3.46Å
518	S	93.4	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	4	169.1	53.8	0	0	0	0	114.1	T217 E222 Q516 N520 Y521 F522	T217-S518 WeakPolarHBondContact OG1-CB 3.26Å; E222-S518 VanDerWaalsContact O-CB 3.24Å; E222-S518 WeakPolarHBondContact O-CB 3.28Å; E222-S518 PolarHBondContact O-OG 3.41Å; Q516-S518 VanDerWaalsContact C-N 3.3Å; Q516-S518 PolarHBondContact O-N 3.05Å; S518-N520 VanDerWaalsContact C-N 3.29Å; S518-N520 PolarHBondContact O-N 2.8Å; S518-Y521 WeakPolarHBondContact O-CB 3.41Å; S518-Y521 PolarHBondContact O-N 3.1Å; S518-F522 WeakPolarHBondContact O-CD2 3.29Å
519	G	93.2	Very high	92.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-33.1	-170.9	0	0	0	0	0	114.6	F514 Q516 R517 Y521 F522 V523	F514-G519 CarbonylContact O-C 3.15Å; F514-G519 VanDerWaalsContact O-CA 3.32Å; F514-G519 WeakPolarHBondContact O-CA 3.32Å; Q516-G519 WeakPolarHBondContact O-CA 3.2Å; Q516-G519 PolarHBondContact O-N 2.93Å; R517-G519 PolarHBondContact O-N 3.46Å; G519-Y521 VanDerWaalsContact C-N 3.27Å; G519-Y521 PolarHBondContact O-N 3.48Å; G519-F522 WeakPolarHBondContact O-CB 3.27Å; G519-F522 PolarHBondContact O-N 3.19Å; G519-F522 VanDerWaalsContact O-N 3.14Å; G519-V523 WeakPolarHBondContact O-CG2 3.4Å; G519-V523 PolarHBondContact O-N 3.34Å
520	N	92.1	Very high	92.5	Very high	12 Å²	12	27.7 Å²	27.7	6%	0.064	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-37.7	175.5	-174.5	59.8	0	0	0	112.1	W166 L214 I216 S518 F522 V523 T524	W166-N520 WeakPolarHBondContact CH2-OD1 3.44Å; L214-N520 HydrophobicContact CD1-CB 3.94Å; I216-N520 HydrophobicContact CD1-CB 4.1Å; S518-N520 VanDerWaalsContact C-N 3.29Å; S518-N520 PolarHBondContact O-N 2.8Å; N520-F522 VanDerWaalsContact C-N 3.34Å; N520-F522 PolarHBondContact O-N 3.13Å; N520-V523 WeakPolarHBondContact O-CB 3.36Å; N520-V523 PolarHBondContact O-N 3.31Å; N520-T524 PolarHBondContact O-N 3.47Å; N520-T524 PolarHBondContact O-OG1 2.92Å
521	Y	92.8	Very high	92	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-67.9	-34.8	177.7	-51.7	-45.8	0	0	0	112.2	I216 T217 I220 S518 G519 M525 Y601 N602 A603 W604	I216-Y521 HydrophobicContact CD1-CD1 4.49Å; I216-Y521 HydrophobicContact CD1-CE1 3.66Å; I216-Y521 HydrophobicContact CD1-CE2 4.19Å; I216-Y521 VanDerWaalsContact CD1-CZ 3.49Å; I216-Y521 WeakPolarHBondContact CD1-OH 3.45Å; I216-Y521 HydrophobicContact CG1-CE1 4.42Å; I216-Y521 HydrophobicContact CG1-CE2 4.06Å; T217-Y521 WeakPolarHBondContact O-CE2 3.48Å; T217-Y521 PolarHBondContact O-OH 2.94Å; I220-Y521 HydrophobicContact CB-CD2 4.16Å; S518-Y521 WeakPolarHBondContact O-CB 3.41Å; S518-Y521 PolarHBondContact O-N 3.1Å; G519-Y521 VanDerWaalsContact C-N 3.27Å; G519-Y521 PolarHBondContact O-N 3.48Å; Y521-M525 PolarHBondContact O-N 3.23Å; Y521-Y601 AromaticContact CD1-CD2 3.47Å; Y521-Y601 HydrophobicContact CD1-CD2 3.47Å; Y521-Y601 VanDerWaalsContact CD1-CD2 3.47Å; Y521-Y601 AromaticContact CD1-CE2 3.71Å; Y521-Y601 HydrophobicContact CD1-CE2 3.71Å; Y521-Y601 HydrophobicContact CD2-CE2 4.07Å; Y521-Y601 AromaticContact CE1-CD2 3.93Å; Y521-Y601 HydrophobicContact CE1-CD2 3.93Å; Y521-Y601 AromaticContact CE1-CE2 3.92Å; Y521-Y601 HydrophobicContact CE1-CE2 3.92Å; Y521-Y601 HydrophobicContact CE2-CE2 4.25Å; Y521-Y601 AromaticContact CG-CD2 3.83Å; Y521-Y601 HydrophobicContact CG-CD2 3.83Å; Y521-Y601 AromaticContact CG-CE2 3.79Å; Y521-Y601 HydrophobicContact CG-CE2 3.79Å; Y521-N602 VanDerWaalsContact CE1-O 3.31Å; Y521-N602 WeakPolarHBondContact CE1-O 3.42Å; Y521-A603 HydrophobicContact CE1-CB 4.31Å; Y521-W604 PolarHBondContact OH-N 2.98Å; Y521-W604 VanDerWaalsContact OH-N 3.14Å
522	F	93.8	Very high	91.6	Very high	11 Å²	11	23.4 Å²	23.4	5%	0.048	12%	0.117	C	C	.	.	H	α-helix	trans	-67.9	-38.4	171.9	-71.7	-83.3	0	0	0	112	I220 L513 F514 S518 G519 N520 M525 F526 W619 M623	I220-F522 HydrophobicContact CG1-CE2 4.16Å; I220-F522 HydrophobicContact CG1-CZ 4.28Å; L513-F522 HydrophobicContact CD1-CD1 4.24Å; L513-F522 HydrophobicContact CD1-CD2 4.45Å; L513-F522 HydrophobicContact CD1-CE1 4.09Å; L513-F522 HydrophobicContact CD1-CE2 4.31Å; L513-F522 HydrophobicContact CD1-CG 4.42Å; L513-F522 HydrophobicContact CD1-CZ 4.13Å; L513-F522 HydrophobicContact CD2-CD1 3.99Å; L513-F522 HydrophobicContact CD2-CE1 4.41Å; L513-F522 HydrophobicContact CD2-CG 4.4Å; L513-F522 HydrophobicContact CG-CD1 4.15Å; L513-F522 HydrophobicContact CG-CE1 4.49Å; L513-F522 HydrophobicContact CG-CG 4.18Å; F514-F522 HydrophobicContact CD1-CB 3.82Å; F514-F522 HydrophobicContact CE1-CB 4.04Å; S518-F522 WeakPolarHBondContact O-CD2 3.29Å; G519-F522 WeakPolarHBondContact O-CB 3.27Å; G519-F522 PolarHBondContact O-N 3.19Å; G519-F522 VanDerWaalsContact O-N 3.14Å; N520-F522 VanDerWaalsContact C-N 3.34Å; N520-F522 PolarHBondContact O-N 3.13Å; F522-M525 PolarHBondContact O-N 3.42Å; F522-F526 VanDerWaalsContact O-CD2 3.29Å; F522-F526 WeakPolarHBondContact O-CD2 3.47Å; F522-F526 PolarHBondContact O-N 3.12Å; F522-W619 HydrophobicContact CE1-CH2 4.25Å; F522-W619 HydrophobicContact CE1-CZ3 4.26Å; F522-W619 AromaticContact CZ-CH2 3.92Å; F522-W619 HydrophobicContact CZ-CH2 3.92Å; F522-W619 HydrophobicContact CZ-CZ3 4.31Å; F522-M623 HydrophobicContact CD1-CE 3.67Å; F522-M623 HydrophobicContact CE1-CE 3.42Å; F522-M623 VanDerWaalsContact CE1-CE 3.42Å; F522-M623 HydrophobicContact CE1-SD 4.12Å
523	V	92.8	Very high	91.4	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-59.9	-48.6	174.9	171.9	0	0	0	0	110.4	Y159 V162 W166 F514 G519 N520 M525 F526 D527	Y159-V523 HydrophobicContact CD2-CG1 4.24Å; V162-V523 HydrophobicContact CG1-CG2 4.17Å; W166-V523 HydrophobicContact CH2-CB 4.16Å; W166-V523 HydrophobicContact CH2-CG1 3.99Å; W166-V523 HydrophobicContact CH2-CG2 3.96Å; W166-V523 HydrophobicContact CZ2-CG2 4.17Å; W166-V523 HydrophobicContact CZ3-CG1 4.46Å; F514-V523 HydrophobicContact CB-CG2 3.81Å; F514-V523 HydrophobicContact CD1-CG2 3.65Å; F514-V523 HydrophobicContact CG-CG2 3.98Å; G519-V523 WeakPolarHBondContact O-CG2 3.4Å; G519-V523 PolarHBondContact O-N 3.34Å; N520-V523 WeakPolarHBondContact O-CB 3.36Å; N520-V523 PolarHBondContact O-N 3.31Å; V523-M525 VanDerWaalsContact C-N 3.34Å; V523-M525 PolarHBondContact O-N 2.92Å; V523-F526 PolarHBondContact O-N 3.23Å; V523-D527 PolarHBondContact O-N 2.92Å
524	T	89.4	Confident	91.3	Very high	41 Å²	41	19.7 Å²	19.7	25%	0.252	10%	0.098	S	C	.	.	H	α-helix	trans	-58.8	-45.3	176.5	-53.8	0	0	0	0	111.6	N520 F526 D527 D528	N520-T524 PolarHBondContact O-N 3.47Å; N520-T524 PolarHBondContact O-OG1 2.92Å; T524-F526 VanDerWaalsContact C-N 3.34Å; T524-F526 PolarHBondContact O-N 3.46Å; T524-D527 PolarHBondContact O-N 3.04Å; T524-D528 WeakPolarHBondContact O-CB 3.41Å; T524-D528 PolarHBondContact O-N 3.22Å
525	M	91.9	Very high	91.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.9	-41.3	178.5	-170.1	-167.8	-66.7	0	0	112.6	I220 Y521 F522 V523 Y529 Y616 A620 M623 A624	I220-M525 HydrophobicContact CD1-CE 3.77Å; Y521-M525 PolarHBondContact O-N 3.23Å; F522-M525 PolarHBondContact O-N 3.42Å; V523-M525 VanDerWaalsContact C-N 3.34Å; V523-M525 PolarHBondContact O-N 2.92Å; M525-Y529 HydrophobicContact CG-CD2 4.06Å; M525-Y529 WeakPolarHBondContact O-CB 3.38Å; M525-Y529 WeakPolarHBondContact O-CD2 3.46Å; M525-Y529 PolarHBondContact O-N 3.1Å; M525-Y616 WeakPolarHBondContact CB-OH 3.44Å; M525-Y616 HydrophobicContact CE-CD1 3.69Å; M525-Y616 HydrophobicContact CE-CE1 3.34Å; M525-A620 HydrophobicContact CE-CB 3.81Å; M525-M623 HydrophobicContact CE-CE 3.66Å; M525-M623 HydrophobicContact SD-CE 3.3Å; M525-M623 WeakPolarHBondContact SD-CE 3.33Å; M525-A624 HydrophobicContact CG-CB 4.12Å; M525-A624 HydrophobicContact SD-CB 4.03Å
526	F	92.3	Very high	91	Very high	15 Å²	15	19.5 Å²	19.5	7%	0.066	10%	0.097	C	C	.	.	H	α-helix	trans	-67	-42	176.5	-89.2	-115.3	0	0	0	111.3	F155 Y159 L513 F514 F522 V523 T524 D528 S530 L627	F155-F526 HydrophobicContact CB-CD1 4.4Å; F155-F526 HydrophobicContact CD1-CE1 4.1Å; Y159-F526 HydrophobicContact CD1-CB 3.99Å; Y159-F526 HydrophobicContact CG-CB 4.42Å; L513-F526 HydrophobicContact CD2-CE2 4.44Å; F514-F526 HydrophobicContact CE1-CB 4.39Å; F514-F526 HydrophobicContact CE1-CD1 4.3Å; F514-F526 AromaticContact CE1-CD2 3.71Å; F514-F526 HydrophobicContact CE1-CD2 3.71Å; F514-F526 AromaticContact CE1-CE2 3.96Å; F514-F526 HydrophobicContact CE1-CE2 3.96Å; F514-F526 AromaticContact CE1-CG 3.88Å; F514-F526 HydrophobicContact CE1-CG 3.88Å; F514-F526 HydrophobicContact CE1-CZ 4.36Å; F514-F526 AromaticContact CZ-CD1 3.89Å; F514-F526 HydrophobicContact CZ-CD1 3.89Å; F514-F526 HydrophobicContact CZ-CD2 4.04Å; F514-F526 AromaticContact CZ-CE1 3.9Å; F514-F526 HydrophobicContact CZ-CE1 3.9Å; F514-F526 HydrophobicContact CZ-CE2 4.04Å; F514-F526 AromaticContact CZ-CG 3.95Å; F514-F526 HydrophobicContact CZ-CG 3.95Å; F514-F526 AromaticContact CZ-CZ 3.96Å; F514-F526 HydrophobicContact CZ-CZ 3.96Å; F522-F526 VanDerWaalsContact O-CD2 3.29Å; F522-F526 WeakPolarHBondContact O-CD2 3.47Å; F522-F526 PolarHBondContact O-N 3.12Å; V523-F526 PolarHBondContact O-N 3.23Å; T524-F526 VanDerWaalsContact C-N 3.34Å; T524-F526 PolarHBondContact O-N 3.46Å; F526-D528 VanDerWaalsContact C-N 3.35Å; F526-D528 PolarHBondContact O-N 2.85Å; F526-S530 WeakPolarHBondContact O-CB 3.44Å; F526-S530 PolarHBondContact O-N 2.7Å; F526-S530 PolarHBondContact O-OG 3.11Å; F526-L627 HydrophobicContact CD1-CD1 4.41Å; F526-L627 HydrophobicContact CD1-CD2 4.45Å; F526-L627 HydrophobicContact CD2-CD1 3.75Å; F526-L627 HydrophobicContact CE1-CD1 4.37Å; F526-L627 HydrophobicContact CE1-CD2 3.76Å; F526-L627 HydrophobicContact CE2-CD1 3.72Å; F526-L627 HydrophobicContact CE2-CD2 4.08Å; F526-L627 HydrophobicContact CG-CD1 4.13Å; F526-L627 HydrophobicContact CZ-CD1 4.05Å; F526-L627 HydrophobicContact CZ-CD2 3.56Å; F526-L627 HydrophobicContact CZ-CG 4.45Å
527	D	87.6	Confident	91	Very high	42 Å²	42	18.7 Å²	18.7	23%	0.225	10%	0.095	C	C	.	.	H	α-helix	trans	-62.8	-41.4	178.3	-167	36.6	0	0	0	112	R88 Y159 V523 T524	R88-D527 IonicContact NH1-OD1 3.49Å; R88-D527 PolarHBondContact NH1-OD1 3.15Å; Y159-D527 HydrophobicContact CD2-CB 4.45Å; Y159-D527 HydrophobicContact CE2-CB 3.78Å; Y159-D527 WeakPolarHBondContact CE2-OD1 3.38Å; Y159-D527 VanDerWaalsContact CZ-OD1 3.31Å; Y159-D527 PolarHBondContact OH-OD1 3.41Å; V523-D527 PolarHBondContact O-N 2.92Å; T524-D527 PolarHBondContact O-N 3.04Å
528	D	85.6	Confident	91	Very high	71 Å²	71	14 Å²	14	38%	0.38	8%	0.078	S	C	.	.	H	α-helix	trans	-75.2	-41.3	-176.9	-70.5	-20.2	0	0	0	113	T524 F526	T524-D528 WeakPolarHBondContact O-CB 3.41Å; T524-D528 PolarHBondContact O-N 3.22Å; F526-D528 VanDerWaalsContact C-N 3.35Å; F526-D528 PolarHBondContact O-N 2.85Å
529	Y	88.6	Confident	91.1	Very high	30 Å²	30	14.1 Å²	14.1	12%	0.118	8%	0.078	C	C	.	.	H	α-helix	trans	-109.1	-27	-169	-64.4	-87.9	0	0	0	115	M525 A531 M594 A599 Y616 A624 I628	M525-Y529 HydrophobicContact CG-CD2 4.06Å; M525-Y529 WeakPolarHBondContact O-CB 3.38Å; M525-Y529 WeakPolarHBondContact O-CD2 3.46Å; M525-Y529 PolarHBondContact O-N 3.1Å; Y529-A531 PolarHBondContact O-N 3.19Å; Y529-M594 HydrophobicContact CD1-CE 4.12Å; Y529-M594 HydrophobicContact CE1-CE 4.41Å; Y529-A599 WeakPolarHBondContact OH-CB 3.25Å; Y529-Y616 HydrophobicContact CE2-CE2 4.02Å; Y529-A624 HydrophobicContact CD1-CB 4.27Å; Y529-A624 HydrophobicContact CD2-CB 4.15Å; Y529-A624 HydrophobicContact CG-CB 4.03Å; Y529-I628 HydrophobicContact CD1-CD1 4.01Å; Y529-I628 WeakPolarHBondContact O-CG1 3.31Å
530	S	89.2	Confident	91.2	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-78	-21.8	-169	76.4	0	0	0	0	114.7	F526	F526-S530 WeakPolarHBondContact O-CB 3.44Å; F526-S530 PolarHBondContact O-N 2.7Å; F526-S530 PolarHBondContact O-OG 3.11Å
531	A	85.6	Confident	91.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-128.1	-39.1	-168.7	0	0	0	0	0	114.4	V152 V156 F310 Y529 L533 L535	V152-A531 HydrophobicContact CG1-CB 4.08Å; V156-A531 HydrophobicContact CG2-CB 3.64Å; F310-A531 HydrophobicContact CE1-CB 3.89Å; F310-A531 HydrophobicContact CZ-CB 3.46Å; F310-A531 VanDerWaalsContact CZ-CB 3.46Å; Y529-A531 PolarHBondContact O-N 3.19Å; A531-L533 PolarHBondContact O-N 3.05Å; A531-L535 HydrophobicContact CB-CD1 3.92Å; A531-L535 HydrophobicContact CB-CG 4.36Å; A531-L535 WeakPolarHBondContact O-CB 3.23Å; A531-L535 WeakPolarHBondContact O-CD1 3.41Å; A531-L535 WeakPolarHBondContact O-CG 3.38Å; A531-L535 PolarHBondContact O-N 3.4Å
532	G	86.5	Confident	91.5	Very high	13 Å²	13	16.8 Å²	16.8	13%	0.134	9%	0.092	C	C	.	.	H	α-helix	trans	-53.4	-62.8	-173.6	0	0	0	0	0	114.8	T536	G532-T536 PolarHBondContact O-N 3.44Å; G532-T536 PolarHBondContact O-OG1 3.35Å
533	L	90.6	Very high	91.6	Very high	18 Å²	18	16.3 Å²	16.3	9%	0.094	9%	0.09	C	C	.	.	H	α-helix	trans	-68.4	-48.4	178.2	178.2	67.3	0	0	0	112.4	A531 L535 T536 V537 I587 T590 V591 M594 I628	A531-L533 PolarHBondContact O-N 3.05Å; L533-L535 PolarHBondContact O-N 3.26Å; L533-T536 PolarHBondContact O-N 3.34Å; L533-V537 HydrophobicContact CD1-CG2 4.25Å; L533-V537 WeakPolarHBondContact O-CG2 3.47Å; L533-V537 PolarHBondContact O-N 2.93Å; L533-V537 VanDerWaalsContact O-N 3.07Å; L533-I587 HydrophobicContact CD1-CG2 4.42Å; L533-T590 HydrophobicContact CB-CG2 4.3Å; L533-T590 HydrophobicContact CD1-CG2 4.24Å; L533-V591 HydrophobicContact CD1-CG2 4.3Å; L533-M594 HydrophobicContact CB-CE 4.36Å; L533-M594 HydrophobicContact CD2-SD 4.17Å; L533-I628 HydrophobicContact CD2-CG2 4.08Å
534	P	92.6	Very high	91.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.1	-43.3	178.7	-29	38	0	0	0	114.3	V152 T536 V537 V538 A631 M632	V152-P534 HydrophobicContact CG2-CB 3.8Å; P534-T536 PolarHBondContact O-N 3.41Å; P534-V537 PolarHBondContact O-N 3.11Å; P534-V538 WeakPolarHBondContact O-CG2 3.47Å; P534-V538 PolarHBondContact O-N 3.44Å; P534-A631 HydrophobicContact CB-CB 3.73Å; P534-A631 HydrophobicContact CG-CB 3.77Å; P534-M632 HydrophobicContact CB-CG 4.12Å; P534-M632 HydrophobicContact CG-CG 4.28Å
535	L	91.4	Very high	92	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-44.8	177.1	-74.1	171.2	0	0	0	111.5	V152 F310 F316 A531 L533 V537 V538 V539	V152-L535 HydrophobicContact CB-CD2 4.32Å; V152-L535 HydrophobicContact CG1-CD1 4.35Å; V152-L535 HydrophobicContact CG1-CD2 3.49Å; V152-L535 VanDerWaalsContact CG1-CD2 3.49Å; V152-L535 HydrophobicContact CG1-CG 3.7Å; F310-L535 HydrophobicContact CE1-CD1 4.17Å; F310-L535 HydrophobicContact CE2-CD1 4.35Å; F310-L535 HydrophobicContact CZ-CD1 4.09Å; F316-L535 HydrophobicContact CD2-CD1 4.35Å; F316-L535 HydrophobicContact CD2-CD2 3.75Å; F316-L535 HydrophobicContact CE2-CD1 3.41Å; F316-L535 VanDerWaalsContact CE2-CD1 3.41Å; F316-L535 HydrophobicContact CE2-CD2 3.65Å; F316-L535 HydrophobicContact CE2-CG 4.19Å; F316-L535 HydrophobicContact CG-CD2 4.41Å; F316-L535 HydrophobicContact CZ-CD1 3.62Å; F316-L535 HydrophobicContact CZ-CD2 4.22Å; A531-L535 HydrophobicContact CB-CD1 3.92Å; A531-L535 HydrophobicContact CB-CG 4.36Å; A531-L535 WeakPolarHBondContact O-CB 3.23Å; A531-L535 WeakPolarHBondContact O-CD1 3.41Å; A531-L535 WeakPolarHBondContact O-CG 3.38Å; A531-L535 PolarHBondContact O-N 3.4Å; L533-L535 PolarHBondContact O-N 3.26Å; L535-V537 VanDerWaalsContact C-N 3.25Å; L535-V537 PolarHBondContact O-N 2.91Å; L535-V538 PolarHBondContact O-N 2.94Å; L535-V538 VanDerWaalsContact O-N 3.15Å; L535-V539 WeakPolarHBondContact O-CB 3.39Å; L535-V539 VanDerWaalsContact O-CG2 3.27Å; L535-V539 WeakPolarHBondContact O-CG2 3.49Å; L535-V539 PolarHBondContact O-N 3.04Å
536	T	92.4	Very high	92.1	Very high	2 Å²	2	17 Å²	17	1%	0.012	9%	0.091	C	C	.	.	H	α-helix	trans	-61.4	-38.9	-179.8	-51.1	0	0	0	0	110.9	F309 G532 L533 P534 I540 L583 L586 I587	F309-T536 HydrophobicContact CE2-CG2 4Å; G532-T536 PolarHBondContact O-N 3.44Å; G532-T536 PolarHBondContact O-OG1 3.35Å; L533-T536 PolarHBondContact O-N 3.34Å; P534-T536 PolarHBondContact O-N 3.41Å; T536-I540 WeakPolarHBondContact O-CG2 3.46Å; T536-I540 PolarHBondContact O-N 2.84Å; T536-I540 VanDerWaalsContact O-N 3.11Å; T536-L583 HydrophobicContact CG2-CD2 4.26Å; T536-L586 HydrophobicContact CG2-CB 4.46Å; T536-I587 HydrophobicContact CG2-CD1 4.16Å; T536-I587 HydrophobicContact CG2-CG1 3.51Å
537	V	94.6	Very high	92.1	Very high	30 Å²	30	16.3 Å²	16.3	18%	0.182	9%	0.089	C	C	.	.	H	α-helix	trans	-68.3	-40.5	174.9	174.5	0	0	0	0	112	L533 P534 L535 I540 L541 I587 M632 L635	L533-V537 HydrophobicContact CD1-CG2 4.25Å; L533-V537 WeakPolarHBondContact O-CG2 3.47Å; L533-V537 PolarHBondContact O-N 2.93Å; L533-V537 VanDerWaalsContact O-N 3.07Å; P534-V537 PolarHBondContact O-N 3.11Å; L535-V537 VanDerWaalsContact C-N 3.25Å; L535-V537 PolarHBondContact O-N 2.91Å; V537-I540 WeakPolarHBondContact O-CG2 3.17Å; V537-L541 HydrophobicContact CG1-CD1 4.18Å; V537-L541 VanDerWaalsContact O-CG 3.26Å; V537-L541 WeakPolarHBondContact O-CG 3.17Å; V537-L541 PolarHBondContact O-N 3.22Å; V537-I587 HydrophobicContact CG2-CD1 4.24Å; V537-M632 HydrophobicContact CB-SD 4.27Å; V537-M632 HydrophobicContact CG1-SD 4.35Å; V537-M632 HydrophobicContact CG2-SD 4.02Å; V537-L635 HydrophobicContact CG1-CD1 3.81Å
538	V	95.1	Very high	92.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.1	-52.7	175	168.1	0	0	0	0	110	I145 S148 S149 P534 L535 I540 L541 E542	I145-V538 HydrophobicContact CG2-CG1 4.15Å; S148-V538 VanDerWaalsContact OG-CG2 3.32Å; S148-V538 WeakPolarHBondContact OG-CG2 3.35Å; S149-V538 WeakPolarHBondContact OG-CG1 3.42Å; P534-V538 WeakPolarHBondContact O-CG2 3.47Å; P534-V538 PolarHBondContact O-N 3.44Å; L535-V538 PolarHBondContact O-N 2.94Å; L535-V538 VanDerWaalsContact O-N 3.15Å; V538-I540 PolarHBondContact O-N 2.68Å; V538-L541 WeakPolarHBondContact O-CB 3.41Å; V538-L541 PolarHBondContact O-N 2.99Å; V538-E542 HydrophobicContact CG1-CG 4.16Å; V538-E542 WeakPolarHBondContact O-CG 3.21Å; V538-E542 PolarHBondContact O-N 3.44Å
539	V	95.3	Very high	92.8	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-61	-39.3	-176.1	171.6	0	0	0	0	112.5	L116 L314 L535 E542 N543 L583	L116-V539 HydrophobicContact CD1-CG1 3.63Å; L314-V539 HydrophobicContact CB-CG2 4.06Å; L535-V539 WeakPolarHBondContact O-CB 3.39Å; L535-V539 VanDerWaalsContact O-CG2 3.27Å; L535-V539 WeakPolarHBondContact O-CG2 3.49Å; L535-V539 PolarHBondContact O-N 3.04Å; V539-E542 PolarHBondContact O-N 3.06Å; V539-N543 WeakPolarHBondContact O-CB 3.35Å; V539-N543 PolarHBondContact O-N 3.43Å; V539-L583 HydrophobicContact CG1-CD1 4.1Å; V539-L583 HydrophobicContact CG1-CD2 4.28Å
540	I	95.6	Very high	93	Very high	15 Å²	15	21.3 Å²	21.3	8%	0.077	10%	0.104	C	C	.	.	H	α-helix	trans	-65.6	-40	174.8	-168.8	175.6	0	0	0	111.7	T536 V537 V538 N543 I544 L583 V584 I587	T536-I540 WeakPolarHBondContact O-CG2 3.46Å; T536-I540 PolarHBondContact O-N 2.84Å; T536-I540 VanDerWaalsContact O-N 3.11Å; V537-I540 WeakPolarHBondContact O-CG2 3.17Å; V538-I540 PolarHBondContact O-N 2.68Å; I540-N543 PolarHBondContact O-N 3.05Å; I540-I544 HydrophobicContact CD1-CD1 4.3Å; I540-I544 HydrophobicContact CG1-CD1 3.84Å; I540-I544 HydrophobicContact CG1-CG1 4.34Å; I540-I544 WeakPolarHBondContact O-CB 3.36Å; I540-I544 VanDerWaalsContact O-CG1 3.27Å; I540-I544 WeakPolarHBondContact O-CG1 3.49Å; I540-I544 PolarHBondContact O-N 3.48Å; I540-L583 HydrophobicContact CB-CB 4.03Å; I540-L583 HydrophobicContact CB-CD1 3.99Å; I540-L583 HydrophobicContact CD1-CB 3.99Å; I540-L583 HydrophobicContact CG1-CB 4.02Å; I540-L583 HydrophobicContact CG1-CD1 4.25Å; I540-V584 HydrophobicContact CD1-CG2 3.51Å; I540-I587 HydrophobicContact CB-CD1 4.36Å; I540-I587 HydrophobicContact CD1-CD1 4.14Å; I540-I587 HydrophobicContact CG2-CD1 3.72Å
541	L	95.8	Very high	93.2	Very high	51 Å²	51	22.2 Å²	22.2	27%	0.267	11%	0.114	S	C	.	.	H	α-helix	trans	-67.9	-38.7	177.7	-69.6	175.2	0	0	0	111.3	I145 V537 V538 I544 S545 L635	I145-L541 HydrophobicContact CD1-CB 3.85Å; I145-L541 HydrophobicContact CG1-CB 4.14Å; V537-L541 HydrophobicContact CG1-CD1 4.18Å; V537-L541 VanDerWaalsContact O-CG 3.26Å; V537-L541 WeakPolarHBondContact O-CG 3.17Å; V537-L541 PolarHBondContact O-N 3.22Å; V538-L541 WeakPolarHBondContact O-CB 3.41Å; V538-L541 PolarHBondContact O-N 2.99Å; L541-I544 PolarHBondContact O-N 3.22Å; L541-S545 VanDerWaalsContact O-CB 3.25Å; L541-S545 WeakPolarHBondContact O-CB 3.03Å; L541-S545 PolarHBondContact O-N 3.36Å; L541-S545 PolarHBondContact O-OG 3.08Å; L541-L635 HydrophobicContact CD1-CD1 3.73Å; L541-L635 HydrophobicContact CD1-CD2 3.83Å; L541-L635 HydrophobicContact CD1-CG 4.26Å
542	E	95.4	Very high	93.5	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.019	12%	0.115	C	C	.	.	H	α-helix	trans	-58.3	-49.5	172.9	-69.4	-172.8	149.3	0	0	111.2	W135 I145 V538 V539 S545 V546	W135-E542 HydrophobicContact CH2-CB 3.51Å; W135-E542 HydrophobicContact CH2-CG 3.66Å; W135-E542 HydrophobicContact CZ2-CB 3.63Å; W135-E542 VanDerWaalsContact CZ2-CD 3.42Å; W135-E542 HydrophobicContact CZ2-CG 3.24Å; W135-E542 VanDerWaalsContact CZ2-OE1 3.31Å; W135-E542 WeakPolarHBondContact CZ2-OE1 3.35Å; W135-E542 HydrophobicContact CZ3-CB 4.34Å; W135-E542 HydrophobicContact CZ3-CG 4.47Å; W135-E542 PolarHBondContact NE1-OE1 2.92Å; I145-E542 HydrophobicContact CG2-CG 3.44Å; I145-E542 VanDerWaalsContact CG2-CG 3.44Å; V538-E542 HydrophobicContact CG1-CG 4.16Å; V538-E542 WeakPolarHBondContact O-CG 3.21Å; V538-E542 PolarHBondContact O-N 3.44Å; V539-E542 PolarHBondContact O-N 3.06Å; E542-S545 WeakPolarHBondContact O-CB 3.29Å; E542-S545 PolarHBondContact O-N 3.22Å; E542-V546 PolarHBondContact O-N 2.95Å; E542-V546 VanDerWaalsContact O-N 3.13Å
543	N	95.7	Very high	93.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-45.5	179.1	-170.8	23.5	0	0	0	112.1	L116 V539 I540 S545 V546 A547 W575 P580	L116-N543 HydrophobicContact CD2-CB 3.79Å; V539-N543 WeakPolarHBondContact O-CB 3.35Å; V539-N543 PolarHBondContact O-N 3.43Å; I540-N543 PolarHBondContact O-N 3.05Å; N543-S545 VanDerWaalsContact C-N 3.31Å; N543-S545 PolarHBondContact O-N 3.48Å; N543-V546 PolarHBondContact O-N 3.06Å; N543-A547 WeakPolarHBondContact O-CB 3.43Å; N543-A547 PolarHBondContact O-N 3.46Å; N543-W575 PolarHBondContact ND2-O 3.18Å; N543-W575 PolarHBondContact OD1-O 3.24Å; N543-P580 WeakPolarHBondContact ND2-CD 3.38Å; N543-P580 VanDerWaalsContact ND2-CG 3.32Å; N543-P580 WeakPolarHBondContact ND2-CG 3.34Å
544	I	95.6	Very high	93.9	Very high	58 Å²	58	33.5 Å²	33.5	30%	0.297	16%	0.156	S	C	.	.	H	α-helix	trans	-61.8	-40.6	176.1	-70.2	170.9	0	0	0	110.9	I540 L541 V546 W548 I549	I540-I544 HydrophobicContact CD1-CD1 4.3Å; I540-I544 HydrophobicContact CG1-CD1 3.84Å; I540-I544 HydrophobicContact CG1-CG1 4.34Å; I540-I544 WeakPolarHBondContact O-CB 3.36Å; I540-I544 VanDerWaalsContact O-CG1 3.27Å; I540-I544 WeakPolarHBondContact O-CG1 3.49Å; I540-I544 PolarHBondContact O-N 3.48Å; L541-I544 PolarHBondContact O-N 3.22Å; I544-V546 VanDerWaalsContact C-N 3.33Å; I544-V546 PolarHBondContact O-N 3.4Å; I544-W548 HydrophobicContact CG2-CB 4.29Å; I544-W548 WeakPolarHBondContact O-CA 3.28Å; I544-W548 WeakPolarHBondContact O-CB 3.3Å; I544-W548 PolarHBondContact O-N 3.06Å; I544-I549 PolarHBondContact O-N 3.15Å
545	S	94.1	Very high	93.9	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	16%	0.158	C	C	.	.	I	π-helix	trans	-59.3	-43.8	179.4	-60.9	0	0	0	0	111.8	L142 I145 L541 E542 N543 I549 Y550	L142-S545 WeakPolarHBondContact CD1-OG 3.21Å; I145-S545 VanDerWaalsContact CD1-OG 3.29Å; I145-S545 WeakPolarHBondContact CD1-OG 3.33Å; L541-S545 VanDerWaalsContact O-CB 3.25Å; L541-S545 WeakPolarHBondContact O-CB 3.03Å; L541-S545 PolarHBondContact O-N 3.36Å; L541-S545 PolarHBondContact O-OG 3.08Å; E542-S545 WeakPolarHBondContact O-CB 3.29Å; E542-S545 PolarHBondContact O-N 3.22Å; N543-S545 VanDerWaalsContact C-N 3.31Å; N543-S545 PolarHBondContact O-N 3.48Å; S545-I549 WeakPolarHBondContact O-CB 3.43Å; S545-I549 PolarHBondContact O-N 3.37Å; S545-Y550 PolarHBondContact O-N 2.89Å
546	V	94.4	Very high	94	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.018	16%	0.158	C	C	.	.	I	π-helix	trans	-81.5	-48.1	180	179.9	0	0	0	0	111.6	L119 V123 W135 E542 N543 I544 Y550 G551 F555	L119-V546 HydrophobicContact CD1-CB 4.13Å; L119-V546 HydrophobicContact CD1-CG1 4.18Å; L119-V546 HydrophobicContact CD2-CB 4.35Å; L119-V546 HydrophobicContact CD2-CG2 3.95Å; L119-V546 HydrophobicContact CG-CB 4.44Å; L119-V546 HydrophobicContact CG-CG1 4.31Å; V123-V546 HydrophobicContact CG2-CG2 3.99Å; W135-V546 HydrophobicContact CH2-CG2 4.02Å; W135-V546 HydrophobicContact CZ3-CG2 3.84Å; E542-V546 PolarHBondContact O-N 2.95Å; E542-V546 VanDerWaalsContact O-N 3.13Å; N543-V546 PolarHBondContact O-N 3.06Å; I544-V546 VanDerWaalsContact C-N 3.33Å; I544-V546 PolarHBondContact O-N 3.4Å; V546-Y550 WeakPolarHBondContact O-CB 3.48Å; V546-G551 PolarHBondContact O-N 3.43Å; V546-F555 HydrophobicContact CG1-CB 4.31Å; V546-F555 HydrophobicContact CG1-CD1 3.75Å; V546-F555 HydrophobicContact CG1-CD2 3.96Å; V546-F555 HydrophobicContact CG1-CE1 3.97Å; V546-F555 HydrophobicContact CG1-CE2 4.19Å; V546-F555 HydrophobicContact CG1-CG 3.74Å; V546-F555 HydrophobicContact CG1-CZ 4.19Å
547	A	93.3	Very high	94.1	Very high	1 Å²	1	38 Å²	38	1%	0.008	18%	0.177	C	C	.	.	I	π-helix	trans	-75.5	-32.3	-172.6	0	0	0	0	0	113.6	N543 T552 W575 R576	N543-A547 WeakPolarHBondContact O-CB 3.43Å; N543-A547 PolarHBondContact O-N 3.46Å; A547-T552 WeakPolarHBondContact CA-OG1 3.46Å; A547-T552 PolarHBondContact O-N 3.08Å; A547-T552 PolarHBondContact O-OG1 3.08Å; A547-W575 HydrophobicContact CB-CB 4.17Å; A547-W575 WeakPolarHBondContact CB-O 3.16Å; A547-R576 PolarHBondContact O-NH1 3.02Å
548	W	93.4	Very high	94	Very high	127 Å²	127	37.3 Å²	37.3	48%	0.481	17%	0.172	S	C	.	.	I	π-helix	trans	-109.4	-41.5	-174.5	-66.1	70.1	0	0	0	114.3	I544 R576	I544-W548 HydrophobicContact CG2-CB 4.29Å; I544-W548 WeakPolarHBondContact O-CA 3.28Å; I544-W548 WeakPolarHBondContact O-CB 3.3Å; I544-W548 PolarHBondContact O-N 3.06Å; W548-R576 VanDerWaalsContact CE3-CZ 3.44Å; W548-R576 WeakPolarHBondContact CZ2-O 3.31Å; W548-R576 PolarHBondContact NE1-O 3.34Å; W548-R576 VanDerWaalsContact NE1-O 3.1Å
549	I	93.4	Very high	93.9	Very high	82 Å²	82	37.3 Å²	37.3	42%	0.421	17%	0.172	S	C	.	.	I	π-helix	trans	-87.2	-52.1	-175.6	-60.2	174.4	0	0	0	110.8	Y139 L142 I544 S545 G551	Y139-I549 HydrophobicContact CD2-CG2 4.26Å; Y139-I549 HydrophobicContact CG-CG2 4.11Å; L142-I549 HydrophobicContact CD1-CD1 3.35Å; I544-I549 PolarHBondContact O-N 3.15Å; S545-I549 WeakPolarHBondContact O-CB 3.43Å; S545-I549 PolarHBondContact O-N 3.37Å; I549-G551 VanDerWaalsContact C-N 3.35Å
550	Y	92.5	Very high	93.8	Very high	38 Å²	38	40.8 Å²	40.8	15%	0.149	19%	0.188	C	C	.	.	I	π-helix	trans	-69.8	-36.3	173.5	-167.2	-103.1	0	0	0	112.1	V138 S545 V546 R554 F555 D558	V138-Y550 HydrophobicContact CG1-CD2 4.14Å; V138-Y550 HydrophobicContact CG1-CG 4.39Å; S545-Y550 PolarHBondContact O-N 2.89Å; V546-Y550 WeakPolarHBondContact O-CB 3.48Å; Y550-R554 HydrophobicContact CE1-CB 4.38Å; Y550-R554 HydrophobicContact CE1-CG 3.91Å; Y550-R554 PolarHBondContact OH-NE 3.19Å; Y550-F555 HydrophobicContact CD1-CB 4.1Å; Y550-F555 HydrophobicContact CD1-CD2 4.47Å; Y550-F555 HydrophobicContact CE1-CB 4.31Å; Y550-F555 HydrophobicContact CE1-CD2 4.38Å; Y550-D558 WeakPolarHBondContact CE1-OD2 3.32Å; Y550-D558 PolarHBondContact OH-OD2 2.89Å
551	G	93	Very high	93.7	Very high	19 Å²	19	45.6 Å²	45.6	20%	0.196	21%	0.214	C	C	.	.	I	π-helix	trans	95.6	120.6	175.2	0	0	0	0	0	112.7	V546 I549 K553 R554 F555	V546-G551 PolarHBondContact O-N 3.43Å; I549-G551 VanDerWaalsContact C-N 3.35Å; G551-K553 VanDerWaalsContact C-N 3.28Å; G551-K553 PolarHBondContact O-N 3.07Å; G551-R554 PolarHBondContact O-N 3.24Å; G551-F555 PolarHBondContact O-N 3.02Å
552	T	92.4	Very high	93.5	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-34.2	-177.3	-42.4	0	0	0	0	113.7	A547 F555 M556 Y572 W575	A547-T552 WeakPolarHBondContact CA-OG1 3.46Å; A547-T552 PolarHBondContact O-N 3.08Å; A547-T552 PolarHBondContact O-OG1 3.08Å; T552-F555 PolarHBondContact O-N 3.35Å; T552-M556 HydrophobicContact CG2-CG 4.42Å; T552-M556 WeakPolarHBondContact O-CB 3.42Å; T552-M556 VanDerWaalsContact O-CG 3.26Å; T552-M556 WeakPolarHBondContact O-CG 3.48Å; T552-M556 PolarHBondContact O-N 3.15Å; T552-Y572 HydrophobicContact CG2-CD2 3.45Å; T552-Y572 VanDerWaalsContact CG2-CD2 3.45Å; T552-Y572 HydrophobicContact CG2-CE2 3.87Å; T552-Y572 HydrophobicContact CG2-CG 4.15Å; T552-W575 HydrophobicContact CG2-CE3 4.23Å
553	K	92.6	Very high	93.3	Very high	152 Å²	152	45 Å²	45	66%	0.661	21%	0.211	S	C	*	.	H	α-helix	trans	-63.8	-45.4	178.7	-68.7	-175.2	-179.9	-179.1	0	111.8	G551 M556 Q557 Y572	G551-K553 VanDerWaalsContact C-N 3.28Å; G551-K553 PolarHBondContact O-N 3.07Å; K553-M556 PolarHBondContact O-N 2.84Å; K553-Q557 PolarHBondContact O-N 2.73Å; K553-Q557 VanDerWaalsContact O-N 3.16Å; K553-Y572 HydrophobicContact CG-CE2 4.05Å
554	R	92.3	Very high	93.1	Very high	111 Å²	111	48.5 Å²	48.5	42%	0.419	25%	0.246	S	C	.	.	H	α-helix	trans	-64.5	-46.7	176.7	-176.7	-178.5	-178.6	166.8	6.9	110.5	Y550 G551 M556 Q557 D558	Y550-R554 HydrophobicContact CE1-CB 4.38Å; Y550-R554 HydrophobicContact CE1-CG 3.91Å; Y550-R554 PolarHBondContact OH-NE 3.19Å; G551-R554 PolarHBondContact O-N 3.24Å; R554-M556 VanDerWaalsContact C-N 3.31Å; R554-M556 PolarHBondContact O-N 3.15Å; R554-Q557 WeakPolarHBondContact O-CA 3.29Å; R554-Q557 WeakPolarHBondContact O-CB 3.24Å; R554-Q557 PolarHBondContact O-N 3.13Å; R554-D558 PolarHBondContact O-N 3.28Å
555	F	93.9	Very high	92.9	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.039	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-39.8	177.9	-170.9	-121.7	0	0	0	112.9	L119 A122 V123 V546 Y550 G551 T552 Q557 D558 L559 W575	L119-F555 HydrophobicContact CG-CE1 4.38Å; A122-F555 HydrophobicContact CB-CE2 4.47Å; A122-F555 HydrophobicContact CB-CZ 3.78Å; V123-F555 HydrophobicContact CG2-CE2 3.68Å; V123-F555 HydrophobicContact CG2-CZ 3.73Å; V546-F555 HydrophobicContact CG1-CB 4.31Å; V546-F555 HydrophobicContact CG1-CD1 3.75Å; V546-F555 HydrophobicContact CG1-CD2 3.96Å; V546-F555 HydrophobicContact CG1-CE1 3.97Å; V546-F555 HydrophobicContact CG1-CE2 4.19Å; V546-F555 HydrophobicContact CG1-CG 3.74Å; V546-F555 HydrophobicContact CG1-CZ 4.19Å; Y550-F555 HydrophobicContact CD1-CB 4.1Å; Y550-F555 HydrophobicContact CD1-CD2 4.47Å; Y550-F555 HydrophobicContact CE1-CB 4.31Å; Y550-F555 HydrophobicContact CE1-CD2 4.38Å; G551-F555 PolarHBondContact O-N 3.02Å; T552-F555 PolarHBondContact O-N 3.35Å; F555-Q557 VanDerWaalsContact C-N 3.29Å; F555-Q557 PolarHBondContact O-N 3.06Å; F555-D558 PolarHBondContact O-N 3.41Å; F555-L559 HydrophobicContact CD1-CD1 3.95Å; F555-L559 HydrophobicContact CE1-CD1 3.75Å; F555-L559 HydrophobicContact CE1-CG 4.37Å; F555-L559 HydrophobicContact CZ-CD1 4.21Å; F555-L559 HydrophobicContact CZ-CD2 4.46Å; F555-L559 HydrophobicContact CZ-CG 4.38Å; F555-L559 VanDerWaalsContact O-CG 3.29Å; F555-L559 WeakPolarHBondContact O-CG 3.49Å; F555-L559 PolarHBondContact O-N 3.39Å; F555-W575 HydrophobicContact CD1-CE3 4.05Å; F555-W575 HydrophobicContact CD1-CH2 4.1Å; F555-W575 AromaticContact CD1-CZ3 3.57Å; F555-W575 HydrophobicContact CD1-CZ3 3.57Å; F555-W575 HydrophobicContact CE1-CE3 4.21Å; F555-W575 AromaticContact CE1-CH2 3.6Å; F555-W575 HydrophobicContact CE1-CH2 3.6Å; F555-W575 HydrophobicContact CE1-CZ2 4.25Å; F555-W575 AromaticContact CE1-CZ3 3.57Å; F555-W575 HydrophobicContact CE1-CZ3 3.57Å
556	M	93.8	Very high	92.7	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-34	174.2	-77.1	-70.2	-172.1	0	0	113	T552 K553 R554 L559 E560 P567 Y572 W575	T552-M556 HydrophobicContact CG2-CG 4.42Å; T552-M556 WeakPolarHBondContact O-CB 3.42Å; T552-M556 VanDerWaalsContact O-CG 3.26Å; T552-M556 WeakPolarHBondContact O-CG 3.48Å; T552-M556 PolarHBondContact O-N 3.15Å; K553-M556 PolarHBondContact O-N 2.84Å; R554-M556 VanDerWaalsContact C-N 3.31Å; R554-M556 PolarHBondContact O-N 3.15Å; M556-L559 HydrophobicContact SD-CD1 4.29Å; M556-E560 WeakPolarHBondContact O-CB 3.47Å; M556-E560 PolarHBondContact O-N 3.31Å; M556-P567 HydrophobicContact SD-CB 4.12Å; M556-P567 HydrophobicContact SD-CG 4.23Å; M556-Y572 HydrophobicContact CG-CD2 4.47Å; M556-W575 HydrophobicContact CE-CE3 3.93Å; M556-W575 HydrophobicContact CE-CH2 4.5Å; M556-W575 HydrophobicContact CE-CZ3 3.59Å; M556-W575 HydrophobicContact SD-CZ3 4.16Å
557	Q	93.8	Very high	92.5	Very high	85 Å²	85	56.8 Å²	56.8	40%	0.397	28%	0.277	S	S	.	.	H	α-helix	trans	-70.9	-44.1	174.2	-173.9	170.6	2.7	0	0	111.3	K553 R554 F555 L559 E560 D561	K553-Q557 PolarHBondContact O-N 2.73Å; K553-Q557 VanDerWaalsContact O-N 3.16Å; R554-Q557 WeakPolarHBondContact O-CA 3.29Å; R554-Q557 WeakPolarHBondContact O-CB 3.24Å; R554-Q557 PolarHBondContact O-N 3.13Å; F555-Q557 VanDerWaalsContact C-N 3.29Å; F555-Q557 PolarHBondContact O-N 3.06Å; Q557-L559 PolarHBondContact O-N 3.01Å; Q557-E560 WeakPolarHBondContact O-CB 3.46Å; Q557-E560 PolarHBondContact O-N 2.95Å; Q557-E560 VanDerWaalsContact O-N 3.07Å; Q557-D561 VanDerWaalsContact O-CG 3.29Å; Q557-D561 PolarHBondContact O-N 3.34Å
558	D	92.3	Very high	92.4	Very high	14 Å²	14	65 Å²	65	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-57.9	-36.7	172.8	-78.1	-67.5	0	0	0	112.1	R126 Y550 R554 F555 M562	R126-D558 IonicContact CZ-OD1 2.64Å; R126-D558 IonicContact NE-OD1 3.99Å; R126-D558 PolarHBondContact NE-OD1 3.47Å; R126-D558 IonicContact NH2-OD1 2.89Å; R126-D558 PolarHBondContact NH2-OD1 2.64Å; Y550-D558 WeakPolarHBondContact CE1-OD2 3.32Å; Y550-D558 PolarHBondContact OH-OD2 2.89Å; R554-D558 PolarHBondContact O-N 3.28Å; F555-D558 PolarHBondContact O-N 3.41Å; D558-M562 WeakPolarHBondContact O-CB 3.37Å; D558-M562 VanDerWaalsContact O-CG 3.24Å; D558-M562 WeakPolarHBondContact O-CG 3.31Å; D558-M562 PolarHBondContact O-N 3.29Å
559	L	93.2	Very high	92.3	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-68.1	-41.1	174.5	-74.6	172.2	0	0	0	112.3	F118 A122 F555 M556 Q557 D561 M562 L563 P567 W575	F118-L559 HydrophobicContact CE1-CD1 4.22Å; F118-L559 HydrophobicContact CE2-CD2 4.44Å; F118-L559 HydrophobicContact CZ-CD1 4.12Å; F118-L559 HydrophobicContact CZ-CD2 4.01Å; A122-L559 HydrophobicContact CB-CD2 3.54Å; F555-L559 HydrophobicContact CD1-CD1 3.95Å; F555-L559 HydrophobicContact CE1-CD1 3.75Å; F555-L559 HydrophobicContact CE1-CG 4.37Å; F555-L559 HydrophobicContact CZ-CD1 4.21Å; F555-L559 HydrophobicContact CZ-CD2 4.46Å; F555-L559 HydrophobicContact CZ-CG 4.38Å; F555-L559 VanDerWaalsContact O-CG 3.29Å; F555-L559 WeakPolarHBondContact O-CG 3.49Å; F555-L559 PolarHBondContact O-N 3.39Å; M556-L559 HydrophobicContact SD-CD1 4.29Å; Q557-L559 PolarHBondContact O-N 3.01Å; L559-D561 VanDerWaalsContact C-N 3.31Å; L559-M562 PolarHBondContact O-N 3.31Å; L559-L563 HydrophobicContact CB-CD1 4.47Å; L559-L563 HydrophobicContact CD2-CD1 4.34Å; L559-L563 VanDerWaalsContact O-CB 3.25Å; L559-L563 WeakPolarHBondContact O-CB 3.46Å; L559-L563 WeakPolarHBondContact O-CG 3.48Å; L559-L563 PolarHBondContact O-N 3.03Å; L559-P567 HydrophobicContact CB-CG 3.79Å; L559-P567 HydrophobicContact CD1-CG 3.93Å; L559-P567 HydrophobicContact CG-CG 4.42Å; L559-W575 HydrophobicContact CD1-CH2 3.66Å; L559-W575 HydrophobicContact CD1-CZ3 3.85Å
560	E	94.1	Very high	92.3	Very high	73 Å²	73	64 Å²	64	34%	0.341	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-41.5	175.1	-172	170.2	174.8	0	0	110.8	M556 Q557 G564 R566	M556-E560 WeakPolarHBondContact O-CB 3.47Å; M556-E560 PolarHBondContact O-N 3.31Å; Q557-E560 WeakPolarHBondContact O-CB 3.46Å; Q557-E560 PolarHBondContact O-N 2.95Å; Q557-E560 VanDerWaalsContact O-N 3.07Å; E560-G564 VanDerWaalsContact O-CA 3.31Å; E560-G564 WeakPolarHBondContact O-CA 3.37Å; E560-G564 PolarHBondContact O-N 2.82Å; E560-R566 HydrophobicContact CB-CB 4.38Å; E560-R566 HydrophobicContact CG-CB 4.02Å; E560-R566 WeakPolarHBondContact OE2-CD 3.25Å; E560-R566 WeakPolarHBondContact OE2-CG 3.5Å; E560-R566 IonicContact OE2-CZ 3.77Å; E560-R566 IonicContact OE2-NE 3.94Å; E560-R566 IonicContact OE2-NH1 2.89Å; E560-R566 PolarHBondContact OE2-NH1 3.47Å
561	D	92.3	Very high	92.4	Very high	116 Å²	116	63 Å²	63	62%	0.62	31%	0.309	S	S	*	.	H	α-helix	trans	-67.4	-35.7	176	-65.7	-23.1	0	0	0	112.7	Q557 L559	Q557-D561 VanDerWaalsContact O-CG 3.29Å; Q557-D561 PolarHBondContact O-N 3.34Å; L559-D561 VanDerWaalsContact C-N 3.31Å
562	M	92.5	Very high	92.5	Very high	22 Å²	22	65 Å²	65	11%	0.108	31%	0.311	C	S	.	.	H	α-helix	trans	-78	-43.7	178.6	-77.1	178.1	70.5	0	0	113.5	Q125 R126 R328 D329 D558 L559	Q125-M562 HydrophobicContact CB-CE 3.83Å; Q125-M562 HydrophobicContact CG-CE 3.63Å; R126-M562 HydrophobicContact CB-CE 4.07Å; R126-M562 HydrophobicContact CB-SD 3.48Å; R126-M562 WeakPolarHBondContact CB-SD 3.36Å; R126-M562 WeakPolarHBondContact CD-SD 3.39Å; R126-M562 HydrophobicContact CG-SD 3.91Å; R328-M562 VanDerWaalsContact O-CE 3.31Å; R328-M562 WeakPolarHBondContact O-CE 3.35Å; D329-M562 WeakPolarHBondContact CA-O 3.34Å; D558-M562 WeakPolarHBondContact O-CB 3.37Å; D558-M562 VanDerWaalsContact O-CG 3.24Å; D558-M562 WeakPolarHBondContact O-CG 3.31Å; D558-M562 PolarHBondContact O-N 3.29Å; L559-M562 PolarHBondContact O-N 3.31Å
563	L	91.4	Very high	92.6	Very high	22 Å²	22	70.9 Å²	70.9	12%	0.115	33%	0.333	C	S	.	.	H	α-helix	trans	-92.1	-16.9	-171.4	-63.3	171.4	0	0	0	112.4	F118 H333 L559 F565 P567	F118-L563 HydrophobicContact CZ-CD1 4.27Å; H333-L563 HydrophobicContact CB-CD1 4.37Å; L559-L563 HydrophobicContact CB-CD1 4.47Å; L559-L563 HydrophobicContact CD2-CD1 4.34Å; L559-L563 VanDerWaalsContact O-CB 3.25Å; L559-L563 WeakPolarHBondContact O-CB 3.46Å; L559-L563 WeakPolarHBondContact O-CG 3.48Å; L559-L563 PolarHBondContact O-N 3.03Å; L563-F565 HydrophobicContact CB-CD1 3.91Å; L563-F565 HydrophobicContact CB-CE1 3.74Å; L563-F565 HydrophobicContact CB-CG 4.38Å; L563-F565 HydrophobicContact CB-CZ 4.05Å; L563-F565 HydrophobicContact CD1-CE2 4.17Å; L563-F565 HydrophobicContact CD1-CZ 3.99Å; L563-F565 HydrophobicContact CG-CE1 4.5Å; L563-F565 HydrophobicContact CG-CZ 4.43Å; L563-F565 VanDerWaalsContact O-CD1 3.31Å; L563-F565 WeakPolarHBondContact O-CD1 3.32Å; L563-F565 PolarHBondContact O-N 2.72Å; L563-P567 HydrophobicContact CD1-CG 4.16Å
564	G	90.1	Very high	92.8	Very high	73 Å²	73	64.4 Å²	64.4	75%	0.753	31%	0.306	S	S	*	.	S	Bend	trans	73.4	-1.4	-171.7	0	0	0	0	0	113.9	E560	E560-G564 VanDerWaalsContact O-CA 3.31Å; E560-G564 WeakPolarHBondContact O-CA 3.37Å; E560-G564 PolarHBondContact O-N 2.82Å
565	F	91.4	Very high	92.9	Very high	81 Å²	81	59.2 Å²	59.2	36%	0.355	29%	0.286	S	S	.	.	S	Bend	trans	-137.4	148.1	173	66.2	-93.3	0	0	0	110.1	H333 L563 P567	H333-F565 HydrophobicContact CB-CZ 4.36Å; L563-F565 HydrophobicContact CB-CD1 3.91Å; L563-F565 HydrophobicContact CB-CE1 3.74Å; L563-F565 HydrophobicContact CB-CG 4.38Å; L563-F565 HydrophobicContact CB-CZ 4.05Å; L563-F565 HydrophobicContact CD1-CE2 4.17Å; L563-F565 HydrophobicContact CD1-CZ 3.99Å; L563-F565 HydrophobicContact CG-CE1 4.5Å; L563-F565 HydrophobicContact CG-CZ 4.43Å; L563-F565 VanDerWaalsContact O-CD1 3.31Å; L563-F565 WeakPolarHBondContact O-CD1 3.32Å; L563-F565 PolarHBondContact O-N 2.72Å; F565-P567 WeakPolarHBondContact O-CD 3.48Å
566	R	90.8	Very high	93	Very high	149 Å²	149	61.4 Å²	61.4	56%	0.562	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-79	125.1	176.9	-164.9	-179.6	-176.7	111.5	-6.1	110.5	E560	E560-R566 HydrophobicContact CB-CB 4.38Å; E560-R566 HydrophobicContact CG-CB 4.02Å; E560-R566 WeakPolarHBondContact OE2-CD 3.25Å; E560-R566 WeakPolarHBondContact OE2-CG 3.5Å; E560-R566 IonicContact OE2-CZ 3.77Å; E560-R566 IonicContact OE2-NE 3.94Å; E560-R566 IonicContact OE2-NH1 2.89Å; E560-R566 PolarHBondContact OE2-NH1 3.47Å
567	P	90.4	Very high	93.1	Very high	7 Å²	7	66.5 Å²	66.5	5%	0.045	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-59.4	154.1	174.6	-23	33.1	0	0	0	112.6	F118 M556 L559 L563 F565 Y571	F118-P567 HydrophobicContact CE1-CB 4.36Å; F118-P567 HydrophobicContact CE1-CG 4.44Å; F118-P567 HydrophobicContact CZ-CG 4.31Å; M556-P567 HydrophobicContact SD-CB 4.12Å; M556-P567 HydrophobicContact SD-CG 4.23Å; L559-P567 HydrophobicContact CB-CG 3.79Å; L559-P567 HydrophobicContact CD1-CG 3.93Å; L559-P567 HydrophobicContact CG-CG 4.42Å; L563-P567 HydrophobicContact CD1-CG 4.16Å; F565-P567 WeakPolarHBondContact O-CD 3.48Å; P567-Y571 HydrophobicContact CB-CD2 4.38Å
568	Y	91.5	Very high	93.2	Very high	174 Å²	174	64.7 Å²	64.7	68%	0.682	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-56.9	144	179.8	-66.4	-71.3	0	0	0	112.5	F570 Y571	Y568-F570 PolarHBondContact O-N 3.22Å; Y568-Y571 PolarHBondContact O-N 3.44Å; Y568-Y571 VanDerWaalsContact O-N 3.09Å
569	T	90.8	Very high	93.3	Very high	93 Å²	93	64 Å²	64	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-59.1	-19.8	178.4	-40.6	0	0	0	0	112.9	Y571 Y572 Y573	T569-Y571 VanDerWaalsContact C-N 3.31Å; T569-Y571 PolarHBondContact O-N 2.5Å; T569-Y572 VanDerWaalsContact O-CB 3.26Å; T569-Y572 WeakPolarHBondContact O-CB 3.11Å; T569-Y572 PolarHBondContact O-N 2.88Å; T569-Y572 VanDerWaalsContact O-N 3.1Å; T569-Y573 HydrophobicContact CG2-CD2 4.14Å; T569-Y573 HydrophobicContact CG2-CE2 3.71Å; T569-Y573 WeakPolarHBondContact O-CD2 3.43Å; T569-Y573 PolarHBondContact O-N 3.25Å
570	F	93.8	Very high	93.4	Very high	95 Å²	95	64.6 Å²	64.6	42%	0.417	31%	0.308	S	S	.	.	H	α-helix	trans	-49	-49.4	170.4	172.9	-103.7	0	0	0	112.5	P115 Y568 Y572 Y573 M574	P115-F570 HydrophobicContact CG-CE1 4.34Å; Y568-F570 PolarHBondContact O-N 3.22Å; F570-Y572 PolarHBondContact O-N 2.97Å; F570-Y573 PolarHBondContact O-N 2.96Å; F570-M574 HydrophobicContact CD1-CG 3.99Å; F570-M574 HydrophobicContact CD2-CE 4.12Å; F570-M574 HydrophobicContact CD2-CG 4.08Å; F570-M574 HydrophobicContact CD2-SD 4.48Å; F570-M574 HydrophobicContact CE1-CG 3.55Å; F570-M574 HydrophobicContact CE1-SD 4.4Å; F570-M574 HydrophobicContact CE2-CE 3.68Å; F570-M574 HydrophobicContact CE2-CG 3.65Å; F570-M574 HydrophobicContact CE2-SD 3.65Å; F570-M574 HydrophobicContact CG-CG 4.24Å; F570-M574 HydrophobicContact CZ-CE 4.27Å; F570-M574 HydrophobicContact CZ-CG 3.37Å; F570-M574 HydrophobicContact CZ-SD 3.61Å; F570-M574 WeakPolarHBondContact O-CG 3.43Å; F570-M574 PolarHBondContact O-N 2.87Å
571	Y	94.3	Very high	93.4	Very high	17 Å²	17	65.3 Å²	65.3	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-31.9	-179.3	-69.6	-76.5	0	0	0	112.8	I114 P115 F118 H333 P567 Y568 T569 M574 W575	I114-Y571 HydrophobicContact CG2-CE1 4.47Å; P115-Y571 HydrophobicContact CB-CD1 4.29Å; F118-Y571 HydrophobicContact CB-CE1 4.4Å; F118-Y571 AromaticContact CD1-CD1 3.76Å; F118-Y571 HydrophobicContact CD1-CD1 3.76Å; F118-Y571 AromaticContact CD1-CE1 3.69Å; F118-Y571 HydrophobicContact CD1-CE1 3.69Å; F118-Y571 HydrophobicContact CD1-CE2 4.49Å; F118-Y571 HydrophobicContact CD1-CG 4.19Å; F118-Y571 HydrophobicContact CE1-CD1 4.37Å; F118-Y571 HydrophobicContact CE1-CD2 4.45Å; F118-Y571 HydrophobicContact CE1-CE1 4.48Å; F118-Y571 HydrophobicContact CE1-CG 4.35Å; F118-Y571 HydrophobicContact CG-CE1 4.44Å; H333-Y571 AromaticContact CD2-CE2 3.62Å; H333-Y571 AromaticContact CD2-CZ 3.79Å; H333-Y571 AromaticContact NE2-CE2 3.26Å; H333-Y571 VanDerWaalsContact NE2-CE2 3.26Å; H333-Y571 WeakPolarHBondContact NE2-CE2 3.45Å; H333-Y571 AromaticContact NE2-CZ 3.55Å; H333-Y571 PolarHBondContact NE2-OH 3.32Å; H333-Y571 VanDerWaalsContact NE2-OH 3.15Å; P567-Y571 HydrophobicContact CB-CD2 4.38Å; Y568-Y571 PolarHBondContact O-N 3.44Å; Y568-Y571 VanDerWaalsContact O-N 3.09Å; T569-Y571 VanDerWaalsContact C-N 3.31Å; T569-Y571 PolarHBondContact O-N 2.5Å; Y571-M574 PolarHBondContact O-N 3.48Å; Y571-W575 HydrophobicContact CD1-CZ2 4.03Å; Y571-W575 HydrophobicContact CG-CZ2 4.4Å; Y571-W575 WeakPolarHBondContact O-CB 3.36Å; Y571-W575 PolarHBondContact O-N 3.38Å
572	Y	94.4	Very high	93.6	Very high	60 Å²	60	61.5 Å²	61.5	24%	0.235	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-49.7	176.6	-179.8	-88.2	0	0	0	110.9	T552 K553 M556 T569 F570 R576	T552-Y572 HydrophobicContact CG2-CD2 3.45Å; T552-Y572 VanDerWaalsContact CG2-CD2 3.45Å; T552-Y572 HydrophobicContact CG2-CE2 3.87Å; T552-Y572 HydrophobicContact CG2-CG 4.15Å; K553-Y572 HydrophobicContact CG-CE2 4.05Å; M556-Y572 HydrophobicContact CG-CD2 4.47Å; T569-Y572 VanDerWaalsContact O-CB 3.26Å; T569-Y572 WeakPolarHBondContact O-CB 3.11Å; T569-Y572 PolarHBondContact O-N 2.88Å; T569-Y572 VanDerWaalsContact O-N 3.1Å; F570-Y572 PolarHBondContact O-N 2.97Å; Y572-R576 WeakPolarHBondContact O-CB 3.26Å; Y572-R576 PolarHBondContact O-N 3.4Å; Y572-R576 VanDerWaalsContact O-N 3.14Å
573	Y	95.2	Very high	93.6	Very high	129 Å²	129	60.5 Å²	60.5	51%	0.506	29%	0.292	S	S	.	.	H	α-helix	trans	-71.9	-35.1	179.6	-69.7	-73.5	0	0	0	112.6	T569 F570 Y577 V578	T569-Y573 HydrophobicContact CG2-CD2 4.14Å; T569-Y573 HydrophobicContact CG2-CE2 3.71Å; T569-Y573 WeakPolarHBondContact O-CD2 3.43Å; T569-Y573 PolarHBondContact O-N 3.25Å; F570-Y573 PolarHBondContact O-N 2.96Å; Y573-Y577 HydrophobicContact CD1-CD2 4Å; Y573-Y577 HydrophobicContact CD1-CE2 4.16Å; Y573-Y577 PolarHBondContact O-N 3.23Å; Y573-V578 PolarHBondContact O-N 3.2Å
574	M	95.6	Very high	93.8	Very high	16 Å²	16	63.4 Å²	63.4	8%	0.079	31%	0.311	C	S	.	.	I	π-helix	trans	-61.1	-55.9	176.2	-69.3	-55.1	102.3	0	0	111.5	L111 P115 F570 Y571 R576 V578 S579	L111-M574 HydrophobicContact CD2-SD 4.11Å; P115-M574 HydrophobicContact CB-CB 3.96Å; P115-M574 HydrophobicContact CB-CG 4.48Å; P115-M574 HydrophobicContact CG-CB 4Å; P115-M574 HydrophobicContact CG-CG 3.99Å; F570-M574 HydrophobicContact CD1-CG 3.99Å; F570-M574 HydrophobicContact CD2-CE 4.12Å; F570-M574 HydrophobicContact CD2-CG 4.08Å; F570-M574 HydrophobicContact CD2-SD 4.48Å; F570-M574 HydrophobicContact CE1-CG 3.55Å; F570-M574 HydrophobicContact CE1-SD 4.4Å; F570-M574 HydrophobicContact CE2-CE 3.68Å; F570-M574 HydrophobicContact CE2-CG 3.65Å; F570-M574 HydrophobicContact CE2-SD 3.65Å; F570-M574 HydrophobicContact CG-CG 4.24Å; F570-M574 HydrophobicContact CZ-CE 4.27Å; F570-M574 HydrophobicContact CZ-CG 3.37Å; F570-M574 HydrophobicContact CZ-SD 3.61Å; F570-M574 WeakPolarHBondContact O-CG 3.43Å; F570-M574 PolarHBondContact O-N 2.87Å; Y571-M574 PolarHBondContact O-N 3.48Å; M574-R576 PolarHBondContact O-N 3.25Å; M574-V578 HydrophobicContact CE-CB 3.78Å; M574-V578 HydrophobicContact CE-CG1 4.13Å; M574-V578 HydrophobicContact CE-CG2 3.47Å; M574-V578 VanDerWaalsContact CE-CG2 3.47Å; M574-V578 PolarHBondContact O-N 3.14Å; M574-V578 HydrophobicContact SD-CB 3.87Å; M574-V578 HydrophobicContact SD-CG1 3.9Å; M574-V578 HydrophobicContact SD-CG2 4.26Å; M574-S579 WeakPolarHBondContact O-CB 3.31Å; M574-S579 PolarHBondContact O-N 2.98Å; M574-S579 PolarHBondContact O-OG 2.85Å; M574-S579 VanDerWaalsContact O-OG 3.09Å
575	W	95.9	Very high	94	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.008	30%	0.302	C	S	.	.	I	π-helix	trans	-65.4	-39.4	-178.3	-63.6	-33.1	0	0	0	112.9	P115 F118 L119 N543 A547 T552 F555 M556 L559 Y571 P580	P115-W575 VanDerWaalsContact C-NE1 3.34Å; P115-W575 PolarHBondContact O-NE1 2.94Å; F118-W575 AromaticContact CD1-CH2 3.66Å; F118-W575 HydrophobicContact CD1-CH2 3.66Å; F118-W575 AromaticContact CD1-CZ2 3.41Å; F118-W575 HydrophobicContact CD1-CZ2 3.41Å; F118-W575 VanDerWaalsContact CD1-CZ2 3.41Å; F118-W575 AromaticContact CE1-CH2 3.56Å; F118-W575 HydrophobicContact CE1-CH2 3.56Å; F118-W575 AromaticContact CE1-CZ2 3.85Å; F118-W575 HydrophobicContact CE1-CZ2 3.85Å; F118-W575 HydrophobicContact CG-CZ2 4.23Å; L119-W575 HydrophobicContact CB-CZ2 4.02Å; L119-W575 HydrophobicContact CD1-CD2 4.24Å; L119-W575 HydrophobicContact CD1-CG 4.04Å; N543-W575 PolarHBondContact ND2-O 3.18Å; N543-W575 PolarHBondContact OD1-O 3.24Å; A547-W575 HydrophobicContact CB-CB 4.17Å; A547-W575 WeakPolarHBondContact CB-O 3.16Å; T552-W575 HydrophobicContact CG2-CE3 4.23Å; F555-W575 HydrophobicContact CD1-CE3 4.05Å; F555-W575 HydrophobicContact CD1-CH2 4.1Å; F555-W575 AromaticContact CD1-CZ3 3.57Å; F555-W575 HydrophobicContact CD1-CZ3 3.57Å; F555-W575 HydrophobicContact CE1-CE3 4.21Å; F555-W575 AromaticContact CE1-CH2 3.6Å; F555-W575 HydrophobicContact CE1-CH2 3.6Å; F555-W575 HydrophobicContact CE1-CZ2 4.25Å; F555-W575 AromaticContact CE1-CZ3 3.57Å; F555-W575 HydrophobicContact CE1-CZ3 3.57Å; M556-W575 HydrophobicContact CE-CE3 3.93Å; M556-W575 HydrophobicContact CE-CH2 4.5Å; M556-W575 HydrophobicContact CE-CZ3 3.59Å; M556-W575 HydrophobicContact SD-CZ3 4.16Å; L559-W575 HydrophobicContact CD1-CH2 3.66Å; L559-W575 HydrophobicContact CD1-CZ3 3.85Å; Y571-W575 HydrophobicContact CD1-CZ2 4.03Å; Y571-W575 HydrophobicContact CG-CZ2 4.4Å; Y571-W575 WeakPolarHBondContact O-CB 3.36Å; Y571-W575 PolarHBondContact O-N 3.38Å; W575-P580 VanDerWaalsContact O-CD 3.3Å; W575-P580 WeakPolarHBondContact O-CD 3.19Å; W575-P580 WeakPolarHBondContact O-CG 3.33Å
576	R	95.6	Very high	94	Very high	55 Å²	55	61.1 Å²	61.1	21%	0.208	29%	0.288	C	S	.	.	I	π-helix	trans	-77.3	-39.1	-173.9	-174.4	63.8	-176.5	-162.9	1.5	113.5	A547 W548 Y572 M574	A547-R576 PolarHBondContact O-NH1 3.02Å; W548-R576 VanDerWaalsContact CE3-CZ 3.44Å; W548-R576 WeakPolarHBondContact CZ2-O 3.31Å; W548-R576 PolarHBondContact NE1-O 3.34Å; W548-R576 VanDerWaalsContact NE1-O 3.1Å; Y572-R576 WeakPolarHBondContact O-CB 3.26Å; Y572-R576 PolarHBondContact O-N 3.4Å; Y572-R576 VanDerWaalsContact O-N 3.14Å; M574-R576 PolarHBondContact O-N 3.25Å
577	Y	95.1	Very high	94	Very high	113 Å²	113	55.8 Å²	55.8	44%	0.443	27%	0.27	S	S	.	.	I	π-helix	trans	-126.2	-55.7	-169.1	-56.6	-71.5	0	0	0	113.1	Y573 P580 T581	Y573-Y577 HydrophobicContact CD1-CD2 4Å; Y573-Y577 HydrophobicContact CD1-CE2 4.16Å; Y573-Y577 PolarHBondContact O-N 3.23Å; Y577-P580 WeakPolarHBondContact O-CD 3.48Å; Y577-T581 WeakPolarHBondContact O-CB 3.41Å; Y577-T581 PolarHBondContact O-N 3.38Å; Y577-T581 PolarHBondContact O-OG1 3.45Å
578	V	95.8	Very high	94.1	Very high	46 Å²	46	57.7 Å²	57.7	28%	0.279	29%	0.287	S	S	.	.	I	π-helix	trans	-70.5	-53.3	-167.8	177.6	0	0	0	0	112.2	Y573 M574 T581 I582	Y573-V578 PolarHBondContact O-N 3.2Å; M574-V578 HydrophobicContact CE-CB 3.78Å; M574-V578 HydrophobicContact CE-CG1 4.13Å; M574-V578 HydrophobicContact CE-CG2 3.47Å; M574-V578 VanDerWaalsContact CE-CG2 3.47Å; M574-V578 PolarHBondContact O-N 3.14Å; M574-V578 HydrophobicContact SD-CB 3.87Å; M574-V578 HydrophobicContact SD-CG1 3.9Å; M574-V578 HydrophobicContact SD-CG2 4.26Å; V578-T581 PolarHBondContact O-N 3.03Å; V578-I582 HydrophobicContact CG1-CD1 3.66Å; V578-I582 HydrophobicContact CG1-CG1 4.4Å; V578-I582 WeakPolarHBondContact O-CG1 3.45Å; V578-I582 PolarHBondContact O-N 3.17Å
579	S	95.2	Very high	94	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-45.5	-178.1	-47.2	0	0	0	0	112.3	L111 M574 T581 I582 L583	L111-S579 PolarHBondContact O-OG 2.88Å; L111-S579 VanDerWaalsContact O-OG 3.07Å; M574-S579 WeakPolarHBondContact O-CB 3.31Å; M574-S579 PolarHBondContact O-N 2.98Å; M574-S579 PolarHBondContact O-OG 2.85Å; M574-S579 VanDerWaalsContact O-OG 3.09Å; S579-T581 PolarHBondContact O-N 2.96Å; S579-I582 PolarHBondContact O-N 3.3Å; S579-L583 WeakPolarHBondContact O-CB 3.3Å; S579-L583 WeakPolarHBondContact O-CG 3.39Å; S579-L583 PolarHBondContact O-N 2.99Å
580	P	95.1	Very high	93.9	Very high	13 Å²	13	46.7 Å²	46.7	8%	0.084	24%	0.24	C	C	.	.	H	α-helix	trans	-56.9	-44.8	173.4	-22.3	31.3	0	0	0	113.2	N543 W575 Y577 L583 V584	N543-P580 WeakPolarHBondContact ND2-CD 3.38Å; N543-P580 VanDerWaalsContact ND2-CG 3.32Å; N543-P580 WeakPolarHBondContact ND2-CG 3.34Å; W575-P580 VanDerWaalsContact O-CD 3.3Å; W575-P580 WeakPolarHBondContact O-CD 3.19Å; W575-P580 WeakPolarHBondContact O-CG 3.33Å; Y577-P580 WeakPolarHBondContact O-CD 3.48Å; P580-L583 PolarHBondContact O-N 3.23Å; P580-V584 WeakPolarHBondContact O-CG2 3.46Å; P580-V584 PolarHBondContact O-N 3Å
581	T	95.4	Very high	93.6	Very high	89 Å²	89	45.8 Å²	45.8	55%	0.546	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-45.9	179.9	-63.2	0	0	0	0	111.8	Y577 V578 S579 L583 V584 V585	Y577-T581 WeakPolarHBondContact O-CB 3.41Å; Y577-T581 PolarHBondContact O-N 3.38Å; Y577-T581 PolarHBondContact O-OG1 3.45Å; V578-T581 PolarHBondContact O-N 3.03Å; S579-T581 PolarHBondContact O-N 2.96Å; T581-L583 VanDerWaalsContact C-N 3.33Å; T581-L583 PolarHBondContact O-N 3.48Å; T581-V584 PolarHBondContact O-N 2.92Å; T581-V585 WeakPolarHBondContact O-CG2 3.34Å; T581-V585 PolarHBondContact O-N 2.89Å; T581-V585 VanDerWaalsContact O-N 3.11Å
582	I	94.7	Very high	93.4	Very high	36 Å²	36	49.9 Å²	49.9	19%	0.185	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-44.3	177	-66.9	171.7	0	0	0	110.3	L108 L111 I112 V578 S579 V584 V585 L586	L108-I582 HydrophobicContact CD2-CG2 4.04Å; L111-I582 HydrophobicContact CB-CD1 3.92Å; L111-I582 HydrophobicContact CD1-CD1 4Å; I112-I582 HydrophobicContact CD1-CG2 4.44Å; I112-I582 HydrophobicContact CG2-CB 3.97Å; I112-I582 HydrophobicContact CG2-CD1 4Å; I112-I582 HydrophobicContact CG2-CG2 3.78Å; V578-I582 HydrophobicContact CG1-CD1 3.66Å; V578-I582 HydrophobicContact CG1-CG1 4.4Å; V578-I582 WeakPolarHBondContact O-CG1 3.45Å; V578-I582 PolarHBondContact O-N 3.17Å; S579-I582 PolarHBondContact O-N 3.3Å; I582-V584 PolarHBondContact O-N 3.41Å; I582-V585 PolarHBondContact O-N 2.83Å; I582-L586 HydrophobicContact CG2-CD1 3.86Å; I582-L586 HydrophobicContact CG2-CG 4.28Å; I582-L586 VanDerWaalsContact O-CG 3.29Å; I582-L586 WeakPolarHBondContact O-CG 3.39Å; I582-L586 PolarHBondContact O-N 3.49Å
583	L	94.3	Very high	92.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-39.6	178.7	-69.5	169.3	0	0	0	112.7	L116 F309 T536 V539 I540 S579 P580 T581 L586 I587	L116-L583 HydrophobicContact CD1-CD1 4.06Å; F309-L583 HydrophobicContact CE1-CD2 4.11Å; F309-L583 HydrophobicContact CE2-CD2 4.3Å; F309-L583 HydrophobicContact CZ-CD2 3.44Å; F309-L583 VanDerWaalsContact CZ-CD2 3.44Å; T536-L583 HydrophobicContact CG2-CD2 4.26Å; V539-L583 HydrophobicContact CG1-CD1 4.1Å; V539-L583 HydrophobicContact CG1-CD2 4.28Å; I540-L583 HydrophobicContact CB-CB 4.03Å; I540-L583 HydrophobicContact CB-CD1 3.99Å; I540-L583 HydrophobicContact CD1-CB 3.99Å; I540-L583 HydrophobicContact CG1-CB 4.02Å; I540-L583 HydrophobicContact CG1-CD1 4.25Å; S579-L583 WeakPolarHBondContact O-CB 3.3Å; S579-L583 WeakPolarHBondContact O-CG 3.39Å; S579-L583 PolarHBondContact O-N 2.99Å; P580-L583 PolarHBondContact O-N 3.23Å; T581-L583 VanDerWaalsContact C-N 3.33Å; T581-L583 PolarHBondContact O-N 3.48Å; L583-L586 HydrophobicContact CD2-CD1 4.48Å; L583-L586 PolarHBondContact O-N 3.24Å; L583-I587 VanDerWaalsContact O-CG1 3.32Å; L583-I587 WeakPolarHBondContact O-CG1 3.48Å; L583-I587 PolarHBondContact O-N 3.1Å
584	V	94.8	Very high	92.4	Very high	84 Å²	84	45.7 Å²	45.7	51%	0.509	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-45.1	174.4	171.9	0	0	0	0	111.1	I540 P580 T581 I582 L586 I587 A588	I540-V584 HydrophobicContact CD1-CG2 3.51Å; P580-V584 WeakPolarHBondContact O-CG2 3.46Å; P580-V584 PolarHBondContact O-N 3Å; T581-V584 PolarHBondContact O-N 2.92Å; I582-V584 PolarHBondContact O-N 3.41Å; V584-L586 VanDerWaalsContact C-N 3.32Å; V584-L586 PolarHBondContact O-N 3.35Å; V584-I587 PolarHBondContact O-N 3.06Å; V584-A588 PolarHBondContact O-N 3.25Å
585	V	93.3	Very high	91.8	Very high	93 Å²	93	49.2 Å²	49.2	56%	0.564	28%	0.279	S	S	*	.	H	α-helix	trans	-61.6	-42.1	177.4	172.6	0	0	0	0	110.8	T581 I582 A588 A589	T581-V585 WeakPolarHBondContact O-CG2 3.34Å; T581-V585 PolarHBondContact O-N 2.89Å; T581-V585 VanDerWaalsContact O-N 3.11Å; I582-V585 PolarHBondContact O-N 2.83Å; V585-A588 PolarHBondContact O-N 3.02Å; V585-A589 WeakPolarHBondContact O-CB 3.31Å; V585-A589 PolarHBondContact O-N 3.18Å
586	L	91.3	Very high	91.3	Very high	13 Å²	13	54.5 Å²	54.5	7%	0.068	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-41.6	177.9	-71.6	170.5	0	0	0	112.6	I112 A305 F309 T536 I582 L583 V584 A589 T590	I112-L586 HydrophobicContact CD1-CD1 4.12Å; A305-L586 HydrophobicContact CB-CD1 3.43Å; A305-L586 VanDerWaalsContact CB-CD1 3.43Å; A305-L586 HydrophobicContact CB-CD2 3.61Å; A305-L586 HydrophobicContact CB-CG 4.16Å; F309-L586 HydrophobicContact CZ-CD1 4.32Å; T536-L586 HydrophobicContact CG2-CB 4.46Å; I582-L586 HydrophobicContact CG2-CD1 3.86Å; I582-L586 HydrophobicContact CG2-CG 4.28Å; I582-L586 VanDerWaalsContact O-CG 3.29Å; I582-L586 WeakPolarHBondContact O-CG 3.39Å; I582-L586 PolarHBondContact O-N 3.49Å; L583-L586 HydrophobicContact CD2-CD1 4.48Å; L583-L586 PolarHBondContact O-N 3.24Å; V584-L586 VanDerWaalsContact C-N 3.32Å; V584-L586 PolarHBondContact O-N 3.35Å; L586-A589 PolarHBondContact O-N 3.06Å; L586-T590 WeakPolarHBondContact O-CB 3.44Å; L586-T590 PolarHBondContact O-N 3.41Å; L586-T590 PolarHBondContact O-OG1 3.08Å
587	I	92.4	Very high	90.6	Very high	36 Å²	36	54.7 Å²	54.7	19%	0.185	32%	0.32	C	S	.	.	H	α-helix	trans	-62.3	-48	175.4	-69.5	168.4	0	0	0	109.9	L533 T536 V537 I540 L583 V584 A589 T590 V591	L533-I587 HydrophobicContact CD1-CG2 4.42Å; T536-I587 HydrophobicContact CG2-CD1 4.16Å; T536-I587 HydrophobicContact CG2-CG1 3.51Å; V537-I587 HydrophobicContact CG2-CD1 4.24Å; I540-I587 HydrophobicContact CB-CD1 4.36Å; I540-I587 HydrophobicContact CD1-CD1 4.14Å; I540-I587 HydrophobicContact CG2-CD1 3.72Å; L583-I587 VanDerWaalsContact O-CG1 3.32Å; L583-I587 WeakPolarHBondContact O-CG1 3.48Å; L583-I587 PolarHBondContact O-N 3.1Å; V584-I587 PolarHBondContact O-N 3.06Å; I587-A589 PolarHBondContact O-N 3.01Å; I587-T590 PolarHBondContact O-N 3.44Å; I587-V591 HydrophobicContact CG2-CG2 4.4Å; I587-V591 WeakPolarHBondContact O-CG2 3.45Å; I587-V591 PolarHBondContact O-N 2.76Å
588	A	91.8	Very high	89.8	Confident	48 Å²	48	53.8 Å²	53.8	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-46.7	177.7	0	0	0	0	0	111.5	V584 V585 T590 V591 I592	V584-A588 PolarHBondContact O-N 3.25Å; V585-A588 PolarHBondContact O-N 3.02Å; A588-T590 VanDerWaalsContact C-N 3.33Å; A588-T590 PolarHBondContact O-N 3.41Å; A588-V591 PolarHBondContact O-N 3.07Å; A588-I592 WeakPolarHBondContact O-CB 3.42Å; A588-I592 WeakPolarHBondContact O-CD1 3.46Å; A588-I592 WeakPolarHBondContact O-CG1 3.38Å; A588-I592 PolarHBondContact O-N 2.79Å
589	A	89.9	Confident	89.2	Confident	24 Å²	24	52.8 Å²	52.8	20%	0.198	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-38.8	177.4	0	0	0	0	0	112.8	V585 L586 I587 E593	V585-A589 WeakPolarHBondContact O-CB 3.31Å; V585-A589 PolarHBondContact O-N 3.18Å; L586-A589 PolarHBondContact O-N 3.06Å; I587-A589 PolarHBondContact O-N 3.01Å; A589-E593 PolarHBondContact O-N 3.25Å
590	T	87.8	Confident	88.8	Confident	12 Å²	12	53.4 Å²	53.4	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-67.8	-44.6	177.9	-54.2	0	0	0	0	111.4	R302 L533 L586 I587 A588 E593 M594	R302-T590 VanDerWaalsContact CD-OG1 3.26Å; R302-T590 WeakPolarHBondContact CD-OG1 3.5Å; R302-T590 WeakPolarHBondContact CG-OG1 3.47Å; L533-T590 HydrophobicContact CB-CG2 4.3Å; L533-T590 HydrophobicContact CD1-CG2 4.24Å; L586-T590 WeakPolarHBondContact O-CB 3.44Å; L586-T590 PolarHBondContact O-N 3.41Å; L586-T590 PolarHBondContact O-OG1 3.08Å; I587-T590 PolarHBondContact O-N 3.44Å; A588-T590 VanDerWaalsContact C-N 3.33Å; A588-T590 PolarHBondContact O-N 3.41Å; T590-E593 PolarHBondContact O-N 2.94Å; T590-M594 HydrophobicContact CG2-CE 4.34Å; T590-M594 HydrophobicContact CG2-SD 4.29Å; T590-M594 WeakPolarHBondContact O-CB 3.37Å; T590-M594 WeakPolarHBondContact O-CG 3.45Å; T590-M594 PolarHBondContact O-N 3.49Å
591	V	89.3	Confident	88.5	Confident	75 Å²	75	53.2 Å²	53.2	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-65.7	-41.4	178	173.3	0	0	0	0	111.3	L533 I587 A588 M594 S595	L533-V591 HydrophobicContact CD1-CG2 4.3Å; I587-V591 HydrophobicContact CG2-CG2 4.4Å; I587-V591 WeakPolarHBondContact O-CG2 3.45Å; I587-V591 PolarHBondContact O-N 2.76Å; A588-V591 PolarHBondContact O-N 3.07Å; V591-M594 PolarHBondContact O-N 2.92Å; V591-S595 PolarHBondContact O-N 3.12Å; V591-S595 PolarHBondContact O-OG 3.42Å
592	I	88.6	Confident	88.1	Confident	103 Å²	103	51.2 Å²	51.2	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-61.2	-49.2	176.2	-70.1	164.8	0	0	0	110.2	A588 M594 S595 V596	A588-I592 WeakPolarHBondContact O-CB 3.42Å; A588-I592 WeakPolarHBondContact O-CD1 3.46Å; A588-I592 WeakPolarHBondContact O-CG1 3.38Å; A588-I592 PolarHBondContact O-N 2.79Å; I592-M594 PolarHBondContact O-N 3.18Å; I592-S595 PolarHBondContact O-N 3.32Å; I592-S595 VanDerWaalsContact O-N 3.07Å; I592-S595 PolarHBondContact O-OG 3.14Å; I592-V596 HydrophobicContact CG2-CG2 4.3Å; I592-V596 WeakPolarHBondContact O-CG2 3.23Å; I592-V596 PolarHBondContact O-N 3.45Å
593	E	84.4	Confident	87.9	Confident	46 Å²	46	49.5 Å²	49.5	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-62.9	-44.4	179.1	-173.5	-169	-121.7	0	0	112.1	R302 A589 T590 S595 V596 S597	R302-E593 IonicContact CZ-OE1 3.23Å; R302-E593 IonicContact CZ-OE2 3.87Å; R302-E593 IonicContact NE-OE2 3.06Å; R302-E593 PolarHBondContact NE-OE2 2.96Å; R302-E593 IonicContact NH1-OE1 2.67Å; R302-E593 PolarHBondContact NH1-OE1 3.33Å; R302-E593 IonicContact NH1-OE2 3.15Å; R302-E593 PolarHBondContact NH1-OE2 3.01Å; R302-E593 IonicContact NH2-OE1 3.4Å; R302-E593 PolarHBondContact NH2-OE1 3.39Å; R302-E593 IonicContact NH2-OE2 3.76Å; R302-E593 PolarHBondContact NH2-OE2 3.06Å; A589-E593 PolarHBondContact O-N 3.25Å; T590-E593 PolarHBondContact O-N 2.94Å; E593-S595 PolarHBondContact O-N 3.02Å; E593-S595 VanDerWaalsContact O-N 3.1Å; E593-V596 PolarHBondContact O-N 3.1Å; E593-S597 WeakPolarHBondContact CG-OG 3.45Å; E593-S597 WeakPolarHBondContact O-CB 3.49Å; E593-S597 PolarHBondContact O-N 3.08Å
594	M	84	Confident	87.7	Confident	55 Å²	55	49.8 Å²	49.8	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-57.8	-26.2	175.6	-76.8	-178	162.7	0	0	112.6	Y529 L533 T590 V591 I592 I628	Y529-M594 HydrophobicContact CD1-CE 4.12Å; Y529-M594 HydrophobicContact CE1-CE 4.41Å; L533-M594 HydrophobicContact CB-CE 4.36Å; L533-M594 HydrophobicContact CD2-SD 4.17Å; T590-M594 HydrophobicContact CG2-CE 4.34Å; T590-M594 HydrophobicContact CG2-SD 4.29Å; T590-M594 WeakPolarHBondContact O-CB 3.37Å; T590-M594 WeakPolarHBondContact O-CG 3.45Å; T590-M594 PolarHBondContact O-N 3.49Å; V591-M594 PolarHBondContact O-N 2.92Å; I592-M594 PolarHBondContact O-N 3.18Å; M594-I628 HydrophobicContact CE-CD1 4.08Å; M594-I628 HydrophobicContact SD-CD1 4.39Å
595	S	83.3	Confident	87.4	Confident	91 Å²	91	47.2 Å²	47.2	64%	0.636	29%	0.292	S	S	*	.	H	α-helix	trans	-85.1	-25.3	176.4	73.6	0	0	0	0	114.5	V591 I592 E593	V591-S595 PolarHBondContact O-N 3.12Å; V591-S595 PolarHBondContact O-OG 3.42Å; I592-S595 PolarHBondContact O-N 3.32Å; I592-S595 VanDerWaalsContact O-N 3.07Å; I592-S595 PolarHBondContact O-OG 3.14Å; E593-S595 PolarHBondContact O-N 3.02Å; E593-S595 VanDerWaalsContact O-N 3.1Å
596	V	86	Confident	87	Confident	112 Å²	112	48.1 Å²	48.1	68%	0.679	29%	0.29	S	S	*	.	H	α-helix	trans	-98.9	-37.8	-174.2	174.3	0	0	0	0	111.8	I592 E593	I592-V596 HydrophobicContact CG2-CG2 4.3Å; I592-V596 WeakPolarHBondContact O-CG2 3.23Å; I592-V596 PolarHBondContact O-N 3.45Å; E593-V596 PolarHBondContact O-N 3.1Å
597	S	80.6	Confident	86.7	Confident	59 Å²	59	55.2 Å²	55.2	41%	0.413	32%	0.322	S	S	.	.	S	Bend	trans	-85.7	132.6	-175.9	-64.8	0	0	0	0	111	E593 A599	E593-S597 WeakPolarHBondContact CG-OG 3.45Å; E593-S597 WeakPolarHBondContact O-CB 3.49Å; E593-S597 PolarHBondContact O-N 3.08Å; S597-A599 PolarHBondContact O-N 3.35Å
598	P	78.4	Confident	86.2	Confident	95 Å²	95	57.3 Å²	57.3	62%	0.617	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-65.5	126.4	176.8	26.6	-32.5	0	0	0	110.4	G600	P598-G600 PolarHBondContact O-N 3.34Å
599	A	82.8	Confident	85.7	Confident	25 Å²	25	55.5 Å²	55.5	21%	0.207	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70.2	116.7	175	0	0	0	0	0	110.5	Y529 S597 Y616 L621	Y529-A599 WeakPolarHBondContact OH-CB 3.25Å; S597-A599 PolarHBondContact O-N 3.35Å; A599-Y616 HydrophobicContact CB-CD2 4.2Å; A599-Y616 PolarHBondContact O-N 2.93Å; A599-Y616 VanDerWaalsContact O-N 3.14Å; A599-L621 HydrophobicContact CB-CD1 3.68Å
600	G	86.2	Confident	85.4	Confident	12 Å²	12	56.7 Å²	56.7	12%	0.124	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	-176.2	178.9	0	0	0	0	0	113.1	P598 H614 Y616	P598-G600 PolarHBondContact O-N 3.34Å; G600-H614 CarbonylContact C-O 3.58Å; G600-H614 WeakPolarHBondContact CA-O 3.35Å; G600-Y616 VanDerWaalsContact O-CE2 3.31Å; G600-Y616 WeakPolarHBondContact O-CE2 3.49Å
601	Y	88.9	Confident	85.3	Confident	10 Å²	10	59.7 Å²	59.7	4%	0.039	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	158.2	-177.5	68.1	-78.5	0	0	0	110.3	I220 Y521 A603 H614 Y616	I220-Y601 HydrophobicContact CB-CE1 4.34Å; I220-Y601 HydrophobicContact CB-CE2 4.41Å; I220-Y601 HydrophobicContact CG2-CE1 3.94Å; I220-Y601 PolarHBondContact N-OH 2.05Å; I220-Y601 VanDerWaalsContact N-OH 3.13Å; Y521-Y601 AromaticContact CD1-CD2 3.47Å; Y521-Y601 HydrophobicContact CD1-CD2 3.47Å; Y521-Y601 VanDerWaalsContact CD1-CD2 3.47Å; Y521-Y601 AromaticContact CD1-CE2 3.71Å; Y521-Y601 HydrophobicContact CD1-CE2 3.71Å; Y521-Y601 HydrophobicContact CD2-CE2 4.07Å; Y521-Y601 AromaticContact CE1-CD2 3.93Å; Y521-Y601 HydrophobicContact CE1-CD2 3.93Å; Y521-Y601 AromaticContact CE1-CE2 3.92Å; Y521-Y601 HydrophobicContact CE1-CE2 3.92Å; Y521-Y601 HydrophobicContact CE2-CE2 4.25Å; Y521-Y601 AromaticContact CG-CD2 3.83Å; Y521-Y601 HydrophobicContact CG-CD2 3.83Å; Y521-Y601 AromaticContact CG-CE2 3.79Å; Y521-Y601 HydrophobicContact CG-CE2 3.79Å; Y601-A603 HydrophobicContact CD2-CB 4.23Å; Y601-A603 HydrophobicContact CE2-CB 3.62Å; Y601-H614 WeakPolarHBondContact CD1-O 3.06Å; Y601-H614 HydrophobicContact CE1-CB 4.07Å; Y601-H614 PolarHBondContact N-O 3.46Å; Y601-H614 PolarHBondContact O-N 3.13Å; Y601-H614 VanDerWaalsContact O-O 3.13Å; Y601-Y616 AromaticContact CD1-CD1 3.5Å; Y601-Y616 HydrophobicContact CD1-CD1 3.5Å; Y601-Y616 AromaticContact CD1-CE1 3.42Å; Y601-Y616 HydrophobicContact CD1-CE1 3.42Å; Y601-Y616 VanDerWaalsContact CD1-CE1 3.42Å; Y601-Y616 HydrophobicContact CD1-CG 4.17Å; Y601-Y616 AromaticContact CE1-CD1 3.99Å; Y601-Y616 HydrophobicContact CE1-CD1 3.99Å; Y601-Y616 HydrophobicContact CE1-CE1 4.22Å; Y601-Y616 HydrophobicContact CG-CD1 4.42Å; Y601-Y616 AromaticContact CG-CE1 3.89Å; Y601-Y616 HydrophobicContact CG-CE1 3.89Å
602	N	88.3	Confident	85.2	Confident	46 Å²	46	62.4 Å²	62.4	25%	0.246	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.5	173.4	-68	-19.6	0	0	0	109.7	Q439 Y521 E611 R612	Q439-N602 PolarHBondContact OE1-ND2 3.47Å; Y521-N602 VanDerWaalsContact CE1-O 3.31Å; Y521-N602 WeakPolarHBondContact CE1-O 3.42Å; N602-E611 HydrophobicContact CB-CB 4.22Å; N602-R612 CarbonylContact C-O 3.58Å; N602-R612 WeakPolarHBondContact CA-O 3.25Å
603	A	89.4	Confident	85.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	144.3	178	0	0	0	0	0	111	S218 Y521 Y601 E611 R612 H614	S218-A603 WeakPolarHBondContact O-CB 3.41Å; Y521-A603 HydrophobicContact CE1-CB 4.31Å; Y601-A603 HydrophobicContact CD2-CB 4.23Å; Y601-A603 HydrophobicContact CE2-CB 3.62Å; A603-E611 CarbonylContact O-C 3.5Å; A603-E611 WeakPolarHBondContact O-CA 3.35Å; A603-R612 PolarHBondContact N-O 3.37Å; A603-R612 PolarHBondContact O-N 3.27Å; A603-H614 HydrophobicContact CB-CB 4.5Å
604	W	90.1	Very high	85.4	Confident	7 Å²	7	63.8 Å²	63.8	3%	0.027	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	122.9	178.1	-178.1	-104.2	0	0	0	111.1	E198 T206 Y210 I216 Y521 G609 E611	E198-W604 HydrophobicContact CG-CZ2 4.46Å; E198-W604 PolarHBondContact OE1-NE1 2.94Å; T206-W604 HydrophobicContact CG2-CH2 3.29Å; T206-W604 HydrophobicContact CG2-CZ2 4.15Å; T206-W604 HydrophobicContact CG2-CZ3 3.6Å; Y210-W604 HydrophobicContact CD1-CB 3.93Å; Y210-W604 HydrophobicContact CD1-CD2 4.12Å; Y210-W604 HydrophobicContact CD1-CE3 4.32Å; Y210-W604 AromaticContact CD1-CG 3.95Å; Y210-W604 HydrophobicContact CD1-CG 3.95Å; Y210-W604 AromaticContact CD2-CD2 3.59Å; Y210-W604 HydrophobicContact CD2-CD2 3.59Å; Y210-W604 AromaticContact CD2-CE2 3.93Å; Y210-W604 AromaticContact CD2-CE3 3.44Å; Y210-W604 HydrophobicContact CD2-CE3 3.44Å; Y210-W604 VanDerWaalsContact CD2-CE3 3.44Å; Y210-W604 HydrophobicContact CD2-CG 4.26Å; Y210-W604 HydrophobicContact CD2-CH2 4Å; Y210-W604 HydrophobicContact CD2-CZ2 4.14Å; Y210-W604 AromaticContact CD2-CZ3 3.66Å; Y210-W604 HydrophobicContact CD2-CZ3 3.66Å; Y210-W604 HydrophobicContact CE1-CB 4.16Å; Y210-W604 HydrophobicContact CE1-CD2 4.45Å; Y210-W604 HydrophobicContact CE1-CE3 4.23Å; Y210-W604 HydrophobicContact CE1-CG 4.44Å; Y210-W604 HydrophobicContact CE2-CD2 4Å; Y210-W604 AromaticContact CE2-CE3 3.37Å; Y210-W604 HydrophobicContact CE2-CE3 3.37Å; Y210-W604 HydrophobicContact CE2-CH2 4.28Å; Y210-W604 AromaticContact CE2-CZ3 3.54Å; Y210-W604 HydrophobicContact CE2-CZ3 3.54Å; Y210-W604 HydrophobicContact CG-CB 4.34Å; Y210-W604 AromaticContact CG-CD2 3.68Å; Y210-W604 HydrophobicContact CG-CD2 3.68Å; Y210-W604 AromaticContact CG-CE3 3.96Å; Y210-W604 HydrophobicContact CG-CE3 3.96Å; Y210-W604 AromaticContact CG-CG 3.85Å; Y210-W604 HydrophobicContact CG-CG 3.85Å; Y210-W604 AromaticContact CZ-CE3 3.8Å; I216-W604 HydrophobicContact CG2-CB 3.8Å; I216-W604 HydrophobicContact CG2-CG 4.05Å; Y521-W604 PolarHBondContact OH-N 2.98Å; Y521-W604 VanDerWaalsContact OH-N 3.14Å; W604-G609 WeakPolarHBondContact CH2-O 3.46Å; W604-E611 HydrophobicContact CE3-CG 4.03Å; W604-E611 HydrophobicContact CZ3-CG 4.47Å
605	V	88.7	Confident	85.7	Confident	30 Å²	30	65 Å²	65	18%	0.182	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	110	178.4	-176.3	0	0	0	0	109.7	E607 E608 G609 S610 R612	V605-E607 VanDerWaalsContact C-N 3.3Å; V605-E607 PolarHBondContact O-N 3.18Å; V605-E608 HydrophobicContact CB-CB 4.44Å; V605-E608 HydrophobicContact CG1-CB 4.29Å; V605-E608 HydrophobicContact CG1-CG 4.19Å; V605-E608 PolarHBondContact O-N 2.82Å; V605-G609 PolarHBondContact O-N 3.14Å; V605-S610 PolarHBondContact N-O 3.31Å; V605-S610 VanDerWaalsContact N-O 3.13Å; V605-R612 HydrophobicContact CG2-CB 3.89Å
606	E	85.5	Confident	86.1	Confident	112 Å²	112	61.5 Å²	61.5	52%	0.523	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-41	-177.1	-170.6	165.4	157.1	0	0	113.6	E198 R211 E608	E198-E606 HydrophobicContact CG-CG 4.47Å; R211-E606 IonicContact CZ-OE2 2.98Å; R211-E606 IonicContact NH1-OE2 3.03Å; R211-E606 IonicContact NH2-OE2 2.76Å; R211-E606 PolarHBondContact NH2-OE2 2.6Å; E606-E608 VanDerWaalsContact C-N 3.31Å; E606-E608 PolarHBondContact O-N 3.42Å
607	E	84.4	Confident	86.4	Confident	161 Å²	161	57.1 Å²	57.1	75%	0.752	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-33.4	-174.9	-62.7	-175.2	177.6	0	0	112.3	K201 V605	K201-E607 PolarHBondContact NZ-O 3.38Å; V605-E607 VanDerWaalsContact C-N 3.3Å; V605-E607 PolarHBondContact O-N 3.18Å
608	E	81.4	Confident	87	Confident	81 Å²	81	59.7 Å²	59.7	38%	0.379	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-25.1	-178.6	-65.2	179.2	169	0	0	111.7	V605 E606 S610 R612	V605-E608 HydrophobicContact CB-CB 4.44Å; V605-E608 HydrophobicContact CG1-CB 4.29Å; V605-E608 HydrophobicContact CG1-CG 4.19Å; V605-E608 PolarHBondContact O-N 2.82Å; E606-E608 VanDerWaalsContact C-N 3.31Å; E606-E608 PolarHBondContact O-N 3.42Å; E608-S610 VanDerWaalsContact C-N 3.25Å; E608-S610 WeakPolarHBondContact CB-OG 3.45Å; E608-R612 IonicContact OE1-CZ 2.78Å; E608-R612 IonicContact OE1-NH1 2.7Å; E608-R612 PolarHBondContact OE1-NH1 2.85Å; E608-R612 IonicContact OE1-NH2 3.43Å; E608-R612 IonicContact OE2-CZ 2.72Å; E608-R612 IonicContact OE2-NE 3.98Å; E608-R612 IonicContact OE2-NH1 3.2Å; E608-R612 PolarHBondContact OE2-NH1 2.81Å
609	G	82.4	Confident	87.7	Confident	9 Å²	9	60.5 Å²	60.5	9%	0.093	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	27.6	-174.2	0	0	0	0	0	112.4	S202 W604 V605	S202-G609 WeakPolarHBondContact CB-O 3.11Å; W604-G609 WeakPolarHBondContact CH2-O 3.46Å; V605-G609 PolarHBondContact O-N 3.14Å
610	S	83.9	Confident	88.1	Confident	49 Å²	49	59.3 Å²	59.3	34%	0.343	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.7	-176.9	59.3	0	0	0	0	112.2	V605 E608	V605-S610 PolarHBondContact N-O 3.31Å; V605-S610 VanDerWaalsContact N-O 3.13Å; E608-S610 VanDerWaalsContact C-N 3.25Å; E608-S610 WeakPolarHBondContact CB-OG 3.45Å
611	E	85.2	Confident	88.4	Confident	75 Å²	75	61.2 Å²	61.2	35%	0.35	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139	171.6	-65.7	-167.7	138.8	0	0	111.5	Y210 N602 A603 W604	Y210-E611 PolarHBondContact OH-OE1 3.25Å; N602-E611 HydrophobicContact CB-CB 4.22Å; A603-E611 CarbonylContact O-C 3.5Å; A603-E611 WeakPolarHBondContact O-CA 3.35Å; W604-E611 HydrophobicContact CE3-CG 4.03Å; W604-E611 HydrophobicContact CZ3-CG 4.47Å
612	R	87.4	Confident	88.5	Confident	133 Å²	133	63.7 Å²	63.7	50%	0.502	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140.4	175.6	-144.9	-179.8	-167.5	150.2	12.3	110.7	N602 A603 V605 E608 H614	N602-R612 CarbonylContact C-O 3.58Å; N602-R612 WeakPolarHBondContact CA-O 3.25Å; A603-R612 PolarHBondContact N-O 3.37Å; A603-R612 PolarHBondContact O-N 3.27Å; V605-R612 HydrophobicContact CG2-CB 3.89Å; E608-R612 IonicContact OE1-CZ 2.78Å; E608-R612 IonicContact OE1-NH1 2.7Å; E608-R612 PolarHBondContact OE1-NH1 2.85Å; E608-R612 IonicContact OE1-NH2 3.43Å; E608-R612 IonicContact OE2-CZ 2.72Å; E608-R612 IonicContact OE2-NE 3.98Å; E608-R612 IonicContact OE2-NH1 3.2Å; E608-R612 PolarHBondContact OE2-NH1 2.81Å; R612-H614 PolarHBondContact O-CD2 3.14Å; R612-H614 PolarHBondContact O-N 3.13Å
613	F	88.3	Confident	88.8	Confident	108 Å²	108	63.8 Å²	63.8	47%	0.474	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.1	177.9	-177.5	-96.1	0	0	0	110.9
614	H	89	Confident	88.9	Confident	70 Å²	70	63.8 Å²	63.8	32%	0.324	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137	174.8	-78.7	-92.6	0	0	0	110.3	G600 Y601 A603 R612	G600-H614 CarbonylContact C-O 3.58Å; G600-H614 WeakPolarHBondContact CA-O 3.35Å; Y601-H614 WeakPolarHBondContact CD1-O 3.06Å; Y601-H614 HydrophobicContact CE1-CB 4.07Å; Y601-H614 PolarHBondContact N-O 3.46Å; Y601-H614 PolarHBondContact O-N 3.13Å; Y601-H614 VanDerWaalsContact O-O 3.13Å; A603-H614 HydrophobicContact CB-CB 4.5Å; R612-H614 PolarHBondContact O-CD2 3.14Å; R612-H614 PolarHBondContact O-N 3.13Å
615	S	90.5	Very high	88.9	Confident	81 Å²	81	68.7 Å²	68.7	57%	0.566	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	146.4	173.5	-56.1	0	0	0	0	111.1
616	Y	90.6	Very high	89.1	Confident	16 Å²	16	69.5 Å²	69.5	6%	0.063	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-65.3	136.6	176.6	-78	-64.3	0	0	0	111.6	I220 M525 Y529 A599 G600 Y601 A620	I220-Y616 HydrophobicContact CD1-CD1 4.36Å; I220-Y616 HydrophobicContact CD1-CE1 4.09Å; M525-Y616 WeakPolarHBondContact CB-OH 3.44Å; M525-Y616 HydrophobicContact CE-CD1 3.69Å; M525-Y616 HydrophobicContact CE-CE1 3.34Å; Y529-Y616 HydrophobicContact CE2-CE2 4.02Å; A599-Y616 HydrophobicContact CB-CD2 4.2Å; A599-Y616 PolarHBondContact O-N 2.93Å; A599-Y616 VanDerWaalsContact O-N 3.14Å; G600-Y616 VanDerWaalsContact O-CE2 3.31Å; G600-Y616 WeakPolarHBondContact O-CE2 3.49Å; Y601-Y616 AromaticContact CD1-CD1 3.5Å; Y601-Y616 HydrophobicContact CD1-CD1 3.5Å; Y601-Y616 AromaticContact CD1-CE1 3.42Å; Y601-Y616 HydrophobicContact CD1-CE1 3.42Å; Y601-Y616 VanDerWaalsContact CD1-CE1 3.42Å; Y601-Y616 HydrophobicContact CD1-CG 4.17Å; Y601-Y616 AromaticContact CE1-CD1 3.99Å; Y601-Y616 HydrophobicContact CE1-CD1 3.99Å; Y601-Y616 HydrophobicContact CE1-CE1 4.22Å; Y601-Y616 HydrophobicContact CG-CD1 4.42Å; Y601-Y616 AromaticContact CG-CE1 3.89Å; Y601-Y616 HydrophobicContact CG-CE1 3.89Å; Y616-A620 HydrophobicContact CD1-CB 3.94Å; Y616-A620 HydrophobicContact CG-CB 4.45Å
617	P	92.8	Very high	89.5	Confident	20 Å²	20	64.9 Å²	64.9	13%	0.13	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-65	158	171	26.4	-32.9	0	0	0	110.8	I220 D221 W619 A620 L621	I220-P617 HydrophobicContact CG2-CG 3.69Å; D221-P617 WeakPolarHBondContact OD1-CG 3.38Å; P617-W619 VanDerWaalsContact C-N 3.28Å; P617-W619 HydrophobicContact CG-CZ2 4.13Å; P617-W619 PolarHBondContact O-N 2.97Å; P617-W619 VanDerWaalsContact O-N 3.13Å; P617-A620 HydrophobicContact CG-CB 3.67Å; P617-A620 WeakPolarHBondContact O-CB 3.4Å; P617-A620 PolarHBondContact O-N 2.04Å; P617-L621 PolarHBondContact O-N 2.68Å
618	P	92.5	Very high	89.9	Confident	113 Å²	113	57.8 Å²	57.8	73%	0.734	30%	0.303	S	S	*	.	H	α-helix	trans	-56.4	-35.8	-172.3	-28.3	35.3	0	0	0	115	A622	P618-A622 WeakPolarHBondContact O-CB 3.48Å; P618-A622 PolarHBondContact O-N 2.88Å
619	W	93.3	Very high	90.5	Very high	112 Å²	112	57.8 Å²	57.8	42%	0.424	31%	0.308	S	S	.	.	H	α-helix	trans	-70	-37.3	177.2	70	-96.4	0	0	0	112.1	I220 D221 F522 P617 A622 M623	I220-W619 HydrophobicContact CD1-CH2 4.32Å; I220-W619 HydrophobicContact CG1-CH2 4.07Å; I220-W619 HydrophobicContact CG1-CZ2 4.32Å; I220-W619 HydrophobicContact CG2-CZ2 4.12Å; D221-W619 PolarHBondContact OD1-NE1 3.13Å; F522-W619 HydrophobicContact CE1-CH2 4.25Å; F522-W619 HydrophobicContact CE1-CZ3 4.26Å; F522-W619 AromaticContact CZ-CH2 3.92Å; F522-W619 HydrophobicContact CZ-CH2 3.92Å; F522-W619 HydrophobicContact CZ-CZ3 4.31Å; P617-W619 VanDerWaalsContact C-N 3.28Å; P617-W619 HydrophobicContact CG-CZ2 4.13Å; P617-W619 PolarHBondContact O-N 2.97Å; P617-W619 VanDerWaalsContact O-N 3.13Å; W619-A622 PolarHBondContact O-N 3.46Å; W619-M623 HydrophobicContact CZ3-CE 4.05Å; W619-M623 PolarHBondContact O-N 3.46Å
620	A	91.8	Very high	91.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-71.4	-38.7	178.6	0	0	0	0	0	110.4	I220 M525 Y616 P617 M623 A624	I220-A620 HydrophobicContact CD1-CB 4.42Å; M525-A620 HydrophobicContact CE-CB 3.81Å; Y616-A620 HydrophobicContact CD1-CB 3.94Å; Y616-A620 HydrophobicContact CG-CB 4.45Å; P617-A620 HydrophobicContact CG-CB 3.67Å; P617-A620 WeakPolarHBondContact O-CB 3.4Å; P617-A620 PolarHBondContact O-N 2.04Å; A620-M623 WeakPolarHBondContact O-CB 3.46Å; A620-M623 PolarHBondContact O-N 2.7Å; A620-A624 PolarHBondContact O-N 2.75Å
621	L	91.4	Very high	91.6	Very high	53 Å²	53	58.2 Å²	58.2	28%	0.277	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-44.4	171.9	-173.8	67.5	0	0	0	111.5	A599 P617 M623 A624 Y625	A599-L621 HydrophobicContact CB-CD1 3.68Å; P617-L621 PolarHBondContact O-N 2.68Å; L621-M623 VanDerWaalsContact C-N 3.27Å; L621-M623 PolarHBondContact O-N 2.68Å; L621-A624 PolarHBondContact O-N 2.89Å; L621-Y625 HydrophobicContact CD1-CD2 4.23Å; L621-Y625 HydrophobicContact CD1-CE2 3.58Å; L621-Y625 HydrophobicContact CD2-CE2 4.03Å; L621-Y625 HydrophobicContact CG-CD2 3.96Å; L621-Y625 HydrophobicContact CG-CE2 3.52Å; L621-Y625 WeakPolarHBondContact O-CD2 2.99Å; L621-Y625 PolarHBondContact O-N 2.86Å
622	A	92.6	Very high	92	Very high	61 Å²	61	56.8 Å²	56.8	50%	0.504	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-39.1	174.6	0	0	0	0	0	111.7	P618 W619 A626	P618-A622 WeakPolarHBondContact O-CB 3.48Å; P618-A622 PolarHBondContact O-N 2.88Å; W619-A622 PolarHBondContact O-N 3.46Å; A622-A626 VanDerWaalsContact O-CB 3.28Å; A622-A626 WeakPolarHBondContact O-CB 3.41Å; A622-A626 PolarHBondContact O-N 3.14Å
623	M	92.7	Very high	92.4	Very high	48 Å²	48	54.3 Å²	54.3	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-66.9	-42.6	175	-172.7	179.9	61.8	0	0	112.2	F522 M525 W619 A620 L621 Y625 A626 L627	F522-M623 HydrophobicContact CD1-CE 3.67Å; F522-M623 HydrophobicContact CE1-CE 3.42Å; F522-M623 VanDerWaalsContact CE1-CE 3.42Å; F522-M623 HydrophobicContact CE1-SD 4.12Å; M525-M623 HydrophobicContact CE-CE 3.66Å; M525-M623 HydrophobicContact SD-CE 3.3Å; M525-M623 WeakPolarHBondContact SD-CE 3.33Å; W619-M623 HydrophobicContact CZ3-CE 4.05Å; W619-M623 PolarHBondContact O-N 3.46Å; A620-M623 WeakPolarHBondContact O-CB 3.46Å; A620-M623 PolarHBondContact O-N 2.7Å; L621-M623 VanDerWaalsContact C-N 3.27Å; L621-M623 PolarHBondContact O-N 2.68Å; M623-Y625 PolarHBondContact O-N 3.28Å; M623-A626 WeakPolarHBondContact O-CB 3.09Å; M623-A626 PolarHBondContact O-N 3.24Å; M623-A626 VanDerWaalsContact O-N 3.11Å; M623-L627 WeakPolarHBondContact O-CG 3.37Å; M623-L627 PolarHBondContact O-N 2.97Å
624	A	91.5	Very high	92.7	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58	-46.3	176.1	0	0	0	0	0	111.8	M525 Y529 A620 L621 L627 I628	M525-A624 HydrophobicContact CG-CB 4.12Å; M525-A624 HydrophobicContact SD-CB 4.03Å; Y529-A624 HydrophobicContact CD1-CB 4.27Å; Y529-A624 HydrophobicContact CD2-CB 4.15Å; Y529-A624 HydrophobicContact CG-CB 4.03Å; A620-A624 PolarHBondContact O-N 2.75Å; L621-A624 PolarHBondContact O-N 2.89Å; A624-L627 PolarHBondContact O-N 3.46Å; A624-I628 PolarHBondContact O-N 2.93Å
625	Y	91.4	Very high	92.9	Very high	111 Å²	111	47.9 Å²	47.9	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-66.4	-36.8	173.8	-69.6	-57.1	0	0	0	112.7	L621 M623 L627 I628 V629	L621-Y625 HydrophobicContact CD1-CD2 4.23Å; L621-Y625 HydrophobicContact CD1-CE2 3.58Å; L621-Y625 HydrophobicContact CD2-CE2 4.03Å; L621-Y625 HydrophobicContact CG-CD2 3.96Å; L621-Y625 HydrophobicContact CG-CE2 3.52Å; L621-Y625 WeakPolarHBondContact O-CD2 2.99Å; L621-Y625 PolarHBondContact O-N 2.86Å; M623-Y625 PolarHBondContact O-N 3.28Å; Y625-L627 VanDerWaalsContact C-N 3.3Å; Y625-L627 PolarHBondContact O-N 3.35Å; Y625-I628 PolarHBondContact O-N 3Å; Y625-V629 WeakPolarHBondContact O-CG2 3.39Å; Y625-V629 PolarHBondContact O-N 3.4Å
626	A	93.5	Very high	93.1	Very high	46 Å²	46	47.1 Å²	47.1	38%	0.38	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-36.5	176.1	0	0	0	0	0	112.1	A622 M623 V629 V630	A622-A626 VanDerWaalsContact O-CB 3.28Å; A622-A626 WeakPolarHBondContact O-CB 3.41Å; A622-A626 PolarHBondContact O-N 3.14Å; M623-A626 WeakPolarHBondContact O-CB 3.09Å; M623-A626 PolarHBondContact O-N 3.24Å; M623-A626 VanDerWaalsContact O-N 3.11Å; A626-V629 PolarHBondContact O-N 3.31Å; A626-V630 WeakPolarHBondContact O-CB 3.33Å; A626-V630 WeakPolarHBondContact O-CG2 3.48Å; A626-V630 PolarHBondContact O-N 3.1Å
627	L	93.4	Very high	93.2	Very high	15 Å²	15	50.7 Å²	50.7	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-46.9	175.4	-68.8	172.4	0	0	0	111.7	F155 F526 M623 A624 Y625 A631	F155-L627 HydrophobicContact CE1-CD2 4.35Å; F155-L627 HydrophobicContact CE2-CD2 4.46Å; F155-L627 HydrophobicContact CZ-CD2 4.21Å; F526-L627 HydrophobicContact CD1-CD1 4.41Å; F526-L627 HydrophobicContact CD1-CD2 4.45Å; F526-L627 HydrophobicContact CD2-CD1 3.75Å; F526-L627 HydrophobicContact CE1-CD1 4.37Å; F526-L627 HydrophobicContact CE1-CD2 3.76Å; F526-L627 HydrophobicContact CE2-CD1 3.72Å; F526-L627 HydrophobicContact CE2-CD2 4.08Å; F526-L627 HydrophobicContact CG-CD1 4.13Å; F526-L627 HydrophobicContact CZ-CD1 4.05Å; F526-L627 HydrophobicContact CZ-CD2 3.56Å; F526-L627 HydrophobicContact CZ-CG 4.45Å; M623-L627 WeakPolarHBondContact O-CG 3.37Å; M623-L627 PolarHBondContact O-N 2.97Å; A624-L627 PolarHBondContact O-N 3.46Å; Y625-L627 VanDerWaalsContact C-N 3.3Å; Y625-L627 PolarHBondContact O-N 3.35Å; L627-A631 WeakPolarHBondContact O-CB 3.49Å; L627-A631 PolarHBondContact O-N 3.02Å
628	I	93.3	Very high	93.1	Very high	12 Å²	12	51 Å²	51	6%	0.062	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-48.6	176.4	-69.5	169.9	0	0	0	110.4	Y529 L533 M594 A624 Y625 A631 M632	Y529-I628 HydrophobicContact CD1-CD1 4.01Å; Y529-I628 WeakPolarHBondContact O-CG1 3.31Å; L533-I628 HydrophobicContact CD2-CG2 4.08Å; M594-I628 HydrophobicContact CE-CD1 4.08Å; M594-I628 HydrophobicContact SD-CD1 4.39Å; A624-I628 PolarHBondContact O-N 2.93Å; Y625-I628 PolarHBondContact O-N 3Å; I628-A631 PolarHBondContact O-N 3.37Å; I628-M632 HydrophobicContact CG2-CE 3.34Å; I628-M632 HydrophobicContact CG2-SD 4.31Å; I628-M632 WeakPolarHBondContact O-CG 3.34Å; I628-M632 PolarHBondContact O-N 3.28Å; I628-M632 VanDerWaalsContact O-N 3.13Å
629	V	93.8	Very high	92.9	Very high	81 Å²	81	49.7 Å²	49.7	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-49	-179	172.6	0	0	0	0	110.6	Y625 A626 A631 M632 L633	Y625-V629 WeakPolarHBondContact O-CG2 3.39Å; Y625-V629 PolarHBondContact O-N 3.4Å; A626-V629 PolarHBondContact O-N 3.31Å; V629-A631 VanDerWaalsContact C-N 3.31Å; V629-A631 PolarHBondContact O-N 3.37Å; V629-M632 PolarHBondContact O-N 3.41Å; V629-M632 VanDerWaalsContact O-N 3.14Å; V629-L633 WeakPolarHBondContact O-CA 3.27Å; V629-L633 WeakPolarHBondContact O-CB 3.48Å; V629-L633 PolarHBondContact O-N 3.35Å
630	V	94.6	Very high	92.8	Very high	67 Å²	67	48.5 Å²	48.5	41%	0.406	27%	0.268	S	S	.	.	H	α-helix	trans	-60.9	-39.5	-179.3	170.3	0	0	0	0	111.6	F155 A626 M632 P634	F155-V630 HydrophobicContact CE2-CG1 4.42Å; F155-V630 HydrophobicContact CZ-CB 4.37Å; F155-V630 HydrophobicContact CZ-CG1 3.85Å; A626-V630 WeakPolarHBondContact O-CB 3.33Å; A626-V630 WeakPolarHBondContact O-CG2 3.48Å; A626-V630 PolarHBondContact O-N 3.1Å; V630-M632 PolarHBondContact O-N 2.95Å; V630-P634 WeakPolarHBondContact O-CD 3.36Å
631	A	94.3	Very high	92.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-39.8	176.1	0	0	0	0	0	112.4	S148 V152 F155 P534 L627 I628 V629	S148-A631 WeakPolarHBondContact CB-O 3.15Å; S148-A631 PolarHBondContact OG-O 3.15Å; V152-A631 HydrophobicContact CG2-CB 3.97Å; F155-A631 HydrophobicContact CD2-CB 4.38Å; F155-A631 HydrophobicContact CE2-CB 4.03Å; P534-A631 HydrophobicContact CB-CB 3.73Å; P534-A631 HydrophobicContact CG-CB 3.77Å; L627-A631 WeakPolarHBondContact O-CB 3.49Å; L627-A631 PolarHBondContact O-N 3.02Å; I628-A631 PolarHBondContact O-N 3.37Å; V629-A631 VanDerWaalsContact C-N 3.31Å; V629-A631 PolarHBondContact O-N 3.37Å
632	M	93.9	Very high	92.3	Very high	46 Å²	46	48.7 Å²	48.7	23%	0.227	27%	0.27	C	S	.	.	H	α-helix	trans	-91.1	-21.5	-175.7	-63.6	-171.1	-53.8	0	0	114.2	P534 V537 I628 V629 V630 P634 L635 P636	P534-M632 HydrophobicContact CB-CG 4.12Å; P534-M632 HydrophobicContact CG-CG 4.28Å; V537-M632 HydrophobicContact CB-SD 4.27Å; V537-M632 HydrophobicContact CG1-SD 4.35Å; V537-M632 HydrophobicContact CG2-SD 4.02Å; I628-M632 HydrophobicContact CG2-CE 3.34Å; I628-M632 HydrophobicContact CG2-SD 4.31Å; I628-M632 WeakPolarHBondContact O-CG 3.34Å; I628-M632 PolarHBondContact O-N 3.28Å; I628-M632 VanDerWaalsContact O-N 3.13Å; V629-M632 PolarHBondContact O-N 3.41Å; V629-M632 VanDerWaalsContact O-N 3.14Å; V630-M632 PolarHBondContact O-N 2.95Å; M632-P634 VanDerWaalsContact C-N 3.31Å; M632-L635 HydrophobicContact CB-CD1 4.34Å; M632-L635 VanDerWaalsContact O-CB 3.27Å; M632-L635 WeakPolarHBondContact O-CB 3.18Å; M632-L635 WeakPolarHBondContact O-CG 3.11Å; M632-L635 PolarHBondContact O-N 3.4Å; M632-P636 VanDerWaalsContact O-CD 3.27Å; M632-P636 WeakPolarHBondContact O-CD 3.42Å
633	L	94.3	Very high	92	Very high	80 Å²	80	50.8 Å²	50.8	42%	0.419	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-36.5	-176.2	-172.3	69.5	0	0	0	114.4	V629 L635 P636 I637	V629-L633 WeakPolarHBondContact O-CA 3.27Å; V629-L633 WeakPolarHBondContact O-CB 3.48Å; V629-L633 PolarHBondContact O-N 3.35Å; L633-L635 PolarHBondContact O-N 2.9Å; L633-P636 VanDerWaalsContact O-CD 3.23Å; L633-P636 WeakPolarHBondContact O-CD 3.41Å; L633-P636 WeakPolarHBondContact O-CG 3.13Å; L633-I637 HydrophobicContact CD1-CD1 3.78Å; L633-I637 HydrophobicContact CD1-CG1 4.07Å; L633-I637 HydrophobicContact CD2-CD1 3.75Å; L633-I637 HydrophobicContact CG-CD1 3.43Å; L633-I637 VanDerWaalsContact CG-CD1 3.43Å; L633-I637 HydrophobicContact CG-CG1 4.01Å; L633-I637 WeakPolarHBondContact O-CB 3.24Å; L633-I637 WeakPolarHBondContact O-CG1 3.17Å; L633-I637 PolarHBondContact O-N 2.87Å
634	P	94.7	Very high	91.7	Very high	19 Å²	19	55 Å²	55	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-59.7	-26.5	176.1	-25.7	35.8	0	0	0	114.3	V147 M151 V630 M632 V638	V147-P634 HydrophobicContact CB-CB 3.82Å; V147-P634 HydrophobicContact CB-CG 4.46Å; V147-P634 HydrophobicContact CG1-CB 3.68Å; V147-P634 HydrophobicContact CG1-CG 3.89Å; M151-P634 HydrophobicContact CG-CG 4.27Å; V630-P634 WeakPolarHBondContact O-CD 3.36Å; M632-P634 VanDerWaalsContact C-N 3.31Å; P634-V638 VanDerWaalsContact O-CB 3.32Å; P634-V638 WeakPolarHBondContact O-CB 3.49Å; P634-V638 VanDerWaalsContact O-CG2 3.25Å; P634-V638 WeakPolarHBondContact O-CG2 3.23Å; P634-V638 PolarHBondContact O-N 3.48Å; P634-V638 VanDerWaalsContact O-N 3.07Å
635	L	94.1	Very high	91.1	Very high	25 Å²	25	60.9 Å²	60.9	13%	0.131	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-61.2	-178.9	-56.6	169.1	0	0	0	111.6	I145 V537 L541 M632 L633 F639	I145-L635 HydrophobicContact CB-CD2 4.41Å; I145-L635 HydrophobicContact CG1-CD2 4.03Å; V537-L635 HydrophobicContact CG1-CD1 3.81Å; L541-L635 HydrophobicContact CD1-CD1 3.73Å; L541-L635 HydrophobicContact CD1-CD2 3.83Å; L541-L635 HydrophobicContact CD1-CG 4.26Å; M632-L635 HydrophobicContact CB-CD1 4.34Å; M632-L635 VanDerWaalsContact O-CB 3.27Å; M632-L635 WeakPolarHBondContact O-CB 3.18Å; M632-L635 WeakPolarHBondContact O-CG 3.11Å; M632-L635 PolarHBondContact O-N 3.4Å; L633-L635 PolarHBondContact O-N 2.9Å; L635-F639 WeakPolarHBondContact O-CB 3.4Å; L635-F639 PolarHBondContact O-N 3.5Å
636	P	94.1	Very high	90.2	Very high	65 Å²	65	62.1 Å²	62.1	42%	0.422	33%	0.331	S	S	.	.	H	α-helix	trans	-70.1	-36.8	177.8	28.5	-36.5	0	0	0	112.7	M632 L633 V638 F639 I640	M632-P636 VanDerWaalsContact O-CD 3.27Å; M632-P636 WeakPolarHBondContact O-CD 3.42Å; L633-P636 VanDerWaalsContact O-CD 3.23Å; L633-P636 WeakPolarHBondContact O-CD 3.41Å; L633-P636 WeakPolarHBondContact O-CG 3.13Å; P636-V638 PolarHBondContact O-N 3.31Å; P636-F639 PolarHBondContact O-N 3.31Å; P636-I640 HydrophobicContact CB-CD1 4.49Å; P636-I640 WeakPolarHBondContact O-CB 3.46Å; P636-I640 VanDerWaalsContact O-CG1 3.24Å; P636-I640 WeakPolarHBondContact O-CG1 3.21Å; P636-I640 PolarHBondContact O-N 3.41Å
637	I	92.6	Very high	89	Confident	91 Å²	91	63.3 Å²	63.3	47%	0.467	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-49.3	-177.3	-71.2	-171.9	0	0	0	110.9	L633 F639 I640 A641	L633-I637 HydrophobicContact CD1-CD1 3.78Å; L633-I637 HydrophobicContact CD1-CG1 4.07Å; L633-I637 HydrophobicContact CD2-CD1 3.75Å; L633-I637 HydrophobicContact CG-CD1 3.43Å; L633-I637 VanDerWaalsContact CG-CD1 3.43Å; L633-I637 HydrophobicContact CG-CG1 4.01Å; L633-I637 WeakPolarHBondContact O-CB 3.24Å; L633-I637 WeakPolarHBondContact O-CG1 3.17Å; L633-I637 PolarHBondContact O-N 2.87Å; I637-F639 VanDerWaalsContact C-N 3.32Å; I637-F639 PolarHBondContact O-N 2.95Å; I637-I640 PolarHBondContact O-N 2.99Å; I637-A641 WeakPolarHBondContact O-CB 3.48Å; I637-A641 PolarHBondContact O-N 3.27Å
638	V	90.4	Very high	87.3	Confident	27 Å²	27	66.6 Å²	66.6	16%	0.164	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-38.2	-178.9	175.4	0	0	0	0	110.8	P634 P636 R642	P634-V638 VanDerWaalsContact O-CB 3.32Å; P634-V638 WeakPolarHBondContact O-CB 3.49Å; P634-V638 VanDerWaalsContact O-CG2 3.25Å; P634-V638 WeakPolarHBondContact O-CG2 3.23Å; P634-V638 PolarHBondContact O-N 3.48Å; P634-V638 VanDerWaalsContact O-N 3.07Å; P636-V638 PolarHBondContact O-N 3.31Å; V638-R642 HydrophobicContact CG1-CG 4.5Å; V638-R642 WeakPolarHBondContact O-CB 3.23Å; V638-R642 WeakPolarHBondContact O-CG 3.49Å; V638-R642 PolarHBondContact O-N 3.33Å
639	F	90.3	Very high	85.4	Confident	84 Å²	84	68.9 Å²	68.9	37%	0.368	37%	0.37	S	S	.	.	H	α-helix	trans	-60.5	-52.6	176.1	-175.9	-94.6	0	0	0	111.6	Q141 L635 P636 I637 R642 H643	Q141-F639 HydrophobicContact CB-CD2 3.91Å; Q141-F639 HydrophobicContact CB-CE2 4.16Å; Q141-F639 WeakPolarHBondContact O-CA 3.41Å; L635-F639 WeakPolarHBondContact O-CB 3.4Å; L635-F639 PolarHBondContact O-N 3.5Å; P636-F639 PolarHBondContact O-N 3.31Å; I637-F639 VanDerWaalsContact C-N 3.32Å; I637-F639 PolarHBondContact O-N 2.95Å; F639-R642 PolarHBondContact O-N 3.29Å; F639-H643 WeakPolarHBondContact O-CB 3.34Å; F639-H643 PolarHBondContact O-N 3.47Å
640	I	90.4	Very high	83.3	Confident	87 Å²	87	68.5 Å²	68.5	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-48.4	179.3	-69.1	170.1	0	0	0	110.7	P636 I637 R642 H643 F644	P636-I640 HydrophobicContact CB-CD1 4.49Å; P636-I640 WeakPolarHBondContact O-CB 3.46Å; P636-I640 VanDerWaalsContact O-CG1 3.24Å; P636-I640 WeakPolarHBondContact O-CG1 3.21Å; P636-I640 PolarHBondContact O-N 3.41Å; I637-I640 PolarHBondContact O-N 2.99Å; I640-R642 VanDerWaalsContact C-N 3.28Å; I640-R642 PolarHBondContact O-N 3.16Å; I640-H643 PolarHBondContact O-N 3.3Å; I640-F644 HydrophobicContact CG2-CD2 3.67Å; I640-F644 HydrophobicContact CG2-CE2 3.89Å; I640-F644 VanDerWaalsContact O-CD2 3.28Å; I640-F644 WeakPolarHBondContact O-CD2 3.3Å; I640-F644 PolarHBondContact O-N 3.1Å
641	A	87.9	Confident	80.9	Confident	19 Å²	19	67 Å²	67	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-60.4	-37.6	-177.4	0	0	0	0	0	112.4	I637 N645 L646 V647	I637-A641 WeakPolarHBondContact O-CB 3.48Å; I637-A641 PolarHBondContact O-N 3.27Å; A641-N645 PolarHBondContact O-N 3.23Å; A641-L646 WeakPolarHBondContact O-CB 3.5Å; A641-L646 PolarHBondContact O-N 3.05Å; A641-V647 HydrophobicContact CB-CG2 4.02Å; A641-V647 PolarHBondContact O-N 3.08Å
642	R	85.4	Confident	78.3	Confident	39 Å²	39	73.5 Å²	73.5	15%	0.147	41%	0.41	C	S	.	.	H	α-helix	trans	-80.6	-34.7	175.7	-68.2	-173.3	-176.2	-171.5	6.7	112.6	N136 P140 Q141 V638 F639 I640 F644 N645	N136-R642 VanDerWaalsContact OD1-CZ 3.3Å; N136-R642 PolarHBondContact OD1-NH1 3.44Å; N136-R642 PolarHBondContact OD1-NH2 3.44Å; P140-R642 VanDerWaalsContact O-CD 3.22Å; P140-R642 WeakPolarHBondContact O-CD 3.49Å; P140-R642 PolarHBondContact O-NH1 3.01Å; Q141-R642 HydrophobicContact CG-CB 4.28Å; V638-R642 HydrophobicContact CG1-CG 4.5Å; V638-R642 WeakPolarHBondContact O-CB 3.23Å; V638-R642 WeakPolarHBondContact O-CG 3.49Å; V638-R642 PolarHBondContact O-N 3.33Å; F639-R642 PolarHBondContact O-N 3.29Å; I640-R642 VanDerWaalsContact C-N 3.28Å; I640-R642 PolarHBondContact O-N 3.16Å; R642-F644 VanDerWaalsContact C-N 3.29Å; R642-F644 PolarHBondContact O-N 2.93Å; R642-N645 PolarHBondContact O-N 3.28Å; R642-N645 VanDerWaalsContact O-N 3.1Å
643	H	85	Confident	75.6	Confident	104 Å²	104	80.8 Å²	80.8	48%	0.481	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-40	175.4	-169.8	82.2	0	0	0	112.1	F639 I640 N645	F639-H643 WeakPolarHBondContact O-CB 3.34Å; F639-H643 PolarHBondContact O-N 3.47Å; I640-H643 PolarHBondContact O-N 3.3Å; H643-N645 VanDerWaalsContact C-N 3.32Å
644	F	87	Confident	73.1	Confident	136 Å²	136	81.1 Å²	81.1	60%	0.596	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	11.4	175.8	-68	-71.5	0	0	0	114.1	I640 R642 L646	I640-F644 HydrophobicContact CG2-CD2 3.67Å; I640-F644 HydrophobicContact CG2-CE2 3.89Å; I640-F644 VanDerWaalsContact O-CD2 3.28Å; I640-F644 WeakPolarHBondContact O-CD2 3.3Å; I640-F644 PolarHBondContact O-N 3.1Å; R642-F644 VanDerWaalsContact C-N 3.29Å; R642-F644 PolarHBondContact O-N 2.93Å; F644-L646 HydrophobicContact CB-CD1 4.24Å; F644-L646 HydrophobicContact CB-CG 4.12Å; F644-L646 PolarHBondContact O-N 2.93Å; F644-L646 VanDerWaalsContact O-N 3.09Å
645	N	79.3	Confident	70.3	Confident	125 Å²	125	82.1 Å²	82.1	67%	0.668	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	25.7	-179	-62.5	-54.1	0	0	0	114.8	A641 R642 H643 V647	A641-N645 PolarHBondContact O-N 3.23Å; R642-N645 PolarHBondContact O-N 3.28Å; R642-N645 VanDerWaalsContact O-N 3.1Å; H643-N645 VanDerWaalsContact C-N 3.32Å; N645-V647 VanDerWaalsContact C-N 3.28Å
646	L	71	Confident	67.6	Low	137 Å²	137	86.2 Å²	86.2	72%	0.717	48%	0.475	S	S	*	.			trans	-72.5	-24.8	177.7	-66.4	170.9	0	0	0	112.1	A641 F644	A641-L646 WeakPolarHBondContact O-CB 3.5Å; A641-L646 PolarHBondContact O-N 3.05Å; F644-L646 HydrophobicContact CB-CD1 4.24Å; F644-L646 HydrophobicContact CB-CG 4.12Å; F644-L646 PolarHBondContact O-N 2.93Å; F644-L646 VanDerWaalsContact O-N 3.09Å
647	V	69	Low	64.6	Low	71 Å²	71	87.6 Å²	87.6	43%	0.43	49%	0.486	S	S	.	.	S	Bend	trans	-115.7	122.5	173.1	175.7	0	0	0	0	107.5	A641 N645 D649	A641-V647 HydrophobicContact CB-CG2 4.02Å; A641-V647 PolarHBondContact O-N 3.08Å; N645-V647 VanDerWaalsContact C-N 3.28Å; V647-D649 PolarHBondContact O-N 2.81Å; V647-D649 VanDerWaalsContact O-N 3.14Å
648	S	57.2	Low	62.2	Low	84 Å²	84	90.3 Å²	90.3	59%	0.587	49%	0.492	S	S	*	.			trans	-51.5	120.8	171.2	176.9	0	0	0	0	108.9	G650	S648-G650 PolarHBondContact O-N 2.76Å; S648-G650 VanDerWaalsContact O-N 3.09Å
649	D	53.6	Low	59.5	Low	59 Å²	59	97.7 Å²	97.7	32%	0.316	52%	0.517	S	S	.	.			trans	-48.7	124	161.4	-72.4	-31.1	0	0	0	105.4	V647 S651	V647-D649 PolarHBondContact O-N 2.81Å; V647-D649 VanDerWaalsContact O-N 3.14Å; D649-S651 WeakPolarHBondContact O-CB 3.48Å; D649-S651 PolarHBondContact O-N 2.72Å
650	G	50.8	Low	56.7	Low	74 Å²	74	102 Å²	102	76%	0.763	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-59	15.2	174.8	0	0	0	0	0	114.8	S648	S648-G650 PolarHBondContact O-N 2.76Å; S648-G650 VanDerWaalsContact O-N 3.09Å
651	S	44.4	Very low	54.3	Low	35 Å²	35	99.4 Å²	99.4	25%	0.245	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-59.8	-28.2	176.9	170.7	0	0	0	0	115.4	D649 K653 L654 S655	D649-S651 WeakPolarHBondContact O-CB 3.48Å; D649-S651 PolarHBondContact O-N 2.72Å; S651-K653 PolarHBondContact O-N 3.08Å; S651-L654 PolarHBondContact O-N 2.98Å; S651-L654 VanDerWaalsContact O-N 3.1Å; S651-S655 PolarHBondContact O-N 3.03Å; S651-S655 VanDerWaalsContact O-N 3.07Å; S651-S655 PolarHBondContact O-OG 3.34Å; S651-S655 WeakPolarHBondContact OG-CB 3.22Å; S651-S655 PolarHBondContact OG-OG 2.97Å
652	N	38.2	Very low	51.9	Low	136 Å²	136	102.9 Å²	102.9	73%	0.727	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-64.9	-4.2	-171	-80.3	-6.8	0	0	0	116.1
653	K	39	Very low	49.7	Very low	199 Å²	199	107.6 Å²	107.6	87%	0.865	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	-12.1	165.4	-73.4	-172.6	177.3	-178.9	0	115.6	S651	S651-K653 PolarHBondContact O-N 3.08Å
654	L	40.2	Very low	47.5	Very low	87 Å²	87	109.3 Å²	109.3	46%	0.455	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.9	-25.5	-173.2	-117.6	97.7	0	0	0	115	R129 S651	R129-L654 VanDerWaalsContact NH2-CD2 3.34Å; S651-L654 PolarHBondContact O-N 2.98Å; S651-L654 VanDerWaalsContact O-N 3.1Å
655	S	36	Very low	45.4	Very low	41 Å²	41	107 Å²	107	29%	0.287	57%	0.569	S	S	.	*	H	α-helix	trans	-81.1	-28.5	-176	70.5	0	0	0	0	113.4	S651 S657 Y658 R659	S651-S655 PolarHBondContact O-N 3.03Å; S651-S655 VanDerWaalsContact O-N 3.07Å; S651-S655 PolarHBondContact O-OG 3.34Å; S651-S655 WeakPolarHBondContact OG-CB 3.22Å; S651-S655 PolarHBondContact OG-OG 2.97Å; S655-S657 VanDerWaalsContact C-N 3.31Å; S655-S657 PolarHBondContact O-N 3.42Å; S655-Y658 PolarHBondContact O-N 3.09Å; S655-R659 VanDerWaalsContact O-CB 3.26Å; S655-R659 WeakPolarHBondContact O-CB 3.47Å; S655-R659 PolarHBondContact O-N 3.45Å
656	V	38	Very low	43.9	Very low	110 Å²	110	105 Å²	105	67%	0.667	56%	0.558	S	S	*	*	H	α-helix	trans	-69.7	-29.6	-175.4	-178.9	0	0	0	0	111.9
657	S	32	Very low	42.5	Very low	94 Å²	94	100.8 Å²	100.8	66%	0.657	54%	0.54	S	S	*	.	H	α-helix	trans	-76.5	-38.8	176.6	-158.6	0	0	0	0	112.1	S655	S655-S657 VanDerWaalsContact C-N 3.31Å; S655-S657 PolarHBondContact O-N 3.42Å
658	Y	40.7	Very low	41.2	Very low	149 Å²	149	100.7 Å²	100.7	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-90.4	-28.1	-173.7	-86.1	-88.7	0	0	0	114.8	S655 K660 G661 M662	S655-Y658 PolarHBondContact O-N 3.09Å; Y658-K660 PolarHBondContact O-N 3.08Å; Y658-G661 PolarHBondContact O-N 3.36Å; Y658-M662 PolarHBondContact O-N 3.03Å
659	R	33.4	Very low	40.8	Very low	182 Å²	182	100.5 Å²	100.5	69%	0.687	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-27.1	175.1	-159.2	176.9	-169.8	-180	3.4	111.9	S655 M663	S655-R659 VanDerWaalsContact O-CB 3.26Å; S655-R659 WeakPolarHBondContact O-CB 3.47Å; S655-R659 PolarHBondContact O-N 3.45Å; R659-M663 PolarHBondContact O-N 3.11Å
660	K	33.2	Very low	40.6	Very low	175 Å²	175	104 Å²	104	76%	0.761	54%	0.543	S	S	*	.	H	α-helix	trans	-73.5	-28.8	173.5	-124.4	179.2	-177.6	-179.4	0	113.5	Y658	Y658-K660 PolarHBondContact O-N 3.08Å
661	G	39.6	Very low	40.5	Very low	32 Å²	32	106.2 Å²	106.2	33%	0.33	53%	0.534	S	S	.	.	H	α-helix	trans	-78.1	-43	171.6	0	0	0	0	0	112	Y658 M663 K664 D665	Y658-G661 PolarHBondContact O-N 3.36Å; G661-M663 PolarHBondContact O-N 3.01Å; G661-K664 WeakPolarHBondContact O-CA 3.47Å; G661-K664 WeakPolarHBondContact O-CB 3.39Å; G661-K664 PolarHBondContact O-N 3.35Å; G661-D665 PolarHBondContact O-N 2.89Å
662	M	37.6	Very low	40.5	Very low	92 Å²	92	109.9 Å²	109.9	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-62.7	-37.9	-178.7	-160.3	-179.8	84.4	0	0	113.4	Y658 K664 I666	Y658-M662 PolarHBondContact O-N 3.03Å; M662-K664 VanDerWaalsContact C-N 3.27Å; M662-K664 PolarHBondContact O-N 3.38Å; M662-I666 HydrophobicContact CE-CD1 4.49Å; M662-I666 HydrophobicContact CG-CD1 4.36Å; M662-I666 WeakPolarHBondContact O-CD1 3.42Å; M662-I666 WeakPolarHBondContact O-CG1 3.3Å; M662-I666 PolarHBondContact O-N 3.34Å; M662-I666 VanDerWaalsContact O-N 3.15Å
663	M	38.9	Very low	40.9	Very low	137 Å²	137	108.6 Å²	108.6	68%	0.675	54%	0.54	S	S	*	.	H	α-helix	trans	-67.1	-28.3	172.8	-97.5	174.1	171.7	0	0	113	R659 G661 S667	R659-M663 PolarHBondContact O-N 3.11Å; G661-M663 PolarHBondContact O-N 3.01Å; M663-S667 PolarHBondContact O-N 3.11Å; M663-S667 PolarHBondContact O-OG 2.93Å
664	K	39.5	Very low	41.2	Very low	140 Å²	140	105.8 Å²	105.8	61%	0.609	53%	0.53	S	S	*	.	H	α-helix	trans	-79.1	-33.4	180	-155.9	177.1	-176	-177.4	0	111.8	G661 M662 S667 N668	G661-K664 WeakPolarHBondContact O-CA 3.47Å; G661-K664 WeakPolarHBondContact O-CB 3.39Å; G661-K664 PolarHBondContact O-N 3.35Å; M662-K664 VanDerWaalsContact C-N 3.27Å; M662-K664 PolarHBondContact O-N 3.38Å; K664-S667 WeakPolarHBondContact CA-OG 3.49Å; K664-S667 PolarHBondContact O-OG 3.38Å; K664-N668 WeakPolarHBondContact O-CB 3.35Å; K664-N668 PolarHBondContact O-N 3.4Å; K664-N668 VanDerWaalsContact O-N 3.12Å; K664-N668 PolarHBondContact O-ND2 3.24Å; K664-N668 VanDerWaalsContact O-ND2 3.16Å; K664-N668 PolarHBondContact O-OD1 2.7Å
665	D	42.2	Very low	41.3	Very low	88 Å²	88	108.2 Å²	108.2	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-74.2	-34.2	174.4	-68.3	-27	0	0	0	112.2	G661 N668 L669	G661-D665 PolarHBondContact O-N 2.89Å; D665-N668 PolarHBondContact O-N 3.13Å; D665-L669 WeakPolarHBondContact O-CB 3.35Å; D665-L669 WeakPolarHBondContact O-CG 3.29Å; D665-L669 PolarHBondContact O-N 2.71Å
666	I	46.9	Very low	41.6	Very low	83 Å²	83	116 Å²	116	43%	0.426	56%	0.562	S	S	.	*	H	α-helix	trans	-63.9	-44.8	173.6	-68.7	163.3	0	0	0	110.6	M662 N668 L669 E670	M662-I666 HydrophobicContact CE-CD1 4.49Å; M662-I666 HydrophobicContact CG-CD1 4.36Å; M662-I666 WeakPolarHBondContact O-CD1 3.42Å; M662-I666 WeakPolarHBondContact O-CG1 3.3Å; M662-I666 PolarHBondContact O-N 3.34Å; M662-I666 VanDerWaalsContact O-N 3.15Å; I666-N668 VanDerWaalsContact C-N 3.33Å; I666-N668 PolarHBondContact O-N 2.91Å; I666-L669 PolarHBondContact O-N 2.76Å; I666-E670 PolarHBondContact O-N 2.92Å; I666-E670 VanDerWaalsContact O-N 3.08Å
667	S	41.9	Very low	41.5	Very low	49 Å²	49	119.8 Å²	119.8	34%	0.343	57%	0.57	S	S	.	*	H	α-helix	trans	-64.5	-37.3	175.8	56.5	0	0	0	0	112.5	M663 K664 E671	M663-S667 PolarHBondContact O-N 3.11Å; M663-S667 PolarHBondContact O-OG 2.93Å; K664-S667 WeakPolarHBondContact CA-OG 3.49Å; K664-S667 PolarHBondContact O-OG 3.38Å; S667-E671 WeakPolarHBondContact O-CB 3.42Å; S667-E671 WeakPolarHBondContact O-CG 3.47Å; S667-E671 PolarHBondContact O-N 2.98Å; S667-E671 VanDerWaalsContact O-N 3.08Å
668	N	42.6	Very low	42.1	Very low	69 Å²	69	122 Å²	122	37%	0.369	57%	0.573	S	S	.	*	H	α-helix	trans	-71.7	-33.3	179.1	-70.3	-16.8	0	0	0	112.7	K664 D665 I666 Q672	K664-N668 WeakPolarHBondContact O-CB 3.35Å; K664-N668 PolarHBondContact O-N 3.4Å; K664-N668 VanDerWaalsContact O-N 3.12Å; K664-N668 PolarHBondContact O-ND2 3.24Å; K664-N668 VanDerWaalsContact O-ND2 3.16Å; K664-N668 PolarHBondContact O-OD1 2.7Å; D665-N668 PolarHBondContact O-N 3.13Å; I666-N668 VanDerWaalsContact C-N 3.33Å; I666-N668 PolarHBondContact O-N 2.91Å; N668-Q672 WeakPolarHBondContact O-CB 3.17Å; N668-Q672 WeakPolarHBondContact O-CG 3.34Å; N668-Q672 PolarHBondContact O-N 2.91Å
669	L	47.7	Very low	41.9	Very low	79 Å²	79	122.3 Å²	122.3	41%	0.414	58%	0.584	S	S	.	*	H	α-helix	trans	-72.9	-39.3	176.6	-83.1	159.2	0	0	0	111.8	D665 I666 Q672 D673	D665-L669 WeakPolarHBondContact O-CB 3.35Å; D665-L669 WeakPolarHBondContact O-CG 3.29Å; D665-L669 PolarHBondContact O-N 2.71Å; I666-L669 PolarHBondContact O-N 2.76Å; L669-Q672 PolarHBondContact O-N 3.31Å; L669-D673 PolarHBondContact O-N 3.12Å
670	E	50.3	Low	41.8	Very low	134 Å²	134	116.8 Å²	116.8	63%	0.626	58%	0.583	S	S	*	*	H	α-helix	trans	-64.4	-41.1	173.2	-75.8	178	157.5	0	0	111.6	I666 Q672 D673 E674	I666-E670 PolarHBondContact O-N 2.92Å; I666-E670 VanDerWaalsContact O-N 3.08Å; E670-Q672 PolarHBondContact O-N 2.96Å; E670-D673 PolarHBondContact O-N 2.74Å; E670-E674 PolarHBondContact O-N 3.46Å; E670-E674 VanDerWaalsContact O-N 3.09Å
671	E	47.8	Very low	41.7	Very low	119 Å²	119	118.2 Å²	118.2	56%	0.556	59%	0.59	S	S	*	*	H	α-helix	trans	-65.7	-35.6	174.8	-78	-178.6	175.8	0	0	112.9	S667 Q675	S667-E671 WeakPolarHBondContact O-CB 3.42Å; S667-E671 WeakPolarHBondContact O-CG 3.47Å; S667-E671 PolarHBondContact O-N 2.98Å; S667-E671 VanDerWaalsContact O-N 3.08Å; E671-Q675 WeakPolarHBondContact O-CB 3.45Å; E671-Q675 WeakPolarHBondContact O-CG 3.47Å; E671-Q675 PolarHBondContact O-N 2.98Å; E671-Q675 VanDerWaalsContact O-N 3.11Å
672	Q	45.9	Very low	41.2	Very low	113 Å²	113	123.9 Å²	123.9	53%	0.528	61%	0.613	S	S	.	*	H	α-helix	trans	-73	-35.1	177.2	-80.7	-175.1	-7.6	0	0	113.2	N668 L669 E670 R676	N668-Q672 WeakPolarHBondContact O-CB 3.17Å; N668-Q672 WeakPolarHBondContact O-CG 3.34Å; N668-Q672 PolarHBondContact O-N 2.91Å; L669-Q672 PolarHBondContact O-N 3.31Å; E670-Q672 PolarHBondContact O-N 2.96Å; Q672-R676 WeakPolarHBondContact O-CB 3.47Å; Q672-R676 PolarHBondContact O-N 3.18Å
673	D	45	Very low	40.9	Very low	109 Å²	109	125.6 Å²	125.6	58%	0.583	63%	0.63	S	S	*	*	H	α-helix	trans	-71.5	-37.3	175.8	-87.8	-17.2	0	0	0	111.6	L669 E670 R676 F677	L669-D673 PolarHBondContact O-N 3.12Å; E670-D673 PolarHBondContact O-N 2.74Å; D673-R676 PolarHBondContact O-N 3.19Å; D673-F677 WeakPolarHBondContact O-CB 3.47Å; D673-F677 PolarHBondContact O-N 3.31Å; D673-F677 VanDerWaalsContact O-N 3.08Å
674	E	45.6	Very low	40.4	Very low	140 Å²	140	124.2 Å²	124.2	65%	0.654	64%	0.635	S	S	*	*	H	α-helix	trans	-65.4	-41.3	172.1	-78.8	-168	155.1	0	0	112.3	E670 F677 I678	E670-E674 PolarHBondContact O-N 3.46Å; E670-E674 VanDerWaalsContact O-N 3.09Å; E674-F677 PolarHBondContact O-N 3.19Å; E674-I678 WeakPolarHBondContact O-CG1 3.43Å; E674-I678 PolarHBondContact O-N 3.05Å; E674-I678 VanDerWaalsContact O-N 3.14Å
675	Q	42.6	Very low	39.9	Very low	137 Å²	137	126.8 Å²	126.8	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-67.5	-35.3	177.1	-76.6	-178.9	-4	0	0	112.9	E671 F677 L679	E671-Q675 WeakPolarHBondContact O-CB 3.45Å; E671-Q675 WeakPolarHBondContact O-CG 3.47Å; E671-Q675 PolarHBondContact O-N 2.98Å; E671-Q675 VanDerWaalsContact O-N 3.11Å; Q675-F677 VanDerWaalsContact C-N 3.35Å; Q675-L679 PolarHBondContact O-N 2.84Å
676	R	42.1	Very low	39.2	Very low	206 Å²	206	127.2 Å²	127.2	78%	0.777	66%	0.664	S	S	*	*	H	α-helix	trans	-69.7	-30.2	173.8	-89.2	-175.9	171.6	176.5	0	113.1	Q672 D673	Q672-R676 WeakPolarHBondContact O-CB 3.47Å; Q672-R676 PolarHBondContact O-N 3.18Å; D673-R676 PolarHBondContact O-N 3.19Å
677	F	36.7	Very low	38.3	Very low	188 Å²	188	129.1 Å²	129.1	83%	0.825	68%	0.682	S	S	*	*	H	α-helix	trans	-78	-29	179	-146	-95	0	0	0	112.7	D673 E674 Q675	D673-F677 WeakPolarHBondContact O-CB 3.47Å; D673-F677 PolarHBondContact O-N 3.31Å; D673-F677 VanDerWaalsContact O-N 3.08Å; E674-F677 PolarHBondContact O-N 3.19Å; Q675-F677 VanDerWaalsContact C-N 3.35Å
678	I	43.2	Very low	37.6	Very low	142 Å²	142	132.4 Å²	132.4	73%	0.728	71%	0.705	S	S	*	*	H	α-helix	trans	-80	-26	178	-64.3	169.4	0	0	0	112.2	E674 G680	E674-I678 WeakPolarHBondContact O-CG1 3.43Å; E674-I678 PolarHBondContact O-N 3.05Å; E674-I678 VanDerWaalsContact O-N 3.14Å; I678-G680 PolarHBondContact O-N 3.23Å
679	L	37.6	Very low	36.9	Very low	154 Å²	154	135.2 Å²	135.2	81%	0.806	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	32.6	-176.9	-121.5	100.9	0	0	0	115.1	Q675 K681	Q675-L679 PolarHBondContact O-N 2.84Å; L679-K681 PolarHBondContact O-N 3.46Å
680	G	31.9	Very low	35.9	Very low	66 Å²	66	140 Å²	140	68%	0.68	75%	0.749	S	S	*	*			trans	-91.3	74.8	174.1	0	0	0	0	0	113.8	I678	I678-G680 PolarHBondContact O-N 3.23Å
681	K	30.3	Very low	34.9	Very low	205 Å²	205	139.1 Å²	139.1	89%	0.891	76%	0.755	S	S	*	*	S	Bend	trans	-152.5	134.1	159	-125.6	175.8	-176.8	176	0	111.9	L679	L679-K681 PolarHBondContact O-N 3.46Å
682	N	28.9	Very low	33.8	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	77%	0.771	S	S	*	*			trans	-39.9	143.5	-168.9	-64.3	-15.2	0	0	0	116.9
683	P	31.2	Very low	32.9	Very low	127 Å²	127	142.1 Å²	142.1	83%	0.825	79%	0.787	S	S	*	*			trans	-87.2	123.6	174.1	33.1	-28.4	0	0	0	111.3
684	S	28.5	Very low	32	Very low	109 Å²	109	148.3 Å²	148.3	76%	0.762	80%	0.803	S	S	*	*			trans	-150.5	118.5	157.2	-43.1	0	0	0	0	111.1
685	E	29.3	Very low	31	Very low	193 Å²	193	146.5 Å²	146.5	90%	0.902	81%	0.812	S	S	*	*			trans	71.3	124.9	155.4	-68.8	-177	145.7	0	0	122.5
686	A	27	Very low	30.3	Very low	97 Å²	97	151 Å²	151	80%	0.802	82%	0.824	S	S	*	*			trans	88.6	155.8	157.7	0	0	0	0	0	118.5
687	P	28.6	Very low	29.6	Very low	123 Å²	123	150 Å²	150	80%	0.799	83%	0.833	S	S	*	*				-123	164.2	-68.7	32.5	-17.4	0	0	0	112
688	S	27.5	Very low	29	Very low	119 Å²	119	144.2 Å²	144.2	83%	0.832	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-56.8	138.3	-177.8	-55.1	0	0	0	0	114.5
689	P	27.5	Very low	28.4	Very low	127 Å²	127	144 Å²	144	83%	0.825	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92.6	122.9	158.6	27.7	-16.2	0	0	0	110.5
690	M	26.7	Very low	27.8	Very low	179 Å²	179	140.6 Å²	140.6	88%	0.882	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-63.1	153.6	166.1	-84.6	-107.6	-77.2	0	0	111.7
691	P	28.4	Very low	27.5	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-76.3	139.8	-174.9	30	-33.6	0	0	0	113.1	H693	P691-H693 PolarHBondContact O-N 3.45Å
692	A	25.7	Very low	27.3	Very low	106 Å²	106	136.9 Å²	136.9	88%	0.876	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-71.2	123.3	178.2	0	0	0	0	0	112.4
693	H	25.9	Very low	27.2	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.875	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-67	136.1	169.1	-105.9	-89.4	0	0	0	111.6	P691	P691-H693 PolarHBondContact O-N 3.45Å
694	R	27	Very low	27	Very low	240 Å²	240	138 Å²	138	91%	0.906	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-64.9	130.5	165.4	-97.6	178.4	175.2	167.2	-0.9	110.4
695	A	25.2	Very low	26.9	Very low	102 Å²	102	140.7 Å²	140.7	84%	0.843	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71.2	129	175.4	0	0	0	0	0	112.3
696	Y	26.6	Very low	26.8	Very low	232 Å²	232	136.9 Å²	136.9	91%	0.91	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-100.5	130	156.4	-104.3	-91.8	0	0	0	107.9
697	L	27.4	Very low	26.7	Very low	183 Å²	183	138.9 Å²	138.9	96%	0.958	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.6	176.2	-80.6	148.2	0	0	0	111.1
698	G	24.6	Very low	26.6	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	80%	0.804	S	S	*	*			trans	-151.2	140.3	164.6	0	0	0	0	0	109.4
699	P	30.4	Very low	26.6	Very low	137 Å²	137	138.4 Å²	138.4	89%	0.89	80%	0.796	S	S	*	*			trans	-97.5	148.2	-163.8	36.2	-31.7	0	0	0	114.1
700	G	24.8	Very low	26.5	Very low	82 Å²	82	142.7 Å²	142.7	85%	0.845	80%	0.798	S	S	*	*			trans	109	131.9	142.1	0	0	0	0	0	118.7
701	G	26.4	Very low	26.5	Very low	67 Å²	67	137 Å²	137	69%	0.691	79%	0.785	S	S	*	*			trans	100.7	95.3	154.3	0	0	0	0	0	115.7
702	T	26.9	Very low	26.3	Very low	126 Å²	126	138.3 Å²	138.3	77%	0.773	79%	0.791	S	S	*	*				83.8	118.6	91.3	42.8	0	0	0	0	116.3
703	Q	26.4	Very low	26.3	Very low	157 Å²	157	138 Å²	138	73%	0.734	78%	0.782	S	S	*	*			trans	66.9	148.4	146.5	-69	174.6	-59	0	0	118
704	E	26.8	Very low	26.4	Very low	145 Å²	145	134.4 Å²	134.4	68%	0.678	77%	0.773	S	S	*	*			cis	-163.8	136.9	3.9	-113.9	161.6	-166.1	0	0	105.8
705	M	26	Very low	26.4	Very low	166 Å²	166	131.5 Å²	131.5	82%	0.818	77%	0.768	S	S	*	*				40.8	124.5	108.8	-95.6	-173.6	-98.6	0	0	114.8
706	T	26.3	Very low	26.6	Very low	114 Å²	114	133.1 Å²	133.1	70%	0.699	77%	0.767	S	S	*	*				176.9	148.2	56.6	3.2	0	0	0	0	110.8
707	N	26	Very low	26.6	Very low	138 Å²	138	125 Å²	125	74%	0.738	75%	0.754	S	S	*	*				39.4	142	127.1	-75.9	-4.4	0	0	0	119.8
708	T	26.1	Very low	26.7	Very low	109 Å²	109	126.3 Å²	126.3	67%	0.669	75%	0.747	S	S	*	*			cis	177.2	135.7	34.3	0.4	0	0	0	0	107.1
709	N	26.7	Very low	26.9	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	75%	0.752	S	S	*	*				83.3	144.2	104.2	-97.4	-3.8	0	0	0	120.9
710	Y	26.6	Very low	26.9	Very low	217 Å²	217	132 Å²	132	85%	0.851	75%	0.748	S	S	*	*			trans	67.9	140.7	160.8	-66.2	-71.7	0	0	0	117.9
711	G	25.7	Very low	27.2	Very low	59 Å²	59	136.6 Å²	136.6	61%	0.608	75%	0.752	S	S	*	*			cis	159.3	139.9	4.5	0	0	0	0	0	109.7
712	T	25.7	Very low	27.3	Very low	143 Å²	143	136.6 Å²	136.6	88%	0.877	75%	0.752	S	S	*	*			trans	59.2	118	145.7	37.7	0	0	0	0	123.7
713	S	25.7	Very low	27.5	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	75%	0.754	S	S	*	*				102.9	127	113	-159.7	0	0	0	0	122.5
714	T	27	Very low	28.7	Very low	114 Å²	114	133.4 Å²	133.4	70%	0.699	75%	0.75	S	S	*	*			trans	86.5	115.2	135.6	34	0	0	0	0	124.7
715	K	28	Very low	29.3	Very low	180 Å²	180	135.4 Å²	135.4	78%	0.783	76%	0.759	S	S	*	*				85.4	134.7	119.7	-91.5	-179.4	177.3	-179	0	123.9
716	T	28.5	Very low	29.9	Very low	135 Å²	135	133 Å²	133	83%	0.828	76%	0.759	S	S	*	*			trans	69.9	140.9	143.9	49.3	0	0	0	0	119
717	G	27.3	Very low	30.8	Very low	61 Å²	61	136.5 Å²	136.5	63%	0.629	77%	0.768	S	S	*	*			cis	165.8	171.5	2.5	0	0	0	0	0	110.3
718	Y	29.2	Very low	31.5	Very low	212 Å²	212	141.7 Å²	141.7	83%	0.831	79%	0.794	S	S	*	*			trans	74.6	146	163.9	-69.5	-81.3	0	0	0	119
719	Q	29.1	Very low	31.7	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	80%	0.8	S	S	*	*			cis	-166.4	165.7	-3.9	-144.7	165.3	2.8	0	0	110.6
720	N	30.3	Very low	32	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	81%	0.808	S	S	*	*			trans	-68.9	170.7	-174.7	-79.3	-21.3	0	0	0	118.7
721	I	31.4	Very low	32.3	Very low	179 Å²	179	140.3 Å²	140.3	92%	0.918	81%	0.805	S	S	*	*			trans	147	136.1	132.5	-72.7	156.4	0	0	0	108.3
722	G	27.6	Very low	32.7	Very low	68 Å²	68	145.1 Å²	145.1	70%	0.701	82%	0.817	S	S	*	*			cis	-176.3	169.8	7.5	0	0	0	0	0	110.1
723	S	30.9	Very low	33.1	Very low	115 Å²	115	145.3 Å²	145.3	80%	0.804	81%	0.813	S	S	*	*			trans	-76.6	-171.5	-179.3	65.2	0	0	0	0	112.5
724	P	51	Low	33.6	Very low	101 Å²	101	148.3 Å²	148.3	66%	0.656	82%	0.821	S	S	*	*			cis	-137.8	153.5	41	35.8	-12.4	0	0	0	116.5
725	E	39.7	Very low	34.1	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	83%	0.83	S	S	*	*				65.1	145.2	110.1	-60.2	-179.4	149.1	0	0	115.6
726	S	38.4	Very low	34.6	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	83%	0.833	S	S	*	*			cis	-161.6	165.1	31	52.3	0	0	0	0	112.7
727	E	45.1	Very low	35.1	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.874	83%	0.834	S	S	*	*			trans	-57.9	145.4	-178.6	-56.5	174.1	142.5	0	0	117.2
728	L	40.8	Very low	35.8	Very low	247 Å²	247	157.7 Å²	157.7	100%	1.293	85%	0.852	S	S	*	*				-163.3	0	113.2	-125.1	146.1	0	0	0	110.8

Retrieved 728 of 728 residues in 1902.3 ms (Link to these results)

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