A0A087XZK9_POEFO Loading...

Cullin-4A

AlphaFold DB , UniProt , Accession A0A087XZK9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 770 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	K	32.3	Very low	29.7	Very low	268 Å²	268	158.9 Å²	158.9	100%	1.165	85%	0.849	S	S	*	*				0	125.6	0	-88.5	178.7	172.5	177.7	0	107.3
2	N	32.7	Very low	29.4	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	85%	0.846	S	S	*	*			trans	-30.9	147.8	-178.7	-61.7	-15.7	0	0	0	114.8
3	T	30.7	Very low	29.3	Very low	122 Å²	122	150.8 Å²	150.8	75%	0.748	84%	0.843	S	S	*	*				-163.6	136.7	55.8	-36.3	0	0	0	0	113.1
4	L	31.5	Very low	29.1	Very low	156 Å²	156	152.1 Å²	152.1	82%	0.817	85%	0.847	S	S	*	*			trans	20.1	119.4	154.4	-67	152.5	0	0	0	122
5	K	30.8	Very low	28.8	Very low	201 Å²	201	153.2 Å²	153.2	87%	0.874	85%	0.849	S	S	*	*			trans	-124.3	126.4	156.4	-87.1	-175.6	175.1	-179	0	109.7
6	H	30.1	Very low	28.7	Very low	191 Å²	191	154.3 Å²	154.3	88%	0.884	85%	0.851	S	S	*	*			trans	-85.4	130.9	166.6	-97.7	-84.7	0	0	0	109.5
7	T	30	Very low	28.7	Very low	121 Å²	121	156.1 Å²	156.1	74%	0.742	85%	0.854	S	S	*	*			trans	-128.4	115.9	171	-43.4	0	0	0	0	108.2
8	A	27	Very low	28.4	Very low	102 Å²	102	153.1 Å²	153.1	84%	0.843	85%	0.853	S	S	*	*			trans	-90.4	131.1	168.7	0	0	0	0	0	108.6
9	V	29.2	Very low	28.3	Very low	133 Å²	133	155.3 Å²	155.3	81%	0.806	86%	0.856	S	S	*	*			trans	-104.1	122.7	178.5	170.6	0	0	0	0	108.7
10	S	25.7	Very low	28.2	Very low	101 Å²	101	155.8 Å²	155.8	71%	0.706	86%	0.858	S	S	*	*			trans	-69.3	133.6	172.4	50.5	0	0	0	0	112.1
11	Q	26.8	Very low	28	Very low	198 Å²	198	154.5 Å²	154.5	93%	0.925	86%	0.855	S	S	*	*			trans	-105.4	113.7	161.9	-96.2	-178.9	-17	0	0	109.7
12	S	25.9	Very low	28	Very low	116 Å²	116	153.1 Å²	153.1	81%	0.811	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-88.7	124	168.4	-49.8	0	0	0	0	108.6
13	A	28.4	Very low	27.6	Very low	97 Å²	97	155.1 Å²	155.1	80%	0.802	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-103.4	128.3	173.6	0	0	0	0	0	110.1
14	N	26.9	Very low	27.8	Very low	168 Å²	168	156.7 Å²	156.7	90%	0.898	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-73.6	135.2	177.1	-86.1	-25	0	0	0	111.8
15	L	24.3	Very low	27.5	Very low	169 Å²	169	159.2 Å²	159.2	89%	0.885	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-78.3	132.7	161.9	-89.6	93.4	0	0	0	110.6
16	I	26.6	Very low	27.3	Very low	170 Å²	170	161.8 Å²	161.8	87%	0.872	86%	0.859	S	S	*	*			trans	-133.9	137	145.4	-63.3	-176	0	0	0	108.1
17	M	29.1	Very low	27.1	Very low	186 Å²	186	157.4 Å²	157.4	92%	0.916	86%	0.856	S	S	*	*			trans	-57.9	147.5	-171.2	-57.1	-131.1	-135	0	0	115.9
18	A	24.2	Very low	26.9	Very low	101 Å²	101	156.5 Å²	156.5	84%	0.835	86%	0.855	S	S	*	*			trans	-158.2	135.2	143.3	0	0	0	0	0	110.8
19	E	25.2	Very low	26.8	Very low	195 Å²	195	161.1 Å²	161.1	91%	0.911	86%	0.856	S	S	*	*			trans	-61.2	144.2	179.8	-67.6	164.8	130.3	0	0	113.1
20	D	26.1	Very low	26.7	Very low	165 Å²	165	160 Å²	160	88%	0.882	85%	0.854	S	S	*	*			trans	-108.4	117.2	176	-158.2	0.5	0	0	0	110.2
21	T	25.6	Very low	26.7	Very low	130 Å²	130	159.4 Å²	159.4	80%	0.798	86%	0.855	S	S	*	*			trans	-121.8	122.7	170.8	-29.3	0	0	0	0	108.3
22	R	30.5	Very low	26.8	Very low	239 Å²	239	157.8 Å²	157.8	90%	0.902	85%	0.852	S	S	*	*			trans	-56	138.9	178.5	-69.3	174	172.7	178.3	-3.5	113
23	Q	26.1	Very low	27	Very low	196 Å²	196	158.4 Å²	158.4	92%	0.916	85%	0.851	S	S	*	*			trans	-161.8	140	139.7	-116.3	172.3	14.3	0	0	113.8
24	D	33.7	Very low	26.9	Very low	155 Å²	155	162.6 Å²	162.6	83%	0.829	85%	0.854	S	S	*	*			trans	-45.9	146	173.7	-72.9	-60.7	0	0	0	114.9
25	K	25.2	Very low	27	Very low	210 Å²	210	163.6 Å²	163.6	91%	0.913	85%	0.853	S	S	*	*			trans	-162.7	124.1	144.5	-109	159.7	-169.4	179.3	0	113.2
26	R	27.9	Very low	27.2	Very low	254 Å²	254	160.2 Å²	160.2	96%	0.958	84%	0.843	S	S	*	*			trans	-55	141.9	159.3	-79.3	173.7	165.7	169.8	-4.8	110.4
27	A	24.2	Very low	27.4	Very low	99 Å²	99	157.8 Å²	157.8	82%	0.818	84%	0.836	S	S	*	*			trans	-113.3	126.3	165.7	0	0	0	0	0	110.7
28	S	26.2	Very low	27.4	Very low	103 Å²	103	156.9 Å²	156.9	72%	0.72	84%	0.836	S	S	*	*			trans	-88.3	145.1	160.1	174.9	0	0	0	0	108
29	F	25.4	Very low	27.8	Very low	199 Å²	199	155.6 Å²	155.6	87%	0.873	83%	0.832	S	S	*	*			trans	-150	118.1	153.2	-111.6	-80	0	0	0	111.3
30	S	26.7	Very low	27.9	Very low	110 Å²	110	155.8 Å²	155.8	77%	0.769	84%	0.835	S	S	*	*			trans	-107.6	137.3	154.3	-59.4	0	0	0	0	107.1
31	A	26.9	Very low	28.2	Very low	87 Å²	87	152.1 Å²	152.1	72%	0.719	83%	0.827	S	S	*	*			trans	-161	134.1	155.6	0	0	0	0	0	109.8
32	L	28.6	Very low	28.8	Very low	164 Å²	164	157.1 Å²	157.1	86%	0.859	83%	0.832	S	S	*	*			trans	169.6	124.9	153.8	-88.5	173	0	0	0	104
33	T	29.4	Very low	28.8	Very low	129 Å²	129	152.7 Å²	152.7	79%	0.791	83%	0.832	S	S	*	*			cis	-172	147.5	2.4	6.6	0	0	0	0	105.9
34	E	26.6	Very low	29.6	Very low	186 Å²	186	149.4 Å²	149.4	87%	0.869	83%	0.83	S	S	*	*			trans	-90.1	147.4	171.5	-74.9	-176.1	151.7	0	0	112.2
35	H	28.8	Very low	29.6	Very low	188 Å²	188	145.7 Å²	145.7	87%	0.87	83%	0.829	S	S	*	*			trans	-152.1	118.3	143.9	-104.8	-58.4	0	0	0	112.6
36	S	28.5	Very low	30.4	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	83%	0.827	S	S	*	*			trans	29.8	123.6	147.9	-71	0	0	0	0	125.9
37	T	30.7	Very low	31.4	Very low	119 Å²	119	139.8 Å²	139.8	73%	0.73	82%	0.822	S	S	*	*				62.3	113.7	128.2	63.2	0	0	0	0	122.1
38	N	29.1	Very low	32.3	Very low	168 Å²	168	139 Å²	139	90%	0.898	82%	0.823	S	S	*	*				-177.2	144.9	94.6	-107.7	-12.4	0	0	0	111
39	G	31.8	Very low	33.7	Very low	73 Å²	73	138.8 Å²	138.8	75%	0.753	83%	0.828	S	S	*	*			trans	-85.9	170.2	-161.9	0	0	0	0	0	117.2
40	M	28.8	Very low	34.9	Very low	200 Å²	200	134.8 Å²	134.8	99%	0.985	82%	0.824	S	S	*	*			trans	-165.6	149.8	132.1	-138.8	124.8	88.1	0	0	110.4
41	A	31.9	Very low	36.6	Very low	87 Å²	87	139.2 Å²	139.2	72%	0.719	83%	0.83	S	S	*	*			trans	-75.6	150.6	-171.3	0	0	0	0	0	114.9
42	R	37.9	Very low	38.6	Very low	236 Å²	236	144.6 Å²	144.6	89%	0.891	84%	0.837	S	S	*	*			trans	41.8	121.2	149	-77.3	-179.6	158.4	-179.1	-5.3	119
43	T	30.8	Very low	40.9	Very low	146 Å²	146	145 Å²	145	90%	0.896	84%	0.839	S	S	*	*				-160.6	141.7	114.7	36	0	0	0	0	111.2
44	S	43.4	Very low	42.9	Very low	126 Å²	126	145 Å²	145	88%	0.881	84%	0.839	S	S	*	*			trans	-72.6	135.4	176.5	52.5	0	0	0	0	112.4
45	G	32.1	Very low	45.2	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	83%	0.828	S	S	*	*			trans	-157.7	131.4	172.5	0	0	0	0	0	113.4
46	K	42.8	Very low	46.8	Very low	200 Å²	200	142.2 Å²	142.2	87%	0.87	83%	0.826	S	S	*	*			trans	-57	148.1	-170.8	-71.9	166.5	171.2	175	0	117.4
47	T	49.8	Very low	48.4	Very low	140 Å²	140	145.2 Å²	145.2	86%	0.859	83%	0.834	S	S	*	*			trans	17.6	111.4	146.6	56	0	0	0	0	118.7
48	G	41.8	Very low	49.8	Very low	82 Å²	82	145.5 Å²	145.5	85%	0.845	83%	0.826	S	S	*	*			trans	-103.5	110.3	168	0	0	0	0	0	112.5
49	A	55	Low	51.1	Low	99 Å²	99	147.1 Å²	147.1	82%	0.818	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-68.3	136.5	162.4	0	0	0	0	0	109.8	K51	A49-K51 PolarHBondContact O-N 3.12Å
50	S	52.2	Low	52.6	Low	114 Å²	114	150.2 Å²	150.2	80%	0.797	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-59	117.2	177.6	53.8	0	0	0	0	111.3	K52	S50-K52 PolarHBondContact O-N 2.97Å
51	K	61.8	Low	54	Low	204 Å²	204	150.3 Å²	150.3	89%	0.887	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.6	174.5	-89.6	-179.9	174.5	175.4	0	110.4	A49	A49-K51 PolarHBondContact O-N 3.12Å
52	K	69.4	Low	55.3	Low	199 Å²	199	152 Å²	152	87%	0.865	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-75.8	127.1	167.5	-69.7	-177.2	179.1	179.4	0	109.5	S50	S50-K52 PolarHBondContact O-N 2.97Å
53	L	76.6	Confident	56.3	Low	173 Å²	173	150 Å²	150	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-90.7	136.2	173.5	-76.1	159.7	0	0	0	109.8
54	V	71.9	Confident	57.7	Low	129 Å²	129	146.5 Å²	146.5	78%	0.782	79%	0.79	S	S	*	*			trans	-113.2	120.2	174.6	179.2	0	0	0	0	108.2	K56	V54-K56 PolarHBondContact O-N 2.82Å
55	I	73.9	Confident	58.7	Low	127 Å²	127	144.1 Å²	144.1	65%	0.651	78%	0.778	S	S	*	*			trans	-74.5	114.4	177.3	-57.9	174.1	0	0	0	108	F58	I55-F58 HydrophobicContact CG2-CD2 4.41Å
56	K	63	Low	60.1	Low	189 Å²	189	149.2 Å²	149.2	82%	0.822	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	138.5	174.9	-71.7	-173.2	176.1	-177.4	0	110	V54	V54-K56 PolarHBondContact O-N 2.82Å
57	N	61	Low	61.4	Low	160 Å²	160	144.2 Å²	144.2	86%	0.856	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.1	33.6	-177.9	-57.3	-27.8	0	0	0	116.4	K59	N57-K59 VanDerWaalsContact C-N 3.34Å; N57-K59 PolarHBondContact O-N 2.95Å
58	F	59.7	Low	62.6	Low	126 Å²	126	141.2 Å²	141.2	55%	0.553	74%	0.737	S	S	*	*			trans	-73.2	85.9	170.5	-162.5	-98	0	0	0	110.7	I55 D60 R61	I55-F58 HydrophobicContact CG2-CD2 4.41Å; F58-D60 PolarHBondContact O-N 3.34Å; F58-D60 VanDerWaalsContact O-N 3.11Å; F58-R61 HydrophobicContact CE1-CG 3.79Å; F58-R61 HydrophobicContact CZ-CG 4.17Å
59	K	58	Low	64.1	Low	202 Å²	202	140 Å²	140	88%	0.878	71%	0.713	S	S	*	*			trans	-74.6	91.1	174.1	-74.8	-175.8	175.7	-178.3	0	109.8	N57	N57-K59 VanDerWaalsContact C-N 3.34Å; N57-K59 PolarHBondContact O-N 2.95Å
60	D	63.4	Low	65.3	Low	138 Å²	138	141.5 Å²	141.5	74%	0.738	70%	0.703	S	S	*	*			trans	52.8	146.2	174.9	-103.2	-34.2	0	0	0	117.2	F58	F58-D60 PolarHBondContact O-N 3.34Å; F58-D60 VanDerWaalsContact O-N 3.11Å
61	R	58.4	Low	66.6	Low	201 Å²	201	140.1 Å²	140.1	76%	0.758	69%	0.687	S	S	*	*			trans	-65.5	130.6	170.3	-70.2	-177.2	-177.2	-171.1	0.6	107.7	F58 K63	F58-R61 HydrophobicContact CE1-CG 3.79Å; F58-R61 HydrophobicContact CZ-CG 4.17Å; R61-K63 PolarHBondContact O-N 2.99Å
62	P	59	Low	67.6	Low	123 Å²	123	130.7 Å²	130.7	80%	0.799	65%	0.646	S	S	*	*			trans	-55.5	112.9	168.4	21.5	-29.8	0	0	0	107.8
63	K	58.7	Low	68.4	Low	193 Å²	193	122.9 Å²	122.9	84%	0.839	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-76.6	125.5	172.7	-71	-178.3	-179.3	177.9	0	106.7	R61	R61-K63 PolarHBondContact O-N 2.99Å
64	L	59.6	Low	68.8	Low	74 Å²	74	117.8 Å²	117.8	39%	0.387	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-55.1	148.5	167.8	-72.4	153.6	0	0	0	109.2	E66 Y68 Y106	L64-E66 PolarHBondContact O-N 3.47Å; L64-Y68 HydrophobicContact CD2-CD1 3.65Å; L64-Y68 HydrophobicContact CD2-CE1 3.98Å; L64-Y68 HydrophobicContact CD2-CG 3.94Å; L64-Y106 HydrophobicContact CD1-CD1 3.83Å; L64-Y106 HydrophobicContact CD1-CD2 4.07Å; L64-Y106 HydrophobicContact CD1-CE1 3.58Å; L64-Y106 HydrophobicContact CD1-CE2 3.85Å; L64-Y106 HydrophobicContact CD1-CG 4.09Å; L64-Y106 HydrophobicContact CD2-CE2 4.15Å; L64-Y106 HydrophobicContact CG-CE1 4.44Å
65	A	63.7	Low	69.5	Low	75 Å²	75	116.2 Å²	116.2	62%	0.62	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-56.6	137.1	166.4	0	0	0	0	0	108.9	N67 Y68	A65-N67 PolarHBondContact O-N 2.91Å; A65-Y68 WeakPolarHBondContact O-CB 2.98Å; A65-Y68 PolarHBondContact O-N 3.07Å
66	E	61.5	Low	70.1	Confident	185 Å²	185	110.2 Å²	110.2	86%	0.864	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.3	-176.2	-69.4	-177.7	164.9	0	0	112.6	L64	L64-E66 PolarHBondContact O-N 3.47Å
67	N	70.3	Confident	71.3	Confident	96 Å²	96	106.2 Å²	106.2	51%	0.513	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-2.5	-178.3	-59	-0.7	0	0	0	114.5	A65 T69 E70 D71	A65-N67 PolarHBondContact O-N 2.91Å; N67-T69 VanDerWaalsContact C-N 3.33Å; N67-T69 PolarHBondContact O-N 2.97Å; N67-E70 PolarHBondContact O-N 3.44Å; N67-D71 WeakPolarHBondContact O-CB 3.38Å; N67-D71 PolarHBondContact O-N 3.39Å
68	Y	75.3	Confident	72.5	Confident	77 Å²	77	102.4 Å²	102.4	30%	0.302	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-38.6	-172.8	179.4	-96.9	0	0	0	113	L64 A65 T72 Y106	L64-Y68 HydrophobicContact CD2-CD1 3.65Å; L64-Y68 HydrophobicContact CD2-CE1 3.98Å; L64-Y68 HydrophobicContact CD2-CG 3.94Å; A65-Y68 WeakPolarHBondContact O-CB 2.98Å; A65-Y68 PolarHBondContact O-N 3.07Å; Y68-T72 VanDerWaalsContact O-CB 3.23Å; Y68-T72 WeakPolarHBondContact O-CB 3.49Å; Y68-T72 PolarHBondContact O-N 2.96Å; Y68-T72 PolarHBondContact O-OG1 2.97Å; Y68-Y106 HydrophobicContact CE1-CE2 4.43Å
69	T	74.6	Confident	73.9	Confident	55 Å²	55	96.5 Å²	96.5	34%	0.337	47%	0.471	S	S	.	.	H	α-helix	trans	-68.6	-38.7	178.8	46.1	0	0	0	0	112.4	N67 W73 L103	N67-T69 VanDerWaalsContact C-N 3.33Å; N67-T69 PolarHBondContact O-N 2.97Å; T69-W73 WeakPolarHBondContact O-CB 3.26Å; T69-W73 PolarHBondContact O-N 2.99Å; T69-W73 VanDerWaalsContact O-N 3.07Å; T69-L103 HydrophobicContact CG2-CD2 4.14Å
70	E	78.8	Confident	75.4	Confident	132 Å²	132	87 Å²	87	62%	0.617	43%	0.429	S	S	*	.	H	α-helix	trans	-74.4	-45.1	-179.7	-65.3	-170.6	167	0	0	111.2	N67 T72 W73 L74	N67-E70 PolarHBondContact O-N 3.44Å; E70-T72 VanDerWaalsContact C-N 3.32Å; E70-T72 PolarHBondContact O-N 3.23Å; E70-W73 PolarHBondContact O-N 3.12Å; E70-L74 WeakPolarHBondContact O-CG 3.25Å; E70-L74 PolarHBondContact O-N 2.93Å
71	D	80.8	Confident	76.5	Confident	84 Å²	84	81.3 Å²	81.3	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-38.3	176.9	-74	-17.1	0	0	0	112.1	N67 L74 K75	N67-D71 WeakPolarHBondContact O-CB 3.38Å; N67-D71 PolarHBondContact O-N 3.39Å; D71-L74 PolarHBondContact O-N 3.49Å; D71-K75 WeakPolarHBondContact O-CG 3.43Å; D71-K75 PolarHBondContact O-N 2.83Å; D71-K75 VanDerWaalsContact O-N 3.09Å
72	T	82	Confident	77.9	Confident	6 Å²	6	72.3 Å²	72.3	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-71.9	-37	177.7	-53.1	0	0	0	0	111.3	Y68 E70 K75 L76 A99 L103	Y68-T72 VanDerWaalsContact O-CB 3.23Å; Y68-T72 WeakPolarHBondContact O-CB 3.49Å; Y68-T72 PolarHBondContact O-N 2.96Å; Y68-T72 PolarHBondContact O-OG1 2.97Å; E70-T72 VanDerWaalsContact C-N 3.32Å; E70-T72 PolarHBondContact O-N 3.23Å; T72-K75 PolarHBondContact O-N 3.17Å; T72-L76 WeakPolarHBondContact O-CG 3.37Å; T72-L76 PolarHBondContact O-N 3.01Å; T72-L76 VanDerWaalsContact O-N 3.08Å; T72-A99 HydrophobicContact CG2-CB 3.66Å; T72-L103 HydrophobicContact CG2-CD1 3.54Å; T72-L103 HydrophobicContact CG2-CD2 4.32Å; T72-L103 HydrophobicContact CG2-CG 3.87Å
73	W	85.6	Confident	79.3	Confident	35 Å²	35	66.9 Å²	66.9	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-64	-42.4	171.2	171.9	-114.1	0	0	0	112.2	T69 E70 K75 L76 R77 L112 Q115 V119	T69-W73 WeakPolarHBondContact O-CB 3.26Å; T69-W73 PolarHBondContact O-N 2.99Å; T69-W73 VanDerWaalsContact O-N 3.07Å; E70-W73 PolarHBondContact O-N 3.12Å; W73-K75 VanDerWaalsContact C-N 3.33Å; W73-K75 PolarHBondContact O-N 2.92Å; W73-L76 HydrophobicContact CE3-CB 4.38Å; W73-L76 PolarHBondContact O-N 2.95Å; W73-R77 HydrophobicContact CZ2-CB 4.16Å; W73-R77 HydrophobicContact CZ2-CG 4.38Å; W73-R77 WeakPolarHBondContact O-CB 3.42Å; W73-R77 PolarHBondContact O-N 3.31Å; W73-L112 HydrophobicContact CE3-CD1 3.43Å; W73-L112 VanDerWaalsContact CE3-CD1 3.43Å; W73-L112 HydrophobicContact CZ3-CD1 3.6Å; W73-Q115 HydrophobicContact CD2-CB 4.37Å; W73-Q115 HydrophobicContact CE3-CB 4.4Å; W73-Q115 VanDerWaalsContact CH2-C 3.49Å; W73-Q115 HydrophobicContact CH2-CB 3.48Å; W73-Q115 VanDerWaalsContact CH2-CB 3.48Å; W73-Q115 HydrophobicContact CZ2-CB 3.43Å; W73-Q115 VanDerWaalsContact CZ2-CB 3.43Å; W73-Q115 HydrophobicContact CZ2-CG 4.32Å; W73-Q115 HydrophobicContact CZ3-CB 3.97Å; W73-V119 HydrophobicContact CH2-CG2 4.17Å; W73-V119 HydrophobicContact CZ2-CG2 3.86Å
74	L	85.5	Confident	80.7	Confident	67 Å²	67	58.5 Å²	58.5	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-58.7	-44.2	176	-72.9	171.2	0	0	0	111.5	E70 D71 L76 R77 D78	E70-L74 WeakPolarHBondContact O-CG 3.25Å; E70-L74 PolarHBondContact O-N 2.93Å; D71-L74 PolarHBondContact O-N 3.49Å; L74-L76 PolarHBondContact O-N 2.86Å; L74-R77 VanDerWaalsContact CD2-CZ 3.46Å; L74-R77 VanDerWaalsContact CD2-NH2 3.28Å; L74-R77 PolarHBondContact O-N 3.39Å; L74-D78 WeakPolarHBondContact O-CB 3.47Å; L74-D78 PolarHBondContact O-N 3.27Å
75	K	85.8	Confident	82	Confident	96 Å²	96	60 Å²	60	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-58.9	-45.2	174.2	-70.9	172.5	-175.2	177.4	0	112.5	D71 T72 W73 A79 Y91	D71-K75 WeakPolarHBondContact O-CG 3.43Å; D71-K75 PolarHBondContact O-N 2.83Å; D71-K75 VanDerWaalsContact O-N 3.09Å; T72-K75 PolarHBondContact O-N 3.17Å; W73-K75 VanDerWaalsContact C-N 3.33Å; W73-K75 PolarHBondContact O-N 2.92Å; K75-A79 WeakPolarHBondContact O-CB 3.25Å; K75-A79 PolarHBondContact O-N 2.71Å; K75-Y91 HydrophobicContact CB-CE2 4.27Å; K75-Y91 HydrophobicContact CG-CE1 4.47Å; K75-Y91 HydrophobicContact CG-CE2 4.17Å
76	L	87.6	Confident	83.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-67.5	-41.7	178.6	-70.3	172.3	0	0	0	112.1	T72 W73 L74 A79 V80 L96 V100 L103 L112 I163 F164	T72-L76 WeakPolarHBondContact O-CG 3.37Å; T72-L76 PolarHBondContact O-N 3.01Å; T72-L76 VanDerWaalsContact O-N 3.08Å; W73-L76 HydrophobicContact CE3-CB 4.38Å; W73-L76 PolarHBondContact O-N 2.95Å; L74-L76 PolarHBondContact O-N 2.86Å; L76-A79 PolarHBondContact O-N 3.43Å; L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.07Å; L76-V80 PolarHBondContact O-N 3.32Å; L76-L96 HydrophobicContact CD2-CB 4.28Å; L76-L96 HydrophobicContact CD2-CD2 4.03Å; L76-V100 HydrophobicContact CD1-CG2 3.78Å; L76-V100 HydrophobicContact CD2-CG2 3.66Å; L76-V100 HydrophobicContact CG-CG2 4.41Å; L76-L103 HydrophobicContact CD1-CD1 3.75Å; L76-L112 HydrophobicContact CD1-CD1 4.25Å; L76-I163 HydrophobicContact CD2-CG2 4.22Å; L76-F164 HydrophobicContact CB-CZ 4.13Å; L76-F164 HydrophobicContact CD1-CE1 4.25Å; L76-F164 HydrophobicContact CD1-CZ 4.38Å; L76-F164 HydrophobicContact CD2-CZ 4.25Å; L76-F164 HydrophobicContact CG-CZ 4.49Å
77	R	88.4	Confident	84.3	Confident	105 Å²	105	55.9 Å²	55.9	40%	0.396	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-44.9	176.2	-174.8	-166.8	69	-179	0	111.4	W73 L74 A79 V80 G81 V119	W73-R77 HydrophobicContact CZ2-CB 4.16Å; W73-R77 HydrophobicContact CZ2-CG 4.38Å; W73-R77 WeakPolarHBondContact O-CB 3.42Å; W73-R77 PolarHBondContact O-N 3.31Å; L74-R77 VanDerWaalsContact CD2-CZ 3.46Å; L74-R77 VanDerWaalsContact CD2-NH2 3.28Å; L74-R77 PolarHBondContact O-N 3.39Å; R77-A79 VanDerWaalsContact C-N 3.31Å; R77-A79 PolarHBondContact O-N 2.62Å; R77-V80 PolarHBondContact O-N 2.74Å; R77-G81 PolarHBondContact O-N 2.99Å; R77-V119 HydrophobicContact CG-CG2 4.11Å
78	D	86.4	Confident	84.8	Confident	80 Å²	80	56.5 Å²	56.5	43%	0.428	31%	0.305	S	S	.	.	H	α-helix	trans	-66.2	-35.7	178.7	-70.5	1.6	0	0	0	111.1	L74 A82	L74-D78 WeakPolarHBondContact O-CB 3.47Å; L74-D78 PolarHBondContact O-N 3.27Å; D78-A82 WeakPolarHBondContact O-CB 3.39Å; D78-A82 PolarHBondContact O-N 3.47Å
79	A	88	Confident	85.1	Confident	2 Å²	2	55 Å²	55	2%	0.017	30%	0.301	C	S	.	.	H	α-helix	trans	-66.2	-44.6	172.5	0	0	0	0	0	112.4	K75 L76 R77 A82 I83 I89 L96	K75-A79 WeakPolarHBondContact O-CB 3.25Å; K75-A79 PolarHBondContact O-N 2.71Å; L76-A79 PolarHBondContact O-N 3.43Å; R77-A79 VanDerWaalsContact C-N 3.31Å; R77-A79 PolarHBondContact O-N 2.62Å; A79-A82 PolarHBondContact O-N 3.49Å; A79-I83 VanDerWaalsContact O-CG1 3.28Å; A79-I83 WeakPolarHBondContact O-CG1 3.42Å; A79-I83 PolarHBondContact O-N 2.95Å; A79-I89 HydrophobicContact CB-CG2 3.94Å; A79-L96 HydrophobicContact CB-CD1 3.63Å; A79-L96 HydrophobicContact CB-CD2 4.06Å
80	V	89.4	Confident	85.3	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-44.5	175	171.8	0	0	0	0	110.9	L76 R77 A82 I83 Q84 L116 V119 I160 F164	L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.07Å; L76-V80 PolarHBondContact O-N 3.32Å; R77-V80 PolarHBondContact O-N 2.74Å; V80-A82 VanDerWaalsContact C-N 3.31Å; V80-A82 PolarHBondContact O-N 3.33Å; V80-I83 PolarHBondContact O-N 3.31Å; V80-Q84 HydrophobicContact CG1-CG 4.38Å; V80-Q84 WeakPolarHBondContact O-CB 3.23Å; V80-Q84 VanDerWaalsContact O-CG 3.32Å; V80-Q84 WeakPolarHBondContact O-CG 3.48Å; V80-Q84 PolarHBondContact O-N 2.79Å; V80-L116 HydrophobicContact CG1-CD1 4.43Å; V80-L116 HydrophobicContact CG2-CD1 3.89Å; V80-V119 HydrophobicContact CG1-CG1 3.78Å; V80-I160 HydrophobicContact CG1-CD1 4.04Å; V80-I160 HydrophobicContact CG1-CG1 4.46Å; V80-I160 HydrophobicContact CG2-CG1 4.49Å; V80-F164 HydrophobicContact CG2-CE2 3.69Å; V80-F164 HydrophobicContact CG2-CZ 4.16Å
81	G	87.8	Confident	85.5	Confident	20 Å²	20	59.3 Å²	59.3	21%	0.206	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-33.5	175.8	0	0	0	0	0	113.1	R77 N85	R77-G81 PolarHBondContact O-N 2.99Å; G81-N85 WeakPolarHBondContact O-CB 3.36Å; G81-N85 PolarHBondContact O-N 3.5Å; G81-N85 VanDerWaalsContact O-N 3.11Å; G81-N85 PolarHBondContact O-ND2 3.24Å
82	A	87.1	Confident	85.8	Confident	12 Å²	12	59.9 Å²	59.9	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-45.9	173.4	0	0	0	0	0	111.6	D78 A79 V80 Q84 N85 S86 T87 I89	D78-A82 WeakPolarHBondContact O-CB 3.39Å; D78-A82 PolarHBondContact O-N 3.47Å; A79-A82 PolarHBondContact O-N 3.49Å; V80-A82 VanDerWaalsContact C-N 3.31Å; V80-A82 PolarHBondContact O-N 3.33Å; A82-Q84 PolarHBondContact O-N 3.41Å; A82-N85 PolarHBondContact O-N 3.29Å; A82-S86 PolarHBondContact O-N 3Å; A82-S86 VanDerWaalsContact O-N 3.11Å; A82-T87 VanDerWaalsContact CA-OG1 3.25Å; A82-T87 WeakPolarHBondContact CA-OG1 3.43Å; A82-T87 WeakPolarHBondContact CB-OG1 3.43Å; A82-T87 PolarHBondContact O-N 3.44Å; A82-T87 PolarHBondContact O-OG1 3.39Å; A82-I89 HydrophobicContact CB-CG1 4.4Å
83	I	89.2	Confident	85.9	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.046	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-48.3	176.9	-66.7	165.7	0	0	0	110.9	A79 V80 N85 S86 I89 Q156 M159 I160 I163	A79-I83 VanDerWaalsContact O-CG1 3.28Å; A79-I83 WeakPolarHBondContact O-CG1 3.42Å; A79-I83 PolarHBondContact O-N 2.95Å; V80-I83 PolarHBondContact O-N 3.31Å; I83-N85 VanDerWaalsContact C-N 3.33Å; I83-N85 PolarHBondContact O-N 2.89Å; I83-S86 PolarHBondContact O-N 3.31Å; I83-S86 VanDerWaalsContact O-N 3.09Å; I83-I89 HydrophobicContact CD1-CD1 3.85Å; I83-I89 HydrophobicContact CG1-CD1 3.65Å; I83-I89 HydrophobicContact CG1-CG1 4.05Å; I83-Q156 HydrophobicContact CG2-CB 3.87Å; I83-Q156 HydrophobicContact CG2-CG 3.97Å; I83-Q156 WeakPolarHBondContact O-CG 3.29Å; I83-Q156 PolarHBondContact O-NE2 3.37Å; I83-M159 HydrophobicContact CB-SD 4.48Å; I83-M159 HydrophobicContact CD1-CB 4.47Å; I83-M159 HydrophobicContact CD1-CG 3.89Å; I83-M159 HydrophobicContact CD1-SD 3.96Å; I83-M159 HydrophobicContact CG1-CG 4.3Å; I83-M159 HydrophobicContact CG1-SD 3.71Å; I83-M159 HydrophobicContact CG2-CB 4.17Å; I83-M159 HydrophobicContact CG2-CG 4.4Å; I83-M159 HydrophobicContact CG2-SD 4.03Å; I83-I160 HydrophobicContact CD1-CG1 4.31Å; I83-I160 HydrophobicContact CG2-CG1 4.29Å; I83-I163 HydrophobicContact CD1-CD1 3.47Å; I83-I163 VanDerWaalsContact CD1-CD1 3.47Å
84	Q	87.8	Confident	86	Confident	17 Å²	17	66.5 Å²	66.5	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-35.5	-178.4	-76	174	-18.4	0	0	113	V80 A82 S86 H123 Q156 I160	V80-Q84 HydrophobicContact CG1-CG 4.38Å; V80-Q84 WeakPolarHBondContact O-CB 3.23Å; V80-Q84 VanDerWaalsContact O-CG 3.32Å; V80-Q84 WeakPolarHBondContact O-CG 3.48Å; V80-Q84 PolarHBondContact O-N 2.79Å; A82-Q84 PolarHBondContact O-N 3.41Å; Q84-S86 VanDerWaalsContact C-N 3.28Å; Q84-S86 PolarHBondContact O-N 3.48Å; Q84-H123 PolarHBondContact O-CE1 3.02Å; Q84-Q156 PolarHBondContact O-NE2 2.98Å; Q84-I160 HydrophobicContact CG-CD1 4.43Å
85	N	86.3	Confident	86	Confident	105 Å²	105	68.6 Å²	68.6	56%	0.561	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	6.1	175.9	-66.3	-43.3	0	0	0	113.5	G81 A82 I83 T87	G81-N85 WeakPolarHBondContact O-CB 3.36Å; G81-N85 PolarHBondContact O-N 3.5Å; G81-N85 VanDerWaalsContact O-N 3.11Å; G81-N85 PolarHBondContact O-ND2 3.24Å; A82-N85 PolarHBondContact O-N 3.29Å; I83-N85 VanDerWaalsContact C-N 3.33Å; I83-N85 PolarHBondContact O-N 2.89Å; N85-T87 HydrophobicContact CB-CG2 4.22Å; N85-T87 PolarHBondContact O-N 2.94Å
86	S	86.6	Confident	86.1	Confident	92 Å²	92	64.3 Å²	64.3	64%	0.643	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	36.7	-175.1	-54.6	0	0	0	0	113.5	A82 I83 Q84	A82-S86 PolarHBondContact O-N 3Å; A82-S86 VanDerWaalsContact O-N 3.11Å; I83-S86 PolarHBondContact O-N 3.31Å; I83-S86 VanDerWaalsContact O-N 3.09Å; Q84-S86 VanDerWaalsContact C-N 3.28Å; Q84-S86 PolarHBondContact O-N 3.48Å
87	T	86.2	Confident	86.2	Confident	82 Å²	82	67 Å²	67	50%	0.503	35%	0.349	S	S	.	.			trans	-104.1	157.8	174.7	62.3	0	0	0	0	111.4	A82 N85 I89	A82-T87 VanDerWaalsContact CA-OG1 3.25Å; A82-T87 WeakPolarHBondContact CA-OG1 3.43Å; A82-T87 WeakPolarHBondContact CB-OG1 3.43Å; A82-T87 PolarHBondContact O-N 3.44Å; A82-T87 PolarHBondContact O-OG1 3.39Å; N85-T87 HydrophobicContact CB-CG2 4.22Å; N85-T87 PolarHBondContact O-N 2.94Å; T87-I89 PolarHBondContact O-N 3.27Å
88	S	80.6	Confident	86.1	Confident	109 Å²	109	66.2 Å²	66.2	76%	0.762	35%	0.35	S	S	*	.			trans	-68.2	130.4	-177.8	58.8	0	0	0	0	111.9
89	I	83.6	Confident	86	Confident	44 Å²	44	63.2 Å²	63.2	23%	0.226	34%	0.336	C	S	.	.			trans	-69.8	134.4	175.3	-50.2	172.1	0	0	0	109.2	A79 A82 I83 T87 Y91 L93 L96 M159	A79-I89 HydrophobicContact CB-CG2 3.94Å; A82-I89 HydrophobicContact CB-CG1 4.4Å; I83-I89 HydrophobicContact CD1-CD1 3.85Å; I83-I89 HydrophobicContact CG1-CD1 3.65Å; I83-I89 HydrophobicContact CG1-CG1 4.05Å; T87-I89 PolarHBondContact O-N 3.27Å; I89-Y91 VanDerWaalsContact C-N 3.34Å; I89-Y91 WeakPolarHBondContact CG2-O 3.38Å; I89-L93 HydrophobicContact CD1-CD2 3.98Å; I89-L96 HydrophobicContact CG2-CD1 3.82Å; I89-M159 HydrophobicContact CD1-SD 4.37Å
90	K	78.4	Confident	86	Confident	188 Å²	188	63.1 Å²	63.1	82%	0.817	34%	0.335	S	S	*	.	S	Bend	trans	-77.3	-18.2	179.8	-65.1	178.9	-178.6	173.3	0	114.1
91	Y	82	Confident	85.9	Confident	91 Å²	91	66.4 Å²	66.4	36%	0.357	35%	0.35	S	S	.	.	S	Bend	trans	-116	153.1	-173.3	-56	-75.2	0	0	0	110.8	K75 I89 L96	K75-Y91 HydrophobicContact CB-CE2 4.27Å; K75-Y91 HydrophobicContact CG-CE1 4.47Å; K75-Y91 HydrophobicContact CG-CE2 4.17Å; I89-Y91 VanDerWaalsContact C-N 3.34Å; I89-Y91 WeakPolarHBondContact CG2-O 3.38Å; Y91-L96 HydrophobicContact CD2-CD2 4.38Å; Y91-L96 HydrophobicContact CG-CD2 4.38Å
92	N	86.9	Confident	85.7	Confident	95 Å²	95	68.6 Å²	68.6	51%	0.508	36%	0.357	S	S	.	.			trans	-72.2	144.8	177.3	-175.3	7.4	0	0	0	111	E94 E95 L96	N92-E94 VanDerWaalsContact C-N 3.26Å; N92-E94 PolarHBondContact O-N 3.15Å; N92-E95 HydrophobicContact CB-CB 4.32Å; N92-E95 HydrophobicContact CB-CG 3.95Å; N92-E95 PolarHBondContact N-OE2 2.92Å; N92-E95 WeakPolarHBondContact O-CB 3.4Å; N92-E95 PolarHBondContact O-N 2.98Å; N92-E95 VanDerWaalsContact O-N 3.12Å; N92-L96 WeakPolarHBondContact O-CG 3.34Å; N92-L96 PolarHBondContact O-N 3.03Å
93	L	85.4	Confident	85.4	Confident	82 Å²	82	68.2 Å²	68.2	43%	0.429	35%	0.353	S	S	.	.	H	α-helix	trans	-59.5	-36.4	179.5	-66.7	176.4	0	0	0	112.3	I89 L96 Y97 I163	I89-L93 HydrophobicContact CD1-CD2 3.98Å; L93-L96 PolarHBondContact O-N 2.74Å; L93-Y97 WeakPolarHBondContact O-CB 3.41Å; L93-Y97 PolarHBondContact O-N 2.8Å; L93-I163 HydrophobicContact CD2-CD1 3.88Å; L93-I163 HydrophobicContact CD2-CG1 3.84Å
94	E	85.9	Confident	85.1	Confident	99 Å²	99	68.3 Å²	68.3	46%	0.463	36%	0.355	S	S	.	.	H	α-helix	trans	-66.5	-39.9	176.5	-175.7	60.3	-153.3	0	0	111.8	N92 L96 Y97 Q98	N92-E94 VanDerWaalsContact C-N 3.26Å; N92-E94 PolarHBondContact O-N 3.15Å; E94-L96 VanDerWaalsContact C-N 3.34Å; E94-L96 PolarHBondContact O-N 2.72Å; E94-Y97 PolarHBondContact O-N 3.18Å; E94-Q98 WeakPolarHBondContact O-CB 3.38Å; E94-Q98 VanDerWaalsContact O-CG 3.32Å; E94-Q98 WeakPolarHBondContact O-CG 3.26Å; E94-Q98 PolarHBondContact O-N 3.01Å; E94-Q98 PolarHBondContact OE1-NE2 2.69Å
95	E	86.9	Confident	84.6	Confident	111 Å²	111	71.2 Å²	71.2	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-65.8	-39.1	176.8	-67.1	172.8	170.3	0	0	111.2	N92 A99	N92-E95 HydrophobicContact CB-CB 4.32Å; N92-E95 HydrophobicContact CB-CG 3.95Å; N92-E95 PolarHBondContact N-OE2 2.92Å; N92-E95 WeakPolarHBondContact O-CB 3.4Å; N92-E95 PolarHBondContact O-N 2.98Å; N92-E95 VanDerWaalsContact O-N 3.12Å; E95-A99 VanDerWaalsContact O-CB 3.27Å; E95-A99 WeakPolarHBondContact O-CB 3.28Å; E95-A99 PolarHBondContact O-N 2.63Å
96	L	87.4	Confident	84.1	Confident	5 Å²	5	71.9 Å²	71.9	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-69.7	-38.4	176.2	-65	171.4	0	0	0	111.8	L76 A79 I89 Y91 N92 L93 E94 A99 V100 I163	L76-L96 HydrophobicContact CD2-CB 4.28Å; L76-L96 HydrophobicContact CD2-CD2 4.03Å; A79-L96 HydrophobicContact CB-CD1 3.63Å; A79-L96 HydrophobicContact CB-CD2 4.06Å; I89-L96 HydrophobicContact CG2-CD1 3.82Å; Y91-L96 HydrophobicContact CD2-CD2 4.38Å; Y91-L96 HydrophobicContact CG-CD2 4.38Å; N92-L96 WeakPolarHBondContact O-CG 3.34Å; N92-L96 PolarHBondContact O-N 3.03Å; L93-L96 PolarHBondContact O-N 2.74Å; E94-L96 VanDerWaalsContact C-N 3.34Å; E94-L96 PolarHBondContact O-N 2.72Å; L96-A99 WeakPolarHBondContact O-CB 3.5Å; L96-A99 PolarHBondContact O-N 2.98Å; L96-V100 WeakPolarHBondContact O-CG2 3.22Å; L96-V100 PolarHBondContact O-N 2.91Å; L96-I163 HydrophobicContact CB-CG2 3.78Å; L96-I163 HydrophobicContact CD1-CD1 4.15Å
97	Y	89.8	Confident	83.7	Confident	58 Å²	58	76.5 Å²	76.5	23%	0.227	38%	0.381	C	S	.	.	H	α-helix	trans	-63.2	-48.8	174.3	173.5	-92.7	0	0	0	111.5	L93 E94 A99 V100 E101 L165 F166	L93-Y97 WeakPolarHBondContact O-CB 3.41Å; L93-Y97 PolarHBondContact O-N 2.8Å; E94-Y97 PolarHBondContact O-N 3.18Å; Y97-A99 VanDerWaalsContact C-N 3.27Å; Y97-A99 PolarHBondContact O-N 3.05Å; Y97-V100 WeakPolarHBondContact O-CB 3.36Å; Y97-V100 PolarHBondContact O-N 2.89Å; Y97-V100 VanDerWaalsContact O-N 3.08Å; Y97-E101 PolarHBondContact O-N 2.83Å; Y97-L165 HydrophobicContact CD2-CB 4.34Å; Y97-L165 HydrophobicContact CE2-CB 3.99Å; Y97-L165 HydrophobicContact CE2-CD2 4.47Å; Y97-F166 HydrophobicContact CE2-CB 3.93Å
98	Q	86.2	Confident	83.5	Confident	89 Å²	89	74.7 Å²	74.7	42%	0.416	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-34.9	176.8	-70.9	176.7	12.1	0	0	111.8	E94 E101 N102	E94-Q98 WeakPolarHBondContact O-CB 3.38Å; E94-Q98 VanDerWaalsContact O-CG 3.32Å; E94-Q98 WeakPolarHBondContact O-CG 3.26Å; E94-Q98 PolarHBondContact O-N 3.01Å; E94-Q98 PolarHBondContact OE1-NE2 2.69Å; Q98-E101 PolarHBondContact O-N 3.11Å; Q98-N102 WeakPolarHBondContact O-CB 3.31Å; Q98-N102 PolarHBondContact O-N 2.78Å; Q98-N102 PolarHBondContact O-ND2 2.82Å
99	A	85.4	Confident	83.6	Confident	17 Å²	17	70 Å²	70	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-42.6	172.4	0	0	0	0	0	112	T72 E95 L96 Y97 L103	T72-A99 HydrophobicContact CG2-CB 3.66Å; E95-A99 VanDerWaalsContact O-CB 3.27Å; E95-A99 WeakPolarHBondContact O-CB 3.28Å; E95-A99 PolarHBondContact O-N 2.63Å; L96-A99 WeakPolarHBondContact O-CB 3.5Å; L96-A99 PolarHBondContact O-N 2.98Å; Y97-A99 VanDerWaalsContact C-N 3.27Å; Y97-A99 PolarHBondContact O-N 3.05Å; A99-L103 WeakPolarHBondContact O-CB 3.32Å; A99-L103 VanDerWaalsContact O-CG 3.28Å; A99-L103 WeakPolarHBondContact O-CG 3.36Å; A99-L103 PolarHBondContact O-N 2.91Å
100	V	86.4	Confident	83.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.3	-42.8	174.4	175.7	0	0	0	0	111.4	L76 L96 Y97 L103 C104 L112 I163 F164 L167	L76-V100 HydrophobicContact CD1-CG2 3.78Å; L76-V100 HydrophobicContact CD2-CG2 3.66Å; L76-V100 HydrophobicContact CG-CG2 4.41Å; L96-V100 WeakPolarHBondContact O-CG2 3.22Å; L96-V100 PolarHBondContact O-N 2.91Å; Y97-V100 WeakPolarHBondContact O-CB 3.36Å; Y97-V100 PolarHBondContact O-N 2.89Å; Y97-V100 VanDerWaalsContact O-N 3.08Å; V100-L103 PolarHBondContact O-N 2.71Å; V100-C104 WeakPolarHBondContact O-CB 2.8Å; V100-C104 PolarHBondContact O-N 2.74Å; V100-C104 PolarHBondContact O-SG 2.61Å; V100-L112 HydrophobicContact CG1-CD2 4.23Å; V100-I163 HydrophobicContact CG2-CG2 4.39Å; V100-F164 HydrophobicContact CG1-CD1 4.06Å; V100-F164 HydrophobicContact CG2-CD1 3.7Å; V100-F164 HydrophobicContact CG2-CE1 3.83Å; V100-F164 HydrophobicContact CG2-CG 4.23Å; V100-F164 HydrophobicContact CG2-CZ 4.43Å; V100-L167 HydrophobicContact CG1-CB 3.95Å
101	E	88.4	Confident	84	Confident	69 Å²	69	65.5 Å²	65.5	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-46.5	177.4	177.6	171	-165.9	0	0	112.1	Y97 Q98 C104 S105 F166	Y97-E101 PolarHBondContact O-N 2.83Å; Q98-E101 PolarHBondContact O-N 3.11Å; E101-C104 PolarHBondContact O-N 2.97Å; E101-S105 WeakPolarHBondContact O-CB 3.15Å; E101-S105 PolarHBondContact O-N 3.4Å; E101-S105 PolarHBondContact O-OG 3.1Å; E101-F166 HydrophobicContact CB-CB 4.42Å; E101-F166 HydrophobicContact CB-CD1 4.23Å; E101-F166 HydrophobicContact CB-CD2 4.18Å; E101-F166 HydrophobicContact CB-CG 4.02Å; E101-F166 HydrophobicContact CG-CD1 4.32Å; E101-F166 HydrophobicContact CG-CD2 3.9Å; E101-F166 HydrophobicContact CG-CE1 4.19Å; E101-F166 HydrophobicContact CG-CE2 3.76Å; E101-F166 HydrophobicContact CG-CG 4.17Å; E101-F166 HydrophobicContact CG-CZ 3.91Å
102	N	83.9	Confident	84.2	Confident	66 Å²	66	61.3 Å²	61.3	35%	0.353	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-47.4	177.1	-72.2	-34.6	0	0	0	111.1	Q98 C104 S105 Y106	Q98-N102 WeakPolarHBondContact O-CB 3.31Å; Q98-N102 PolarHBondContact O-N 2.78Å; Q98-N102 PolarHBondContact O-ND2 2.82Å; N102-C104 VanDerWaalsContact C-N 3.32Å; N102-C104 PolarHBondContact O-N 2.75Å; N102-S105 WeakPolarHBondContact O-CB 3.4Å; N102-S105 PolarHBondContact O-N 3.09Å; N102-Y106 WeakPolarHBondContact O-CD2 3.26Å; N102-Y106 WeakPolarHBondContact O-CE2 3.29Å; N102-Y106 PolarHBondContact O-N 2.75Å
103	L	81	Confident	84.2	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-37.9	177	-74.7	178.5	0	0	0	113	T69 T72 L76 A99 V100 Y106 L112	T69-L103 HydrophobicContact CG2-CD2 4.14Å; T72-L103 HydrophobicContact CG2-CD1 3.54Å; T72-L103 HydrophobicContact CG2-CD2 4.32Å; T72-L103 HydrophobicContact CG2-CG 3.87Å; L76-L103 HydrophobicContact CD1-CD1 3.75Å; A99-L103 WeakPolarHBondContact O-CB 3.32Å; A99-L103 VanDerWaalsContact O-CG 3.28Å; A99-L103 WeakPolarHBondContact O-CG 3.36Å; A99-L103 PolarHBondContact O-N 2.91Å; V100-L103 PolarHBondContact O-N 2.71Å; L103-Y106 PolarHBondContact O-N 2.81Å; L103-L112 HydrophobicContact CB-CD2 4.4Å; L103-L112 HydrophobicContact CD1-CD1 4.46Å
104	C	80.9	Confident	84.4	Confident	11 Å²	11	61.2 Å²	61.2	7%	0.074	30%	0.304	C	S	.	.	H	α-helix	trans	-68.1	-37.2	176.1	-70.4	0	0	0	0	112	V100 E101 N102 Y106 K107 S109 F166	V100-C104 WeakPolarHBondContact O-CB 2.8Å; V100-C104 PolarHBondContact O-N 2.74Å; V100-C104 PolarHBondContact O-SG 2.61Å; E101-C104 PolarHBondContact O-N 2.97Å; N102-C104 VanDerWaalsContact C-N 3.32Å; N102-C104 PolarHBondContact O-N 2.75Å; C104-Y106 PolarHBondContact O-N 2.92Å; C104-K107 PolarHBondContact O-N 2.94Å; C104-K107 VanDerWaalsContact O-N 3.08Å; C104-S109 WeakPolarHBondContact CA-OG 3.49Å; C104-F166 HydrophobicContact CB-CD1 3.61Å; C104-F166 HydrophobicContact CB-CE1 3.57Å
105	S	78.8	Confident	84.5	Confident	79 Å²	79	59.8 Å²	59.8	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-62.5	-25.7	176.1	-62.6	0	0	0	0	113	E101 N102 K107	E101-S105 WeakPolarHBondContact O-CB 3.15Å; E101-S105 PolarHBondContact O-N 3.4Å; E101-S105 PolarHBondContact O-OG 3.1Å; N102-S105 WeakPolarHBondContact O-CB 3.4Å; N102-S105 PolarHBondContact O-N 3.09Å; S105-K107 VanDerWaalsContact C-N 3.3Å; S105-K107 PolarHBondContact O-N 3.32Å
106	Y	75.9	Confident	84.6	Confident	118 Å²	118	54.8 Å²	54.8	46%	0.463	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	14.3	174.9	-64	-61.6	0	0	0	114.7	L64 Y68 N102 L103 C104 V108	L64-Y106 HydrophobicContact CD1-CD1 3.83Å; L64-Y106 HydrophobicContact CD1-CD2 4.07Å; L64-Y106 HydrophobicContact CD1-CE1 3.58Å; L64-Y106 HydrophobicContact CD1-CE2 3.85Å; L64-Y106 HydrophobicContact CD1-CG 4.09Å; L64-Y106 HydrophobicContact CD2-CE2 4.15Å; L64-Y106 HydrophobicContact CG-CE1 4.44Å; Y68-Y106 HydrophobicContact CE1-CE2 4.43Å; N102-Y106 WeakPolarHBondContact O-CD2 3.26Å; N102-Y106 WeakPolarHBondContact O-CE2 3.29Å; N102-Y106 PolarHBondContact O-N 2.75Å; L103-Y106 PolarHBondContact O-N 2.81Å; C104-Y106 PolarHBondContact O-N 2.92Å; Y106-V108 VanDerWaalsContact C-N 3.26Å; Y106-V108 PolarHBondContact O-N 3.45Å
107	K	77.4	Confident	84.8	Confident	189 Å²	189	58.3 Å²	58.3	82%	0.822	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	21.9	180	-57.3	-172.8	174.9	-173	0	115.2	C104 S105 S109	C104-K107 PolarHBondContact O-N 2.94Å; C104-K107 VanDerWaalsContact O-N 3.08Å; S105-K107 VanDerWaalsContact C-N 3.3Å; S105-K107 PolarHBondContact O-N 3.32Å; K107-S109 VanDerWaalsContact C-N 3.32Å
108	V	81.2	Confident	84.9	Confident	45 Å²	45	59.6 Å²	59.6	27%	0.273	30%	0.295	S	S	.	.			trans	-89.8	4.3	178	-167	0	0	0	0	112.3	Y106 P110 T111 L112	Y106-V108 VanDerWaalsContact C-N 3.26Å; Y106-V108 PolarHBondContact O-N 3.45Å; V108-P110 VanDerWaalsContact C-CD 3.44Å; V108-T111 PolarHBondContact O-N 2.96Å; V108-L112 PolarHBondContact O-N 3.15Å
109	S	83	Confident	85.1	Confident	11 Å²	11	56.8 Å²	56.8	8%	0.077	28%	0.284	C	S	.	.	H	α-helix	trans	-51.9	-41.3	-176.6	-44.3	0	0	0	0	115.8	C104 K107 L112 Y113	C104-S109 WeakPolarHBondContact CA-OG 3.49Å; K107-S109 VanDerWaalsContact C-N 3.32Å; S109-L112 PolarHBondContact O-N 3.24Å; S109-Y113 PolarHBondContact O-N 3.42Å
110	P	84.6	Confident	85.3	Confident	60 Å²	60	57 Å²	57	39%	0.39	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-44.2	178.5	-20.4	31.1	0	0	0	113.3	V108 K114 Y171	V108-P110 VanDerWaalsContact C-CD 3.44Å; P110-K114 PolarHBondContact O-N 2.69Å; P110-Y171 HydrophobicContact CB-CE1 4.35Å; P110-Y171 HydrophobicContact CB-CE2 4.49Å; P110-Y171 WeakPolarHBondContact CB-OH 3.43Å; P110-Y171 HydrophobicContact CG-CE1 4.43Å; P110-Y171 HydrophobicContact CG-CE2 3.8Å; P110-Y171 WeakPolarHBondContact CG-OH 3.41Å
111	T	85.6	Confident	85.6	Confident	77 Å²	77	58.2 Å²	58.2	47%	0.472	29%	0.29	S	S	.	.	H	α-helix	trans	-67.1	-41.6	178.9	-53.4	0	0	0	0	110.4	V108 Y113 K114 Q115	V108-T111 PolarHBondContact O-N 2.96Å; T111-Y113 PolarHBondContact O-N 2.85Å; T111-K114 PolarHBondContact O-N 3.42Å; T111-Q115 HydrophobicContact CG2-CG 4.31Å; T111-Q115 WeakPolarHBondContact O-CB 3.33Å; T111-Q115 VanDerWaalsContact O-CG 3.27Å; T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.23Å
112	L	86.1	Confident	85.7	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-44.1	179	-174.4	62.4	0	0	0	112.2	W73 L76 V100 L103 V108 S109 Q115 L116 F164 L167	W73-L112 HydrophobicContact CE3-CD1 3.43Å; W73-L112 VanDerWaalsContact CE3-CD1 3.43Å; W73-L112 HydrophobicContact CZ3-CD1 3.6Å; L76-L112 HydrophobicContact CD1-CD1 4.25Å; V100-L112 HydrophobicContact CG1-CD2 4.23Å; L103-L112 HydrophobicContact CB-CD2 4.4Å; L103-L112 HydrophobicContact CD1-CD1 4.46Å; V108-L112 PolarHBondContact O-N 3.15Å; S109-L112 PolarHBondContact O-N 3.24Å; L112-Q115 PolarHBondContact O-N 3.49Å; L112-L116 WeakPolarHBondContact O-CB 3.4Å; L112-L116 PolarHBondContact O-N 3.4Å; L112-F164 HydrophobicContact CD1-CE1 4.23Å; L112-F164 HydrophobicContact CD2-CE1 4.43Å; L112-F164 HydrophobicContact CG-CE1 4.31Å; L112-L167 HydrophobicContact CD2-CD1 4.47Å; L112-L167 HydrophobicContact CD2-CD2 4.19Å; L112-L167 HydrophobicContact CG-CD2 4.15Å
113	Y	88.5	Confident	86	Confident	17 Å²	17	56.7 Å²	56.7	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-43.9	176.2	-179.5	-92.6	0	0	0	111.9	S109 T111 Q115 L116 R117 V172 L178 P179 T184	S109-Y113 PolarHBondContact O-N 3.42Å; T111-Y113 PolarHBondContact O-N 2.85Å; Y113-Q115 PolarHBondContact O-N 2.95Å; Y113-L116 PolarHBondContact O-N 3.28Å; Y113-R117 WeakPolarHBondContact O-CB 3.38Å; Y113-R117 PolarHBondContact O-N 3.04Å; Y113-V172 HydrophobicContact CD2-CG2 3.56Å; Y113-V172 HydrophobicContact CE2-CG1 4.46Å; Y113-V172 HydrophobicContact CE2-CG2 3.64Å; Y113-L178 HydrophobicContact CD1-CD1 4.48Å; Y113-L178 HydrophobicContact CE1-CD2 4.1Å; Y113-P179 WeakPolarHBondContact OH-CD 3.32Å; Y113-P179 PolarHBondContact OH-O 3.42Å; Y113-T184 PolarHBondContact OH-OG1 2.84Å
114	K	88.2	Confident	86.4	Confident	158 Å²	158	56.8 Å²	56.8	69%	0.687	28%	0.283	S	S	*	.	H	α-helix	trans	-61.7	-43.1	177	-171.6	-179.3	-178.9	-178.8	0	111.8	P110 T111 R117 Q118	P110-K114 PolarHBondContact O-N 2.69Å; T111-K114 PolarHBondContact O-N 3.42Å; K114-R117 PolarHBondContact O-N 2.94Å; K114-Q118 PolarHBondContact O-N 2.81Å
115	Q	88.1	Confident	86.8	Confident	68 Å²	68	61.6 Å²	61.6	32%	0.318	30%	0.3	S	S	.	.	H	α-helix	trans	-67.2	-41.6	178.6	-72.5	177.5	-30.5	0	0	111.9	W73 T111 L112 Y113 Q118 V119	W73-Q115 HydrophobicContact CD2-CB 4.37Å; W73-Q115 HydrophobicContact CE3-CB 4.4Å; W73-Q115 VanDerWaalsContact CH2-C 3.49Å; W73-Q115 HydrophobicContact CH2-CB 3.48Å; W73-Q115 VanDerWaalsContact CH2-CB 3.48Å; W73-Q115 HydrophobicContact CZ2-CB 3.43Å; W73-Q115 VanDerWaalsContact CZ2-CB 3.43Å; W73-Q115 HydrophobicContact CZ2-CG 4.32Å; W73-Q115 HydrophobicContact CZ3-CB 3.97Å; T111-Q115 HydrophobicContact CG2-CG 4.31Å; T111-Q115 WeakPolarHBondContact O-CB 3.33Å; T111-Q115 VanDerWaalsContact O-CG 3.27Å; T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.23Å; L112-Q115 PolarHBondContact O-N 3.49Å; Y113-Q115 PolarHBondContact O-N 2.95Å; Q115-Q118 PolarHBondContact O-N 3.44Å; Q115-V119 WeakPolarHBondContact O-CG2 3.38Å; Q115-V119 PolarHBondContact O-N 3.02Å; Q115-V119 VanDerWaalsContact O-N 3.09Å
116	L	90	Very high	87.3	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-45.9	174.4	179.7	62.3	0	0	0	111.7	V80 L112 Y113 Q118 V119 C120 I160 F164 I181	V80-L116 HydrophobicContact CG1-CD1 4.43Å; V80-L116 HydrophobicContact CG2-CD1 3.89Å; L112-L116 WeakPolarHBondContact O-CB 3.4Å; L112-L116 PolarHBondContact O-N 3.4Å; Y113-L116 PolarHBondContact O-N 3.28Å; L116-Q118 VanDerWaalsContact C-N 3.31Å; L116-Q118 PolarHBondContact O-N 3.11Å; L116-V119 PolarHBondContact O-N 3.47Å; L116-C120 PolarHBondContact O-N 3.33Å; L116-C120 PolarHBondContact O-SG 3Å; L116-C120 VanDerWaalsContact O-SG 3.41Å; L116-I160 HydrophobicContact CD1-CG2 3.96Å; L116-I160 HydrophobicContact CD2-CG2 4.25Å; L116-F164 HydrophobicContact CD1-CD2 4.33Å; L116-F164 HydrophobicContact CD1-CE1 4.4Å; L116-F164 HydrophobicContact CD1-CE2 3.83Å; L116-F164 HydrophobicContact CD1-CZ 3.85Å; L116-F164 HydrophobicContact CD2-CB 4.29Å; L116-F164 HydrophobicContact CD2-CD1 3.81Å; L116-F164 HydrophobicContact CD2-CD2 3.97Å; L116-F164 HydrophobicContact CD2-CE1 4.04Å; L116-F164 HydrophobicContact CD2-CE2 4.21Å; L116-F164 HydrophobicContact CD2-CG 3.76Å; L116-F164 HydrophobicContact CD2-CZ 4.22Å; L116-I181 HydrophobicContact CD2-CD1 4.11Å
117	R	91.4	Very high	87.8	Confident	79 Å²	79	57.8 Å²	57.8	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-44.3	175.8	-176.2	177.3	-176.6	-73.9	1.1	111.3	Y113 K114 C120 E121 T184 E187	Y113-R117 WeakPolarHBondContact O-CB 3.38Å; Y113-R117 PolarHBondContact O-N 3.04Å; K114-R117 PolarHBondContact O-N 2.94Å; R117-C120 PolarHBondContact O-N 3.11Å; R117-E121 IonicContact CZ-OE2 3.92Å; R117-E121 IonicContact NH1-OE2 3.8Å; R117-E121 PolarHBondContact NH1-OE2 3.35Å; R117-E121 VanDerWaalsContact O-CB 3.27Å; R117-E121 WeakPolarHBondContact O-CB 3.39Å; R117-E121 PolarHBondContact O-N 2.85Å; R117-T184 HydrophobicContact CB-CG2 4.42Å; R117-T184 HydrophobicContact CG-CG2 3.81Å; R117-E187 IonicContact NH2-OE1 3.96Å; R117-E187 PolarHBondContact NH2-OE1 3.42Å
118	Q	91.1	Very high	88.2	Confident	86 Å²	86	49.4 Å²	49.4	40%	0.402	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-46.1	179.5	-173.6	62	50.1	0	0	112.3	K114 Q115 L116 C120 E121 D122	K114-Q118 PolarHBondContact O-N 2.81Å; Q115-Q118 PolarHBondContact O-N 3.44Å; L116-Q118 VanDerWaalsContact C-N 3.31Å; L116-Q118 PolarHBondContact O-N 3.11Å; Q118-C120 VanDerWaalsContact C-N 3.34Å; Q118-C120 PolarHBondContact O-N 3Å; Q118-E121 PolarHBondContact O-N 3.14Å; Q118-D122 VanDerWaalsContact NE2-CG 3.31Å; Q118-D122 PolarHBondContact NE2-OD1 3.44Å; Q118-D122 PolarHBondContact NE2-OD2 2.87Å; Q118-D122 VanDerWaalsContact NE2-OD2 3.12Å; Q118-D122 PolarHBondContact O-N 3.33Å
119	V	91.4	Very high	88.3	Confident	29 Å²	29	52 Å²	52	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-42.5	178.7	174.5	0	0	0	0	111.1	W73 R77 V80 Q115 L116 H123	W73-V119 HydrophobicContact CH2-CG2 4.17Å; W73-V119 HydrophobicContact CZ2-CG2 3.86Å; R77-V119 HydrophobicContact CG-CG2 4.11Å; V80-V119 HydrophobicContact CG1-CG1 3.78Å; Q115-V119 WeakPolarHBondContact O-CG2 3.38Å; Q115-V119 PolarHBondContact O-N 3.02Å; Q115-V119 VanDerWaalsContact O-N 3.09Å; L116-V119 PolarHBondContact O-N 3.47Å; V119-H123 PolarHBondContact O-N 3.33Å
120	C	90.4	Very high	88.2	Confident	21 Å²	21	53.2 Å²	53.2	14%	0.142	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-41.1	173.9	-67.5	0	0	0	0	112.3	L116 R117 Q118 H123 V124 L188	L116-C120 PolarHBondContact O-N 3.33Å; L116-C120 PolarHBondContact O-SG 3Å; L116-C120 VanDerWaalsContact O-SG 3.41Å; R117-C120 PolarHBondContact O-N 3.11Å; Q118-C120 VanDerWaalsContact C-N 3.34Å; Q118-C120 PolarHBondContact O-N 3Å; C120-H123 PolarHBondContact O-N 2.9Å; C120-V124 VanDerWaalsContact O-CG2 3.29Å; C120-V124 WeakPolarHBondContact O-CG2 3.48Å; C120-V124 PolarHBondContact O-N 3.26Å; C120-L188 HydrophobicContact CB-CD1 3.74Å
121	E	91.7	Very high	88.1	Confident	27 Å²	27	50.8 Å²	50.8	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-45.3	179.4	-178.5	163.8	-178	0	0	112.1	R117 Q118 H123 V124 R125 L188 H192	R117-E121 IonicContact CZ-OE2 3.92Å; R117-E121 IonicContact NH1-OE2 3.8Å; R117-E121 PolarHBondContact NH1-OE2 3.35Å; R117-E121 VanDerWaalsContact O-CB 3.27Å; R117-E121 WeakPolarHBondContact O-CB 3.39Å; R117-E121 PolarHBondContact O-N 2.85Å; Q118-E121 PolarHBondContact O-N 3.14Å; E121-H123 VanDerWaalsContact C-N 3.33Å; E121-H123 PolarHBondContact O-N 3.5Å; E121-V124 PolarHBondContact O-N 2.98Å; E121-R125 VanDerWaalsContact O-CB 3.32Å; E121-R125 WeakPolarHBondContact O-CB 3.45Å; E121-R125 PolarHBondContact O-N 3.37Å; E121-R125 IonicContact OE1-NH2 3.19Å; E121-R125 PolarHBondContact OE1-NH2 2.91Å; E121-L188 HydrophobicContact CB-CD1 4.19Å; E121-L188 HydrophobicContact CB-CD2 3.68Å; E121-L188 HydrophobicContact CG-CD2 3.77Å; E121-H192 IonicContact OE1-CE1 3.65Å; E121-H192 IonicContact OE1-NE2 2.81Å; E121-H192 PolarHBondContact OE1-NE2 2.91Å
122	D	90.4	Very high	87.8	Confident	77 Å²	77	53.3 Å²	53.3	41%	0.412	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-39.4	179.1	-68	-30	0	0	0	111.6	Q118 A126	Q118-D122 VanDerWaalsContact NE2-CG 3.31Å; Q118-D122 PolarHBondContact NE2-OD1 3.44Å; Q118-D122 PolarHBondContact NE2-OD2 2.87Å; Q118-D122 VanDerWaalsContact NE2-OD2 3.12Å; Q118-D122 PolarHBondContact O-N 3.33Å; D122-A126 PolarHBondContact O-N 2.87Å; D122-A126 VanDerWaalsContact O-N 3.09Å
123	H	90.2	Very high	86.8	Confident	26 Å²	26	59.6 Å²	59.6	12%	0.12	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-50.2	175.3	-178.3	78.5	0	0	0	112.3	Q84 V119 C120 E121 R125 A126 Q127	Q84-H123 PolarHBondContact O-CE1 3.02Å; V119-H123 PolarHBondContact O-N 3.33Å; C120-H123 PolarHBondContact O-N 2.9Å; E121-H123 VanDerWaalsContact C-N 3.33Å; E121-H123 PolarHBondContact O-N 3.5Å; H123-R125 VanDerWaalsContact C-N 3.27Å; H123-R125 PolarHBondContact O-N 3.32Å; H123-A126 WeakPolarHBondContact O-CB 3.39Å; H123-A126 PolarHBondContact O-N 3.29Å; H123-A126 VanDerWaalsContact O-N 3.12Å; H123-Q127 PolarHBondContact CE1-NE2 2.93Å; H123-Q127 PolarHBondContact NE2-NE2 3.45Å; H123-Q127 WeakPolarHBondContact O-CG 3.44Å; H123-Q127 PolarHBondContact O-N 3.34Å; H123-Q127 VanDerWaalsContact O-N 3.16Å
124	V	90.1	Very high	85.6	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-37.9	179.9	176.4	0	0	0	0	110.7	C120 E121 A126 Q127 L188 H192 I193	C120-V124 VanDerWaalsContact O-CG2 3.29Å; C120-V124 WeakPolarHBondContact O-CG2 3.48Å; C120-V124 PolarHBondContact O-N 3.26Å; E121-V124 PolarHBondContact O-N 2.98Å; V124-A126 VanDerWaalsContact C-N 3.34Å; V124-A126 PolarHBondContact O-N 3.17Å; V124-Q127 WeakPolarHBondContact O-CB 3.5Å; V124-Q127 PolarHBondContact O-N 2.96Å; V124-Q127 VanDerWaalsContact O-N 3.12Å; V124-L188 HydrophobicContact CG2-CB 4.4Å; V124-H192 HydrophobicContact CG1-CB 4.03Å; V124-I193 HydrophobicContact CG1-CD1 4.42Å; V124-I193 HydrophobicContact CG1-CG1 3.89Å
125	R	88.8	Confident	84.2	Confident	113 Å²	113	65 Å²	65	43%	0.426	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-39	175.2	-168	-178.9	-63.9	155.4	1.2	112.1	E121 H123 Q127 I128	E121-R125 VanDerWaalsContact O-CB 3.32Å; E121-R125 WeakPolarHBondContact O-CB 3.45Å; E121-R125 PolarHBondContact O-N 3.37Å; E121-R125 IonicContact OE1-NH2 3.19Å; E121-R125 PolarHBondContact OE1-NH2 2.91Å; H123-R125 VanDerWaalsContact C-N 3.27Å; H123-R125 PolarHBondContact O-N 3.32Å; R125-Q127 VanDerWaalsContact C-N 3.27Å; R125-Q127 PolarHBondContact O-N 3.34Å; R125-I128 WeakPolarHBondContact O-CG2 3.33Å; R125-I128 PolarHBondContact O-N 3.29Å
126	A	88.4	Confident	82.9	Confident	57 Å²	57	67.6 Å²	67.6	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-31.5	173.7	0	0	0	0	0	112.9	D122 H123 V124 I128 H129	D122-A126 PolarHBondContact O-N 2.87Å; D122-A126 VanDerWaalsContact O-N 3.09Å; H123-A126 WeakPolarHBondContact O-CB 3.39Å; H123-A126 PolarHBondContact O-N 3.29Å; H123-A126 VanDerWaalsContact O-N 3.12Å; V124-A126 VanDerWaalsContact C-N 3.34Å; V124-A126 PolarHBondContact O-N 3.17Å; A126-I128 PolarHBondContact O-N 3.4Å; A126-H129 PolarHBondContact O-CD2 2.87Å; A126-H129 PolarHBondContact O-N 2.9Å
127	Q	86.8	Confident	82.1	Confident	59 Å²	59	69.6 Å²	69.6	28%	0.276	34%	0.338	S	S	.	.	H	α-helix	trans	-66.8	-18.8	179.5	-64.9	-57.6	-40.2	0	0	113.8	H123 V124 R125 H129 Q130 I193	H123-Q127 PolarHBondContact CE1-NE2 2.93Å; H123-Q127 PolarHBondContact NE2-NE2 3.45Å; H123-Q127 WeakPolarHBondContact O-CG 3.44Å; H123-Q127 PolarHBondContact O-N 3.34Å; H123-Q127 VanDerWaalsContact O-N 3.16Å; V124-Q127 WeakPolarHBondContact O-CB 3.5Å; V124-Q127 PolarHBondContact O-N 2.96Å; V124-Q127 VanDerWaalsContact O-N 3.12Å; R125-Q127 VanDerWaalsContact C-N 3.27Å; R125-Q127 PolarHBondContact O-N 3.34Å; Q127-H129 VanDerWaalsContact C-N 3.3Å; Q127-H129 PolarHBondContact O-N 3.18Å; Q127-Q130 WeakPolarHBondContact O-CG 3.38Å; Q127-Q130 PolarHBondContact O-N 3.29Å; Q127-Q130 PolarHBondContact O-NE2 2.96Å; Q127-I193 HydrophobicContact CB-CD1 4.09Å
128	I	86.2	Confident	81.7	Confident	14 Å²	14	69.9 Å²	69.9	7%	0.072	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-31.7	-179.1	-156.7	-175.9	0	0	0	112.9	R125 A126 Q130 F131 R132 H192 I193 D196	R125-I128 WeakPolarHBondContact O-CG2 3.33Å; R125-I128 PolarHBondContact O-N 3.29Å; A126-I128 PolarHBondContact O-N 3.4Å; I128-Q130 PolarHBondContact O-N 3.43Å; I128-F131 PolarHBondContact O-N 3.35Å; I128-R132 PolarHBondContact O-N 3.44Å; I128-H192 WeakPolarHBondContact CD1-O 3.46Å; I128-I193 HydrophobicContact CB-CD1 3.99Å; I128-I193 HydrophobicContact CG1-CD1 4.35Å; I128-D196 HydrophobicContact CD1-CB 4.11Å
129	H	83.4	Confident	81.4	Confident	100 Å²	100	68.3 Å²	68.3	46%	0.463	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-34.3	-175.9	-73	-79.5	0	0	0	111.8	A126 Q127 F131 R132 E133	A126-H129 PolarHBondContact O-CD2 2.87Å; A126-H129 PolarHBondContact O-N 2.9Å; Q127-H129 VanDerWaalsContact C-N 3.3Å; Q127-H129 PolarHBondContact O-N 3.18Å; H129-F131 PolarHBondContact O-N 3.2Å; H129-F131 VanDerWaalsContact O-N 3.15Å; H129-R132 PolarHBondContact O-N 3.15Å; H129-E133 IonicContact ND1-OE1 3.7Å; H129-E133 WeakPolarHBondContact O-CG 3.49Å; H129-E133 PolarHBondContact O-N 2.88Å; H129-E133 VanDerWaalsContact O-N 3.08Å
130	Q	81.5	Confident	81.1	Confident	35 Å²	35	69.4 Å²	69.4	16%	0.164	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-21.6	179.3	93.3	-172.4	-69.3	0	0	113.8	Q127 I128 R145	Q127-Q130 WeakPolarHBondContact O-CG 3.38Å; Q127-Q130 PolarHBondContact O-N 3.29Å; Q127-Q130 PolarHBondContact O-NE2 2.96Å; I128-Q130 PolarHBondContact O-N 3.43Å; Q130-R145 PolarHBondContact O-NH1 2.94Å
131	F	82.6	Confident	81	Confident	9 Å²	9	70.7 Å²	70.7	4%	0.039	35%	0.353	C	S	.	.	H	α-helix	trans	-96.9	-26.1	178.5	-59.9	-68.2	0	0	0	112.6	I128 H129 F142 R145 M146 C149 I193 V199	I128-F131 PolarHBondContact O-N 3.35Å; H129-F131 PolarHBondContact O-N 3.2Å; H129-F131 VanDerWaalsContact O-N 3.15Å; F131-F142 HydrophobicContact CB-CE2 4.17Å; F131-F142 HydrophobicContact CD1-CD2 4.36Å; F131-F142 AromaticContact CD1-CE2 3.74Å; F131-F142 HydrophobicContact CD1-CE2 3.74Å; F131-F142 HydrophobicContact CD1-CZ 4.24Å; F131-F142 HydrophobicContact CG-CE2 4.39Å; F131-R145 HydrophobicContact CE1-CG 4.22Å; F131-M146 HydrophobicContact CD1-CE 4.02Å; F131-M146 HydrophobicContact CD2-CE 4.41Å; F131-M146 HydrophobicContact CE1-CB 4.28Å; F131-M146 HydrophobicContact CE1-CE 3.73Å; F131-M146 HydrophobicContact CE1-SD 4.31Å; F131-M146 HydrophobicContact CE2-CE 4.15Å; F131-M146 HydrophobicContact CG-CE 4.35Å; F131-M146 HydrophobicContact CZ-CE 3.8Å; F131-M146 HydrophobicContact CZ-SD 4.01Å; F131-C149 HydrophobicContact CE2-CB 4.44Å; F131-C149 HydrophobicContact CZ-CB 3.78Å; F131-I193 HydrophobicContact CD2-CG2 4.3Å; F131-I193 HydrophobicContact CE2-CD1 4.4Å; F131-I193 HydrophobicContact CE2-CG2 3.99Å; F131-V199 HydrophobicContact CB-CG2 3.78Å; F131-V199 HydrophobicContact CG-CG2 4.49Å
132	R	77.7	Confident	80.9	Confident	130 Å²	130	69.6 Å²	69.6	49%	0.491	35%	0.348	S	S	.	.	H	α-helix	trans	-84.7	-35.4	-179.1	-72.4	-176	172.4	178.7	0.4	113.9	I128 H129 D196	I128-R132 PolarHBondContact O-N 3.44Å; H129-R132 PolarHBondContact O-N 3.15Å; R132-D196 IonicContact CZ-OD2 3.66Å; R132-D196 IonicContact NE-OD2 3.63Å; R132-D196 PolarHBondContact NE-OD2 2.87Å; R132-D196 IonicContact NH2-OD2 2.85Å; R132-D196 PolarHBondContact NH2-OD2 2.82Å
133	E	66.6	Low	80.9	Confident	135 Å²	135	66 Å²	66	63%	0.631	33%	0.329	S	S	*	.	S	Bend	trans	-78.1	-20.1	-172.6	-70.3	175.2	-179.8	0	0	113.9	H129	H129-E133 IonicContact ND1-OE1 3.7Å; H129-E133 WeakPolarHBondContact O-CG 3.49Å; H129-E133 PolarHBondContact O-N 2.88Å; H129-E133 VanDerWaalsContact O-N 3.08Å
134	Y	61.6	Low	81	Confident	118 Å²	118	69.8 Å²	69.8	46%	0.463	35%	0.345	S	S	.	.			trans	-108.9	65.6	-176.1	-64	-89.3	0	0	0	112	S136 M137 R202	Y134-S136 PolarHBondContact O-N 3.09Å; Y134-M137 HydrophobicContact CD1-CE 4.46Å; Y134-M137 HydrophobicContact CG-CE 4.1Å; Y134-R202 PolarHBondContact O-NH1 3.29Å; Y134-R202 VanDerWaalsContact O-NH1 3.13Å
135	Q	59.2	Low	81	Confident	172 Å²	172	73.4 Å²	73.4	80%	0.804	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.6	176	-72.6	-177.5	-8.3	0	0	113.3
136	S	60.7	Low	81.1	Confident	121 Å²	121	68 Å²	68	85%	0.846	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	2.1	-177.4	65.9	0	0	0	0	115.6	Y134	Y134-S136 PolarHBondContact O-N 3.09Å
137	M	74	Confident	81.3	Confident	49 Å²	49	66.1 Å²	66.1	24%	0.241	32%	0.32	C	S	.	.	S	Bend	trans	-75.1	147.5	-178.8	-169.9	180	-53.2	0	0	111.5	Y134 F142 R202	Y134-M137 HydrophobicContact CD1-CE 4.46Å; Y134-M137 HydrophobicContact CG-CE 4.1Å; M137-F142 HydrophobicContact SD-CB 4.36Å; M137-R202 PolarHBondContact O-NH2 3.29Å
138	D	83.1	Confident	81.6	Confident	84 Å²	84	71.6 Å²	71.6	45%	0.449	34%	0.338	S	S	.	.			trans	-68.5	154.4	172.1	64.3	-64.1	0	0	0	111.4	L140 S141 F142	D138-L140 VanDerWaalsContact C-N 3.31Å; D138-L140 PolarHBondContact O-N 2.91Å; D138-S141 PolarHBondContact O-N 3.04Å; D138-S141 WeakPolarHBondContact OD1-CB 3.42Å; D138-S141 PolarHBondContact OD1-OG 3.23Å; D138-S141 PolarHBondContact OD2-N 3.43Å; D138-S141 PolarHBondContact OD2-OG 3.16Å; D138-F142 WeakPolarHBondContact O-CB 3.33Å; D138-F142 PolarHBondContact O-N 3.17Å
139	N	83.7	Confident	81.8	Confident	53 Å²	53	71.7 Å²	71.7	28%	0.283	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-37.6	-176.3	-73.1	-17.6	0	0	0	112	F142 L143 E209	N139-F142 WeakPolarHBondContact O-CB 3.49Å; N139-F142 PolarHBondContact O-N 3.4Å; N139-L143 VanDerWaalsContact O-CG 3.31Å; N139-L143 WeakPolarHBondContact O-CG 3.38Å; N139-L143 PolarHBondContact O-N 3.4Å; N139-E209 PolarHBondContact ND2-OE2 3.49Å
140	L	86.8	Confident	82.3	Confident	52 Å²	52	67.5 Å²	67.5	27%	0.272	32%	0.32	S	S	.	.	H	α-helix	trans	-67.5	-45.5	180	-179.7	62	0	0	0	112.4	D138 F142 L143 K144 L224	D138-L140 VanDerWaalsContact C-N 3.31Å; D138-L140 PolarHBondContact O-N 2.91Å; L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 PolarHBondContact O-N 2.88Å; L140-L143 PolarHBondContact O-N 2.82Å; L140-K144 WeakPolarHBondContact O-CG 3.48Å; L140-K144 PolarHBondContact O-N 2.94Å; L140-L224 HydrophobicContact CD1-CD2 3.92Å
141	S	87	Confident	82.9	Confident	49 Å²	49	69.2 Å²	69.2	34%	0.343	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-36.9	174.6	-61.4	0	0	0	0	111.9	D138 K144 R145	D138-S141 PolarHBondContact O-N 3.04Å; D138-S141 WeakPolarHBondContact OD1-CB 3.42Å; D138-S141 PolarHBondContact OD1-OG 3.23Å; D138-S141 PolarHBondContact OD2-N 3.43Å; D138-S141 PolarHBondContact OD2-OG 3.16Å; S141-K144 PolarHBondContact O-N 2.83Å; S141-R145 WeakPolarHBondContact O-CB 3.23Å; S141-R145 PolarHBondContact O-N 3.34Å
142	F	89.8	Confident	83.3	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.018	34%	0.337	C	S	.	.	H	α-helix	trans	-60.8	-46.5	173.7	177.8	-93	0	0	0	111.7	F131 M137 D138 N139 L140 R145 M146 V199 R202 T203	F131-F142 HydrophobicContact CB-CE2 4.17Å; F131-F142 HydrophobicContact CD1-CD2 4.36Å; F131-F142 AromaticContact CD1-CE2 3.74Å; F131-F142 HydrophobicContact CD1-CE2 3.74Å; F131-F142 HydrophobicContact CD1-CZ 4.24Å; F131-F142 HydrophobicContact CG-CE2 4.39Å; M137-F142 HydrophobicContact SD-CB 4.36Å; D138-F142 WeakPolarHBondContact O-CB 3.33Å; D138-F142 PolarHBondContact O-N 3.17Å; N139-F142 WeakPolarHBondContact O-CB 3.49Å; N139-F142 PolarHBondContact O-N 3.4Å; L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 PolarHBondContact O-N 2.88Å; F142-R145 PolarHBondContact O-N 3.13Å; F142-M146 HydrophobicContact CZ-CE 4.39Å; F142-M146 PolarHBondContact O-N 3.48Å; F142-V199 HydrophobicContact CZ-CG1 4.19Å; F142-R202 HydrophobicContact CD1-CB 4.48Å; F142-R202 HydrophobicContact CD1-CG 3.86Å; F142-R202 HydrophobicContact CE1-CB 3.95Å; F142-R202 HydrophobicContact CE1-CG 3.82Å; F142-R202 HydrophobicContact CG-CG 4.25Å; F142-R202 HydrophobicContact CZ-CB 4.15Å; F142-R202 HydrophobicContact CZ-CG 4.17Å; F142-T203 WeakPolarHBondContact CE1-OG1 3.18Å
143	L	91.1	Very high	84	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-44.3	176.6	-68.4	-176.3	0	0	0	112.3	N139 L140 R145 M146 N147 T203 I207 Q210 L224 L228	N139-L143 VanDerWaalsContact O-CG 3.31Å; N139-L143 WeakPolarHBondContact O-CG 3.38Å; N139-L143 PolarHBondContact O-N 3.4Å; L140-L143 PolarHBondContact O-N 2.82Å; L143-R145 VanDerWaalsContact C-N 3.28Å; L143-R145 PolarHBondContact O-N 3.4Å; L143-M146 PolarHBondContact O-N 3.35Å; L143-N147 WeakPolarHBondContact O-CB 3.27Å; L143-N147 PolarHBondContact O-N 3.44Å; L143-T203 HydrophobicContact CD2-CG2 4.17Å; L143-I207 HydrophobicContact CD1-CG1 4.35Å; L143-I207 HydrophobicContact CD2-CG1 4.04Å; L143-Q210 HydrophobicContact CD1-CG 4.12Å; L143-L224 HydrophobicContact CB-CD2 4.12Å; L143-L228 HydrophobicContact CB-CD1 3.8Å; L143-L228 HydrophobicContact CD1-CD1 4.43Å; L143-L228 HydrophobicContact CD2-CD1 3.97Å; L143-L228 HydrophobicContact CG-CD1 4.26Å
144	K	91.8	Very high	85.2	Confident	106 Å²	106	60 Å²	60	46%	0.461	29%	0.293	S	S	.	.	H	α-helix	trans	-60.3	-39.5	176	-74	178.5	179.2	175.7	0	111.8	L140 S141 N147 R148 L224	L140-K144 WeakPolarHBondContact O-CG 3.48Å; L140-K144 PolarHBondContact O-N 2.94Å; S141-K144 PolarHBondContact O-N 2.83Å; K144-N147 PolarHBondContact O-N 2.83Å; K144-R148 PolarHBondContact O-N 3.18Å; K144-L224 HydrophobicContact CG-CD1 4.37Å; K144-L224 HydrophobicContact CG-CD2 3.72Å
145	R	90.2	Very high	86.6	Confident	81 Å²	81	62 Å²	62	31%	0.306	30%	0.3	S	S	.	.	H	α-helix	trans	-68	-43.9	176.9	-168.1	172.9	-166.2	-174.4	13.1	112	Q130 F131 S141 F142 L143 N147 R148 C149	Q130-R145 PolarHBondContact O-NH1 2.94Å; F131-R145 HydrophobicContact CE1-CG 4.22Å; S141-R145 WeakPolarHBondContact O-CB 3.23Å; S141-R145 PolarHBondContact O-N 3.34Å; F142-R145 PolarHBondContact O-N 3.13Å; L143-R145 VanDerWaalsContact C-N 3.28Å; L143-R145 PolarHBondContact O-N 3.4Å; R145-N147 VanDerWaalsContact C-N 3.32Å; R145-N147 PolarHBondContact O-N 3.23Å; R145-R148 PolarHBondContact O-N 3.47Å; R145-C149 WeakPolarHBondContact O-CB 3.41Å; R145-C149 PolarHBondContact O-N 3.18Å
146	M	90.9	Very high	88.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-47.4	174.3	-179.5	56.4	70.7	0	0	110.8	F131 F142 L143 R148 C149 W150 F189 I193 V199 L228 M231	F131-M146 HydrophobicContact CD1-CE 4.02Å; F131-M146 HydrophobicContact CD2-CE 4.41Å; F131-M146 HydrophobicContact CE1-CB 4.28Å; F131-M146 HydrophobicContact CE1-CE 3.73Å; F131-M146 HydrophobicContact CE1-SD 4.31Å; F131-M146 HydrophobicContact CE2-CE 4.15Å; F131-M146 HydrophobicContact CG-CE 4.35Å; F131-M146 HydrophobicContact CZ-CE 3.8Å; F131-M146 HydrophobicContact CZ-SD 4.01Å; F142-M146 HydrophobicContact CZ-CE 4.39Å; F142-M146 PolarHBondContact O-N 3.48Å; L143-M146 PolarHBondContact O-N 3.35Å; M146-R148 PolarHBondContact O-N 2.93Å; M146-C149 WeakPolarHBondContact O-CB 3.49Å; M146-C149 PolarHBondContact O-N 3.17Å; M146-W150 WeakPolarHBondContact O-CB 3.13Å; M146-W150 PolarHBondContact O-N 3.41Å; M146-F189 HydrophobicContact SD-CZ 4.18Å; M146-I193 HydrophobicContact CE-CG2 3.89Å; M146-I193 HydrophobicContact SD-CG2 4.04Å; M146-V199 HydrophobicContact CE-CG1 3.23Å; M146-L228 HydrophobicContact CB-CD2 4.14Å; M146-L228 HydrophobicContact CG-CD2 3.8Å; M146-M231 HydrophobicContact CG-CE 4.09Å; M146-M231 HydrophobicContact CG-SD 4.35Å; M146-M231 HydrophobicContact SD-SD 4.42Å
147	N	93.4	Very high	89.6	Confident	18 Å²	18	49.6 Å²	49.6	10%	0.096	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-41.9	179.6	-174.3	49.3	0	0	0	112.6	L143 K144 R145 W150 Q151 L224 S227 L228	L143-N147 WeakPolarHBondContact O-CB 3.27Å; L143-N147 PolarHBondContact O-N 3.44Å; K144-N147 PolarHBondContact O-N 2.83Å; R145-N147 VanDerWaalsContact C-N 3.32Å; R145-N147 PolarHBondContact O-N 3.23Å; N147-W150 PolarHBondContact O-N 3.27Å; N147-Q151 PolarHBondContact ND2-NE2 3.4Å; N147-Q151 VanDerWaalsContact ND2-NE2 3.19Å; N147-Q151 WeakPolarHBondContact O-CB 3.46Å; N147-Q151 VanDerWaalsContact O-CG 3.28Å; N147-Q151 WeakPolarHBondContact O-CG 3.3Å; N147-Q151 PolarHBondContact O-N 3.39Å; N147-L224 HydrophobicContact CB-CD1 3.4Å; N147-L224 VanDerWaalsContact CB-CD1 3.4Å; N147-S227 WeakPolarHBondContact OD1-CB 3.35Å; N147-S227 PolarHBondContact OD1-OG 3.36Å; N147-L228 HydrophobicContact CB-CD2 3.86Å; N147-L228 HydrophobicContact CB-CG 4.08Å
148	R	92.1	Very high	90.4	Very high	174 Å²	174	52.1 Å²	52.1	66%	0.657	24%	0.243	S	C	*	.	H	α-helix	trans	-62.9	-46.7	175.4	-176.3	174.9	-179.3	168.5	1.8	111.5	K144 R145 M146 W150 Q151 D152	K144-R148 PolarHBondContact O-N 3.18Å; R145-R148 PolarHBondContact O-N 3.47Å; M146-R148 PolarHBondContact O-N 2.93Å; R148-W150 VanDerWaalsContact C-N 3.26Å; R148-W150 PolarHBondContact O-N 3.48Å; R148-Q151 PolarHBondContact O-N 3.24Å; R148-D152 WeakPolarHBondContact CG-OD2 2.99Å; R148-D152 IonicContact NE-OD2 3.62Å; R148-D152 WeakPolarHBondContact O-CB 3.32Å; R148-D152 VanDerWaalsContact O-CG 3.29Å; R148-D152 PolarHBondContact O-N 2.97Å
149	C	91.8	Very high	90.6	Very high	15 Å²	15	52.1 Å²	52.1	10%	0.101	24%	0.241	C	C	.	.	H	α-helix	trans	-57.8	-41.2	177.1	-173.7	0	0	0	0	111.7	F131 R145 M146 H153	F131-C149 HydrophobicContact CE2-CB 4.44Å; F131-C149 HydrophobicContact CZ-CB 3.78Å; R145-C149 WeakPolarHBondContact O-CB 3.41Å; R145-C149 PolarHBondContact O-N 3.18Å; M146-C149 WeakPolarHBondContact O-CB 3.49Å; M146-C149 PolarHBondContact O-N 3.17Å; C149-H153 VanDerWaalsContact O-CB 3.29Å; C149-H153 WeakPolarHBondContact O-CB 3.31Å; C149-H153 PolarHBondContact O-N 2.73Å
150	W	93.6	Very high	90.9	Very high	13 Å²	13	49.8 Å²	49.8	5%	0.049	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-50.6	175.4	171.6	-117.7	0	0	0	112.7	M146 N147 R148 D152 H153 C154 L186 F189 M231 D234 L235	M146-W150 WeakPolarHBondContact O-CB 3.13Å; M146-W150 PolarHBondContact O-N 3.41Å; N147-W150 PolarHBondContact O-N 3.27Å; R148-W150 VanDerWaalsContact C-N 3.26Å; R148-W150 PolarHBondContact O-N 3.48Å; W150-D152 VanDerWaalsContact C-N 3.3Å; W150-D152 PolarHBondContact O-N 3.06Å; W150-H153 PolarHBondContact O-N 3.3Å; W150-C154 WeakPolarHBondContact CZ2-SG 3.34Å; W150-C154 PolarHBondContact O-N 2.76Å; W150-C154 PolarHBondContact O-SG 3.34Å; W150-C154 VanDerWaalsContact O-SG 3.37Å; W150-L186 HydrophobicContact CH2-CD2 3.43Å; W150-L186 VanDerWaalsContact CH2-CD2 3.43Å; W150-L186 HydrophobicContact CZ2-CD2 4.43Å; W150-L186 HydrophobicContact CZ3-CD2 4.07Å; W150-F189 HydrophobicContact CB-CZ 4.17Å; W150-F189 AromaticContact CE3-CD1 3.74Å; W150-F189 HydrophobicContact CE3-CD1 3.74Å; W150-F189 HydrophobicContact CE3-CD2 4.31Å; W150-F189 AromaticContact CE3-CE1 3.65Å; W150-F189 HydrophobicContact CE3-CE1 3.65Å; W150-F189 HydrophobicContact CE3-CE2 4.24Å; W150-F189 HydrophobicContact CE3-CG 4.07Å; W150-F189 AromaticContact CE3-CZ 3.92Å; W150-F189 HydrophobicContact CE3-CZ 3.92Å; W150-F189 HydrophobicContact CZ3-CB 4.45Å; W150-F189 AromaticContact CZ3-CD1 3.82Å; W150-F189 HydrophobicContact CZ3-CD1 3.82Å; W150-F189 HydrophobicContact CZ3-CE1 4.2Å; W150-F189 HydrophobicContact CZ3-CG 4.06Å; W150-M231 HydrophobicContact CB-CG 4.38Å; W150-M231 HydrophobicContact CB-SD 3.7Å; W150-M231 HydrophobicContact CD2-CB 3.97Å; W150-M231 HydrophobicContact CD2-CG 3.46Å; W150-M231 VanDerWaalsContact CD2-CG 3.46Å; W150-M231 HydrophobicContact CD2-SD 3.93Å; W150-M231 HydrophobicContact CE3-CG 3.85Å; W150-M231 HydrophobicContact CE3-SD 4.25Å; W150-M231 HydrophobicContact CG-CB 3.98Å; W150-M231 HydrophobicContact CG-CG 3.7Å; W150-M231 HydrophobicContact CG-SD 3.69Å; W150-M231 HydrophobicContact CH2-CG 4.31Å; W150-M231 HydrophobicContact CZ2-CB 4.15Å; W150-M231 HydrophobicContact CZ2-CG 4.02Å; W150-M231 HydrophobicContact CZ3-CG 4.26Å; W150-D234 HydrophobicContact CH2-CB 4.36Å; W150-D234 HydrophobicContact CZ2-CB 4.09Å; W150-L235 HydrophobicContact CH2-CD2 3.98Å; W150-L235 HydrophobicContact CH2-CG 4.14Å; W150-L235 HydrophobicContact CZ3-CD1 4.37Å; W150-L235 HydrophobicContact CZ3-CD2 3.89Å; W150-L235 HydrophobicContact CZ3-CG 4.24Å
151	Q	93.3	Very high	91.1	Very high	70 Å²	70	52.2 Å²	52.2	33%	0.327	23%	0.234	S	C	.	.	H	α-helix	trans	-60.9	-40.8	-179.8	-72.8	179.9	-1.6	0	0	112.1	N147 R148 R155 S227	N147-Q151 PolarHBondContact ND2-NE2 3.4Å; N147-Q151 VanDerWaalsContact ND2-NE2 3.19Å; N147-Q151 WeakPolarHBondContact O-CB 3.46Å; N147-Q151 VanDerWaalsContact O-CG 3.28Å; N147-Q151 WeakPolarHBondContact O-CG 3.3Å; N147-Q151 PolarHBondContact O-N 3.39Å; R148-Q151 PolarHBondContact O-N 3.24Å; Q151-R155 VanDerWaalsContact O-CG 3.31Å; Q151-R155 WeakPolarHBondContact O-CG 3.38Å; Q151-R155 PolarHBondContact O-N 3Å; Q151-S227 PolarHBondContact NE2-OG 3.41Å
152	D	91.7	Very high	91.3	Very high	44 Å²	44	52.6 Å²	52.6	24%	0.235	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-46.3	176.6	-69.4	-20.5	0	0	0	110.2	R148 W150 C154 R155 Q156	R148-D152 WeakPolarHBondContact CG-OD2 2.99Å; R148-D152 IonicContact NE-OD2 3.62Å; R148-D152 WeakPolarHBondContact O-CB 3.32Å; R148-D152 VanDerWaalsContact O-CG 3.29Å; R148-D152 PolarHBondContact O-N 2.97Å; W150-D152 VanDerWaalsContact C-N 3.3Å; W150-D152 PolarHBondContact O-N 3.06Å; D152-C154 PolarHBondContact O-N 3.14Å; D152-R155 PolarHBondContact O-N 3.5Å; D152-R155 IonicContact OD1-NH1 2.95Å; D152-Q156 WeakPolarHBondContact O-CB 3.12Å; D152-Q156 WeakPolarHBondContact O-CG 3.27Å; D152-Q156 PolarHBondContact O-N 2.92Å
153	H	91.9	Very high	91.2	Very high	19 Å²	19	52.5 Å²	52.5	9%	0.088	24%	0.236	C	C	.	.	H	α-helix	trans	-57.7	-43.8	175.4	-179.6	69.1	0	0	0	113	C149 W150 Q156 T157 G185 F189	C149-H153 VanDerWaalsContact O-CB 3.29Å; C149-H153 WeakPolarHBondContact O-CB 3.31Å; C149-H153 PolarHBondContact O-N 2.73Å; W150-H153 PolarHBondContact O-N 3.3Å; H153-Q156 PolarHBondContact O-N 3.09Å; H153-T157 VanDerWaalsContact O-CB 3.3Å; H153-T157 WeakPolarHBondContact O-CB 3.44Å; H153-T157 PolarHBondContact O-N 3.14Å; H153-T157 PolarHBondContact O-OG1 2.86Å; H153-G185 PolarHBondContact NE2-O 3.44Å; H153-F189 HydrophobicContact CB-CD2 4.16Å; H153-F189 HydrophobicContact CB-CE2 4.26Å; H153-F189 AromaticContact CD2-CD2 3.67Å; H153-F189 AromaticContact CG-CD2 3.81Å
154	C	91.9	Very high	91.3	Very high	18 Å²	18	52.5 Å²	52.5	12%	0.122	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-48.9	176	-71.8	0	0	0	0	111.9	W150 D152 Q156 T157 I158 W182	W150-C154 WeakPolarHBondContact CZ2-SG 3.34Å; W150-C154 PolarHBondContact O-N 2.76Å; W150-C154 PolarHBondContact O-SG 3.34Å; W150-C154 VanDerWaalsContact O-SG 3.37Å; D152-C154 PolarHBondContact O-N 3.14Å; C154-Q156 VanDerWaalsContact C-N 3.35Å; C154-Q156 PolarHBondContact O-N 3.24Å; C154-T157 PolarHBondContact O-N 3.13Å; C154-I158 VanDerWaalsContact O-CG1 3.31Å; C154-I158 WeakPolarHBondContact O-CG1 3.38Å; C154-I158 PolarHBondContact O-N 3.25Å; C154-W182 HydrophobicContact CB-CH2 3.93Å; C154-W182 HydrophobicContact CB-CZ3 4.46Å
155	R	91.1	Very high	91.2	Very high	160 Å²	160	50.1 Å²	50.1	60%	0.604	23%	0.229	S	C	*	.	H	α-helix	trans	-61.2	-44.9	179	-72.8	172.6	-175.9	165.7	2	111.5	Q151 D152 I158 M159	Q151-R155 VanDerWaalsContact O-CG 3.31Å; Q151-R155 WeakPolarHBondContact O-CG 3.38Å; Q151-R155 PolarHBondContact O-N 3Å; D152-R155 PolarHBondContact O-N 3.5Å; D152-R155 IonicContact OD1-NH1 2.95Å; R155-I158 PolarHBondContact O-N 3.42Å; R155-M159 PolarHBondContact O-N 2.98Å
156	Q	91.1	Very high	91.2	Very high	23 Å²	23	48.4 Å²	48.4	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-43.2	178.1	-69.9	171.6	1.1	0	0	111.4	I83 Q84 D152 H153 C154 M159 I160	I83-Q156 HydrophobicContact CG2-CB 3.87Å; I83-Q156 HydrophobicContact CG2-CG 3.97Å; I83-Q156 WeakPolarHBondContact O-CG 3.29Å; I83-Q156 PolarHBondContact O-NE2 3.37Å; Q84-Q156 PolarHBondContact O-NE2 2.98Å; D152-Q156 WeakPolarHBondContact O-CB 3.12Å; D152-Q156 WeakPolarHBondContact O-CG 3.27Å; D152-Q156 PolarHBondContact O-N 2.92Å; H153-Q156 PolarHBondContact O-N 3.09Å; C154-Q156 VanDerWaalsContact C-N 3.35Å; C154-Q156 PolarHBondContact O-N 3.24Å; Q156-M159 WeakPolarHBondContact O-CB 3.05Å; Q156-M159 PolarHBondContact O-N 2.87Å; Q156-I160 VanDerWaalsContact O-CG1 3.29Å; Q156-I160 WeakPolarHBondContact O-CG1 3.45Å; Q156-I160 PolarHBondContact O-N 3.42Å
157	T	90.6	Very high	91.1	Very high	10 Å²	10	48.4 Å²	48.4	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-37.7	178.4	-56.7	0	0	0	0	112.1	H153 C154 M159 I160 R161 W182	H153-T157 VanDerWaalsContact O-CB 3.3Å; H153-T157 WeakPolarHBondContact O-CB 3.44Å; H153-T157 PolarHBondContact O-N 3.14Å; H153-T157 PolarHBondContact O-OG1 2.86Å; C154-T157 PolarHBondContact O-N 3.13Å; T157-M159 VanDerWaalsContact C-N 3.32Å; T157-M159 PolarHBondContact O-N 3.12Å; T157-I160 PolarHBondContact O-N 2.92Å; T157-R161 VanDerWaalsContact O-CB 3.32Å; T157-R161 WeakPolarHBondContact O-CB 3.42Å; T157-R161 PolarHBondContact O-N 3.43Å; T157-W182 HydrophobicContact CG2-CE3 3.74Å; T157-W182 HydrophobicContact CG2-CZ3 4.16Å
158	I	90.8	Very high	90.8	Very high	102 Å²	102	48 Å²	48	52%	0.523	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-43	172.3	-68.9	163.7	0	0	0	110.4	C154 R155 R161 S162 W182	C154-I158 VanDerWaalsContact O-CG1 3.31Å; C154-I158 WeakPolarHBondContact O-CG1 3.38Å; C154-I158 PolarHBondContact O-N 3.25Å; R155-I158 PolarHBondContact O-N 3.42Å; I158-R161 WeakPolarHBondContact O-CB 3.36Å; I158-R161 PolarHBondContact O-N 3.4Å; I158-S162 PolarHBondContact O-N 2.78Å; I158-W182 HydrophobicContact CD1-CH2 4.3Å; I158-W182 HydrophobicContact CD1-CZ3 4.14Å; I158-W182 HydrophobicContact CG1-CE3 4.15Å; I158-W182 HydrophobicContact CG1-CH2 4.18Å; I158-W182 HydrophobicContact CG1-CZ3 3.54Å
159	M	88.5	Confident	90.7	Very high	84 Å²	84	47.9 Å²	47.9	41%	0.414	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-44.5	179.1	-166.7	175.4	-67.2	0	0	111.7	I83 I89 R155 Q156 T157 R161 S162 I163	I83-M159 HydrophobicContact CB-SD 4.48Å; I83-M159 HydrophobicContact CD1-CB 4.47Å; I83-M159 HydrophobicContact CD1-CG 3.89Å; I83-M159 HydrophobicContact CD1-SD 3.96Å; I83-M159 HydrophobicContact CG1-CG 4.3Å; I83-M159 HydrophobicContact CG1-SD 3.71Å; I83-M159 HydrophobicContact CG2-CB 4.17Å; I83-M159 HydrophobicContact CG2-CG 4.4Å; I83-M159 HydrophobicContact CG2-SD 4.03Å; I89-M159 HydrophobicContact CD1-SD 4.37Å; R155-M159 PolarHBondContact O-N 2.98Å; Q156-M159 WeakPolarHBondContact O-CB 3.05Å; Q156-M159 PolarHBondContact O-N 2.87Å; T157-M159 VanDerWaalsContact C-N 3.32Å; T157-M159 PolarHBondContact O-N 3.12Å; M159-R161 VanDerWaalsContact C-N 3.32Å; M159-R161 PolarHBondContact O-N 3.46Å; M159-S162 PolarHBondContact O-N 3.44Å; M159-S162 VanDerWaalsContact O-N 3.13Å; M159-S162 PolarHBondContact O-OG 3.2Å; M159-I163 PolarHBondContact O-N 3.12Å
160	I	90.4	Very high	90.4	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-45.9	173.1	-67.3	165.3	0	0	0	109.9	V80 I83 Q84 L116 Q156 T157 S162 I163 F164 I181	V80-I160 HydrophobicContact CG1-CD1 4.04Å; V80-I160 HydrophobicContact CG1-CG1 4.46Å; V80-I160 HydrophobicContact CG2-CG1 4.49Å; I83-I160 HydrophobicContact CD1-CG1 4.31Å; I83-I160 HydrophobicContact CG2-CG1 4.29Å; Q84-I160 HydrophobicContact CG-CD1 4.43Å; L116-I160 HydrophobicContact CD1-CG2 3.96Å; L116-I160 HydrophobicContact CD2-CG2 4.25Å; Q156-I160 VanDerWaalsContact O-CG1 3.29Å; Q156-I160 WeakPolarHBondContact O-CG1 3.45Å; Q156-I160 PolarHBondContact O-N 3.42Å; T157-I160 PolarHBondContact O-N 2.92Å; I160-S162 PolarHBondContact O-N 3.08Å; I160-I163 PolarHBondContact O-N 3.04Å; I160-F164 HydrophobicContact CG2-CD2 3.88Å; I160-F164 HydrophobicContact CG2-CE2 4.25Å; I160-F164 VanDerWaalsContact O-CD2 3.32Å; I160-F164 WeakPolarHBondContact O-CD2 3.39Å; I160-F164 PolarHBondContact O-N 2.97Å; I160-I181 HydrophobicContact CG2-CG2 4.24Å
161	R	91	Very high	90	Very high	103 Å²	103	51.2 Å²	51.2	39%	0.389	24%	0.236	S	C	.	.	H	α-helix	trans	-59.2	-35.9	176.7	-174.8	-179.3	-178.1	-163.9	-2.6	112.5	T157 I158 M159 F164 L165 D168 I181	T157-R161 VanDerWaalsContact O-CB 3.32Å; T157-R161 WeakPolarHBondContact O-CB 3.42Å; T157-R161 PolarHBondContact O-N 3.43Å; I158-R161 WeakPolarHBondContact O-CB 3.36Å; I158-R161 PolarHBondContact O-N 3.4Å; M159-R161 VanDerWaalsContact C-N 3.32Å; M159-R161 PolarHBondContact O-N 3.46Å; R161-F164 CarbonylContact O-C 3.52Å; R161-F164 PolarHBondContact O-N 3.32Å; R161-L165 VanDerWaalsContact O-CA 3.27Å; R161-L165 WeakPolarHBondContact O-CA 3.34Å; R161-L165 PolarHBondContact O-N 2.92Å; R161-D168 IonicContact CZ-OD2 2.63Å; R161-D168 IonicContact NE-OD2 3.02Å; R161-D168 PolarHBondContact NE-OD2 2.66Å; R161-D168 IonicContact NH2-OD2 3.33Å; R161-I181 HydrophobicContact CB-CG2 4.42Å
162	S	89.6	Confident	89.7	Confident	56 Å²	56	48.2 Å²	48.2	39%	0.392	22%	0.223	S	C	.	.	H	α-helix	trans	-66.5	-40.2	177.7	75.8	0	0	0	0	112.6	I158 M159 I160 L165	I158-S162 PolarHBondContact O-N 2.78Å; M159-S162 PolarHBondContact O-N 3.44Å; M159-S162 VanDerWaalsContact O-N 3.13Å; M159-S162 PolarHBondContact O-OG 3.2Å; I160-S162 PolarHBondContact O-N 3.08Å; S162-L165 WeakPolarHBondContact O-CB 3.29Å
163	I	89.6	Confident	89.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-43.3	175.4	-66.2	168.3	0	0	0	110.7	L76 I83 L93 L96 V100 M159 I160 L165	L76-I163 HydrophobicContact CD2-CG2 4.22Å; I83-I163 HydrophobicContact CD1-CD1 3.47Å; I83-I163 VanDerWaalsContact CD1-CD1 3.47Å; L93-I163 HydrophobicContact CD2-CD1 3.88Å; L93-I163 HydrophobicContact CD2-CG1 3.84Å; L96-I163 HydrophobicContact CB-CG2 3.78Å; L96-I163 HydrophobicContact CD1-CD1 4.15Å; V100-I163 HydrophobicContact CG2-CG2 4.39Å; M159-I163 PolarHBondContact O-N 3.12Å; I160-I163 PolarHBondContact O-N 3.04Å; I163-L165 VanDerWaalsContact C-N 3.3Å; I163-L165 PolarHBondContact O-N 3.18Å
164	F	91.3	Very high	89.2	Confident	1 Å²	1	59 Å²	59	0%	0.004	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	21.9	-177.8	-69.2	-94.5	0	0	0	113.2	L76 V80 V100 L112 L116 I160 R161 F166 L167 D168 I181	L76-F164 HydrophobicContact CB-CZ 4.13Å; L76-F164 HydrophobicContact CD1-CE1 4.25Å; L76-F164 HydrophobicContact CD1-CZ 4.38Å; L76-F164 HydrophobicContact CD2-CZ 4.25Å; L76-F164 HydrophobicContact CG-CZ 4.49Å; V80-F164 HydrophobicContact CG2-CE2 3.69Å; V80-F164 HydrophobicContact CG2-CZ 4.16Å; V100-F164 HydrophobicContact CG1-CD1 4.06Å; V100-F164 HydrophobicContact CG2-CD1 3.7Å; V100-F164 HydrophobicContact CG2-CE1 3.83Å; V100-F164 HydrophobicContact CG2-CG 4.23Å; V100-F164 HydrophobicContact CG2-CZ 4.43Å; L112-F164 HydrophobicContact CD1-CE1 4.23Å; L112-F164 HydrophobicContact CD2-CE1 4.43Å; L112-F164 HydrophobicContact CG-CE1 4.31Å; L116-F164 HydrophobicContact CD1-CD2 4.33Å; L116-F164 HydrophobicContact CD1-CE1 4.4Å; L116-F164 HydrophobicContact CD1-CE2 3.83Å; L116-F164 HydrophobicContact CD1-CZ 3.85Å; L116-F164 HydrophobicContact CD2-CB 4.29Å; L116-F164 HydrophobicContact CD2-CD1 3.81Å; L116-F164 HydrophobicContact CD2-CD2 3.97Å; L116-F164 HydrophobicContact CD2-CE1 4.04Å; L116-F164 HydrophobicContact CD2-CE2 4.21Å; L116-F164 HydrophobicContact CD2-CG 3.76Å; L116-F164 HydrophobicContact CD2-CZ 4.22Å; I160-F164 HydrophobicContact CG2-CD2 3.88Å; I160-F164 HydrophobicContact CG2-CE2 4.25Å; I160-F164 VanDerWaalsContact O-CD2 3.32Å; I160-F164 WeakPolarHBondContact O-CD2 3.39Å; I160-F164 PolarHBondContact O-N 2.97Å; R161-F164 CarbonylContact O-C 3.52Å; R161-F164 PolarHBondContact O-N 3.32Å; F164-F166 VanDerWaalsContact C-N 3.26Å; F164-F166 PolarHBondContact O-N 3.23Å; F164-L167 HydrophobicContact CB-CB 4.42Å; F164-L167 HydrophobicContact CD1-CD2 3.95Å; F164-L167 WeakPolarHBondContact O-CB 3.32Å; F164-L167 PolarHBondContact O-N 3.33Å; F164-D168 PolarHBondContact O-N 3.24Å; F164-I181 HydrophobicContact CB-CD1 3.45Å; F164-I181 VanDerWaalsContact CB-CD1 3.45Å; F164-I181 HydrophobicContact CG-CD1 4.46Å
165	L	91	Very high	88.9	Confident	56 Å²	56	61.1 Å²	61.1	29%	0.293	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-37.3	-173.9	178	67.7	0	0	0	112.3	Y97 R161 S162 I163 D168 R169	Y97-L165 HydrophobicContact CD2-CB 4.34Å; Y97-L165 HydrophobicContact CE2-CB 3.99Å; Y97-L165 HydrophobicContact CE2-CD2 4.47Å; R161-L165 VanDerWaalsContact O-CA 3.27Å; R161-L165 WeakPolarHBondContact O-CA 3.34Å; R161-L165 PolarHBondContact O-N 2.92Å; S162-L165 WeakPolarHBondContact O-CB 3.29Å; I163-L165 VanDerWaalsContact C-N 3.3Å; I163-L165 PolarHBondContact O-N 3.18Å; L165-D168 PolarHBondContact O-N 3.22Å; L165-R169 HydrophobicContact CD1-CG 4.2Å; L165-R169 WeakPolarHBondContact O-CB 3.32Å; L165-R169 PolarHBondContact O-N 2.99Å
166	F	89.4	Confident	88.4	Confident	45 Å²	45	59.5 Å²	59.5	20%	0.197	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-41.1	176.4	-168.4	-91.5	0	0	0	111.6	Y97 E101 C104 F164 T170	Y97-F166 HydrophobicContact CE2-CB 3.93Å; E101-F166 HydrophobicContact CB-CB 4.42Å; E101-F166 HydrophobicContact CB-CD1 4.23Å; E101-F166 HydrophobicContact CB-CD2 4.18Å; E101-F166 HydrophobicContact CB-CG 4.02Å; E101-F166 HydrophobicContact CG-CD1 4.32Å; E101-F166 HydrophobicContact CG-CD2 3.9Å; E101-F166 HydrophobicContact CG-CE1 4.19Å; E101-F166 HydrophobicContact CG-CE2 3.76Å; E101-F166 HydrophobicContact CG-CG 4.17Å; E101-F166 HydrophobicContact CG-CZ 3.91Å; C104-F166 HydrophobicContact CB-CD1 3.61Å; C104-F166 HydrophobicContact CB-CE1 3.57Å; F164-F166 VanDerWaalsContact C-N 3.26Å; F164-F166 PolarHBondContact O-N 3.23Å; F166-T170 HydrophobicContact CD1-CG2 4.11Å; F166-T170 HydrophobicContact CD2-CG2 4.3Å; F166-T170 HydrophobicContact CE1-CG2 3.85Å; F166-T170 HydrophobicContact CE2-CG2 4.05Å; F166-T170 HydrophobicContact CG-CG2 4.34Å; F166-T170 HydrophobicContact CZ-CG2 3.83Å; F166-T170 WeakPolarHBondContact O-CB 3.33Å; F166-T170 WeakPolarHBondContact O-CG2 3.43Å; F166-T170 PolarHBondContact O-N 3.34Å; F166-T170 PolarHBondContact O-OG1 2.9Å
167	L	88.2	Confident	88.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-43.9	177.2	-179.6	67.9	0	0	0	111.5	V100 L112 F164 Y171 V172	V100-L167 HydrophobicContact CG1-CB 3.95Å; L112-L167 HydrophobicContact CD2-CD1 4.47Å; L112-L167 HydrophobicContact CD2-CD2 4.19Å; L112-L167 HydrophobicContact CG-CD2 4.15Å; F164-L167 HydrophobicContact CB-CB 4.42Å; F164-L167 HydrophobicContact CD1-CD2 3.95Å; F164-L167 WeakPolarHBondContact O-CB 3.32Å; F164-L167 PolarHBondContact O-N 3.33Å; L167-Y171 HydrophobicContact CD1-CD1 4.18Å; L167-Y171 HydrophobicContact CD1-CG 4.47Å; L167-Y171 PolarHBondContact O-N 3.41Å; L167-Y171 VanDerWaalsContact O-N 3.16Å; L167-V172 PolarHBondContact O-N 3.16Å; L167-V172 VanDerWaalsContact O-N 3.14Å
168	D	88.8	Confident	87.9	Confident	9 Å²	9	68.3 Å²	68.3	5%	0.048	35%	0.345	C	S	.	.	I	π-helix	trans	-63.7	-44	179.5	-159.9	31.4	0	0	0	111.2	R161 F164 L165 L173 I181	R161-D168 IonicContact CZ-OD2 2.63Å; R161-D168 IonicContact NE-OD2 3.02Å; R161-D168 PolarHBondContact NE-OD2 2.66Å; R161-D168 IonicContact NH2-OD2 3.33Å; F164-D168 PolarHBondContact O-N 3.24Å; L165-D168 PolarHBondContact O-N 3.22Å; D168-L173 WeakPolarHBondContact O-CB 3.43Å; D168-L173 PolarHBondContact O-N 3.49Å; D168-I181 HydrophobicContact CB-CD1 3.94Å; D168-I181 HydrophobicContact CB-CG1 4.25Å; D168-I181 PolarHBondContact OD1-N 2.68Å
169	R	88.6	Confident	87.8	Confident	172 Å²	172	65.4 Å²	65.4	65%	0.649	33%	0.332	S	S	*	.	I	π-helix	trans	-83.6	-18.6	-176.7	-76.5	-169.5	149.3	161.3	-3	115.9	L165 L173	L165-R169 HydrophobicContact CD1-CG 4.2Å; L165-R169 WeakPolarHBondContact O-CB 3.32Å; L165-R169 PolarHBondContact O-N 2.99Å; R169-L173 WeakPolarHBondContact O-CB 3.31Å; R169-L173 WeakPolarHBondContact O-CD2 3.45Å
170	T	87.1	Confident	88	Confident	42 Å²	42	62.6 Å²	62.6	26%	0.258	32%	0.321	S	S	.	.	I	π-helix	trans	-102.3	-67.1	179.9	60	0	0	0	0	111.4	F166 Q174	F166-T170 HydrophobicContact CD1-CG2 4.11Å; F166-T170 HydrophobicContact CD2-CG2 4.3Å; F166-T170 HydrophobicContact CE1-CG2 3.85Å; F166-T170 HydrophobicContact CE2-CG2 4.05Å; F166-T170 HydrophobicContact CG-CG2 4.34Å; F166-T170 HydrophobicContact CZ-CG2 3.83Å; F166-T170 WeakPolarHBondContact O-CB 3.33Å; F166-T170 WeakPolarHBondContact O-CG2 3.43Å; F166-T170 PolarHBondContact O-N 3.34Å; F166-T170 PolarHBondContact O-OG1 2.9Å; T170-Q174 WeakPolarHBondContact O-CB 3.4Å; T170-Q174 WeakPolarHBondContact O-CG 3.48Å; T170-Q174 PolarHBondContact O-N 3.29Å
171	Y	84.9	Confident	88	Confident	56 Å²	56	62.9 Å²	62.9	22%	0.22	32%	0.322	C	S	.	.	I	π-helix	trans	-78.8	-49.3	-172.9	178.7	-110.4	0	0	0	112.1	P110 L167 Q174 N175 L178	P110-Y171 HydrophobicContact CB-CE1 4.35Å; P110-Y171 HydrophobicContact CB-CE2 4.49Å; P110-Y171 WeakPolarHBondContact CB-OH 3.43Å; P110-Y171 HydrophobicContact CG-CE1 4.43Å; P110-Y171 HydrophobicContact CG-CE2 3.8Å; P110-Y171 WeakPolarHBondContact CG-OH 3.41Å; L167-Y171 HydrophobicContact CD1-CD1 4.18Å; L167-Y171 HydrophobicContact CD1-CG 4.47Å; L167-Y171 PolarHBondContact O-N 3.41Å; L167-Y171 VanDerWaalsContact O-N 3.16Å; Y171-Q174 PolarHBondContact O-N 2.95Å; Y171-N175 WeakPolarHBondContact CD2-ND2 3.48Å; Y171-N175 VanDerWaalsContact CE2-ND2 3.26Å; Y171-N175 WeakPolarHBondContact CE2-ND2 3.04Å; Y171-N175 PolarHBondContact O-N 3.48Å; Y171-N175 PolarHBondContact O-ND2 3.01Å; Y171-L178 HydrophobicContact CD1-CD1 4.31Å; Y171-L178 HydrophobicContact CE1-CD1 3.54Å
172	V	86.5	Confident	88	Confident	7 Å²	7	61 Å²	61	4%	0.042	32%	0.315	C	S	.	.	I	π-helix	trans	-69.1	-45.3	-176.3	-177.4	0	0	0	0	110.6	Y113 L167 Q174 N175 L178 P179	Y113-V172 HydrophobicContact CD2-CG2 3.56Å; Y113-V172 HydrophobicContact CE2-CG1 4.46Å; Y113-V172 HydrophobicContact CE2-CG2 3.64Å; L167-V172 PolarHBondContact O-N 3.16Å; L167-V172 VanDerWaalsContact O-N 3.14Å; V172-Q174 VanDerWaalsContact C-N 3.25Å; V172-Q174 PolarHBondContact O-N 2.98Å; V172-N175 CarbonylContact O-C 3.43Å; V172-N175 PolarHBondContact O-N 3.22Å; V172-N175 VanDerWaalsContact O-O 3.1Å; V172-L178 HydrophobicContact CG1-CB 4.24Å; V172-P179 VanDerWaalsContact CG1-O 3.29Å; V172-P179 WeakPolarHBondContact CG1-O 3.46Å
173	L	87.4	Confident	88	Confident	133 Å²	133	61.9 Å²	61.9	70%	0.696	32%	0.316	S	S	*	.	H	α-helix	trans	-60.3	-30.8	177.6	-171.5	63.5	0	0	0	114	D168 R169 N175	D168-L173 WeakPolarHBondContact O-CB 3.43Å; D168-L173 PolarHBondContact O-N 3.49Å; R169-L173 WeakPolarHBondContact O-CB 3.31Å; R169-L173 WeakPolarHBondContact O-CD2 3.45Å; L173-N175 VanDerWaalsContact C-N 3.34Å
174	Q	86.1	Confident	88	Confident	157 Å²	157	62.2 Å²	62.2	73%	0.734	32%	0.318	S	S	*	.	H	α-helix	trans	-79.1	-16.2	177.2	-74.1	174	6.9	0	0	113.3	T170 Y171 V172	T170-Q174 WeakPolarHBondContact O-CB 3.4Å; T170-Q174 WeakPolarHBondContact O-CG 3.48Å; T170-Q174 PolarHBondContact O-N 3.29Å; Y171-Q174 PolarHBondContact O-N 2.95Å; V172-Q174 VanDerWaalsContact C-N 3.25Å; V172-Q174 PolarHBondContact O-N 2.98Å
175	N	85.8	Confident	87.9	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.332	32%	0.321	S	S	.	.			trans	-112.2	98	-177.7	-71.2	-69.3	0	0	0	110.6	Y171 V172 L173 L177 L178	Y171-N175 WeakPolarHBondContact CD2-ND2 3.48Å; Y171-N175 VanDerWaalsContact CE2-ND2 3.26Å; Y171-N175 WeakPolarHBondContact CE2-ND2 3.04Å; Y171-N175 PolarHBondContact O-N 3.48Å; Y171-N175 PolarHBondContact O-ND2 3.01Å; V172-N175 CarbonylContact O-C 3.43Å; V172-N175 PolarHBondContact O-N 3.22Å; V172-N175 VanDerWaalsContact O-O 3.1Å; L173-N175 VanDerWaalsContact C-N 3.34Å; N175-L177 PolarHBondContact O-N 3.41Å; N175-L178 HydrophobicContact CB-CB 4.38Å; N175-L178 HydrophobicContact CB-CD1 4.03Å; N175-L178 HydrophobicContact CB-CG 4.14Å; N175-L178 PolarHBondContact O-N 3.23Å
176	S	80.6	Confident	88	Confident	125 Å²	125	60.6 Å²	60.6	87%	0.874	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.2	180	56.6	0	0	0	0	115.1
177	L	85.1	Confident	88.1	Confident	164 Å²	164	61.3 Å²	61.3	86%	0.859	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.4	177.2	-64.9	172.6	0	0	0	113.3	N175	N175-L177 PolarHBondContact O-N 3.41Å
178	L	86	Confident	88.2	Confident	54 Å²	54	61.4 Å²	61.4	28%	0.283	32%	0.316	S	S	.	.	S	Bend	trans	-104.5	125.9	-178.6	-63.7	-180	0	0	0	110.2	Y113 Y171 V172 N175	Y113-L178 HydrophobicContact CD1-CD1 4.48Å; Y113-L178 HydrophobicContact CE1-CD2 4.1Å; Y171-L178 HydrophobicContact CD1-CD1 4.31Å; Y171-L178 HydrophobicContact CE1-CD1 3.54Å; V172-L178 HydrophobicContact CG1-CB 4.24Å; N175-L178 HydrophobicContact CB-CB 4.38Å; N175-L178 HydrophobicContact CB-CD1 4.03Å; N175-L178 HydrophobicContact CB-CG 4.14Å; N175-L178 PolarHBondContact O-N 3.23Å
179	P	88.1	Confident	88.4	Confident	41 Å²	41	61.1 Å²	61.1	27%	0.266	31%	0.314	S	S	.	.			trans	-66.4	150.8	174.1	23.8	-28.1	0	0	0	110.7	Y113 V172 D183 T184	Y113-P179 WeakPolarHBondContact OH-CD 3.32Å; Y113-P179 PolarHBondContact OH-O 3.42Å; V172-P179 VanDerWaalsContact CG1-O 3.29Å; V172-P179 WeakPolarHBondContact CG1-O 3.46Å; P179-D183 HydrophobicContact CB-CB 3.79Å; P179-T184 PolarHBondContact O-OG1 3.24Å
180	S	91.7	Very high	88.5	Confident	25 Å²	25	56.1 Å²	56.1	18%	0.175	30%	0.295	C	S	.	.			trans	-58.2	162.5	172.4	74.5	0	0	0	0	110.8	W182 D183 T184	S180-W182 PolarHBondContact O-N 2.97Å; S180-W182 PolarHBondContact OG-N 3.19Å; S180-D183 WeakPolarHBondContact CB-OD2 3.46Å; S180-D183 PolarHBondContact N-OD2 3.44Å; S180-D183 PolarHBondContact O-N 3.3Å; S180-D183 VanDerWaalsContact O-N 3.14Å; S180-D183 PolarHBondContact OG-N 2.87Å; S180-D183 VanDerWaalsContact OG-N 3.1Å; S180-D183 PolarHBondContact OG-OD2 3.1Å; S180-T184 WeakPolarHBondContact O-CB 3.18Å; S180-T184 PolarHBondContact O-N 2.95Å; S180-T184 PolarHBondContact O-OG1 3.44Å
181	I	90.8	Very high	88.6	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-34.9	176.6	-61.4	179.1	0	0	0	110.7	L116 I160 R161 F164 D168 G185	L116-I181 HydrophobicContact CD2-CD1 4.11Å; I160-I181 HydrophobicContact CG2-CG2 4.24Å; R161-I181 HydrophobicContact CB-CG2 4.42Å; F164-I181 HydrophobicContact CB-CD1 3.45Å; F164-I181 VanDerWaalsContact CB-CD1 3.45Å; F164-I181 HydrophobicContact CG-CD1 4.46Å; D168-I181 HydrophobicContact CB-CD1 3.94Å; D168-I181 HydrophobicContact CB-CG1 4.25Å; D168-I181 PolarHBondContact OD1-N 2.68Å; I181-G185 PolarHBondContact O-N 3.38Å; I181-G185 VanDerWaalsContact O-N 3.08Å
182	W	90.9	Very high	88.8	Confident	64 Å²	64	56.8 Å²	56.8	24%	0.242	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-52.4	174.5	-177.3	-102.6	0	0	0	111.8	C154 T157 I158 S180 T184 G185 L186	C154-W182 HydrophobicContact CB-CH2 3.93Å; C154-W182 HydrophobicContact CB-CZ3 4.46Å; T157-W182 HydrophobicContact CG2-CE3 3.74Å; T157-W182 HydrophobicContact CG2-CZ3 4.16Å; I158-W182 HydrophobicContact CD1-CH2 4.3Å; I158-W182 HydrophobicContact CD1-CZ3 4.14Å; I158-W182 HydrophobicContact CG1-CE3 4.15Å; I158-W182 HydrophobicContact CG1-CH2 4.18Å; I158-W182 HydrophobicContact CG1-CZ3 3.54Å; S180-W182 PolarHBondContact O-N 2.97Å; S180-W182 PolarHBondContact OG-N 3.19Å; W182-T184 PolarHBondContact O-N 2.86Å; W182-G185 WeakPolarHBondContact O-CA 3.47Å; W182-G185 PolarHBondContact O-N 3.48Å; W182-L186 HydrophobicContact CZ2-CD2 4.44Å; W182-L186 WeakPolarHBondContact O-CG 3.43Å; W182-L186 PolarHBondContact O-N 2.93Å
183	D	89.4	Confident	88.8	Confident	75 Å²	75	56.5 Å²	56.5	40%	0.401	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-33.4	-179	-57.9	-42.7	0	0	0	111.9	P179 S180 L186 E187	P179-D183 HydrophobicContact CB-CB 3.79Å; S180-D183 WeakPolarHBondContact CB-OD2 3.46Å; S180-D183 PolarHBondContact N-OD2 3.44Å; S180-D183 PolarHBondContact O-N 3.3Å; S180-D183 VanDerWaalsContact O-N 3.14Å; S180-D183 PolarHBondContact OG-N 2.87Å; S180-D183 VanDerWaalsContact OG-N 3.1Å; S180-D183 PolarHBondContact OG-OD2 3.1Å; D183-L186 PolarHBondContact O-N 3.49Å; D183-E187 WeakPolarHBondContact O-CB 3.5Å; D183-E187 PolarHBondContact O-N 3.02Å
184	T	89.5	Confident	88.7	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.049	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-44.1	172.3	-50.9	0	0	0	0	110.8	Y113 R117 P179 S180 W182 L186 E187 L188	Y113-T184 PolarHBondContact OH-OG1 2.84Å; R117-T184 HydrophobicContact CB-CG2 4.42Å; R117-T184 HydrophobicContact CG-CG2 3.81Å; P179-T184 PolarHBondContact O-OG1 3.24Å; S180-T184 WeakPolarHBondContact O-CB 3.18Å; S180-T184 PolarHBondContact O-N 2.95Å; S180-T184 PolarHBondContact O-OG1 3.44Å; W182-T184 PolarHBondContact O-N 2.86Å; T184-L186 VanDerWaalsContact C-N 3.31Å; T184-L186 PolarHBondContact O-N 2.93Å; T184-E187 PolarHBondContact O-N 3.36Å; T184-L188 HydrophobicContact CG2-CD1 4.24Å; T184-L188 HydrophobicContact CG2-CG 4.48Å; T184-L188 WeakPolarHBondContact O-CB 3.31Å; T184-L188 VanDerWaalsContact O-CG 3.24Å; T184-L188 WeakPolarHBondContact O-CG 3.35Å; T184-L188 PolarHBondContact O-N 3Å
185	G	90.9	Very high	88.7	Confident	6 Å²	6	45.9 Å²	45.9	6%	0.062	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-40.2	174.3	0	0	0	0	0	112.5	H153 I181 W182 F189	H153-G185 PolarHBondContact NE2-O 3.44Å; I181-G185 PolarHBondContact O-N 3.38Å; I181-G185 VanDerWaalsContact O-N 3.08Å; W182-G185 WeakPolarHBondContact O-CA 3.47Å; W182-G185 PolarHBondContact O-N 3.48Å; G185-F189 WeakPolarHBondContact O-CB 3.49Å; G185-F189 PolarHBondContact O-N 3.32Å; G185-F189 VanDerWaalsContact O-N 3.14Å
186	L	91.6	Very high	88.8	Confident	18 Å²	18	44 Å²	44	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-45.7	174.7	-62.2	-177.7	0	0	0	112.1	W150 W182 D183 T184 L188 F189 R190 L235	W150-L186 HydrophobicContact CH2-CD2 3.43Å; W150-L186 VanDerWaalsContact CH2-CD2 3.43Å; W150-L186 HydrophobicContact CZ2-CD2 4.43Å; W150-L186 HydrophobicContact CZ3-CD2 4.07Å; W182-L186 HydrophobicContact CZ2-CD2 4.44Å; W182-L186 WeakPolarHBondContact O-CG 3.43Å; W182-L186 PolarHBondContact O-N 2.93Å; D183-L186 PolarHBondContact O-N 3.49Å; T184-L186 VanDerWaalsContact C-N 3.31Å; T184-L186 PolarHBondContact O-N 2.93Å; L186-L188 PolarHBondContact O-N 3.36Å; L186-F189 PolarHBondContact O-N 2.91Å; L186-R190 VanDerWaalsContact O-CB 3.26Å; L186-R190 WeakPolarHBondContact O-CB 3.45Å; L186-R190 PolarHBondContact O-N 3.44Å; L186-L235 HydrophobicContact CB-CD2 4.24Å; L186-L235 HydrophobicContact CD2-CD2 4.22Å; L186-L235 WeakPolarHBondContact O-CD2 3.33Å
187	E	91.9	Very high	89	Confident	59 Å²	59	42.4 Å²	42.4	28%	0.276	23%	0.233	S	C	.	.	H	α-helix	trans	-58	-46.2	176.3	-175.9	-166.1	135.3	0	0	112	R117 D183 T184 R190 T191	R117-E187 IonicContact NH2-OE1 3.96Å; R117-E187 PolarHBondContact NH2-OE1 3.42Å; D183-E187 WeakPolarHBondContact O-CB 3.5Å; D183-E187 PolarHBondContact O-N 3.02Å; T184-E187 PolarHBondContact O-N 3.36Å; E187-R190 PolarHBondContact O-N 3.3Å; E187-T191 WeakPolarHBondContact O-CB 3.4Å; E187-T191 PolarHBondContact O-N 2.95Å; E187-T191 PolarHBondContact O-OG1 2.76Å
188	L	90.9	Very high	89	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-44.8	179.6	-69.8	175.1	0	0	0	111.7	C120 E121 V124 T184 L186 T191 H192	C120-L188 HydrophobicContact CB-CD1 3.74Å; E121-L188 HydrophobicContact CB-CD1 4.19Å; E121-L188 HydrophobicContact CB-CD2 3.68Å; E121-L188 HydrophobicContact CG-CD2 3.77Å; V124-L188 HydrophobicContact CG2-CB 4.4Å; T184-L188 HydrophobicContact CG2-CD1 4.24Å; T184-L188 HydrophobicContact CG2-CG 4.48Å; T184-L188 WeakPolarHBondContact O-CB 3.31Å; T184-L188 VanDerWaalsContact O-CG 3.24Å; T184-L188 WeakPolarHBondContact O-CG 3.35Å; T184-L188 PolarHBondContact O-N 3Å; L186-L188 PolarHBondContact O-N 3.36Å; L188-T191 PolarHBondContact O-N 3.5Å; L188-H192 PolarHBondContact O-CD2 3.36Å; L188-H192 PolarHBondContact O-N 3.02Å
189	F	92.2	Very high	89.1	Confident	3 Å²	3	35.5 Å²	35.5	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-41.6	177.7	-165.7	-87.5	0	0	0	111.7	M146 W150 H153 G185 L186 I193 V194 M231 L235	M146-F189 HydrophobicContact SD-CZ 4.18Å; W150-F189 HydrophobicContact CB-CZ 4.17Å; W150-F189 AromaticContact CE3-CD1 3.74Å; W150-F189 HydrophobicContact CE3-CD1 3.74Å; W150-F189 HydrophobicContact CE3-CD2 4.31Å; W150-F189 AromaticContact CE3-CE1 3.65Å; W150-F189 HydrophobicContact CE3-CE1 3.65Å; W150-F189 HydrophobicContact CE3-CE2 4.24Å; W150-F189 HydrophobicContact CE3-CG 4.07Å; W150-F189 AromaticContact CE3-CZ 3.92Å; W150-F189 HydrophobicContact CE3-CZ 3.92Å; W150-F189 HydrophobicContact CZ3-CB 4.45Å; W150-F189 AromaticContact CZ3-CD1 3.82Å; W150-F189 HydrophobicContact CZ3-CD1 3.82Å; W150-F189 HydrophobicContact CZ3-CE1 4.2Å; W150-F189 HydrophobicContact CZ3-CG 4.06Å; H153-F189 HydrophobicContact CB-CD2 4.16Å; H153-F189 HydrophobicContact CB-CE2 4.26Å; H153-F189 AromaticContact CD2-CD2 3.67Å; H153-F189 AromaticContact CG-CD2 3.81Å; G185-F189 WeakPolarHBondContact O-CB 3.49Å; G185-F189 PolarHBondContact O-N 3.32Å; G185-F189 VanDerWaalsContact O-N 3.14Å; L186-F189 PolarHBondContact O-N 2.91Å; F189-I193 HydrophobicContact CD1-CB 4.38Å; F189-I193 HydrophobicContact CD2-CB 4.48Å; F189-I193 HydrophobicContact CD2-CG1 4.11Å; F189-I193 HydrophobicContact CE1-CB 4.28Å; F189-I193 HydrophobicContact CE1-CG2 4.16Å; F189-I193 HydrophobicContact CE2-CB 4.37Å; F189-I193 HydrophobicContact CE2-CG1 4.13Å; F189-I193 HydrophobicContact CE2-CG2 4.35Å; F189-I193 HydrophobicContact CG-CB 4.49Å; F189-I193 HydrophobicContact CG-CG1 4.48Å; F189-I193 HydrophobicContact CZ-CB 4.27Å; F189-I193 HydrophobicContact CZ-CG2 3.94Å; F189-I193 WeakPolarHBondContact O-CA 3.19Å; F189-I193 WeakPolarHBondContact O-CB 3.5Å; F189-I193 PolarHBondContact O-N 2.84Å; F189-V194 HydrophobicContact CD1-CG2 3.84Å; F189-V194 HydrophobicContact CE1-CG2 3.57Å; F189-V194 PolarHBondContact O-N 3.49Å; F189-M231 HydrophobicContact CE1-SD 3.82Å; F189-M231 HydrophobicContact CZ-SD 4.35Å; F189-L235 HydrophobicContact CB-CD2 4.38Å; F189-L235 HydrophobicContact CD1-CD1 3.68Å; F189-L235 HydrophobicContact CD1-CD2 4.18Å; F189-L235 HydrophobicContact CE1-CD1 4.07Å
190	R	91.4	Very high	89.1	Confident	67 Å²	67	36.2 Å²	36.2	25%	0.253	21%	0.207	S	C	.	.	I	π-helix	trans	-57.9	-50.5	173.7	-170.3	-171.2	-12.3	-162.7	5.1	110.9	L186 E187 V194 S195 L235 Q236 V237	L186-R190 VanDerWaalsContact O-CB 3.26Å; L186-R190 WeakPolarHBondContact O-CB 3.45Å; L186-R190 PolarHBondContact O-N 3.44Å; E187-R190 PolarHBondContact O-N 3.3Å; R190-V194 PolarHBondContact O-N 3.02Å; R190-S195 WeakPolarHBondContact O-CB 3.42Å; R190-S195 PolarHBondContact O-N 3.13Å; R190-S195 PolarHBondContact O-OG 2.9Å; R190-L235 HydrophobicContact CB-CD2 4.11Å; R190-L235 VanDerWaalsContact CD-O 3.29Å; R190-L235 WeakPolarHBondContact CD-O 3.44Å; R190-L235 PolarHBondContact NE-O 3.41Å; R190-L235 PolarHBondContact NH1-O 2.87Å; R190-Q236 VanDerWaalsContact NH1-OE1 3.11Å; R190-V237 HydrophobicContact CG-CG1 4.02Å
191	T	89.8	Confident	88.9	Confident	76 Å²	76	40.5 Å²	40.5	47%	0.466	22%	0.223	S	C	.	.	I	π-helix	trans	-71	-45.6	-171.1	-55.4	0	0	0	0	112.2	E187 L188	E187-T191 WeakPolarHBondContact O-CB 3.4Å; E187-T191 PolarHBondContact O-N 2.95Å; E187-T191 PolarHBondContact O-OG1 2.76Å; L188-T191 PolarHBondContact O-N 3.5Å
192	H	87.8	Confident	88.8	Confident	36 Å²	36	41.9 Å²	41.9	17%	0.167	23%	0.227	C	C	.	.	I	π-helix	trans	-94.8	-24.8	-171.2	-67.4	-64.8	0	0	0	113.9	E121 V124 I128 L188	E121-H192 IonicContact OE1-CE1 3.65Å; E121-H192 IonicContact OE1-NE2 2.81Å; E121-H192 PolarHBondContact OE1-NE2 2.91Å; V124-H192 HydrophobicContact CG1-CB 4.03Å; I128-H192 WeakPolarHBondContact CD1-O 3.46Å; L188-H192 PolarHBondContact O-CD2 3.36Å; L188-H192 PolarHBondContact O-N 3.02Å
193	I	87.1	Confident	88.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-107.6	-60.6	-178	-55.1	-64	0	0	0	111.3	V124 Q127 I128 F131 M146 F189 V199	V124-I193 HydrophobicContact CG1-CD1 4.42Å; V124-I193 HydrophobicContact CG1-CG1 3.89Å; Q127-I193 HydrophobicContact CB-CD1 4.09Å; I128-I193 HydrophobicContact CB-CD1 3.99Å; I128-I193 HydrophobicContact CG1-CD1 4.35Å; F131-I193 HydrophobicContact CD2-CG2 4.3Å; F131-I193 HydrophobicContact CE2-CD1 4.4Å; F131-I193 HydrophobicContact CE2-CG2 3.99Å; M146-I193 HydrophobicContact CE-CG2 3.89Å; M146-I193 HydrophobicContact SD-CG2 4.04Å; F189-I193 HydrophobicContact CD1-CB 4.38Å; F189-I193 HydrophobicContact CD2-CB 4.48Å; F189-I193 HydrophobicContact CD2-CG1 4.11Å; F189-I193 HydrophobicContact CE1-CB 4.28Å; F189-I193 HydrophobicContact CE1-CG2 4.16Å; F189-I193 HydrophobicContact CE2-CB 4.37Å; F189-I193 HydrophobicContact CE2-CG1 4.13Å; F189-I193 HydrophobicContact CE2-CG2 4.35Å; F189-I193 HydrophobicContact CG-CB 4.49Å; F189-I193 HydrophobicContact CG-CG1 4.48Å; F189-I193 HydrophobicContact CZ-CB 4.27Å; F189-I193 HydrophobicContact CZ-CG2 3.94Å; F189-I193 WeakPolarHBondContact O-CA 3.19Å; F189-I193 WeakPolarHBondContact O-CB 3.5Å; F189-I193 PolarHBondContact O-N 2.84Å; I193-V199 HydrophobicContact CG2-CG1 4.42Å; I193-V199 WeakPolarHBondContact O-CG1 3.3Å
194	V	85.8	Confident	88.9	Confident	6 Å²	6	35.7 Å²	35.7	4%	0.036	20%	0.199	C	C	.	.	I	π-helix	trans	-82.1	-26.9	-168.9	178.7	0	0	0	0	113.2	F189 R190 D196 Q200 M231 L232 L235 V237	F189-V194 HydrophobicContact CD1-CG2 3.84Å; F189-V194 HydrophobicContact CE1-CG2 3.57Å; F189-V194 PolarHBondContact O-N 3.49Å; R190-V194 PolarHBondContact O-N 3.02Å; V194-D196 VanDerWaalsContact C-N 3.27Å; V194-Q200 VanDerWaalsContact O-CB 3.29Å; V194-Q200 WeakPolarHBondContact O-CB 3.33Å; V194-M231 HydrophobicContact CG2-CE 4.41Å; V194-L232 HydrophobicContact CG1-CD2 3.93Å; V194-L235 HydrophobicContact CB-CD1 4.13Å; V194-L235 HydrophobicContact CG1-CD1 4.38Å; V194-L235 HydrophobicContact CG2-CD1 3.55Å; V194-V237 HydrophobicContact CG1-CG2 3.91Å
195	S	84.9	Confident	89	Confident	61 Å²	61	38.6 Å²	38.6	43%	0.427	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-4.4	175.9	-55.4	0	0	0	0	113.1	R190 S197	R190-S195 WeakPolarHBondContact O-CB 3.42Å; R190-S195 PolarHBondContact O-N 3.13Å; R190-S195 PolarHBondContact O-OG 2.9Å; S195-S197 PolarHBondContact O-N 2.96Å
196	D	87.5	Confident	89	Confident	24 Å²	24	38.3 Å²	38.3	13%	0.128	21%	0.209	C	C	.	.	S	Bend	trans	-66.7	122.4	168.5	179.2	-87	0	0	0	109.6	I128 R132 V194 A198 V199 Q200	I128-D196 HydrophobicContact CD1-CB 4.11Å; R132-D196 IonicContact CZ-OD2 3.66Å; R132-D196 IonicContact NE-OD2 3.63Å; R132-D196 PolarHBondContact NE-OD2 2.87Å; R132-D196 IonicContact NH2-OD2 2.85Å; R132-D196 PolarHBondContact NH2-OD2 2.82Å; V194-D196 VanDerWaalsContact C-N 3.27Å; D196-A198 VanDerWaalsContact C-N 3.28Å; D196-A198 PolarHBondContact O-N 3.16Å; D196-A198 WeakPolarHBondContact OD1-CB 3.21Å; D196-A198 PolarHBondContact OD1-N 3.1Å; D196-A198 VanDerWaalsContact OD1-N 3.09Å; D196-V199 HydrophobicContact CB-CB 4.12Å; D196-V199 HydrophobicContact CB-CG2 4.11Å; D196-V199 PolarHBondContact O-N 2.94Å; D196-V199 WeakPolarHBondContact OD1-CG2 3.05Å; D196-V199 PolarHBondContact OD1-N 2.9Å; D196-V199 VanDerWaalsContact OD1-N 3.1Å; D196-Q200 VanDerWaalsContact O-CB 3.3Å; D196-Q200 WeakPolarHBondContact O-CB 3.06Å; D196-Q200 PolarHBondContact O-N 3.11Å
197	S	84.8	Confident	89.1	Confident	91 Å²	91	37.4 Å²	37.4	64%	0.636	20%	0.204	S	C	*	.	H	α-helix	trans	-57.6	-37.3	-172.1	-178.5	0	0	0	0	113.6	S195 K201	S195-S197 PolarHBondContact O-N 2.96Å; S197-K201 WeakPolarHBondContact O-CB 3.44Å; S197-K201 PolarHBondContact O-N 3.27Å
198	A	85.7	Confident	89.1	Confident	69 Å²	69	35.6 Å²	35.6	57%	0.57	20%	0.196	S	C	*	.	H	α-helix	trans	-73.7	-42.5	-179	0	0	0	0	0	111.3	D196 R202	D196-A198 VanDerWaalsContact C-N 3.28Å; D196-A198 PolarHBondContact O-N 3.16Å; D196-A198 WeakPolarHBondContact OD1-CB 3.21Å; D196-A198 PolarHBondContact OD1-N 3.1Å; D196-A198 VanDerWaalsContact OD1-N 3.09Å; A198-R202 VanDerWaalsContact O-CB 3.31Å; A198-R202 WeakPolarHBondContact O-CB 3.17Å; A198-R202 PolarHBondContact O-N 2.77Å; A198-R202 VanDerWaalsContact O-N 3.11Å
199	V	87.9	Confident	89.2	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.024	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-45.8	177	176.4	0	0	0	0	111	F131 F142 M146 I193 D196 R202 T203	F131-V199 HydrophobicContact CB-CG2 3.78Å; F131-V199 HydrophobicContact CG-CG2 4.49Å; F142-V199 HydrophobicContact CZ-CG1 4.19Å; M146-V199 HydrophobicContact CE-CG1 3.23Å; I193-V199 HydrophobicContact CG2-CG1 4.42Å; I193-V199 WeakPolarHBondContact O-CG1 3.3Å; D196-V199 HydrophobicContact CB-CB 4.12Å; D196-V199 HydrophobicContact CB-CG2 4.11Å; D196-V199 PolarHBondContact O-N 2.94Å; D196-V199 WeakPolarHBondContact OD1-CG2 3.05Å; D196-V199 PolarHBondContact OD1-N 2.9Å; D196-V199 VanDerWaalsContact OD1-N 3.1Å; V199-R202 PolarHBondContact O-N 3.37Å; V199-T203 VanDerWaalsContact O-CB 3.32Å; V199-T203 WeakPolarHBondContact O-CB 3.42Å; V199-T203 PolarHBondContact O-N 3.26Å; V199-T203 PolarHBondContact O-OG1 2.99Å
200	Q	88.8	Confident	89.2	Confident	55 Å²	55	40.3 Å²	40.3	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-53.3	178	-167.1	-173.8	45	0	0	111	V194 D196 R202 T203 V204 S241	V194-Q200 VanDerWaalsContact O-CB 3.29Å; V194-Q200 WeakPolarHBondContact O-CB 3.33Å; D196-Q200 VanDerWaalsContact O-CB 3.3Å; D196-Q200 WeakPolarHBondContact O-CB 3.06Å; D196-Q200 PolarHBondContact O-N 3.11Å; Q200-R202 VanDerWaalsContact C-N 3.34Å; Q200-R202 PolarHBondContact O-N 2.97Å; Q200-T203 PolarHBondContact O-N 3.26Å; Q200-V204 WeakPolarHBondContact O-CG2 3.33Å; Q200-V204 PolarHBondContact O-N 3.33Å; Q200-S241 PolarHBondContact NE2-OG 3.26Å
201	K	88.1	Confident	89.3	Confident	116 Å²	116	37.2 Å²	37.2	50%	0.504	21%	0.207	S	C	.	.	H	α-helix	trans	-57.7	-47.9	-178.6	-178.3	178.7	176.7	-176.6	0	111.2	S197 V204 E205	S197-K201 WeakPolarHBondContact O-CB 3.44Å; S197-K201 PolarHBondContact O-N 3.27Å; K201-V204 PolarHBondContact O-N 2.6Å; K201-E205 WeakPolarHBondContact CE-OE1 3.42Å; K201-E205 WeakPolarHBondContact CE-OE2 3.49Å; K201-E205 HydrophobicContact CG-CG 4.46Å; K201-E205 VanDerWaalsContact CG-OE1 3.26Å; K201-E205 WeakPolarHBondContact CG-OE1 3.43Å; K201-E205 VanDerWaalsContact O-CB 3.3Å; K201-E205 WeakPolarHBondContact O-CB 3.43Å; K201-E205 VanDerWaalsContact O-CG 3.3Å; K201-E205 WeakPolarHBondContact O-CG 3.37Å; K201-E205 PolarHBondContact O-N 3.43Å
202	R	88.6	Confident	89.4	Confident	39 Å²	39	37.4 Å²	37.4	15%	0.147	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-36.6	-179.3	-168.7	176.9	-177.8	-174.3	4.4	112.9	Y134 M137 F142 A198 V199 Q200 G206	Y134-R202 PolarHBondContact O-NH1 3.29Å; Y134-R202 VanDerWaalsContact O-NH1 3.13Å; M137-R202 PolarHBondContact O-NH2 3.29Å; F142-R202 HydrophobicContact CD1-CB 4.48Å; F142-R202 HydrophobicContact CD1-CG 3.86Å; F142-R202 HydrophobicContact CE1-CB 3.95Å; F142-R202 HydrophobicContact CE1-CG 3.82Å; F142-R202 HydrophobicContact CG-CG 4.25Å; F142-R202 HydrophobicContact CZ-CB 4.15Å; F142-R202 HydrophobicContact CZ-CG 4.17Å; A198-R202 VanDerWaalsContact O-CB 3.31Å; A198-R202 WeakPolarHBondContact O-CB 3.17Å; A198-R202 PolarHBondContact O-N 2.77Å; A198-R202 VanDerWaalsContact O-N 3.11Å; V199-R202 PolarHBondContact O-N 3.37Å; Q200-R202 VanDerWaalsContact C-N 3.34Å; Q200-R202 PolarHBondContact O-N 2.97Å; R202-G206 PolarHBondContact O-N 2.86Å
203	T	89.9	Confident	89.6	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-48.4	175.6	-55.6	0	0	0	0	110.4	F142 L143 V199 Q200 G206 I207	F142-T203 WeakPolarHBondContact CE1-OG1 3.18Å; L143-T203 HydrophobicContact CD2-CG2 4.17Å; V199-T203 VanDerWaalsContact O-CB 3.32Å; V199-T203 WeakPolarHBondContact O-CB 3.42Å; V199-T203 PolarHBondContact O-N 3.26Å; V199-T203 PolarHBondContact O-OG1 2.99Å; Q200-T203 PolarHBondContact O-N 3.26Å; T203-G206 PolarHBondContact O-N 3.26Å; T203-I207 HydrophobicContact CG2-CD1 3.97Å; T203-I207 VanDerWaalsContact O-CG1 3.23Å; T203-I207 WeakPolarHBondContact O-CG1 3.42Å; T203-I207 PolarHBondContact O-N 3.06Å
204	V	91.9	Very high	89.8	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-47.4	178.7	172.2	0	0	0	0	110.8	Q200 K201 G206 I207 L208 F242 R245	Q200-V204 WeakPolarHBondContact O-CG2 3.33Å; Q200-V204 PolarHBondContact O-N 3.33Å; K201-V204 PolarHBondContact O-N 2.6Å; V204-G206 PolarHBondContact O-N 2.66Å; V204-I207 PolarHBondContact O-N 3.09Å; V204-L208 HydrophobicContact CG1-CD1 3.88Å; V204-L208 HydrophobicContact CG1-CG 4.31Å; V204-L208 VanDerWaalsContact O-CG 3.25Å; V204-L208 WeakPolarHBondContact O-CG 3.4Å; V204-L208 PolarHBondContact O-N 2.65Å; V204-F242 HydrophobicContact CG1-CD2 4.26Å; V204-F242 HydrophobicContact CG2-CB 4.49Å; V204-R245 HydrophobicContact CG1-CB 4.39Å
205	E	90.8	Very high	90.1	Very high	69 Å²	69	39 Å²	39	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-43	178.8	-76.4	168.6	-174.8	0	0	112.2	K201 I207 L208 E209 R245	K201-E205 WeakPolarHBondContact CE-OE1 3.42Å; K201-E205 WeakPolarHBondContact CE-OE2 3.49Å; K201-E205 HydrophobicContact CG-CG 4.46Å; K201-E205 VanDerWaalsContact CG-OE1 3.26Å; K201-E205 WeakPolarHBondContact CG-OE1 3.43Å; K201-E205 VanDerWaalsContact O-CB 3.3Å; K201-E205 WeakPolarHBondContact O-CB 3.43Å; K201-E205 VanDerWaalsContact O-CG 3.3Å; K201-E205 WeakPolarHBondContact O-CG 3.37Å; K201-E205 PolarHBondContact O-N 3.43Å; E205-I207 PolarHBondContact O-N 3.14Å; E205-L208 PolarHBondContact O-N 2.78Å; E205-E209 WeakPolarHBondContact O-CB 3.26Å; E205-E209 PolarHBondContact O-N 2.7Å; E205-R245 IonicContact OE1-CZ 2.83Å; E205-R245 IonicContact OE1-NH1 2.8Å; E205-R245 PolarHBondContact OE1-NH1 3.03Å; E205-R245 IonicContact OE1-NH2 3.54Å; E205-R245 PolarHBondContact OE1-NH2 3.19Å
206	G	90.9	Very high	90.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-40.5	175.4	0	0	0	0	0	112.8	R202 T203 V204 Q210	R202-G206 PolarHBondContact O-N 2.86Å; T203-G206 PolarHBondContact O-N 3.26Å; V204-G206 PolarHBondContact O-N 2.66Å; G206-Q210 WeakPolarHBondContact O-CG 3.47Å; G206-Q210 PolarHBondContact O-N 2.88Å; G206-Q210 VanDerWaalsContact O-N 3.12Å
207	I	93.6	Very high	90.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-44.9	176.2	-69.6	168.3	0	0	0	110.3	L143 T203 V204 E205 E209 Q210 I211 L225 L228 L229 L232 F242	L143-I207 HydrophobicContact CD1-CG1 4.35Å; L143-I207 HydrophobicContact CD2-CG1 4.04Å; T203-I207 HydrophobicContact CG2-CD1 3.97Å; T203-I207 VanDerWaalsContact O-CG1 3.23Å; T203-I207 WeakPolarHBondContact O-CG1 3.42Å; T203-I207 PolarHBondContact O-N 3.06Å; V204-I207 PolarHBondContact O-N 3.09Å; E205-I207 PolarHBondContact O-N 3.14Å; I207-E209 PolarHBondContact O-N 2.57Å; I207-Q210 PolarHBondContact O-N 2.74Å; I207-I211 HydrophobicContact CG2-CD1 3.94Å; I207-I211 WeakPolarHBondContact O-CG1 3.3Å; I207-I211 PolarHBondContact O-N 3.43Å; I207-I211 VanDerWaalsContact O-N 3.07Å; I207-L225 HydrophobicContact CG1-CD2 4.42Å; I207-L225 HydrophobicContact CG2-CD2 4.17Å; I207-L228 HydrophobicContact CD1-CB 4.15Å; I207-L229 HydrophobicContact CD1-CD2 4.43Å; I207-L229 HydrophobicContact CG2-CD2 4.13Å; I207-L229 HydrophobicContact CG2-CG 4.47Å; I207-L232 HydrophobicContact CD1-CD1 4.09Å; I207-F242 HydrophobicContact CB-CE2 4.27Å; I207-F242 HydrophobicContact CG2-CD2 4.21Å; I207-F242 HydrophobicContact CG2-CE2 3.46Å; I207-F242 VanDerWaalsContact CG2-CE2 3.46Å; I207-F242 HydrophobicContact CG2-CZ 4.04Å
208	L	93.4	Very high	90.5	Very high	20 Å²	20	44.3 Å²	44.3	11%	0.105	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-42	178.8	-67.8	175.1	0	0	0	112	V204 E205 Q210 I211 E212 F242 R245 F246 E249	V204-L208 HydrophobicContact CG1-CD1 3.88Å; V204-L208 HydrophobicContact CG1-CG 4.31Å; V204-L208 VanDerWaalsContact O-CG 3.25Å; V204-L208 WeakPolarHBondContact O-CG 3.4Å; V204-L208 PolarHBondContact O-N 2.65Å; E205-L208 PolarHBondContact O-N 2.78Å; L208-Q210 PolarHBondContact O-N 2.98Å; L208-I211 PolarHBondContact O-N 3.27Å; L208-E212 PolarHBondContact O-N 3.19Å; L208-F242 HydrophobicContact CD2-CD2 4.44Å; L208-F242 HydrophobicContact CD2-CE2 3.73Å; L208-F242 HydrophobicContact CD2-CZ 4.34Å; L208-F242 HydrophobicContact CG-CE2 4.27Å; L208-R245 HydrophobicContact CD1-CB 4.28Å; L208-F246 HydrophobicContact CD2-CB 3.79Å; L208-F246 HydrophobicContact CD2-CD2 3.73Å; L208-F246 HydrophobicContact CD2-CG 4.27Å; L208-E249 HydrophobicContact CD1-CG 4.32Å
209	E	91.8	Very high	90.6	Very high	82 Å²	82	47.9 Å²	47.9	38%	0.383	25%	0.254	S	S	.	.	H	α-helix	trans	-60	-45.1	176.1	-176.3	179.7	-169.5	0	0	111.3	N139 E205 I207 I211 E212 L213	N139-E209 PolarHBondContact ND2-OE2 3.49Å; E205-E209 WeakPolarHBondContact O-CB 3.26Å; E205-E209 PolarHBondContact O-N 2.7Å; I207-E209 PolarHBondContact O-N 2.57Å; E209-I211 VanDerWaalsContact C-N 3.33Å; E209-I211 PolarHBondContact O-N 2.78Å; E209-E212 PolarHBondContact O-N 3.43Å; E209-L213 HydrophobicContact CG-CD1 4.49Å; E209-L213 WeakPolarHBondContact O-CG 3.21Å; E209-L213 PolarHBondContact O-N 3.37Å
210	Q	92.8	Very high	90.7	Very high	23 Å²	23	48.9 Å²	48.9	11%	0.107	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-40.3	175.4	-67	-62.3	-68.1	0	0	112	L143 G206 I207 L208 E212 L213 E214 V220 L225	L143-Q210 HydrophobicContact CD1-CG 4.12Å; G206-Q210 WeakPolarHBondContact O-CG 3.47Å; G206-Q210 PolarHBondContact O-N 2.88Å; G206-Q210 VanDerWaalsContact O-N 3.12Å; I207-Q210 PolarHBondContact O-N 2.74Å; L208-Q210 PolarHBondContact O-N 2.98Å; Q210-E212 VanDerWaalsContact C-N 3.32Å; Q210-E212 PolarHBondContact O-N 3.14Å; Q210-L213 PolarHBondContact O-N 3.25Å; Q210-E214 PolarHBondContact O-N 2.99Å; Q210-V220 HydrophobicContact CB-CG1 4.43Å; Q210-V220 WeakPolarHBondContact O-CG1 3.36Å; Q210-L225 HydrophobicContact CB-CD1 4.37Å; Q210-L225 HydrophobicContact CB-CD2 4.02Å; Q210-L225 HydrophobicContact CG-CD2 4.5Å
211	I	93.6	Very high	90.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.7	-62.9	166.6	0	0	0	111.1	I207 L208 E209 E214 R215 L225 F242 F246 Y288	I207-I211 HydrophobicContact CG2-CD1 3.94Å; I207-I211 WeakPolarHBondContact O-CG1 3.3Å; I207-I211 PolarHBondContact O-N 3.43Å; I207-I211 VanDerWaalsContact O-N 3.07Å; L208-I211 PolarHBondContact O-N 3.27Å; E209-I211 VanDerWaalsContact C-N 3.33Å; E209-I211 PolarHBondContact O-N 2.78Å; I211-E214 PolarHBondContact O-N 3.17Å; I211-R215 WeakPolarHBondContact O-CG 3.21Å; I211-R215 PolarHBondContact O-N 3.35Å; I211-L225 HydrophobicContact CG1-CD1 4.46Å; I211-F242 HydrophobicContact CD1-CE2 4.35Å; I211-F242 HydrophobicContact CD1-CZ 3.91Å; I211-F246 HydrophobicContact CD1-CD2 4.19Å; I211-F246 HydrophobicContact CD1-CE2 4.05Å; I211-F246 HydrophobicContact CG2-CE2 4.11Å; I211-Y288 HydrophobicContact CD1-CE2 4.18Å; I211-Y288 HydrophobicContact CG1-CE2 4.08Å
212	E	91.9	Very high	91.1	Very high	81 Å²	81	48.5 Å²	48.5	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-43	176.1	-173.1	169	-172.3	0	0	112	L208 E209 Q210 E214 R215 N216 L253	L208-E212 PolarHBondContact O-N 3.19Å; E209-E212 PolarHBondContact O-N 3.43Å; Q210-E212 VanDerWaalsContact C-N 3.32Å; Q210-E212 PolarHBondContact O-N 3.14Å; E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.29Å; E212-R215 WeakPolarHBondContact O-CB 3.36Å; E212-R215 PolarHBondContact O-N 3.49Å; E212-N216 PolarHBondContact O-N 3.11Å; E212-N216 VanDerWaalsContact O-N 3.1Å; E212-N216 PolarHBondContact O-ND2 3.31Å; E212-L253 HydrophobicContact CG-CD1 4.21Å
213	L	91	Very high	91.3	Very high	46 Å²	46	50.5 Å²	50.5	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-42	173.7	-66	174.6	0	0	0	111.5	E209 Q210 R215 N216 G217 E218 V220	E209-L213 HydrophobicContact CG-CD1 4.49Å; E209-L213 WeakPolarHBondContact O-CG 3.21Å; E209-L213 PolarHBondContact O-N 3.37Å; Q210-L213 PolarHBondContact O-N 3.25Å; L213-R215 VanDerWaalsContact C-N 3.35Å; L213-R215 PolarHBondContact O-N 2.78Å; L213-N216 CarbonylContact O-C 3.54Å; L213-N216 PolarHBondContact O-N 3.5Å; L213-N216 VanDerWaalsContact O-N 3.09Å; L213-G217 PolarHBondContact O-N 2.83Å; L213-E218 HydrophobicContact CB-CB 4.15Å; L213-E218 WeakPolarHBondContact O-CB 3.29Å; L213-E218 PolarHBondContact O-N 2.9Å; L213-V220 HydrophobicContact CB-CG1 4.41Å
214	E	92.1	Very high	91.5	Very high	19 Å²	19	50.5 Å²	50.5	9%	0.089	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-38.6	175.2	-170.1	177.7	-153.2	0	0	112.2	Q210 I211 E212 N216 G217 V220 R222 R284 Y288	Q210-E214 PolarHBondContact O-N 2.99Å; I211-E214 PolarHBondContact O-N 3.17Å; E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.29Å; E214-N216 PolarHBondContact O-N 2.94Å; E214-G217 PolarHBondContact O-N 2.85Å; E214-V220 HydrophobicContact CB-CG1 4.12Å; E214-V220 HydrophobicContact CB-CG2 3.77Å; E214-V220 HydrophobicContact CG-CG2 3.94Å; E214-R222 IonicContact OE1-CZ 3.56Å; E214-R222 IonicContact OE1-NE 3.04Å; E214-R222 PolarHBondContact OE1-NE 3.22Å; E214-R222 IonicContact OE1-NH2 2.86Å; E214-R222 PolarHBondContact OE1-NH2 2.79Å; E214-R284 IonicContact OE2-NE 3.67Å; E214-Y288 WeakPolarHBondContact OE2-CE1 3.44Å; E214-Y288 PolarHBondContact OE2-OH 2.99Å
215	R	91.1	Very high	91.6	Very high	11 Å²	11	50.4 Å²	50.4	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-27.5	173.9	-76.6	173.5	171.6	158.9	2.4	112.9	I211 E212 L213 G217 T250 R277 E281	I211-R215 WeakPolarHBondContact O-CG 3.21Å; I211-R215 PolarHBondContact O-N 3.35Å; E212-R215 WeakPolarHBondContact O-CB 3.36Å; E212-R215 PolarHBondContact O-N 3.49Å; L213-R215 VanDerWaalsContact C-N 3.35Å; L213-R215 PolarHBondContact O-N 2.78Å; R215-G217 VanDerWaalsContact C-N 3.3Å; R215-T250 PolarHBondContact NH1-OG1 3.33Å; R215-T250 VanDerWaalsContact NH2-CG2 3.29Å; R215-T250 PolarHBondContact NH2-OG1 3.14Å; R215-R277 PolarHBondContact O-NH1 3.3Å; R215-R277 PolarHBondContact O-NH2 3.29Å; R215-E281 IonicContact CZ-OE1 3.33Å; R215-E281 VanDerWaalsContact CZ-OE1 3.24Å; R215-E281 IonicContact NE-OE1 2.73Å; R215-E281 PolarHBondContact NE-OE1 2.75Å; R215-E281 IonicContact NH2-OE1 3.07Å; R215-E281 PolarHBondContact NH2-OE1 2.97Å; R215-E281 IonicContact NH2-OE2 2.8Å; R215-E281 PolarHBondContact NH2-OE2 2.84Å
216	N	88.9	Confident	91.8	Very high	109 Å²	109	55.2 Å²	55.2	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.1	175.7	-66.1	-31.6	0	0	0	113.2	E212 L213 E214	E212-N216 PolarHBondContact O-N 3.11Å; E212-N216 VanDerWaalsContact O-N 3.1Å; E212-N216 PolarHBondContact O-ND2 3.31Å; L213-N216 CarbonylContact O-C 3.54Å; L213-N216 PolarHBondContact O-N 3.5Å; L213-N216 VanDerWaalsContact O-N 3.09Å; E214-N216 PolarHBondContact O-N 2.94Å
217	G	86.8	Confident	91.9	Very high	67 Å²	67	56.6 Å²	56.6	69%	0.691	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.4	9.5	175.4	0	0	0	0	0	114.7	L213 E214 R215	L213-G217 PolarHBondContact O-N 2.83Å; E214-G217 PolarHBondContact O-N 2.85Å; R215-G217 VanDerWaalsContact C-N 3.3Å
218	E	90.4	Very high	91.9	Very high	110 Å²	110	56.6 Å²	56.6	51%	0.514	30%	0.302	S	S	.	.			trans	-79.1	150.3	173.4	-60.8	-168.6	-173.1	0	0	111.9	L213	L213-E218 HydrophobicContact CB-CB 4.15Å; L213-E218 WeakPolarHBondContact O-CB 3.29Å; L213-E218 PolarHBondContact O-N 2.9Å
219	T	87.6	Confident	92	Very high	145 Å²	145	55.8 Å²	55.8	89%	0.89	30%	0.298	S	S	*	.			trans	-83	120.6	177.8	54.7	0	0	0	0	110.8
220	V	91.5	Very high	92	Very high	25 Å²	25	53.2 Å²	53.2	15%	0.152	29%	0.293	C	S	.	.			trans	-114.1	157.2	177.6	-59.2	0	0	0	0	112.4	Q210 L213 E214 R222 L225	Q210-V220 HydrophobicContact CB-CG1 4.43Å; Q210-V220 WeakPolarHBondContact O-CG1 3.36Å; L213-V220 HydrophobicContact CB-CG1 4.41Å; E214-V220 HydrophobicContact CB-CG1 4.12Å; E214-V220 HydrophobicContact CB-CG2 3.77Å; E214-V220 HydrophobicContact CG-CG2 3.94Å; V220-R222 PolarHBondContact O-N 3.29Å; V220-L225 HydrophobicContact CG2-CD1 4.09Å
221	D	91.6	Very high	92.1	Very high	67 Å²	67	52.1 Å²	52.1	36%	0.358	29%	0.288	S	S	.	.			trans	-76.6	88.3	175.7	-173.3	-10.3	0	0	0	110.7	S223 L224 L225	D221-S223 PolarHBondContact O-N 3.26Å; D221-S223 WeakPolarHBondContact OD1-CB 3.41Å; D221-S223 PolarHBondContact OD1-N 2.83Å; D221-S223 PolarHBondContact OD1-OG 3.24Å; D221-L224 HydrophobicContact CB-CB 3.94Å; D221-L224 WeakPolarHBondContact O-CB 3.41Å; D221-L224 PolarHBondContact O-N 3.2Å; D221-L224 PolarHBondContact OD1-N 2.98Å; D221-L224 VanDerWaalsContact OD1-N 3.13Å; D221-L225 PolarHBondContact O-N 3.37Å
222	R	92.4	Very high	92	Very high	95 Å²	95	52.2 Å²	52.2	36%	0.358	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-28	177.7	-67.2	-173.2	172.9	-166.1	1	113.1	E214 V220 R226 D283 S287 Y288	E214-R222 IonicContact OE1-CZ 3.56Å; E214-R222 IonicContact OE1-NE 3.04Å; E214-R222 PolarHBondContact OE1-NE 3.22Å; E214-R222 IonicContact OE1-NH2 2.86Å; E214-R222 PolarHBondContact OE1-NH2 2.79Å; V220-R222 PolarHBondContact O-N 3.29Å; R222-R226 WeakPolarHBondContact O-CB 3.47Å; R222-R226 PolarHBondContact O-N 3.22Å; R222-D283 IonicContact CZ-OD2 3.82Å; R222-D283 IonicContact NH1-OD1 3.64Å; R222-D283 IonicContact NH1-OD2 3.02Å; R222-D283 PolarHBondContact NH1-OD2 3.35Å; R222-D283 IonicContact NH2-OD2 2.87Å; R222-D283 PolarHBondContact NH2-OD2 2.99Å; R222-S287 PolarHBondContact NH1-OG 3.14Å; R222-S287 VanDerWaalsContact NH1-OG 3.08Å; R222-Y288 HydrophobicContact CB-CD1 4.33Å; R222-Y288 HydrophobicContact CG-CD1 4.21Å; R222-Y288 HydrophobicContact CG-CE1 4.26Å
223	S	93.4	Very high	92	Very high	81 Å²	81	50.6 Å²	50.6	57%	0.566	29%	0.286	S	S	*	.	H	α-helix	trans	-71.5	-38.6	179.5	78.1	0	0	0	0	111.6	D221 S227	D221-S223 PolarHBondContact O-N 3.26Å; D221-S223 WeakPolarHBondContact OD1-CB 3.41Å; D221-S223 PolarHBondContact OD1-N 2.83Å; D221-S223 PolarHBondContact OD1-OG 3.24Å; S223-S227 WeakPolarHBondContact O-CB 3.36Å; S223-S227 PolarHBondContact O-N 3.25Å
224	L	93.5	Very high	92	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-47.8	173.9	178.3	62.9	0	0	0	111.1	L140 L143 K144 N147 D221 S227 L228	L140-L224 HydrophobicContact CD1-CD2 3.92Å; L143-L224 HydrophobicContact CB-CD2 4.12Å; K144-L224 HydrophobicContact CG-CD1 4.37Å; K144-L224 HydrophobicContact CG-CD2 3.72Å; N147-L224 HydrophobicContact CB-CD1 3.4Å; N147-L224 VanDerWaalsContact CB-CD1 3.4Å; D221-L224 HydrophobicContact CB-CB 3.94Å; D221-L224 WeakPolarHBondContact O-CB 3.41Å; D221-L224 PolarHBondContact O-N 3.2Å; D221-L224 PolarHBondContact OD1-N 2.98Å; D221-L224 VanDerWaalsContact OD1-N 3.13Å; L224-S227 PolarHBondContact O-N 2.87Å; L224-L228 HydrophobicContact CD1-CD1 3.8Å; L224-L228 HydrophobicContact CD1-CG 4.24Å; L224-L228 HydrophobicContact CG-CD1 3.91Å; L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 WeakPolarHBondContact O-CG 3.42Å; L224-L228 PolarHBondContact O-N 3.26Å
225	L	94.1	Very high	91.9	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178	-65.2	179.4	0	0	0	111.6	I207 Q210 I211 V220 D221 S227 L228 L229 Y288	I207-L225 HydrophobicContact CG1-CD2 4.42Å; I207-L225 HydrophobicContact CG2-CD2 4.17Å; Q210-L225 HydrophobicContact CB-CD1 4.37Å; Q210-L225 HydrophobicContact CB-CD2 4.02Å; Q210-L225 HydrophobicContact CG-CD2 4.5Å; I211-L225 HydrophobicContact CG1-CD1 4.46Å; V220-L225 HydrophobicContact CG2-CD1 4.09Å; D221-L225 PolarHBondContact O-N 3.37Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.21Å; L225-L228 PolarHBondContact O-N 3.28Å; L225-L229 VanDerWaalsContact O-CB 3.32Å; L225-L229 WeakPolarHBondContact O-CB 3.24Å; L225-L229 WeakPolarHBondContact O-CG 3.26Å; L225-L229 PolarHBondContact O-N 2.88Å; L225-Y288 HydrophobicContact CB-CD1 4.35Å; L225-Y288 HydrophobicContact CB-CD2 4.27Å; L225-Y288 HydrophobicContact CB-CG 4.05Å; L225-Y288 HydrophobicContact CD1-CD1 4.34Å; L225-Y288 HydrophobicContact CD1-CE1 4.03Å; L225-Y288 HydrophobicContact CD1-CE2 4.29Å
226	R	94.4	Very high	91.9	Very high	169 Å²	169	58 Å²	58	64%	0.638	32%	0.323	S	S	*	.	H	α-helix	trans	-59	-42	177.1	-174.2	177.3	-179.1	168.5	1.5	112.1	R222 G230 S287	R222-R226 WeakPolarHBondContact O-CB 3.47Å; R222-R226 PolarHBondContact O-N 3.22Å; R226-G230 PolarHBondContact O-N 2.86Å; R226-S287 WeakPolarHBondContact CD-O 3.48Å
227	S	94.3	Very high	92	Very high	29 Å²	29	53.5 Å²	53.5	20%	0.203	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-42.8	179.6	-169.4	0	0	0	0	111.9	N147 Q151 S223 L224 L225 M231	N147-S227 WeakPolarHBondContact OD1-CB 3.35Å; N147-S227 PolarHBondContact OD1-OG 3.36Å; Q151-S227 PolarHBondContact NE2-OG 3.41Å; S223-S227 WeakPolarHBondContact O-CB 3.36Å; S223-S227 PolarHBondContact O-N 3.25Å; L224-S227 PolarHBondContact O-N 2.87Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.21Å; S227-M231 WeakPolarHBondContact O-CB 3.44Å; S227-M231 PolarHBondContact O-N 3.18Å
228	L	93.9	Very high	92.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-72.5	-39.1	179.1	-72.4	169.6	0	0	0	113.3	L143 M146 N147 I207 L224 L225 M231 L232	L143-L228 HydrophobicContact CB-CD1 3.8Å; L143-L228 HydrophobicContact CD1-CD1 4.43Å; L143-L228 HydrophobicContact CD2-CD1 3.97Å; L143-L228 HydrophobicContact CG-CD1 4.26Å; M146-L228 HydrophobicContact CB-CD2 4.14Å; M146-L228 HydrophobicContact CG-CD2 3.8Å; N147-L228 HydrophobicContact CB-CD2 3.86Å; N147-L228 HydrophobicContact CB-CG 4.08Å; I207-L228 HydrophobicContact CD1-CB 4.15Å; L224-L228 HydrophobicContact CD1-CD1 3.8Å; L224-L228 HydrophobicContact CD1-CG 4.24Å; L224-L228 HydrophobicContact CG-CD1 3.91Å; L224-L228 WeakPolarHBondContact O-CB 3.38Å; L224-L228 WeakPolarHBondContact O-CG 3.42Å; L224-L228 PolarHBondContact O-N 3.26Å; L225-L228 PolarHBondContact O-N 3.28Å; L228-M231 HydrophobicContact CD2-CE 3.99Å; L228-M231 HydrophobicContact CD2-SD 4.46Å; L228-M231 WeakPolarHBondContact O-CB 3.49Å; L228-M231 PolarHBondContact O-N 3.32Å; L228-L232 WeakPolarHBondContact O-CG 3.3Å; L228-L232 PolarHBondContact O-N 3.29Å
229	L	93.9	Very high	92.2	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-70.7	-36.8	174.7	-69.8	166.3	0	0	0	111.1	I207 L225 L232 S233 Y238 F242 Y288 L289	I207-L229 HydrophobicContact CD1-CD2 4.43Å; I207-L229 HydrophobicContact CG2-CD2 4.13Å; I207-L229 HydrophobicContact CG2-CG 4.47Å; L225-L229 VanDerWaalsContact O-CB 3.32Å; L225-L229 WeakPolarHBondContact O-CB 3.24Å; L225-L229 WeakPolarHBondContact O-CG 3.26Å; L225-L229 PolarHBondContact O-N 2.88Å; L229-L232 HydrophobicContact CD2-CD1 4.38Å; L229-L232 PolarHBondContact O-N 3.32Å; L229-S233 PolarHBondContact O-N 2.83Å; L229-Y238 HydrophobicContact CB-CE2 4.22Å; L229-Y238 HydrophobicContact CD2-CD2 4.23Å; L229-Y238 HydrophobicContact CD2-CE2 3.68Å; L229-Y238 HydrophobicContact CG-CE2 4.49Å; L229-F242 HydrophobicContact CD2-CD1 3.75Å; L229-F242 HydrophobicContact CD2-CD2 4.19Å; L229-F242 HydrophobicContact CD2-CE1 3.56Å; L229-F242 HydrophobicContact CD2-CE2 4.03Å; L229-F242 HydrophobicContact CD2-CG 4.07Å; L229-F242 HydrophobicContact CD2-CZ 3.7Å; L229-Y288 HydrophobicContact CD1-CD2 3.56Å; L229-Y288 HydrophobicContact CD1-CE2 4.34Å; L229-Y288 HydrophobicContact CD1-CG 4.39Å; L229-Y288 VanDerWaalsContact CD1-O 3.25Å; L229-Y288 WeakPolarHBondContact CD1-O 3.39Å; L229-L289 HydrophobicContact CD1-CD2 4.03Å
230	G	92.9	Very high	92.2	Very high	27 Å²	27	50.6 Å²	50.6	28%	0.278	26%	0.26	S	S	.	.	H	α-helix	trans	-57.1	-47.2	168.1	0	0	0	0	0	111.8	R226 L232 S233 D234	R226-G230 PolarHBondContact O-N 2.86Å; G230-L232 PolarHBondContact O-N 3.09Å; G230-S233 WeakPolarHBondContact O-CB 3.29Å; G230-S233 PolarHBondContact O-N 3.15Å; G230-S233 VanDerWaalsContact O-N 3.11Å; G230-D234 VanDerWaalsContact O-CG 3.31Å; G230-D234 PolarHBondContact O-N 2.98Å
231	M	93.6	Very high	92	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-55.4	-48.9	172.7	174.5	-167.9	75.2	0	0	111.9	M146 W150 F189 V194 S227 L228 S233 D234 L235	M146-M231 HydrophobicContact CG-CE 4.09Å; M146-M231 HydrophobicContact CG-SD 4.35Å; M146-M231 HydrophobicContact SD-SD 4.42Å; W150-M231 HydrophobicContact CB-CG 4.38Å; W150-M231 HydrophobicContact CB-SD 3.7Å; W150-M231 HydrophobicContact CD2-CB 3.97Å; W150-M231 HydrophobicContact CD2-CG 3.46Å; W150-M231 VanDerWaalsContact CD2-CG 3.46Å; W150-M231 HydrophobicContact CD2-SD 3.93Å; W150-M231 HydrophobicContact CE3-CG 3.85Å; W150-M231 HydrophobicContact CE3-SD 4.25Å; W150-M231 HydrophobicContact CG-CB 3.98Å; W150-M231 HydrophobicContact CG-CG 3.7Å; W150-M231 HydrophobicContact CG-SD 3.69Å; W150-M231 HydrophobicContact CH2-CG 4.31Å; W150-M231 HydrophobicContact CZ2-CB 4.15Å; W150-M231 HydrophobicContact CZ2-CG 4.02Å; W150-M231 HydrophobicContact CZ3-CG 4.26Å; F189-M231 HydrophobicContact CE1-SD 3.82Å; F189-M231 HydrophobicContact CZ-SD 4.35Å; V194-M231 HydrophobicContact CG2-CE 4.41Å; S227-M231 WeakPolarHBondContact O-CB 3.44Å; S227-M231 PolarHBondContact O-N 3.18Å; L228-M231 HydrophobicContact CD2-CE 3.99Å; L228-M231 HydrophobicContact CD2-SD 4.46Å; L228-M231 WeakPolarHBondContact O-CB 3.49Å; L228-M231 PolarHBondContact O-N 3.32Å; M231-S233 PolarHBondContact O-N 3.45Å; M231-D234 PolarHBondContact O-N 3.09Å; M231-L235 HydrophobicContact CG-CD1 3.65Å; M231-L235 HydrophobicContact CG-CG 4.32Å; M231-L235 WeakPolarHBondContact O-CB 3.5Å; M231-L235 WeakPolarHBondContact O-CG 3.43Å; M231-L235 PolarHBondContact O-N 2.87Å; M231-L235 HydrophobicContact SD-CD1 4.42Å
232	L	91.8	Very high	92.1	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-31.6	179.1	-66.1	176.6	0	0	0	112.3	V194 I207 L228 L229 G230 Q236 V237 Y238 F242	V194-L232 HydrophobicContact CG1-CD2 3.93Å; I207-L232 HydrophobicContact CD1-CD1 4.09Å; L228-L232 WeakPolarHBondContact O-CG 3.3Å; L228-L232 PolarHBondContact O-N 3.29Å; L229-L232 HydrophobicContact CD2-CD1 4.38Å; L229-L232 PolarHBondContact O-N 3.32Å; G230-L232 PolarHBondContact O-N 3.09Å; L232-Q236 PolarHBondContact O-N 3.2Å; L232-V237 HydrophobicContact CB-CG2 4.12Å; L232-V237 HydrophobicContact CD2-CG2 3.58Å; L232-V237 HydrophobicContact CG-CG2 4.46Å; L232-V237 WeakPolarHBondContact O-CG2 3.42Å; L232-V237 PolarHBondContact O-N 2.74Å; L232-Y238 HydrophobicContact CB-CD2 4.29Å; L232-Y238 PolarHBondContact O-N 2.87Å; L232-F242 HydrophobicContact CD1-CB 4.17Å
233	S	92.9	Very high	92.2	Very high	47 Å²	47	43.7 Å²	43.7	33%	0.329	23%	0.23	S	C	.	.	H	α-helix	trans	-71.4	-48.4	174.7	-165.2	0	0	0	0	111.5	L229 G230 M231 L235 Q236	L229-S233 PolarHBondContact O-N 2.83Å; G230-S233 WeakPolarHBondContact O-CB 3.29Å; G230-S233 PolarHBondContact O-N 3.15Å; G230-S233 VanDerWaalsContact O-N 3.11Å; M231-S233 PolarHBondContact O-N 3.45Å; S233-L235 PolarHBondContact O-N 2.8Å; S233-Q236 WeakPolarHBondContact O-CA 3.26Å; S233-Q236 PolarHBondContact O-N 2.93Å
234	D	90.7	Very high	92.1	Very high	89 Å²	89	46.2 Å²	46.2	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-59.7	-35.1	176.7	-69.5	-22.8	0	0	0	112	W150 G230 M231 Q236	W150-D234 HydrophobicContact CH2-CB 4.36Å; W150-D234 HydrophobicContact CZ2-CB 4.09Å; G230-D234 VanDerWaalsContact O-CG 3.31Å; G230-D234 PolarHBondContact O-N 2.98Å; M231-D234 PolarHBondContact O-N 3.09Å; D234-Q236 VanDerWaalsContact C-N 3.29Å
235	L	90.6	Very high	92	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.7	176.4	-63.4	173.9	0	0	0	113.7	W150 L186 F189 R190 V194 M231 S233 V237	W150-L235 HydrophobicContact CH2-CD2 3.98Å; W150-L235 HydrophobicContact CH2-CG 4.14Å; W150-L235 HydrophobicContact CZ3-CD1 4.37Å; W150-L235 HydrophobicContact CZ3-CD2 3.89Å; W150-L235 HydrophobicContact CZ3-CG 4.24Å; L186-L235 HydrophobicContact CB-CD2 4.24Å; L186-L235 HydrophobicContact CD2-CD2 4.22Å; L186-L235 WeakPolarHBondContact O-CD2 3.33Å; F189-L235 HydrophobicContact CB-CD2 4.38Å; F189-L235 HydrophobicContact CD1-CD1 3.68Å; F189-L235 HydrophobicContact CD1-CD2 4.18Å; F189-L235 HydrophobicContact CE1-CD1 4.07Å; R190-L235 HydrophobicContact CB-CD2 4.11Å; R190-L235 VanDerWaalsContact CD-O 3.29Å; R190-L235 WeakPolarHBondContact CD-O 3.44Å; R190-L235 PolarHBondContact NE-O 3.41Å; R190-L235 PolarHBondContact NH1-O 2.87Å; V194-L235 HydrophobicContact CB-CD1 4.13Å; V194-L235 HydrophobicContact CG1-CD1 4.38Å; V194-L235 HydrophobicContact CG2-CD1 3.55Å; M231-L235 HydrophobicContact CG-CD1 3.65Å; M231-L235 HydrophobicContact CG-CG 4.32Å; M231-L235 WeakPolarHBondContact O-CB 3.5Å; M231-L235 WeakPolarHBondContact O-CG 3.43Å; M231-L235 PolarHBondContact O-N 2.87Å; M231-L235 HydrophobicContact SD-CD1 4.42Å; S233-L235 PolarHBondContact O-N 2.8Å; L235-V237 VanDerWaalsContact C-N 3.27Å; L235-V237 HydrophobicContact CB-CG2 4.08Å; L235-V237 PolarHBondContact O-N 2.66Å
236	Q	90.4	Very high	92.1	Very high	144 Å²	144	50.5 Å²	50.5	67%	0.673	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	29.9	179.6	-53.5	176.2	-34.1	0	0	114.4	R190 L232 S233 D234	R190-Q236 VanDerWaalsContact NH1-OE1 3.11Å; L232-Q236 PolarHBondContact O-N 3.2Å; S233-Q236 WeakPolarHBondContact O-CA 3.26Å; S233-Q236 PolarHBondContact O-N 2.93Å; D234-Q236 VanDerWaalsContact C-N 3.29Å
237	V	91	Very high	92.1	Very high	14 Å²	14	44.3 Å²	44.3	9%	0.085	23%	0.228	C	C	.	.			trans	-111.4	-5.7	178.7	-65.5	0	0	0	0	113.1	R190 V194 L232 L235 K239 S241	R190-V237 HydrophobicContact CG-CG1 4.02Å; V194-V237 HydrophobicContact CG1-CG2 3.91Å; L232-V237 HydrophobicContact CB-CG2 4.12Å; L232-V237 HydrophobicContact CD2-CG2 3.58Å; L232-V237 HydrophobicContact CG-CG2 4.46Å; L232-V237 WeakPolarHBondContact O-CG2 3.42Å; L232-V237 PolarHBondContact O-N 2.74Å; L235-V237 VanDerWaalsContact C-N 3.27Å; L235-V237 HydrophobicContact CB-CG2 4.08Å; L235-V237 PolarHBondContact O-N 2.66Å; V237-K239 PolarHBondContact O-N 3.36Å; V237-S241 WeakPolarHBondContact O-CB 2.98Å; V237-S241 PolarHBondContact O-N 2.9Å; V237-S241 PolarHBondContact O-OG 3.1Å; V237-S241 VanDerWaalsContact O-OG 3.11Å
238	Y	92.3	Very high	92.1	Very high	7 Å²	7	46.9 Å²	46.9	3%	0.027	24%	0.242	C	C	.	.	I	π-helix	trans	-51.8	-51.5	-176.8	-177.4	-84.8	0	0	0	113.2	L229 L232 F242 E243 D290 T293	L229-Y238 HydrophobicContact CB-CE2 4.22Å; L229-Y238 HydrophobicContact CD2-CD2 4.23Å; L229-Y238 HydrophobicContact CD2-CE2 3.68Å; L229-Y238 HydrophobicContact CG-CE2 4.49Å; L232-Y238 HydrophobicContact CB-CD2 4.29Å; L232-Y238 PolarHBondContact O-N 2.87Å; Y238-F242 HydrophobicContact CD2-CD1 4.18Å; Y238-F242 HydrophobicContact CE1-CD1 4.27Å; Y238-F242 AromaticContact CE2-CD1 3.7Å; Y238-F242 HydrophobicContact CE2-CD1 3.7Å; Y238-F242 HydrophobicContact CE2-CE1 4.03Å; Y238-F242 AromaticContact CZ-CD1 3.73Å; Y238-F242 AromaticContact CZ-CE1 3.93Å; Y238-F242 WeakPolarHBondContact O-CA 3.35Å; Y238-F242 WeakPolarHBondContact O-CB 3.49Å; Y238-F242 PolarHBondContact O-N 3.34Å; Y238-E243 HydrophobicContact CD1-CB 4.29Å; Y238-E243 HydrophobicContact CE1-CB 4.07Å; Y238-E243 HydrophobicContact CE1-CG 4.48Å; Y238-E243 PolarHBondContact O-N 3.21Å; Y238-D290 HydrophobicContact CD1-CB 4.22Å; Y238-D290 HydrophobicContact CE1-CB 3.65Å; Y238-D290 HydrophobicContact CE2-CB 4.02Å; Y238-D290 PolarHBondContact OH-N 3.4Å; Y238-T293 WeakPolarHBondContact CE1-OG1 3.46Å; Y238-T293 PolarHBondContact OH-OG1 3.32Å
239	K	88.7	Confident	92	Very high	123 Å²	123	50 Å²	50	54%	0.535	26%	0.257	S	S	.	.	I	π-helix	trans	-66.2	-50.6	-174.5	-63.7	-166	173.9	-178.1	0	112.2	V237 E243 E244	V237-K239 PolarHBondContact O-N 3.36Å; K239-E243 WeakPolarHBondContact CG-OE2 3.28Å; K239-E243 WeakPolarHBondContact O-CB 3.45Å; K239-E244 PolarHBondContact O-N 2.99Å
240	D	87.7	Confident	92	Very high	131 Å²	131	49.9 Å²	49.9	70%	0.701	26%	0.256	S	S	*	.	I	π-helix	trans	-75.8	-34.9	-173.2	-57	-21.6	0	0	0	112.4
241	S	88.1	Confident	92.1	Very high	18 Å²	18	51.4 Å²	51.4	13%	0.126	26%	0.258	C	S	.	.	I	π-helix	trans	-96.4	-34	-172	-50.3	0	0	0	0	113.5	Q200 V237	Q200-S241 PolarHBondContact NE2-OG 3.26Å; V237-S241 WeakPolarHBondContact O-CB 2.98Å; V237-S241 PolarHBondContact O-N 2.9Å; V237-S241 PolarHBondContact O-OG 3.1Å; V237-S241 VanDerWaalsContact O-OG 3.11Å
242	F	93.3	Very high	92.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-112.4	-53.5	-172.8	172.4	-97.9	0	0	0	112.5	V204 I207 L208 I211 L229 L232 Y238 E244 R245 F246 L289	V204-F242 HydrophobicContact CG1-CD2 4.26Å; V204-F242 HydrophobicContact CG2-CB 4.49Å; I207-F242 HydrophobicContact CB-CE2 4.27Å; I207-F242 HydrophobicContact CG2-CD2 4.21Å; I207-F242 HydrophobicContact CG2-CE2 3.46Å; I207-F242 VanDerWaalsContact CG2-CE2 3.46Å; I207-F242 HydrophobicContact CG2-CZ 4.04Å; L208-F242 HydrophobicContact CD2-CD2 4.44Å; L208-F242 HydrophobicContact CD2-CE2 3.73Å; L208-F242 HydrophobicContact CD2-CZ 4.34Å; L208-F242 HydrophobicContact CG-CE2 4.27Å; I211-F242 HydrophobicContact CD1-CE2 4.35Å; I211-F242 HydrophobicContact CD1-CZ 3.91Å; L229-F242 HydrophobicContact CD2-CD1 3.75Å; L229-F242 HydrophobicContact CD2-CD2 4.19Å; L229-F242 HydrophobicContact CD2-CE1 3.56Å; L229-F242 HydrophobicContact CD2-CE2 4.03Å; L229-F242 HydrophobicContact CD2-CG 4.07Å; L229-F242 HydrophobicContact CD2-CZ 3.7Å; L232-F242 HydrophobicContact CD1-CB 4.17Å; Y238-F242 HydrophobicContact CD2-CD1 4.18Å; Y238-F242 HydrophobicContact CE1-CD1 4.27Å; Y238-F242 AromaticContact CE2-CD1 3.7Å; Y238-F242 HydrophobicContact CE2-CD1 3.7Å; Y238-F242 HydrophobicContact CE2-CE1 4.03Å; Y238-F242 AromaticContact CZ-CD1 3.73Å; Y238-F242 AromaticContact CZ-CE1 3.93Å; Y238-F242 WeakPolarHBondContact O-CA 3.35Å; Y238-F242 WeakPolarHBondContact O-CB 3.49Å; Y238-F242 PolarHBondContact O-N 3.34Å; F242-E244 PolarHBondContact O-N 3.17Å; F242-R245 PolarHBondContact O-N 3.42Å; F242-F246 HydrophobicContact CD1-CB 4.32Å; F242-F246 HydrophobicContact CE1-CB 3.89Å; F242-F246 HydrophobicContact CE1-CD1 4.36Å; F242-F246 HydrophobicContact CE1-CD2 4.48Å; F242-F246 AromaticContact CE1-CG 3.98Å; F242-F246 HydrophobicContact CE1-CG 3.98Å; F242-F246 HydrophobicContact CE2-CB 4.12Å; F242-F246 HydrophobicContact CZ-CB 3.78Å; F242-F246 AromaticContact CZ-CD2 3.9Å; F242-F246 HydrophobicContact CZ-CD2 3.9Å; F242-F246 AromaticContact CZ-CG 3.82Å; F242-F246 HydrophobicContact CZ-CG 3.82Å; F242-F246 VanDerWaalsContact O-CB 3.26Å; F242-F246 WeakPolarHBondContact O-CB 3.39Å; F242-F246 PolarHBondContact O-N 3.36Å; F242-L289 HydrophobicContact CE1-CD2 4.07Å; F242-L289 HydrophobicContact CZ-CD2 4.26Å
243	E	93.5	Very high	92.2	Very high	24 Å²	24	59.5 Å²	59.5	11%	0.112	29%	0.29	C	S	.	.	I	π-helix	trans	-58.7	-45.4	-169.8	-173.7	173	-146.2	0	0	112.7	Y238 K239 R245 F246 L247 T293	Y238-E243 HydrophobicContact CD1-CB 4.29Å; Y238-E243 HydrophobicContact CE1-CB 4.07Å; Y238-E243 HydrophobicContact CE1-CG 4.48Å; Y238-E243 PolarHBondContact O-N 3.21Å; K239-E243 WeakPolarHBondContact CG-OE2 3.28Å; K239-E243 WeakPolarHBondContact O-CB 3.45Å; E243-R245 PolarHBondContact O-N 2.91Å; E243-F246 PolarHBondContact O-N 2.95Å; E243-L247 HydrophobicContact CG-CD1 3.97Å; E243-L247 HydrophobicContact CG-CG 4.38Å; E243-L247 WeakPolarHBondContact O-CB 3.29Å; E243-L247 VanDerWaalsContact O-CG 3.26Å; E243-L247 WeakPolarHBondContact O-CG 3.3Å; E243-L247 PolarHBondContact O-N 3.28Å; E243-T293 HydrophobicContact CG-CG2 4.36Å; E243-T293 VanDerWaalsContact OE1-CA 3.28Å; E243-T293 WeakPolarHBondContact OE1-CA 3.2Å; E243-T293 WeakPolarHBondContact OE1-CB 3.27Å; E243-T293 PolarHBondContact OE1-OG1 2.82Å
244	E	91.6	Very high	92.4	Very high	134 Å²	134	57.3 Å²	57.3	63%	0.626	28%	0.275	S	S	*	.	H	α-helix	trans	-61.9	-45.4	178.9	-171.3	-178.8	170.5	0	0	112.4	K239 F242 T248	K239-E244 PolarHBondContact O-N 2.99Å; F242-E244 PolarHBondContact O-N 3.17Å; E244-T248 WeakPolarHBondContact O-CB 3.46Å; E244-T248 PolarHBondContact O-N 3.41Å; E244-T248 PolarHBondContact O-OG1 3.15Å
245	R	92.8	Very high	92.5	Very high	95 Å²	95	54 Å²	54	36%	0.358	26%	0.26	S	S	.	.	H	α-helix	trans	-67.8	-40.7	177.2	-68	-166	73.6	-168.6	2.1	111.5	V204 E205 L208 F242 E243 T248 E249	V204-R245 HydrophobicContact CG1-CB 4.39Å; E205-R245 IonicContact OE1-CZ 2.83Å; E205-R245 IonicContact OE1-NH1 2.8Å; E205-R245 PolarHBondContact OE1-NH1 3.03Å; E205-R245 IonicContact OE1-NH2 3.54Å; E205-R245 PolarHBondContact OE1-NH2 3.19Å; L208-R245 HydrophobicContact CD1-CB 4.28Å; F242-R245 PolarHBondContact O-N 3.42Å; E243-R245 PolarHBondContact O-N 2.91Å; R245-T248 PolarHBondContact O-N 3.14Å; R245-E249 PolarHBondContact O-N 3.4Å
246	F	95	Very high	92.7	Very high	1 Å²	1	56.9 Å²	56.9	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-46.5	177.1	170.1	-110.5	0	0	0	112.1	L208 I211 F242 E243 T248 T250 L289 T293 L297	L208-F246 HydrophobicContact CD2-CB 3.79Å; L208-F246 HydrophobicContact CD2-CD2 3.73Å; L208-F246 HydrophobicContact CD2-CG 4.27Å; I211-F246 HydrophobicContact CD1-CD2 4.19Å; I211-F246 HydrophobicContact CD1-CE2 4.05Å; I211-F246 HydrophobicContact CG2-CE2 4.11Å; F242-F246 HydrophobicContact CD1-CB 4.32Å; F242-F246 HydrophobicContact CE1-CB 3.89Å; F242-F246 HydrophobicContact CE1-CD1 4.36Å; F242-F246 HydrophobicContact CE1-CD2 4.48Å; F242-F246 AromaticContact CE1-CG 3.98Å; F242-F246 HydrophobicContact CE1-CG 3.98Å; F242-F246 HydrophobicContact CE2-CB 4.12Å; F242-F246 HydrophobicContact CZ-CB 3.78Å; F242-F246 AromaticContact CZ-CD2 3.9Å; F242-F246 HydrophobicContact CZ-CD2 3.9Å; F242-F246 AromaticContact CZ-CG 3.82Å; F242-F246 HydrophobicContact CZ-CG 3.82Å; F242-F246 VanDerWaalsContact O-CB 3.26Å; F242-F246 WeakPolarHBondContact O-CB 3.39Å; F242-F246 PolarHBondContact O-N 3.36Å; E243-F246 PolarHBondContact O-N 2.95Å; F246-T248 VanDerWaalsContact C-N 3.34Å; F246-T250 WeakPolarHBondContact O-CB 3.27Å; F246-T250 PolarHBondContact O-N 3.26Å; F246-T250 PolarHBondContact O-OG1 3.38Å; F246-L289 HydrophobicContact CE1-CD1 4.2Å; F246-L289 HydrophobicContact CZ-CD1 3.99Å; F246-L289 HydrophobicContact CZ-CD2 4.42Å; F246-T293 HydrophobicContact CD1-CG2 4.01Å; F246-T293 HydrophobicContact CE1-CG2 3.81Å; F246-L297 HydrophobicContact CE1-CD1 3.83Å; F246-L297 HydrophobicContact CE1-CD2 3.98Å; F246-L297 HydrophobicContact CE1-CG 4.34Å; F246-L297 HydrophobicContact CZ-CD1 3.87Å; F246-L297 HydrophobicContact CZ-CD2 3.99Å
247	L	94.6	Very high	92.9	Very high	40 Å²	40	50.7 Å²	50.7	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-36.9	177.5	-67.8	174.1	0	0	0	111.5	E243 N251 P296 L297	E243-L247 HydrophobicContact CG-CD1 3.97Å; E243-L247 HydrophobicContact CG-CG 4.38Å; E243-L247 WeakPolarHBondContact O-CB 3.29Å; E243-L247 VanDerWaalsContact O-CG 3.26Å; E243-L247 WeakPolarHBondContact O-CG 3.3Å; E243-L247 PolarHBondContact O-N 3.28Å; L247-N251 VanDerWaalsContact O-CB 3.22Å; L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 3.34Å; L247-P296 HydrophobicContact CD1-CB 3.68Å; L247-P296 HydrophobicContact CD2-CB 4.06Å; L247-L297 HydrophobicContact CD2-CB 4.24Å
248	T	94	Very high	92.9	Very high	83 Å²	83	50 Å²	50	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-49.4	177.1	-59.4	0	0	0	0	112	E244 R245 F246 N251 R252	E244-T248 WeakPolarHBondContact O-CB 3.46Å; E244-T248 PolarHBondContact O-N 3.41Å; E244-T248 PolarHBondContact O-OG1 3.15Å; R245-T248 PolarHBondContact O-N 3.14Å; F246-T248 VanDerWaalsContact C-N 3.34Å; T248-N251 WeakPolarHBondContact O-CB 3.21Å; T248-N251 PolarHBondContact O-N 3.33Å; T248-R252 PolarHBondContact O-N 3.28Å
249	E	92.4	Very high	92.9	Very high	66 Å²	66	55.2 Å²	55.2	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-38.7	177.1	-71.5	-54.7	142.2	0	0	112	L208 R245 N251 R252 L253	L208-E249 HydrophobicContact CD1-CG 4.32Å; R245-E249 PolarHBondContact O-N 3.4Å; E249-N251 VanDerWaalsContact C-N 3.32Å; E249-N251 PolarHBondContact O-N 2.72Å; E249-R252 PolarHBondContact O-N 2.73Å; E249-R252 IonicContact OE2-CZ 2.67Å; E249-R252 VanDerWaalsContact OE2-CZ 3.28Å; E249-R252 IonicContact OE2-NE 2.73Å; E249-R252 PolarHBondContact OE2-NE 2.83Å; E249-R252 IonicContact OE2-NH2 3.11Å; E249-R252 PolarHBondContact OE2-NH2 3.34Å; E249-L253 WeakPolarHBondContact O-CB 3.27Å; E249-L253 PolarHBondContact O-N 3.4Å
250	T	94.5	Very high	93.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-40.7	175.3	-61.7	0	0	0	0	111.9	R215 F246 L253 Y254 L297 V301	R215-T250 PolarHBondContact NH1-OG1 3.33Å; R215-T250 VanDerWaalsContact NH2-CG2 3.29Å; R215-T250 PolarHBondContact NH2-OG1 3.14Å; F246-T250 WeakPolarHBondContact O-CB 3.27Å; F246-T250 PolarHBondContact O-N 3.26Å; F246-T250 PolarHBondContact O-OG1 3.38Å; T250-L253 PolarHBondContact O-N 2.81Å; T250-Y254 HydrophobicContact CG2-CD2 3.52Å; T250-Y254 HydrophobicContact CG2-CE2 3.59Å; T250-Y254 WeakPolarHBondContact O-CD2 3.26Å; T250-Y254 PolarHBondContact O-N 3.42Å; T250-L297 HydrophobicContact CG2-CD1 3.69Å; T250-V301 HydrophobicContact CG2-CG2 4.48Å
251	N	94.4	Very high	93.5	Very high	59 Å²	59	49.5 Å²	49.5	32%	0.316	24%	0.241	S	C	.	.	H	α-helix	trans	-62.3	-47.7	176.1	-169.3	-37.6	0	0	0	111	L247 T248 E249 L253 A255 C300 Q304	L247-N251 VanDerWaalsContact O-CB 3.22Å; L247-N251 WeakPolarHBondContact O-CB 3.31Å; L247-N251 PolarHBondContact O-N 3.34Å; T248-N251 WeakPolarHBondContact O-CB 3.21Å; T248-N251 PolarHBondContact O-N 3.33Å; E249-N251 VanDerWaalsContact C-N 3.32Å; E249-N251 PolarHBondContact O-N 2.72Å; N251-L253 PolarHBondContact O-N 3.31Å; N251-A255 WeakPolarHBondContact O-CB 3.18Å; N251-A255 PolarHBondContact O-N 3.38Å; N251-C300 VanDerWaalsContact CB-SG 3.56Å; N251-Q304 PolarHBondContact OD1-NE2 3Å
252	R	94.4	Very high	93.6	Very high	147 Å²	147	49.3 Å²	49.3	56%	0.555	24%	0.238	S	C	*	.	H	α-helix	trans	-59.3	-45.3	177.4	-173.3	-178.3	68.7	83.1	2.1	112.1	T248 E249 A256	T248-R252 PolarHBondContact O-N 3.28Å; E249-R252 PolarHBondContact O-N 2.73Å; E249-R252 IonicContact OE2-CZ 2.67Å; E249-R252 VanDerWaalsContact OE2-CZ 3.28Å; E249-R252 IonicContact OE2-NE 2.73Å; E249-R252 PolarHBondContact OE2-NE 2.83Å; E249-R252 IonicContact OE2-NH2 3.11Å; E249-R252 PolarHBondContact OE2-NH2 3.34Å; R252-A256 PolarHBondContact O-N 3.37Å
253	L	94.1	Very high	93.5	Very high	28 Å²	28	57 Å²	57	15%	0.147	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-53.6	180	-175.4	156.1	0	0	0	111.3	E212 E249 T250 N251 A255 A256 E257	E212-L253 HydrophobicContact CG-CD1 4.21Å; E249-L253 WeakPolarHBondContact O-CB 3.27Å; E249-L253 PolarHBondContact O-N 3.4Å; T250-L253 PolarHBondContact O-N 2.81Å; N251-L253 PolarHBondContact O-N 3.31Å; L253-A255 VanDerWaalsContact C-N 3.33Å; L253-A255 PolarHBondContact O-N 3.33Å; L253-A256 PolarHBondContact O-N 2.8Å; L253-E257 WeakPolarHBondContact CD2-OE2 3.35Å; L253-E257 WeakPolarHBondContact O-CB 3.47Å; L253-E257 PolarHBondContact O-N 3Å
254	Y	95.6	Very high	93.4	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-71.1	-27.5	-177.4	-75.4	-56.3	0	0	0	113.4	T250 E257 G258 R277 E281 V301 L305	T250-Y254 HydrophobicContact CG2-CD2 3.52Å; T250-Y254 HydrophobicContact CG2-CE2 3.59Å; T250-Y254 WeakPolarHBondContact O-CD2 3.26Å; T250-Y254 PolarHBondContact O-N 3.42Å; Y254-E257 WeakPolarHBondContact CD1-OE2 3.26Å; Y254-E257 WeakPolarHBondContact CE1-OE2 3.36Å; Y254-E257 PolarHBondContact O-N 2.88Å; Y254-G258 PolarHBondContact O-N 3.21Å; Y254-R277 HydrophobicContact CE1-CB 4.34Å; Y254-R277 HydrophobicContact CE1-CG 4.13Å; Y254-E281 HydrophobicContact CE2-CG 4.49Å; Y254-E281 WeakPolarHBondContact CE2-OE1 3.4Å; Y254-E281 PolarHBondContact OH-OE1 3.01Å; Y254-V301 HydrophobicContact CD2-CB 4.35Å; Y254-V301 HydrophobicContact CD2-CG1 4.31Å; Y254-V301 HydrophobicContact CD2-CG2 3.61Å; Y254-V301 HydrophobicContact CE1-CG1 4.47Å; Y254-V301 HydrophobicContact CE2-CB 4.35Å; Y254-V301 HydrophobicContact CE2-CG1 4.19Å; Y254-V301 HydrophobicContact CE2-CG2 3.38Å; Y254-L305 HydrophobicContact CD1-CD1 3.8Å; Y254-L305 HydrophobicContact CD1-CD2 4Å; Y254-L305 HydrophobicContact CD1-CG 4.01Å; Y254-L305 HydrophobicContact CE1-CD1 4.08Å; Y254-L305 HydrophobicContact CG-CG 4.39Å
255	A	94.1	Very high	93.4	Very high	21 Å²	21	60.5 Å²	60.5	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-44.6	171	0	0	0	0	0	111.6	N251 L253 Q259	N251-A255 WeakPolarHBondContact O-CB 3.18Å; N251-A255 PolarHBondContact O-N 3.38Å; L253-A255 VanDerWaalsContact C-N 3.33Å; L253-A255 PolarHBondContact O-N 3.33Å; A255-Q259 WeakPolarHBondContact O-CG 3.35Å; A255-Q259 PolarHBondContact O-N 2.8Å
256	A	94.1	Very high	93.4	Very high	60 Å²	60	61.7 Å²	61.7	50%	0.496	30%	0.299	S	S	.	.	H	α-helix	trans	-69.5	-41.6	176.5	0	0	0	0	0	112	R252 L253 Q259 R260	R252-A256 PolarHBondContact O-N 3.37Å; L253-A256 PolarHBondContact O-N 2.8Å; A256-Q259 PolarHBondContact O-N 3.48Å; A256-R260 WeakPolarHBondContact O-CB 3.32Å; A256-R260 PolarHBondContact O-N 2.88Å
257	E	93.7	Very high	93.3	Very high	13 Å²	13	62.2 Å²	62.2	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-43.1	179.4	-170.9	172.1	-173.2	0	0	111.9	L253 Y254 R260 L261 H273 R277	L253-E257 WeakPolarHBondContact CD2-OE2 3.35Å; L253-E257 WeakPolarHBondContact O-CB 3.47Å; L253-E257 PolarHBondContact O-N 3Å; Y254-E257 WeakPolarHBondContact CD1-OE2 3.26Å; Y254-E257 WeakPolarHBondContact CE1-OE2 3.36Å; Y254-E257 PolarHBondContact O-N 2.88Å; E257-R260 PolarHBondContact O-N 2.76Å; E257-L261 HydrophobicContact CG-CD1 3.64Å; E257-L261 HydrophobicContact CG-CG 4.21Å; E257-L261 WeakPolarHBondContact O-CB 3.14Å; E257-L261 WeakPolarHBondContact O-CG 2.86Å; E257-L261 PolarHBondContact O-N 3.19Å; E257-H273 IonicContact OE1-CE1 3.2Å; E257-H273 PolarHBondContact OE1-CE1 3.07Å; E257-H273 IonicContact OE1-NE2 2.72Å; E257-H273 PolarHBondContact OE1-NE2 2.85Å; E257-R277 IonicContact OE1-CZ 2.66Å; E257-R277 IonicContact OE1-NE 3.14Å; E257-R277 PolarHBondContact OE1-NE 3.23Å; E257-R277 VanDerWaalsContact OE1-NE 3.09Å; E257-R277 IonicContact OE1-NH2 3.88Å; E257-R277 PolarHBondContact OE1-NH2 2.81Å; E257-R277 IonicContact OE2-NE 3.21Å; E257-R277 IonicContact OE2-NH2 3.42Å
258	G	92.6	Very high	93.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-49.2	176.2	0	0	0	0	0	112.3	Y254 R260 M262 H309	Y254-G258 PolarHBondContact O-N 3.21Å; G258-R260 PolarHBondContact O-N 2.91Å; G258-M262 VanDerWaalsContact O-CB 3.23Å; G258-M262 WeakPolarHBondContact O-CB 3.32Å; G258-M262 PolarHBondContact O-N 3.12Å; G258-H309 VanDerWaalsContact C-NE2 3.34Å
259	Q	92.3	Very high	93.1	Very high	117 Å²	117	62.6 Å²	62.6	55%	0.547	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-45.9	178.6	-71.7	176.2	13	0	0	112.7	A255 A256 H309	A255-Q259 WeakPolarHBondContact O-CG 3.35Å; A255-Q259 PolarHBondContact O-N 2.8Å; A256-Q259 PolarHBondContact O-N 3.48Å; Q259-H309 PolarHBondContact N-NE2 3.15Å
260	R	94.4	Very high	93.3	Very high	131 Å²	131	59.5 Å²	59.5	49%	0.494	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-52.8	-179.8	-177.2	-174.2	65.1	178.8	-2.7	111.4	A256 E257 G258 M262 Q263 E264	A256-R260 WeakPolarHBondContact O-CB 3.32Å; A256-R260 PolarHBondContact O-N 2.88Å; E257-R260 PolarHBondContact O-N 2.76Å; G258-R260 PolarHBondContact O-N 2.91Å; R260-M262 VanDerWaalsContact C-N 3.3Å; R260-M262 PolarHBondContact O-N 3.46Å; R260-Q263 PolarHBondContact O-N 3.41Å; R260-Q263 VanDerWaalsContact O-N 3.08Å; R260-E264 WeakPolarHBondContact CD-OE1 3.49Å; R260-E264 VanDerWaalsContact CG-CD 3.43Å; R260-E264 HydrophobicContact CG-CG 4.25Å; R260-E264 WeakPolarHBondContact CG-OE1 3.2Å; R260-E264 IonicContact NE-OE2 2.86Å; R260-E264 WeakPolarHBondContact O-CG 3.28Å; R260-E264 PolarHBondContact O-N 2.67Å
261	L	93.8	Very high	93.2	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-69.4	-27.1	-174.4	-67.2	179.5	0	0	0	113	E257 Q263 R265 Y270 H273	E257-L261 HydrophobicContact CG-CD1 3.64Å; E257-L261 HydrophobicContact CG-CG 4.21Å; E257-L261 WeakPolarHBondContact O-CB 3.14Å; E257-L261 WeakPolarHBondContact O-CG 2.86Å; E257-L261 PolarHBondContact O-N 3.19Å; L261-Q263 PolarHBondContact O-N 2.89Å; L261-R265 HydrophobicContact CD2-CG 4.41Å; L261-R265 PolarHBondContact O-N 3.49Å; L261-Y270 HydrophobicContact CB-CD2 3.81Å; L261-Y270 HydrophobicContact CB-CE2 3.86Å; L261-H273 WeakPolarHBondContact CD1-CD2 3.41Å; L261-H273 WeakPolarHBondContact CD1-NE2 3.49Å
262	M	91	Very high	93.3	Very high	15 Å²	15	60.9 Å²	60.9	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-19.7	173.4	-166.6	58	48.5	0	0	113.6	G258 R260 Y270 H309 A312 V313 K316	G258-M262 VanDerWaalsContact O-CB 3.23Å; G258-M262 WeakPolarHBondContact O-CB 3.32Å; G258-M262 PolarHBondContact O-N 3.12Å; R260-M262 VanDerWaalsContact C-N 3.3Å; R260-M262 PolarHBondContact O-N 3.46Å; M262-Y270 HydrophobicContact CE-CD1 3.56Å; M262-Y270 HydrophobicContact CE-CD2 3.86Å; M262-Y270 HydrophobicContact CE-CE1 3.27Å; M262-Y270 HydrophobicContact CE-CE2 3.59Å; M262-Y270 HydrophobicContact CE-CG 3.85Å; M262-H309 HydrophobicContact CE-CB 3.85Å; M262-A312 HydrophobicContact CG-CB 4.39Å; M262-A312 HydrophobicContact SD-CB 4.37Å; M262-V313 HydrophobicContact CE-CG2 3.43Å; M262-V313 VanDerWaalsContact CE-CG2 3.43Å; M262-V313 HydrophobicContact SD-CG2 3.82Å; M262-K316 PolarHBondContact O-NZ 3.44Å
263	Q	90.4	Very high	93.3	Very high	161 Å²	161	54.2 Å²	54.2	75%	0.752	26%	0.264	S	S	*	.	H	α-helix	trans	-96.7	-38.4	176.5	-64.4	179.1	17.2	0	0	111.8	R260 L261	R260-Q263 PolarHBondContact O-N 3.41Å; R260-Q263 VanDerWaalsContact O-N 3.08Å; L261-Q263 PolarHBondContact O-N 2.89Å
264	E	92.3	Very high	93.3	Very high	127 Å²	127	52.9 Å²	52.9	59%	0.593	26%	0.257	S	S	*	.	H	α-helix	trans	-81.5	-29.4	-174.8	-70.5	176.6	179.8	0	0	114.2	R260	R260-E264 WeakPolarHBondContact CD-OE1 3.49Å; R260-E264 VanDerWaalsContact CG-CD 3.43Å; R260-E264 HydrophobicContact CG-CG 4.25Å; R260-E264 WeakPolarHBondContact CG-OE1 3.2Å; R260-E264 IonicContact NE-OE2 2.86Å; R260-E264 WeakPolarHBondContact O-CG 3.28Å; R260-E264 PolarHBondContact O-N 2.67Å
265	R	91	Very high	93.3	Very high	104 Å²	104	54.3 Å²	54.3	39%	0.392	27%	0.269	S	S	.	.	S	Bend	trans	-123.3	156.5	-170.3	-60.2	-170.1	-175	177.7	0.5	113.2	L261 E269	L261-R265 HydrophobicContact CD2-CG 4.41Å; L261-R265 PolarHBondContact O-N 3.49Å; R265-E269 HydrophobicContact CB-CB 4.42Å
266	D	92.1	Very high	93.3	Very high	121 Å²	121	58.5 Å²	58.5	65%	0.647	28%	0.28	S	S	*	.			trans	-73.6	156.6	172.1	-70.8	-24	0	0	0	111.8	E269 Y270	D266-E269 PolarHBondContact O-N 2.92Å; D266-E269 VanDerWaalsContact O-N 3.17Å; D266-Y270 WeakPolarHBondContact O-CB 3.2Å; D266-Y270 PolarHBondContact O-N 3.22Å
267	V	92.6	Very high	93.3	Very high	11 Å²	11	56.4 Å²	56.4	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-44.8	-177.4	169.6	0	0	0	0	113.6	E269 Y270 L271 V313 K316 L321	V267-E269 PolarHBondContact O-N 3.36Å; V267-Y270 PolarHBondContact O-N 3.41Å; V267-L271 HydrophobicContact CG1-CD1 3.96Å; V267-L271 HydrophobicContact CG1-CG 4.25Å; V267-L271 VanDerWaalsContact O-CG 3.28Å; V267-L271 WeakPolarHBondContact O-CG 3.42Å; V267-L271 PolarHBondContact O-N 3.43Å; V267-V313 HydrophobicContact CG1-CG1 3.76Å; V267-V313 HydrophobicContact CG2-CG1 4.48Å; V267-K316 HydrophobicContact CG2-CB 4.38Å; V267-L321 HydrophobicContact CG1-CD1 4.26Å
268	P	93.3	Very high	93.3	Very high	20 Å²	20	56.3 Å²	56.3	13%	0.13	26%	0.259	C	S	.	.	H	α-helix	trans	-53.2	-50	174.5	-27.8	35.4	0	0	0	113.4	Y270 L271 H272 L321 E329	P268-Y270 VanDerWaalsContact C-N 3.35Å; P268-L271 PolarHBondContact O-N 2.89Å; P268-H272 PolarHBondContact O-N 3.32Å; P268-H272 PolarHBondContact O-ND1 2.91Å; P268-L321 HydrophobicContact CG-CD2 3.96Å; P268-E329 HydrophobicContact CB-CG 3.92Å; P268-E329 HydrophobicContact CG-CG 4.47Å
269	E	93.1	Very high	93.4	Very high	112 Å²	112	63.3 Å²	63.3	52%	0.523	29%	0.292	S	S	.	.	H	α-helix	trans	-68.7	-37.2	-177.9	-61.7	-174.8	169.6	0	0	111.6	R265 D266 V267 H272 H273	R265-E269 HydrophobicContact CB-CB 4.42Å; D266-E269 PolarHBondContact O-N 2.92Å; D266-E269 VanDerWaalsContact O-N 3.17Å; V267-E269 PolarHBondContact O-N 3.36Å; E269-H272 PolarHBondContact O-N 3.03Å; E269-H273 WeakPolarHBondContact O-CB 3.45Å; E269-H273 PolarHBondContact O-N 3.36Å
270	Y	94.8	Very high	93.5	Very high	1 Å²	1	59.9 Å²	59.9	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-47.9	174.3	-176.4	-96.9	0	0	0	111.6	L261 M262 D266 V267 P268 H272 H273 V274 L305 V313	L261-Y270 HydrophobicContact CB-CD2 3.81Å; L261-Y270 HydrophobicContact CB-CE2 3.86Å; M262-Y270 HydrophobicContact CE-CD1 3.56Å; M262-Y270 HydrophobicContact CE-CD2 3.86Å; M262-Y270 HydrophobicContact CE-CE1 3.27Å; M262-Y270 HydrophobicContact CE-CE2 3.59Å; M262-Y270 HydrophobicContact CE-CG 3.85Å; D266-Y270 WeakPolarHBondContact O-CB 3.2Å; D266-Y270 PolarHBondContact O-N 3.22Å; V267-Y270 PolarHBondContact O-N 3.41Å; P268-Y270 VanDerWaalsContact C-N 3.35Å; Y270-H272 PolarHBondContact O-N 3.41Å; Y270-H273 WeakPolarHBondContact O-CB 3.31Å; Y270-H273 PolarHBondContact O-N 3.47Å; Y270-H273 VanDerWaalsContact O-N 3.14Å; Y270-V274 HydrophobicContact CD1-CG2 4.02Å; Y270-V274 HydrophobicContact CE1-CG2 3.57Å; Y270-V274 HydrophobicContact CE2-CG2 4.48Å; Y270-V274 WeakPolarHBondContact O-CG2 3.41Å; Y270-V274 PolarHBondContact O-N 2.99Å; Y270-L305 WeakPolarHBondContact CE1-O 3.45Å; Y270-L305 PolarHBondContact OH-O 3.16Å; Y270-V313 HydrophobicContact CD1-CG2 4.26Å; Y270-V313 HydrophobicContact CE1-CG2 4.22Å
271	L	94.3	Very high	93.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-41.5	179.9	-66.6	169.9	0	0	0	112.2	V267 P268 H273 V274 A275 V313 L332 L333 L336 F337	V267-L271 HydrophobicContact CG1-CD1 3.96Å; V267-L271 HydrophobicContact CG1-CG 4.25Å; V267-L271 VanDerWaalsContact O-CG 3.28Å; V267-L271 WeakPolarHBondContact O-CG 3.42Å; V267-L271 PolarHBondContact O-N 3.43Å; P268-L271 PolarHBondContact O-N 2.89Å; L271-H273 VanDerWaalsContact C-N 3.31Å; L271-H273 PolarHBondContact O-N 3.36Å; L271-V274 PolarHBondContact O-N 3.2Å; L271-A275 PolarHBondContact O-N 3Å; L271-V313 HydrophobicContact CD2-CG1 4.41Å; L271-L332 HydrophobicContact CB-CD2 3.89Å; L271-L332 HydrophobicContact CB-CG 4.35Å; L271-L333 HydrophobicContact CD1-CB 3.87Å; L271-L333 HydrophobicContact CD1-CD1 4.06Å; L271-L333 HydrophobicContact CD1-CG 4.31Å; L271-L336 HydrophobicContact CB-CD1 4.13Å; L271-L336 HydrophobicContact CD2-CD1 3.87Å; L271-F337 HydrophobicContact CD2-CE2 4.48Å
272	H	94.9	Very high	93.4	Very high	87 Å²	87	56.9 Å²	56.9	40%	0.403	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-40	174.7	-74.2	92.4	0	0	0	111.7	P268 E269 Y270 A275 R276 E329	P268-H272 PolarHBondContact O-N 3.32Å; P268-H272 PolarHBondContact O-ND1 2.91Å; E269-H272 PolarHBondContact O-N 3.03Å; Y270-H272 PolarHBondContact O-N 3.41Å; H272-A275 PolarHBondContact O-N 3.07Å; H272-R276 WeakPolarHBondContact O-CB 3.41Å; H272-R276 PolarHBondContact O-N 3.22Å; H272-E329 IonicContact CE1-OE1 3.81Å
273	H	94.4	Very high	93.6	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-43.8	175.2	-179.8	81.5	0	0	0	112.1	E257 L261 E269 Y270 L271 A275 R276 R277	E257-H273 IonicContact OE1-CE1 3.2Å; E257-H273 PolarHBondContact OE1-CE1 3.07Å; E257-H273 IonicContact OE1-NE2 2.72Å; E257-H273 PolarHBondContact OE1-NE2 2.85Å; L261-H273 WeakPolarHBondContact CD1-CD2 3.41Å; L261-H273 WeakPolarHBondContact CD1-NE2 3.49Å; E269-H273 WeakPolarHBondContact O-CB 3.45Å; E269-H273 PolarHBondContact O-N 3.36Å; Y270-H273 WeakPolarHBondContact O-CB 3.31Å; Y270-H273 PolarHBondContact O-N 3.47Å; Y270-H273 VanDerWaalsContact O-N 3.14Å; L271-H273 VanDerWaalsContact C-N 3.31Å; L271-H273 PolarHBondContact O-N 3.36Å; H273-A275 PolarHBondContact O-N 3.36Å; H273-R276 PolarHBondContact CE1-NH2 2.92Å; H273-R276 PolarHBondContact ND1-NH2 3.25Å; H273-R276 PolarHBondContact O-N 3.48Å; H273-R277 PolarHBondContact CE1-NE 3.29Å; H273-R277 WeakPolarHBondContact O-CG 3.23Å; H273-R277 PolarHBondContact O-N 3.02Å
274	V	94.8	Very high	93.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-44.7	176.2	177	0	0	0	0	111.3	Y270 L271 R276 R277 L278 L305 L306 L336	Y270-V274 HydrophobicContact CD1-CG2 4.02Å; Y270-V274 HydrophobicContact CE1-CG2 3.57Å; Y270-V274 HydrophobicContact CE2-CG2 4.48Å; Y270-V274 WeakPolarHBondContact O-CG2 3.41Å; Y270-V274 PolarHBondContact O-N 2.99Å; L271-V274 PolarHBondContact O-N 3.2Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 3.48Å; V274-R277 PolarHBondContact O-N 3.22Å; V274-L278 HydrophobicContact CG1-CD1 4.21Å; V274-L278 WeakPolarHBondContact O-CG 3.26Å; V274-L278 PolarHBondContact O-N 2.95Å; V274-L305 HydrophobicContact CG1-CB 4.17Å; V274-L305 HydrophobicContact CG1-CD1 4.39Å; V274-L305 HydrophobicContact CG2-CB 3.95Å; V274-L305 HydrophobicContact CG2-CD1 4.3Å; V274-L306 HydrophobicContact CB-CD2 4.46Å; V274-L306 HydrophobicContact CG1-CD1 4.08Å; V274-L306 HydrophobicContact CG1-CD2 3.86Å; V274-L306 HydrophobicContact CG1-CG 3.84Å; V274-L306 HydrophobicContact CG2-CD2 4.35Å; V274-L336 HydrophobicContact CB-CD1 4.43Å; V274-L336 HydrophobicContact CG1-CD1 4.47Å; V274-L336 HydrophobicContact CG1-CD2 4.34Å
275	A	95.1	Very high	93.7	Very high	29 Å²	29	46.3 Å²	46.3	24%	0.24	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-45.5	177.5	0	0	0	0	0	111.8	L271 H272 H273 L278 E279 L332 L336	L271-A275 PolarHBondContact O-N 3Å; H272-A275 PolarHBondContact O-N 3.07Å; H273-A275 PolarHBondContact O-N 3.36Å; A275-L278 PolarHBondContact O-N 2.87Å; A275-E279 PolarHBondContact O-N 3.35Å; A275-L332 HydrophobicContact CB-CD1 3.96Å; A275-L336 HydrophobicContact CB-CD2 4.47Å
276	R	94.9	Very high	93.8	Very high	110 Å²	110	46.5 Å²	46.5	42%	0.415	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-45.8	175.2	-175.3	-177.1	65.5	107.9	-6.3	112	H272 H273 V274 L278 E279 E280	H272-R276 WeakPolarHBondContact O-CB 3.41Å; H272-R276 PolarHBondContact O-N 3.22Å; H273-R276 PolarHBondContact CE1-NH2 2.92Å; H273-R276 PolarHBondContact ND1-NH2 3.25Å; H273-R276 PolarHBondContact O-N 3.48Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 3.48Å; R276-L278 VanDerWaalsContact C-N 3.33Å; R276-L278 PolarHBondContact O-N 2.97Å; R276-E279 PolarHBondContact O-N 3.22Å; R276-E280 HydrophobicContact CG-CG 4.43Å; R276-E280 WeakPolarHBondContact CG-OE1 3.08Å; R276-E280 IonicContact CZ-OE1 2.71Å; R276-E280 IonicContact NE-OE1 3.88Å; R276-E280 IonicContact NH1-OE1 3.33Å; R276-E280 PolarHBondContact NH1-OE1 2.8Å; R276-E280 WeakPolarHBondContact O-CG 3.48Å; R276-E280 PolarHBondContact O-N 3.48Å
277	R	94.2	Very high	93.8	Very high	16 Å²	16	41.9 Å²	41.9	6%	0.06	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-40.6	178	-73	-57.5	-165.9	-168.5	8.4	112.5	R215 Y254 E257 H273 V274 E279 E280 E281 L305	R215-R277 PolarHBondContact O-NH1 3.3Å; R215-R277 PolarHBondContact O-NH2 3.29Å; Y254-R277 HydrophobicContact CE1-CB 4.34Å; Y254-R277 HydrophobicContact CE1-CG 4.13Å; E257-R277 IonicContact OE1-CZ 2.66Å; E257-R277 IonicContact OE1-NE 3.14Å; E257-R277 PolarHBondContact OE1-NE 3.23Å; E257-R277 VanDerWaalsContact OE1-NE 3.09Å; E257-R277 IonicContact OE1-NH2 3.88Å; E257-R277 PolarHBondContact OE1-NH2 2.81Å; E257-R277 IonicContact OE2-NE 3.21Å; E257-R277 IonicContact OE2-NH2 3.42Å; H273-R277 PolarHBondContact CE1-NE 3.29Å; H273-R277 WeakPolarHBondContact O-CG 3.23Å; H273-R277 PolarHBondContact O-N 3.02Å; V274-R277 PolarHBondContact O-N 3.22Å; R277-E279 VanDerWaalsContact C-N 3.34Å; R277-E280 WeakPolarHBondContact CD-OE2 3.1Å; R277-E280 IonicContact CZ-OE2 3.52Å; R277-E280 IonicContact NH1-OE2 3.23Å; R277-E280 PolarHBondContact NH1-OE2 2.95Å; R277-E280 PolarHBondContact O-N 3.42Å; R277-E281 WeakPolarHBondContact O-CG 3.44Å; R277-E281 PolarHBondContact O-N 2.88Å; R277-L305 HydrophobicContact CB-CD1 4.12Å; R277-L305 HydrophobicContact CG-CD1 4.32Å
278	L	94.2	Very high	93.7	Very high	11 Å²	11	41.9 Å²	41.9	6%	0.058	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-38.9	175.9	-70.5	172	0	0	0	112.2	V274 A275 R276 N282 I298 V301 E302 L336	V274-L278 HydrophobicContact CG1-CD1 4.21Å; V274-L278 WeakPolarHBondContact O-CG 3.26Å; V274-L278 PolarHBondContact O-N 2.95Å; A275-L278 PolarHBondContact O-N 2.87Å; R276-L278 VanDerWaalsContact C-N 3.33Å; R276-L278 PolarHBondContact O-N 2.97Å; L278-N282 WeakPolarHBondContact O-CB 3.42Å; L278-N282 PolarHBondContact O-N 3.36Å; L278-I298 HydrophobicContact CD2-CD1 4.49Å; L278-I298 HydrophobicContact CD2-CG2 4.4Å; L278-V301 HydrophobicContact CD2-CB 4.17Å; L278-V301 HydrophobicContact CD2-CG1 3.86Å; L278-E302 HydrophobicContact CD2-CG 3.93Å; L278-L336 HydrophobicContact CD1-CD2 3.8Å
279	E	93.9	Very high	93.8	Very high	146 Å²	146	41.7 Å²	41.7	68%	0.682	21%	0.209	S	C	*	.	H	α-helix	trans	-66.1	-46.2	175.5	-173.4	173.3	-164.6	0	0	111.6	A275 R276 R277 E281 N282 D283	A275-E279 PolarHBondContact O-N 3.35Å; R276-E279 PolarHBondContact O-N 3.22Å; R277-E279 VanDerWaalsContact C-N 3.34Å; E279-E281 PolarHBondContact O-N 2.93Å; E279-N282 PolarHBondContact O-N 2.8Å; E279-D283 PolarHBondContact O-N 3.17Å
280	E	93.5	Very high	93.7	Very high	45 Å²	45	38.7 Å²	38.7	21%	0.21	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-45.3	175.8	-72.9	173.1	-170.2	0	0	112.3	R276 R277 N282 D283 R284	R276-E280 HydrophobicContact CG-CG 4.43Å; R276-E280 WeakPolarHBondContact CG-OE1 3.08Å; R276-E280 IonicContact CZ-OE1 2.71Å; R276-E280 IonicContact NE-OE1 3.88Å; R276-E280 IonicContact NH1-OE1 3.33Å; R276-E280 PolarHBondContact NH1-OE1 2.8Å; R276-E280 WeakPolarHBondContact O-CG 3.48Å; R276-E280 PolarHBondContact O-N 3.48Å; R277-E280 WeakPolarHBondContact CD-OE2 3.1Å; R277-E280 IonicContact CZ-OE2 3.52Å; R277-E280 IonicContact NH1-OE2 3.23Å; R277-E280 PolarHBondContact NH1-OE2 2.95Å; R277-E280 PolarHBondContact O-N 3.42Å; E280-N282 VanDerWaalsContact C-N 3.33Å; E280-N282 PolarHBondContact O-N 3.45Å; E280-D283 PolarHBondContact O-N 3.36Å; E280-R284 WeakPolarHBondContact O-CG 3.35Å; E280-R284 PolarHBondContact O-N 2.99Å; E280-R284 IonicContact OE2-NH2 2.66Å; E280-R284 PolarHBondContact OE2-NH2 2.93Å
281	E	94.4	Very high	93.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-36.8	177.4	-67.9	-66	169.1	0	0	112	R215 Y254 R277 E279 R284 I285 L297 I298 V301	R215-E281 IonicContact CZ-OE1 3.33Å; R215-E281 VanDerWaalsContact CZ-OE1 3.24Å; R215-E281 IonicContact NE-OE1 2.73Å; R215-E281 PolarHBondContact NE-OE1 2.75Å; R215-E281 IonicContact NH2-OE1 3.07Å; R215-E281 PolarHBondContact NH2-OE1 2.97Å; R215-E281 IonicContact NH2-OE2 2.8Å; R215-E281 PolarHBondContact NH2-OE2 2.84Å; Y254-E281 HydrophobicContact CE2-CG 4.49Å; Y254-E281 WeakPolarHBondContact CE2-OE1 3.4Å; Y254-E281 PolarHBondContact OH-OE1 3.01Å; R277-E281 WeakPolarHBondContact O-CG 3.44Å; R277-E281 PolarHBondContact O-N 2.88Å; E279-E281 PolarHBondContact O-N 2.93Å; E281-R284 PolarHBondContact O-N 2.67Å; E281-R284 IonicContact OE1-CZ 3.92Å; E281-R284 IonicContact OE1-NH1 3.4Å; E281-R284 PolarHBondContact OE1-NH1 3Å; E281-R284 IonicContact OE2-NH1 2.83Å; E281-R284 PolarHBondContact OE2-NH1 3.47Å; E281-R284 VanDerWaalsContact OE2-NH1 3.14Å; E281-I285 WeakPolarHBondContact O-CD1 3.48Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.21Å; E281-I285 PolarHBondContact O-N 3.35Å; E281-L297 HydrophobicContact CB-CD2 4.39Å; E281-I298 HydrophobicContact CB-CD1 4.1Å; E281-V301 HydrophobicContact CG-CG2 4.15Å
282	N	93.1	Very high	93.4	Very high	70 Å²	70	46.6 Å²	46.6	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-66.8	-38.2	175.6	-167.1	77.3	0	0	0	112	L278 E279 E280 I285 V286 Q294	L278-N282 WeakPolarHBondContact O-CB 3.42Å; L278-N282 PolarHBondContact O-N 3.36Å; E279-N282 PolarHBondContact O-N 2.8Å; E280-N282 VanDerWaalsContact C-N 3.33Å; E280-N282 PolarHBondContact O-N 3.45Å; N282-I285 PolarHBondContact O-N 3.25Å; N282-V286 WeakPolarHBondContact O-CG2 3.49Å; N282-V286 PolarHBondContact O-N 3.06Å; N282-Q294 PolarHBondContact OD1-NE2 3.38Å
283	D	93.6	Very high	93.4	Very high	70 Å²	70	42.4 Å²	42.4	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-64	-40	172.1	179.8	62.1	0	0	0	112.2	R222 E279 E280 I285 V286 S287	R222-D283 IonicContact CZ-OD2 3.82Å; R222-D283 IonicContact NH1-OD1 3.64Å; R222-D283 IonicContact NH1-OD2 3.02Å; R222-D283 PolarHBondContact NH1-OD2 3.35Å; R222-D283 IonicContact NH2-OD2 2.87Å; R222-D283 PolarHBondContact NH2-OD2 2.99Å; E279-D283 PolarHBondContact O-N 3.17Å; E280-D283 PolarHBondContact O-N 3.36Å; D283-I285 VanDerWaalsContact C-N 3.33Å; D283-I285 PolarHBondContact O-N 2.73Å; D283-V286 PolarHBondContact O-N 3.15Å; D283-S287 VanDerWaalsContact O-CB 3.28Å; D283-S287 WeakPolarHBondContact O-CB 3.46Å; D283-S287 PolarHBondContact O-N 2.72Å; D283-S287 PolarHBondContact O-OG 3.4Å
284	R	92.9	Very high	93.3	Very high	7 Å²	7	45.1 Å²	45.1	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-40.1	174.6	-71.3	178.7	-160	104.9	9.2	112.1	E214 E280 E281 S287 Y288 L289	E214-R284 IonicContact OE2-NE 3.67Å; E280-R284 WeakPolarHBondContact O-CG 3.35Å; E280-R284 PolarHBondContact O-N 2.99Å; E280-R284 IonicContact OE2-NH2 2.66Å; E280-R284 PolarHBondContact OE2-NH2 2.93Å; E281-R284 PolarHBondContact O-N 2.67Å; E281-R284 IonicContact OE1-CZ 3.92Å; E281-R284 IonicContact OE1-NH1 3.4Å; E281-R284 PolarHBondContact OE1-NH1 3Å; E281-R284 IonicContact OE2-NH1 2.83Å; E281-R284 PolarHBondContact OE2-NH1 3.47Å; E281-R284 VanDerWaalsContact OE2-NH1 3.14Å; R284-S287 PolarHBondContact O-N 3.37Å; R284-Y288 HydrophobicContact CB-CE1 4.45Å; R284-Y288 HydrophobicContact CB-CE2 4.49Å; R284-Y288 WeakPolarHBondContact CD-OH 3.39Å; R284-Y288 HydrophobicContact CG-CE1 4.31Å; R284-Y288 WeakPolarHBondContact CG-OH 3.29Å; R284-Y288 PolarHBondContact O-N 3.23Å; R284-L289 HydrophobicContact CB-CD1 4.38Å; R284-L289 PolarHBondContact O-N 3.22Å
285	I	92.7	Very high	93.2	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-49.1	175.2	-69.3	155.2	0	0	0	110.8	E281 N282 D283 S287 L289 Q294 L297 I298	E281-I285 WeakPolarHBondContact O-CD1 3.48Å; E281-I285 VanDerWaalsContact O-CG1 3.27Å; E281-I285 WeakPolarHBondContact O-CG1 3.21Å; E281-I285 PolarHBondContact O-N 3.35Å; N282-I285 PolarHBondContact O-N 3.25Å; D283-I285 VanDerWaalsContact C-N 3.33Å; D283-I285 PolarHBondContact O-N 2.73Å; I285-S287 VanDerWaalsContact C-N 3.28Å; I285-S287 PolarHBondContact O-N 2.95Å; I285-L289 HydrophobicContact CG1-CD1 4.07Å; I285-Q294 HydrophobicContact CD1-CB 4.02Å; I285-Q294 HydrophobicContact CD1-CG 3.89Å; I285-Q294 HydrophobicContact CG2-CB 3.98Å; I285-Q294 HydrophobicContact CG2-CG 4.4Å; I285-L297 HydrophobicContact CD1-CD2 3.95Å; I285-L297 HydrophobicContact CG1-CD2 3.93Å; I285-I298 HydrophobicContact CD1-CD1 4.17Å; I285-I298 HydrophobicContact CD1-CG1 4.09Å
286	V	92.3	Very high	93.2	Very high	108 Å²	108	54 Å²	54	66%	0.655	27%	0.27	S	S	*	.	H	α-helix	trans	-66.8	-32.7	179	176.1	0	0	0	0	111.9	N282 D283	N282-V286 WeakPolarHBondContact O-CG2 3.49Å; N282-V286 PolarHBondContact O-N 3.06Å; D283-V286 PolarHBondContact O-N 3.15Å
287	S	92.4	Very high	93.2	Very high	25 Å²	25	48.7 Å²	48.7	18%	0.175	25%	0.25	C	S	.	.	H	α-helix	trans	-74.5	-53.7	-175.1	-68.2	0	0	0	0	113.5	R222 R226 D283 R284 I285	R222-S287 PolarHBondContact NH1-OG 3.14Å; R222-S287 VanDerWaalsContact NH1-OG 3.08Å; R226-S287 WeakPolarHBondContact CD-O 3.48Å; D283-S287 VanDerWaalsContact O-CB 3.28Å; D283-S287 WeakPolarHBondContact O-CB 3.46Å; D283-S287 PolarHBondContact O-N 2.72Å; D283-S287 PolarHBondContact O-OG 3.4Å; R284-S287 PolarHBondContact O-N 3.37Å; I285-S287 VanDerWaalsContact C-N 3.28Å; I285-S287 PolarHBondContact O-N 2.95Å
288	Y	92.1	Very high	93.2	Very high	10 Å²	10	49.3 Å²	49.3	4%	0.039	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.9	-11.1	-168.8	58	-109	0	0	0	117.1	I211 E214 R222 L225 L229 R284	I211-Y288 HydrophobicContact CD1-CE2 4.18Å; I211-Y288 HydrophobicContact CG1-CE2 4.08Å; E214-Y288 WeakPolarHBondContact OE2-CE1 3.44Å; E214-Y288 PolarHBondContact OE2-OH 2.99Å; R222-Y288 HydrophobicContact CB-CD1 4.33Å; R222-Y288 HydrophobicContact CG-CD1 4.21Å; R222-Y288 HydrophobicContact CG-CE1 4.26Å; L225-Y288 HydrophobicContact CB-CD1 4.35Å; L225-Y288 HydrophobicContact CB-CD2 4.27Å; L225-Y288 HydrophobicContact CB-CG 4.05Å; L225-Y288 HydrophobicContact CD1-CD1 4.34Å; L225-Y288 HydrophobicContact CD1-CE1 4.03Å; L225-Y288 HydrophobicContact CD1-CE2 4.29Å; L229-Y288 HydrophobicContact CD1-CD2 3.56Å; L229-Y288 HydrophobicContact CD1-CE2 4.34Å; L229-Y288 HydrophobicContact CD1-CG 4.39Å; L229-Y288 VanDerWaalsContact CD1-O 3.25Å; L229-Y288 WeakPolarHBondContact CD1-O 3.39Å; R284-Y288 HydrophobicContact CB-CE1 4.45Å; R284-Y288 HydrophobicContact CB-CE2 4.49Å; R284-Y288 WeakPolarHBondContact CD-OH 3.39Å; R284-Y288 HydrophobicContact CG-CE1 4.31Å; R284-Y288 WeakPolarHBondContact CG-OH 3.29Å; R284-Y288 PolarHBondContact O-N 3.23Å
289	L	93.8	Very high	93.1	Very high	17 Å²	17	52 Å²	52	9%	0.089	27%	0.273	C	S	.	.	S	Bend	trans	-84.8	163.5	177.1	-58.9	168.2	0	0	0	111.8	L229 F242 F246 R284 I285 L297	L229-L289 HydrophobicContact CD1-CD2 4.03Å; F242-L289 HydrophobicContact CE1-CD2 4.07Å; F242-L289 HydrophobicContact CZ-CD2 4.26Å; F246-L289 HydrophobicContact CE1-CD1 4.2Å; F246-L289 HydrophobicContact CZ-CD1 3.99Å; F246-L289 HydrophobicContact CZ-CD2 4.42Å; R284-L289 HydrophobicContact CB-CD1 4.38Å; R284-L289 PolarHBondContact O-N 3.22Å; I285-L289 HydrophobicContact CG1-CD1 4.07Å; L289-L297 HydrophobicContact CD1-CD2 3.79Å
290	D	91.8	Very high	93.1	Very high	48 Å²	48	45.8 Å²	45.8	26%	0.257	25%	0.245	S	C	.	.			trans	-75.3	142.7	173.5	-169.9	-89.2	0	0	0	110.7	Y238 S292 T293	Y238-D290 HydrophobicContact CD1-CB 4.22Å; Y238-D290 HydrophobicContact CE1-CB 3.65Å; Y238-D290 HydrophobicContact CE2-CB 4.02Å; Y238-D290 PolarHBondContact OH-N 3.4Å; D290-S292 PolarHBondContact O-N 3.36Å; D290-S292 VanDerWaalsContact O-N 3.15Å; D290-S292 WeakPolarHBondContact OD1-CB 3.39Å; D290-S292 PolarHBondContact OD1-N 2.88Å; D290-S292 PolarHBondContact OD1-OG 3.1Å; D290-T293 WeakPolarHBondContact O-CB 3.32Å; D290-T293 PolarHBondContact O-N 3.2Å
291	Q	91.3	Very high	93.1	Very high	121 Å²	121	43.6 Å²	43.6	57%	0.565	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-60.8	-26.3	-179.1	-173.6	60.3	26.5	0	0	112.5	T293 Q294	Q291-T293 PolarHBondContact O-N 3.35Å; Q291-Q294 WeakPolarHBondContact O-CB 3.39Å; Q291-Q294 PolarHBondContact O-N 3.47Å
292	S	92.3	Very high	93	Very high	46 Å²	46	44.9 Å²	44.9	32%	0.322	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-65.7	-26.3	176	64.2	0	0	0	0	113.4	D290 P296	D290-S292 PolarHBondContact O-N 3.36Å; D290-S292 VanDerWaalsContact O-N 3.15Å; D290-S292 WeakPolarHBondContact OD1-CB 3.39Å; D290-S292 PolarHBondContact OD1-N 2.88Å; D290-S292 PolarHBondContact OD1-OG 3.1Å; S292-P296 VanDerWaalsContact O-CD 3.31Å; S292-P296 WeakPolarHBondContact O-CD 3.32Å
293	T	93.7	Very high	93	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-80.1	-15.1	180	-56.4	0	0	0	0	113.3	Y238 E243 F246 D290 Q291 K295 P296 L297	Y238-T293 WeakPolarHBondContact CE1-OG1 3.46Å; Y238-T293 PolarHBondContact OH-OG1 3.32Å; E243-T293 HydrophobicContact CG-CG2 4.36Å; E243-T293 VanDerWaalsContact OE1-CA 3.28Å; E243-T293 WeakPolarHBondContact OE1-CA 3.2Å; E243-T293 WeakPolarHBondContact OE1-CB 3.27Å; E243-T293 PolarHBondContact OE1-OG1 2.82Å; F246-T293 HydrophobicContact CD1-CG2 4.01Å; F246-T293 HydrophobicContact CE1-CG2 3.81Å; D290-T293 WeakPolarHBondContact O-CB 3.32Å; D290-T293 PolarHBondContact O-N 3.2Å; Q291-T293 PolarHBondContact O-N 3.35Å; T293-K295 PolarHBondContact O-N 3.01Å; T293-P296 WeakPolarHBondContact O-CD 3.35Å; T293-L297 HydrophobicContact CG2-CB 4.16Å; T293-L297 WeakPolarHBondContact O-CB 3.48Å; T293-L297 PolarHBondContact O-N 3.12Å
294	Q	93.1	Very high	93	Very high	64 Å²	64	44.3 Å²	44.3	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-52	-53.7	-178.9	176.3	170.3	34.3	0	0	112.3	N282 I285 Q291 I298	N282-Q294 PolarHBondContact OD1-NE2 3.38Å; I285-Q294 HydrophobicContact CD1-CB 4.02Å; I285-Q294 HydrophobicContact CD1-CG 3.89Å; I285-Q294 HydrophobicContact CG2-CB 3.98Å; I285-Q294 HydrophobicContact CG2-CG 4.4Å; Q291-Q294 WeakPolarHBondContact O-CB 3.39Å; Q291-Q294 PolarHBondContact O-N 3.47Å; Q294-I298 HydrophobicContact CG-CG1 4.47Å; Q294-I298 WeakPolarHBondContact O-CB 3.39Å; Q294-I298 VanDerWaalsContact O-CG1 3.28Å; Q294-I298 WeakPolarHBondContact O-CG1 3.46Å; Q294-I298 PolarHBondContact O-N 3.21Å
295	K	93.1	Very high	93	Very high	163 Å²	163	44 Å²	44	71%	0.709	23%	0.231	S	C	*	.	H	α-helix	trans	-68.2	-49.6	-174.1	-179.7	-178.9	-177.3	-178.9	0	111.9	T293 L297 C299	T293-K295 PolarHBondContact O-N 3.01Å; K295-L297 PolarHBondContact O-N 3.37Å; K295-C299 VanDerWaalsContact O-CB 3.31Å; K295-C299 WeakPolarHBondContact O-CB 3.27Å; K295-C299 PolarHBondContact O-N 2.71Å; K295-C299 VanDerWaalsContact O-N 3.09Å; K295-C299 PolarHBondContact O-SG 2.8Å
296	P	94.4	Very high	92.9	Very high	52 Å²	52	43.9 Å²	43.9	34%	0.338	23%	0.231	S	C	.	.	H	α-helix	trans	-58.2	-42.5	175	-26	34.5	0	0	0	114	L247 S292 T293 C300	L247-P296 HydrophobicContact CD1-CB 3.68Å; L247-P296 HydrophobicContact CD2-CB 4.06Å; S292-P296 VanDerWaalsContact O-CD 3.31Å; S292-P296 WeakPolarHBondContact O-CD 3.32Å; T293-P296 WeakPolarHBondContact O-CD 3.35Å; P296-C300 WeakPolarHBondContact O-CB 3.49Å; P296-C300 PolarHBondContact O-N 2.94Å
297	L	94.4	Very high	92.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-54.3	-178.7	174.4	58.4	0	0	0	111.5	F246 L247 T250 E281 I285 L289 T293 K295 C299 C300 V301	F246-L297 HydrophobicContact CE1-CD1 3.83Å; F246-L297 HydrophobicContact CE1-CD2 3.98Å; F246-L297 HydrophobicContact CE1-CG 4.34Å; F246-L297 HydrophobicContact CZ-CD1 3.87Å; F246-L297 HydrophobicContact CZ-CD2 3.99Å; L247-L297 HydrophobicContact CD2-CB 4.24Å; T250-L297 HydrophobicContact CG2-CD1 3.69Å; E281-L297 HydrophobicContact CB-CD2 4.39Å; I285-L297 HydrophobicContact CD1-CD2 3.95Å; I285-L297 HydrophobicContact CG1-CD2 3.93Å; L289-L297 HydrophobicContact CD1-CD2 3.79Å; T293-L297 HydrophobicContact CG2-CB 4.16Å; T293-L297 WeakPolarHBondContact O-CB 3.48Å; T293-L297 PolarHBondContact O-N 3.12Å; K295-L297 PolarHBondContact O-N 3.37Å; L297-C299 VanDerWaalsContact C-N 3.32Å; L297-C299 PolarHBondContact O-N 2.98Å; L297-C300 WeakPolarHBondContact O-CA 3.35Å; L297-C300 VanDerWaalsContact O-CB 3.28Å; L297-C300 WeakPolarHBondContact O-CB 3.23Å; L297-C300 PolarHBondContact O-N 3.41Å; L297-V301 HydrophobicContact CD1-CG2 4.25Å; L297-V301 WeakPolarHBondContact O-CG2 3.5Å; L297-V301 PolarHBondContact O-N 3.14Å
298	I	93.8	Very high	92.7	Very high	29 Å²	29	43.8 Å²	43.8	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-42.3	-178.4	-64.2	-61.1	0	0	0	110.7	L278 E281 I285 Q294 C300 V301 E302	L278-I298 HydrophobicContact CD2-CD1 4.49Å; L278-I298 HydrophobicContact CD2-CG2 4.4Å; E281-I298 HydrophobicContact CB-CD1 4.1Å; I285-I298 HydrophobicContact CD1-CD1 4.17Å; I285-I298 HydrophobicContact CD1-CG1 4.09Å; Q294-I298 HydrophobicContact CG-CG1 4.47Å; Q294-I298 WeakPolarHBondContact O-CB 3.39Å; Q294-I298 VanDerWaalsContact O-CG1 3.28Å; Q294-I298 WeakPolarHBondContact O-CG1 3.46Å; Q294-I298 PolarHBondContact O-N 3.21Å; I298-C300 VanDerWaalsContact C-N 3.26Å; I298-C300 PolarHBondContact O-N 3.48Å; I298-V301 PolarHBondContact O-N 3.25Å; I298-E302 HydrophobicContact CG2-CG 4.12Å; I298-E302 WeakPolarHBondContact CG2-OE1 3.42Å; I298-E302 WeakPolarHBondContact O-CB 3.35Å; I298-E302 VanDerWaalsContact O-CG 3.29Å; I298-E302 WeakPolarHBondContact O-CG 3.48Å; I298-E302 PolarHBondContact O-N 3.13Å
299	C	92.6	Very high	92.7	Very high	66 Å²	66	44.6 Å²	44.6	45%	0.446	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-34.5	174.4	-73.1	0	0	0	0	112.9	K295 L297 K303	K295-C299 VanDerWaalsContact O-CB 3.31Å; K295-C299 WeakPolarHBondContact O-CB 3.27Å; K295-C299 PolarHBondContact O-N 2.71Å; K295-C299 VanDerWaalsContact O-N 3.09Å; K295-C299 PolarHBondContact O-SG 2.8Å; L297-C299 VanDerWaalsContact C-N 3.32Å; L297-C299 PolarHBondContact O-N 2.98Å; C299-K303 WeakPolarHBondContact O-CB 3.35Å; C299-K303 PolarHBondContact O-N 2.96Å
300	C	93.4	Very high	92.5	Very high	16 Å²	16	45 Å²	45	11%	0.108	23%	0.231	C	C	.	.	H	α-helix	trans	-65.9	-48.6	175.8	-173.1	0	0	0	0	111.2	N251 P296 L297 I298 K303 Q304	N251-C300 VanDerWaalsContact CB-SG 3.56Å; P296-C300 WeakPolarHBondContact O-CB 3.49Å; P296-C300 PolarHBondContact O-N 2.94Å; L297-C300 WeakPolarHBondContact O-CA 3.35Å; L297-C300 VanDerWaalsContact O-CB 3.28Å; L297-C300 WeakPolarHBondContact O-CB 3.23Å; L297-C300 PolarHBondContact O-N 3.41Å; I298-C300 VanDerWaalsContact C-N 3.26Å; I298-C300 PolarHBondContact O-N 3.48Å; C300-K303 PolarHBondContact O-N 2.71Å; C300-Q304 WeakPolarHBondContact O-CG 3.25Å; C300-Q304 PolarHBondContact O-N 3.44Å
301	V	94.1	Very high	92.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-46	179.4	-177	0	0	0	0	111.4	T250 Y254 L278 E281 L297 I298 K303 Q304 L305	T250-V301 HydrophobicContact CG2-CG2 4.48Å; Y254-V301 HydrophobicContact CD2-CB 4.35Å; Y254-V301 HydrophobicContact CD2-CG1 4.31Å; Y254-V301 HydrophobicContact CD2-CG2 3.61Å; Y254-V301 HydrophobicContact CE1-CG1 4.47Å; Y254-V301 HydrophobicContact CE2-CB 4.35Å; Y254-V301 HydrophobicContact CE2-CG1 4.19Å; Y254-V301 HydrophobicContact CE2-CG2 3.38Å; L278-V301 HydrophobicContact CD2-CB 4.17Å; L278-V301 HydrophobicContact CD2-CG1 3.86Å; E281-V301 HydrophobicContact CG-CG2 4.15Å; L297-V301 HydrophobicContact CD1-CG2 4.25Å; L297-V301 WeakPolarHBondContact O-CG2 3.5Å; L297-V301 PolarHBondContact O-N 3.14Å; I298-V301 PolarHBondContact O-N 3.25Å; V301-K303 VanDerWaalsContact C-N 3.33Å; V301-K303 PolarHBondContact O-N 3.15Å; V301-Q304 PolarHBondContact O-N 3.13Å; V301-L305 HydrophobicContact CG1-CD1 3.67Å; V301-L305 HydrophobicContact CG1-CG 4.24Å; V301-L305 WeakPolarHBondContact O-CB 3.33Å; V301-L305 PolarHBondContact O-N 3.49Å
302	E	93.3	Very high	92.4	Very high	27 Å²	27	43 Å²	43	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-61	-41.3	176.5	-71.3	174.3	165.5	0	0	111.8	L278 I298 L306 G307 K339	L278-E302 HydrophobicContact CD2-CG 3.93Å; I298-E302 HydrophobicContact CG2-CG 4.12Å; I298-E302 WeakPolarHBondContact CG2-OE1 3.42Å; I298-E302 WeakPolarHBondContact O-CB 3.35Å; I298-E302 VanDerWaalsContact O-CG 3.29Å; I298-E302 WeakPolarHBondContact O-CG 3.48Å; I298-E302 PolarHBondContact O-N 3.13Å; E302-L306 WeakPolarHBondContact O-CA 3.46Å; E302-L306 VanDerWaalsContact O-CB 3.29Å; E302-L306 WeakPolarHBondContact O-CB 3.42Å; E302-L306 PolarHBondContact O-N 2.85Å; E302-G307 PolarHBondContact O-N 2.83Å; E302-K339 WeakPolarHBondContact OE1-CB 3.42Å; E302-K339 WeakPolarHBondContact OE1-CD 3.38Å
303	K	91.9	Very high	92.4	Very high	108 Å²	108	40.9 Å²	40.9	47%	0.47	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-50.1	176.8	-176.9	-174.9	174.6	-171.1	0	111.4	C299 C300 V301 G307 E308	C299-K303 WeakPolarHBondContact O-CB 3.35Å; C299-K303 PolarHBondContact O-N 2.96Å; C300-K303 PolarHBondContact O-N 2.71Å; V301-K303 VanDerWaalsContact C-N 3.33Å; V301-K303 PolarHBondContact O-N 3.15Å; K303-G307 CarbonylContact O-C 3.58Å; K303-G307 WeakPolarHBondContact O-CA 3.48Å; K303-G307 PolarHBondContact O-N 2.92Å; K303-E308 WeakPolarHBondContact CE-OE1 3.48Å; K303-E308 PolarHBondContact O-N 3.2Å
304	Q	93.6	Very high	92.4	Very high	20 Å²	20	40.9 Å²	40.9	9%	0.093	21%	0.214	C	C	.	.	H	α-helix	trans	-74.2	-43.7	-173.2	-66.7	-57.3	-21.5	0	0	112.8	N251 C300 V301 H309	N251-Q304 PolarHBondContact OD1-NE2 3Å; C300-Q304 WeakPolarHBondContact O-CG 3.25Å; C300-Q304 PolarHBondContact O-N 3.44Å; V301-Q304 PolarHBondContact O-N 3.13Å; Q304-H309 PolarHBondContact O-CD2 3.42Å; Q304-H309 VanDerWaalsContact O-CD2 3.28Å
305	L	93	Very high	92.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-84	-30.2	-177.1	-64.7	-176.3	0	0	0	113.5	Y254 Y270 V274 R277 V301	Y254-L305 HydrophobicContact CD1-CD1 3.8Å; Y254-L305 HydrophobicContact CD1-CD2 4Å; Y254-L305 HydrophobicContact CD1-CG 4.01Å; Y254-L305 HydrophobicContact CE1-CD1 4.08Å; Y254-L305 HydrophobicContact CG-CG 4.39Å; Y270-L305 WeakPolarHBondContact CE1-O 3.45Å; Y270-L305 PolarHBondContact OH-O 3.16Å; V274-L305 HydrophobicContact CG1-CB 4.17Å; V274-L305 HydrophobicContact CG1-CD1 4.39Å; V274-L305 HydrophobicContact CG2-CB 3.95Å; V274-L305 HydrophobicContact CG2-CD1 4.3Å; R277-L305 HydrophobicContact CB-CD1 4.12Å; R277-L305 HydrophobicContact CG-CD1 4.32Å; V301-L305 HydrophobicContact CG1-CD1 3.67Å; V301-L305 HydrophobicContact CG1-CG 4.24Å; V301-L305 WeakPolarHBondContact O-CB 3.33Å; V301-L305 PolarHBondContact O-N 3.49Å
306	L	91.3	Very high	91.9	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-57.4	179.7	-61.5	169.6	0	0	0	111.1	V274 E302 E308 H309 M310 L336 V340	V274-L306 HydrophobicContact CB-CD2 4.46Å; V274-L306 HydrophobicContact CG1-CD1 4.08Å; V274-L306 HydrophobicContact CG1-CD2 3.86Å; V274-L306 HydrophobicContact CG1-CG 3.84Å; V274-L306 HydrophobicContact CG2-CD2 4.35Å; E302-L306 WeakPolarHBondContact O-CA 3.46Å; E302-L306 VanDerWaalsContact O-CB 3.29Å; E302-L306 WeakPolarHBondContact O-CB 3.42Å; E302-L306 PolarHBondContact O-N 2.85Å; L306-E308 PolarHBondContact O-N 3.31Å; L306-H309 CarbonylContact O-C 3.56Å; L306-H309 PolarHBondContact O-N 3.15Å; L306-M310 WeakPolarHBondContact O-CG 3.18Å; L306-M310 PolarHBondContact O-N 3.31Å; L306-L336 HydrophobicContact CD1-CB 3.89Å; L306-L336 HydrophobicContact CD1-CD2 4.35Å; L306-L336 HydrophobicContact CD2-CB 4.27Å; L306-V340 HydrophobicContact CB-CG2 3.79Å; L306-V340 HydrophobicContact CD1-CG2 4.11Å
307	G	90.1	Very high	91.5	Very high	17 Å²	17	40.9 Å²	40.9	18%	0.175	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-52.6	-52.6	-170.9	0	0	0	0	0	114.9	E302 K303 H309 M310	E302-G307 PolarHBondContact O-N 2.83Å; K303-G307 CarbonylContact O-C 3.58Å; K303-G307 WeakPolarHBondContact O-CA 3.48Å; K303-G307 PolarHBondContact O-N 2.92Å; G307-H309 PolarHBondContact O-N 3.29Å; G307-M310 WeakPolarHBondContact O-CE 3.44Å
308	E	90.4	Very high	91.4	Very high	114 Å²	114	41 Å²	41	53%	0.533	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-70.8	-18.6	-178.5	-60.8	-60	153.7	0	0	113.1	K303 L306	K303-E308 WeakPolarHBondContact CE-OE1 3.48Å; K303-E308 PolarHBondContact O-N 3.2Å; L306-E308 PolarHBondContact O-N 3.31Å
309	H	90.6	Very high	91.2	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.12	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-115.5	4.7	-172.9	-58	-49.6	0	0	0	114.5	G258 Q259 M262 Q304 L306 G307 N311 A312 V313	G258-H309 VanDerWaalsContact C-NE2 3.34Å; Q259-H309 PolarHBondContact N-NE2 3.15Å; M262-H309 HydrophobicContact CE-CB 3.85Å; Q304-H309 PolarHBondContact O-CD2 3.42Å; Q304-H309 VanDerWaalsContact O-CD2 3.28Å; L306-H309 CarbonylContact O-C 3.56Å; L306-H309 PolarHBondContact O-N 3.15Å; G307-H309 PolarHBondContact O-N 3.29Å; H309-N311 PolarHBondContact O-N 3.27Å; H309-A312 PolarHBondContact O-N 3.42Å; H309-A312 VanDerWaalsContact O-N 3.1Å; H309-V313 WeakPolarHBondContact O-CG2 3.25Å; H309-V313 PolarHBondContact O-N 3.26Å
310	M	89.9	Confident	91.2	Very high	25 Å²	25	43.6 Å²	43.6	12%	0.123	23%	0.226	C	C	.	.	H	α-helix	trans	-52.5	-49.8	-175	-63.6	-176.8	-74	0	0	112.8	L306 G307 A312 V313 L314 F337 V340 A342	L306-M310 WeakPolarHBondContact O-CG 3.18Å; L306-M310 PolarHBondContact O-N 3.31Å; G307-M310 WeakPolarHBondContact O-CE 3.44Å; M310-A312 PolarHBondContact O-N 3.07Å; M310-V313 PolarHBondContact O-N 3.34Å; M310-L314 WeakPolarHBondContact O-CG 3.49Å; M310-L314 PolarHBondContact O-N 3.44Å; M310-L314 VanDerWaalsContact O-N 3.08Å; M310-F337 HydrophobicContact CB-CE1 3.96Å; M310-F337 HydrophobicContact CB-CZ 4.36Å; M310-F337 HydrophobicContact CG-CE1 4.15Å; M310-V340 HydrophobicContact CE-CG1 4.4Å; M310-V340 HydrophobicContact SD-CB 4.41Å; M310-V340 HydrophobicContact SD-CG1 3.78Å; M310-A342 HydrophobicContact CE-CB 4.11Å
311	N	90.9	Very high	91.1	Very high	95 Å²	95	43 Å²	43	51%	0.508	22%	0.222	S	C	.	.	H	α-helix	trans	-64.4	-40.6	-179	-73.3	-38.2	0	0	0	111.9	H309 L314 Q315 T346	H309-N311 PolarHBondContact O-N 3.27Å; N311-L314 PolarHBondContact O-N 2.98Å; N311-Q315 WeakPolarHBondContact O-CB 3.45Å; N311-Q315 PolarHBondContact O-N 3.44Å; N311-T346 VanDerWaalsContact OD1-CG2 3.32Å; N311-T346 WeakPolarHBondContact OD1-CG2 3.47Å
312	A	90.9	Very high	91.1	Very high	33 Å²	33	43 Å²	43	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-65.9	-41.8	179.8	0	0	0	0	0	111.7	M262 H309 M310 K316	M262-A312 HydrophobicContact CG-CB 4.39Å; M262-A312 HydrophobicContact SD-CB 4.37Å; H309-A312 PolarHBondContact O-N 3.42Å; H309-A312 VanDerWaalsContact O-N 3.1Å; M310-A312 PolarHBondContact O-N 3.07Å; A312-K316 WeakPolarHBondContact O-CB 3.32Å; A312-K316 PolarHBondContact O-N 3.07Å; A312-K316 VanDerWaalsContact O-N 3.07Å
313	V	92.4	Very high	90.9	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-49.9	175.4	170.1	0	0	0	0	110.8	M262 V267 Y270 L271 H309 M310 G317 L333 F337	M262-V313 HydrophobicContact CE-CG2 3.43Å; M262-V313 VanDerWaalsContact CE-CG2 3.43Å; M262-V313 HydrophobicContact SD-CG2 3.82Å; V267-V313 HydrophobicContact CG1-CG1 3.76Å; V267-V313 HydrophobicContact CG2-CG1 4.48Å; Y270-V313 HydrophobicContact CD1-CG2 4.26Å; Y270-V313 HydrophobicContact CE1-CG2 4.22Å; L271-V313 HydrophobicContact CD2-CG1 4.41Å; H309-V313 WeakPolarHBondContact O-CG2 3.25Å; H309-V313 PolarHBondContact O-N 3.26Å; M310-V313 PolarHBondContact O-N 3.34Å; V313-G317 PolarHBondContact O-N 3.07Å; V313-L333 HydrophobicContact CG1-CD1 4.47Å; V313-F337 HydrophobicContact CB-CZ 4.27Å; V313-F337 HydrophobicContact CG1-CE2 4.21Å; V313-F337 HydrophobicContact CG1-CZ 3.99Å
314	L	92.7	Very high	90.9	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-42.5	-177.4	-64.1	176.2	0	0	0	112	M310 N311 K316 L318 L333 F337 T346 L347 F350	M310-L314 WeakPolarHBondContact O-CG 3.49Å; M310-L314 PolarHBondContact O-N 3.44Å; M310-L314 VanDerWaalsContact O-N 3.08Å; N311-L314 PolarHBondContact O-N 2.98Å; L314-K316 PolarHBondContact O-N 2.89Å; L314-L318 HydrophobicContact CD2-CB 4.31Å; L314-L318 HydrophobicContact CD2-CD1 4.44Å; L314-L318 HydrophobicContact CD2-CD2 4.33Å; L314-L318 WeakPolarHBondContact O-CB 3.45Å; L314-L318 PolarHBondContact O-N 3.3Å; L314-L333 HydrophobicContact CD2-CD1 4.11Å; L314-L333 HydrophobicContact CD2-CD2 4.22Å; L314-F337 HydrophobicContact CD1-CD1 4.47Å; L314-F337 HydrophobicContact CD1-CE1 3.72Å; L314-F337 HydrophobicContact CD1-CZ 4.47Å; L314-F337 HydrophobicContact CD2-CE1 3.89Å; L314-F337 HydrophobicContact CD2-CZ 4.01Å; L314-F337 HydrophobicContact CG-CE1 3.77Å; L314-F337 HydrophobicContact CG-CZ 4.02Å; L314-T346 HydrophobicContact CD1-CG2 3.84Å; L314-L347 HydrophobicContact CD1-CB 4.46Å; L314-L347 HydrophobicContact CD2-CD1 3.7Å; L314-F350 HydrophobicContact CB-CB 4.36Å; L314-F350 HydrophobicContact CB-CD1 3.86Å; L314-F350 HydrophobicContact CB-CD2 3.96Å; L314-F350 HydrophobicContact CB-CE1 4.06Å; L314-F350 HydrophobicContact CB-CE2 4.15Å; L314-F350 HydrophobicContact CB-CG 3.8Å; L314-F350 HydrophobicContact CB-CZ 4.2Å; L314-F350 HydrophobicContact CD1-CB 4.3Å; L314-F350 HydrophobicContact CD1-CD2 3.61Å; L314-F350 HydrophobicContact CD1-CE2 4.1Å; L314-F350 HydrophobicContact CD1-CG 4.04Å; L314-F350 HydrophobicContact CG-CD2 4.45Å
315	Q	89.8	Confident	90.8	Very high	147 Å²	147	47.6 Å²	47.6	69%	0.687	25%	0.249	S	C	*	.	H	α-helix	trans	-65.4	-38	-178.8	-173	177.2	8.3	0	0	112.8	N311 F350	N311-Q315 WeakPolarHBondContact O-CB 3.45Å; N311-Q315 PolarHBondContact O-N 3.44Å; Q315-F350 HydrophobicContact CB-CE1 4.1Å; Q315-F350 HydrophobicContact CB-CZ 4.49Å
316	K	86.8	Confident	90.8	Very high	125 Å²	125	52.2 Å²	52.2	54%	0.543	27%	0.267	S	S	.	.	H	α-helix	trans	-83.7	-36.5	178.8	-71.9	-176	176.9	-175.8	0	113.4	M262 V267 A312 L314	M262-K316 PolarHBondContact O-NZ 3.44Å; V267-K316 HydrophobicContact CG2-CB 4.38Å; A312-K316 WeakPolarHBondContact O-CB 3.32Å; A312-K316 PolarHBondContact O-N 3.07Å; A312-K316 VanDerWaalsContact O-N 3.07Å; L314-K316 PolarHBondContact O-N 2.89Å
317	G	86.1	Confident	90.8	Very high	6 Å²	6	54.5 Å²	54.5	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-112.3	-29.4	-163.7	0	0	0	0	0	116.2	V313 S319 N320 L321	V313-G317 PolarHBondContact O-N 3.07Å; G317-S319 PolarHBondContact O-N 2.84Å; G317-N320 PolarHBondContact O-N 2.9Å; G317-L321 VanDerWaalsContact O-CG 3.3Å; G317-L321 WeakPolarHBondContact O-CG 3.19Å; G317-L321 PolarHBondContact O-N 3.5Å
318	L	91.3	Very high	91	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-44.2	-168.5	-175.6	67	0	0	0	112.1	L314 N320 L321 L322 L330 L347 F350	L314-L318 HydrophobicContact CD2-CB 4.31Å; L314-L318 HydrophobicContact CD2-CD1 4.44Å; L314-L318 HydrophobicContact CD2-CD2 4.33Å; L314-L318 WeakPolarHBondContact O-CB 3.45Å; L314-L318 PolarHBondContact O-N 3.3Å; L318-N320 PolarHBondContact O-N 3.19Å; L318-L321 PolarHBondContact O-N 3.47Å; L318-L322 HydrophobicContact CD1-CD1 4.06Å; L318-L322 HydrophobicContact CD1-CG 4.2Å; L318-L322 HydrophobicContact CD2-CD1 4.31Å; L318-L322 HydrophobicContact CG-CD1 3.8Å; L318-L322 HydrophobicContact CG-CG 4.31Å; L318-L322 WeakPolarHBondContact O-CB 3.21Å; L318-L322 VanDerWaalsContact O-CG 3.28Å; L318-L322 WeakPolarHBondContact O-CG 3.49Å; L318-L322 PolarHBondContact O-N 2.9Å; L318-L330 HydrophobicContact CD1-CD2 4.16Å; L318-L347 HydrophobicContact CD1-CD1 4.07Å; L318-L347 HydrophobicContact CD2-CD1 4.18Å; L318-F350 HydrophobicContact CD2-CB 3.59Å
319	S	90.1	Very high	91.1	Very high	55 Å²	55	54.7 Å²	54.7	39%	0.385	28%	0.284	S	S	.	.	H	α-helix	trans	-59.1	-50	179.6	-53.7	0	0	0	0	111.2	G317 L321 L322 D323	G317-S319 PolarHBondContact O-N 2.84Å; S319-L321 VanDerWaalsContact C-N 3.35Å; S319-L321 PolarHBondContact O-N 3.06Å; S319-L322 PolarHBondContact O-N 3.22Å; S319-L322 VanDerWaalsContact O-N 3.15Å; S319-D323 WeakPolarHBondContact O-CB 3.33Å; S319-D323 PolarHBondContact O-N 3.17Å
320	N	91.7	Very high	91.3	Very high	96 Å²	96	53.5 Å²	53.5	51%	0.513	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-41.7	179.7	-65.3	5.8	0	0	0	112.2	G317 L318 L322 D323 E324	G317-N320 PolarHBondContact O-N 2.9Å; L318-N320 PolarHBondContact O-N 3.19Å; N320-L322 VanDerWaalsContact C-N 3.31Å; N320-L322 PolarHBondContact O-N 2.81Å; N320-D323 PolarHBondContact O-N 2.63Å; N320-E324 WeakPolarHBondContact O-CB 3.43Å; N320-E324 PolarHBondContact O-N 3.14Å
321	L	92.9	Very high	91.5	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-40.8	176.8	-73.6	175.8	0	0	0	112.1	V267 P268 G317 L318 S319 N325 R326 E329 L330 L333	V267-L321 HydrophobicContact CG1-CD1 4.26Å; P268-L321 HydrophobicContact CG-CD2 3.96Å; G317-L321 VanDerWaalsContact O-CG 3.3Å; G317-L321 WeakPolarHBondContact O-CG 3.19Å; G317-L321 PolarHBondContact O-N 3.5Å; L318-L321 PolarHBondContact O-N 3.47Å; S319-L321 VanDerWaalsContact C-N 3.35Å; S319-L321 PolarHBondContact O-N 3.06Å; L321-N325 PolarHBondContact O-N 3.45Å; L321-R326 HydrophobicContact CD2-CB 3.85Å; L321-R326 HydrophobicContact CD2-CG 4.35Å; L321-R326 PolarHBondContact O-N 3Å; L321-E329 HydrophobicContact CD2-CB 3.67Å; L321-E329 HydrophobicContact CD2-CG 4.22Å; L321-L330 HydrophobicContact CB-CD2 3.93Å; L321-L330 HydrophobicContact CB-CG 4.22Å; L321-L330 HydrophobicContact CD1-CD2 4.5Å; L321-L333 HydrophobicContact CD1-CD1 4.04Å
322	L	92.8	Very high	91.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-72.9	-42.7	178.6	-69.4	175.1	0	0	0	111.6	L318 S319 N320 N325 L330 W351 Y354 K382 V386	L318-L322 HydrophobicContact CD1-CD1 4.06Å; L318-L322 HydrophobicContact CD1-CG 4.2Å; L318-L322 HydrophobicContact CD2-CD1 4.31Å; L318-L322 HydrophobicContact CG-CD1 3.8Å; L318-L322 HydrophobicContact CG-CG 4.31Å; L318-L322 WeakPolarHBondContact O-CB 3.21Å; L318-L322 VanDerWaalsContact O-CG 3.28Å; L318-L322 WeakPolarHBondContact O-CG 3.49Å; L318-L322 PolarHBondContact O-N 2.9Å; S319-L322 PolarHBondContact O-N 3.22Å; S319-L322 VanDerWaalsContact O-N 3.15Å; N320-L322 VanDerWaalsContact C-N 3.31Å; N320-L322 PolarHBondContact O-N 2.81Å; L322-N325 PolarHBondContact O-N 2.9Å; L322-L330 HydrophobicContact CD2-CD1 3.89Å; L322-L330 HydrophobicContact CD2-CD2 3.73Å; L322-L330 HydrophobicContact CD2-CG 4.5Å; L322-L330 HydrophobicContact CG-CD2 4.22Å; L322-W351 HydrophobicContact CD1-CE3 4.01Å; L322-W351 HydrophobicContact CD1-CZ3 4.14Å; L322-W351 HydrophobicContact CD2-CE3 4.2Å; L322-W351 HydrophobicContact CD2-CZ3 3.65Å; L322-Y354 HydrophobicContact CB-CD1 4.44Å; L322-Y354 HydrophobicContact CB-CE1 3.82Å; L322-Y354 HydrophobicContact CB-CE2 3.88Å; L322-Y354 VanDerWaalsContact CB-CZ 3.48Å; L322-Y354 HydrophobicContact CD1-CD1 3.41Å; L322-Y354 VanDerWaalsContact CD1-CD1 3.41Å; L322-Y354 HydrophobicContact CD1-CD2 3.96Å; L322-Y354 HydrophobicContact CD1-CE1 3.64Å; L322-Y354 HydrophobicContact CD1-CE2 4.13Å; L322-Y354 HydrophobicContact CD1-CG 3.59Å; L322-Y354 HydrophobicContact CG-CE1 4.32Å; L322-K382 WeakPolarHBondContact O-CE 3.36Å; L322-K382 PolarHBondContact O-NZ 3.13Å; L322-V386 HydrophobicContact CD2-CG1 4.2Å; L322-V386 HydrophobicContact CD2-CG2 4.49Å
323	D	90.4	Very high	91.9	Very high	71 Å²	71	48.5 Å²	48.5	38%	0.38	25%	0.251	S	S	.	.	H	α-helix	trans	-61.8	-48.8	178.4	-74.2	-37.3	0	0	0	111.5	S319 N320 N325 Y354 K382	S319-D323 WeakPolarHBondContact O-CB 3.33Å; S319-D323 PolarHBondContact O-N 3.17Å; N320-D323 PolarHBondContact O-N 2.63Å; D323-N325 PolarHBondContact O-N 2.91Å; D323-Y354 PolarHBondContact OD1-OH 3.3Å; D323-K382 PolarHBondContact O-NZ 2.96Å
324	E	91.8	Very high	92	Very high	115 Å²	115	49.9 Å²	49.9	54%	0.537	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-3.2	178.7	-66.3	-177.4	-170.7	0	0	114.2	N320 R326	N320-E324 WeakPolarHBondContact O-CB 3.43Å; N320-E324 PolarHBondContact O-N 3.14Å; E324-R326 VanDerWaalsContact C-N 3.35Å; E324-R326 HydrophobicContact CB-CG 4.03Å; E324-R326 PolarHBondContact O-N 3.49Å; E324-R326 IonicContact OE1-NH2 2.89Å; E324-R326 IonicContact OE2-CZ 3.7Å; E324-R326 IonicContact OE2-NE 3.89Å; E324-R326 PolarHBondContact OE2-NE 3.14Å; E324-R326 IonicContact OE2-NH2 2.81Å; E324-R326 PolarHBondContact OE2-NH2 2.8Å
325	N	91.1	Very high	92.1	Very high	64 Å²	64	55.4 Å²	55.4	34%	0.342	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	44.2	-179.9	-166	44.2	0	0	0	113.2	L321 L322 D323 V327	L321-N325 PolarHBondContact O-N 3.45Å; L322-N325 PolarHBondContact O-N 2.9Å; D323-N325 PolarHBondContact O-N 2.91Å; N325-V327 VanDerWaalsContact C-N 3.33Å; N325-V327 PolarHBondContact O-N 2.81Å
326	R	92.2	Very high	92.3	Very high	98 Å²	98	48.6 Å²	48.6	37%	0.37	25%	0.25	S	C	.	.			trans	-77.4	77.9	179.3	-70.2	-155.5	-166.4	-170.7	6.2	111.8	L321 E324 T328 E329 L330	L321-R326 HydrophobicContact CD2-CB 3.85Å; L321-R326 HydrophobicContact CD2-CG 4.35Å; L321-R326 PolarHBondContact O-N 3Å; E324-R326 VanDerWaalsContact C-N 3.35Å; E324-R326 HydrophobicContact CB-CG 4.03Å; E324-R326 PolarHBondContact O-N 3.49Å; E324-R326 IonicContact OE1-NH2 2.89Å; E324-R326 IonicContact OE2-CZ 3.7Å; E324-R326 IonicContact OE2-NE 3.89Å; E324-R326 PolarHBondContact OE2-NE 3.14Å; E324-R326 IonicContact OE2-NH2 2.81Å; E324-R326 PolarHBondContact OE2-NH2 2.8Å; R326-T328 PolarHBondContact O-N 2.92Å; R326-E329 HydrophobicContact CB-CB 4.25Å; R326-E329 HydrophobicContact CB-CG 4.47Å; R326-E329 WeakPolarHBondContact CB-OE2 3.31Å; R326-E329 PolarHBondContact O-N 3.07Å; R326-L330 WeakPolarHBondContact O-CB 3.29Å; R326-L330 WeakPolarHBondContact O-CD1 3.48Å; R326-L330 VanDerWaalsContact O-CG 3.28Å; R326-L330 WeakPolarHBondContact O-CG 3.32Å; R326-L330 PolarHBondContact O-N 2.79Å
327	V	92.7	Very high	92.6	Very high	49 Å²	49	42.7 Å²	42.7	30%	0.297	22%	0.224	S	C	.	.	H	α-helix	trans	-57.9	-42.3	-172.9	176.9	0	0	0	0	112.9	N325 L330 A331 C390	N325-V327 VanDerWaalsContact C-N 3.33Å; N325-V327 PolarHBondContact O-N 2.81Å; V327-L330 PolarHBondContact O-N 3.41Å; V327-A331 WeakPolarHBondContact O-CB 3.34Å; V327-A331 PolarHBondContact O-N 2.89Å; V327-C390 PolarHBondContact O-SG 3.46Å
328	T	92.5	Very high	92.9	Very high	100 Å²	100	45.3 Å²	45.3	61%	0.613	24%	0.242	S	C	*	.	H	α-helix	trans	-63.2	-47.7	-177.5	-50.2	0	0	0	0	111.2	R326 A331 L332	R326-T328 PolarHBondContact O-N 2.92Å; T328-A331 PolarHBondContact O-N 3.33Å; T328-L332 PolarHBondContact O-N 3.4Å
329	E	93.8	Very high	92.7	Very high	36 Å²	36	50.4 Å²	50.4	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-37.5	-179.9	-68.3	68.2	-160.5	0	0	111.7	P268 H272 L321 R326 L332 L333	P268-E329 HydrophobicContact CB-CG 3.92Å; P268-E329 HydrophobicContact CG-CG 4.47Å; H272-E329 IonicContact CE1-OE1 3.81Å; L321-E329 HydrophobicContact CD2-CB 3.67Å; L321-E329 HydrophobicContact CD2-CG 4.22Å; R326-E329 HydrophobicContact CB-CB 4.25Å; R326-E329 HydrophobicContact CB-CG 4.47Å; R326-E329 WeakPolarHBondContact CB-OE2 3.31Å; R326-E329 PolarHBondContact O-N 3.07Å; E329-L332 PolarHBondContact O-N 3.09Å; E329-L333 VanDerWaalsContact O-CB 3.27Å; E329-L333 WeakPolarHBondContact O-CB 3.3Å; E329-L333 PolarHBondContact O-N 3.06Å
330	L	94.5	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-39.4	175.2	-74.1	165	0	0	0	111.9	L318 L321 L322 R326 V327 L333 Y334 V386 C390	L318-L330 HydrophobicContact CD1-CD2 4.16Å; L321-L330 HydrophobicContact CB-CD2 3.93Å; L321-L330 HydrophobicContact CB-CG 4.22Å; L321-L330 HydrophobicContact CD1-CD2 4.5Å; L322-L330 HydrophobicContact CD2-CD1 3.89Å; L322-L330 HydrophobicContact CD2-CD2 3.73Å; L322-L330 HydrophobicContact CD2-CG 4.5Å; L322-L330 HydrophobicContact CG-CD2 4.22Å; R326-L330 WeakPolarHBondContact O-CB 3.29Å; R326-L330 WeakPolarHBondContact O-CD1 3.48Å; R326-L330 VanDerWaalsContact O-CG 3.28Å; R326-L330 WeakPolarHBondContact O-CG 3.32Å; R326-L330 PolarHBondContact O-N 2.79Å; V327-L330 PolarHBondContact O-N 3.41Å; L330-L333 PolarHBondContact O-N 3.28Å; L330-Y334 WeakPolarHBondContact O-CB 3.42Å; L330-Y334 PolarHBondContact O-N 3.35Å; L330-V386 HydrophobicContact CD1-CG1 4.27Å; L330-V386 HydrophobicContact CD1-CG2 4.25Å; L330-C390 HydrophobicContact CB-CB 3.95Å
331	A	95.1	Very high	92.3	Very high	23 Å²	23	54.5 Å²	54.5	19%	0.19	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-43.6	173.8	0	0	0	0	0	111.2	V327 T328 Y334 Q335 C390	V327-A331 WeakPolarHBondContact O-CB 3.34Å; V327-A331 PolarHBondContact O-N 2.89Å; T328-A331 PolarHBondContact O-N 3.33Å; A331-Y334 PolarHBondContact O-N 3.38Å; A331-Q335 WeakPolarHBondContact O-CG 3.41Å; A331-Q335 PolarHBondContact O-N 3.28Å; A331-C390 HydrophobicContact CB-CB 4.34Å
332	L	94.9	Very high	92.1	Very high	26 Å²	26	56.6 Å²	56.6	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-44.6	175.7	-177.5	60.9	0	0	0	111.7	L271 A275 T328 E329 Y334 Q335 L336	L271-L332 HydrophobicContact CB-CD2 3.89Å; L271-L332 HydrophobicContact CB-CG 4.35Å; A275-L332 HydrophobicContact CB-CD1 3.96Å; T328-L332 PolarHBondContact O-N 3.4Å; E329-L332 PolarHBondContact O-N 3.09Å; L332-Y334 VanDerWaalsContact C-N 3.33Å; L332-Y334 PolarHBondContact O-N 2.97Å; L332-Q335 PolarHBondContact O-N 3.01Å; L332-L336 HydrophobicContact CD1-CD1 4.09Å; L332-L336 HydrophobicContact CD1-CG 4.16Å; L332-L336 HydrophobicContact CG-CD1 3.94Å; L332-L336 HydrophobicContact CG-CG 4.41Å; L332-L336 WeakPolarHBondContact O-CB 3.18Å; L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 3.16Å
333	L	94.6	Very high	92	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-47.4	176.1	-175.8	147.6	0	0	0	110.6	L271 V313 L314 L321 E329 L330 L336 F337 L347	L271-L333 HydrophobicContact CD1-CB 3.87Å; L271-L333 HydrophobicContact CD1-CD1 4.06Å; L271-L333 HydrophobicContact CD1-CG 4.31Å; V313-L333 HydrophobicContact CG1-CD1 4.47Å; L314-L333 HydrophobicContact CD2-CD1 4.11Å; L314-L333 HydrophobicContact CD2-CD2 4.22Å; L321-L333 HydrophobicContact CD1-CD1 4.04Å; E329-L333 VanDerWaalsContact O-CB 3.27Å; E329-L333 WeakPolarHBondContact O-CB 3.3Å; E329-L333 PolarHBondContact O-N 3.06Å; L330-L333 PolarHBondContact O-N 3.28Å; L333-L336 PolarHBondContact O-N 3.02Å; L333-F337 HydrophobicContact CD2-CD2 4.27Å; L333-F337 HydrophobicContact CD2-CG 4.46Å; L333-F337 HydrophobicContact CG-CD2 4.04Å; L333-F337 HydrophobicContact CG-CE2 4.04Å; L333-F337 WeakPolarHBondContact O-CB 3.49Å; L333-F337 WeakPolarHBondContact O-CD2 3.43Å; L333-F337 PolarHBondContact O-N 3.01Å; L333-L347 HydrophobicContact CD2-CD1 3.55Å; L333-L347 HydrophobicContact CD2-CD2 3.57Å; L333-L347 HydrophobicContact CD2-CG 4.17Å
334	Y	95	Very high	92.1	Very high	30 Å²	30	55.4 Å²	55.4	12%	0.118	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-45.7	178.6	178.6	-101.5	0	0	0	112.3	L330 A331 L332 F337 S338 L344 L347 F391 A392 N394 F397	L330-Y334 WeakPolarHBondContact O-CB 3.42Å; L330-Y334 PolarHBondContact O-N 3.35Å; A331-Y334 PolarHBondContact O-N 3.38Å; L332-Y334 VanDerWaalsContact C-N 3.33Å; L332-Y334 PolarHBondContact O-N 2.97Å; Y334-F337 PolarHBondContact O-N 2.83Å; Y334-S338 WeakPolarHBondContact O-CB 3.43Å; Y334-S338 PolarHBondContact O-N 3.16Å; Y334-L344 HydrophobicContact CD2-CD2 3.93Å; Y334-L344 HydrophobicContact CE2-CD2 3.67Å; Y334-L347 HydrophobicContact CD2-CD2 4.18Å; Y334-F391 HydrophobicContact CD2-CB 4.01Å; Y334-F391 AromaticContact CD2-CD1 3.56Å; Y334-F391 HydrophobicContact CD2-CD1 3.56Å; Y334-F391 HydrophobicContact CD2-CE1 4.3Å; Y334-F391 AromaticContact CD2-CG 3.97Å; Y334-F391 HydrophobicContact CD2-CG 3.97Å; Y334-F391 HydrophobicContact CE2-CB 4.02Å; Y334-F391 HydrophobicContact CE2-CD1 4.41Å; Y334-F391 HydrophobicContact CE2-CG 4.4Å; Y334-F391 HydrophobicContact CG-CB 4.38Å; Y334-F391 AromaticContact CG-CD1 3.68Å; Y334-F391 HydrophobicContact CG-CD1 3.68Å; Y334-F391 HydrophobicContact CG-CE1 4.45Å; Y334-F391 HydrophobicContact CG-CG 4.38Å; Y334-A392 HydrophobicContact CE1-CB 4.2Å; Y334-N394 PolarHBondContact OH-ND2 3.4Å; Y334-F397 HydrophobicContact CD2-CE2 4.44Å; Y334-F397 HydrophobicContact CE2-CD2 4.41Å; Y334-F397 AromaticContact CE2-CE2 3.88Å; Y334-F397 HydrophobicContact CE2-CE2 3.88Å; Y334-F397 HydrophobicContact CE2-CZ 4.38Å
335	Q	94.1	Very high	92.2	Very high	116 Å²	116	53.9 Å²	53.9	54%	0.542	28%	0.283	S	S	.	.	H	α-helix	trans	-59.8	-47.4	176.7	-73.7	177.7	-4.7	0	0	112.3	A331 L332 S338	A331-Q335 WeakPolarHBondContact O-CG 3.41Å; A331-Q335 PolarHBondContact O-N 3.28Å; L332-Q335 PolarHBondContact O-N 3.01Å; Q335-S338 PolarHBondContact O-N 2.79Å; Q335-S338 PolarHBondContact O-OG 3.08Å
336	L	93.4	Very high	92.3	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-65	-44.7	178.6	-69.1	174.8	0	0	0	111.8	L271 V274 A275 L278 L306 L332 L333 S338 K339	L271-L336 HydrophobicContact CB-CD1 4.13Å; L271-L336 HydrophobicContact CD2-CD1 3.87Å; V274-L336 HydrophobicContact CB-CD1 4.43Å; V274-L336 HydrophobicContact CG1-CD1 4.47Å; V274-L336 HydrophobicContact CG1-CD2 4.34Å; A275-L336 HydrophobicContact CB-CD2 4.47Å; L278-L336 HydrophobicContact CD1-CD2 3.8Å; L306-L336 HydrophobicContact CD1-CB 3.89Å; L306-L336 HydrophobicContact CD1-CD2 4.35Å; L306-L336 HydrophobicContact CD2-CB 4.27Å; L332-L336 HydrophobicContact CD1-CD1 4.09Å; L332-L336 HydrophobicContact CD1-CG 4.16Å; L332-L336 HydrophobicContact CG-CD1 3.94Å; L332-L336 HydrophobicContact CG-CG 4.41Å; L332-L336 WeakPolarHBondContact O-CB 3.18Å; L332-L336 WeakPolarHBondContact O-CG 3.47Å; L332-L336 PolarHBondContact O-N 3.16Å; L333-L336 PolarHBondContact O-N 3.02Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.37Å; L336-K339 WeakPolarHBondContact O-CB 3.36Å; L336-K339 PolarHBondContact O-N 3.16Å
337	F	93.3	Very high	92.4	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-69.8	-23.4	180	-82.3	-121.3	0	0	0	112.6	L271 M310 V313 L314 L333 Y334 K339 V340 G343 L347	L271-F337 HydrophobicContact CD2-CE2 4.48Å; M310-F337 HydrophobicContact CB-CE1 3.96Å; M310-F337 HydrophobicContact CB-CZ 4.36Å; M310-F337 HydrophobicContact CG-CE1 4.15Å; V313-F337 HydrophobicContact CB-CZ 4.27Å; V313-F337 HydrophobicContact CG1-CE2 4.21Å; V313-F337 HydrophobicContact CG1-CZ 3.99Å; L314-F337 HydrophobicContact CD1-CD1 4.47Å; L314-F337 HydrophobicContact CD1-CE1 3.72Å; L314-F337 HydrophobicContact CD1-CZ 4.47Å; L314-F337 HydrophobicContact CD2-CE1 3.89Å; L314-F337 HydrophobicContact CD2-CZ 4.01Å; L314-F337 HydrophobicContact CG-CE1 3.77Å; L314-F337 HydrophobicContact CG-CZ 4.02Å; L333-F337 HydrophobicContact CD2-CD2 4.27Å; L333-F337 HydrophobicContact CD2-CG 4.46Å; L333-F337 HydrophobicContact CG-CD2 4.04Å; L333-F337 HydrophobicContact CG-CE2 4.04Å; L333-F337 WeakPolarHBondContact O-CB 3.49Å; L333-F337 WeakPolarHBondContact O-CD2 3.43Å; L333-F337 PolarHBondContact O-N 3.01Å; Y334-F337 PolarHBondContact O-N 2.83Å; F337-K339 PolarHBondContact O-N 3.44Å; F337-V340 PolarHBondContact O-N 3.2Å; F337-G343 WeakPolarHBondContact O-CA 3.45Å; F337-L347 HydrophobicContact CB-CD2 4.49Å; F337-L347 HydrophobicContact CD1-CB 4.24Å
338	S	92.2	Very high	92.5	Very high	61 Å²	61	46.7 Å²	46.7	43%	0.427	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-24.9	172.8	80.4	0	0	0	0	114	Y334 Q335 L336	Y334-S338 WeakPolarHBondContact O-CB 3.43Å; Y334-S338 PolarHBondContact O-N 3.16Å; Q335-S338 PolarHBondContact O-N 2.79Å; Q335-S338 PolarHBondContact O-OG 3.08Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.37Å
339	K	88	Confident	92.6	Very high	109 Å²	109	46.4 Å²	46.4	47%	0.474	24%	0.243	S	C	.	.	H	α-helix	trans	-79	-23.2	-179	-60.9	-180	-179.7	-171.2	0	112.2	E302 L336 F337	E302-K339 WeakPolarHBondContact OE1-CB 3.42Å; E302-K339 WeakPolarHBondContact OE1-CD 3.38Å; L336-K339 WeakPolarHBondContact O-CB 3.36Å; L336-K339 PolarHBondContact O-N 3.16Å; F337-K339 PolarHBondContact O-N 3.44Å
340	V	89.3	Confident	92.6	Very high	23 Å²	23	47.3 Å²	47.3	14%	0.139	25%	0.247	C	C	.	.	S	Bend	trans	-95.1	130	-179.1	-174.7	0	0	0	0	110.5	L306 M310 F337 A342 G343	L306-V340 HydrophobicContact CB-CG2 3.79Å; L306-V340 HydrophobicContact CD1-CG2 4.11Å; M310-V340 HydrophobicContact CE-CG1 4.4Å; M310-V340 HydrophobicContact SD-CB 4.41Å; M310-V340 HydrophobicContact SD-CG1 3.78Å; F337-V340 PolarHBondContact O-N 3.2Å; V340-A342 PolarHBondContact O-N 2.91Å; V340-A342 VanDerWaalsContact O-N 3.09Å; V340-G343 PolarHBondContact O-N 3.4Å
341	K	83.3	Confident	92.7	Very high	214 Å²	214	47.3 Å²	47.3	93%	0.93	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-37.4	-176.1	-68.8	-176.7	179.3	179.2	0	114.6
342	A	88.3	Confident	92.7	Very high	48 Å²	48	49 Å²	49	40%	0.397	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	4.1	179.3	0	0	0	0	0	113.5	M310 V340 T346	M310-A342 HydrophobicContact CE-CB 4.11Å; V340-A342 PolarHBondContact O-N 2.91Å; V340-A342 VanDerWaalsContact O-N 3.09Å; A342-T346 WeakPolarHBondContact O-CB 3.46Å; A342-T346 PolarHBondContact O-N 3.23Å; A342-T346 PolarHBondContact O-OG1 3.13Å
343	G	90.9	Very high	92.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-56.4	-174.9	0	0	0	0	0	112.6	F337 V340 T346 L347	F337-G343 WeakPolarHBondContact O-CA 3.45Å; V340-G343 PolarHBondContact O-N 3.4Å; G343-T346 PolarHBondContact O-N 3.03Å; G343-L347 WeakPolarHBondContact O-CB 3.41Å; G343-L347 PolarHBondContact O-N 2.82Å
344	L	92.4	Very high	92.7	Very high	47 Å²	47	51.8 Å²	51.8	25%	0.246	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-44.7	-179.5	-60.8	-179.5	0	0	0	113.9	Y334 T346 L347 L348	Y334-L344 HydrophobicContact CD2-CD2 3.93Å; Y334-L344 HydrophobicContact CE2-CD2 3.67Å; L344-T346 VanDerWaalsContact C-N 3.31Å; L344-T346 PolarHBondContact O-N 3.3Å; L344-L347 PolarHBondContact O-N 3.33Å; L344-L348 VanDerWaalsContact O-CB 3.3Å; L344-L348 WeakPolarHBondContact O-CB 3.38Å; L344-L348 PolarHBondContact O-N 3.42Å
345	P	93.8	Very high	92.8	Very high	82 Å²	82	50.4 Å²	50.4	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-40.4	175.6	-25.4	35.3	0	0	0	113.1	L348 Q349	P345-L348 WeakPolarHBondContact O-CB 3.4Å; P345-L348 PolarHBondContact O-N 3.2Å; P345-Q349 PolarHBondContact O-N 3.37Å; P345-Q349 VanDerWaalsContact O-N 3.11Å
346	T	93.4	Very high	92.8	Very high	29 Å²	29	48 Å²	48	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-46.9	178.6	-51.8	0	0	0	0	110.6	N311 L314 A342 G343 L344 L348 Q349 F350	N311-T346 VanDerWaalsContact OD1-CG2 3.32Å; N311-T346 WeakPolarHBondContact OD1-CG2 3.47Å; L314-T346 HydrophobicContact CD1-CG2 3.84Å; A342-T346 WeakPolarHBondContact O-CB 3.46Å; A342-T346 PolarHBondContact O-N 3.23Å; A342-T346 PolarHBondContact O-OG1 3.13Å; G343-T346 PolarHBondContact O-N 3.03Å; L344-T346 VanDerWaalsContact C-N 3.31Å; L344-T346 PolarHBondContact O-N 3.3Å; T346-L348 VanDerWaalsContact C-N 3.27Å; T346-L348 PolarHBondContact O-N 2.91Å; T346-Q349 WeakPolarHBondContact O-CB 3.38Å; T346-Q349 PolarHBondContact O-N 2.69Å; T346-Q349 VanDerWaalsContact O-N 3.13Å; T346-F350 HydrophobicContact CG2-CD2 4.05Å; T346-F350 HydrophobicContact CG2-CE2 3.94Å; T346-F350 WeakPolarHBondContact O-CD2 3.12Å; T346-F350 PolarHBondContact O-N 3.02Å; T346-F350 VanDerWaalsContact O-N 3.12Å
347	L	95.1	Very high	92.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.8	-41	174.7	176.2	57.3	0	0	0	111.8	L314 L318 L333 Y334 F337 G343 L344 Q349 F350 W351 F397	L314-L347 HydrophobicContact CD1-CB 4.46Å; L314-L347 HydrophobicContact CD2-CD1 3.7Å; L318-L347 HydrophobicContact CD1-CD1 4.07Å; L318-L347 HydrophobicContact CD2-CD1 4.18Å; L333-L347 HydrophobicContact CD2-CD1 3.55Å; L333-L347 HydrophobicContact CD2-CD2 3.57Å; L333-L347 HydrophobicContact CD2-CG 4.17Å; Y334-L347 HydrophobicContact CD2-CD2 4.18Å; F337-L347 HydrophobicContact CB-CD2 4.49Å; F337-L347 HydrophobicContact CD1-CB 4.24Å; G343-L347 WeakPolarHBondContact O-CB 3.41Å; G343-L347 PolarHBondContact O-N 2.82Å; L344-L347 PolarHBondContact O-N 3.33Å; L347-Q349 VanDerWaalsContact C-N 3.31Å; L347-Q349 PolarHBondContact O-N 3.45Å; L347-F350 PolarHBondContact O-N 3.1Å; L347-W351 VanDerWaalsContact O-CB 3.22Å; L347-W351 WeakPolarHBondContact O-CB 3.42Å; L347-W351 PolarHBondContact O-N 2.95Å; L347-F397 HydrophobicContact CB-CZ 4.34Å; L347-F397 HydrophobicContact CD2-CE1 4.27Å; L347-F397 HydrophobicContact CD2-CZ 3.91Å; L347-F397 HydrophobicContact CG-CE1 3.93Å; L347-F397 HydrophobicContact CG-CZ 3.84Å
348	L	94.8	Very high	92.9	Very high	31 Å²	31	54.5 Å²	54.5	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-39.3	177.6	-168.6	71.8	0	0	0	112	L344 P345 T346 R352 A396 F397 A400	L344-L348 VanDerWaalsContact O-CB 3.3Å; L344-L348 WeakPolarHBondContact O-CB 3.38Å; L344-L348 PolarHBondContact O-N 3.42Å; P345-L348 WeakPolarHBondContact O-CB 3.4Å; P345-L348 PolarHBondContact O-N 3.2Å; T346-L348 VanDerWaalsContact C-N 3.27Å; T346-L348 PolarHBondContact O-N 2.91Å; L348-R352 VanDerWaalsContact O-CG 3.24Å; L348-R352 WeakPolarHBondContact O-CG 3.37Å; L348-R352 PolarHBondContact O-N 3.29Å; L348-A396 HydrophobicContact CD2-CB 4.4Å; L348-F397 HydrophobicContact CB-CE1 4.43Å; L348-F397 HydrophobicContact CB-CZ 4.22Å; L348-F397 HydrophobicContact CD1-CB 4.27Å; L348-F397 HydrophobicContact CD1-CD1 3.66Å; L348-F397 HydrophobicContact CD1-CD2 3.82Å; L348-F397 HydrophobicContact CD1-CE1 3.82Å; L348-F397 HydrophobicContact CD1-CE2 3.98Å; L348-F397 HydrophobicContact CD1-CG 3.66Å; L348-F397 HydrophobicContact CD1-CZ 3.98Å; L348-A400 HydrophobicContact CD1-CB 3.58Å; L348-A400 HydrophobicContact CG-CB 4.1Å
349	Q	94.4	Very high	93	Very high	95 Å²	95	51.6 Å²	51.6	44%	0.444	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-51.8	176.6	-177.4	57.9	38.7	0	0	111.2	P345 T346 L347 W351 R352 D353	P345-Q349 PolarHBondContact O-N 3.37Å; P345-Q349 VanDerWaalsContact O-N 3.11Å; T346-Q349 WeakPolarHBondContact O-CB 3.38Å; T346-Q349 PolarHBondContact O-N 2.69Å; T346-Q349 VanDerWaalsContact O-N 3.13Å; L347-Q349 VanDerWaalsContact C-N 3.31Å; L347-Q349 PolarHBondContact O-N 3.45Å; Q349-W351 VanDerWaalsContact C-N 3.3Å; Q349-W351 PolarHBondContact O-N 3.32Å; Q349-R352 WeakPolarHBondContact O-CB 3.49Å; Q349-R352 PolarHBondContact O-N 3.35Å; Q349-R352 VanDerWaalsContact O-N 3.16Å; Q349-D353 VanDerWaalsContact NE2-CG 3.27Å; Q349-D353 PolarHBondContact NE2-OD1 3.18Å; Q349-D353 VanDerWaalsContact NE2-OD1 3.08Å; Q349-D353 PolarHBondContact NE2-OD2 3.33Å; Q349-D353 PolarHBondContact O-N 2.95Å
350	F	94.8	Very high	93.2	Very high	54 Å²	54	46.7 Å²	46.7	24%	0.237	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-36	178.2	-82.2	-96	0	0	0	112.5	L314 Q315 L318 T346 L347 D353 Y354	L314-F350 HydrophobicContact CB-CB 4.36Å; L314-F350 HydrophobicContact CB-CD1 3.86Å; L314-F350 HydrophobicContact CB-CD2 3.96Å; L314-F350 HydrophobicContact CB-CE1 4.06Å; L314-F350 HydrophobicContact CB-CE2 4.15Å; L314-F350 HydrophobicContact CB-CG 3.8Å; L314-F350 HydrophobicContact CB-CZ 4.2Å; L314-F350 HydrophobicContact CD1-CB 4.3Å; L314-F350 HydrophobicContact CD1-CD2 3.61Å; L314-F350 HydrophobicContact CD1-CE2 4.1Å; L314-F350 HydrophobicContact CD1-CG 4.04Å; L314-F350 HydrophobicContact CG-CD2 4.45Å; Q315-F350 HydrophobicContact CB-CE1 4.1Å; Q315-F350 HydrophobicContact CB-CZ 4.49Å; L318-F350 HydrophobicContact CD2-CB 3.59Å; T346-F350 HydrophobicContact CG2-CD2 4.05Å; T346-F350 HydrophobicContact CG2-CE2 3.94Å; T346-F350 WeakPolarHBondContact O-CD2 3.12Å; T346-F350 PolarHBondContact O-N 3.02Å; T346-F350 VanDerWaalsContact O-N 3.12Å; L347-F350 PolarHBondContact O-N 3.1Å; F350-D353 PolarHBondContact O-N 3.44Å; F350-Y354 VanDerWaalsContact O-CB 3.31Å; F350-Y354 WeakPolarHBondContact O-CB 3.29Å; F350-Y354 PolarHBondContact O-N 3.36Å
351	W	95.2	Very high	93.3	Very high	1 Å²	1	51 Å²	51	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-46.2	172.5	169.7	-104.4	0	0	0	112.2	L322 L347 Q349 I355 M383 V386 V387 F391 F397 M401	L322-W351 HydrophobicContact CD1-CE3 4.01Å; L322-W351 HydrophobicContact CD1-CZ3 4.14Å; L322-W351 HydrophobicContact CD2-CE3 4.2Å; L322-W351 HydrophobicContact CD2-CZ3 3.65Å; L347-W351 VanDerWaalsContact O-CB 3.22Å; L347-W351 WeakPolarHBondContact O-CB 3.42Å; L347-W351 PolarHBondContact O-N 2.95Å; Q349-W351 VanDerWaalsContact C-N 3.3Å; Q349-W351 PolarHBondContact O-N 3.32Å; W351-I355 HydrophobicContact CD2-CD1 3.85Å; W351-I355 HydrophobicContact CG-CD1 4.25Å; W351-I355 HydrophobicContact CH2-CD1 4.28Å; W351-I355 HydrophobicContact CZ2-CD1 3.59Å; W351-I355 WeakPolarHBondContact O-CG1 3.42Å; W351-I355 PolarHBondContact O-N 3.34Å; W351-I355 VanDerWaalsContact O-N 3.09Å; W351-M383 HydrophobicContact CH2-CB 4.04Å; W351-M383 HydrophobicContact CH2-CG 4.28Å; W351-M383 HydrophobicContact CH2-SD 3.43Å; W351-M383 WeakPolarHBondContact CH2-SD 3.4Å; W351-M383 HydrophobicContact CZ2-CB 4.26Å; W351-M383 HydrophobicContact CZ2-SD 4.22Å; W351-M383 HydrophobicContact CZ3-SD 3.73Å; W351-V386 HydrophobicContact CH2-CB 4.12Å; W351-V386 HydrophobicContact CH2-CG1 3.93Å; W351-V386 HydrophobicContact CZ3-CB 4.43Å; W351-V386 HydrophobicContact CZ3-CG1 3.86Å; W351-V387 HydrophobicContact CH2-CG2 4.08Å; W351-V387 HydrophobicContact CZ2-CG2 3.5Å; W351-V387 VanDerWaalsContact CZ2-CG2 3.5Å; W351-F391 HydrophobicContact CD2-CE2 4.01Å; W351-F391 AromaticContact CE3-CE2 3.81Å; W351-F391 HydrophobicContact CE3-CE2 3.81Å; W351-F391 HydrophobicContact CE3-CZ 4.3Å; W351-F391 HydrophobicContact CH2-CE2 4.25Å; W351-F391 HydrophobicContact CZ2-CE2 4.42Å; W351-F391 AromaticContact CZ3-CE2 3.94Å; W351-F391 HydrophobicContact CZ3-CE2 3.94Å; W351-F391 HydrophobicContact CZ3-CZ 4.45Å; W351-F397 HydrophobicContact CB-CD1 4.36Å; W351-F397 HydrophobicContact CB-CE1 4.16Å; W351-F397 AromaticContact CD1-CD1 3.72Å; W351-F397 HydrophobicContact CD2-CD1 4.33Å; W351-F397 AromaticContact CG-CD1 3.9Å; W351-F397 HydrophobicContact CG-CD1 3.9Å; W351-F397 HydrophobicContact CG-CE1 4.18Å; W351-M401 HydrophobicContact CZ2-SD 4.4Å
352	R	95.3	Very high	93.8	Very high	57 Å²	57	41.5 Å²	41.5	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-45.9	175.9	-73.6	166.7	176	-130.7	-16.1	111.4	L348 Q349 I355 K356 A400 E403	L348-R352 VanDerWaalsContact O-CG 3.24Å; L348-R352 WeakPolarHBondContact O-CG 3.37Å; L348-R352 PolarHBondContact O-N 3.29Å; Q349-R352 WeakPolarHBondContact O-CB 3.49Å; Q349-R352 PolarHBondContact O-N 3.35Å; Q349-R352 VanDerWaalsContact O-N 3.16Å; R352-I355 PolarHBondContact O-N 3.5Å; R352-K356 WeakPolarHBondContact O-CG 2.93Å; R352-K356 PolarHBondContact O-N 2.98Å; R352-A400 HydrophobicContact CG-CB 3.67Å; R352-E403 IonicContact CZ-OE2 2.81Å; R352-E403 IonicContact NH1-OE1 3.82Å; R352-E403 IonicContact NH1-OE2 3.73Å; R352-E403 PolarHBondContact NH1-OE2 3.44Å; R352-E403 VanDerWaalsContact NH1-OE2 3.1Å; R352-E403 IonicContact NH2-OE2 3.38Å; R352-E403 PolarHBondContact NH2-OE2 3.43Å
353	D	94.7	Very high	94	Very high	71 Å²	71	39.2 Å²	39.2	38%	0.38	20%	0.201	S	C	.	.	H	α-helix	trans	-68.7	-40.4	-176.2	-66.8	-22.4	0	0	0	111.5	Q349 F350 K356 S357	Q349-D353 VanDerWaalsContact NE2-CG 3.27Å; Q349-D353 PolarHBondContact NE2-OD1 3.18Å; Q349-D353 VanDerWaalsContact NE2-OD1 3.08Å; Q349-D353 PolarHBondContact NE2-OD2 3.33Å; Q349-D353 PolarHBondContact O-N 2.95Å; F350-D353 PolarHBondContact O-N 3.44Å; D353-K356 PolarHBondContact O-N 3.42Å; D353-S357 WeakPolarHBondContact O-CB 3.41Å; D353-S357 PolarHBondContact O-N 2.97Å
354	Y	95.8	Very high	93.8	Very high	15 Å²	15	41.9 Å²	41.9	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-50.6	172.1	172.4	-90	0	0	0	111.5	L322 D323 F350 K356 S357 F358 F379 M383	L322-Y354 HydrophobicContact CB-CD1 4.44Å; L322-Y354 HydrophobicContact CB-CE1 3.82Å; L322-Y354 HydrophobicContact CB-CE2 3.88Å; L322-Y354 VanDerWaalsContact CB-CZ 3.48Å; L322-Y354 HydrophobicContact CD1-CD1 3.41Å; L322-Y354 VanDerWaalsContact CD1-CD1 3.41Å; L322-Y354 HydrophobicContact CD1-CD2 3.96Å; L322-Y354 HydrophobicContact CD1-CE1 3.64Å; L322-Y354 HydrophobicContact CD1-CE2 4.13Å; L322-Y354 HydrophobicContact CD1-CG 3.59Å; L322-Y354 HydrophobicContact CG-CE1 4.32Å; D323-Y354 PolarHBondContact OD1-OH 3.3Å; F350-Y354 VanDerWaalsContact O-CB 3.31Å; F350-Y354 WeakPolarHBondContact O-CB 3.29Å; F350-Y354 PolarHBondContact O-N 3.36Å; Y354-K356 VanDerWaalsContact C-N 3.3Å; Y354-K356 PolarHBondContact O-N 3.08Å; Y354-S357 PolarHBondContact O-N 3.39Å; Y354-F358 WeakPolarHBondContact O-CB 3.25Å; Y354-F358 PolarHBondContact O-N 2.97Å; Y354-F379 HydrophobicContact CE1-CE2 4.19Å; Y354-F379 HydrophobicContact CE1-CZ 4.39Å; Y354-M383 HydrophobicContact CE1-CE 4.36Å; Y354-M383 HydrophobicContact CE1-SD 4.12Å
355	I	96.1	Very high	93.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-43	179.4	-69.9	168.4	0	0	0	111.1	W351 R352 G359 F379 M383 M401 A404 F405 F408	W351-I355 HydrophobicContact CD2-CD1 3.85Å; W351-I355 HydrophobicContact CG-CD1 4.25Å; W351-I355 HydrophobicContact CH2-CD1 4.28Å; W351-I355 HydrophobicContact CZ2-CD1 3.59Å; W351-I355 WeakPolarHBondContact O-CG1 3.42Å; W351-I355 PolarHBondContact O-N 3.34Å; W351-I355 VanDerWaalsContact O-N 3.09Å; R352-I355 PolarHBondContact O-N 3.5Å; I355-G359 WeakPolarHBondContact O-CA 3.3Å; I355-G359 PolarHBondContact O-N 3.06Å; I355-F379 HydrophobicContact CG1-CZ 4.35Å; I355-F379 HydrophobicContact CG2-CE1 4.16Å; I355-F379 HydrophobicContact CG2-CZ 4.37Å; I355-M383 HydrophobicContact CD1-SD 4.47Å; I355-M383 HydrophobicContact CG1-CG 4.41Å; I355-M383 HydrophobicContact CG1-SD 4.07Å; I355-M401 HydrophobicContact CD1-CB 4.05Å; I355-M401 HydrophobicContact CD1-CG 4.01Å; I355-A404 HydrophobicContact CB-CB 4.01Å; I355-A404 HydrophobicContact CG2-CB 3.62Å; I355-F405 HydrophobicContact CG2-CD2 3.71Å; I355-F405 HydrophobicContact CG2-CE2 3.72Å; I355-F408 HydrophobicContact CG2-CD1 4.04Å; I355-F408 HydrophobicContact CG2-CE1 3.72Å
356	K	95.1	Very high	93.2	Very high	66 Å²	66	41.3 Å²	41.3	29%	0.287	22%	0.218	S	C	.	.	H	α-helix	trans	-66.4	-38.7	178.9	-73.7	176	-177.8	178.8	0	112.4	R352 D353 Y354 G360 A404 T407	R352-K356 WeakPolarHBondContact O-CG 2.93Å; R352-K356 PolarHBondContact O-N 2.98Å; D353-K356 PolarHBondContact O-N 3.42Å; Y354-K356 VanDerWaalsContact C-N 3.3Å; Y354-K356 PolarHBondContact O-N 3.08Å; K356-G360 WeakPolarHBondContact O-CA 3.39Å; K356-G360 PolarHBondContact O-N 3.3Å; K356-A404 HydrophobicContact CG-CB 3.98Å; K356-T407 HydrophobicContact CD-CG2 4.39Å
357	S	94.1	Very high	93	Very high	73 Å²	73	47.3 Å²	47.3	51%	0.51	24%	0.244	S	C	.	.	H	α-helix	trans	-69.3	-58.1	179.3	-164.8	0	0	0	0	110.9	D353 Y354 G360 E361	D353-S357 WeakPolarHBondContact O-CB 3.41Å; D353-S357 PolarHBondContact O-N 2.97Å; Y354-S357 PolarHBondContact O-N 3.39Å; S357-G360 WeakPolarHBondContact O-CA 3.45Å; S357-G360 PolarHBondContact O-N 3.04Å; S357-G360 VanDerWaalsContact O-N 3.15Å; S357-E361 PolarHBondContact O-N 2.82Å
358	F	93.9	Very high	92.6	Very high	68 Å²	68	52.5 Å²	52.5	30%	0.298	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-46.4	-178	-170.4	-90.3	0	0	0	111.6	Y354 G360 E361 I362 F379	Y354-F358 WeakPolarHBondContact O-CB 3.25Å; Y354-F358 PolarHBondContact O-N 2.97Å; F358-G360 VanDerWaalsContact C-N 3.26Å; F358-G360 PolarHBondContact O-N 3.07Å; F358-E361 PolarHBondContact O-N 2.88Å; F358-I362 HydrophobicContact CD1-CD1 3.95Å; F358-I362 HydrophobicContact CD1-CG1 4.48Å; F358-I362 HydrophobicContact CE1-CD1 3.8Å; F358-I362 HydrophobicContact CE1-CG1 4.36Å; F358-I362 PolarHBondContact O-N 3.15Å; F358-F379 HydrophobicContact CB-CE2 4.47Å; F358-F379 HydrophobicContact CB-CZ 4.19Å; F358-F379 HydrophobicContact CD1-CD1 4.3Å; F358-F379 AromaticContact CD1-CD2 3.56Å; F358-F379 HydrophobicContact CD1-CD2 3.56Å; F358-F379 HydrophobicContact CD1-CE1 4.12Å; F358-F379 AromaticContact CD1-CE2 3.36Å; F358-F379 HydrophobicContact CD1-CE2 3.36Å; F358-F379 HydrophobicContact CD1-CG 4.05Å; F358-F379 AromaticContact CD1-CZ 3.66Å; F358-F379 HydrophobicContact CD1-CZ 3.66Å; F358-F379 AromaticContact CE1-CD2 3.61Å; F358-F379 HydrophobicContact CE1-CD2 3.61Å; F358-F379 AromaticContact CE1-CE2 3.85Å; F358-F379 HydrophobicContact CE1-CE2 3.85Å; F358-F379 HydrophobicContact CE1-CG 4.11Å; F358-F379 HydrophobicContact CG-CE2 4.15Å; F358-F379 HydrophobicContact CG-CZ 4.31Å
359	G	93.6	Very high	92.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-34.6	175.2	0	0	0	0	0	112.8	I355 I362 V363 F408	I355-G359 WeakPolarHBondContact O-CA 3.3Å; I355-G359 PolarHBondContact O-N 3.06Å; G359-I362 PolarHBondContact O-N 3.31Å; G359-V363 WeakPolarHBondContact O-CG2 3.4Å; G359-V363 PolarHBondContact O-N 3.42Å; G359-F408 VanDerWaalsContact O-CD2 3.25Å; G359-F408 WeakPolarHBondContact O-CD2 3.46Å; G359-F408 WeakPolarHBondContact O-CE2 3.18Å
360	G	92.7	Very high	92	Very high	7 Å²	7	57.2 Å²	57.2	7%	0.072	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-42.3	173.3	0	0	0	0	0	112.7	K356 S357 F358 I362 V363 C364	K356-G360 WeakPolarHBondContact O-CA 3.39Å; K356-G360 PolarHBondContact O-N 3.3Å; S357-G360 WeakPolarHBondContact O-CA 3.45Å; S357-G360 PolarHBondContact O-N 3.04Å; S357-G360 VanDerWaalsContact O-N 3.15Å; F358-G360 VanDerWaalsContact C-N 3.26Å; F358-G360 PolarHBondContact O-N 3.07Å; G360-I362 VanDerWaalsContact C-N 3.33Å; G360-I362 PolarHBondContact O-N 2.96Å; G360-V363 PolarHBondContact O-N 3.26Å; G360-C364 WeakPolarHBondContact O-CB 3.47Å; G360-C364 PolarHBondContact O-N 3.36Å; G360-C364 PolarHBondContact O-SG 3.49Å; G360-C364 VanDerWaalsContact O-SG 3.41Å
361	E	92.4	Very high	91.9	Very high	113 Å²	113	59.2 Å²	59.2	53%	0.528	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-37.3	176.6	-69.8	177	-165.1	0	0	112.5	S357 F358 T365	S357-E361 PolarHBondContact O-N 2.82Å; F358-E361 PolarHBondContact O-N 2.88Å; E361-T365 WeakPolarHBondContact O-CB 3.37Å; E361-T365 PolarHBondContact O-OG1 2.87Å
362	I	92.7	Very high	91.8	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-48.8	175.8	-61.9	171.5	0	0	0	110.7	F358 G359 G360 M372 D375 L376 F379	F358-I362 HydrophobicContact CD1-CD1 3.95Å; F358-I362 HydrophobicContact CD1-CG1 4.48Å; F358-I362 HydrophobicContact CE1-CD1 3.8Å; F358-I362 HydrophobicContact CE1-CG1 4.36Å; F358-I362 PolarHBondContact O-N 3.15Å; G359-I362 PolarHBondContact O-N 3.31Å; G360-I362 VanDerWaalsContact C-N 3.33Å; G360-I362 PolarHBondContact O-N 2.96Å; I362-M372 HydrophobicContact CG2-CG 4.15Å; I362-D375 HydrophobicContact CD1-CB 4.43Å; I362-D375 HydrophobicContact CG2-CB 3.8Å; I362-L376 HydrophobicContact CG2-CD2 4.07Å; I362-L376 HydrophobicContact CG2-CG 3.98Å; I362-F379 HydrophobicContact CD1-CB 3.98Å; I362-F379 HydrophobicContact CD1-CD1 4.08Å; I362-F379 HydrophobicContact CD1-CG 4.08Å
363	V	91.9	Very high	91.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-85.4	-31.6	-172.8	-61.3	0	0	0	0	114	G359 G360 M372 L376 F408 R412	G359-V363 WeakPolarHBondContact O-CG2 3.4Å; G359-V363 PolarHBondContact O-N 3.42Å; G360-V363 PolarHBondContact O-N 3.26Å; V363-M372 HydrophobicContact CB-SD 4.4Å; V363-M372 HydrophobicContact CG1-CG 4.38Å; V363-M372 HydrophobicContact CG1-SD 4.29Å; V363-L376 HydrophobicContact CG1-CD1 4.08Å; V363-L376 HydrophobicContact CG1-CD2 3.97Å; V363-L376 HydrophobicContact CG1-CG 4.41Å; V363-F408 HydrophobicContact CG1-CD2 4.33Å; V363-F408 HydrophobicContact CG1-CE2 4.26Å; V363-F408 HydrophobicContact CG2-CD2 4.22Å; V363-F408 WeakPolarHBondContact CG2-O 3.43Å; V363-R412 WeakPolarHBondContact O-CD 3.49Å; V363-R412 PolarHBondContact O-NH1 2.89Å
364	C	87.8	Confident	91.7	Very high	56 Å²	56	56.7 Å²	56.7	38%	0.378	29%	0.288	S	S	.	.	H	α-helix	trans	-83.9	-10	-172.1	-71.3	0	0	0	0	114.6	G360 P366	G360-C364 WeakPolarHBondContact O-CB 3.47Å; G360-C364 PolarHBondContact O-N 3.36Å; G360-C364 PolarHBondContact O-SG 3.49Å; G360-C364 VanDerWaalsContact O-SG 3.41Å; C364-P366 VanDerWaalsContact O-CD 3.26Å; C364-P366 WeakPolarHBondContact O-CD 3.4Å
365	T	88.5	Confident	91.7	Very high	42 Å²	42	58.7 Å²	58.7	26%	0.258	30%	0.3	S	S	.	.			trans	-93.6	101.8	-177	-52.7	0	0	0	0	110.7	E361 E367 K368	E361-T365 WeakPolarHBondContact O-CB 3.37Å; E361-T365 PolarHBondContact O-OG1 2.87Å; T365-E367 HydrophobicContact CG2-CB 4.45Å; T365-E367 WeakPolarHBondContact CG2-OE2 3.28Å; T365-E367 PolarHBondContact O-N 3.47Å; T365-K368 HydrophobicContact CG2-CB 4.42Å; T365-K368 HydrophobicContact CG2-CD 4.19Å; T365-K368 HydrophobicContact CG2-CG 3.97Å; T365-K368 PolarHBondContact O-N 2.99Å; T365-K368 VanDerWaalsContact O-N 3.09Å
366	P	86.1	Confident	91.6	Very high	76 Å²	76	58.8 Å²	58.8	49%	0.494	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62.7	-26.8	-173.2	-21.8	35.5	0	0	0	113.9	C364 K368 D369	C364-P366 VanDerWaalsContact O-CD 3.26Å; C364-P366 WeakPolarHBondContact O-CD 3.4Å; P366-K368 PolarHBondContact O-N 2.96Å; P366-D369 WeakPolarHBondContact O-CB 3.09Å; P366-D369 PolarHBondContact O-N 3.1Å
367	E	87.4	Confident	91.6	Very high	155 Å²	155	56.2 Å²	56.2	72%	0.724	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-66	-25.8	179.2	-59.4	72.2	-153.4	0	0	112	T365	T365-E367 HydrophobicContact CG2-CB 4.45Å; T365-E367 WeakPolarHBondContact CG2-OE2 3.28Å; T365-E367 PolarHBondContact O-N 3.47Å
368	K	87.4	Confident	91.6	Very high	108 Å²	108	56.6 Å²	56.6	47%	0.47	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-95	9.1	-179.8	-63.6	-174.5	179.1	-178.9	0	113.6	T365 P366 K370 D371 M372	T365-K368 HydrophobicContact CG2-CB 4.42Å; T365-K368 HydrophobicContact CG2-CD 4.19Å; T365-K368 HydrophobicContact CG2-CG 3.97Å; T365-K368 PolarHBondContact O-N 2.99Å; T365-K368 VanDerWaalsContact O-N 3.09Å; P366-K368 PolarHBondContact O-N 2.96Å; K368-K370 PolarHBondContact O-N 3.07Å; K368-D371 PolarHBondContact O-N 3.47Å; K368-M372 PolarHBondContact O-N 2.87Å
369	D	89.4	Confident	91.7	Very high	34 Å²	34	53.8 Å²	53.8	18%	0.182	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-27.9	-178.1	-86.1	7.8	0	0	0	114.4	P366 R412 L419	P366-D369 WeakPolarHBondContact O-CB 3.09Å; P366-D369 PolarHBondContact O-N 3.1Å; D369-R412 IonicContact OD1-CZ 2.83Å; D369-R412 IonicContact OD1-NH1 2.87Å; D369-R412 PolarHBondContact OD1-NH1 3.32Å; D369-R412 IonicContact OD1-NH2 3.59Å; D369-R412 PolarHBondContact OD1-NH2 3.33Å; D369-R412 IonicContact OD2-CZ 3.56Å; D369-R412 IonicContact OD2-NH1 3.06Å; D369-R412 IonicContact OD2-NH2 2.81Å; D369-R412 PolarHBondContact OD2-NH2 3.35Å; D369-L419 HydrophobicContact CB-CD1 3.99Å
370	K	88	Confident	91.8	Very high	192 Å²	192	54.6 Å²	54.6	84%	0.835	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-39.2	178.7	-66.8	-177	-179	171.5	0	112.6	K368	K368-K370 PolarHBondContact O-N 3.07Å
371	D	91.6	Very high	91.9	Very high	96 Å²	96	56.9 Å²	56.9	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-14.5	-173.4	-55	-46.8	0	0	0	111.7	K368 V373 Q374 D375	K368-D371 PolarHBondContact O-N 3.47Å; D371-V373 VanDerWaalsContact C-N 3.33Å; D371-V373 PolarHBondContact O-N 3.39Å; D371-V373 VanDerWaalsContact O-N 3.07Å; D371-Q374 WeakPolarHBondContact O-CA 3.39Å; D371-Q374 WeakPolarHBondContact O-CB 3.36Å; D371-Q374 PolarHBondContact O-N 3.15Å; D371-D375 PolarHBondContact O-N 3.47Å
372	M	94	Very high	92	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-44.3	-47.8	-176.2	-173.3	-165	75.2	0	0	114.7	I362 V363 K368 L376 P416 L419	I362-M372 HydrophobicContact CG2-CG 4.15Å; V363-M372 HydrophobicContact CB-SD 4.4Å; V363-M372 HydrophobicContact CG1-CG 4.38Å; V363-M372 HydrophobicContact CG1-SD 4.29Å; K368-M372 PolarHBondContact O-N 2.87Å; M372-L376 HydrophobicContact CG-CD1 4.28Å; M372-L376 WeakPolarHBondContact O-CB 3.28Å; M372-L376 WeakPolarHBondContact O-CG 3.43Å; M372-L376 PolarHBondContact O-N 3.02Å; M372-P416 HydrophobicContact CE-CB 4.46Å; M372-L419 HydrophobicContact CE-CB 3.57Å; M372-L419 HydrophobicContact CE-CD1 3.28Å; M372-L419 HydrophobicContact CE-CG 4.01Å; M372-L419 HydrophobicContact SD-CD1 3.76Å
373	V	94.2	Very high	92.1	Very high	8 Å²	8	53.2 Å²	53.2	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-69.8	-38.3	-178	-178.3	0	0	0	0	111.6	D371 L376 L377 L419 I420 Y423	D371-V373 VanDerWaalsContact C-N 3.33Å; D371-V373 PolarHBondContact O-N 3.39Å; D371-V373 VanDerWaalsContact O-N 3.07Å; V373-L376 PolarHBondContact O-N 3Å; V373-L377 HydrophobicContact CG1-CD1 4.35Å; V373-L377 VanDerWaalsContact O-CG 3.28Å; V373-L377 WeakPolarHBondContact O-CG 3.45Å; V373-L377 PolarHBondContact O-N 3.05Å; V373-L377 VanDerWaalsContact O-N 3.16Å; V373-L419 HydrophobicContact CG2-CB 3.94Å; V373-I420 HydrophobicContact CG1-CG1 4.07Å; V373-I420 HydrophobicContact CG2-CG1 3.84Å; V373-Y423 HydrophobicContact CB-CD2 3.87Å; V373-Y423 HydrophobicContact CB-CE2 4.42Å; V373-Y423 HydrophobicContact CB-CG 3.96Å; V373-Y423 HydrophobicContact CG1-CD1 3.75Å; V373-Y423 HydrophobicContact CG1-CD2 3.92Å; V373-Y423 HydrophobicContact CG1-CE1 4.25Å; V373-Y423 HydrophobicContact CG1-CE2 4.38Å; V373-Y423 HydrophobicContact CG1-CG 3.57Å
374	Q	93.4	Very high	92.2	Very high	67 Å²	67	55.8 Å²	55.8	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-47.8	177	-175.1	59.1	51	0	0	110.2	D371 L376 L377 D378 Y423	D371-Q374 WeakPolarHBondContact O-CA 3.39Å; D371-Q374 WeakPolarHBondContact O-CB 3.36Å; D371-Q374 PolarHBondContact O-N 3.15Å; Q374-L376 VanDerWaalsContact C-N 3.28Å; Q374-L376 PolarHBondContact O-N 2.95Å; Q374-L377 WeakPolarHBondContact O-CB 3.44Å; Q374-L377 PolarHBondContact O-N 3.37Å; Q374-D378 VanDerWaalsContact NE2-CG 3.32Å; Q374-D378 PolarHBondContact NE2-OD1 3.41Å; Q374-D378 PolarHBondContact NE2-OD2 3.23Å; Q374-D378 PolarHBondContact O-N 2.82Å; Q374-Y423 PolarHBondContact OE1-OH 2.87Å
375	D	94.7	Very high	92.5	Very high	58 Å²	58	56 Å²	56	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-59.3	-37.8	177.1	-67.9	-13.5	0	0	0	112	I362 D371 F379	I362-D375 HydrophobicContact CD1-CB 4.43Å; I362-D375 HydrophobicContact CG2-CB 3.8Å; D371-D375 PolarHBondContact O-N 3.47Å; D375-F379 WeakPolarHBondContact O-CB 3.45Å; D375-F379 PolarHBondContact O-N 3.27Å
376	L	95.1	Very high	92.8	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-39.8	174.7	-77.4	173.8	0	0	0	112.9	I362 V363 M372 V373 Q374 K380 F408 I409	I362-L376 HydrophobicContact CG2-CD2 4.07Å; I362-L376 HydrophobicContact CG2-CG 3.98Å; V363-L376 HydrophobicContact CG1-CD1 4.08Å; V363-L376 HydrophobicContact CG1-CD2 3.97Å; V363-L376 HydrophobicContact CG1-CG 4.41Å; M372-L376 HydrophobicContact CG-CD1 4.28Å; M372-L376 WeakPolarHBondContact O-CB 3.28Å; M372-L376 WeakPolarHBondContact O-CG 3.43Å; M372-L376 PolarHBondContact O-N 3.02Å; V373-L376 PolarHBondContact O-N 3Å; Q374-L376 VanDerWaalsContact C-N 3.28Å; Q374-L376 PolarHBondContact O-N 2.95Å; L376-K380 VanDerWaalsContact O-CB 3.31Å; L376-K380 WeakPolarHBondContact O-CB 3.24Å; L376-K380 PolarHBondContact O-N 3.35Å; L376-F408 HydrophobicContact CD2-CE2 3.6Å; L376-F408 HydrophobicContact CD2-CZ 4Å; L376-I409 HydrophobicContact CD2-CG1 4.45Å
377	L	94.6	Very high	93.2	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-47.7	177.8	-69.3	167.5	0	0	0	110.5	V373 Q374 F379 K380 D381 Y423 K446 I447 I450	V373-L377 HydrophobicContact CG1-CD1 4.35Å; V373-L377 VanDerWaalsContact O-CG 3.28Å; V373-L377 WeakPolarHBondContact O-CG 3.45Å; V373-L377 PolarHBondContact O-N 3.05Å; V373-L377 VanDerWaalsContact O-N 3.16Å; Q374-L377 WeakPolarHBondContact O-CB 3.44Å; Q374-L377 PolarHBondContact O-N 3.37Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 3.2Å; L377-K380 PolarHBondContact O-N 3.45Å; L377-D381 PolarHBondContact O-N 3.06Å; L377-Y423 HydrophobicContact CD1-CE1 4.1Å; L377-K446 HydrophobicContact CD2-CB 3.89Å; L377-I447 HydrophobicContact CD1-CG1 4.21Å; L377-I447 HydrophobicContact CD2-CG1 4.33Å; L377-I450 HydrophobicContact CD2-CG1 3.8Å
378	D	94.7	Very high	93.5	Very high	82 Å²	82	48.2 Å²	48.2	44%	0.439	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-39.2	-179.4	-64.4	-25	0	0	0	111	Q374 D381 K382	Q374-D378 VanDerWaalsContact NE2-CG 3.32Å; Q374-D378 PolarHBondContact NE2-OD1 3.41Å; Q374-D378 PolarHBondContact NE2-OD2 3.23Å; Q374-D378 PolarHBondContact O-N 2.82Å; D378-D381 PolarHBondContact O-N 2.66Å; D378-K382 WeakPolarHBondContact O-CB 3.24Å; D378-K382 PolarHBondContact O-N 3.28Å
379	F	95.6	Very high	93.7	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.035	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-42.4	173.6	-177.5	-128	0	0	0	111.9	Y354 I355 F358 I362 D375 L377 K382 M383 F405 F408	Y354-F379 HydrophobicContact CE1-CE2 4.19Å; Y354-F379 HydrophobicContact CE1-CZ 4.39Å; I355-F379 HydrophobicContact CG1-CZ 4.35Å; I355-F379 HydrophobicContact CG2-CE1 4.16Å; I355-F379 HydrophobicContact CG2-CZ 4.37Å; F358-F379 HydrophobicContact CB-CE2 4.47Å; F358-F379 HydrophobicContact CB-CZ 4.19Å; F358-F379 HydrophobicContact CD1-CD1 4.3Å; F358-F379 AromaticContact CD1-CD2 3.56Å; F358-F379 HydrophobicContact CD1-CD2 3.56Å; F358-F379 HydrophobicContact CD1-CE1 4.12Å; F358-F379 AromaticContact CD1-CE2 3.36Å; F358-F379 HydrophobicContact CD1-CE2 3.36Å; F358-F379 HydrophobicContact CD1-CG 4.05Å; F358-F379 AromaticContact CD1-CZ 3.66Å; F358-F379 HydrophobicContact CD1-CZ 3.66Å; F358-F379 AromaticContact CE1-CD2 3.61Å; F358-F379 HydrophobicContact CE1-CD2 3.61Å; F358-F379 AromaticContact CE1-CE2 3.85Å; F358-F379 HydrophobicContact CE1-CE2 3.85Å; F358-F379 HydrophobicContact CE1-CG 4.11Å; F358-F379 HydrophobicContact CG-CE2 4.15Å; F358-F379 HydrophobicContact CG-CZ 4.31Å; I362-F379 HydrophobicContact CD1-CB 3.98Å; I362-F379 HydrophobicContact CD1-CD1 4.08Å; I362-F379 HydrophobicContact CD1-CG 4.08Å; D375-F379 WeakPolarHBondContact O-CB 3.45Å; D375-F379 PolarHBondContact O-N 3.27Å; L377-F379 VanDerWaalsContact C-N 3.34Å; L377-F379 PolarHBondContact O-N 3.2Å; F379-K382 PolarHBondContact O-N 2.99Å; F379-M383 HydrophobicContact CD2-CE 4.28Å; F379-M383 HydrophobicContact CD2-CG 4.09Å; F379-M383 HydrophobicContact CE1-CG 4.36Å; F379-M383 HydrophobicContact CE2-CE 3.81Å; F379-M383 HydrophobicContact CE2-CG 3.69Å; F379-M383 HydrophobicContact CE2-SD 3.72Å; F379-M383 HydrophobicContact CZ-CG 3.84Å; F379-M383 HydrophobicContact CZ-SD 4.01Å; F379-M383 VanDerWaalsContact O-CG 3.32Å; F379-M383 WeakPolarHBondContact O-CG 3.31Å; F379-M383 PolarHBondContact O-N 3Å; F379-F405 HydrophobicContact CD1-CE1 4.01Å; F379-F405 HydrophobicContact CD1-CE2 4.42Å; F379-F405 AromaticContact CD1-CZ 3.56Å; F379-F405 HydrophobicContact CD1-CZ 3.56Å; F379-F405 HydrophobicContact CE1-CE1 4.41Å; F379-F405 HydrophobicContact CE1-CE2 4.15Å; F379-F405 AromaticContact CE1-CZ 3.73Å; F379-F405 HydrophobicContact CE1-CZ 3.73Å; F379-F405 HydrophobicContact CG-CZ 4.39Å; F379-F408 HydrophobicContact CD1-CZ 4.4Å; F379-F408 HydrophobicContact CE1-CE1 4.27Å; F379-F408 HydrophobicContact CE1-CZ 4.3Å
380	K	95.4	Very high	93.9	Very high	17 Å²	17	44.9 Å²	44.9	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-44.8	176.8	-177.5	60.3	169.6	68.2	0	112	L376 L377 K382 M383 D384 F405 I450	L376-K380 VanDerWaalsContact O-CB 3.31Å; L376-K380 WeakPolarHBondContact O-CB 3.24Å; L376-K380 PolarHBondContact O-N 3.35Å; L377-K380 PolarHBondContact O-N 3.45Å; K380-K382 VanDerWaalsContact C-N 3.33Å; K380-K382 PolarHBondContact O-N 3.4Å; K380-M383 PolarHBondContact O-N 3.11Å; K380-D384 IonicContact NZ-OD1 3.18Å; K380-D384 PolarHBondContact NZ-OD1 2.94Å; K380-D384 IonicContact NZ-OD2 3.67Å; K380-D384 PolarHBondContact NZ-OD2 2.67Å; K380-D384 WeakPolarHBondContact O-CB 3.3Å; K380-D384 PolarHBondContact O-N 2.98Å; K380-F405 HydrophobicContact CB-CE1 3.87Å; K380-F405 HydrophobicContact CB-CZ 4.04Å; K380-F405 HydrophobicContact CD-CD1 4.12Å; K380-F405 HydrophobicContact CD-CD2 4.42Å; K380-F405 HydrophobicContact CD-CE1 3.72Å; K380-F405 HydrophobicContact CD-CE2 4.04Å; K380-F405 HydrophobicContact CD-CG 4.47Å; K380-F405 HydrophobicContact CD-CZ 3.67Å; K380-F405 HydrophobicContact CG-CE1 4.33Å; K380-F405 HydrophobicContact CG-CZ 4.48Å; K380-I450 HydrophobicContact CB-CD1 3.83Å; K380-I450 HydrophobicContact CD-CD1 4.47Å; K380-I450 HydrophobicContact CG-CD1 3.87Å
381	D	94.8	Very high	94.2	Very high	56 Å²	56	35.7 Å²	35.7	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-60.5	-43	176.5	-76.4	-26.2	0	0	0	111.4	L377 D378 D384 N385 K446	L377-D381 PolarHBondContact O-N 3.06Å; D378-D381 PolarHBondContact O-N 2.66Å; D381-D384 PolarHBondContact O-N 3.24Å; D381-N385 WeakPolarHBondContact O-CB 3.45Å; D381-N385 PolarHBondContact O-N 3.28Å; D381-K446 VanDerWaalsContact CG-NZ 3.29Å; D381-K446 WeakPolarHBondContact OD1-CE 3.4Å; D381-K446 IonicContact OD1-NZ 3.92Å; D381-K446 PolarHBondContact OD1-NZ 3.41Å; D381-K446 IonicContact OD2-NZ 2.82Å; D381-K446 PolarHBondContact OD2-NZ 2.86Å
382	K	94.7	Very high	94.2	Very high	50 Å²	50	34.9 Å²	34.9	22%	0.217	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-49.1	176.4	-171.6	-176.1	-175.8	-178.4	0	111.4	L322 D323 D378 F379 K380 N385 V386	L322-K382 WeakPolarHBondContact O-CE 3.36Å; L322-K382 PolarHBondContact O-NZ 3.13Å; D323-K382 PolarHBondContact O-NZ 2.96Å; D378-K382 WeakPolarHBondContact O-CB 3.24Å; D378-K382 PolarHBondContact O-N 3.28Å; F379-K382 PolarHBondContact O-N 2.99Å; K380-K382 VanDerWaalsContact C-N 3.33Å; K380-K382 PolarHBondContact O-N 3.4Å; K382-N385 PolarHBondContact O-N 3.12Å; K382-V386 WeakPolarHBondContact O-CG2 3.49Å; K382-V386 PolarHBondContact O-N 3.43Å
383	M	94.9	Very high	94.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67	-38.7	-179.5	-63.1	-59.5	94.1	0	0	112.1	W351 Y354 I355 F379 K380 N385 V386 V387 M401 F405	W351-M383 HydrophobicContact CH2-CB 4.04Å; W351-M383 HydrophobicContact CH2-CG 4.28Å; W351-M383 HydrophobicContact CH2-SD 3.43Å; W351-M383 WeakPolarHBondContact CH2-SD 3.4Å; W351-M383 HydrophobicContact CZ2-CB 4.26Å; W351-M383 HydrophobicContact CZ2-SD 4.22Å; W351-M383 HydrophobicContact CZ3-SD 3.73Å; Y354-M383 HydrophobicContact CE1-CE 4.36Å; Y354-M383 HydrophobicContact CE1-SD 4.12Å; I355-M383 HydrophobicContact CD1-SD 4.47Å; I355-M383 HydrophobicContact CG1-CG 4.41Å; I355-M383 HydrophobicContact CG1-SD 4.07Å; F379-M383 HydrophobicContact CD2-CE 4.28Å; F379-M383 HydrophobicContact CD2-CG 4.09Å; F379-M383 HydrophobicContact CE1-CG 4.36Å; F379-M383 HydrophobicContact CE2-CE 3.81Å; F379-M383 HydrophobicContact CE2-CG 3.69Å; F379-M383 HydrophobicContact CE2-SD 3.72Å; F379-M383 HydrophobicContact CZ-CG 3.84Å; F379-M383 HydrophobicContact CZ-SD 4.01Å; F379-M383 VanDerWaalsContact O-CG 3.32Å; F379-M383 WeakPolarHBondContact O-CG 3.31Å; F379-M383 PolarHBondContact O-N 3Å; K380-M383 PolarHBondContact O-N 3.11Å; M383-N385 PolarHBondContact O-N 3.33Å; M383-V386 PolarHBondContact O-N 2.89Å; M383-V387 WeakPolarHBondContact O-CG2 3.33Å; M383-V387 PolarHBondContact O-N 2.6Å; M383-M401 HydrophobicContact CB-SD 3.63Å; M383-F405 HydrophobicContact CB-CE2 4.41Å; M383-F405 HydrophobicContact CG-CE2 4.25Å; M383-F405 HydrophobicContact CG-CZ 4.38Å
384	D	93.9	Very high	94.1	Very high	53 Å²	53	44.4 Å²	44.4	28%	0.283	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-44.9	173.9	-78.9	-24.8	0	0	0	111.7	K380 D381 V386 V387 Q388 M401	K380-D384 IonicContact NZ-OD1 3.18Å; K380-D384 PolarHBondContact NZ-OD1 2.94Å; K380-D384 IonicContact NZ-OD2 3.67Å; K380-D384 PolarHBondContact NZ-OD2 2.67Å; K380-D384 WeakPolarHBondContact O-CB 3.3Å; K380-D384 PolarHBondContact O-N 2.98Å; D381-D384 PolarHBondContact O-N 3.24Å; D384-V386 PolarHBondContact O-N 2.65Å; D384-V387 PolarHBondContact O-N 3.48Å; D384-Q388 VanDerWaalsContact O-CB 3.27Å; D384-Q388 WeakPolarHBondContact O-CB 3.32Å; D384-Q388 PolarHBondContact O-N 2.87Å; D384-M401 WeakPolarHBondContact OD1-CE 3.11Å
385	N	94.4	Very high	94.1	Very high	61 Å²	61	46.9 Å²	46.9	33%	0.326	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-41.2	177.6	-177.8	35.9	0	0	0	111.9	D381 K382 M383 V387 Q388 S389	D381-N385 WeakPolarHBondContact O-CB 3.45Å; D381-N385 PolarHBondContact O-N 3.28Å; K382-N385 PolarHBondContact O-N 3.12Å; M383-N385 PolarHBondContact O-N 3.33Å; N385-V387 PolarHBondContact O-N 3.29Å; N385-Q388 PolarHBondContact O-N 3.22Å; N385-S389 WeakPolarHBondContact O-CB 3.48Å; N385-S389 PolarHBondContact O-N 3.48Å; N385-S389 PolarHBondContact O-OG 3.41Å; N385-S389 PolarHBondContact OD1-OG 3.39Å
386	V	94.8	Very high	94.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-46.3	175.5	171.7	0	0	0	0	110.6	L322 L330 W351 K382 M383 D384 Q388 C390 F391	L322-V386 HydrophobicContact CD2-CG1 4.2Å; L322-V386 HydrophobicContact CD2-CG2 4.49Å; L330-V386 HydrophobicContact CD1-CG1 4.27Å; L330-V386 HydrophobicContact CD1-CG2 4.25Å; W351-V386 HydrophobicContact CH2-CB 4.12Å; W351-V386 HydrophobicContact CH2-CG1 3.93Å; W351-V386 HydrophobicContact CZ3-CB 4.43Å; W351-V386 HydrophobicContact CZ3-CG1 3.86Å; K382-V386 WeakPolarHBondContact O-CG2 3.49Å; K382-V386 PolarHBondContact O-N 3.43Å; M383-V386 PolarHBondContact O-N 2.89Å; D384-V386 PolarHBondContact O-N 2.65Å; V386-Q388 VanDerWaalsContact C-N 3.34Å; V386-Q388 PolarHBondContact O-N 3.07Å; V386-C390 HydrophobicContact CG1-CB 4.24Å; V386-C390 WeakPolarHBondContact O-CA 3.46Å; V386-C390 WeakPolarHBondContact O-CB 3.49Å; V386-C390 PolarHBondContact O-N 3.28Å; V386-F391 HydrophobicContact CG1-CD2 4.37Å; V386-F391 HydrophobicContact CG1-CE1 4.38Å; V386-F391 HydrophobicContact CG1-CE2 3.87Å; V386-F391 HydrophobicContact CG1-CZ 3.88Å; V386-F391 PolarHBondContact O-N 3.43Å
387	V	94.4	Very high	94.1	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	25%	0.247	C	C	.	.	H	α-helix	trans	-66.4	-37.9	179.2	177.9	0	0	0	0	111.8	W351 M383 D384 N385 F391 R393 F397 I398 M401	W351-V387 HydrophobicContact CH2-CG2 4.08Å; W351-V387 HydrophobicContact CZ2-CG2 3.5Å; W351-V387 VanDerWaalsContact CZ2-CG2 3.5Å; M383-V387 WeakPolarHBondContact O-CG2 3.33Å; M383-V387 PolarHBondContact O-N 2.6Å; D384-V387 PolarHBondContact O-N 3.48Å; N385-V387 PolarHBondContact O-N 3.29Å; V387-F391 HydrophobicContact CG2-CD2 4.13Å; V387-F391 CarbonylContact O-C 3.59Å; V387-F391 PolarHBondContact O-N 2.93Å; V387-R393 PolarHBondContact O-N 2.96Å; V387-R393 VanDerWaalsContact O-N 3.09Å; V387-F397 HydrophobicContact CG1-CB 4.33Å; V387-F397 HydrophobicContact CG2-CB 4.38Å; V387-I398 HydrophobicContact CG1-CD1 4.32Å; V387-I398 HydrophobicContact CG1-CG1 3.53Å; V387-M401 HydrophobicContact CG2-SD 4.45Å
388	Q	93.2	Very high	94.2	Very high	105 Å²	105	47.2 Å²	47.2	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-71.6	-43.9	-179.2	-170.2	175.7	17.7	0	0	112.7	D384 N385 V386 R393	D384-Q388 VanDerWaalsContact O-CB 3.27Å; D384-Q388 WeakPolarHBondContact O-CB 3.32Å; D384-Q388 PolarHBondContact O-N 2.87Å; N385-Q388 PolarHBondContact O-N 3.22Å; V386-Q388 VanDerWaalsContact C-N 3.34Å; V386-Q388 PolarHBondContact O-N 3.07Å; Q388-R393 HydrophobicContact CG-CG 4.33Å; Q388-R393 VanDerWaalsContact NE2-NH2 3.19Å
389	S	91.9	Very high	94.2	Very high	66 Å²	66	47.3 Å²	47.3	46%	0.462	25%	0.252	S	S	.	.	H	α-helix	trans	-94.4	-36.7	-171.9	-61	0	0	0	0	113.2	N385	N385-S389 WeakPolarHBondContact O-CB 3.48Å; N385-S389 PolarHBondContact O-N 3.48Å; N385-S389 PolarHBondContact O-OG 3.41Å; N385-S389 PolarHBondContact OD1-OG 3.39Å
390	C	93.6	Very high	94.2	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.041	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-40.9	-174.9	-49	0	0	0	0	112.8	V327 L330 A331 V386	V327-C390 PolarHBondContact O-SG 3.46Å; L330-C390 HydrophobicContact CB-CB 3.95Å; A331-C390 HydrophobicContact CB-CB 4.34Å; V386-C390 HydrophobicContact CG1-CB 4.24Å; V386-C390 WeakPolarHBondContact O-CA 3.46Å; V386-C390 WeakPolarHBondContact O-CB 3.49Å; V386-C390 PolarHBondContact O-N 3.28Å
391	F	93.7	Very high	94.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-99.9	20.1	-172	-55.9	-21.1	0	0	0	113.6	Y334 W351 V386 V387 R393 N394 F397	Y334-F391 HydrophobicContact CD2-CB 4.01Å; Y334-F391 AromaticContact CD2-CD1 3.56Å; Y334-F391 HydrophobicContact CD2-CD1 3.56Å; Y334-F391 HydrophobicContact CD2-CE1 4.3Å; Y334-F391 AromaticContact CD2-CG 3.97Å; Y334-F391 HydrophobicContact CD2-CG 3.97Å; Y334-F391 HydrophobicContact CE2-CB 4.02Å; Y334-F391 HydrophobicContact CE2-CD1 4.41Å; Y334-F391 HydrophobicContact CE2-CG 4.4Å; Y334-F391 HydrophobicContact CG-CB 4.38Å; Y334-F391 AromaticContact CG-CD1 3.68Å; Y334-F391 HydrophobicContact CG-CD1 3.68Å; Y334-F391 HydrophobicContact CG-CE1 4.45Å; Y334-F391 HydrophobicContact CG-CG 4.38Å; W351-F391 HydrophobicContact CD2-CE2 4.01Å; W351-F391 AromaticContact CE3-CE2 3.81Å; W351-F391 HydrophobicContact CE3-CE2 3.81Å; W351-F391 HydrophobicContact CE3-CZ 4.3Å; W351-F391 HydrophobicContact CH2-CE2 4.25Å; W351-F391 HydrophobicContact CZ2-CE2 4.42Å; W351-F391 AromaticContact CZ3-CE2 3.94Å; W351-F391 HydrophobicContact CZ3-CE2 3.94Å; W351-F391 HydrophobicContact CZ3-CZ 4.45Å; V386-F391 HydrophobicContact CG1-CD2 4.37Å; V386-F391 HydrophobicContact CG1-CE1 4.38Å; V386-F391 HydrophobicContact CG1-CE2 3.87Å; V386-F391 HydrophobicContact CG1-CZ 3.88Å; V386-F391 PolarHBondContact O-N 3.43Å; V387-F391 HydrophobicContact CG2-CD2 4.13Å; V387-F391 CarbonylContact O-C 3.59Å; V387-F391 PolarHBondContact O-N 2.93Å; F391-R393 PolarHBondContact O-N 3.21Å; F391-N394 VanDerWaalsContact O-CB 3.29Å; F391-N394 WeakPolarHBondContact O-CB 3.41Å; F391-N394 PolarHBondContact O-N 2.9Å; F391-F397 HydrophobicContact CD2-CB 4.19Å; F391-F397 AromaticContact CD2-CD1 3.45Å; F391-F397 HydrophobicContact CD2-CD1 3.45Å; F391-F397 VanDerWaalsContact CD2-CD1 3.45Å; F391-F397 AromaticContact CD2-CE1 3.94Å; F391-F397 HydrophobicContact CD2-CE1 3.94Å; F391-F397 AromaticContact CD2-CG 3.83Å; F391-F397 HydrophobicContact CD2-CG 3.83Å; F391-F397 AromaticContact CE2-CD1 3.61Å; F391-F397 HydrophobicContact CE2-CD1 3.61Å; F391-F397 AromaticContact CE2-CE1 3.84Å; F391-F397 HydrophobicContact CE2-CE1 3.84Å; F391-F397 HydrophobicContact CE2-CG 4.44Å; F391-F397 HydrophobicContact CG-CD1 4.34Å; F391-F397 HydrophobicContact CG-CG 4.48Å; F391-F397 HydrophobicContact CZ-CE1 4.43Å
392	A	91.3	Very high	94.2	Very high	79 Å²	79	48.3 Å²	48.3	65%	0.653	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	33.6	176	0	0	0	0	0	114.4	Y334 N394	Y334-A392 HydrophobicContact CE1-CB 4.2Å; A392-N394 VanDerWaalsContact C-N 3.29Å; A392-N394 PolarHBondContact O-N 3.19Å
393	R	92.8	Very high	94.2	Very high	163 Å²	163	50 Å²	50	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	37.5	-176.9	-54.4	178.7	-176.7	-167.9	-0.3	113.7	V387 Q388 F391 E395	V387-R393 PolarHBondContact O-N 2.96Å; V387-R393 VanDerWaalsContact O-N 3.09Å; Q388-R393 HydrophobicContact CG-CG 4.33Å; Q388-R393 VanDerWaalsContact NE2-NH2 3.19Å; F391-R393 PolarHBondContact O-N 3.21Å; R393-E395 PolarHBondContact O-N 3.25Å
394	N	93.3	Very high	94.3	Very high	44 Å²	44	50 Å²	50	24%	0.235	26%	0.263	C	S	.	.			trans	-64.5	117.9	177.4	-172.4	-34.2	0	0	0	111.7	Y334 F391 A392 A396 F397 I398	Y334-N394 PolarHBondContact OH-ND2 3.4Å; F391-N394 VanDerWaalsContact O-CB 3.29Å; F391-N394 WeakPolarHBondContact O-CB 3.41Å; F391-N394 PolarHBondContact O-N 2.9Å; A392-N394 VanDerWaalsContact C-N 3.29Å; A392-N394 PolarHBondContact O-N 3.19Å; N394-A396 PolarHBondContact O-N 3.45Å; N394-A396 WeakPolarHBondContact OD1-CB 3.44Å; N394-A396 PolarHBondContact OD1-N 2.92Å; N394-F397 HydrophobicContact CB-CD2 3.93Å; N394-F397 PolarHBondContact O-N 2.89Å; N394-I398 PolarHBondContact O-N 3.09Å
395	E	94.6	Very high	94.4	Very high	119 Å²	119	47.5 Å²	47.5	56%	0.556	25%	0.249	S	C	*	.	H	α-helix	trans	-56.5	-32.5	-178.9	-71.9	-62.8	150.8	0	0	113.6	R393 F397 I398 N399	R393-E395 PolarHBondContact O-N 3.25Å; E395-F397 VanDerWaalsContact C-N 3.31Å; E395-F397 PolarHBondContact O-N 2.9Å; E395-I398 PolarHBondContact O-N 2.67Å; E395-N399 WeakPolarHBondContact O-CB 3.32Å; E395-N399 VanDerWaalsContact O-CG 3.24Å; E395-N399 PolarHBondContact O-N 2.64Å; E395-N399 PolarHBondContact O-ND2 3Å
396	A	95.1	Very high	94.4	Very high	43 Å²	43	48.5 Å²	48.5	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-40	177.6	0	0	0	0	0	111.6	L348 N394 A400	L348-A396 HydrophobicContact CD2-CB 4.4Å; N394-A396 PolarHBondContact O-N 3.45Å; N394-A396 WeakPolarHBondContact OD1-CB 3.44Å; N394-A396 PolarHBondContact OD1-N 2.92Å; A396-A400 WeakPolarHBondContact O-CB 3.41Å; A396-A400 PolarHBondContact O-N 3.37Å
397	F	95.6	Very high	94.4	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-71.9	-37.4	177.3	-77.1	-96	0	0	0	112.1	Y334 L347 L348 W351 V387 F391 N394 E395 M401	Y334-F397 HydrophobicContact CD2-CE2 4.44Å; Y334-F397 HydrophobicContact CE2-CD2 4.41Å; Y334-F397 AromaticContact CE2-CE2 3.88Å; Y334-F397 HydrophobicContact CE2-CE2 3.88Å; Y334-F397 HydrophobicContact CE2-CZ 4.38Å; L347-F397 HydrophobicContact CB-CZ 4.34Å; L347-F397 HydrophobicContact CD2-CE1 4.27Å; L347-F397 HydrophobicContact CD2-CZ 3.91Å; L347-F397 HydrophobicContact CG-CE1 3.93Å; L347-F397 HydrophobicContact CG-CZ 3.84Å; L348-F397 HydrophobicContact CB-CE1 4.43Å; L348-F397 HydrophobicContact CB-CZ 4.22Å; L348-F397 HydrophobicContact CD1-CB 4.27Å; L348-F397 HydrophobicContact CD1-CD1 3.66Å; L348-F397 HydrophobicContact CD1-CD2 3.82Å; L348-F397 HydrophobicContact CD1-CE1 3.82Å; L348-F397 HydrophobicContact CD1-CE2 3.98Å; L348-F397 HydrophobicContact CD1-CG 3.66Å; L348-F397 HydrophobicContact CD1-CZ 3.98Å; W351-F397 HydrophobicContact CB-CD1 4.36Å; W351-F397 HydrophobicContact CB-CE1 4.16Å; W351-F397 AromaticContact CD1-CD1 3.72Å; W351-F397 HydrophobicContact CD2-CD1 4.33Å; W351-F397 AromaticContact CG-CD1 3.9Å; W351-F397 HydrophobicContact CG-CD1 3.9Å; W351-F397 HydrophobicContact CG-CE1 4.18Å; V387-F397 HydrophobicContact CG1-CB 4.33Å; V387-F397 HydrophobicContact CG2-CB 4.38Å; F391-F397 HydrophobicContact CD2-CB 4.19Å; F391-F397 AromaticContact CD2-CD1 3.45Å; F391-F397 HydrophobicContact CD2-CD1 3.45Å; F391-F397 VanDerWaalsContact CD2-CD1 3.45Å; F391-F397 AromaticContact CD2-CE1 3.94Å; F391-F397 HydrophobicContact CD2-CE1 3.94Å; F391-F397 AromaticContact CD2-CG 3.83Å; F391-F397 HydrophobicContact CD2-CG 3.83Å; F391-F397 AromaticContact CE2-CD1 3.61Å; F391-F397 HydrophobicContact CE2-CD1 3.61Å; F391-F397 AromaticContact CE2-CE1 3.84Å; F391-F397 HydrophobicContact CE2-CE1 3.84Å; F391-F397 HydrophobicContact CE2-CG 4.44Å; F391-F397 HydrophobicContact CG-CD1 4.34Å; F391-F397 HydrophobicContact CG-CG 4.48Å; F391-F397 HydrophobicContact CZ-CE1 4.43Å; N394-F397 HydrophobicContact CB-CD2 3.93Å; N394-F397 PolarHBondContact O-N 2.89Å; E395-F397 VanDerWaalsContact C-N 3.31Å; E395-F397 PolarHBondContact O-N 2.9Å; F397-M401 VanDerWaalsContact O-CB 3.28Å; F397-M401 WeakPolarHBondContact O-CB 3.44Å; F397-M401 PolarHBondContact O-N 3.4Å
398	I	95.1	Very high	94.4	Very high	34 Å²	34	51.8 Å²	51.8	17%	0.174	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-47.8	174	-62.9	173.5	0	0	0	110.2	V387 N394 E395 M401 K402	V387-I398 HydrophobicContact CG1-CD1 4.32Å; V387-I398 HydrophobicContact CG1-CG1 3.53Å; N394-I398 PolarHBondContact O-N 3.09Å; E395-I398 PolarHBondContact O-N 2.67Å; I398-M401 PolarHBondContact O-N 2.8Å; I398-K402 HydrophobicContact CG2-CD 4.25Å; I398-K402 WeakPolarHBondContact O-CG 3.47Å; I398-K402 PolarHBondContact O-N 3.33Å
399	N	95.1	Very high	94.5	Very high	83 Å²	83	46.8 Å²	46.8	44%	0.444	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-42.2	-179.9	-68.8	-27.5	0	0	0	111.8	E395 M401 K402 E403	E395-N399 WeakPolarHBondContact O-CB 3.32Å; E395-N399 VanDerWaalsContact O-CG 3.24Å; E395-N399 PolarHBondContact O-N 2.64Å; E395-N399 PolarHBondContact O-ND2 3Å; N399-M401 VanDerWaalsContact C-N 3.32Å; N399-M401 PolarHBondContact O-N 2.9Å; N399-K402 PolarHBondContact O-N 3.33Å; N399-E403 WeakPolarHBondContact O-CB 3.47Å; N399-E403 PolarHBondContact O-N 3.08Å
400	A	95.9	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.3	-42.5	173.2	0	0	0	0	0	112.9	L348 R352 A396 A404	L348-A400 HydrophobicContact CD1-CB 3.58Å; L348-A400 HydrophobicContact CG-CB 4.1Å; R352-A400 HydrophobicContact CG-CB 3.67Å; A396-A400 WeakPolarHBondContact O-CB 3.41Å; A396-A400 PolarHBondContact O-N 3.37Å; A400-A404 VanDerWaalsContact O-CB 3.24Å; A400-A404 WeakPolarHBondContact O-CB 3.03Å; A400-A404 PolarHBondContact O-N 2.98Å
401	M	96.1	Very high	94.4	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.02	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-47.5	175.6	175.5	-179	65.3	0	0	111	W351 I355 M383 D384 V387 F397 I398 N399 E403 A404 F405	W351-M401 HydrophobicContact CZ2-SD 4.4Å; I355-M401 HydrophobicContact CD1-CB 4.05Å; I355-M401 HydrophobicContact CD1-CG 4.01Å; M383-M401 HydrophobicContact CB-SD 3.63Å; D384-M401 WeakPolarHBondContact OD1-CE 3.11Å; V387-M401 HydrophobicContact CG2-SD 4.45Å; F397-M401 VanDerWaalsContact O-CB 3.28Å; F397-M401 WeakPolarHBondContact O-CB 3.44Å; F397-M401 PolarHBondContact O-N 3.4Å; I398-M401 PolarHBondContact O-N 2.8Å; N399-M401 VanDerWaalsContact C-N 3.32Å; N399-M401 PolarHBondContact O-N 2.9Å; M401-E403 VanDerWaalsContact C-N 3.33Å; M401-E403 PolarHBondContact O-N 3.18Å; M401-A404 PolarHBondContact O-N 3.49Å; M401-F405 HydrophobicContact CG-CD2 3.61Å; M401-F405 HydrophobicContact CG-CE2 3.68Å; M401-F405 WeakPolarHBondContact O-CB 3.14Å; M401-F405 VanDerWaalsContact O-CD2 3.3Å; M401-F405 WeakPolarHBondContact O-CD2 3.2Å; M401-F405 PolarHBondContact O-N 3.35Å; M401-F405 HydrophobicContact SD-CE2 4.34Å
402	K	94.4	Very high	94.2	Very high	98 Å²	98	54.1 Å²	54.1	43%	0.426	27%	0.272	S	S	.	.	H	α-helix	trans	-55.7	-48	176.6	-72.5	170.4	-177.6	168	0	111.6	I398 N399 F405 E406 F453	I398-K402 HydrophobicContact CG2-CD 4.25Å; I398-K402 WeakPolarHBondContact O-CG 3.47Å; I398-K402 PolarHBondContact O-N 3.33Å; N399-K402 PolarHBondContact O-N 3.33Å; K402-F405 PolarHBondContact O-N 2.77Å; K402-E406 WeakPolarHBondContact O-CB 3.4Å; K402-E406 PolarHBondContact O-N 3.31Å; K402-F453 HydrophobicContact CB-CE1 4.08Å; K402-F453 HydrophobicContact CG-CE1 4.15Å; K402-F453 HydrophobicContact CG-CZ 4.32Å
403	E	94.9	Very high	94	Very high	85 Å²	85	54.8 Å²	54.8	40%	0.397	27%	0.27	S	S	.	.	H	α-helix	trans	-61.4	-44	177.1	-171.6	-164.4	148.1	0	0	111.7	R352 N399 M401 E406 T407	R352-E403 IonicContact CZ-OE2 2.81Å; R352-E403 IonicContact NH1-OE1 3.82Å; R352-E403 IonicContact NH1-OE2 3.73Å; R352-E403 PolarHBondContact NH1-OE2 3.44Å; R352-E403 VanDerWaalsContact NH1-OE2 3.1Å; R352-E403 IonicContact NH2-OE2 3.38Å; R352-E403 PolarHBondContact NH2-OE2 3.43Å; N399-E403 WeakPolarHBondContact O-CB 3.47Å; N399-E403 PolarHBondContact O-N 3.08Å; M401-E403 VanDerWaalsContact C-N 3.33Å; M401-E403 PolarHBondContact O-N 3.18Å; E403-E406 PolarHBondContact O-N 3.47Å; E403-T407 WeakPolarHBondContact O-CB 3.31Å; E403-T407 PolarHBondContact O-N 3.08Å; E403-T407 PolarHBondContact O-OG1 2.97Å
404	A	96.5	Very high	93.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-65.1	-45.1	178.3	0	0	0	0	0	112.2	I355 K356 A400 M401 T407 F408	I355-A404 HydrophobicContact CB-CB 4.01Å; I355-A404 HydrophobicContact CG2-CB 3.62Å; K356-A404 HydrophobicContact CG-CB 3.98Å; A400-A404 VanDerWaalsContact O-CB 3.24Å; A400-A404 WeakPolarHBondContact O-CB 3.03Å; A400-A404 PolarHBondContact O-N 2.98Å; M401-A404 PolarHBondContact O-N 3.49Å; A404-T407 WeakPolarHBondContact O-CB 3.34Å; A404-T407 PolarHBondContact O-N 3.43Å; A404-T407 VanDerWaalsContact O-N 3.15Å; A404-F408 WeakPolarHBondContact O-CD1 3.32Å; A404-F408 PolarHBondContact O-N 3.02Å
405	F	96.3	Very high	93.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.9	-46.4	175.3	-92	-99.8	0	0	0	112.1	I355 F379 K380 M383 M401 K402 T407 F408 I409 F453	I355-F405 HydrophobicContact CG2-CD2 3.71Å; I355-F405 HydrophobicContact CG2-CE2 3.72Å; F379-F405 HydrophobicContact CD1-CE1 4.01Å; F379-F405 HydrophobicContact CD1-CE2 4.42Å; F379-F405 AromaticContact CD1-CZ 3.56Å; F379-F405 HydrophobicContact CD1-CZ 3.56Å; F379-F405 HydrophobicContact CE1-CE1 4.41Å; F379-F405 HydrophobicContact CE1-CE2 4.15Å; F379-F405 AromaticContact CE1-CZ 3.73Å; F379-F405 HydrophobicContact CE1-CZ 3.73Å; F379-F405 HydrophobicContact CG-CZ 4.39Å; K380-F405 HydrophobicContact CB-CE1 3.87Å; K380-F405 HydrophobicContact CB-CZ 4.04Å; K380-F405 HydrophobicContact CD-CD1 4.12Å; K380-F405 HydrophobicContact CD-CD2 4.42Å; K380-F405 HydrophobicContact CD-CE1 3.72Å; K380-F405 HydrophobicContact CD-CE2 4.04Å; K380-F405 HydrophobicContact CD-CG 4.47Å; K380-F405 HydrophobicContact CD-CZ 3.67Å; K380-F405 HydrophobicContact CG-CE1 4.33Å; K380-F405 HydrophobicContact CG-CZ 4.48Å; M383-F405 HydrophobicContact CB-CE2 4.41Å; M383-F405 HydrophobicContact CG-CE2 4.25Å; M383-F405 HydrophobicContact CG-CZ 4.38Å; M401-F405 HydrophobicContact CG-CD2 3.61Å; M401-F405 HydrophobicContact CG-CE2 3.68Å; M401-F405 WeakPolarHBondContact O-CB 3.14Å; M401-F405 VanDerWaalsContact O-CD2 3.3Å; M401-F405 WeakPolarHBondContact O-CD2 3.2Å; M401-F405 PolarHBondContact O-N 3.35Å; M401-F405 HydrophobicContact SD-CE2 4.34Å; K402-F405 PolarHBondContact O-N 2.77Å; F405-T407 VanDerWaalsContact C-N 3.32Å; F405-T407 PolarHBondContact O-N 2.95Å; F405-F408 VanDerWaalsContact CA-CE1 3.41Å; F405-F408 HydrophobicContact CB-CE1 4.09Å; F405-F408 AromaticContact CD1-CE1 3.74Å; F405-F408 HydrophobicContact CD1-CE1 3.74Å; F405-F408 AromaticContact CD1-CZ 3.54Å; F405-F408 HydrophobicContact CD1-CZ 3.54Å; F405-F408 AromaticContact CD2-CE1 3.96Å; F405-F408 HydrophobicContact CD2-CE1 3.96Å; F405-F408 HydrophobicContact CE1-CE1 4.1Å; F405-F408 AromaticContact CE1-CZ 3.75Å; F405-F408 HydrophobicContact CE1-CZ 3.75Å; F405-F408 HydrophobicContact CE2-CE1 4.32Å; F405-F408 AromaticContact CG-CE1 3.67Å; F405-F408 HydrophobicContact CG-CE1 3.67Å; F405-F408 AromaticContact CG-CZ 3.98Å; F405-F408 HydrophobicContact CG-CZ 3.98Å; F405-F408 HydrophobicContact CZ-CE1 4.37Å; F405-F408 HydrophobicContact CZ-CZ 4.35Å; F405-I409 HydrophobicContact CD1-CD1 4.23Å; F405-I409 VanDerWaalsContact O-CB 3.3Å; F405-I409 WeakPolarHBondContact O-CB 3.31Å; F405-I409 WeakPolarHBondContact O-CD1 3.32Å; F405-I409 WeakPolarHBondContact O-CG1 3.38Å; F405-I409 PolarHBondContact O-N 3.21Å; F405-I409 VanDerWaalsContact O-N 3.13Å; F405-F453 HydrophobicContact CB-CD1 4.47Å; F405-F453 HydrophobicContact CB-CD2 3.92Å; F405-F453 HydrophobicContact CB-CE2 3.98Å; F405-F453 HydrophobicContact CB-CG 4.2Å; F405-F453 HydrophobicContact CB-CZ 4.3Å; F405-F453 HydrophobicContact CD1-CD2 4.41Å; F405-F453 HydrophobicContact CD1-CE2 4.35Å; F405-F453 HydrophobicContact CG-CE2 4.36Å
406	E	94.4	Very high	93.5	Very high	83 Å²	83	43.7 Å²	43.7	39%	0.388	23%	0.225	S	C	.	.	H	α-helix	trans	-61.3	-41.2	173.7	-172.8	175.5	174.4	0	0	111.9	K402 E403 N410 F453 H455	K402-E406 WeakPolarHBondContact O-CB 3.4Å; K402-E406 PolarHBondContact O-N 3.31Å; E403-E406 PolarHBondContact O-N 3.47Å; E406-N410 WeakPolarHBondContact O-CB 3.22Å; E406-N410 PolarHBondContact O-N 2.74Å; E406-N410 PolarHBondContact O-ND2 3.26Å; E406-F453 HydrophobicContact CB-CB 4.41Å; E406-F453 HydrophobicContact CB-CD1 4.32Å; E406-H455 IonicContact OE1-CD2 3.77Å; E406-H455 IonicContact OE1-CE1 2.68Å; E406-H455 IonicContact OE1-NE2 3.91Å; E406-H455 PolarHBondContact OE1-NE2 2.93Å
407	T	93.8	Very high	93.4	Very high	69 Å²	69	41.7 Å²	41.7	42%	0.423	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-51.5	-179	-55.7	0	0	0	0	112.2	K356 E403 A404 F405 K411	K356-T407 HydrophobicContact CD-CG2 4.39Å; E403-T407 WeakPolarHBondContact O-CB 3.31Å; E403-T407 PolarHBondContact O-N 3.08Å; E403-T407 PolarHBondContact O-OG1 2.97Å; A404-T407 WeakPolarHBondContact O-CB 3.34Å; A404-T407 PolarHBondContact O-N 3.43Å; A404-T407 VanDerWaalsContact O-N 3.15Å; F405-T407 VanDerWaalsContact C-N 3.32Å; F405-T407 PolarHBondContact O-N 2.95Å; T407-K411 PolarHBondContact O-N 3.42Å
408	F	95.2	Very high	93.3	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-76.3	-37	-172.7	79.1	-110.4	0	0	0	112.2	I355 G359 V363 L376 F379 A404 F405 N410 K411	I355-F408 HydrophobicContact CG2-CD1 4.04Å; I355-F408 HydrophobicContact CG2-CE1 3.72Å; G359-F408 VanDerWaalsContact O-CD2 3.25Å; G359-F408 WeakPolarHBondContact O-CD2 3.46Å; G359-F408 WeakPolarHBondContact O-CE2 3.18Å; V363-F408 HydrophobicContact CG1-CD2 4.33Å; V363-F408 HydrophobicContact CG1-CE2 4.26Å; V363-F408 HydrophobicContact CG2-CD2 4.22Å; V363-F408 WeakPolarHBondContact CG2-O 3.43Å; L376-F408 HydrophobicContact CD2-CE2 3.6Å; L376-F408 HydrophobicContact CD2-CZ 4Å; F379-F408 HydrophobicContact CD1-CZ 4.4Å; F379-F408 HydrophobicContact CE1-CE1 4.27Å; F379-F408 HydrophobicContact CE1-CZ 4.3Å; A404-F408 WeakPolarHBondContact O-CD1 3.32Å; A404-F408 PolarHBondContact O-N 3.02Å; F405-F408 VanDerWaalsContact CA-CE1 3.41Å; F405-F408 HydrophobicContact CB-CE1 4.09Å; F405-F408 AromaticContact CD1-CE1 3.74Å; F405-F408 HydrophobicContact CD1-CE1 3.74Å; F405-F408 AromaticContact CD1-CZ 3.54Å; F405-F408 HydrophobicContact CD1-CZ 3.54Å; F405-F408 AromaticContact CD2-CE1 3.96Å; F405-F408 HydrophobicContact CD2-CE1 3.96Å; F405-F408 HydrophobicContact CE1-CE1 4.1Å; F405-F408 AromaticContact CE1-CZ 3.75Å; F405-F408 HydrophobicContact CE1-CZ 3.75Å; F405-F408 HydrophobicContact CE2-CE1 4.32Å; F405-F408 AromaticContact CG-CE1 3.67Å; F405-F408 HydrophobicContact CG-CE1 3.67Å; F405-F408 AromaticContact CG-CZ 3.98Å; F405-F408 HydrophobicContact CG-CZ 3.98Å; F405-F408 HydrophobicContact CZ-CE1 4.37Å; F405-F408 HydrophobicContact CZ-CZ 4.35Å; F408-N410 VanDerWaalsContact C-N 3.26Å; F408-N410 PolarHBondContact O-N 3.01Å; F408-K411 WeakPolarHBondContact O-CB 3.05Å; F408-K411 PolarHBondContact O-N 3.03Å; F408-K411 VanDerWaalsContact O-N 3.1Å
409	I	95	Very high	93.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-43.4	178.2	-70.5	172.2	0	0	0	109.6	L376 F405 K411 P416 I450 F453 I454	L376-I409 HydrophobicContact CD2-CG1 4.45Å; F405-I409 HydrophobicContact CD1-CD1 4.23Å; F405-I409 VanDerWaalsContact O-CB 3.3Å; F405-I409 WeakPolarHBondContact O-CB 3.31Å; F405-I409 WeakPolarHBondContact O-CD1 3.32Å; F405-I409 WeakPolarHBondContact O-CG1 3.38Å; F405-I409 PolarHBondContact O-N 3.21Å; F405-I409 VanDerWaalsContact O-N 3.13Å; I409-K411 VanDerWaalsContact C-N 3.26Å; I409-K411 PolarHBondContact O-N 3.34Å; I409-P416 HydrophobicContact CG2-CB 3.91Å; I409-P416 HydrophobicContact CG2-CG 4.3Å; I409-P416 WeakPolarHBondContact O-CG 3.42Å; I409-I450 HydrophobicContact CD1-CG2 4.1Å; I409-F453 HydrophobicContact CD1-CB 3.91Å; I409-F453 HydrophobicContact CD1-CD2 4.19Å; I409-F453 HydrophobicContact CD1-CG 4.48Å; I409-I454 HydrophobicContact CG2-CG1 4.2Å
410	N	92	Very high	93.2	Very high	39 Å²	39	37.5 Å²	37.5	21%	0.209	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.1	-178.4	-63.4	-57.9	0	0	0	114.1	E406 F408 R412 F453 H455	E406-N410 WeakPolarHBondContact O-CB 3.22Å; E406-N410 PolarHBondContact O-N 2.74Å; E406-N410 PolarHBondContact O-ND2 3.26Å; F408-N410 VanDerWaalsContact C-N 3.26Å; F408-N410 PolarHBondContact O-N 3.01Å; N410-R412 PolarHBondContact O-N 3.06Å; N410-F453 PolarHBondContact ND2-O 3.28Å; N410-H455 VanDerWaalsContact CG-CG 3.41Å; N410-H455 PolarHBondContact ND2-CD2 2.96Å; N410-H455 VanDerWaalsContact ND2-CD2 3.28Å; N410-H455 PolarHBondContact ND2-NE2 3.38Å; N410-H455 WeakPolarHBondContact OD1-CB 3.28Å; N410-H455 PolarHBondContact OD1-N 2.91Å
411	K	91	Very high	93.1	Very high	150 Å²	150	37.5 Å²	37.5	65%	0.652	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.3	170.5	-167.9	178.4	179.4	-176.5	0	111.4	T407 F408 I409 P413	T407-K411 PolarHBondContact O-N 3.42Å; F408-K411 WeakPolarHBondContact O-CB 3.05Å; F408-K411 PolarHBondContact O-N 3.03Å; F408-K411 VanDerWaalsContact O-N 3.1Å; I409-K411 VanDerWaalsContact C-N 3.26Å; I409-K411 PolarHBondContact O-N 3.34Å; K411-P413 WeakPolarHBondContact O-CD 3.46Å
412	R	89.9	Confident	92.9	Very high	36 Å²	36	39.7 Å²	39.7	14%	0.136	20%	0.195	C	C	.	.	S	Bend	trans	-98	111.3	172.2	-173.1	169.1	178	-146.9	6.1	110.6	V363 D369 N410 K415 P416	V363-R412 WeakPolarHBondContact O-CD 3.49Å; V363-R412 PolarHBondContact O-NH1 2.89Å; D369-R412 IonicContact OD1-CZ 2.83Å; D369-R412 IonicContact OD1-NH1 2.87Å; D369-R412 PolarHBondContact OD1-NH1 3.32Å; D369-R412 IonicContact OD1-NH2 3.59Å; D369-R412 PolarHBondContact OD1-NH2 3.33Å; D369-R412 IonicContact OD2-CZ 3.56Å; D369-R412 IonicContact OD2-NH1 3.06Å; D369-R412 IonicContact OD2-NH2 2.81Å; D369-R412 PolarHBondContact OD2-NH2 3.35Å; N410-R412 PolarHBondContact O-N 3.06Å; R412-K415 HydrophobicContact CG-CB 4.21Å; R412-K415 VanDerWaalsContact CZ-CB 3.47Å; R412-P416 HydrophobicContact CB-CG 4.26Å; R412-P416 WeakPolarHBondContact O-CD 3.3Å
413	P	86.1	Confident	92.8	Very high	93 Å²	93	36.7 Å²	36.7	60%	0.604	18%	0.181	S	C	*	.			trans	-67.6	136.3	-177.1	-20.9	33.3	0	0	0	112.6	K411 K415	K411-P413 WeakPolarHBondContact O-CD 3.46Å; P413-K415 PolarHBondContact O-N 3.06Å
414	N	86.2	Confident	92.7	Very high	37 Å²	37	32.7 Å²	32.7	20%	0.198	16%	0.162	C	C	.	.	S	Bend	trans	62.1	-34.3	168	-48.3	-53.4	0	0	0	117.3	A417 E418 V459 F700 R703	N414-A417 WeakPolarHBondContact O-CB 3.28Å; N414-A417 PolarHBondContact O-N 2.91Å; N414-E418 PolarHBondContact O-N 3.2Å; N414-E418 VanDerWaalsContact O-N 3.1Å; N414-V459 HydrophobicContact CB-CG1 4.3Å; N414-V459 HydrophobicContact CB-CG2 4.01Å; N414-F700 WeakPolarHBondContact ND2-CZ 3.31Å; N414-R703 PolarHBondContact OD1-NH1 2.92Å; N414-R703 PolarHBondContact OD1-NH2 3.47Å
415	K	90.8	Very high	92.4	Very high	54 Å²	54	33.2 Å²	33.2	24%	0.235	17%	0.165	C	C	.	.	H	α-helix	trans	-62.7	-41.6	-177.4	-85.4	-64	-175.9	-160.2	0	115	R412 P413 A417 E418 L419	R412-K415 HydrophobicContact CG-CB 4.21Å; R412-K415 VanDerWaalsContact CZ-CB 3.47Å; P413-K415 PolarHBondContact O-N 3.06Å; K415-A417 VanDerWaalsContact C-N 3.27Å; K415-A417 PolarHBondContact O-N 2.64Å; K415-E418 WeakPolarHBondContact CD-OE2 3.33Å; K415-E418 WeakPolarHBondContact CE-OE2 3.5Å; K415-E418 IonicContact NZ-OE1 3.66Å; K415-E418 PolarHBondContact NZ-OE1 2.98Å; K415-E418 IonicContact NZ-OE2 3.72Å; K415-E418 PolarHBondContact NZ-OE2 3.44Å; K415-E418 PolarHBondContact O-N 2.94Å; K415-L419 WeakPolarHBondContact O-CB 3.35Å; K415-L419 WeakPolarHBondContact O-CG 3.43Å; K415-L419 PolarHBondContact O-N 3.23Å
416	P	93.6	Very high	92	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.019	19%	0.189	C	C	.	.	H	α-helix	trans	-54.4	-43.6	171.8	-28.3	36.6	0	0	0	113	M372 I409 R412 I420	M372-P416 HydrophobicContact CE-CB 4.46Å; I409-P416 HydrophobicContact CG2-CB 3.91Å; I409-P416 HydrophobicContact CG2-CG 4.3Å; I409-P416 WeakPolarHBondContact O-CG 3.42Å; R412-P416 HydrophobicContact CB-CG 4.26Å; R412-P416 WeakPolarHBondContact O-CD 3.3Å; P416-I420 WeakPolarHBondContact O-CB 2.99Å; P416-I420 WeakPolarHBondContact O-CD1 3.34Å; P416-I420 WeakPolarHBondContact O-CG1 3.39Å; P416-I420 PolarHBondContact O-N 3.3Å
417	A	93.6	Very high	91.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-64.4	-44.5	178.6	0	0	0	0	0	112.5	N414 K415 A421 I454 G456 V459 F460	N414-A417 WeakPolarHBondContact O-CB 3.28Å; N414-A417 PolarHBondContact O-N 2.91Å; K415-A417 VanDerWaalsContact C-N 3.27Å; K415-A417 PolarHBondContact O-N 2.64Å; A417-A421 PolarHBondContact O-N 2.87Å; A417-A421 VanDerWaalsContact O-N 3.12Å; A417-I454 HydrophobicContact CB-CG2 3.79Å; A417-G456 VanDerWaalsContact CB-O 3.23Å; A417-G456 WeakPolarHBondContact CB-O 3.11Å; A417-V459 HydrophobicContact CB-CB 3.99Å; A417-V459 HydrophobicContact CB-CG1 4.12Å; A417-F460 HydrophobicContact CB-CB 4.21Å
418	E	93	Very high	91.4	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.028	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-50.2	177	178.8	-168.4	147.1	0	0	112	N414 K415 I420 A421 K422 V459 F463 Q692	N414-E418 PolarHBondContact O-N 3.2Å; N414-E418 VanDerWaalsContact O-N 3.1Å; K415-E418 WeakPolarHBondContact CD-OE2 3.33Å; K415-E418 WeakPolarHBondContact CE-OE2 3.5Å; K415-E418 IonicContact NZ-OE1 3.66Å; K415-E418 PolarHBondContact NZ-OE1 2.98Å; K415-E418 IonicContact NZ-OE2 3.72Å; K415-E418 PolarHBondContact NZ-OE2 3.44Å; K415-E418 PolarHBondContact O-N 2.94Å; E418-I420 VanDerWaalsContact C-N 3.29Å; E418-I420 PolarHBondContact O-N 3.34Å; E418-A421 WeakPolarHBondContact O-CB 3.4Å; E418-A421 PolarHBondContact O-N 3.49Å; E418-A421 VanDerWaalsContact O-N 3.17Å; E418-K422 HydrophobicContact CG-CD 4.23Å; E418-K422 WeakPolarHBondContact O-CG 3.41Å; E418-K422 PolarHBondContact O-N 2.94Å; E418-K422 WeakPolarHBondContact OE1-CE 3.15Å; E418-K422 IonicContact OE1-NZ 3.28Å; E418-K422 PolarHBondContact OE1-NZ 3.46Å; E418-V459 HydrophobicContact CB-CG1 4.34Å; E418-F463 HydrophobicContact CB-CD2 3.94Å; E418-F463 HydrophobicContact CB-CE2 3.91Å; E418-F463 HydrophobicContact CB-CZ 4.44Å; E418-F463 HydrophobicContact CG-CD1 4.01Å; E418-F463 HydrophobicContact CG-CD2 3.76Å; E418-F463 HydrophobicContact CG-CE1 3.88Å; E418-F463 HydrophobicContact CG-CE2 3.64Å; E418-F463 HydrophobicContact CG-CG 3.96Å; E418-F463 HydrophobicContact CG-CZ 3.7Å; E418-Q692 PolarHBondContact OE1-NE2 3.43Å
419	L	93.8	Very high	91	Very high	24 Å²	24	34.1 Å²	34.1	13%	0.126	17%	0.169	C	C	.	.	H	α-helix	trans	-66.5	-34.2	-176.6	-69.9	173.9	0	0	0	111.3	D369 M372 V373 K415 K422 Y423	D369-L419 HydrophobicContact CB-CD1 3.99Å; M372-L419 HydrophobicContact CE-CB 3.57Å; M372-L419 HydrophobicContact CE-CD1 3.28Å; M372-L419 HydrophobicContact CE-CG 4.01Å; M372-L419 HydrophobicContact SD-CD1 3.76Å; V373-L419 HydrophobicContact CG2-CB 3.94Å; K415-L419 WeakPolarHBondContact O-CB 3.35Å; K415-L419 WeakPolarHBondContact O-CG 3.43Å; K415-L419 PolarHBondContact O-N 3.23Å; L419-K422 PolarHBondContact O-N 3.29Å; L419-Y423 VanDerWaalsContact O-CB 3.29Å; L419-Y423 WeakPolarHBondContact O-CB 3.46Å; L419-Y423 PolarHBondContact O-N 3.06Å
420	I	95.1	Very high	89.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-41.7	172.9	-72.8	169.1	0	0	0	111.2	V373 P416 E418 K422 Y423 V424 I447 I450 I454 F460	V373-I420 HydrophobicContact CG1-CG1 4.07Å; V373-I420 HydrophobicContact CG2-CG1 3.84Å; P416-I420 WeakPolarHBondContact O-CB 2.99Å; P416-I420 WeakPolarHBondContact O-CD1 3.34Å; P416-I420 WeakPolarHBondContact O-CG1 3.39Å; P416-I420 PolarHBondContact O-N 3.3Å; E418-I420 VanDerWaalsContact C-N 3.29Å; E418-I420 PolarHBondContact O-N 3.34Å; I420-K422 PolarHBondContact O-N 3.49Å; I420-Y423 PolarHBondContact O-N 3.41Å; I420-V424 VanDerWaalsContact O-CG2 3.31Å; I420-V424 WeakPolarHBondContact O-CG2 3.42Å; I420-V424 PolarHBondContact O-N 3.29Å; I420-I447 HydrophobicContact CG2-CG2 3.78Å; I420-I450 HydrophobicContact CD1-CG2 3.81Å; I420-I454 HydrophobicContact CB-CD1 4.49Å; I420-I454 HydrophobicContact CD1-CD1 3.35Å; I420-I454 HydrophobicContact CD1-CG1 4.29Å; I420-I454 HydrophobicContact CG1-CD1 4.46Å; I420-F460 HydrophobicContact CG2-CD2 4.1Å; I420-F460 HydrophobicContact CG2-CE2 3.96Å
421	A	93.9	Very high	87.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-44.9	174	0	0	0	0	0	111.9	A417 E418 V424 D425 F460 F463	A417-A421 PolarHBondContact O-N 2.87Å; A417-A421 VanDerWaalsContact O-N 3.12Å; E418-A421 WeakPolarHBondContact O-CB 3.4Å; E418-A421 PolarHBondContact O-N 3.49Å; E418-A421 VanDerWaalsContact O-N 3.17Å; A421-V424 PolarHBondContact O-N 3.04Å; A421-D425 PolarHBondContact O-N 3.48Å; A421-F460 HydrophobicContact CB-CD2 3.64Å; A421-F460 HydrophobicContact CB-CE2 3.89Å; A421-F460 HydrophobicContact CB-CG 4.33Å; A421-F463 HydrophobicContact CB-CB 3.79Å
422	K	91.6	Very high	86.4	Confident	50 Å²	50	33.9 Å²	33.9	22%	0.217	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-37.7	177.1	-72.1	178.8	172.8	-179	0	112.8	E418 L419 I420 D425 S426 E687	E418-K422 HydrophobicContact CG-CD 4.23Å; E418-K422 WeakPolarHBondContact O-CG 3.41Å; E418-K422 PolarHBondContact O-N 2.94Å; E418-K422 WeakPolarHBondContact OE1-CE 3.15Å; E418-K422 IonicContact OE1-NZ 3.28Å; E418-K422 PolarHBondContact OE1-NZ 3.46Å; L419-K422 PolarHBondContact O-N 3.29Å; I420-K422 PolarHBondContact O-N 3.49Å; K422-D425 PolarHBondContact O-N 2.87Å; K422-S426 PolarHBondContact O-N 3.42Å; K422-E687 WeakPolarHBondContact CE-OE2 3.29Å; K422-E687 IonicContact NZ-OE2 2.8Å; K422-E687 PolarHBondContact NZ-OE2 2.77Å
423	Y	92.4	Very high	84.7	Confident	36 Å²	36	41.6 Å²	41.6	14%	0.141	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-45.4	176.4	-172	-90.9	0	0	0	110.7	V373 Q374 L377 L419 I420 D425 S426 K427 I447	V373-Y423 HydrophobicContact CB-CD2 3.87Å; V373-Y423 HydrophobicContact CB-CE2 4.42Å; V373-Y423 HydrophobicContact CB-CG 3.96Å; V373-Y423 HydrophobicContact CG1-CD1 3.75Å; V373-Y423 HydrophobicContact CG1-CD2 3.92Å; V373-Y423 HydrophobicContact CG1-CE1 4.25Å; V373-Y423 HydrophobicContact CG1-CE2 4.38Å; V373-Y423 HydrophobicContact CG1-CG 3.57Å; Q374-Y423 PolarHBondContact OE1-OH 2.87Å; L377-Y423 HydrophobicContact CD1-CE1 4.1Å; L419-Y423 VanDerWaalsContact O-CB 3.29Å; L419-Y423 WeakPolarHBondContact O-CB 3.46Å; L419-Y423 PolarHBondContact O-N 3.06Å; I420-Y423 PolarHBondContact O-N 3.41Å; Y423-D425 PolarHBondContact O-N 3.09Å; Y423-S426 WeakPolarHBondContact O-CB 3.4Å; Y423-S426 PolarHBondContact O-N 2.95Å; Y423-K427 HydrophobicContact CD1-CG 4.24Å; Y423-K427 HydrophobicContact CE1-CD 4.41Å; Y423-K427 VanDerWaalsContact CE1-CE 3.49Å; Y423-K427 HydrophobicContact CE1-CG 3.97Å; Y423-K427 WeakPolarHBondContact O-CG 3.35Å; Y423-K427 PolarHBondContact O-N 2.97Å; Y423-K427 WeakPolarHBondContact OH-CE 3.3Å; Y423-K427 PolarHBondContact OH-NZ 2.96Å; Y423-I447 HydrophobicContact CD1-CD1 3.72Å; Y423-I447 HydrophobicContact CD1-CG1 4.36Å; Y423-I447 HydrophobicContact CE1-CD1 3.81Å; Y423-I447 HydrophobicContact CE1-CG1 4.37Å
424	V	92.4	Very high	83.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-44	174.1	176.1	0	0	0	0	111.3	I420 A421 S426 K427 L428 L444 I447 Y464 M486	I420-V424 VanDerWaalsContact O-CG2 3.31Å; I420-V424 WeakPolarHBondContact O-CG2 3.42Å; I420-V424 PolarHBondContact O-N 3.29Å; A421-V424 PolarHBondContact O-N 3.04Å; V424-S426 VanDerWaalsContact C-N 3.33Å; V424-S426 PolarHBondContact O-N 3.21Å; V424-K427 PolarHBondContact O-N 3.32Å; V424-K427 VanDerWaalsContact O-N 3.16Å; V424-L428 HydrophobicContact CG1-CD1 3.64Å; V424-L428 HydrophobicContact CG1-CG 4.3Å; V424-L428 WeakPolarHBondContact O-CG 3.23Å; V424-L428 PolarHBondContact O-N 3.21Å; V424-L444 HydrophobicContact CG1-CD2 4.34Å; V424-I447 HydrophobicContact CG2-CD1 3.97Å; V424-I447 HydrophobicContact CG2-CG2 3.78Å; V424-Y464 HydrophobicContact CG1-CD2 4.31Å; V424-Y464 HydrophobicContact CG1-CE2 3.74Å; V424-M486 HydrophobicContact CG1-CE 4.18Å; V424-M486 HydrophobicContact CG1-CG 4.41Å; V424-M486 HydrophobicContact CG1-SD 4.38Å; V424-M486 HydrophobicContact CG2-CE 4.32Å
425	D	89.9	Confident	82.3	Confident	13 Å²	13	45.9 Å²	45.9	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-44.6	174.6	173.2	63.8	0	0	0	112	A421 K422 Y423 K427 L428 R429 D467 R471	A421-D425 PolarHBondContact O-N 3.48Å; K422-D425 PolarHBondContact O-N 2.87Å; Y423-D425 PolarHBondContact O-N 3.09Å; D425-K427 VanDerWaalsContact C-N 3.3Å; D425-K427 PolarHBondContact O-N 3.19Å; D425-L428 PolarHBondContact O-N 3.05Å; D425-R429 VanDerWaalsContact CG-NE 3.32Å; D425-R429 VanDerWaalsContact O-CG 3.32Å; D425-R429 WeakPolarHBondContact O-CG 2.93Å; D425-R429 PolarHBondContact O-N 2.9Å; D425-R429 IonicContact OD1-CZ 3.29Å; D425-R429 IonicContact OD1-NE 3.02Å; D425-R429 PolarHBondContact OD1-NE 3.34Å; D425-R429 IonicContact OD1-NH2 2.76Å; D425-R429 IonicContact OD2-CZ 3.46Å; D425-R429 IonicContact OD2-NE 3.09Å; D425-R429 PolarHBondContact OD2-NE 3.41Å; D425-R429 IonicContact OD2-NH2 2.94Å; D425-R429 PolarHBondContact OD2-NH2 3.05Å; D425-D467 HydrophobicContact CB-CB 3.95Å; D425-R471 VanDerWaalsContact OD1-CD 3.32Å; D425-R471 WeakPolarHBondContact OD1-CD 3.43Å; D425-R471 IonicContact OD1-CZ 3.12Å; D425-R471 IonicContact OD1-NE 3.06Å; D425-R471 IonicContact OD1-NH1 2.66Å; D425-R471 PolarHBondContact OD1-NH1 2.92Å
426	S	88.6	Confident	81.9	Confident	70 Å²	70	47 Å²	47	49%	0.49	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-38.7	176.8	-170.7	0	0	0	0	112.4	K422 Y423 V424	K422-S426 PolarHBondContact O-N 3.42Å; Y423-S426 WeakPolarHBondContact O-CB 3.4Å; Y423-S426 PolarHBondContact O-N 2.95Å; V424-S426 VanDerWaalsContact C-N 3.33Å; V424-S426 PolarHBondContact O-N 3.21Å
427	K	87.8	Confident	81.4	Confident	46 Å²	46	53.7 Å²	53.7	20%	0.2	29%	0.293	C	S	.	.	H	α-helix	trans	-72.7	-29.9	179.5	-64.2	-61.2	-178.3	177.2	0	113.2	Y423 V424 D425 N432 L440	Y423-K427 HydrophobicContact CD1-CG 4.24Å; Y423-K427 HydrophobicContact CE1-CD 4.41Å; Y423-K427 VanDerWaalsContact CE1-CE 3.49Å; Y423-K427 HydrophobicContact CE1-CG 3.97Å; Y423-K427 WeakPolarHBondContact O-CG 3.35Å; Y423-K427 PolarHBondContact O-N 2.97Å; Y423-K427 WeakPolarHBondContact OH-CE 3.3Å; Y423-K427 PolarHBondContact OH-NZ 2.96Å; V424-K427 PolarHBondContact O-N 3.32Å; V424-K427 VanDerWaalsContact O-N 3.16Å; D425-K427 VanDerWaalsContact C-N 3.3Å; D425-K427 PolarHBondContact O-N 3.19Å; K427-N432 PolarHBondContact O-ND2 2.94Å; K427-L440 HydrophobicContact CB-CD1 4.1Å
428	L	87.9	Confident	81.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-89.9	0.6	-178.6	-68.2	173.4	0	0	0	114.5	V424 D425 L440 L444 S477 A478 A482 M486	V424-L428 HydrophobicContact CG1-CD1 3.64Å; V424-L428 HydrophobicContact CG1-CG 4.3Å; V424-L428 WeakPolarHBondContact O-CG 3.23Å; V424-L428 PolarHBondContact O-N 3.21Å; D425-L428 PolarHBondContact O-N 3.05Å; L428-L440 HydrophobicContact CD2-CD2 4.38Å; L428-L444 HydrophobicContact CD2-CD1 4.49Å; L428-S477 CarbonylContact O-C 3.5Å; L428-A478 WeakPolarHBondContact O-CB 3.48Å; L428-A478 PolarHBondContact O-N 3.05Å; L428-A482 HydrophobicContact CD2-CB 4.04Å; L428-M486 HydrophobicContact CD1-CG 4.5Å
429	R	85.6	Confident	80.8	Confident	59 Å²	59	64.2 Å²	64.2	22%	0.223	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-82.3	143.1	177.4	-79.9	172	-174.6	-124.9	4.3	112.5	D425 G431 N432 R471 K476	D425-R429 VanDerWaalsContact CG-NE 3.32Å; D425-R429 VanDerWaalsContact O-CG 3.32Å; D425-R429 WeakPolarHBondContact O-CG 2.93Å; D425-R429 PolarHBondContact O-N 2.9Å; D425-R429 IonicContact OD1-CZ 3.29Å; D425-R429 IonicContact OD1-NE 3.02Å; D425-R429 PolarHBondContact OD1-NE 3.34Å; D425-R429 IonicContact OD1-NH2 2.76Å; D425-R429 IonicContact OD2-CZ 3.46Å; D425-R429 IonicContact OD2-NE 3.09Å; D425-R429 PolarHBondContact OD2-NE 3.41Å; D425-R429 IonicContact OD2-NH2 2.94Å; D425-R429 PolarHBondContact OD2-NH2 3.05Å; R429-G431 PolarHBondContact O-N 3.47Å; R429-N432 PolarHBondContact O-N 2.95Å; R429-N432 VanDerWaalsContact O-N 3.14Å; R429-R471 HydrophobicContact CG-CG 4.44Å; R429-K476 CarbonylContact C-O 3.53Å; R429-K476 WeakPolarHBondContact CA-O 3.28Å
430	A	61.5	Low	80.5	Confident	58 Å²	58	63.9 Å²	63.9	48%	0.479	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	4	-177	0	0	0	0	0	116.9	K476	A430-K476 WeakPolarHBondContact CB-O 3.06Å; A430-K476 PolarHBondContact N-O 3.48Å
431	G	58.6	Low	80.2	Confident	68 Å²	68	66.8 Å²	66.8	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-8.6	175	0	0	0	0	0	114.3	R429 K433	R429-G431 PolarHBondContact O-N 3.47Å; G431-K433 PolarHBondContact O-N 3.05Å
432	N	61.2	Low	80	Confident	58 Å²	58	74.3 Å²	74.3	31%	0.31	38%	0.382	S	S	.	.			trans	-84	63.5	-174.6	-137.8	26.2	0	0	0	110.8	K427 R429 E434	K427-N432 PolarHBondContact O-ND2 2.94Å; R429-N432 PolarHBondContact O-N 2.95Å; R429-N432 VanDerWaalsContact O-N 3.14Å; N432-E434 PolarHBondContact O-N 3.07Å
433	K	55.8	Low	80	Confident	197 Å²	197	74.1 Å²	74.1	86%	0.857	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-1.3	-176.2	-73.4	-172.3	176.3	-174.1	0	114.7	G431	G431-K433 PolarHBondContact O-N 3.05Å
434	E	55.5	Low	79.9	Confident	184 Å²	184	72.4 Å²	72.4	86%	0.86	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-16.1	-174	-66.4	179.8	174.9	0	0	113.7	N432	N432-E434 PolarHBondContact O-N 3.07Å
435	A	65.8	Low	79.9	Confident	36 Å²	36	75.8 Å²	75.8	30%	0.298	40%	0.395	S	S	.	.	S	Bend	trans	-106.8	130.8	-178.5	0	0	0	0	0	111.4	E439	A435-E439 HydrophobicContact CB-CB 4.48Å
436	T	83.2	Confident	80.1	Confident	78 Å²	78	79.2 Å²	79.2	48%	0.479	41%	0.409	S	S	.	.			trans	-67	160.4	166.8	58.3	0	0	0	0	110.8	E438 E439 L440	T436-E438 PolarHBondContact O-N 2.7Å; T436-E439 PolarHBondContact N-OE2 3.17Å; T436-E439 PolarHBondContact O-N 2.72Å; T436-E439 WeakPolarHBondContact OG1-CB 3.33Å; T436-E439 VanDerWaalsContact OG1-CG 3.22Å; T436-E439 WeakPolarHBondContact OG1-CG 3.41Å; T436-E439 PolarHBondContact OG1-N 3.42Å; T436-E439 PolarHBondContact OG1-OE2 3.49Å; T436-L440 WeakPolarHBondContact O-CB 3.47Å; T436-L440 PolarHBondContact O-N 3.25Å
437	E	82.3	Confident	80.3	Confident	144 Å²	144	76 Å²	76	67%	0.673	39%	0.386	S	S	*	.	H	α-helix	trans	-58.6	-35.7	176.2	-67.9	-172.2	155	0	0	112	L440 E441	E437-L440 PolarHBondContact O-N 3.3Å; E437-E441 WeakPolarHBondContact O-CB 3.45Å; E437-E441 PolarHBondContact O-N 2.97Å
438	E	87	Confident	80.6	Confident	138 Å²	138	74 Å²	74	65%	0.645	38%	0.378	S	S	*	.	H	α-helix	trans	-66.4	-43.3	176.4	-66	-174.1	-172.9	0	0	112.7	T436 L440 E441 R442	T436-E438 PolarHBondContact O-N 2.7Å; E438-L440 VanDerWaalsContact C-N 3.35Å; E438-E441 PolarHBondContact O-N 3.4Å; E438-R442 WeakPolarHBondContact O-CG 3.47Å; E438-R442 PolarHBondContact O-N 3.37Å; E438-R442 IonicContact OE2-NH2 3.64Å
439	E	86.6	Confident	80.9	Confident	90 Å²	90	76.6 Å²	76.6	42%	0.421	39%	0.391	S	S	.	.	H	α-helix	trans	-66.5	-40.4	176.6	-73.2	163.2	154.8	0	0	111.2	A435 T436 E441 R442 I443	A435-E439 HydrophobicContact CB-CB 4.48Å; T436-E439 PolarHBondContact N-OE2 3.17Å; T436-E439 PolarHBondContact O-N 2.72Å; T436-E439 WeakPolarHBondContact OG1-CB 3.33Å; T436-E439 VanDerWaalsContact OG1-CG 3.22Å; T436-E439 WeakPolarHBondContact OG1-CG 3.41Å; T436-E439 PolarHBondContact OG1-N 3.42Å; T436-E439 PolarHBondContact OG1-OE2 3.49Å; E439-E441 VanDerWaalsContact C-N 3.33Å; E439-E441 PolarHBondContact O-N 3.22Å; E439-R442 PolarHBondContact O-N 3.49Å; E439-I443 VanDerWaalsContact O-CG1 3.26Å; E439-I443 WeakPolarHBondContact O-CG1 3.26Å; E439-I443 PolarHBondContact O-N 2.91Å
440	L	87	Confident	81.3	Confident	16 Å²	16	74 Å²	74	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-59.3	-46.8	175.1	-178.5	61.2	0	0	0	110.6	K427 L428 T436 E437 E438 R442 I443 L444 A482	K427-L440 HydrophobicContact CB-CD1 4.1Å; L428-L440 HydrophobicContact CD2-CD2 4.38Å; T436-L440 WeakPolarHBondContact O-CB 3.47Å; T436-L440 PolarHBondContact O-N 3.25Å; E437-L440 PolarHBondContact O-N 3.3Å; E438-L440 VanDerWaalsContact C-N 3.35Å; L440-R442 PolarHBondContact O-N 2.88Å; L440-I443 PolarHBondContact O-N 2.57Å; L440-L444 HydrophobicContact CG-CD1 4.47Å; L440-L444 WeakPolarHBondContact O-CG 3.47Å; L440-L444 PolarHBondContact O-N 2.96Å; L440-A482 HydrophobicContact CD2-CB 3.9Å
441	E	89.8	Confident	82.8	Confident	61 Å²	61	71.3 Å²	71.3	29%	0.285	36%	0.359	S	S	.	.	H	α-helix	trans	-60.8	-43.8	178.4	-170.8	67.8	-173.5	0	0	111.9	E437 E438 E439 I443 L444 D445 S485 K489	E437-E441 WeakPolarHBondContact O-CB 3.45Å; E437-E441 PolarHBondContact O-N 2.97Å; E438-E441 PolarHBondContact O-N 3.4Å; E439-E441 VanDerWaalsContact C-N 3.33Å; E439-E441 PolarHBondContact O-N 3.22Å; E441-I443 VanDerWaalsContact C-N 3.33Å; E441-I443 PolarHBondContact O-N 3.02Å; E441-L444 PolarHBondContact O-N 2.93Å; E441-D445 PolarHBondContact O-N 3.46Å; E441-S485 PolarHBondContact OE1-OG 2.92Å; E441-S485 PolarHBondContact OE2-OG 2.99Å; E441-K489 WeakPolarHBondContact OE1-CE 3.39Å; E441-K489 IonicContact OE1-NZ 2.66Å; E441-K489 PolarHBondContact OE1-NZ 2.65Å
442	R	90.6	Very high	84.4	Confident	158 Å²	158	73.8 Å²	73.8	60%	0.596	35%	0.347	S	S	*	.	H	α-helix	trans	-61.3	-40.5	174.9	-70.5	177.1	-167.4	170	9.5	112.3	E438 E439 L440 D445 K446	E438-R442 WeakPolarHBondContact O-CG 3.47Å; E438-R442 PolarHBondContact O-N 3.37Å; E438-R442 IonicContact OE2-NH2 3.64Å; E439-R442 PolarHBondContact O-N 3.49Å; L440-R442 PolarHBondContact O-N 2.88Å; R442-D445 PolarHBondContact O-N 2.9Å; R442-K446 WeakPolarHBondContact O-CG 3.17Å; R442-K446 PolarHBondContact O-N 2.81Å
443	I	89.7	Confident	85.9	Confident	46 Å²	46	71.9 Å²	71.9	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-44.1	176.4	-70.3	165.6	0	0	0	110.1	E439 L440 E441 D445 K446 I447	E439-I443 VanDerWaalsContact O-CG1 3.26Å; E439-I443 WeakPolarHBondContact O-CG1 3.26Å; E439-I443 PolarHBondContact O-N 2.91Å; L440-I443 PolarHBondContact O-N 2.57Å; E441-I443 VanDerWaalsContact C-N 3.33Å; E441-I443 PolarHBondContact O-N 3.02Å; I443-D445 VanDerWaalsContact C-N 3.34Å; I443-D445 PolarHBondContact O-N 3.02Å; I443-K446 PolarHBondContact O-N 3.47Å; I443-I447 HydrophobicContact CG2-CD1 3.79Å; I443-I447 HydrophobicContact CG2-CG1 4.43Å; I443-I447 VanDerWaalsContact O-CG1 3.28Å; I443-I447 WeakPolarHBondContact O-CG1 3.45Å; I443-I447 PolarHBondContact O-N 2.98Å
444	L	91.5	Very high	87.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-42.5	176.9	-66.3	-179.4	0	0	0	111.3	V424 L428 L440 E441 K446 I447 M448 M486 K489	V424-L444 HydrophobicContact CG1-CD2 4.34Å; L428-L444 HydrophobicContact CD2-CD1 4.49Å; L440-L444 HydrophobicContact CG-CD1 4.47Å; L440-L444 WeakPolarHBondContact O-CG 3.47Å; L440-L444 PolarHBondContact O-N 2.96Å; E441-L444 PolarHBondContact O-N 2.93Å; L444-K446 PolarHBondContact O-N 3.36Å; L444-I447 PolarHBondContact O-N 2.99Å; L444-M448 VanDerWaalsContact O-CG 3.28Å; L444-M448 WeakPolarHBondContact O-CG 3.47Å; L444-M448 PolarHBondContact O-N 3.32Å; L444-M486 HydrophobicContact CB-SD 4.47Å; L444-M486 HydrophobicContact CD1-CB 4.46Å; L444-M486 HydrophobicContact CD1-SD 4.38Å; L444-M486 HydrophobicContact CD2-SD 3.88Å; L444-M486 HydrophobicContact CG-SD 4.46Å; L444-K489 HydrophobicContact CB-CD 4.43Å
445	D	93.1	Very high	89.2	Confident	72 Å²	72	57.2 Å²	57.2	39%	0.385	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-43.9	175.6	-79.1	-30.4	0	0	0	112.7	E441 R442 I443 I447 M448 I449 K489	E441-D445 PolarHBondContact O-N 3.46Å; R442-D445 PolarHBondContact O-N 2.9Å; I443-D445 VanDerWaalsContact C-N 3.34Å; I443-D445 PolarHBondContact O-N 3.02Å; D445-I447 PolarHBondContact O-N 3.43Å; D445-M448 PolarHBondContact O-N 3.48Å; D445-I449 WeakPolarHBondContact O-CG1 3.39Å; D445-I449 PolarHBondContact O-N 2.83Å; D445-I449 VanDerWaalsContact O-N 3.09Å; D445-K489 WeakPolarHBondContact OD1-CE 3.14Å; D445-K489 IonicContact OD1-NZ 2.93Å; D445-K489 PolarHBondContact OD1-NZ 3.03Å; D445-K489 IonicContact OD2-NZ 2.74Å
446	K	93.3	Very high	90	Very high	85 Å²	85	55.8 Å²	55.8	37%	0.37	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-42.4	175.9	-71	-175	176.1	-167	0	112.1	L377 D381 R442 I443 L444 M448 I449 I450	L377-K446 HydrophobicContact CD2-CB 3.89Å; D381-K446 VanDerWaalsContact CG-NZ 3.29Å; D381-K446 WeakPolarHBondContact OD1-CE 3.4Å; D381-K446 IonicContact OD1-NZ 3.92Å; D381-K446 PolarHBondContact OD1-NZ 3.41Å; D381-K446 IonicContact OD2-NZ 2.82Å; D381-K446 PolarHBondContact OD2-NZ 2.86Å; R442-K446 WeakPolarHBondContact O-CG 3.17Å; R442-K446 PolarHBondContact O-N 2.81Å; I443-K446 PolarHBondContact O-N 3.47Å; L444-K446 PolarHBondContact O-N 3.36Å; K446-M448 VanDerWaalsContact C-N 3.28Å; K446-M448 PolarHBondContact O-N 2.96Å; K446-I449 WeakPolarHBondContact O-CB 3.16Å; K446-I449 PolarHBondContact O-N 3.38Å; K446-I450 PolarHBondContact O-N 2.76Å
447	I	93.8	Very high	90.4	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-41.2	175.3	-66.8	164.1	0	0	0	110.4	L377 I420 Y423 V424 I443 L444 D445 I449 I450 F451	L377-I447 HydrophobicContact CD1-CG1 4.21Å; L377-I447 HydrophobicContact CD2-CG1 4.33Å; I420-I447 HydrophobicContact CG2-CG2 3.78Å; Y423-I447 HydrophobicContact CD1-CD1 3.72Å; Y423-I447 HydrophobicContact CD1-CG1 4.36Å; Y423-I447 HydrophobicContact CE1-CD1 3.81Å; Y423-I447 HydrophobicContact CE1-CG1 4.37Å; V424-I447 HydrophobicContact CG2-CD1 3.97Å; V424-I447 HydrophobicContact CG2-CG2 3.78Å; I443-I447 HydrophobicContact CG2-CD1 3.79Å; I443-I447 HydrophobicContact CG2-CG1 4.43Å; I443-I447 VanDerWaalsContact O-CG1 3.28Å; I443-I447 WeakPolarHBondContact O-CG1 3.45Å; I443-I447 PolarHBondContact O-N 2.98Å; L444-I447 PolarHBondContact O-N 2.99Å; D445-I447 PolarHBondContact O-N 3.43Å; I447-I449 VanDerWaalsContact C-N 3.28Å; I447-I449 PolarHBondContact O-N 3.49Å; I447-I450 PolarHBondContact O-N 2.99Å; I447-I450 VanDerWaalsContact O-N 3.13Å; I447-F451 WeakPolarHBondContact O-CB 3.2Å; I447-F451 PolarHBondContact O-N 3.32Å
448	M	94	Very high	90.7	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-33.7	178.8	-72	-53	-56	0	0	112.5	L444 D445 K446 F451 R452 M486 K489 L490 E493	L444-M448 VanDerWaalsContact O-CG 3.28Å; L444-M448 WeakPolarHBondContact O-CG 3.47Å; L444-M448 PolarHBondContact O-N 3.32Å; D445-M448 PolarHBondContact O-N 3.48Å; K446-M448 VanDerWaalsContact C-N 3.28Å; K446-M448 PolarHBondContact O-N 2.96Å; M448-F451 HydrophobicContact CE-CB 4.46Å; M448-F451 HydrophobicContact CE-CD1 3.53Å; M448-F451 HydrophobicContact CE-CE1 4.05Å; M448-F451 HydrophobicContact CE-CG 4.2Å; M448-F451 WeakPolarHBondContact O-CB 3.37Å; M448-F451 PolarHBondContact O-N 3.43Å; M448-F451 HydrophobicContact SD-CB 4.47Å; M448-F451 HydrophobicContact SD-CD1 4.38Å; M448-F451 HydrophobicContact SD-CG 4.5Å; M448-R452 WeakPolarHBondContact O-CG 3.42Å; M448-R452 PolarHBondContact O-N 3Å; M448-M486 HydrophobicContact SD-CE 3.52Å; M448-M486 VanDerWaalsContact SD-CE 3.52Å; M448-M486 HydrophobicContact SD-SD 4.35Å; M448-K489 HydrophobicContact CE-CB 4.45Å; M448-K489 HydrophobicContact CG-CB 4.03Å; M448-K489 HydrophobicContact CG-CD 4.09Å; M448-K489 HydrophobicContact SD-CB 4.37Å; M448-L490 HydrophobicContact CE-CD2 4.03Å; M448-L490 HydrophobicContact SD-CD2 4.08Å; M448-E493 HydrophobicContact CE-CB 4.01Å; M448-E493 HydrophobicContact CE-CG 3.59Å
449	I	92.7	Very high	90.9	Very high	53 Å²	53	42.3 Å²	42.3	27%	0.272	19%	0.191	S	C	.	.	H	α-helix	trans	-61.3	-46.3	172.4	-64.9	167.7	0	0	0	110.6	D445 K446 I447 R452 F453	D445-I449 WeakPolarHBondContact O-CG1 3.39Å; D445-I449 PolarHBondContact O-N 2.83Å; D445-I449 VanDerWaalsContact O-N 3.09Å; K446-I449 WeakPolarHBondContact O-CB 3.16Å; K446-I449 PolarHBondContact O-N 3.38Å; I447-I449 VanDerWaalsContact C-N 3.28Å; I447-I449 PolarHBondContact O-N 3.49Å; I449-R452 PolarHBondContact O-N 2.95Å; I449-F453 HydrophobicContact CG2-CE2 4.23Å; I449-F453 HydrophobicContact CG2-CZ 4.47Å
450	I	94.3	Very high	91.3	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-39.5	177	-57.3	-60	0	0	0	111.2	L377 K380 I409 I420 K446 I447 R452 F453	L377-I450 HydrophobicContact CD2-CG1 3.8Å; K380-I450 HydrophobicContact CB-CD1 3.83Å; K380-I450 HydrophobicContact CD-CD1 4.47Å; K380-I450 HydrophobicContact CG-CD1 3.87Å; I409-I450 HydrophobicContact CD1-CG2 4.1Å; I420-I450 HydrophobicContact CD1-CG2 3.81Å; K446-I450 PolarHBondContact O-N 2.76Å; I447-I450 PolarHBondContact O-N 2.99Å; I447-I450 VanDerWaalsContact O-N 3.13Å; I450-R452 PolarHBondContact O-N 3.36Å; I450-F453 HydrophobicContact CD1-CD2 4.45Å; I450-F453 HydrophobicContact CD1-CE2 4.43Å; I450-F453 WeakPolarHBondContact O-CB 3.29Å; I450-F453 PolarHBondContact O-N 3.02Å
451	F	93.9	Very high	91.5	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-58	-33.3	179	173.1	-96	0	0	0	112.9	I447 M448 F453 I454 K457 F460 L490 C494	I447-F451 WeakPolarHBondContact O-CB 3.2Å; I447-F451 PolarHBondContact O-N 3.32Å; M448-F451 HydrophobicContact CE-CB 4.46Å; M448-F451 HydrophobicContact CE-CD1 3.53Å; M448-F451 HydrophobicContact CE-CE1 4.05Å; M448-F451 HydrophobicContact CE-CG 4.2Å; M448-F451 WeakPolarHBondContact O-CB 3.37Å; M448-F451 PolarHBondContact O-N 3.43Å; M448-F451 HydrophobicContact SD-CB 4.47Å; M448-F451 HydrophobicContact SD-CD1 4.38Å; M448-F451 HydrophobicContact SD-CG 4.5Å; F451-F453 PolarHBondContact O-N 3.44Å; F451-I454 HydrophobicContact CD2-CD1 4.22Å; F451-I454 PolarHBondContact O-N 2.91Å; F451-I454 VanDerWaalsContact O-N 3.15Å; F451-K457 HydrophobicContact CE1-CD 3.99Å; F451-K457 HydrophobicContact CE1-CG 4.42Å; F451-K457 HydrophobicContact CE2-CB 4.4Å; F451-K457 HydrophobicContact CE2-CG 4.05Å; F451-K457 HydrophobicContact CZ-CB 4.15Å; F451-K457 HydrophobicContact CZ-CD 3.76Å; F451-K457 HydrophobicContact CZ-CG 3.77Å; F451-F460 HydrophobicContact CD2-CD1 4.31Å; F451-F460 HydrophobicContact CD2-CD2 4.18Å; F451-F460 HydrophobicContact CD2-CE2 4.43Å; F451-F460 HydrophobicContact CD2-CG 4.13Å; F451-F460 HydrophobicContact CE2-CB 4.04Å; F451-F460 AromaticContact CE2-CD1 3.56Å; F451-F460 HydrophobicContact CE2-CD1 3.56Å; F451-F460 HydrophobicContact CE2-CD2 4.15Å; F451-F460 HydrophobicContact CE2-CE1 4.04Å; F451-F460 AromaticContact CE2-CG 3.63Å; F451-F460 HydrophobicContact CE2-CG 3.63Å; F451-F460 HydrophobicContact CZ-CD1 4.27Å; F451-L490 HydrophobicContact CE1-CD2 4.25Å; F451-L490 HydrophobicContact CZ-CD2 4.13Å; F451-C494 WeakPolarHBondContact CE1-SG 3.27Å; F451-C494 VanDerWaalsContact CZ-SG 3.56Å
452	R	92.6	Very high	91.6	Very high	120 Å²	120	36.8 Å²	36.8	45%	0.453	17%	0.168	S	C	.	.	H	α-helix	trans	-57.3	-38.4	175.2	-68.7	-175.8	-158.3	131.2	8.7	112.4	M448 I449 I450 I454 K457 E493	M448-R452 WeakPolarHBondContact O-CG 3.42Å; M448-R452 PolarHBondContact O-N 3Å; I449-R452 PolarHBondContact O-N 2.95Å; I450-R452 PolarHBondContact O-N 3.36Å; R452-I454 PolarHBondContact O-N 3.18Å; R452-K457 PolarHBondContact O-NZ 3.49Å; R452-E493 WeakPolarHBondContact CD-OE2 3.44Å; R452-E493 VanDerWaalsContact CG-OE2 3.32Å; R452-E493 WeakPolarHBondContact CG-OE2 3.38Å; R452-E493 IonicContact CZ-OE1 3.25Å; R452-E493 VanDerWaalsContact CZ-OE1 3.28Å; R452-E493 VanDerWaalsContact NE-CD 3.26Å; R452-E493 IonicContact NE-OE1 3.66Å; R452-E493 PolarHBondContact NE-OE1 2.92Å; R452-E493 IonicContact NE-OE2 3.06Å; R452-E493 PolarHBondContact NE-OE2 3.48Å; R452-E493 VanDerWaalsContact NE-OE2 3.07Å; R452-E493 IonicContact NH2-OE1 3.24Å; R452-E493 PolarHBondContact NH2-OE1 3.33Å
453	F	92.6	Very high	91.7	Very high	18 Å²	18	29.2 Å²	29.2	8%	0.079	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-10.4	-177.9	-55.9	-48.1	0	0	0	113.8	K402 F405 E406 I409 N410 I449 I450 F451	K402-F453 HydrophobicContact CB-CE1 4.08Å; K402-F453 HydrophobicContact CG-CE1 4.15Å; K402-F453 HydrophobicContact CG-CZ 4.32Å; F405-F453 HydrophobicContact CB-CD1 4.47Å; F405-F453 HydrophobicContact CB-CD2 3.92Å; F405-F453 HydrophobicContact CB-CE2 3.98Å; F405-F453 HydrophobicContact CB-CG 4.2Å; F405-F453 HydrophobicContact CB-CZ 4.3Å; F405-F453 HydrophobicContact CD1-CD2 4.41Å; F405-F453 HydrophobicContact CD1-CE2 4.35Å; F405-F453 HydrophobicContact CG-CE2 4.36Å; E406-F453 HydrophobicContact CB-CB 4.41Å; E406-F453 HydrophobicContact CB-CD1 4.32Å; I409-F453 HydrophobicContact CD1-CB 3.91Å; I409-F453 HydrophobicContact CD1-CD2 4.19Å; I409-F453 HydrophobicContact CD1-CG 4.48Å; N410-F453 PolarHBondContact ND2-O 3.28Å; I449-F453 HydrophobicContact CG2-CE2 4.23Å; I449-F453 HydrophobicContact CG2-CZ 4.47Å; I450-F453 HydrophobicContact CD1-CD2 4.45Å; I450-F453 HydrophobicContact CD1-CE2 4.43Å; I450-F453 WeakPolarHBondContact O-CB 3.29Å; I450-F453 PolarHBondContact O-N 3.02Å; F451-F453 PolarHBondContact O-N 3.44Å
454	I	91.7	Very high	91.9	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.015	13%	0.128	C	C	.	.			trans	-85.1	133.5	-176.3	-57.7	170.2	0	0	0	110.9	I409 A417 I420 F451 R452 K457	I409-I454 HydrophobicContact CG2-CG1 4.2Å; A417-I454 HydrophobicContact CB-CG2 3.79Å; I420-I454 HydrophobicContact CB-CD1 4.49Å; I420-I454 HydrophobicContact CD1-CD1 3.35Å; I420-I454 HydrophobicContact CD1-CG1 4.29Å; I420-I454 HydrophobicContact CG1-CD1 4.46Å; F451-I454 HydrophobicContact CD2-CD1 4.22Å; F451-I454 PolarHBondContact O-N 2.91Å; F451-I454 VanDerWaalsContact O-N 3.15Å; R452-I454 PolarHBondContact O-N 3.18Å; I454-K457 PolarHBondContact O-NZ 3.34Å
455	H	87.1	Confident	91.9	Very high	70 Å²	70	28.6 Å²	28.6	32%	0.324	14%	0.135	S	C	.	.	S	Bend	trans	-79.6	-45.5	171.9	-65.9	172.9	0	0	0	112.3	E406 N410 K457 P737	E406-H455 IonicContact OE1-CD2 3.77Å; E406-H455 IonicContact OE1-CE1 2.68Å; E406-H455 IonicContact OE1-NE2 3.91Å; E406-H455 PolarHBondContact OE1-NE2 2.93Å; N410-H455 VanDerWaalsContact CG-CG 3.41Å; N410-H455 PolarHBondContact ND2-CD2 2.96Å; N410-H455 VanDerWaalsContact ND2-CD2 3.28Å; N410-H455 PolarHBondContact ND2-NE2 3.38Å; N410-H455 WeakPolarHBondContact OD1-CB 3.28Å; N410-H455 PolarHBondContact OD1-N 2.91Å; H455-K457 VanDerWaalsContact C-N 3.27Å; H455-K457 PolarHBondContact O-N 2.98Å; H455-P737 HydrophobicContact CB-CG 4Å
456	G	84	Confident	91.8	Very high	6 Å²	6	26.1 Å²	26.1	6%	0.062	12%	0.121	C	C	.	.			trans	-76.7	56.3	-177.3	0	0	0	0	0	115.7	A417 D458 V459 F460	A417-G456 VanDerWaalsContact CB-O 3.23Å; A417-G456 WeakPolarHBondContact CB-O 3.11Å; G456-D458 VanDerWaalsContact C-N 3.25Å; G456-D458 PolarHBondContact O-N 3.33Å; G456-V459 WeakPolarHBondContact O-CB 3.37Å; G456-V459 PolarHBondContact O-N 2.81Å; G456-F460 PolarHBondContact O-N 3.43Å
457	K	90.6	Very high	91.6	Very high	50 Å²	50	22.4 Å²	22.4	22%	0.217	11%	0.105	C	C	.	.	H	α-helix	trans	-66	-25.6	-177.5	-66.4	-176.5	170	72.6	0	113.6	F451 R452 I454 H455 F460 E461 F498	F451-K457 HydrophobicContact CE1-CD 3.99Å; F451-K457 HydrophobicContact CE1-CG 4.42Å; F451-K457 HydrophobicContact CE2-CB 4.4Å; F451-K457 HydrophobicContact CE2-CG 4.05Å; F451-K457 HydrophobicContact CZ-CB 4.15Å; F451-K457 HydrophobicContact CZ-CD 3.76Å; F451-K457 HydrophobicContact CZ-CG 3.77Å; R452-K457 PolarHBondContact O-NZ 3.49Å; I454-K457 PolarHBondContact O-NZ 3.34Å; H455-K457 VanDerWaalsContact C-N 3.27Å; H455-K457 PolarHBondContact O-N 2.98Å; K457-F460 WeakPolarHBondContact O-CB 3.5Å; K457-F460 PolarHBondContact O-N 3.45Å; K457-E461 PolarHBondContact O-N 3.09Å; K457-F498 HydrophobicContact CB-CE2 4.29Å
458	D	89	Confident	91.5	Very high	22 Å²	22	22.3 Å²	22.3	12%	0.118	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-35.2	173.3	60.8	-26	0	0	0	113	G456 E461 A462 R703	G456-D458 VanDerWaalsContact C-N 3.25Å; G456-D458 PolarHBondContact O-N 3.33Å; D458-E461 PolarHBondContact O-N 3.28Å; D458-A462 PolarHBondContact O-N 3.3Å; D458-R703 IonicContact OD1-CZ 3.74Å; D458-R703 IonicContact OD1-NE 2.72Å; D458-R703 IonicContact OD1-NH2 2.61Å; D458-R703 PolarHBondContact OD1-NH2 2.95Å; D458-R703 WeakPolarHBondContact OD2-CG 3.39Å; D458-R703 IonicContact OD2-CZ 3.89Å; D458-R703 IonicContact OD2-NE 2.74Å; D458-R703 PolarHBondContact OD2-NE 3.42Å; D458-R703 IonicContact OD2-NH2 2.71Å; D458-R703 PolarHBondContact OD2-NH2 3.06Å
459	V	92.1	Very high	91.3	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.03	10%	0.103	C	C	.	.	H	α-helix	trans	-63.4	-47.8	171.1	177.9	0	0	0	0	109.3	N414 A417 E418 G456 E461 A462 F463 V699 R703	N414-V459 HydrophobicContact CB-CG1 4.3Å; N414-V459 HydrophobicContact CB-CG2 4.01Å; A417-V459 HydrophobicContact CB-CB 3.99Å; A417-V459 HydrophobicContact CB-CG1 4.12Å; E418-V459 HydrophobicContact CB-CG1 4.34Å; G456-V459 WeakPolarHBondContact O-CB 3.37Å; G456-V459 PolarHBondContact O-N 2.81Å; V459-E461 VanDerWaalsContact C-N 3.33Å; V459-E461 PolarHBondContact O-N 2.82Å; V459-A462 PolarHBondContact O-N 3.38Å; V459-F463 HydrophobicContact CG1-CD2 3.74Å; V459-F463 HydrophobicContact CG1-CE2 3.73Å; V459-F463 VanDerWaalsContact O-CD2 3.28Å; V459-F463 WeakPolarHBondContact O-CD2 3.39Å; V459-F463 PolarHBondContact O-N 3.05Å; V459-F463 VanDerWaalsContact O-N 3.14Å; V459-V699 HydrophobicContact CG2-CG1 3.85Å; V459-R703 VanDerWaalsContact CG2-NH2 3.34Å
460	F	93.8	Very high	90.9	Very high	2 Å²	2	21 Å²	21	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-55.8	-48.2	174.5	172.3	-85.4	0	0	0	111	A417 I420 A421 F451 G456 K457 A462 F463 Y464 M486 L490 F498	A417-F460 HydrophobicContact CB-CB 4.21Å; I420-F460 HydrophobicContact CG2-CD2 4.1Å; I420-F460 HydrophobicContact CG2-CE2 3.96Å; A421-F460 HydrophobicContact CB-CD2 3.64Å; A421-F460 HydrophobicContact CB-CE2 3.89Å; A421-F460 HydrophobicContact CB-CG 4.33Å; F451-F460 HydrophobicContact CD2-CD1 4.31Å; F451-F460 HydrophobicContact CD2-CD2 4.18Å; F451-F460 HydrophobicContact CD2-CE2 4.43Å; F451-F460 HydrophobicContact CD2-CG 4.13Å; F451-F460 HydrophobicContact CE2-CB 4.04Å; F451-F460 AromaticContact CE2-CD1 3.56Å; F451-F460 HydrophobicContact CE2-CD1 3.56Å; F451-F460 HydrophobicContact CE2-CD2 4.15Å; F451-F460 HydrophobicContact CE2-CE1 4.04Å; F451-F460 AromaticContact CE2-CG 3.63Å; F451-F460 HydrophobicContact CE2-CG 3.63Å; F451-F460 HydrophobicContact CZ-CD1 4.27Å; G456-F460 PolarHBondContact O-N 3.43Å; K457-F460 WeakPolarHBondContact O-CB 3.5Å; K457-F460 PolarHBondContact O-N 3.45Å; F460-A462 VanDerWaalsContact C-N 3.33Å; F460-A462 PolarHBondContact O-N 3.37Å; F460-F463 PolarHBondContact O-N 3.37Å; F460-Y464 HydrophobicContact CE1-CD2 4.14Å; F460-Y464 HydrophobicContact CE1-CG 4Å; F460-Y464 HydrophobicContact CE2-CD2 4.42Å; F460-Y464 AromaticContact CZ-CD2 3.71Å; F460-Y464 HydrophobicContact CZ-CD2 3.71Å; F460-Y464 HydrophobicContact CZ-CE2 4.41Å; F460-Y464 HydrophobicContact CZ-CG 4.04Å; F460-Y464 WeakPolarHBondContact O-CB 3.35Å; F460-Y464 PolarHBondContact O-N 3.32Å; F460-M486 HydrophobicContact CZ-CE 4.24Å; F460-L490 HydrophobicContact CD1-CD2 4.48Å; F460-L490 HydrophobicContact CE1-CD1 4.06Å; F460-L490 HydrophobicContact CE1-CD2 3.6Å; F460-L490 HydrophobicContact CZ-CD2 4.1Å; F460-F498 HydrophobicContact CD1-CZ 4.35Å
461	E	92.3	Very high	90.6	Very high	31 Å²	31	20.9 Å²	20.9	15%	0.145	10%	0.096	C	C	.	.	H	α-helix	trans	-55.7	-46.7	178.4	-165.2	-156.1	143.4	0	0	111.7	K457 D458 V459 Y464 K465 F498	K457-E461 PolarHBondContact O-N 3.09Å; D458-E461 PolarHBondContact O-N 3.28Å; V459-E461 VanDerWaalsContact C-N 3.33Å; V459-E461 PolarHBondContact O-N 2.82Å; E461-Y464 PolarHBondContact O-N 3.31Å; E461-K465 WeakPolarHBondContact O-CB 3.28Å; E461-K465 PolarHBondContact O-N 2.8Å; E461-F498 HydrophobicContact CB-CE1 4.44Å; E461-F498 HydrophobicContact CB-CE2 3.7Å; E461-F498 HydrophobicContact CB-CZ 3.59Å; E461-F498 HydrophobicContact CG-CE1 4.38Å; E461-F498 HydrophobicContact CG-CE2 4.02Å; E461-F498 HydrophobicContact CG-CZ 3.94Å
462	A	91	Very high	90.2	Very high	17 Å²	17	22.4 Å²	22.4	14%	0.14	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-47.3	-176.5	0	0	0	0	0	112.4	D458 V459 F460 K466 T695 V699	D458-A462 PolarHBondContact O-N 3.3Å; V459-A462 PolarHBondContact O-N 3.38Å; F460-A462 VanDerWaalsContact C-N 3.33Å; F460-A462 PolarHBondContact O-N 3.37Å; A462-K466 PolarHBondContact O-N 3Å; A462-T695 HydrophobicContact CB-CG2 4.12Å; A462-V699 HydrophobicContact CB-CG2 3.33Å
463	F	92.1	Very high	89.8	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68	-46.3	176.4	-76.8	-78.2	0	0	0	111.3	E418 A421 V459 F460 K465 K466 D467 E687 Q692 T695	E418-F463 HydrophobicContact CB-CD2 3.94Å; E418-F463 HydrophobicContact CB-CE2 3.91Å; E418-F463 HydrophobicContact CB-CZ 4.44Å; E418-F463 HydrophobicContact CG-CD1 4.01Å; E418-F463 HydrophobicContact CG-CD2 3.76Å; E418-F463 HydrophobicContact CG-CE1 3.88Å; E418-F463 HydrophobicContact CG-CE2 3.64Å; E418-F463 HydrophobicContact CG-CG 3.96Å; E418-F463 HydrophobicContact CG-CZ 3.7Å; A421-F463 HydrophobicContact CB-CB 3.79Å; V459-F463 HydrophobicContact CG1-CD2 3.74Å; V459-F463 HydrophobicContact CG1-CE2 3.73Å; V459-F463 VanDerWaalsContact O-CD2 3.28Å; V459-F463 WeakPolarHBondContact O-CD2 3.39Å; V459-F463 PolarHBondContact O-N 3.05Å; V459-F463 VanDerWaalsContact O-N 3.14Å; F460-F463 PolarHBondContact O-N 3.37Å; F463-K465 PolarHBondContact O-N 2.88Å; F463-K466 PolarHBondContact O-N 3.43Å; F463-D467 PolarHBondContact O-N 3.09Å; F463-E687 WeakPolarHBondContact CE1-OE1 3.29Å; F463-Q692 HydrophobicContact CE1-CG 4.15Å; F463-Q692 HydrophobicContact CZ-CG 4.31Å; F463-T695 HydrophobicContact CD1-CG2 4.19Å; F463-T695 HydrophobicContact CD2-CG2 4.48Å; F463-T695 HydrophobicContact CE1-CG2 4.06Å; F463-T695 HydrophobicContact CE2-CG2 4.35Å; F463-T695 HydrophobicContact CG-CG2 4.4Å; F463-T695 HydrophobicContact CZ-CG2 4.14Å
464	Y	94	Very high	89	Confident	1 Å²	1	17.6 Å²	17.6	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-59.3	-44.2	178.6	-175.2	-90.6	0	0	0	112	V424 F460 E461 D467 L468 M486 L487 L490 L502	V424-Y464 HydrophobicContact CG1-CD2 4.31Å; V424-Y464 HydrophobicContact CG1-CE2 3.74Å; F460-Y464 HydrophobicContact CE1-CD2 4.14Å; F460-Y464 HydrophobicContact CE1-CG 4Å; F460-Y464 HydrophobicContact CE2-CD2 4.42Å; F460-Y464 AromaticContact CZ-CD2 3.71Å; F460-Y464 HydrophobicContact CZ-CD2 3.71Å; F460-Y464 HydrophobicContact CZ-CE2 4.41Å; F460-Y464 HydrophobicContact CZ-CG 4.04Å; F460-Y464 WeakPolarHBondContact O-CB 3.35Å; F460-Y464 PolarHBondContact O-N 3.32Å; E461-Y464 PolarHBondContact O-N 3.31Å; Y464-D467 PolarHBondContact O-N 3.12Å; Y464-L468 HydrophobicContact CE1-CB 4.46Å; Y464-L468 HydrophobicContact CE1-CD2 4.29Å; Y464-L468 WeakPolarHBondContact O-CB 3.49Å; Y464-L468 PolarHBondContact O-N 3.4Å; Y464-M486 HydrophobicContact CE2-CG 4.19Å; Y464-M486 WeakPolarHBondContact OH-CG 3.47Å; Y464-L487 HydrophobicContact CE1-CD2 4.37Å; Y464-L490 HydrophobicContact CD1-CD1 4.38Å; Y464-L490 HydrophobicContact CE1-CD1 4.06Å; Y464-L502 HydrophobicContact CD1-CD1 3.9Å; Y464-L502 HydrophobicContact CD1-CD2 4.13Å; Y464-L502 HydrophobicContact CE1-CD1 3.99Å; Y464-L502 HydrophobicContact CE1-CD2 4.45Å
465	K	92.4	Very high	87.8	Confident	32 Å²	32	20.4 Å²	20.4	14%	0.139	12%	0.118	C	C	.	.	H	α-helix	trans	-61.6	-43.7	177.2	-176.6	174.9	65.7	-173	0	112	E461 F463 A469 L502 M505 P545	E461-K465 WeakPolarHBondContact O-CB 3.28Å; E461-K465 PolarHBondContact O-N 2.8Å; F463-K465 PolarHBondContact O-N 2.88Å; K465-A469 WeakPolarHBondContact O-CB 3.2Å; K465-A469 PolarHBondContact O-N 3.48Å; K465-L502 HydrophobicContact CB-CD2 3.75Å; K465-L502 HydrophobicContact CG-CD2 3.89Å; K465-M505 HydrophobicContact CG-SD 3.78Å; K465-P545 HydrophobicContact CG-CG 4.31Å
466	K	89.9	Confident	86.7	Confident	20 Å²	20	19.1 Å²	19.1	9%	0.087	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-47	176.9	-178.4	179.3	67.4	-176.1	0	111.2	A462 F463 A469 K470 P545 E687 T695	A462-K466 PolarHBondContact O-N 3Å; F463-K466 PolarHBondContact O-N 3.43Å; K466-A469 WeakPolarHBondContact O-CB 3.46Å; K466-A469 PolarHBondContact O-N 2.72Å; K466-K470 PolarHBondContact O-N 2.94Å; K466-K470 VanDerWaalsContact O-N 3.14Å; K466-P545 HydrophobicContact CB-CG 4.5Å; K466-E687 IonicContact NZ-OE1 2.88Å; K466-E687 PolarHBondContact NZ-OE1 2.98Å; K466-T695 PolarHBondContact NZ-OG1 3.26Å
467	D	89.8	Confident	86.1	Confident	7 Å²	7	20.4 Å²	20.4	4%	0.037	12%	0.12	C	C	.	.	H	α-helix	trans	-70.1	-38.2	-178	-69.5	-25.3	0	0	0	111.6	D425 F463 Y464 A469 K470 R471	D425-D467 HydrophobicContact CB-CB 3.95Å; F463-D467 PolarHBondContact O-N 3.09Å; Y464-D467 PolarHBondContact O-N 3.12Å; D467-A469 VanDerWaalsContact C-N 3.32Å; D467-A469 PolarHBondContact O-N 3.3Å; D467-K470 PolarHBondContact O-N 2.93Å; D467-R471 WeakPolarHBondContact O-CG 3.28Å; D467-R471 PolarHBondContact O-N 3.14Å
468	L	91.1	Very high	85.1	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-44.1	171	178.9	65.2	0	0	0	111.3	Y464 K470 R471 L472 E483 L502 M505 F506	Y464-L468 HydrophobicContact CE1-CB 4.46Å; Y464-L468 HydrophobicContact CE1-CD2 4.29Å; Y464-L468 WeakPolarHBondContact O-CB 3.49Å; Y464-L468 PolarHBondContact O-N 3.4Å; L468-K470 VanDerWaalsContact C-N 3.31Å; L468-K470 PolarHBondContact O-N 3.42Å; L468-R471 PolarHBondContact O-N 3.22Å; L468-R471 VanDerWaalsContact O-N 3.13Å; L468-L472 HydrophobicContact CD1-CD1 4.08Å; L468-L472 HydrophobicContact CD1-CD2 4.47Å; L468-L472 HydrophobicContact CD1-CG 3.97Å; L468-L472 HydrophobicContact CD2-CD1 4.44Å; L468-L472 HydrophobicContact CG-CD1 3.92Å; L468-L472 HydrophobicContact CG-CG 4.22Å; L468-L472 WeakPolarHBondContact O-CB 3.47Å; L468-L472 WeakPolarHBondContact O-CG 3.41Å; L468-L472 PolarHBondContact O-N 2.99Å; L468-E483 WeakPolarHBondContact CD1-OE2 3.45Å; L468-L502 HydrophobicContact CD2-CB 4.29Å; L468-L502 HydrophobicContact CD2-CD2 3.84Å; L468-M505 HydrophobicContact CB-CE 4.26Å; L468-M505 HydrophobicContact CD2-CE 3.99Å; L468-M505 HydrophobicContact CD2-SD 4.22Å; L468-M505 HydrophobicContact CG-CE 3.97Å; L468-F506 HydrophobicContact CD1-CE2 3.99Å; L468-F506 HydrophobicContact CD1-CZ 4.1Å; L468-F506 HydrophobicContact CD2-CE2 3.97Å
469	A	89.7	Confident	84.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60	-42.7	177.3	0	0	0	0	0	111.7	K465 K466 D467 L473 M505 W544 P545 Y547	K465-A469 WeakPolarHBondContact O-CB 3.2Å; K465-A469 PolarHBondContact O-N 3.48Å; K466-A469 WeakPolarHBondContact O-CB 3.46Å; K466-A469 PolarHBondContact O-N 2.72Å; D467-A469 VanDerWaalsContact C-N 3.32Å; D467-A469 PolarHBondContact O-N 3.3Å; A469-L473 WeakPolarHBondContact O-CB 3.27Å; A469-L473 WeakPolarHBondContact O-CG 3.4Å; A469-L473 PolarHBondContact O-N 3.31Å; A469-M505 HydrophobicContact CB-CE 3.67Å; A469-W544 HydrophobicContact CB-CE3 3.76Å; A469-W544 HydrophobicContact CB-CZ3 3.78Å; A469-P545 HydrophobicContact CB-CG 4.01Å; A469-Y547 VanDerWaalsContact CB-OH 3.27Å; A469-Y547 WeakPolarHBondContact CB-OH 3.37Å
470	K	85.5	Confident	84.1	Confident	31 Å²	31	24.3 Å²	24.3	14%	0.135	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-40.9	174.3	-67.7	-176.9	-178.6	-172.8	0	111.5	K466 D467 L468 V474 M685 E691	K466-K470 PolarHBondContact O-N 2.94Å; K466-K470 VanDerWaalsContact O-N 3.14Å; D467-K470 PolarHBondContact O-N 2.93Å; L468-K470 VanDerWaalsContact C-N 3.31Å; L468-K470 PolarHBondContact O-N 3.42Å; K470-V474 VanDerWaalsContact O-CB 3.26Å; K470-V474 WeakPolarHBondContact O-CB 3.47Å; K470-V474 VanDerWaalsContact O-CG2 3.31Å; K470-V474 WeakPolarHBondContact O-CG2 3.22Å; K470-V474 PolarHBondContact O-N 3.44Å; K470-V474 VanDerWaalsContact O-N 3.15Å; K470-M685 HydrophobicContact CB-CE 4.49Å; K470-E691 IonicContact NZ-OE1 3.75Å; K470-E691 IonicContact NZ-OE2 2.72Å; K470-E691 PolarHBondContact NZ-OE2 2.74Å
471	R	86.8	Confident	83.7	Confident	1 Å²	1	29.7 Å²	29.7	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-67.8	-44.4	179.1	-69.2	-165.7	-55	-84.4	3.5	112.8	D425 R429 D467 L468 G475 K476 E483	D425-R471 VanDerWaalsContact OD1-CD 3.32Å; D425-R471 WeakPolarHBondContact OD1-CD 3.43Å; D425-R471 IonicContact OD1-CZ 3.12Å; D425-R471 IonicContact OD1-NE 3.06Å; D425-R471 IonicContact OD1-NH1 2.66Å; D425-R471 PolarHBondContact OD1-NH1 2.92Å; R429-R471 HydrophobicContact CG-CG 4.44Å; D467-R471 WeakPolarHBondContact O-CG 3.28Å; D467-R471 PolarHBondContact O-N 3.14Å; L468-R471 PolarHBondContact O-N 3.22Å; L468-R471 VanDerWaalsContact O-N 3.13Å; R471-G475 PolarHBondContact O-N 3.38Å; R471-K476 PolarHBondContact O-N 3.06Å; R471-K476 VanDerWaalsContact O-N 3.14Å; R471-E483 IonicContact CZ-OE1 2.78Å; R471-E483 IonicContact CZ-OE2 2.57Å; R471-E483 IonicContact NE-OE1 2.7Å; R471-E483 PolarHBondContact NE-OE1 2.76Å; R471-E483 IonicContact NE-OE2 2.78Å; R471-E483 IonicContact NH2-OE1 3.37Å; R471-E483 IonicContact NH2-OE2 3.97Å; R471-E483 PolarHBondContact NH2-OE2 3.47Å
472	L	86.4	Confident	83.5	Confident	34 Å²	34	28.8 Å²	28.8	18%	0.178	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-47.4	179.7	-71.1	177.8	0	0	0	112.2	L468 M505 F506 M509 W544	L468-L472 HydrophobicContact CD1-CD1 4.08Å; L468-L472 HydrophobicContact CD1-CD2 4.47Å; L468-L472 HydrophobicContact CD1-CG 3.97Å; L468-L472 HydrophobicContact CD2-CD1 4.44Å; L468-L472 HydrophobicContact CG-CD1 3.92Å; L468-L472 HydrophobicContact CG-CG 4.22Å; L468-L472 WeakPolarHBondContact O-CB 3.47Å; L468-L472 WeakPolarHBondContact O-CG 3.41Å; L468-L472 PolarHBondContact O-N 2.99Å; L472-M505 HydrophobicContact CD1-CB 4.2Å; L472-M505 HydrophobicContact CD1-CE 4.24Å; L472-F506 HydrophobicContact CD1-CE2 4.39Å; L472-F506 HydrophobicContact CD1-CZ 4.49Å; L472-F506 HydrophobicContact CD2-CD1 4.47Å; L472-F506 HydrophobicContact CD2-CE1 3.87Å; L472-F506 HydrophobicContact CD2-CZ 3.93Å; L472-M509 HydrophobicContact CB-CG 4.44Å; L472-M509 HydrophobicContact CB-SD 4.27Å; L472-M509 HydrophobicContact CD1-CG 4.21Å; L472-W544 HydrophobicContact CB-CH2 4.32Å; L472-W544 HydrophobicContact CD1-CH2 4.07Å
473	L	83.7	Confident	83.4	Confident	15 Å²	15	28 Å²	28	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-79.7	-31.6	-173.6	-63.6	174.1	0	0	0	113.7	A469 M509 N537 L539 W544 L584	A469-L473 WeakPolarHBondContact O-CB 3.27Å; A469-L473 WeakPolarHBondContact O-CG 3.4Å; A469-L473 PolarHBondContact O-N 3.31Å; L473-M509 HydrophobicContact CD2-CE 4.05Å; L473-M509 HydrophobicContact CD2-SD 4.18Å; L473-N537 HydrophobicContact CD2-CB 4.28Å; L473-L539 HydrophobicContact CD1-CD1 4.03Å; L473-L539 HydrophobicContact CD2-CD1 4.18Å; L473-L539 HydrophobicContact CD2-CD2 4.02Å; L473-W544 HydrophobicContact CD1-CE3 4.21Å; L473-W544 HydrophobicContact CD1-CZ3 3.72Å; L473-W544 HydrophobicContact CD2-CH2 4.04Å; L473-W544 HydrophobicContact CD2-CZ3 4.03Å; L473-W544 HydrophobicContact CG-CH2 4.15Å; L473-W544 HydrophobicContact CG-CZ3 3.72Å; L473-L584 HydrophobicContact CD1-CB 4.4Å; L473-L584 HydrophobicContact CD1-CD1 3.82Å; L473-L584 HydrophobicContact CD1-CD2 4.16Å; L473-L584 HydrophobicContact CD1-CG 4.35Å
474	V	75.6	Confident	83.3	Confident	22 Å²	22	32.5 Å²	32.5	13%	0.133	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.4	-176.7	-167.4	0	0	0	0	112.2	K470 K679 M685	K470-V474 VanDerWaalsContact O-CB 3.26Å; K470-V474 WeakPolarHBondContact O-CB 3.47Å; K470-V474 VanDerWaalsContact O-CG2 3.31Å; K470-V474 WeakPolarHBondContact O-CG2 3.22Å; K470-V474 PolarHBondContact O-N 3.44Å; K470-V474 VanDerWaalsContact O-N 3.15Å; V474-K679 PolarHBondContact O-NZ 2.84Å; V474-M685 HydrophobicContact CB-CE 3.9Å; V474-M685 HydrophobicContact CB-SD 4.2Å; V474-M685 HydrophobicContact CG1-CE 4.01Å; V474-M685 HydrophobicContact CG1-CG 4.26Å; V474-M685 HydrophobicContact CG1-SD 3.61Å; V474-M685 HydrophobicContact CG2-CE 4.35Å
475	G	66.1	Low	83.2	Confident	62 Å²	62	33.8 Å²	33.8	64%	0.639	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	55.5	171.4	0	0	0	0	0	112.9	R471	R471-G475 PolarHBondContact O-N 3.38Å
476	K	64.4	Low	83.2	Confident	43 Å²	43	32.2 Å²	32.2	19%	0.187	20%	0.197	C	C	.	.			trans	-132.2	16.7	-176.5	-67.6	-158.3	-174.4	173.5	0	115.2	R429 A430 R471 M685	R429-K476 CarbonylContact C-O 3.53Å; R429-K476 WeakPolarHBondContact CA-O 3.28Å; A430-K476 WeakPolarHBondContact CB-O 3.06Å; A430-K476 PolarHBondContact N-O 3.48Å; R471-K476 PolarHBondContact O-N 3.06Å; R471-K476 VanDerWaalsContact O-N 3.14Å; K476-M685 HydrophobicContact CD-CE 3.84Å; K476-M685 HydrophobicContact CD-SD 3.45Å; K476-M685 WeakPolarHBondContact CD-SD 3.44Å; K476-M685 WeakPolarHBondContact CE-SD 3.48Å; K476-M685 HydrophobicContact CG-CE 4.35Å; K476-M685 HydrophobicContact CG-SD 4.32Å; K476-M685 PolarHBondContact NZ-SD 3.46Å
477	S	72.3	Confident	83.3	Confident	34 Å²	34	31.9 Å²	31.9	24%	0.238	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-68.9	141.1	171.5	-64	0	0	0	0	110.9	L428 E483	L428-S477 CarbonylContact O-C 3.5Å; S477-E483 WeakPolarHBondContact CB-OE1 3.21Å; S477-E483 PolarHBondContact OG-OE1 3.03Å
478	A	68.3	Low	83.5	Confident	50 Å²	50	35.2 Å²	35.2	41%	0.413	22%	0.22	S	C	.	.	S	Bend	trans	-67.7	-44.4	177.6	0	0	0	0	0	111.7	L428	L428-A478 WeakPolarHBondContact O-CB 3.48Å; L428-A478 PolarHBondContact O-N 3.05Å
479	S	79.3	Confident	83.6	Confident	22 Å²	22	36.9 Å²	36.9	15%	0.154	23%	0.227	C	C	.	.			trans	-151.3	140.5	176.3	170.3	0	0	0	0	109.5	D481 A482 E483	S479-D481 VanDerWaalsContact C-N 3.3Å; S479-D481 PolarHBondContact OG-N 3.44Å; S479-A482 PolarHBondContact OG-N 3.32Å; S479-E483 VanDerWaalsContact O-CG 3.31Å; S479-E483 WeakPolarHBondContact O-CG 3.22Å; S479-E483 PolarHBondContact O-N 2.88Å
480	V	81.2	Confident	83.9	Confident	87 Å²	87	36.9 Å²	36.9	53%	0.527	23%	0.227	S	C	.	.	H	α-helix	trans	-67.9	-37	174.6	176.7	0	0	0	0	110.2	E483 K484	V480-E483 PolarHBondContact O-N 2.94Å; V480-K484 HydrophobicContact CG1-CD 4.44Å; V480-K484 WeakPolarHBondContact O-CG 3.29Å; V480-K484 PolarHBondContact O-N 3.01Å
481	D	85.8	Confident	84.2	Confident	115 Å²	115	39.3 Å²	39.3	62%	0.615	24%	0.237	S	C	*	.	H	α-helix	trans	-70.6	-37.4	-179.3	-63.2	-35.5	0	0	0	111.2	S479 E483 K484 S485	S479-D481 VanDerWaalsContact C-N 3.3Å; S479-D481 PolarHBondContact OG-N 3.44Å; D481-E483 VanDerWaalsContact C-N 3.34Å; D481-E483 PolarHBondContact O-N 2.95Å; D481-K484 PolarHBondContact O-N 3.27Å; D481-S485 WeakPolarHBondContact O-CB 3.19Å; D481-S485 PolarHBondContact O-N 3.45Å
482	A	87.1	Confident	84.5	Confident	12 Å²	12	46.8 Å²	46.8	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-39.9	173	0	0	0	0	0	112.4	L428 L440 S479 S485 M486	L428-A482 HydrophobicContact CD2-CB 4.04Å; L440-A482 HydrophobicContact CD2-CB 3.9Å; S479-A482 PolarHBondContact OG-N 3.32Å; A482-S485 PolarHBondContact O-N 2.97Å; A482-M486 PolarHBondContact O-N 2.8Å
483	E	88.9	Confident	84.6	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-68.4	-40.2	176.8	-60.6	-94.7	-158.5	0	0	111.4	L468 R471 S477 S479 V480 D481 M486 L487 F506	L468-E483 WeakPolarHBondContact CD1-OE2 3.45Å; R471-E483 IonicContact CZ-OE1 2.78Å; R471-E483 IonicContact CZ-OE2 2.57Å; R471-E483 IonicContact NE-OE1 2.7Å; R471-E483 PolarHBondContact NE-OE1 2.76Å; R471-E483 IonicContact NE-OE2 2.78Å; R471-E483 IonicContact NH2-OE1 3.37Å; R471-E483 IonicContact NH2-OE2 3.97Å; R471-E483 PolarHBondContact NH2-OE2 3.47Å; S477-E483 WeakPolarHBondContact CB-OE1 3.21Å; S477-E483 PolarHBondContact OG-OE1 3.03Å; S479-E483 VanDerWaalsContact O-CG 3.31Å; S479-E483 WeakPolarHBondContact O-CG 3.22Å; S479-E483 PolarHBondContact O-N 2.88Å; V480-E483 PolarHBondContact O-N 2.94Å; D481-E483 VanDerWaalsContact C-N 3.34Å; D481-E483 PolarHBondContact O-N 2.95Å; E483-M486 PolarHBondContact O-N 3.05Å; E483-L487 PolarHBondContact O-N 3.03Å; E483-L487 VanDerWaalsContact O-N 3.08Å; E483-F506 HydrophobicContact CB-CE1 4.37Å; E483-F506 HydrophobicContact CB-CZ 3.73Å
484	K	89.9	Confident	84.8	Confident	94 Å²	94	49.3 Å²	49.3	41%	0.409	29%	0.287	S	S	.	.	H	α-helix	trans	-64.2	-40.1	173.7	-74	-177.6	176.5	-176	0	111.8	V480 D481 L487 S488 E510	V480-K484 HydrophobicContact CG1-CD 4.44Å; V480-K484 WeakPolarHBondContact O-CG 3.29Å; V480-K484 PolarHBondContact O-N 3.01Å; D481-K484 PolarHBondContact O-N 3.27Å; K484-L487 PolarHBondContact O-N 3.3Å; K484-S488 PolarHBondContact O-N 3.4Å; K484-E510 IonicContact NZ-OE1 2.88Å
485	S	92.1	Very high	85.4	Confident	27 Å²	27	49.8 Å²	49.8	19%	0.189	30%	0.296	C	S	.	.	H	α-helix	trans	-59	-49.7	174.1	178.9	0	0	0	0	110.7	E441 D481 A482 L487 S488 K489	E441-S485 PolarHBondContact OE1-OG 2.92Å; E441-S485 PolarHBondContact OE2-OG 2.99Å; D481-S485 WeakPolarHBondContact O-CB 3.19Å; D481-S485 PolarHBondContact O-N 3.45Å; A482-S485 PolarHBondContact O-N 2.97Å; S485-L487 VanDerWaalsContact C-N 3.32Å; S485-L487 PolarHBondContact O-N 3.03Å; S485-S488 WeakPolarHBondContact O-CB 3.34Å; S485-S488 PolarHBondContact O-N 3.32Å; S485-K489 WeakPolarHBondContact O-CG 3.49Å; S485-K489 PolarHBondContact O-N 3.44Å; S485-K489 WeakPolarHBondContact OG-CE 3.35Å
486	M	93	Very high	86.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-42.1	178.2	-171.4	62.2	-165.6	0	0	112.4	V424 L428 L444 M448 F460 Y464 A482 E483 S488 K489 L490	V424-M486 HydrophobicContact CG1-CE 4.18Å; V424-M486 HydrophobicContact CG1-CG 4.41Å; V424-M486 HydrophobicContact CG1-SD 4.38Å; V424-M486 HydrophobicContact CG2-CE 4.32Å; L428-M486 HydrophobicContact CD1-CG 4.5Å; L444-M486 HydrophobicContact CB-SD 4.47Å; L444-M486 HydrophobicContact CD1-CB 4.46Å; L444-M486 HydrophobicContact CD1-SD 4.38Å; L444-M486 HydrophobicContact CD2-SD 3.88Å; L444-M486 HydrophobicContact CG-SD 4.46Å; M448-M486 HydrophobicContact SD-CE 3.52Å; M448-M486 VanDerWaalsContact SD-CE 3.52Å; M448-M486 HydrophobicContact SD-SD 4.35Å; F460-M486 HydrophobicContact CZ-CE 4.24Å; Y464-M486 HydrophobicContact CE2-CG 4.19Å; Y464-M486 WeakPolarHBondContact OH-CG 3.47Å; A482-M486 PolarHBondContact O-N 2.8Å; E483-M486 PolarHBondContact O-N 3.05Å; M486-S488 PolarHBondContact O-N 3.26Å; M486-K489 PolarHBondContact O-N 2.89Å; M486-L490 HydrophobicContact CE-CD1 4.22Å; M486-L490 HydrophobicContact CE-CD2 4.08Å; M486-L490 HydrophobicContact CE-CG 4.02Å; M486-L490 HydrophobicContact CG-CD1 4.39Å; M486-L490 WeakPolarHBondContact O-CG 3.22Å; M486-L490 PolarHBondContact O-N 3.24Å
487	L	92.4	Very high	87.6	Confident	12 Å²	12	52 Å²	52	6%	0.063	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-40.7	174.4	-73.3	-176.3	0	0	0	112.8	Y464 E483 K484 S485 K489 L490 K491 L502 F506	Y464-L487 HydrophobicContact CE1-CD2 4.37Å; E483-L487 PolarHBondContact O-N 3.03Å; E483-L487 VanDerWaalsContact O-N 3.08Å; K484-L487 PolarHBondContact O-N 3.3Å; S485-L487 VanDerWaalsContact C-N 3.32Å; S485-L487 PolarHBondContact O-N 3.03Å; L487-K489 VanDerWaalsContact C-N 3.34Å; L487-K489 PolarHBondContact O-N 3.39Å; L487-L490 PolarHBondContact O-N 3.26Å; L487-K491 WeakPolarHBondContact O-CB 3.22Å; L487-K491 PolarHBondContact O-N 3.46Å; L487-L502 HydrophobicContact CD2-CB 3.51Å; L487-L502 HydrophobicContact CD2-CD1 3.62Å; L487-L502 HydrophobicContact CD2-CG 4.18Å; L487-F506 HydrophobicContact CD1-CD2 3.43Å; L487-F506 VanDerWaalsContact CD1-CD2 3.43Å; L487-F506 HydrophobicContact CD1-CE2 3.39Å; L487-F506 HydrophobicContact CD1-CG 4.44Å; L487-F506 HydrophobicContact CD1-CZ 4.37Å; L487-F506 HydrophobicContact CG-CE2 4.31Å
488	S	93.8	Very high	88.3	Confident	78 Å²	78	51.7 Å²	51.7	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-44.6	176	-170.4	0	0	0	0	111.4	K484 S485 M486 K491 H492	K484-S488 PolarHBondContact O-N 3.4Å; S485-S488 WeakPolarHBondContact O-CB 3.34Å; S485-S488 PolarHBondContact O-N 3.32Å; M486-S488 PolarHBondContact O-N 3.26Å; S488-K491 WeakPolarHBondContact O-CB 3.29Å; S488-K491 PolarHBondContact O-N 3.24Å; S488-H492 PolarHBondContact O-N 3.45Å
489	K	94.3	Very high	89.5	Confident	34 Å²	34	49.3 Å²	49.3	15%	0.148	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-44.7	176.4	-64.6	178.4	-165.3	-67	0	112.1	E441 L444 D445 M448 S485 M486 L487 K491 H492 E493	E441-K489 WeakPolarHBondContact OE1-CE 3.39Å; E441-K489 IonicContact OE1-NZ 2.66Å; E441-K489 PolarHBondContact OE1-NZ 2.65Å; L444-K489 HydrophobicContact CB-CD 4.43Å; D445-K489 WeakPolarHBondContact OD1-CE 3.14Å; D445-K489 IonicContact OD1-NZ 2.93Å; D445-K489 PolarHBondContact OD1-NZ 3.03Å; D445-K489 IonicContact OD2-NZ 2.74Å; M448-K489 HydrophobicContact CE-CB 4.45Å; M448-K489 HydrophobicContact CG-CB 4.03Å; M448-K489 HydrophobicContact CG-CD 4.09Å; M448-K489 HydrophobicContact SD-CB 4.37Å; S485-K489 WeakPolarHBondContact O-CG 3.49Å; S485-K489 PolarHBondContact O-N 3.44Å; S485-K489 WeakPolarHBondContact OG-CE 3.35Å; M486-K489 PolarHBondContact O-N 2.89Å; L487-K489 VanDerWaalsContact C-N 3.34Å; L487-K489 PolarHBondContact O-N 3.39Å; K489-K491 VanDerWaalsContact C-N 3.31Å; K489-K491 PolarHBondContact O-N 3.24Å; K489-H492 PolarHBondContact O-N 3.19Å; K489-E493 WeakPolarHBondContact O-CG 3.49Å; K489-E493 PolarHBondContact O-N 3.04Å; K489-E493 VanDerWaalsContact O-N 3.15Å
490	L	94	Very high	90.1	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-38.6	175.6	-71.3	171.5	0	0	0	112.1	M448 F451 F460 Y464 M486 L487 E493 C494 F498 T499 L502	M448-L490 HydrophobicContact CE-CD2 4.03Å; M448-L490 HydrophobicContact SD-CD2 4.08Å; F451-L490 HydrophobicContact CE1-CD2 4.25Å; F451-L490 HydrophobicContact CZ-CD2 4.13Å; F460-L490 HydrophobicContact CD1-CD2 4.48Å; F460-L490 HydrophobicContact CE1-CD1 4.06Å; F460-L490 HydrophobicContact CE1-CD2 3.6Å; F460-L490 HydrophobicContact CZ-CD2 4.1Å; Y464-L490 HydrophobicContact CD1-CD1 4.38Å; Y464-L490 HydrophobicContact CE1-CD1 4.06Å; M486-L490 HydrophobicContact CE-CD1 4.22Å; M486-L490 HydrophobicContact CE-CD2 4.08Å; M486-L490 HydrophobicContact CE-CG 4.02Å; M486-L490 HydrophobicContact CG-CD1 4.39Å; M486-L490 WeakPolarHBondContact O-CG 3.22Å; M486-L490 PolarHBondContact O-N 3.24Å; L487-L490 PolarHBondContact O-N 3.26Å; L490-E493 PolarHBondContact O-N 3.09Å; L490-C494 WeakPolarHBondContact O-CB 3.45Å; L490-C494 PolarHBondContact O-N 2.97Å; L490-F498 HydrophobicContact CD2-CE1 4.38Å; L490-T499 HydrophobicContact CB-CG2 3.78Å; L490-L502 HydrophobicContact CD1-CD1 4.42Å
491	K	93.3	Very high	90.6	Very high	82 Å²	82	50.5 Å²	50.5	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-66.2	-39.6	177.6	-172.7	177.9	-164.5	148.5	0	112	L487 S488 K489 G495 T499 E503	L487-K491 WeakPolarHBondContact O-CB 3.22Å; L487-K491 PolarHBondContact O-N 3.46Å; S488-K491 WeakPolarHBondContact O-CB 3.29Å; S488-K491 PolarHBondContact O-N 3.24Å; K489-K491 VanDerWaalsContact C-N 3.31Å; K489-K491 PolarHBondContact O-N 3.24Å; K491-G495 CarbonylContact O-C 3.48Å; K491-G495 WeakPolarHBondContact O-CA 3.4Å; K491-G495 PolarHBondContact O-N 3.4Å; K491-T499 HydrophobicContact CB-CG2 3.88Å; K491-E503 WeakPolarHBondContact CD-OE1 3.41Å; K491-E503 WeakPolarHBondContact CE-OE1 3.33Å; K491-E503 IonicContact NZ-OE1 3.22Å; K491-E503 PolarHBondContact NZ-OE1 2.81Å; K491-E503 IonicContact NZ-OE2 3.69Å; K491-E503 PolarHBondContact NZ-OE2 2.76Å
492	H	92.2	Very high	91	Very high	158 Å²	158	45 Å²	45	73%	0.731	26%	0.264	S	S	*	.	H	α-helix	trans	-63.1	-44.3	176.5	-175.8	68.8	0	0	0	111.7	S488 K489	S488-H492 PolarHBondContact O-N 3.45Å; K489-H492 PolarHBondContact O-N 3.19Å
493	E	88.6	Confident	91.3	Very high	63 Å²	63	46.9 Å²	46.9	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-82.1	-36.4	-174.6	-64.2	-73.6	172	0	0	113.5	M448 R452 K489 L490	M448-E493 HydrophobicContact CE-CB 4.01Å; M448-E493 HydrophobicContact CE-CG 3.59Å; R452-E493 WeakPolarHBondContact CD-OE2 3.44Å; R452-E493 VanDerWaalsContact CG-OE2 3.32Å; R452-E493 WeakPolarHBondContact CG-OE2 3.38Å; R452-E493 IonicContact CZ-OE1 3.25Å; R452-E493 VanDerWaalsContact CZ-OE1 3.28Å; R452-E493 VanDerWaalsContact NE-CD 3.26Å; R452-E493 IonicContact NE-OE1 3.66Å; R452-E493 PolarHBondContact NE-OE1 2.92Å; R452-E493 IonicContact NE-OE2 3.06Å; R452-E493 PolarHBondContact NE-OE2 3.48Å; R452-E493 VanDerWaalsContact NE-OE2 3.07Å; R452-E493 IonicContact NH2-OE1 3.24Å; R452-E493 PolarHBondContact NH2-OE1 3.33Å; K489-E493 WeakPolarHBondContact O-CG 3.49Å; K489-E493 PolarHBondContact O-N 3.04Å; K489-E493 VanDerWaalsContact O-N 3.15Å; L490-E493 PolarHBondContact O-N 3.09Å
494	C	87.4	Confident	91.5	Very high	40 Å²	40	47 Å²	47	27%	0.27	27%	0.272	S	S	.	.	H	α-helix	trans	-109.3	-11	-174.9	-61.5	0	0	0	0	114.6	F451 L490 F498	F451-C494 WeakPolarHBondContact CE1-SG 3.27Å; F451-C494 VanDerWaalsContact CZ-SG 3.56Å; L490-C494 WeakPolarHBondContact O-CB 3.45Å; L490-C494 PolarHBondContact O-N 2.97Å; C494-F498 HydrophobicContact CB-CB 3.59Å; C494-F498 HydrophobicContact CB-CD1 3.52Å; C494-F498 HydrophobicContact CB-CD2 4.08Å; C494-F498 HydrophobicContact CB-CE1 4.18Å; C494-F498 HydrophobicContact CB-CG 3.46Å; C494-F498 VanDerWaalsContact CB-CG 3.46Å
495	G	88.1	Confident	91.7	Very high	32 Å²	32	42.5 Å²	42.5	33%	0.33	25%	0.252	S	S	.	.			trans	84.6	169	-175.3	0	0	0	0	0	114.4	K491 A497 F498	K491-G495 CarbonylContact O-C 3.48Å; K491-G495 WeakPolarHBondContact O-CA 3.4Å; K491-G495 PolarHBondContact O-N 3.4Å; G495-A497 PolarHBondContact O-N 3.06Å; G495-F498 PolarHBondContact O-N 3.25Å
496	A	89.4	Confident	91.7	Very high	57 Å²	57	42.3 Å²	42.3	47%	0.471	25%	0.248	S	C	.	.	H	α-helix	trans	-68	-27.8	-171.9	0	0	0	0	0	114.8	F498 T499 S500	A496-F498 VanDerWaalsContact C-N 3.31Å; A496-F498 PolarHBondContact O-N 2.89Å; A496-T499 PolarHBondContact O-N 2.82Å; A496-T499 PolarHBondContact O-OG1 2.99Å; A496-S500 WeakPolarHBondContact O-CB 3.38Å; A496-S500 PolarHBondContact O-N 2.96Å
497	A	87.3	Confident	91.7	Very high	93 Å²	93	48.3 Å²	48.3	77%	0.769	27%	0.274	S	S	*	.	H	α-helix	trans	-66.4	-36.3	178.9	0	0	0	0	0	111.8	G495	G495-A497 PolarHBondContact O-N 3.06Å
498	F	87.7	Confident	91.8	Very high	29 Å²	29	48.3 Å²	48.3	13%	0.127	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-42.2	178.4	-175.8	-95.4	0	0	0	111.8	K457 F460 E461 L490 C494 G495 A496	K457-F498 HydrophobicContact CB-CE2 4.29Å; F460-F498 HydrophobicContact CD1-CZ 4.35Å; E461-F498 HydrophobicContact CB-CE1 4.44Å; E461-F498 HydrophobicContact CB-CE2 3.7Å; E461-F498 HydrophobicContact CB-CZ 3.59Å; E461-F498 HydrophobicContact CG-CE1 4.38Å; E461-F498 HydrophobicContact CG-CE2 4.02Å; E461-F498 HydrophobicContact CG-CZ 3.94Å; L490-F498 HydrophobicContact CD2-CE1 4.38Å; C494-F498 HydrophobicContact CB-CB 3.59Å; C494-F498 HydrophobicContact CB-CD1 3.52Å; C494-F498 HydrophobicContact CB-CD2 4.08Å; C494-F498 HydrophobicContact CB-CE1 4.18Å; C494-F498 HydrophobicContact CB-CG 3.46Å; C494-F498 VanDerWaalsContact CB-CG 3.46Å; G495-F498 PolarHBondContact O-N 3.25Å; A496-F498 VanDerWaalsContact C-N 3.31Å; A496-F498 PolarHBondContact O-N 2.89Å
499	T	92.8	Very high	91.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-87.2	-9.5	-178.8	59.1	0	0	0	0	114.2	L490 K491 A496 K501 L502 E503	L490-T499 HydrophobicContact CB-CG2 3.78Å; K491-T499 HydrophobicContact CB-CG2 3.88Å; A496-T499 PolarHBondContact O-N 2.82Å; A496-T499 PolarHBondContact O-OG1 2.99Å; T499-K501 VanDerWaalsContact C-N 3.31Å; T499-K501 PolarHBondContact O-N 2.86Å; T499-L502 WeakPolarHBondContact O-CB 3.42Å; T499-L502 PolarHBondContact O-N 2.56Å; T499-E503 PolarHBondContact O-N 3.42Å; T499-E503 PolarHBondContact OG1-OE1 2.96Å
500	S	92.3	Very high	91.5	Very high	56 Å²	56	48.3 Å²	48.3	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-53.3	-43.8	-172.7	176	0	0	0	0	113.6	A496 G504	A496-S500 WeakPolarHBondContact O-CB 3.38Å; A496-S500 PolarHBondContact O-N 2.96Å; S500-G504 PolarHBondContact O-N 3.32Å
501	K	92.2	Very high	91.5	Very high	77 Å²	77	52.9 Å²	52.9	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-42.5	177.8	-65.2	177.1	-174.6	164.7	0	111.5	T499 G504 M505 Y543	T499-K501 VanDerWaalsContact C-N 3.31Å; T499-K501 PolarHBondContact O-N 2.86Å; K501-G504 WeakPolarHBondContact O-CA 3.37Å; K501-G504 PolarHBondContact O-N 2.89Å; K501-M505 WeakPolarHBondContact O-CG 3.43Å; K501-M505 PolarHBondContact O-N 3.44Å; K501-Y543 HydrophobicContact CB-CD1 4.46Å; K501-Y543 HydrophobicContact CG-CD1 4.28Å
502	L	93.7	Very high	91.5	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-43.8	179.4	-55	172.7	0	0	0	111.4	Y464 K465 L468 L487 L490 T499 G504 M505 F506	Y464-L502 HydrophobicContact CD1-CD1 3.9Å; Y464-L502 HydrophobicContact CD1-CD2 4.13Å; Y464-L502 HydrophobicContact CE1-CD1 3.99Å; Y464-L502 HydrophobicContact CE1-CD2 4.45Å; K465-L502 HydrophobicContact CB-CD2 3.75Å; K465-L502 HydrophobicContact CG-CD2 3.89Å; L468-L502 HydrophobicContact CD2-CB 4.29Å; L468-L502 HydrophobicContact CD2-CD2 3.84Å; L487-L502 HydrophobicContact CD2-CB 3.51Å; L487-L502 HydrophobicContact CD2-CD1 3.62Å; L487-L502 HydrophobicContact CD2-CG 4.18Å; L490-L502 HydrophobicContact CD1-CD1 4.42Å; T499-L502 WeakPolarHBondContact O-CB 3.42Å; T499-L502 PolarHBondContact O-N 2.56Å; L502-G504 VanDerWaalsContact C-N 3.27Å; L502-G504 PolarHBondContact O-N 3.2Å; L502-M505 HydrophobicContact CD2-SD 4.14Å; L502-M505 WeakPolarHBondContact O-CB 3.48Å; L502-M505 PolarHBondContact O-N 3.07Å; L502-M505 VanDerWaalsContact O-N 3.15Å; L502-F506 WeakPolarHBondContact O-CD2 3.49Å; L502-F506 PolarHBondContact O-N 3.42Å
503	E	93.2	Very high	91.4	Very high	50 Å²	50	48.3 Å²	48.3	23%	0.234	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-38.5	172.8	-70	177.9	-150.8	0	0	111.2	K491 T499 M505 F506 K507	K491-E503 WeakPolarHBondContact CD-OE1 3.41Å; K491-E503 WeakPolarHBondContact CE-OE1 3.33Å; K491-E503 IonicContact NZ-OE1 3.22Å; K491-E503 PolarHBondContact NZ-OE1 2.81Å; K491-E503 IonicContact NZ-OE2 3.69Å; K491-E503 PolarHBondContact NZ-OE2 2.76Å; T499-E503 PolarHBondContact O-N 3.42Å; T499-E503 PolarHBondContact OG1-OE1 2.96Å; E503-M505 VanDerWaalsContact C-N 3.33Å; E503-M505 PolarHBondContact O-N 3.22Å; E503-F506 PolarHBondContact O-N 2.91Å; E503-K507 WeakPolarHBondContact O-CG 3.46Å; E503-K507 PolarHBondContact O-N 2.94Å
504	G	94.1	Very high	91.7	Very high	4 Å²	4	49.6 Å²	49.6	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-40.9	172.5	0	0	0	0	0	113.1	S500 K501 L502 F506 K507 D508	S500-G504 PolarHBondContact O-N 3.32Å; K501-G504 WeakPolarHBondContact O-CA 3.37Å; K501-G504 PolarHBondContact O-N 2.89Å; L502-G504 VanDerWaalsContact C-N 3.27Å; L502-G504 PolarHBondContact O-N 3.2Å; G504-F506 VanDerWaalsContact C-N 3.33Å; G504-F506 PolarHBondContact O-N 3.06Å; G504-K507 PolarHBondContact O-N 2.8Å; G504-D508 PolarHBondContact O-N 3.34Å
505	M	94.1	Very high	92	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-39.9	176	-64.4	166.5	61.7	0	0	112.1	K465 L468 A469 L472 K501 L502 E503 D508 M509 W544	K465-M505 HydrophobicContact CG-SD 3.78Å; L468-M505 HydrophobicContact CB-CE 4.26Å; L468-M505 HydrophobicContact CD2-CE 3.99Å; L468-M505 HydrophobicContact CD2-SD 4.22Å; L468-M505 HydrophobicContact CG-CE 3.97Å; A469-M505 HydrophobicContact CB-CE 3.67Å; L472-M505 HydrophobicContact CD1-CB 4.2Å; L472-M505 HydrophobicContact CD1-CE 4.24Å; K501-M505 WeakPolarHBondContact O-CG 3.43Å; K501-M505 PolarHBondContact O-N 3.44Å; L502-M505 HydrophobicContact CD2-SD 4.14Å; L502-M505 WeakPolarHBondContact O-CB 3.48Å; L502-M505 PolarHBondContact O-N 3.07Å; L502-M505 VanDerWaalsContact O-N 3.15Å; E503-M505 VanDerWaalsContact C-N 3.33Å; E503-M505 PolarHBondContact O-N 3.22Å; M505-D508 PolarHBondContact O-N 3.48Å; M505-M509 WeakPolarHBondContact O-CG 3.38Å; M505-M509 PolarHBondContact O-N 2.71Å; M505-W544 HydrophobicContact CB-CD2 4.49Å; M505-W544 HydrophobicContact CB-CH2 4.2Å; M505-W544 HydrophobicContact CB-CZ2 3.68Å; M505-W544 HydrophobicContact CE-CD2 4.24Å; M505-W544 HydrophobicContact CE-CE3 3.82Å; M505-W544 HydrophobicContact CE-CH2 4.17Å; M505-W544 HydrophobicContact CE-CZ3 3.79Å; M505-W544 HydrophobicContact CG-CD2 3.91Å; M505-W544 HydrophobicContact CG-CE3 4.43Å; M505-W544 HydrophobicContact CG-CG 4.21Å; M505-W544 HydrophobicContact CG-CZ2 4.03Å; M505-W544 WeakPolarHBondContact O-CZ2 3.35Å
506	F	91.6	Very high	92.3	Very high	23 Å²	23	47.6 Å²	47.6	10%	0.101	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-42.8	175	-83.9	-87.6	0	0	0	112.5	L468 L472 E483 L487 L502 E503 G504 D508 M509 E510	L468-F506 HydrophobicContact CD1-CE2 3.99Å; L468-F506 HydrophobicContact CD1-CZ 4.1Å; L468-F506 HydrophobicContact CD2-CE2 3.97Å; L472-F506 HydrophobicContact CD1-CE2 4.39Å; L472-F506 HydrophobicContact CD1-CZ 4.49Å; L472-F506 HydrophobicContact CD2-CD1 4.47Å; L472-F506 HydrophobicContact CD2-CE1 3.87Å; L472-F506 HydrophobicContact CD2-CZ 3.93Å; E483-F506 HydrophobicContact CB-CE1 4.37Å; E483-F506 HydrophobicContact CB-CZ 3.73Å; L487-F506 HydrophobicContact CD1-CD2 3.43Å; L487-F506 VanDerWaalsContact CD1-CD2 3.43Å; L487-F506 HydrophobicContact CD1-CE2 3.39Å; L487-F506 HydrophobicContact CD1-CG 4.44Å; L487-F506 HydrophobicContact CD1-CZ 4.37Å; L487-F506 HydrophobicContact CG-CE2 4.31Å; L502-F506 WeakPolarHBondContact O-CD2 3.49Å; L502-F506 PolarHBondContact O-N 3.42Å; E503-F506 PolarHBondContact O-N 2.91Å; G504-F506 VanDerWaalsContact C-N 3.33Å; G504-F506 PolarHBondContact O-N 3.06Å; F506-D508 VanDerWaalsContact C-N 3.3Å; F506-D508 PolarHBondContact O-N 3.5Å; F506-M509 WeakPolarHBondContact O-CB 3.43Å; F506-M509 PolarHBondContact O-N 3.02Å; F506-M509 VanDerWaalsContact O-N 3.12Å; F506-E510 PolarHBondContact O-N 2.75Å; F506-E510 VanDerWaalsContact O-N 3.07Å
507	K	93.2	Very high	92.4	Very high	126 Å²	126	49.4 Å²	49.4	55%	0.548	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-41.9	175.2	-71.4	177.8	-177.9	178.5	0	111.7	E503 G504 M509 E510 L511	E503-K507 WeakPolarHBondContact O-CG 3.46Å; E503-K507 PolarHBondContact O-N 2.94Å; G504-K507 PolarHBondContact O-N 2.8Å; K507-M509 VanDerWaalsContact C-N 3.29Å; K507-M509 PolarHBondContact O-N 3.07Å; K507-E510 PolarHBondContact O-N 2.93Å; K507-L511 WeakPolarHBondContact O-CB 3.32Å; K507-L511 WeakPolarHBondContact O-CD1 3.41Å; K507-L511 VanDerWaalsContact O-CG 3.27Å; K507-L511 WeakPolarHBondContact O-CG 3.49Å; K507-L511 PolarHBondContact O-N 3.34Å
508	D	94.5	Very high	92.7	Very high	11 Å²	11	48.8 Å²	48.8	6%	0.059	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-38	175.7	-76.8	-19.4	0	0	0	111.8	G504 M505 F506 S512 T540 W544	G504-D508 PolarHBondContact O-N 3.34Å; M505-D508 PolarHBondContact O-N 3.48Å; F506-D508 VanDerWaalsContact C-N 3.3Å; F506-D508 PolarHBondContact O-N 3.5Å; D508-S512 WeakPolarHBondContact O-CB 3.44Å; D508-S512 PolarHBondContact O-N 2.92Å; D508-S512 PolarHBondContact O-OG 2.95Å; D508-T540 PolarHBondContact OD1-OG1 3.06Å; D508-T540 VanDerWaalsContact OD2-CB 3.3Å; D508-T540 WeakPolarHBondContact OD2-CB 3.33Å; D508-T540 PolarHBondContact OD2-N 3.36Å; D508-T540 PolarHBondContact OD2-OG1 3.32Å; D508-W544 HydrophobicContact CB-CZ2 4.28Å; D508-W544 PolarHBondContact OD2-NE1 3.26Å
509	M	91.1	Very high	92.9	Very high	18 Å²	18	47.8 Å²	47.8	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-39.6	175.7	-65.2	-64.4	83.7	0	0	112.9	L472 L473 M505 F506 K507 K513 N537 L539 W544	L472-M509 HydrophobicContact CB-CG 4.44Å; L472-M509 HydrophobicContact CB-SD 4.27Å; L472-M509 HydrophobicContact CD1-CG 4.21Å; L473-M509 HydrophobicContact CD2-CE 4.05Å; L473-M509 HydrophobicContact CD2-SD 4.18Å; M505-M509 WeakPolarHBondContact O-CG 3.38Å; M505-M509 PolarHBondContact O-N 2.71Å; F506-M509 WeakPolarHBondContact O-CB 3.43Å; F506-M509 PolarHBondContact O-N 3.02Å; F506-M509 VanDerWaalsContact O-N 3.12Å; K507-M509 VanDerWaalsContact C-N 3.29Å; K507-M509 PolarHBondContact O-N 3.07Å; M509-K513 WeakPolarHBondContact O-CG 3.39Å; M509-K513 PolarHBondContact O-N 3.23Å; M509-N537 HydrophobicContact CE-CB 3.94Å; M509-L539 HydrophobicContact CE-CD2 3.34Å; M509-W544 HydrophobicContact CE-CH2 3.76Å; M509-W544 HydrophobicContact CE-CZ2 3.68Å; M509-W544 HydrophobicContact CG-CH2 4.41Å; M509-W544 HydrophobicContact CG-CZ2 4.47Å; M509-W544 HydrophobicContact SD-CH2 4.07Å; M509-W544 HydrophobicContact SD-CZ2 4.43Å
510	E	90.7	Very high	92.7	Very high	95 Å²	95	51.8 Å²	51.8	44%	0.444	25%	0.251	S	S	.	.	H	α-helix	trans	-68.6	-50.1	176.6	-69.3	176	175.9	0	0	110.7	K484 F506 K507 S512 K513 D514	K484-E510 IonicContact NZ-OE1 2.88Å; F506-E510 PolarHBondContact O-N 2.75Å; F506-E510 VanDerWaalsContact O-N 3.07Å; K507-E510 PolarHBondContact O-N 2.93Å; E510-S512 VanDerWaalsContact C-N 3.28Å; E510-S512 PolarHBondContact O-N 3.48Å; E510-K513 WeakPolarHBondContact O-CB 3.38Å; E510-K513 PolarHBondContact O-N 3.33Å; E510-D514 PolarHBondContact O-N 3.42Å
511	L	93.4	Very high	92.5	Very high	96 Å²	96	54.3 Å²	54.3	50%	0.503	26%	0.257	S	S	.	.	H	α-helix	trans	-58.3	-39	176.5	-72.8	163.6	0	0	0	112.3	K507 K513 D514 I515	K507-L511 WeakPolarHBondContact O-CB 3.32Å; K507-L511 WeakPolarHBondContact O-CD1 3.41Å; K507-L511 VanDerWaalsContact O-CG 3.27Å; K507-L511 WeakPolarHBondContact O-CG 3.49Å; K507-L511 PolarHBondContact O-N 3.34Å; L511-K513 VanDerWaalsContact C-N 3.32Å; L511-K513 PolarHBondContact O-N 3.12Å; L511-D514 PolarHBondContact O-N 3.41Å; L511-I515 WeakPolarHBondContact O-CB 3.28Å; L511-I515 WeakPolarHBondContact O-CD1 3.26Å; L511-I515 VanDerWaalsContact O-CG1 3.23Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 3.21Å
512	S	93.5	Very high	92.3	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-38.9	177	-66.9	0	0	0	0	112.3	D508 E510 I515 M516 I538	D508-S512 WeakPolarHBondContact O-CB 3.44Å; D508-S512 PolarHBondContact O-N 2.92Å; D508-S512 PolarHBondContact O-OG 2.95Å; E510-S512 VanDerWaalsContact C-N 3.28Å; E510-S512 PolarHBondContact O-N 3.48Å; S512-I515 PolarHBondContact O-N 2.89Å; S512-M516 WeakPolarHBondContact O-CB 3.29Å; S512-M516 VanDerWaalsContact O-CG 3.32Å; S512-M516 WeakPolarHBondContact O-CG 3.4Å; S512-M516 PolarHBondContact O-N 3.5Å; S512-I538 PolarHBondContact OG-N 3.34Å; S512-I538 PolarHBondContact OG-O 3.09Å; S512-I538 VanDerWaalsContact OG-O 3.14Å
513	K	91.3	Very high	91.8	Very high	141 Å²	141	57.7 Å²	57.7	61%	0.613	27%	0.271	S	S	*	.	H	α-helix	trans	-64.4	-44.1	176.4	-70	171.1	-176.8	177.4	0	111.1	M509 E510 L511 M516 I517	M509-K513 WeakPolarHBondContact O-CG 3.39Å; M509-K513 PolarHBondContact O-N 3.23Å; E510-K513 WeakPolarHBondContact O-CB 3.38Å; E510-K513 PolarHBondContact O-N 3.33Å; L511-K513 VanDerWaalsContact C-N 3.32Å; L511-K513 PolarHBondContact O-N 3.12Å; K513-M516 PolarHBondContact O-N 3.44Å; K513-I517 WeakPolarHBondContact O-CG1 3.4Å; K513-I517 PolarHBondContact O-N 3.47Å
514	D	93.7	Very high	91.3	Very high	90 Å²	90	62.6 Å²	62.6	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-44	178.6	-66.1	-21.4	0	0	0	111.8	E510 L511 M516 I517 Q518	E510-D514 PolarHBondContact O-N 3.42Å; L511-D514 PolarHBondContact O-N 3.41Å; D514-M516 VanDerWaalsContact C-N 3.29Å; D514-M516 PolarHBondContact O-N 3.21Å; D514-I517 PolarHBondContact O-N 3.39Å; D514-Q518 WeakPolarHBondContact O-CG 3.46Å; D514-Q518 PolarHBondContact O-N 3.33Å
515	I	94.4	Very high	90.4	Very high	21 Å²	21	69 Å²	69	11%	0.108	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-40.2	175.4	-67.9	166.2	0	0	0	110.5	L511 S512 Q518 F519 F565 F568 Y569	L511-I515 WeakPolarHBondContact O-CB 3.28Å; L511-I515 WeakPolarHBondContact O-CD1 3.26Å; L511-I515 VanDerWaalsContact O-CG1 3.23Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 3.21Å; S512-I515 PolarHBondContact O-N 2.89Å; I515-Q518 PolarHBondContact O-N 3.09Å; I515-F519 WeakPolarHBondContact O-CB 3.41Å; I515-F519 PolarHBondContact O-N 3.1Å; I515-F565 HydrophobicContact CG2-CZ 4.47Å; I515-F568 HydrophobicContact CG2-CE1 4.14Å; I515-Y569 HydrophobicContact CD1-CE2 4.1Å; I515-Y569 HydrophobicContact CG2-CD2 4.36Å
516	M	93.8	Very high	89.4	Confident	10 Å²	10	73.3 Å²	73.3	5%	0.049	35%	0.347	C	S	.	.	H	α-helix	trans	-66.4	-36.7	177.8	-81.6	-54.9	-44.6	0	0	113.2	S512 K513 D514 Q518 F519 K520 L534 T535 V536 F565	S512-M516 WeakPolarHBondContact O-CB 3.29Å; S512-M516 VanDerWaalsContact O-CG 3.32Å; S512-M516 WeakPolarHBondContact O-CG 3.4Å; S512-M516 PolarHBondContact O-N 3.5Å; K513-M516 PolarHBondContact O-N 3.44Å; D514-M516 VanDerWaalsContact C-N 3.29Å; D514-M516 PolarHBondContact O-N 3.21Å; M516-Q518 VanDerWaalsContact C-N 3.33Å; M516-F519 HydrophobicContact CE-CB 4.5Å; M516-F519 HydrophobicContact CE-CD1 3.8Å; M516-F519 PolarHBondContact O-N 2.97Å; M516-F519 HydrophobicContact SD-CD1 4.36Å; M516-K520 HydrophobicContact CE-CG 4.3Å; M516-K520 WeakPolarHBondContact O-CG 3.45Å; M516-K520 PolarHBondContact O-N 2.92Å; M516-L534 VanDerWaalsContact CE-O 3.29Å; M516-L534 WeakPolarHBondContact CE-O 3.26Å; M516-T535 HydrophobicContact CG-CG2 4.33Å; M516-V536 VanDerWaalsContact CG-O 3.27Å; M516-V536 WeakPolarHBondContact CG-O 3.43Å; M516-V536 HydrophobicContact SD-CB 3.87Å; M516-V536 HydrophobicContact SD-CG2 4.13Å; M516-V536 PolarHBondContact SD-N 3.49Å; M516-F565 HydrophobicContact SD-CE2 3.99Å
517	I	92.9	Very high	87.6	Confident	95 Å²	95	78.1 Å²	78.1	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-46.7	173.2	-67.9	163.7	0	0	0	109.8	K513 D514 F519 K520 Q521	K513-I517 WeakPolarHBondContact O-CG1 3.4Å; K513-I517 PolarHBondContact O-N 3.47Å; D514-I517 PolarHBondContact O-N 3.39Å; I517-F519 VanDerWaalsContact C-N 3.33Å; I517-F519 PolarHBondContact O-N 3Å; I517-K520 PolarHBondContact O-N 3.5Å; I517-Q521 WeakPolarHBondContact O-CG 3.31Å; I517-Q521 PolarHBondContact O-N 3.21Å
518	Q	92.4	Very high	86.3	Confident	80 Å²	80	80.6 Å²	80.6	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-36.7	178	-64.5	176.5	28.5	0	0	112.6	D514 I515 M516 Y522 F568	D514-Q518 WeakPolarHBondContact O-CG 3.46Å; D514-Q518 PolarHBondContact O-N 3.33Å; I515-Q518 PolarHBondContact O-N 3.09Å; M516-Q518 VanDerWaalsContact C-N 3.33Å; Q518-Y522 WeakPolarHBondContact O-CB 3.4Å; Q518-Y522 PolarHBondContact O-N 2.66Å; Q518-F568 HydrophobicContact CB-CZ 4Å
519	F	91.4	Very high	84.8	Confident	7 Å²	7	85.9 Å²	85.9	3%	0.031	43%	0.432	C	S	.	.	H	α-helix	trans	-67.5	-43.6	176.4	180	-111.9	0	0	0	111.6	I515 M516 I517 Q521 Y522 M523 L534 V564 F565 F568	I515-F519 WeakPolarHBondContact O-CB 3.41Å; I515-F519 PolarHBondContact O-N 3.1Å; M516-F519 HydrophobicContact CE-CB 4.5Å; M516-F519 HydrophobicContact CE-CD1 3.8Å; M516-F519 PolarHBondContact O-N 2.97Å; M516-F519 HydrophobicContact SD-CD1 4.36Å; I517-F519 VanDerWaalsContact C-N 3.33Å; I517-F519 PolarHBondContact O-N 3Å; F519-Q521 VanDerWaalsContact C-N 3.31Å; F519-Q521 PolarHBondContact O-N 3.49Å; F519-Y522 HydrophobicContact CD2-CD1 4.46Å; F519-Y522 WeakPolarHBondContact O-CB 3.43Å; F519-Y522 PolarHBondContact O-N 3.11Å; F519-Y522 VanDerWaalsContact O-N 3.16Å; F519-M523 HydrophobicContact CD1-CG 4.23Å; F519-M523 HydrophobicContact CD2-CG 4.23Å; F519-M523 HydrophobicContact CE1-CG 3.8Å; F519-M523 HydrophobicContact CE1-SD 4.31Å; F519-M523 HydrophobicContact CE2-CG 3.81Å; F519-M523 HydrophobicContact CE2-SD 3.93Å; F519-M523 HydrophobicContact CG-CG 4.44Å; F519-M523 HydrophobicContact CZ-CG 3.58Å; F519-M523 HydrophobicContact CZ-SD 3.6Å; F519-M523 VanDerWaalsContact O-CG 3.32Å; F519-M523 WeakPolarHBondContact O-CG 3.5Å; F519-M523 PolarHBondContact O-N 3.4Å; F519-L534 HydrophobicContact CE1-CD2 4.39Å; F519-V564 HydrophobicContact CE2-CG1 4.25Å; F519-V564 HydrophobicContact CZ-CG1 4.33Å; F519-F565 HydrophobicContact CB-CE2 4.48Å; F519-F565 AromaticContact CD1-CD2 3.91Å; F519-F565 HydrophobicContact CD1-CD2 3.91Å; F519-F565 HydrophobicContact CD1-CE2 4.47Å; F519-F565 AromaticContact CD2-CD2 3.86Å; F519-F565 HydrophobicContact CD2-CD2 3.86Å; F519-F565 AromaticContact CE1-CD2 4Å; F519-F565 HydrophobicContact CE1-CD2 4Å; F519-F565 HydrophobicContact CE2-CB 4.07Å; F519-F565 AromaticContact CE2-CD2 3.96Å; F519-F565 HydrophobicContact CE2-CD2 3.96Å; F519-F565 HydrophobicContact CE2-CG 4.48Å; F519-F565 AromaticContact CG-CD2 3.82Å; F519-F565 HydrophobicContact CG-CD2 3.82Å; F519-F565 HydrophobicContact CG-CE2 4.23Å; F519-F565 HydrophobicContact CZ-CB 3.94Å; F519-F565 HydrophobicContact CZ-CD2 4.02Å; F519-F565 HydrophobicContact CZ-CG 4.5Å; F519-F568 HydrophobicContact CB-CD1 4.14Å; F519-F568 HydrophobicContact CB-CE1 3.68Å; F519-F568 HydrophobicContact CB-CZ 3.96Å; F519-F568 HydrophobicContact CD2-CB 4.03Å; F519-F568 AromaticContact CD2-CD1 3.55Å; F519-F568 HydrophobicContact CD2-CD1 3.55Å; F519-F568 HydrophobicContact CD2-CD2 4.19Å; F519-F568 AromaticContact CD2-CE1 4Å; F519-F568 HydrophobicContact CD2-CE1 4Å; F519-F568 AromaticContact CD2-CG 3.66Å; F519-F568 HydrophobicContact CD2-CG 3.66Å; F519-F568 HydrophobicContact CD2-CZ 4.47Å; F519-F568 HydrophobicContact CE2-CB 4.18Å; F519-F568 HydrophobicContact CE2-CD1 4.43Å; F519-F568 HydrophobicContact CE2-CG 4.31Å; F519-F568 HydrophobicContact CG-CD1 4.25Å; F519-F568 HydrophobicContact CG-CE1 4.29Å
520	K	89.2	Confident	83.8	Confident	85 Å²	85	88.2 Å²	88.2	37%	0.37	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-41	175.8	-73.4	-173.2	178.1	-163	0	111.4	M516 I517 M523 Q524 E533	M516-K520 HydrophobicContact CE-CG 4.3Å; M516-K520 WeakPolarHBondContact O-CG 3.45Å; M516-K520 PolarHBondContact O-N 2.92Å; I517-K520 PolarHBondContact O-N 3.5Å; K520-M523 PolarHBondContact O-N 2.87Å; K520-Q524 WeakPolarHBondContact O-CG 2.86Å; K520-Q524 PolarHBondContact O-N 3.31Å; K520-E533 IonicContact NZ-OE1 3.81Å; K520-E533 PolarHBondContact NZ-OE1 3.46Å
521	Q	88.9	Confident	83.3	Confident	109 Å²	109	91.3 Å²	91.3	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-64.9	-40.9	173.7	-71.3	173.1	-10.6	0	0	112.7	I517 F519 M523 Q524	I517-Q521 WeakPolarHBondContact O-CG 3.31Å; I517-Q521 PolarHBondContact O-N 3.21Å; F519-Q521 VanDerWaalsContact C-N 3.31Å; F519-Q521 PolarHBondContact O-N 3.49Å; Q521-M523 VanDerWaalsContact C-N 3.32Å; Q521-M523 PolarHBondContact O-N 3.43Å; Q521-Q524 PolarHBondContact O-N 2.93Å
522	Y	86.8	Confident	83	Confident	101 Å²	101	89.7 Å²	89.7	40%	0.396	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-39.6	175	175	-102.3	0	0	0	112	Q518 F519 N525 Q526 F568	Q518-Y522 WeakPolarHBondContact O-CB 3.4Å; Q518-Y522 PolarHBondContact O-N 2.66Å; F519-Y522 HydrophobicContact CD2-CD1 4.46Å; F519-Y522 WeakPolarHBondContact O-CB 3.43Å; F519-Y522 PolarHBondContact O-N 3.11Å; F519-Y522 VanDerWaalsContact O-N 3.16Å; Y522-N525 PolarHBondContact O-N 3.47Å; Y522-Q526 PolarHBondContact OH-NE2 3.47Å; Y522-Q526 VanDerWaalsContact OH-NE2 3.11Å; Y522-F568 HydrophobicContact CD1-CB 4.44Å; Y522-F568 AromaticContact CD1-CD2 3.77Å; Y522-F568 HydrophobicContact CD1-CD2 3.77Å; Y522-F568 HydrophobicContact CD1-CE2 4.45Å; Y522-F568 HydrophobicContact CD1-CG 4.4Å; Y522-F568 HydrophobicContact CD2-CD2 4.29Å; Y522-F568 HydrophobicContact CE1-CB 4.4Å; Y522-F568 HydrophobicContact CE1-CD2 4.32Å; Y522-F568 AromaticContact CG-CD2 3.76Å; Y522-F568 HydrophobicContact CG-CD2 3.76Å; Y522-F568 HydrophobicContact CG-CE2 4.07Å
523	M	84.3	Confident	82.8	Confident	48 Å²	48	97 Å²	97	24%	0.236	50%	0.495	C	S	.	.	H	α-helix	trans	-72.3	-31.8	178.5	-67.2	-80.5	72.4	0	0	113.6	F519 K520 Q521 N525 Q526 V564	F519-M523 HydrophobicContact CD1-CG 4.23Å; F519-M523 HydrophobicContact CD2-CG 4.23Å; F519-M523 HydrophobicContact CE1-CG 3.8Å; F519-M523 HydrophobicContact CE1-SD 4.31Å; F519-M523 HydrophobicContact CE2-CG 3.81Å; F519-M523 HydrophobicContact CE2-SD 3.93Å; F519-M523 HydrophobicContact CG-CG 4.44Å; F519-M523 HydrophobicContact CZ-CG 3.58Å; F519-M523 HydrophobicContact CZ-SD 3.6Å; F519-M523 VanDerWaalsContact O-CG 3.32Å; F519-M523 WeakPolarHBondContact O-CG 3.5Å; F519-M523 PolarHBondContact O-N 3.4Å; K520-M523 PolarHBondContact O-N 2.87Å; Q521-M523 VanDerWaalsContact C-N 3.32Å; Q521-M523 PolarHBondContact O-N 3.43Å; M523-N525 PolarHBondContact O-N 2.9Å; M523-Q526 HydrophobicContact CE-CB 4.18Å; M523-Q526 HydrophobicContact CE-CG 3.76Å; M523-Q526 PolarHBondContact O-N 3.5Å; M523-V564 HydrophobicContact CE-CG1 3.57Å; M523-V564 HydrophobicContact SD-CG1 3.64Å
524	Q	81.2	Confident	82.8	Confident	152 Å²	152	92.3 Å²	92.3	71%	0.71	48%	0.476	S	S	*	.	H	α-helix	trans	-61.1	-24.9	173.3	-76.9	171.7	-4.6	0	0	113	K520 Q521 Q526	K520-Q524 WeakPolarHBondContact O-CG 2.86Å; K520-Q524 PolarHBondContact O-N 3.31Å; Q521-Q524 PolarHBondContact O-N 2.93Å; Q524-Q526 VanDerWaalsContact C-N 3.34Å
525	N	75.4	Confident	82.7	Confident	140 Å²	140	92.2 Å²	92.2	75%	0.749	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.8	178.4	-63.2	-19.2	0	0	0	113.2	Y522 M523	Y522-N525 PolarHBondContact O-N 3.47Å; M523-N525 PolarHBondContact O-N 2.9Å
526	Q	73.1	Confident	82.6	Confident	89 Å²	89	91.5 Å²	91.5	42%	0.416	48%	0.476	S	S	.	.	S	Bend	trans	-98.3	143.3	175	-67.7	-153.5	3.5	0	0	111.5	Y522 M523 Q524 E528	Y522-Q526 PolarHBondContact OH-NE2 3.47Å; Y522-Q526 VanDerWaalsContact OH-NE2 3.11Å; M523-Q526 HydrophobicContact CE-CB 4.18Å; M523-Q526 HydrophobicContact CE-CG 3.76Å; M523-Q526 PolarHBondContact O-N 3.5Å; Q524-Q526 VanDerWaalsContact C-N 3.34Å; Q526-E528 VanDerWaalsContact C-N 3.3Å; Q526-E528 PolarHBondContact O-N 3.25Å
527	S	54.9	Low	82.6	Confident	125 Å²	125	94.1 Å²	94.1	87%	0.874	49%	0.49	S	S	*	.	S	Bend	trans	-75.4	-7.7	-168.7	-41.9	0	0	0	0	115.5
528	E	65.9	Low	82.7	Confident	177 Å²	177	91 Å²	91	83%	0.827	47%	0.474	S	S	*	.			trans	-109.2	112.1	179.4	-72.4	-156.2	166	0	0	112	Q526 S530	Q526-E528 VanDerWaalsContact C-N 3.3Å; Q526-E528 PolarHBondContact O-N 3.25Å; E528-S530 PolarHBondContact O-N 3.2Å
529	P	63.2	Low	82.8	Confident	122 Å²	122	89.5 Å²	89.5	79%	0.792	47%	0.468	S	S	*	.			trans	-71.6	119.4	171.3	26.1	-28.7	0	0	0	110.1
530	S	68.9	Low	82.9	Confident	68 Å²	68	92 Å²	92	48%	0.476	49%	0.485	S	S	.	.			trans	-78.7	138.8	169.9	-174.5	0	0	0	0	110.9	E528 I532	E528-S530 PolarHBondContact O-N 3.2Å; S530-I532 PolarHBondContact O-N 3.14Å; S530-I532 PolarHBondContact OG-N 3.07Å
531	N	80.3	Confident	83	Confident	159 Å²	159	95.3 Å²	95.3	85%	0.85	50%	0.503	S	S	*	.	S	Bend	trans	-77	-5.6	176.7	-68.4	-27.8	0	0	0	113.7
532	I	88.3	Confident	83.1	Confident	63 Å²	63	92.8 Å²	92.8	32%	0.323	51%	0.507	S	S	.	.	S	Bend	trans	-112.1	121.6	-176.9	-56	172.8	0	0	0	109.4	S530 L534 E557 M558 L561	S530-I532 PolarHBondContact O-N 3.14Å; S530-I532 PolarHBondContact OG-N 3.07Å; I532-L534 PolarHBondContact O-N 2.97Å; I532-E557 HydrophobicContact CD1-CB 4.08Å; I532-M558 HydrophobicContact CD1-CG 4.31Å; I532-L561 HydrophobicContact CB-CD1 3.69Å; I532-L561 HydrophobicContact CD1-CD1 4.07Å; I532-L561 HydrophobicContact CG1-CD1 4.38Å; I532-L561 HydrophobicContact CG2-CD1 4.01Å
533	E	88.8	Confident	83.3	Confident	155 Å²	155	92.3 Å²	92.3	72%	0.724	51%	0.505	S	S	*	.			trans	-77.9	106.7	170.5	-171.9	-178.9	-177.2	0	0	110.4	K520	K520-E533 IonicContact NZ-OE1 3.81Å; K520-E533 PolarHBondContact NZ-OE1 3.46Å
534	L	90.6	Very high	83.7	Confident	42 Å²	42	90.5 Å²	90.5	22%	0.22	50%	0.495	C	S	.	.			trans	-90.8	131.5	175.8	-179	66	0	0	0	111.4	M516 F519 I532 V536 L561 F565	M516-L534 VanDerWaalsContact CE-O 3.29Å; M516-L534 WeakPolarHBondContact CE-O 3.26Å; F519-L534 HydrophobicContact CE1-CD2 4.39Å; I532-L534 PolarHBondContact O-N 2.97Å; L534-V536 HydrophobicContact CD1-CG2 3.97Å; L534-V536 HydrophobicContact CD2-CG2 3.71Å; L534-V536 HydrophobicContact CG-CG2 3.69Å; L534-L561 HydrophobicContact CD2-CB 4.26Å; L534-F565 HydrophobicContact CD2-CB 4.28Å
535	T	91.7	Very high	84.1	Confident	88 Å²	88	84.2 Å²	84.2	54%	0.54	47%	0.467	S	S	.	.			trans	-126.5	126.4	164.6	-59.4	0	0	0	0	109	M516	M516-T535 HydrophobicContact CG-CG2 4.33Å
536	V	93.3	Very high	84.6	Confident	7 Å²	7	81.3 Å²	81.3	4%	0.042	46%	0.458	C	S	.	.			trans	-115.8	134.2	-176.5	-170.6	0	0	0	0	109.8	M516 L534 I538 F565 W580	M516-V536 VanDerWaalsContact CG-O 3.27Å; M516-V536 WeakPolarHBondContact CG-O 3.43Å; M516-V536 HydrophobicContact SD-CB 3.87Å; M516-V536 HydrophobicContact SD-CG2 4.13Å; M516-V536 PolarHBondContact SD-N 3.49Å; L534-V536 HydrophobicContact CD1-CG2 3.97Å; L534-V536 HydrophobicContact CD2-CG2 3.71Å; L534-V536 HydrophobicContact CG-CG2 3.69Å; V536-I538 HydrophobicContact CG1-CD1 3.87Å; V536-I538 HydrophobicContact CG1-CG1 4.4Å; V536-F565 HydrophobicContact CB-CD2 4.35Å; V536-F565 HydrophobicContact CB-CE1 4.15Å; V536-F565 HydrophobicContact CB-CE2 3.87Å; V536-F565 HydrophobicContact CB-CZ 3.76Å; V536-F565 HydrophobicContact CG1-CD1 4.29Å; V536-F565 HydrophobicContact CG1-CE1 3.75Å; V536-F565 HydrophobicContact CG1-CE2 4.37Å; V536-F565 HydrophobicContact CG1-CZ 3.77Å; V536-F565 HydrophobicContact CG2-CD1 4.18Å; V536-F565 HydrophobicContact CG2-CD2 3.82Å; V536-F565 HydrophobicContact CG2-CE1 4.26Å; V536-F565 HydrophobicContact CG2-CE2 3.86Å; V536-F565 HydrophobicContact CG2-CG 3.98Å; V536-F565 HydrophobicContact CG2-CZ 4.09Å; V536-W580 HydrophobicContact CG1-CH2 3.78Å; V536-W580 HydrophobicContact CG1-CZ3 3.95Å; V536-W580 HydrophobicContact CG2-CH2 3.85Å; V536-W580 HydrophobicContact CG2-CZ3 4.41Å
537	N	92.9	Very high	85.2	Confident	65 Å²	65	79.9 Å²	79.9	35%	0.348	45%	0.45	S	S	.	.			trans	-105.8	124.1	167.7	-68.3	-50.2	0	0	0	109.1	L473 M509 L539	L473-N537 HydrophobicContact CD2-CB 4.28Å; M509-N537 HydrophobicContact CE-CB 3.94Å; N537-L539 HydrophobicContact CB-CD2 4.09Å
538	I	94.3	Very high	86.7	Confident	28 Å²	28	78.8 Å²	78.8	14%	0.144	44%	0.438	C	S	.	.			trans	-100	122.7	179	-59.5	-66.8	0	0	0	109.1	S512 V536 F565 Y569 L578	S512-I538 PolarHBondContact OG-N 3.34Å; S512-I538 PolarHBondContact OG-O 3.09Å; S512-I538 VanDerWaalsContact OG-O 3.14Å; V536-I538 HydrophobicContact CG1-CD1 3.87Å; V536-I538 HydrophobicContact CG1-CG1 4.4Å; I538-F565 HydrophobicContact CD1-CE1 3.66Å; I538-F565 HydrophobicContact CD1-CZ 3.87Å; I538-F565 HydrophobicContact CG1-CE1 4.38Å; I538-F565 HydrophobicContact CG1-CZ 4.09Å; I538-Y569 HydrophobicContact CB-CE2 4.35Å; I538-Y569 HydrophobicContact CD1-CD2 4.31Å; I538-Y569 HydrophobicContact CD1-CE2 4.23Å; I538-Y569 HydrophobicContact CG1-CD2 4.2Å; I538-Y569 HydrophobicContact CG1-CE2 3.88Å; I538-Y569 HydrophobicContact CG2-CE2 3.87Å; I538-L578 HydrophobicContact CD1-CD2 4.11Å
539	L	94.8	Very high	87.7	Confident	49 Å²	49	73.6 Å²	73.6	26%	0.257	42%	0.419	S	S	.	.			trans	-117.2	132.3	-170	-43.9	-177.1	0	0	0	110	L473 M509 N537 M541 W544 L584	L473-L539 HydrophobicContact CD1-CD1 4.03Å; L473-L539 HydrophobicContact CD2-CD1 4.18Å; L473-L539 HydrophobicContact CD2-CD2 4.02Å; M509-L539 HydrophobicContact CE-CD2 3.34Å; N537-L539 HydrophobicContact CB-CD2 4.09Å; L539-M541 PolarHBondContact O-N 3.2Å; L539-W544 HydrophobicContact CB-CD2 4.11Å; L539-W544 HydrophobicContact CB-CG 4Å; L539-W544 HydrophobicContact CD1-CD2 3.99Å; L539-W544 HydrophobicContact CD1-CE3 4Å; L539-W544 HydrophobicContact CD1-CG 4.44Å; L539-W544 HydrophobicContact CD1-CZ3 4.34Å; L539-W544 HydrophobicContact CD2-CD2 4.26Å; L539-W544 HydrophobicContact CD2-CH2 3.98Å; L539-W544 HydrophobicContact CD2-CZ2 3.62Å; L539-W544 HydrophobicContact CD2-CZ3 4.44Å; L539-W544 HydrophobicContact CG-CD2 4.34Å; L539-L584 HydrophobicContact CD1-CD1 4.38Å
540	T	94.9	Very high	88.9	Confident	61 Å²	61	68.8 Å²	68.8	37%	0.374	39%	0.386	S	S	.	.			trans	-76.7	111.9	175.5	-61	0	0	0	0	109.8	D508 G542 Y543 W544	D508-T540 PolarHBondContact OD1-OG1 3.06Å; D508-T540 VanDerWaalsContact OD2-CB 3.3Å; D508-T540 WeakPolarHBondContact OD2-CB 3.33Å; D508-T540 PolarHBondContact OD2-N 3.36Å; D508-T540 PolarHBondContact OD2-OG1 3.32Å; T540-G542 PolarHBondContact O-N 2.84Å; T540-Y543 HydrophobicContact CG2-CD2 3.88Å; T540-Y543 HydrophobicContact CG2-CE2 4.06Å; T540-Y543 HydrophobicContact CG2-CG 4.36Å; T540-Y543 PolarHBondContact O-N 3.2Å; T540-W544 VanDerWaalsContact O-CD1 3.3Å; T540-W544 PolarHBondContact O-N 2.94Å
541	M	90.9	Very high	89.8	Confident	153 Å²	153	74.2 Å²	74.2	75%	0.754	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-31.9	-171.4	-168.5	179.2	-175.6	0	0	115	L539	L539-M541 PolarHBondContact O-N 3.2Å
542	G	89.7	Confident	90.4	Very high	57 Å²	57	67.7 Å²	67.7	59%	0.588	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.8	179.6	0	0	0	0	0	115.9	T540	T540-G542 PolarHBondContact O-N 2.84Å
543	Y	91.3	Very high	90.7	Very high	90 Å²	90	70.2 Å²	70.2	35%	0.353	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-34	179.3	-64.1	-28.4	0	0	0	112.6	K501 T540	K501-Y543 HydrophobicContact CB-CD1 4.46Å; K501-Y543 HydrophobicContact CG-CD1 4.28Å; T540-Y543 HydrophobicContact CG2-CD2 3.88Å; T540-Y543 HydrophobicContact CG2-CE2 4.06Å; T540-Y543 HydrophobicContact CG2-CG 4.36Å; T540-Y543 PolarHBondContact O-N 3.2Å
544	W	92.9	Very high	90.9	Very high	10 Å²	10	64.4 Å²	64.4	4%	0.038	35%	0.354	C	S	.	.	S	Bend	trans	-87.9	160.7	-174.2	-66.8	74.5	0	0	0	111.8	A469 L472 L473 M505 D508 M509 L539 T540 Y547	A469-W544 HydrophobicContact CB-CE3 3.76Å; A469-W544 HydrophobicContact CB-CZ3 3.78Å; L472-W544 HydrophobicContact CB-CH2 4.32Å; L472-W544 HydrophobicContact CD1-CH2 4.07Å; L473-W544 HydrophobicContact CD1-CE3 4.21Å; L473-W544 HydrophobicContact CD1-CZ3 3.72Å; L473-W544 HydrophobicContact CD2-CH2 4.04Å; L473-W544 HydrophobicContact CD2-CZ3 4.03Å; L473-W544 HydrophobicContact CG-CH2 4.15Å; L473-W544 HydrophobicContact CG-CZ3 3.72Å; M505-W544 HydrophobicContact CB-CD2 4.49Å; M505-W544 HydrophobicContact CB-CH2 4.2Å; M505-W544 HydrophobicContact CB-CZ2 3.68Å; M505-W544 HydrophobicContact CE-CD2 4.24Å; M505-W544 HydrophobicContact CE-CE3 3.82Å; M505-W544 HydrophobicContact CE-CH2 4.17Å; M505-W544 HydrophobicContact CE-CZ3 3.79Å; M505-W544 HydrophobicContact CG-CD2 3.91Å; M505-W544 HydrophobicContact CG-CE3 4.43Å; M505-W544 HydrophobicContact CG-CG 4.21Å; M505-W544 HydrophobicContact CG-CZ2 4.03Å; M505-W544 WeakPolarHBondContact O-CZ2 3.35Å; D508-W544 HydrophobicContact CB-CZ2 4.28Å; D508-W544 PolarHBondContact OD2-NE1 3.26Å; M509-W544 HydrophobicContact CE-CH2 3.76Å; M509-W544 HydrophobicContact CE-CZ2 3.68Å; M509-W544 HydrophobicContact CG-CH2 4.41Å; M509-W544 HydrophobicContact CG-CZ2 4.47Å; M509-W544 HydrophobicContact SD-CH2 4.07Å; M509-W544 HydrophobicContact SD-CZ2 4.43Å; L539-W544 HydrophobicContact CB-CD2 4.11Å; L539-W544 HydrophobicContact CB-CG 4Å; L539-W544 HydrophobicContact CD1-CD2 3.99Å; L539-W544 HydrophobicContact CD1-CE3 4Å; L539-W544 HydrophobicContact CD1-CG 4.44Å; L539-W544 HydrophobicContact CD1-CZ3 4.34Å; L539-W544 HydrophobicContact CD2-CD2 4.26Å; L539-W544 HydrophobicContact CD2-CH2 3.98Å; L539-W544 HydrophobicContact CD2-CZ2 3.62Å; L539-W544 HydrophobicContact CD2-CZ3 4.44Å; L539-W544 HydrophobicContact CG-CD2 4.34Å; T540-W544 VanDerWaalsContact O-CD1 3.3Å; T540-W544 PolarHBondContact O-N 2.94Å; W544-Y547 HydrophobicContact CB-CE2 4.38Å
545	P	90	Very high	91	Very high	20 Å²	20	64.7 Å²	64.7	13%	0.13	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-54.6	147.5	168.6	-23	32.8	0	0	0	111.7	K465 K466 A469 Y547	K465-P545 HydrophobicContact CG-CG 4.31Å; K466-P545 HydrophobicContact CB-CG 4.5Å; A469-P545 HydrophobicContact CB-CG 4.01Å; P545-Y547 HydrophobicContact CB-CE1 4.35Å; P545-Y547 HydrophobicContact CB-CE2 4.34Å; P545-Y547 WeakPolarHBondContact O-CD2 3.2Å; P545-Y547 WeakPolarHBondContact O-CE2 3.26Å; P545-Y547 PolarHBondContact O-N 3.37Å
546	S	86.7	Confident	90.9	Very high	79 Å²	79	64.4 Å²	64.4	55%	0.552	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-74.3	118.9	173.9	-48.3	0	0	0	0	110.2	R698	S546-R698 PolarHBondContact O-NH1 3.32Å
547	Y	85.6	Confident	90.7	Very high	60 Å²	60	69.5 Å²	69.5	24%	0.235	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-102	132.2	176.1	-57.2	-75.7	0	0	0	110	A469 W544 P545 P549 L584	A469-Y547 VanDerWaalsContact CB-OH 3.27Å; A469-Y547 WeakPolarHBondContact CB-OH 3.37Å; W544-Y547 HydrophobicContact CB-CE2 4.38Å; P545-Y547 HydrophobicContact CB-CE1 4.35Å; P545-Y547 HydrophobicContact CB-CE2 4.34Å; P545-Y547 WeakPolarHBondContact O-CD2 3.2Å; P545-Y547 WeakPolarHBondContact O-CE2 3.26Å; P545-Y547 PolarHBondContact O-N 3.37Å; Y547-P549 WeakPolarHBondContact O-CD 3.47Å; Y547-L584 HydrophobicContact CD1-CD1 4.21Å; Y547-L584 HydrophobicContact CD1-CD2 4.1Å; Y547-L584 HydrophobicContact CD1-CG 4.41Å; Y547-L584 HydrophobicContact CD2-CD1 3.81Å; Y547-L584 HydrophobicContact CE1-CD1 4.09Å; Y547-L584 HydrophobicContact CE1-CD2 3.7Å; Y547-L584 HydrophobicContact CE1-CG 4.35Å; Y547-L584 HydrophobicContact CE2-CD1 3.66Å; Y547-L584 HydrophobicContact CG-CD1 4.08Å
548	T	85.5	Confident	90.7	Very high	102 Å²	102	68.6 Å²	68.6	63%	0.626	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-71.4	120.8	173.3	-51.3	0	0	0	0	108.5
549	P	86.9	Confident	90.6	Very high	67 Å²	67	70.1 Å²	70.1	44%	0.435	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-62.6	137.2	173.8	-16.9	30.6	0	0	0	109.7	Y547	Y547-P549 WeakPolarHBondContact O-CD 3.47Å
550	M	87.7	Confident	90.4	Very high	22 Å²	22	74.6 Å²	74.6	11%	0.108	41%	0.406	C	S	.	.			trans	-122.5	133.8	172.3	-172.6	170.1	75.7	0	0	108.4	V552 P582 F605 I630 E631	M550-V552 HydrophobicContact CE-CG1 3.59Å; M550-V552 HydrophobicContact CG-CG1 4.37Å; M550-P582 WeakPolarHBondContact O-CG 3.15Å; M550-F605 HydrophobicContact CE-CD1 3.76Å; M550-F605 HydrophobicContact CE-CD2 4.35Å; M550-F605 HydrophobicContact CE-CE1 3.03Å; M550-F605 HydrophobicContact CE-CE2 3.72Å; M550-F605 HydrophobicContact CE-CG 4.4Å; M550-F605 HydrophobicContact CE-CZ 3.01Å; M550-F605 HydrophobicContact SD-CZ 4.49Å; M550-I630 HydrophobicContact CE-CG2 4.04Å; M550-E631 HydrophobicContact CG-CG 4.34Å; M550-E631 HydrophobicContact SD-CB 4.03Å; M550-E631 HydrophobicContact SD-CG 3.87Å
551	E	89	Confident	90.2	Very high	181 Å²	181	72.7 Å²	72.7	85%	0.846	39%	0.393	S	S	*	.			trans	-81.9	132.2	173.5	-63.9	-167.4	167.1	0	0	109.2
552	V	93.6	Very high	90.3	Very high	23 Å²	23	67.2 Å²	67.2	14%	0.139	37%	0.366	C	S	.	.			trans	-139.6	149	177.9	-64	0	0	0	0	109.5	M550 L554 P582 F605 L608 I630	M550-V552 HydrophobicContact CE-CG1 3.59Å; M550-V552 HydrophobicContact CG-CG1 4.37Å; V552-L554 HydrophobicContact CG2-CD2 3.95Å; V552-L554 HydrophobicContact CG2-CG 4.21Å; V552-L554 PolarHBondContact O-N 3Å; V552-P582 HydrophobicContact CG1-CB 4.42Å; V552-P582 HydrophobicContact CG2-CB 3.84Å; V552-P582 HydrophobicContact CG2-CG 3.79Å; V552-F605 HydrophobicContact CG1-CD1 4.29Å; V552-F605 HydrophobicContact CG1-CE1 3.94Å; V552-L608 HydrophobicContact CB-CD1 3.85Å; V552-L608 HydrophobicContact CG1-CD1 4.48Å; V552-L608 HydrophobicContact CG2-CD1 4.07Å; V552-I630 HydrophobicContact CG1-CG1 4.25Å
553	H	93.8	Very high	90.4	Very high	116 Å²	116	68.3 Å²	68.3	54%	0.537	36%	0.355	S	S	.	.			trans	-83.2	102.6	177.4	-57.5	140.4	0	0	0	110.1	L608 A627 T628	H553-L608 WeakPolarHBondContact O-CD2 3.36Å; H553-A627 WeakPolarHBondContact CB-O 3.32Å; H553-A627 PolarHBondContact ND1-O 3.46Å; H553-T628 PolarHBondContact N-O 3.37Å
554	L	93.1	Very high	90.4	Very high	32 Å²	32	66.2 Å²	66.2	17%	0.168	35%	0.352	C	S	.	.			trans	-85.5	142.1	176	-63.3	178.5	0	0	0	111	V552 M558 V559 Q562 L604 L608	V552-L554 HydrophobicContact CG2-CD2 3.95Å; V552-L554 HydrophobicContact CG2-CG 4.21Å; V552-L554 PolarHBondContact O-N 3Å; L554-M558 HydrophobicContact CB-CB 4.41Å; L554-V559 HydrophobicContact CB-CG2 3.74Å; L554-Q562 VanDerWaalsContact CD1-OE1 3.23Å; L554-L604 HydrophobicContact CD2-CD1 4.11Å; L554-L604 HydrophobicContact CD2-CD2 4.18Å; L554-L604 HydrophobicContact CD2-CG 4.41Å; L554-L608 HydrophobicContact CD2-CD1 4.37Å; L554-L608 HydrophobicContact CD2-CD2 4.09Å
555	P	92.4	Very high	90.4	Very high	48 Å²	48	65.7 Å²	65.7	31%	0.312	35%	0.35	S	S	.	.			trans	-54.3	146.2	169.8	-25	32.7	0	0	0	111.9	E557 M558 V559 L608 L611	P555-E557 PolarHBondContact O-N 3.32Å; P555-E557 VanDerWaalsContact O-N 3.13Å; P555-M558 HydrophobicContact CB-CG 4.44Å; P555-M558 HydrophobicContact CG-CG 4.49Å; P555-M558 HydrophobicContact CG-SD 4.15Å; P555-M558 WeakPolarHBondContact O-CB 3.36Å; P555-M558 PolarHBondContact O-N 3.17Å; P555-V559 PolarHBondContact O-N 3.21Å; P555-V559 VanDerWaalsContact O-N 3.12Å; P555-L608 HydrophobicContact CG-CD2 4.4Å; P555-L611 HydrophobicContact CG-CD1 3.82Å
556	S	90.1	Very high	90.5	Very high	83 Å²	83	67.8 Å²	67.8	58%	0.58	36%	0.357	S	S	*	.	H	α-helix	trans	-56.1	-35.1	-175.2	62.4	0	0	0	0	113.2	V559 K560	S556-V559 PolarHBondContact O-N 3.32Å; S556-K560 WeakPolarHBondContact O-CG 3.28Å; S556-K560 PolarHBondContact O-N 2.89Å
557	E	89.3	Confident	90.8	Very high	114 Å²	114	69.9 Å²	69.9	53%	0.533	36%	0.361	S	S	.	.	H	α-helix	trans	-62.5	-41.4	174.8	-62.5	-173.2	175.1	0	0	112.7	I532 P555 L561	I532-E557 HydrophobicContact CD1-CB 4.08Å; P555-E557 PolarHBondContact O-N 3.32Å; P555-E557 VanDerWaalsContact O-N 3.13Å; E557-L561 PolarHBondContact O-N 2.81Å
558	M	92.1	Very high	91.2	Very high	45 Å²	45	67.8 Å²	67.8	22%	0.222	35%	0.353	C	S	.	.	H	α-helix	trans	-69.7	-39.1	178.3	-63.9	-173.8	70.6	0	0	111.4	I532 L554 P555 L561 Q562 L604	I532-M558 HydrophobicContact CD1-CG 4.31Å; L554-M558 HydrophobicContact CB-CB 4.41Å; P555-M558 HydrophobicContact CB-CG 4.44Å; P555-M558 HydrophobicContact CG-CG 4.49Å; P555-M558 HydrophobicContact CG-SD 4.15Å; P555-M558 WeakPolarHBondContact O-CB 3.36Å; P555-M558 PolarHBondContact O-N 3.17Å; M558-L561 PolarHBondContact O-N 3.11Å; M558-Q562 WeakPolarHBondContact O-CG 3.28Å; M558-Q562 PolarHBondContact O-N 3.03Å; M558-L604 HydrophobicContact CE-CD1 3.71Å
559	V	92.6	Very high	91.6	Very high	61 Å²	61	63.2 Å²	63.2	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-44.2	176.6	177.9	0	0	0	0	110.9	L554 P555 S556 L561 Q562 E563	L554-V559 HydrophobicContact CB-CG2 3.74Å; P555-V559 PolarHBondContact O-N 3.21Å; P555-V559 VanDerWaalsContact O-N 3.12Å; S556-V559 PolarHBondContact O-N 3.32Å; V559-L561 VanDerWaalsContact C-N 3.33Å; V559-L561 PolarHBondContact O-N 3.28Å; V559-Q562 PolarHBondContact O-N 3.25Å; V559-E563 PolarHBondContact O-N 3.38Å
560	K	90.9	Very high	91.9	Very high	143 Å²	143	62.8 Å²	62.8	62%	0.622	32%	0.319	S	S	*	.	H	α-helix	trans	-56.2	-47.5	175.2	-73.4	172.9	-176.2	-179.6	0	111.4	S556 Q562 E563 V564	S556-K560 WeakPolarHBondContact O-CG 3.28Å; S556-K560 PolarHBondContact O-N 2.89Å; K560-Q562 PolarHBondContact O-N 3.01Å; K560-E563 PolarHBondContact O-N 3.37Å; K560-V564 VanDerWaalsContact O-CG2 3.3Å; K560-V564 WeakPolarHBondContact O-CG2 3.43Å; K560-V564 PolarHBondContact O-N 2.96Å
561	L	90.4	Very high	92.2	Very high	21 Å²	21	65.1 Å²	65.1	11%	0.11	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-39.6	178.5	-73.6	171	0	0	0	112.9	I532 L534 E557 M558 V559 F565	I532-L561 HydrophobicContact CB-CD1 3.69Å; I532-L561 HydrophobicContact CD1-CD1 4.07Å; I532-L561 HydrophobicContact CG1-CD1 4.38Å; I532-L561 HydrophobicContact CG2-CD1 4.01Å; L534-L561 HydrophobicContact CD2-CB 4.26Å; E557-L561 PolarHBondContact O-N 2.81Å; M558-L561 PolarHBondContact O-N 3.11Å; V559-L561 VanDerWaalsContact C-N 3.33Å; V559-L561 PolarHBondContact O-N 3.28Å; L561-F565 WeakPolarHBondContact O-CB 3.47Å; L561-F565 PolarHBondContact O-N 2.72Å
562	Q	92.4	Very high	92.3	Very high	37 Å²	37	61.5 Å²	61.5	17%	0.173	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-42.3	175	-76.6	-173	-26.1	0	0	112.1	L554 M558 V559 K560 K566 W580	L554-Q562 VanDerWaalsContact CD1-OE1 3.23Å; M558-Q562 WeakPolarHBondContact O-CG 3.28Å; M558-Q562 PolarHBondContact O-N 3.03Å; V559-Q562 PolarHBondContact O-N 3.25Å; K560-Q562 PolarHBondContact O-N 3.01Å; Q562-K566 WeakPolarHBondContact O-CB 3.31Å; Q562-K566 PolarHBondContact O-N 3.15Å; Q562-W580 HydrophobicContact CB-CZ2 3.88Å; Q562-W580 HydrophobicContact CG-CD2 4.21Å; Q562-W580 HydrophobicContact CG-CH2 4.03Å; Q562-W580 HydrophobicContact CG-CZ2 3.69Å; Q562-W580 HydrophobicContact CG-CZ3 4.42Å
563	E	91.6	Very high	92.2	Very high	80 Å²	80	62.9 Å²	62.9	37%	0.374	33%	0.334	S	S	.	.	H	α-helix	trans	-70.7	-40.7	178.7	-74.2	-58.4	151.9	0	0	112.4	V559 K560 F565 K566 L567	V559-E563 PolarHBondContact O-N 3.38Å; K560-E563 PolarHBondContact O-N 3.37Å; E563-F565 VanDerWaalsContact C-N 3.34Å; E563-F565 PolarHBondContact O-N 2.57Å; E563-K566 VanDerWaalsContact CD-NZ 3.28Å; E563-K566 PolarHBondContact O-N 3.01Å; E563-K566 IonicContact OE1-NZ 3.2Å; E563-K566 PolarHBondContact OE1-NZ 3.05Å; E563-K566 WeakPolarHBondContact OE2-CD 3.47Å; E563-K566 IonicContact OE2-NZ 3.03Å; E563-K566 PolarHBondContact OE2-NZ 3.35Å; E563-L567 WeakPolarHBondContact O-CG 3.47Å; E563-L567 PolarHBondContact O-N 2.64Å
564	V	91.7	Very high	92	Very high	46 Å²	46	62.6 Å²	62.6	28%	0.279	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-46	174.1	171.2	0	0	0	0	110.9	F519 M523 K560 F568	F519-V564 HydrophobicContact CE2-CG1 4.25Å; F519-V564 HydrophobicContact CZ-CG1 4.33Å; M523-V564 HydrophobicContact CE-CG1 3.57Å; M523-V564 HydrophobicContact SD-CG1 3.64Å; K560-V564 VanDerWaalsContact O-CG2 3.3Å; K560-V564 WeakPolarHBondContact O-CG2 3.43Å; K560-V564 PolarHBondContact O-N 2.96Å; V564-F568 PolarHBondContact O-N 3.33Å; V564-F568 VanDerWaalsContact O-N 3.1Å
565	F	92.9	Very high	91.9	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.7	-42.5	175.4	178.8	-88.3	0	0	0	112	I515 M516 F519 L534 V536 I538 L561 E563 F568 Y569 W580	I515-F565 HydrophobicContact CG2-CZ 4.47Å; M516-F565 HydrophobicContact SD-CE2 3.99Å; F519-F565 HydrophobicContact CB-CE2 4.48Å; F519-F565 AromaticContact CD1-CD2 3.91Å; F519-F565 HydrophobicContact CD1-CD2 3.91Å; F519-F565 HydrophobicContact CD1-CE2 4.47Å; F519-F565 AromaticContact CD2-CD2 3.86Å; F519-F565 HydrophobicContact CD2-CD2 3.86Å; F519-F565 AromaticContact CE1-CD2 4Å; F519-F565 HydrophobicContact CE1-CD2 4Å; F519-F565 HydrophobicContact CE2-CB 4.07Å; F519-F565 AromaticContact CE2-CD2 3.96Å; F519-F565 HydrophobicContact CE2-CD2 3.96Å; F519-F565 HydrophobicContact CE2-CG 4.48Å; F519-F565 AromaticContact CG-CD2 3.82Å; F519-F565 HydrophobicContact CG-CD2 3.82Å; F519-F565 HydrophobicContact CG-CE2 4.23Å; F519-F565 HydrophobicContact CZ-CB 3.94Å; F519-F565 HydrophobicContact CZ-CD2 4.02Å; F519-F565 HydrophobicContact CZ-CG 4.5Å; L534-F565 HydrophobicContact CD2-CB 4.28Å; V536-F565 HydrophobicContact CB-CD2 4.35Å; V536-F565 HydrophobicContact CB-CE1 4.15Å; V536-F565 HydrophobicContact CB-CE2 3.87Å; V536-F565 HydrophobicContact CB-CZ 3.76Å; V536-F565 HydrophobicContact CG1-CD1 4.29Å; V536-F565 HydrophobicContact CG1-CE1 3.75Å; V536-F565 HydrophobicContact CG1-CE2 4.37Å; V536-F565 HydrophobicContact CG1-CZ 3.77Å; V536-F565 HydrophobicContact CG2-CD1 4.18Å; V536-F565 HydrophobicContact CG2-CD2 3.82Å; V536-F565 HydrophobicContact CG2-CE1 4.26Å; V536-F565 HydrophobicContact CG2-CE2 3.86Å; V536-F565 HydrophobicContact CG2-CG 3.98Å; V536-F565 HydrophobicContact CG2-CZ 4.09Å; I538-F565 HydrophobicContact CD1-CE1 3.66Å; I538-F565 HydrophobicContact CD1-CZ 3.87Å; I538-F565 HydrophobicContact CG1-CE1 4.38Å; I538-F565 HydrophobicContact CG1-CZ 4.09Å; L561-F565 WeakPolarHBondContact O-CB 3.47Å; L561-F565 PolarHBondContact O-N 2.72Å; E563-F565 VanDerWaalsContact C-N 3.34Å; E563-F565 PolarHBondContact O-N 2.57Å; F565-F568 WeakPolarHBondContact O-CB 3.38Å; F565-F568 PolarHBondContact O-N 3.37Å; F565-Y569 HydrophobicContact CE1-CD2 4.43Å; F565-Y569 HydrophobicContact CZ-CD2 4.33Å; F565-Y569 WeakPolarHBondContact O-CB 3.33Å; F565-Y569 PolarHBondContact O-N 2.84Å; F565-W580 HydrophobicContact CD1-CH2 4.24Å; F565-W580 HydrophobicContact CD1-CZ2 4.05Å
566	K	93.1	Very high	91.9	Very high	64 Å²	64	69.8 Å²	69.8	28%	0.278	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-43.5	179.4	173.1	172.1	155	-137.9	0	112	Q562 E563 Y569 L570 L578	Q562-K566 WeakPolarHBondContact O-CB 3.31Å; Q562-K566 PolarHBondContact O-N 3.15Å; E563-K566 VanDerWaalsContact CD-NZ 3.28Å; E563-K566 PolarHBondContact O-N 3.01Å; E563-K566 IonicContact OE1-NZ 3.2Å; E563-K566 PolarHBondContact OE1-NZ 3.05Å; E563-K566 WeakPolarHBondContact OE2-CD 3.47Å; E563-K566 IonicContact OE2-NZ 3.03Å; E563-K566 PolarHBondContact OE2-NZ 3.35Å; K566-Y569 PolarHBondContact O-N 2.95Å; K566-L570 HydrophobicContact CG-CD1 3.82Å; K566-L570 HydrophobicContact CG-CG 4.41Å; K566-L570 WeakPolarHBondContact O-CB 3.3Å; K566-L570 VanDerWaalsContact O-CG 3.27Å; K566-L570 WeakPolarHBondContact O-CG 3.25Å; K566-L570 PolarHBondContact O-N 2.73Å; K566-L578 HydrophobicContact CB-CD1 4.33Å; K566-L578 HydrophobicContact CG-CD1 4.28Å
567	L	92	Very high	92	Very high	123 Å²	123	75.2 Å²	75.2	64%	0.644	41%	0.406	S	S	*	.	H	α-helix	trans	-62.1	-45.2	174.6	-71.4	172	0	0	0	111.6	E563 Y569 G571	E563-L567 WeakPolarHBondContact O-CG 3.47Å; E563-L567 PolarHBondContact O-N 2.64Å; L567-Y569 PolarHBondContact O-N 3.01Å; L567-G571 PolarHBondContact O-N 3.08Å
568	F	93.4	Very high	92.2	Very high	15 Å²	15	71.6 Å²	71.6	7%	0.066	39%	0.39	C	S	.	.	H	α-helix	trans	-58.1	-48	174.8	165	-95.6	0	0	0	112	I515 Q518 F519 Y522 V564 F565 G571 K572	I515-F568 HydrophobicContact CG2-CE1 4.14Å; Q518-F568 HydrophobicContact CB-CZ 4Å; F519-F568 HydrophobicContact CB-CD1 4.14Å; F519-F568 HydrophobicContact CB-CE1 3.68Å; F519-F568 HydrophobicContact CB-CZ 3.96Å; F519-F568 HydrophobicContact CD2-CB 4.03Å; F519-F568 AromaticContact CD2-CD1 3.55Å; F519-F568 HydrophobicContact CD2-CD1 3.55Å; F519-F568 HydrophobicContact CD2-CD2 4.19Å; F519-F568 AromaticContact CD2-CE1 4Å; F519-F568 HydrophobicContact CD2-CE1 4Å; F519-F568 AromaticContact CD2-CG 3.66Å; F519-F568 HydrophobicContact CD2-CG 3.66Å; F519-F568 HydrophobicContact CD2-CZ 4.47Å; F519-F568 HydrophobicContact CE2-CB 4.18Å; F519-F568 HydrophobicContact CE2-CD1 4.43Å; F519-F568 HydrophobicContact CE2-CG 4.31Å; F519-F568 HydrophobicContact CG-CD1 4.25Å; F519-F568 HydrophobicContact CG-CE1 4.29Å; Y522-F568 HydrophobicContact CD1-CB 4.44Å; Y522-F568 AromaticContact CD1-CD2 3.77Å; Y522-F568 HydrophobicContact CD1-CD2 3.77Å; Y522-F568 HydrophobicContact CD1-CE2 4.45Å; Y522-F568 HydrophobicContact CD1-CG 4.4Å; Y522-F568 HydrophobicContact CD2-CD2 4.29Å; Y522-F568 HydrophobicContact CE1-CB 4.4Å; Y522-F568 HydrophobicContact CE1-CD2 4.32Å; Y522-F568 AromaticContact CG-CD2 3.76Å; Y522-F568 HydrophobicContact CG-CD2 3.76Å; Y522-F568 HydrophobicContact CG-CE2 4.07Å; V564-F568 PolarHBondContact O-N 3.33Å; V564-F568 VanDerWaalsContact O-N 3.1Å; F565-F568 WeakPolarHBondContact O-CB 3.38Å; F565-F568 PolarHBondContact O-N 3.37Å; F568-G571 PolarHBondContact O-N 2.66Å; F568-K572 HydrophobicContact CE2-CD 3.98Å; F568-K572 HydrophobicContact CZ-CD 3.92Å; F568-K572 PolarHBondContact O-N 3.32Å
569	Y	94.4	Very high	92.3	Very high	6 Å²	6	74.7 Å²	74.7	2%	0.024	40%	0.404	C	S	.	.	H	α-helix	trans	-66.1	-48.4	-177.3	-175.6	-87.8	0	0	0	111.7	I515 I538 F565 K566 L567 G571 K572 H573 R576 L578	I515-Y569 HydrophobicContact CD1-CE2 4.1Å; I515-Y569 HydrophobicContact CG2-CD2 4.36Å; I538-Y569 HydrophobicContact CB-CE2 4.35Å; I538-Y569 HydrophobicContact CD1-CD2 4.31Å; I538-Y569 HydrophobicContact CD1-CE2 4.23Å; I538-Y569 HydrophobicContact CG1-CD2 4.2Å; I538-Y569 HydrophobicContact CG1-CE2 3.88Å; I538-Y569 HydrophobicContact CG2-CE2 3.87Å; F565-Y569 HydrophobicContact CE1-CD2 4.43Å; F565-Y569 HydrophobicContact CZ-CD2 4.33Å; F565-Y569 WeakPolarHBondContact O-CB 3.33Å; F565-Y569 PolarHBondContact O-N 2.84Å; K566-Y569 PolarHBondContact O-N 2.95Å; L567-Y569 PolarHBondContact O-N 3.01Å; Y569-G571 VanDerWaalsContact C-N 3.3Å; Y569-G571 PolarHBondContact O-N 2.57Å; Y569-K572 PolarHBondContact O-N 2.83Å; Y569-H573 HydrophobicContact CD1-CB 4.35Å; Y569-H573 AromaticContact CD2-CD2 3.81Å; Y569-H573 HydrophobicContact CE1-CB 3.94Å; Y569-H573 AromaticContact CE2-CD2 3.57Å; Y569-H573 AromaticContact CZ-CD2 3.75Å; Y569-H573 WeakPolarHBondContact O-CB 3.3Å; Y569-H573 PolarHBondContact O-N 2.8Å; Y569-R576 HydrophobicContact CE1-CB 4.35Å; Y569-R576 PolarHBondContact OH-NH1 3.07Å; Y569-L578 HydrophobicContact CD1-CD1 3.72Å; Y569-L578 HydrophobicContact CD1-CD2 3.78Å; Y569-L578 HydrophobicContact CD1-CG 3.9Å; Y569-L578 HydrophobicContact CE1-CD1 4.48Å; Y569-L578 HydrophobicContact CE1-CD2 3.68Å; Y569-L578 HydrophobicContact CE1-CG 4.23Å; Y569-L578 HydrophobicContact CG-CD1 3.99Å; Y569-L578 HydrophobicContact CG-CD2 4.45Å
570	L	94.3	Very high	92.3	Very high	59 Å²	59	75.7 Å²	75.7	31%	0.309	40%	0.401	S	S	.	.	H	α-helix	trans	-68.6	-29.8	-179.5	-66.2	177.3	0	0	0	112.4	K566 K572 H573 R576	K566-L570 HydrophobicContact CG-CD1 3.82Å; K566-L570 HydrophobicContact CG-CG 4.41Å; K566-L570 WeakPolarHBondContact O-CB 3.3Å; K566-L570 VanDerWaalsContact O-CG 3.27Å; K566-L570 WeakPolarHBondContact O-CG 3.25Å; K566-L570 PolarHBondContact O-N 2.73Å; L570-K572 VanDerWaalsContact C-N 3.32Å; L570-K572 PolarHBondContact O-N 3.33Å; L570-H573 CarbonylContact O-C 3.6Å; L570-R576 WeakPolarHBondContact CD2-O 3.34Å
571	G	92.1	Very high	92.4	Very high	70 Å²	70	70.8 Å²	70.8	72%	0.722	38%	0.38	S	S	*	.	H	α-helix	trans	-65	-33.5	173.2	0	0	0	0	0	113.3	L567 F568 Y569	L567-G571 PolarHBondContact O-N 3.08Å; F568-G571 PolarHBondContact O-N 2.66Å; Y569-G571 VanDerWaalsContact C-N 3.3Å; Y569-G571 PolarHBondContact O-N 2.57Å
572	K	91.3	Very high	92.4	Very high	106 Å²	106	70.6 Å²	70.6	46%	0.461	38%	0.38	S	S	.	.	H	α-helix	trans	-90.4	-29.3	176.3	-72.2	-171.5	171.6	-178	0	113.9	F568 Y569 L570	F568-K572 HydrophobicContact CE2-CD 3.98Å; F568-K572 HydrophobicContact CZ-CD 3.92Å; F568-K572 PolarHBondContact O-N 3.32Å; Y569-K572 PolarHBondContact O-N 2.83Å; L570-K572 VanDerWaalsContact C-N 3.32Å; L570-K572 PolarHBondContact O-N 3.33Å
573	H	91.4	Very high	92.1	Very high	52 Å²	52	71.4 Å²	71.4	24%	0.241	39%	0.388	C	S	.	.	S	Bend	trans	-120.9	80	-175.5	-61.2	-72.5	0	0	0	110.7	Y569 L570 R576	Y569-H573 HydrophobicContact CD1-CB 4.35Å; Y569-H573 AromaticContact CD2-CD2 3.81Å; Y569-H573 HydrophobicContact CE1-CB 3.94Å; Y569-H573 AromaticContact CE2-CD2 3.57Å; Y569-H573 AromaticContact CZ-CD2 3.75Å; Y569-H573 WeakPolarHBondContact O-CB 3.3Å; Y569-H573 PolarHBondContact O-N 2.8Å; L570-H573 CarbonylContact O-C 3.6Å; H573-R576 HydrophobicContact CB-CG 4.35Å
574	S	90.1	Very high	91.9	Very high	110 Å²	110	69.7 Å²	69.7	77%	0.769	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	148	178.2	54.8	0	0	0	0	112.3	R576	S574-R576 VanDerWaalsContact C-N 3.32Å; S574-R576 PolarHBondContact O-N 3.1Å
575	G	90.4	Very high	91.7	Very high	92 Å²	92	68.5 Å²	68.5	95%	0.948	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	8.9	178.8	0	0	0	0	0	115.5
576	R	93.8	Very high	91.6	Very high	139 Å²	139	72.5 Å²	72.5	53%	0.525	40%	0.397	S	S	.	.			trans	-103.1	157.1	176.5	-59.3	-166.5	-176.7	-172.5	-3.9	112	Y569 L570 H573 S574	Y569-R576 HydrophobicContact CE1-CB 4.35Å; Y569-R576 PolarHBondContact OH-NH1 3.07Å; L570-R576 WeakPolarHBondContact CD2-O 3.34Å; H573-R576 HydrophobicContact CB-CG 4.35Å; S574-R576 VanDerWaalsContact C-N 3.32Å; S574-R576 PolarHBondContact O-N 3.1Å
577	K	92.4	Very high	91.5	Very high	196 Å²	196	70.7 Å²	70.7	85%	0.852	39%	0.394	S	S	*	.			trans	-123.2	134.8	170.6	-175.7	179.2	179.4	-178.1	0	108.9
578	L	93.6	Very high	91.5	Very high	38 Å²	38	67.9 Å²	67.9	20%	0.199	38%	0.382	C	S	.	.			trans	-98	144.3	174.3	-66.7	-179.4	0	0	0	110.6	I538 K566 Y569	I538-L578 HydrophobicContact CD1-CD2 4.11Å; K566-L578 HydrophobicContact CB-CD1 4.33Å; K566-L578 HydrophobicContact CG-CD1 4.28Å; Y569-L578 HydrophobicContact CD1-CD1 3.72Å; Y569-L578 HydrophobicContact CD1-CD2 3.78Å; Y569-L578 HydrophobicContact CD1-CG 3.9Å; Y569-L578 HydrophobicContact CE1-CD1 4.48Å; Y569-L578 HydrophobicContact CE1-CD2 3.68Å; Y569-L578 HydrophobicContact CE1-CG 4.23Å; Y569-L578 HydrophobicContact CG-CD1 3.99Å; Y569-L578 HydrophobicContact CG-CD2 4.45Å
579	Q	93.6	Very high	91.5	Very high	110 Å²	110	68.8 Å²	68.8	51%	0.514	39%	0.387	S	S	.	.			trans	-135.7	116.2	171.4	-175.9	177.4	41.3	0	0	108.2
580	W	92.8	Very high	91.5	Very high	82 Å²	82	77 Å²	77	31%	0.311	42%	0.423	S	S	.	.			trans	-74.3	143.6	178.1	-71.4	98.3	0	0	0	110.8	V536 Q562 F565 P582	V536-W580 HydrophobicContact CG1-CH2 3.78Å; V536-W580 HydrophobicContact CG1-CZ3 3.95Å; V536-W580 HydrophobicContact CG2-CH2 3.85Å; V536-W580 HydrophobicContact CG2-CZ3 4.41Å; Q562-W580 HydrophobicContact CB-CZ2 3.88Å; Q562-W580 HydrophobicContact CG-CD2 4.21Å; Q562-W580 HydrophobicContact CG-CH2 4.03Å; Q562-W580 HydrophobicContact CG-CZ2 3.69Å; Q562-W580 HydrophobicContact CG-CZ3 4.42Å; F565-W580 HydrophobicContact CD1-CH2 4.24Å; F565-W580 HydrophobicContact CD1-CZ2 4.05Å; W580-P582 WeakPolarHBondContact O-CD 3.38Å
581	Q	92.4	Very high	91.4	Very high	41 Å²	41	74.9 Å²	74.9	19%	0.192	41%	0.414	C	S	.	.			trans	-121.9	89.5	-178.3	-69.9	-66.8	-17.2	0	0	110.1	T583 L584	Q581-T583 PolarHBondContact O-N 3.35Å; Q581-L584 HydrophobicContact CB-CD1 4.1Å; Q581-L584 HydrophobicContact CB-CG 4.4Å; Q581-L584 PolarHBondContact O-N 2.69Å
582	P	90.1	Very high	91.3	Very high	16 Å²	16	77.7 Å²	77.7	10%	0.104	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-57.1	-33.3	-175.9	-31.3	40.2	0	0	0	114.4	M550 V552 W580 L584 G585 L604 F605	M550-P582 WeakPolarHBondContact O-CG 3.15Å; V552-P582 HydrophobicContact CG1-CB 4.42Å; V552-P582 HydrophobicContact CG2-CB 3.84Å; V552-P582 HydrophobicContact CG2-CG 3.79Å; W580-P582 WeakPolarHBondContact O-CD 3.38Å; P582-L584 PolarHBondContact O-N 2.9Å; P582-L584 VanDerWaalsContact O-N 3.14Å; P582-G585 PolarHBondContact O-N 3.02Å; P582-L604 HydrophobicContact CB-CD2 3.8Å; P582-F605 HydrophobicContact CB-CE1 3.73Å; P582-F605 HydrophobicContact CB-CZ 4.24Å
583	T	86.4	Confident	91.2	Very high	54 Å²	54	73.4 Å²	73.4	33%	0.331	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.3	-26.3	179.8	-44	0	0	0	0	113.9	Q581 F605	Q581-T583 PolarHBondContact O-N 3.35Å; T583-F605 VanDerWaalsContact CA-CZ 3.46Å; T583-F605 HydrophobicContact CG2-CE2 4.31Å; T583-F605 HydrophobicContact CG2-CZ 4.49Å
584	L	87.3	Confident	90.9	Very high	44 Å²	44	78.1 Å²	78.1	23%	0.23	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-96.9	-7.6	-179.9	-56.4	175.1	0	0	0	112.5	L473 L539 Y547 Q581 P582	L473-L584 HydrophobicContact CD1-CB 4.4Å; L473-L584 HydrophobicContact CD1-CD1 3.82Å; L473-L584 HydrophobicContact CD1-CD2 4.16Å; L473-L584 HydrophobicContact CD1-CG 4.35Å; L539-L584 HydrophobicContact CD1-CD1 4.38Å; Y547-L584 HydrophobicContact CD1-CD1 4.21Å; Y547-L584 HydrophobicContact CD1-CD2 4.1Å; Y547-L584 HydrophobicContact CD1-CG 4.41Å; Y547-L584 HydrophobicContact CD2-CD1 3.81Å; Y547-L584 HydrophobicContact CE1-CD1 4.09Å; Y547-L584 HydrophobicContact CE1-CD2 3.7Å; Y547-L584 HydrophobicContact CE1-CG 4.35Å; Y547-L584 HydrophobicContact CE2-CD1 3.66Å; Y547-L584 HydrophobicContact CG-CD1 4.08Å; Q581-L584 HydrophobicContact CB-CD1 4.1Å; Q581-L584 HydrophobicContact CB-CG 4.4Å; Q581-L584 PolarHBondContact O-N 2.69Å; P582-L584 PolarHBondContact O-N 2.9Å; P582-L584 VanDerWaalsContact O-N 3.14Å
585	G	88.7	Confident	90.5	Very high	22 Å²	22	78.3 Å²	78.3	23%	0.227	40%	0.398	C	S	.	.			trans	-71.6	143	-177.6	0	0	0	0	0	112.3	P582 L604	P582-G585 PolarHBondContact O-N 3.02Å; G585-L604 PolarHBondContact O-N 3.24Å
586	H	89.8	Confident	90.3	Very high	84 Å²	84	75.4 Å²	75.4	39%	0.389	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.5	170.6	68.2	-86.2	0	0	0	110	V602	H586-V602 CarbonylContact C-O 3.52Å; H586-V602 VanDerWaalsContact CA-O 3.28Å; H586-V602 WeakPolarHBondContact CA-O 3.3Å; H586-V602 VanDerWaalsContact CB-O 3.32Å; H586-V602 WeakPolarHBondContact CB-O 3.37Å
587	A	91.3	Very high	90.1	Very high	26 Å²	26	75.4 Å²	75.4	22%	0.215	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	167	-179.9	0	0	0	0	0	111	V602	A587-V602 PolarHBondContact N-O 2.63Å; A587-V602 PolarHBondContact O-N 2.95Å
588	V	92.4	Very high	90.1	Very high	64 Å²	64	68 Å²	68	39%	0.388	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.8	169.3	-178.5	0	0	0	0	107.5	E599 L600	V588-E599 HydrophobicContact CG1-CB 4.04Å; V588-E599 HydrophobicContact CG1-CG 4.29Å; V588-L600 CarbonylContact C-O 3.57Å; V588-L600 WeakPolarHBondContact CA-O 3.2Å
589	L	93.4	Very high	90.1	Very high	34 Å²	34	68.2 Å²	68.2	18%	0.178	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.6	177.2	-59.1	-178.7	0	0	0	110.1	E599 L600 V602 T607 L610	L589-E599 CarbonylContact O-C 3.54Å; L589-E599 WeakPolarHBondContact O-CA 3.4Å; L589-L600 HydrophobicContact CB-CB 4.46Å; L589-L600 PolarHBondContact N-O 3.25Å; L589-L600 PolarHBondContact O-N 2.84Å; L589-V602 HydrophobicContact CD1-CG2 3.74Å; L589-V602 HydrophobicContact CG-CG2 3.76Å; L589-T607 HydrophobicContact CD1-CG2 4.28Å; L589-T607 HydrophobicContact CD2-CG2 3.89Å; L589-L610 HydrophobicContact CD1-CB 4.05Å; L589-L610 HydrophobicContact CD1-CD1 3.89Å
590	K	93.3	Very high	90	Very high	178 Å²	178	63.2 Å²	63.2	77%	0.774	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.6	167.1	-66.8	178.1	-176.6	173.8	0	107.4	E599	K590-E599 HydrophobicContact CG-CG 4.33Å
591	A	92.2	Very high	89.9	Confident	14 Å²	14	60.8 Å²	60.8	12%	0.116	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.9	179.8	0	0	0	0	0	109.9	F593 K597 K598 L600	A591-F593 HydrophobicContact CB-CD2 4.1Å; A591-F593 HydrophobicContact CB-CE2 3.43Å; A591-F593 VanDerWaalsContact CB-CE2 3.43Å; A591-F593 HydrophobicContact CB-CZ 3.9Å; A591-K597 WeakPolarHBondContact O-CA 3.36Å; A591-K598 PolarHBondContact N-O 2.89Å; A591-K598 PolarHBondContact O-N 2.99Å; A591-L600 HydrophobicContact CB-CD1 3.85Å; A591-L600 HydrophobicContact CB-CG 4.04Å
592	E	90.3	Very high	89.8	Confident	130 Å²	130	58.9 Å²	58.9	61%	0.607	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	110	174.6	-60.1	-159.2	154.9	0	0	109.4	K597	E592-K597 HydrophobicContact CG-CD 4.45Å; E592-K597 HydrophobicContact CG-CG 4.34Å; E592-K597 WeakPolarHBondContact OE1-CE 3.46Å; E592-K597 IonicContact OE1-NZ 3.94Å; E592-K597 PolarHBondContact OE1-NZ 3.46Å
593	F	88.9	Confident	89.9	Confident	15 Å²	15	58.1 Å²	58.1	7%	0.066	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	163.2	172.9	-61.1	-81	0	0	0	109.7	A591 E595 G596 K598 L600 V649 F667 N668 F671	A591-F593 HydrophobicContact CB-CD2 4.1Å; A591-F593 HydrophobicContact CB-CE2 3.43Å; A591-F593 VanDerWaalsContact CB-CE2 3.43Å; A591-F593 HydrophobicContact CB-CZ 3.9Å; F593-E595 VanDerWaalsContact C-N 3.25Å; F593-E595 PolarHBondContact O-N 2.79Å; F593-G596 PolarHBondContact N-O 3.19Å; F593-G596 PolarHBondContact O-N 3.42Å; F593-K598 HydrophobicContact CD2-CB 4.16Å; F593-K598 HydrophobicContact CD2-CG 3.94Å; F593-K598 HydrophobicContact CE2-CB 4.15Å; F593-K598 HydrophobicContact CE2-CG 4.3Å; F593-L600 HydrophobicContact CZ-CD1 4.43Å; F593-V649 HydrophobicContact CZ-CG1 4.27Å; F593-F667 HydrophobicContact CD1-CE1 4.14Å; F593-F667 HydrophobicContact CD1-CE2 4.25Å; F593-F667 AromaticContact CD1-CZ 3.52Å; F593-F667 HydrophobicContact CD1-CZ 3.52Å; F593-F667 HydrophobicContact CE1-CE1 4.25Å; F593-F667 AromaticContact CE1-CE2 3.56Å; F593-F667 HydrophobicContact CE1-CE2 3.56Å; F593-F667 AromaticContact CE1-CZ 3.3Å; F593-F667 HydrophobicContact CE1-CZ 3.3Å; F593-F667 HydrophobicContact CG-CZ 4.47Å; F593-F667 HydrophobicContact CZ-CE2 4.15Å; F593-F667 HydrophobicContact CZ-CZ 4.12Å; F593-N668 WeakPolarHBondContact CD1-O 3.45Å; F593-F671 HydrophobicContact CD1-CB 3.81Å; F593-F671 HydrophobicContact CD1-CD1 4.37Å; F593-F671 HydrophobicContact CD2-CD1 4.28Å; F593-F671 HydrophobicContact CE1-CB 3.72Å; F593-F671 HydrophobicContact CE1-CD1 4Å; F593-F671 HydrophobicContact CE1-CG 4.17Å; F593-F671 AromaticContact CE2-CD1 3.9Å; F593-F671 HydrophobicContact CE2-CD1 3.9Å; F593-F671 HydrophobicContact CE2-CE1 4.47Å; F593-F671 HydrophobicContact CG-CD1 4.49Å; F593-F671 HydrophobicContact CZ-CB 4.34Å; F593-F671 AromaticContact CZ-CD1 3.76Å; F593-F671 HydrophobicContact CZ-CD1 3.76Å; F593-F671 HydrophobicContact CZ-CE1 4.48Å; F593-F671 HydrophobicContact CZ-CG 4.32Å
594	K	86.4	Confident	90.1	Very high	151 Å²	151	56.2 Å²	56.2	66%	0.657	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.3	178.8	-71.7	-178.2	-174.7	160.1	0	113.5	G596 N669 D670	K594-G596 VanDerWaalsContact C-N 3.27Å; K594-G596 PolarHBondContact O-N 3.29Å; K594-N669 HydrophobicContact CD-CB 4.5Å; K594-D670 IonicContact NZ-OD1 3.72Å; K594-D670 PolarHBondContact NZ-OD1 3.4Å
595	E	80.3	Confident	90.3	Very high	115 Å²	115	54.2 Å²	54.2	54%	0.537	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	4.5	-179.8	-62.4	-163.5	158.6	0	0	113.9	F593 K672	F593-E595 VanDerWaalsContact C-N 3.25Å; F593-E595 PolarHBondContact O-N 2.79Å; E595-K672 VanDerWaalsContact OE1-CD 3.3Å; E595-K672 WeakPolarHBondContact OE1-CD 3.49Å; E595-K672 WeakPolarHBondContact OE1-CE 3.5Å; E595-K672 IonicContact OE1-NZ 2.79Å; E595-K672 PolarHBondContact OE1-NZ 2.89Å; E595-K672 VanDerWaalsContact OE2-CD 3.29Å; E595-K672 WeakPolarHBondContact OE2-CD 3.45Å; E595-K672 VanDerWaalsContact OE2-CG 3.25Å; E595-K672 WeakPolarHBondContact OE2-CG 3.4Å
596	G	86.5	Confident	90.5	Very high	30 Å²	30	53.2 Å²	53.2	31%	0.309	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	127.7	173.4	173.6	0	0	0	0	0	114.2	F593 K594	F593-G596 PolarHBondContact N-O 3.19Å; F593-G596 PolarHBondContact O-N 3.42Å; K594-G596 VanDerWaalsContact C-N 3.27Å; K594-G596 PolarHBondContact O-N 3.29Å
597	K	91.1	Very high	90.7	Very high	139 Å²	139	49.4 Å²	49.4	60%	0.604	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	139.7	-178.4	-52.1	-166.9	-172.6	-151.8	0	110.8	A591 E592 F676	A591-K597 WeakPolarHBondContact O-CA 3.36Å; E592-K597 HydrophobicContact CG-CD 4.45Å; E592-K597 HydrophobicContact CG-CG 4.34Å; E592-K597 WeakPolarHBondContact OE1-CE 3.46Å; E592-K597 IonicContact OE1-NZ 3.94Å; E592-K597 PolarHBondContact OE1-NZ 3.46Å; K597-F676 WeakPolarHBondContact O-CD2 3.16Å; K597-F676 VanDerWaalsContact O-CE2 3.25Å; K597-F676 WeakPolarHBondContact O-CE2 3.47Å
598	K	92.3	Very high	90.9	Very high	41 Å²	41	48.5 Å²	48.5	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	155.9	177.5	-58.5	-68.4	175.6	171.6	0	110.3	A591 F593 H673 I678	A591-K598 PolarHBondContact N-O 2.89Å; A591-K598 PolarHBondContact O-N 2.99Å; F593-K598 HydrophobicContact CD2-CB 4.16Å; F593-K598 HydrophobicContact CD2-CG 3.94Å; F593-K598 HydrophobicContact CE2-CB 4.15Å; F593-K598 HydrophobicContact CE2-CG 4.3Å; K598-H673 PolarHBondContact NZ-O 3.12Å; K598-I678 HydrophobicContact CB-CD1 4.41Å
599	E	92.9	Very high	91	Very high	43 Å²	43	45.5 Å²	45.5	20%	0.201	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.2	172	-75.2	-174.7	173.4	0	0	110.6	V588 L589 K590 F676 R677 I678	V588-E599 HydrophobicContact CG1-CB 4.04Å; V588-E599 HydrophobicContact CG1-CG 4.29Å; L589-E599 CarbonylContact O-C 3.54Å; L589-E599 WeakPolarHBondContact O-CA 3.4Å; K590-E599 HydrophobicContact CG-CG 4.33Å; E599-F676 HydrophobicContact CB-CE1 4.2Å; E599-F676 HydrophobicContact CG-CD1 4.48Å; E599-F676 HydrophobicContact CG-CE1 3.65Å; E599-F676 HydrophobicContact CG-CZ 3.92Å; E599-F676 PolarHBondContact N-O 3.43Å; E599-R677 HydrophobicContact CB-CB 4.39Å; E599-R677 HydrophobicContact CB-CG 4.17Å; E599-R677 CarbonylContact O-C 3.59Å; E599-R677 WeakPolarHBondContact O-CA 3.49Å; E599-I678 PolarHBondContact O-N 3.04Å
600	L	92	Very high	91	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.4	179.7	-51.1	-176.2	0	0	0	109.1	V588 L589 A591 F593 V602 L610 V649 I678 I680	V588-L600 CarbonylContact C-O 3.57Å; V588-L600 WeakPolarHBondContact CA-O 3.2Å; L589-L600 HydrophobicContact CB-CB 4.46Å; L589-L600 PolarHBondContact N-O 3.25Å; L589-L600 PolarHBondContact O-N 2.84Å; A591-L600 HydrophobicContact CB-CD1 3.85Å; A591-L600 HydrophobicContact CB-CG 4.04Å; F593-L600 HydrophobicContact CZ-CD1 4.43Å; L600-V602 HydrophobicContact CB-CG1 3.93Å; L600-V602 PolarHBondContact O-N 3.01Å; L600-L610 HydrophobicContact CD1-CD1 4.31Å; L600-V649 HydrophobicContact CD1-CG1 4.12Å; L600-I678 HydrophobicContact CD2-CB 4.06Å; L600-I678 HydrophobicContact CD2-CD1 4.02Å; L600-I678 HydrophobicContact CD2-CG1 4.41Å; L600-I680 HydrophobicContact CB-CD1 4.39Å; L600-I680 HydrophobicContact CD1-CD1 4.24Å; L600-I680 HydrophobicContact CD2-CD1 4.1Å; L600-I680 HydrophobicContact CG-CD1 4.48Å
601	Q	89.9	Confident	91.1	Very high	32 Å²	32	38.9 Å²	38.9	15%	0.15	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	106.9	167.9	-173.5	179.8	6.7	0	0	108.8	I678 K679 I680	Q601-I678 PolarHBondContact N-O 3.4Å; Q601-K679 HydrophobicContact CB-CG 4.45Å; Q601-I680 PolarHBondContact O-N 3.35Å; Q601-I680 VanDerWaalsContact O-N 3.09Å
602	V	90.7	Very high	91.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	158.9	-169.3	-71.5	0	0	0	0	110.9	H586 A587 L589 L600 Q606 T607 L610 I680	H586-V602 CarbonylContact C-O 3.52Å; H586-V602 VanDerWaalsContact CA-O 3.28Å; H586-V602 WeakPolarHBondContact CA-O 3.3Å; H586-V602 VanDerWaalsContact CB-O 3.32Å; H586-V602 WeakPolarHBondContact CB-O 3.37Å; A587-V602 PolarHBondContact N-O 2.63Å; A587-V602 PolarHBondContact O-N 2.95Å; L589-V602 HydrophobicContact CD1-CG2 3.74Å; L589-V602 HydrophobicContact CG-CG2 3.76Å; L600-V602 HydrophobicContact CB-CG1 3.93Å; L600-V602 PolarHBondContact O-N 3.01Å; V602-Q606 HydrophobicContact CB-CB 3.74Å; V602-Q606 HydrophobicContact CG1-CB 4.22Å; V602-T607 VanDerWaalsContact CG2-OG1 3.29Å; V602-T607 WeakPolarHBondContact CG2-OG1 3.29Å; V602-L610 HydrophobicContact CG1-CD1 4.08Å; V602-I680 HydrophobicContact CG1-CB 4.21Å; V602-I680 HydrophobicContact CG1-CD1 4.26Å
603	S	91	Very high	91.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	166.1	169.7	74.7	0	0	0	0	111.8	F605 Q606 T607 Q684	S603-F605 VanDerWaalsContact C-N 3.29Å; S603-F605 PolarHBondContact O-N 2.92Å; S603-Q606 PolarHBondContact O-N 3.28Å; S603-Q606 VanDerWaalsContact OG-CG 3.3Å; S603-Q606 WeakPolarHBondContact OG-CG 3.27Å; S603-Q606 PolarHBondContact OG-N 3.38Å; S603-Q606 VanDerWaalsContact OG-N 3.14Å; S603-T607 PolarHBondContact O-N 2.92Å; S603-T607 PolarHBondContact O-OG1 3.32Å; S603-Q684 PolarHBondContact OG-NE2 3.37Å; S603-Q684 VanDerWaalsContact OG-NE2 3.09Å; S603-Q684 PolarHBondContact OG-OE1 2.9Å
604	L	91.4	Very high	91.5	Very high	15 Å²	15	40.1 Å²	40.1	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-40.4	175.7	-175.5	59.7	0	0	0	111.8	L554 M558 P582 G585 Q606 T607 L608	L554-L604 HydrophobicContact CD2-CD1 4.11Å; L554-L604 HydrophobicContact CD2-CD2 4.18Å; L554-L604 HydrophobicContact CD2-CG 4.41Å; M558-L604 HydrophobicContact CE-CD1 3.71Å; P582-L604 HydrophobicContact CB-CD2 3.8Å; G585-L604 PolarHBondContact O-N 3.24Å; L604-Q606 PolarHBondContact O-N 3.38Å; L604-T607 VanDerWaalsContact O-CB 3.31Å; L604-T607 WeakPolarHBondContact O-CB 3.46Å; L604-T607 PolarHBondContact O-N 3.44Å; L604-T607 VanDerWaalsContact O-N 3.14Å; L604-L608 WeakPolarHBondContact O-CG 3.19Å; L604-L608 PolarHBondContact O-N 2.82Å
605	F	92.5	Very high	91.7	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-44	176.1	-55.9	-28.5	0	0	0	112	M550 V552 P582 T583 S603 T607 L608 V609 I630 E634 T638 Q684	M550-F605 HydrophobicContact CE-CD1 3.76Å; M550-F605 HydrophobicContact CE-CD2 4.35Å; M550-F605 HydrophobicContact CE-CE1 3.03Å; M550-F605 HydrophobicContact CE-CE2 3.72Å; M550-F605 HydrophobicContact CE-CG 4.4Å; M550-F605 HydrophobicContact CE-CZ 3.01Å; M550-F605 HydrophobicContact SD-CZ 4.49Å; V552-F605 HydrophobicContact CG1-CD1 4.29Å; V552-F605 HydrophobicContact CG1-CE1 3.94Å; P582-F605 HydrophobicContact CB-CE1 3.73Å; P582-F605 HydrophobicContact CB-CZ 4.24Å; T583-F605 VanDerWaalsContact CA-CZ 3.46Å; T583-F605 HydrophobicContact CG2-CE2 4.31Å; T583-F605 HydrophobicContact CG2-CZ 4.49Å; S603-F605 VanDerWaalsContact C-N 3.29Å; S603-F605 PolarHBondContact O-N 2.92Å; F605-T607 VanDerWaalsContact C-N 3.27Å; F605-T607 PolarHBondContact O-N 3.28Å; F605-L608 PolarHBondContact O-N 3.32Å; F605-V609 WeakPolarHBondContact O-CG2 3.45Å; F605-V609 PolarHBondContact O-N 3.11Å; F605-I630 HydrophobicContact CB-CD1 3.84Å; F605-I630 HydrophobicContact CD1-CD1 4.3Å; F605-I630 HydrophobicContact CD1-CG1 4.23Å; F605-I630 HydrophobicContact CG-CD1 4.3Å; F605-E634 HydrophobicContact CD2-CG 3.58Å; F605-E634 HydrophobicContact CE2-CG 3.6Å; F605-T638 HydrophobicContact CB-CG2 3.95Å; F605-Q684 VanDerWaalsContact CD2-NE2 3.29Å
606	Q	92.7	Very high	92	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-38	173.8	-71.9	173.6	-22.8	0	0	111.5	V602 S603 L604 L610 T638 S641 L642 I680	V602-Q606 HydrophobicContact CB-CB 3.74Å; V602-Q606 HydrophobicContact CG1-CB 4.22Å; S603-Q606 PolarHBondContact O-N 3.28Å; S603-Q606 VanDerWaalsContact OG-CG 3.3Å; S603-Q606 WeakPolarHBondContact OG-CG 3.27Å; S603-Q606 PolarHBondContact OG-N 3.38Å; S603-Q606 VanDerWaalsContact OG-N 3.14Å; L604-Q606 PolarHBondContact O-N 3.38Å; Q606-L610 WeakPolarHBondContact O-CB 3.36Å; Q606-L610 VanDerWaalsContact O-CG 3.26Å; Q606-L610 WeakPolarHBondContact O-CG 3.34Å; Q606-L610 PolarHBondContact O-N 2.64Å; Q606-T638 HydrophobicContact CB-CG2 4.39Å; Q606-T638 HydrophobicContact CG-CG2 3.79Å; Q606-S641 PolarHBondContact NE2-OG 3.03Å; Q606-L642 HydrophobicContact CB-CD1 4.38Å; Q606-L642 HydrophobicContact CB-CD2 4.2Å; Q606-L642 HydrophobicContact CG-CD1 4.25Å; Q606-L642 HydrophobicContact CG-CD2 4.04Å; Q606-L642 HydrophobicContact CG-CG 4.15Å; Q606-I680 PolarHBondContact NE2-O 3.4Å
607	T	93.8	Very high	92	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-49.4	176.1	-63.7	0	0	0	0	112	L589 V602 S603 L604 F605 V609 L610 L611	L589-T607 HydrophobicContact CD1-CG2 4.28Å; L589-T607 HydrophobicContact CD2-CG2 3.89Å; V602-T607 VanDerWaalsContact CG2-OG1 3.29Å; V602-T607 WeakPolarHBondContact CG2-OG1 3.29Å; S603-T607 PolarHBondContact O-N 2.92Å; S603-T607 PolarHBondContact O-OG1 3.32Å; L604-T607 VanDerWaalsContact O-CB 3.31Å; L604-T607 WeakPolarHBondContact O-CB 3.46Å; L604-T607 PolarHBondContact O-N 3.44Å; L604-T607 VanDerWaalsContact O-N 3.14Å; F605-T607 VanDerWaalsContact C-N 3.27Å; F605-T607 PolarHBondContact O-N 3.28Å; T607-V609 VanDerWaalsContact C-N 3.32Å; T607-V609 PolarHBondContact O-N 2.75Å; T607-L610 PolarHBondContact O-N 3.13Å; T607-L611 HydrophobicContact CG2-CD1 3.7Å; T607-L611 HydrophobicContact CG2-CG 4.14Å; T607-L611 WeakPolarHBondContact O-CB 3.45Å; T607-L611 VanDerWaalsContact O-CG 3.26Å; T607-L611 WeakPolarHBondContact O-CG 3.42Å; T607-L611 PolarHBondContact O-N 3.04Å
608	L	94.1	Very high	92.1	Very high	7 Å²	7	41.1 Å²	41.1	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-44.5	-179.2	-63.6	180	0	0	0	111.6	V552 H553 L554 P555 L604 F605 L611 T628	V552-L608 HydrophobicContact CB-CD1 3.85Å; V552-L608 HydrophobicContact CG1-CD1 4.48Å; V552-L608 HydrophobicContact CG2-CD1 4.07Å; H553-L608 WeakPolarHBondContact O-CD2 3.36Å; L554-L608 HydrophobicContact CD2-CD1 4.37Å; L554-L608 HydrophobicContact CD2-CD2 4.09Å; P555-L608 HydrophobicContact CG-CD2 4.4Å; L604-L608 WeakPolarHBondContact O-CG 3.19Å; L604-L608 PolarHBondContact O-N 2.82Å; F605-L608 PolarHBondContact O-N 3.32Å; L608-L611 PolarHBondContact O-N 3.44Å; L608-T628 HydrophobicContact CB-CG2 3.93Å
609	V	94.6	Very high	92.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-46.6	176.5	175.1	0	0	0	0	111.4	F605 T607 L611 M612 F613 I624 T628 I630 L635 T638 L639 L642 L650	F605-V609 WeakPolarHBondContact O-CG2 3.45Å; F605-V609 PolarHBondContact O-N 3.11Å; T607-V609 VanDerWaalsContact C-N 3.32Å; T607-V609 PolarHBondContact O-N 2.75Å; V609-L611 PolarHBondContact O-N 3.03Å; V609-M612 WeakPolarHBondContact O-CB 3.17Å; V609-M612 PolarHBondContact O-N 3.42Å; V609-F613 HydrophobicContact CG1-CE2 4.3Å; V609-F613 WeakPolarHBondContact O-CD2 3.47Å; V609-I624 HydrophobicContact CB-CG2 4.49Å; V609-I624 HydrophobicContact CG1-CG2 4.22Å; V609-I624 HydrophobicContact CG2-CG2 3.79Å; V609-T628 HydrophobicContact CG2-CG2 4.33Å; V609-I630 HydrophobicContact CG2-CD1 4.2Å; V609-L635 HydrophobicContact CG2-CD1 4.12Å; V609-T638 HydrophobicContact CG2-CG2 4.22Å; V609-L639 HydrophobicContact CG1-CD2 3.81Å; V609-L642 HydrophobicContact CB-CD1 4.19Å; V609-L642 HydrophobicContact CG1-CD1 3.93Å; V609-L650 HydrophobicContact CG1-CD1 4.2Å
610	L	94.6	Very high	92.2	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-33.2	-177.4	-72.8	172.5	0	0	0	112.9	L589 L600 V602 Q606 T607 M612 F613 L642 V649 L650	L589-L610 HydrophobicContact CD1-CB 4.05Å; L589-L610 HydrophobicContact CD1-CD1 3.89Å; L600-L610 HydrophobicContact CD1-CD1 4.31Å; V602-L610 HydrophobicContact CG1-CD1 4.08Å; Q606-L610 WeakPolarHBondContact O-CB 3.36Å; Q606-L610 VanDerWaalsContact O-CG 3.26Å; Q606-L610 WeakPolarHBondContact O-CG 3.34Å; Q606-L610 PolarHBondContact O-N 2.64Å; T607-L610 PolarHBondContact O-N 3.13Å; L610-M612 PolarHBondContact O-N 3.36Å; L610-F613 PolarHBondContact O-N 3.27Å; L610-L642 HydrophobicContact CD1-CD2 4.02Å; L610-L642 HydrophobicContact CD2-CD2 4.31Å; L610-L642 HydrophobicContact CG-CD1 4.41Å; L610-L642 HydrophobicContact CG-CD2 4.23Å; L610-V649 HydrophobicContact CD2-CG2 4.13Å; L610-L650 HydrophobicContact CD2-CD2 4.12Å; L610-L650 HydrophobicContact CD2-CG 4.29Å
611	L	94.1	Very high	92.2	Very high	57 Å²	57	39.9 Å²	39.9	30%	0.298	20%	0.201	S	C	.	.	H	α-helix	trans	-65.4	-27.9	179	-74.7	173.3	0	0	0	112.9	P555 T607 L608 V609 F613 N614	P555-L611 HydrophobicContact CG-CD1 3.82Å; T607-L611 HydrophobicContact CG2-CD1 3.7Å; T607-L611 HydrophobicContact CG2-CG 4.14Å; T607-L611 WeakPolarHBondContact O-CB 3.45Å; T607-L611 VanDerWaalsContact O-CG 3.26Å; T607-L611 WeakPolarHBondContact O-CG 3.42Å; T607-L611 PolarHBondContact O-N 3.04Å; L608-L611 PolarHBondContact O-N 3.44Å; V609-L611 PolarHBondContact O-N 3.03Å; L611-F613 PolarHBondContact O-N 2.99Å; L611-N614 WeakPolarHBondContact O-CB 3.44Å; L611-N614 PolarHBondContact O-N 3.08Å; L611-N614 PolarHBondContact O-ND2 2.92Å; L611-N614 VanDerWaalsContact O-ND2 3.17Å
612	M	94.1	Very high	92.3	Very high	31 Å²	31	44.9 Å²	44.9	15%	0.153	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-31.9	175.7	-64.7	179.9	62.3	0	0	112.4	V609 L610 N614 E615 G616 F619 I624 A627 T628	V609-M612 WeakPolarHBondContact O-CB 3.17Å; V609-M612 PolarHBondContact O-N 3.42Å; L610-M612 PolarHBondContact O-N 3.36Å; M612-N614 PolarHBondContact O-N 2.99Å; M612-E615 PolarHBondContact O-N 3.2Å; M612-E615 VanDerWaalsContact O-N 3.16Å; M612-G616 PolarHBondContact O-N 3.29Å; M612-F619 HydrophobicContact CB-CD2 4.34Å; M612-F619 HydrophobicContact CB-CE2 3.87Å; M612-F619 HydrophobicContact CB-CZ 4.27Å; M612-F619 HydrophobicContact CE-CD1 4.07Å; M612-F619 HydrophobicContact CE-CD2 4.33Å; M612-F619 HydrophobicContact CE-CE1 4.19Å; M612-F619 HydrophobicContact CE-CE2 4.47Å; M612-F619 HydrophobicContact CE-CG 4.13Å; M612-F619 HydrophobicContact CE-CZ 4.38Å; M612-F619 WeakPolarHBondContact O-CE2 3.43Å; M612-I624 HydrophobicContact CE-CG1 4.22Å; M612-I624 HydrophobicContact SD-CB 4.32Å; M612-I624 HydrophobicContact SD-CG1 4.22Å; M612-I624 HydrophobicContact SD-CG2 4.12Å; M612-A627 HydrophobicContact CE-CB 3.41Å; M612-A627 VanDerWaalsContact CE-CB 3.41Å; M612-A627 HydrophobicContact SD-CB 3.74Å; M612-T628 HydrophobicContact SD-CG2 3.72Å
613	F	94.5	Very high	92.4	Very high	25 Å²	25	49.1 Å²	49.1	11%	0.11	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	0.4	-178.7	-67.6	-84.4	0	0	0	114.1	V609 L610 L611 G616 F619 L650 F665 F667	V609-F613 HydrophobicContact CG1-CE2 4.3Å; V609-F613 WeakPolarHBondContact O-CD2 3.47Å; L610-F613 PolarHBondContact O-N 3.27Å; L611-F613 PolarHBondContact O-N 2.99Å; F613-G616 CarbonylContact C-O 3.49Å; F613-G616 WeakPolarHBondContact CA-O 3.19Å; F613-F619 HydrophobicContact CD1-CD2 4.04Å; F613-F619 HydrophobicContact CD1-CE2 4.09Å; F613-F619 AromaticContact CE1-CD2 3.68Å; F613-F619 HydrophobicContact CE1-CD2 3.68Å; F613-F619 HydrophobicContact CE1-CE2 4.21Å; F613-F619 HydrophobicContact CE2-CD2 4.32Å; F613-F619 HydrophobicContact CG-CE2 4.38Å; F613-F619 AromaticContact CZ-CD2 3.85Å; F613-F619 HydrophobicContact CZ-CD2 3.85Å; F613-L650 HydrophobicContact CD2-CD2 3.93Å; F613-L650 HydrophobicContact CE1-CD2 4.28Å; F613-L650 HydrophobicContact CE2-CD1 3.91Å; F613-L650 HydrophobicContact CE2-CD2 3.62Å; F613-L650 HydrophobicContact CE2-CG 4.44Å; F613-L650 HydrophobicContact CG-CD2 4.38Å; F613-L650 HydrophobicContact CZ-CD1 4.24Å; F613-L650 HydrophobicContact CZ-CD2 3.8Å; F613-F665 WeakPolarHBondContact CE1-O 3.32Å; F613-F665 HydrophobicContact CZ-CB 4.14Å; F613-F667 HydrophobicContact CB-CB 4.39Å; F613-F667 HydrophobicContact CD1-CB 4.05Å; F613-F667 HydrophobicContact CG-CB 4.38Å
614	N	92.3	Very high	92.6	Very high	128 Å²	128	49.1 Å²	49.1	68%	0.684	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-23.4	168	-65.3	-46.5	0	0	0	112.4	L611 M612	L611-N614 WeakPolarHBondContact O-CB 3.44Å; L611-N614 PolarHBondContact O-N 3.08Å; L611-N614 PolarHBondContact O-ND2 2.92Å; L611-N614 VanDerWaalsContact O-ND2 3.17Å; M612-N614 PolarHBondContact O-N 2.99Å
615	E	89.4	Confident	92.7	Very high	194 Å²	194	53.7 Å²	53.7	91%	0.907	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-7.6	-175.3	-64.5	-178.9	-171.4	0	0	113.2	M612	M612-E615 PolarHBondContact O-N 3.2Å; M612-E615 VanDerWaalsContact O-N 3.16Å
616	G	87.7	Confident	92.7	Very high	22 Å²	22	57.2 Å²	57.2	23%	0.227	29%	0.289	C	S	.	.			trans	-154.4	160	176.3	0	0	0	0	0	113.5	M612 F613	M612-G616 PolarHBondContact O-N 3.29Å; F613-G616 CarbonylContact C-O 3.49Å; F613-G616 WeakPolarHBondContact CA-O 3.19Å
617	E	85.9	Confident	92.7	Very high	173 Å²	173	59.4 Å²	59.4	81%	0.808	31%	0.308	S	S	*	.	S	Bend	trans	-95.9	-34.7	-171.6	-63.6	-172.9	167.4	0	0	114.1	N666	E617-N666 WeakPolarHBondContact O-CA 3.32Å; E617-N666 WeakPolarHBondContact O-CB 3.18Å
618	E	92.9	Very high	92.6	Very high	68 Å²	68	59.4 Å²	59.4	32%	0.318	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.7	-177.7	-174.1	175.3	-108.4	0	0	110.6	R664 F665 N666	E618-R664 HydrophobicContact CG-CB 4.13Å; E618-R664 IonicContact OE2-CZ 3.7Å; E618-R664 IonicContact OE2-NH1 3.54Å; E618-R664 PolarHBondContact OE2-NH1 3.22Å; E618-F665 WeakPolarHBondContact CA-O 3.48Å; E618-N666 HydrophobicContact CB-CB 4.21Å; E618-N666 HydrophobicContact CG-CB 4.26Å
619	F	94.8	Very high	92.6	Very high	38 Å²	38	60.4 Å²	60.4	17%	0.167	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.6	177.5	-59	-76	0	0	0	111	M612 F613 E623 I624 R664 F665	M612-F619 HydrophobicContact CB-CD2 4.34Å; M612-F619 HydrophobicContact CB-CE2 3.87Å; M612-F619 HydrophobicContact CB-CZ 4.27Å; M612-F619 HydrophobicContact CE-CD1 4.07Å; M612-F619 HydrophobicContact CE-CD2 4.33Å; M612-F619 HydrophobicContact CE-CE1 4.19Å; M612-F619 HydrophobicContact CE-CE2 4.47Å; M612-F619 HydrophobicContact CE-CG 4.13Å; M612-F619 HydrophobicContact CE-CZ 4.38Å; M612-F619 WeakPolarHBondContact O-CE2 3.43Å; F613-F619 HydrophobicContact CD1-CD2 4.04Å; F613-F619 HydrophobicContact CD1-CE2 4.09Å; F613-F619 AromaticContact CE1-CD2 3.68Å; F613-F619 HydrophobicContact CE1-CD2 3.68Å; F613-F619 HydrophobicContact CE1-CE2 4.21Å; F613-F619 HydrophobicContact CE2-CD2 4.32Å; F613-F619 HydrophobicContact CG-CE2 4.38Å; F613-F619 AromaticContact CZ-CD2 3.85Å; F613-F619 HydrophobicContact CZ-CD2 3.85Å; F619-E623 HydrophobicContact CB-CB 4.49Å; F619-I624 HydrophobicContact CB-CD1 4.03Å; F619-I624 HydrophobicContact CB-CG1 3.69Å; F619-R664 WeakPolarHBondContact O-CA 3.32Å; F619-F665 PolarHBondContact N-O 3.15Å; F619-F665 PolarHBondContact O-N 2.99Å
620	S	93.8	Very high	92.5	Very high	19 Å²	19	60.5 Å²	60.5	13%	0.133	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	160.9	166.9	62.3	0	0	0	0	111.7	E622 E623 I624	S620-E622 VanDerWaalsContact C-N 3.25Å; S620-E622 PolarHBondContact O-N 3.29Å; S620-E623 WeakPolarHBondContact CB-OE2 3.31Å; S620-E623 PolarHBondContact N-OE2 2.87Å; S620-E623 PolarHBondContact O-N 2.9Å; S620-E623 VanDerWaalsContact OG-CG 3.23Å; S620-E623 WeakPolarHBondContact OG-CG 3.31Å; S620-E623 PolarHBondContact OG-N 2.99Å; S620-E623 PolarHBondContact OG-OE2 3.2Å; S620-I624 WeakPolarHBondContact O-CG1 3.49Å; S620-I624 PolarHBondContact O-N 3.17Å; S620-I624 VanDerWaalsContact O-N 3.09Å
621	M	92.4	Very high	92.4	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-55.9	-40.2	174.5	-175.5	-171.4	167	0	0	112.4	I624 R625 E632 L635 R636 L639 V659 D663 F665	M621-I624 PolarHBondContact O-N 3.38Å; M621-R625 WeakPolarHBondContact O-CB 3.38Å; M621-R625 PolarHBondContact O-N 2.89Å; M621-E632 HydrophobicContact CE-CG 3.62Å; M621-L635 HydrophobicContact CE-CD2 4.28Å; M621-L635 HydrophobicContact CG-CD2 4.23Å; M621-R636 HydrophobicContact CE-CG 3.54Å; M621-R636 HydrophobicContact SD-CG 4.33Å; M621-L639 HydrophobicContact CG-CD1 4.1Å; M621-V659 HydrophobicContact SD-CG1 4.06Å; M621-D663 PolarHBondContact N-O 3.12Å; M621-D663 VanDerWaalsContact N-O 3.1Å; M621-F665 HydrophobicContact CB-CE2 4.42Å
622	E	91.4	Very high	92.2	Very high	138 Å²	138	66.1 Å²	66.1	65%	0.645	35%	0.345	S	S	*	.	H	α-helix	trans	-65.4	-42.5	179.9	-67	-173.9	168.3	0	0	112.3	S620 R625 A626	S620-E622 VanDerWaalsContact C-N 3.25Å; S620-E622 PolarHBondContact O-N 3.29Å; E622-R625 WeakPolarHBondContact O-CB 3.39Å; E622-R625 PolarHBondContact O-N 3.24Å; E622-A626 PolarHBondContact O-N 3.38Å
623	E	92.9	Very high	91.8	Very high	88 Å²	88	67 Å²	67	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176	-72.6	161.9	151.3	0	0	111.2	F619 S620 R625 A626 A627	F619-E623 HydrophobicContact CB-CB 4.49Å; S620-E623 WeakPolarHBondContact CB-OE2 3.31Å; S620-E623 PolarHBondContact N-OE2 2.87Å; S620-E623 PolarHBondContact O-N 2.9Å; S620-E623 VanDerWaalsContact OG-CG 3.23Å; S620-E623 WeakPolarHBondContact OG-CG 3.31Å; S620-E623 PolarHBondContact OG-N 2.99Å; S620-E623 PolarHBondContact OG-OE2 3.2Å; E623-R625 VanDerWaalsContact C-N 3.35Å; E623-R625 PolarHBondContact O-N 3.42Å; E623-A626 PolarHBondContact O-N 3.49Å; E623-A627 WeakPolarHBondContact O-CB 3.34Å; E623-A627 PolarHBondContact O-N 3.17Å
624	I	93.9	Very high	91.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.4	-42.5	176.3	-64	167.7	0	0	0	110.6	V609 M612 F619 S620 M621 A627 T628 L635 L639 F665	V609-I624 HydrophobicContact CB-CG2 4.49Å; V609-I624 HydrophobicContact CG1-CG2 4.22Å; V609-I624 HydrophobicContact CG2-CG2 3.79Å; M612-I624 HydrophobicContact CE-CG1 4.22Å; M612-I624 HydrophobicContact SD-CB 4.32Å; M612-I624 HydrophobicContact SD-CG1 4.22Å; M612-I624 HydrophobicContact SD-CG2 4.12Å; F619-I624 HydrophobicContact CB-CD1 4.03Å; F619-I624 HydrophobicContact CB-CG1 3.69Å; S620-I624 WeakPolarHBondContact O-CG1 3.49Å; S620-I624 PolarHBondContact O-N 3.17Å; S620-I624 VanDerWaalsContact O-N 3.09Å; M621-I624 PolarHBondContact O-N 3.38Å; I624-A627 PolarHBondContact O-N 3.31Å; I624-T628 HydrophobicContact CG2-CG2 4.21Å; I624-T628 WeakPolarHBondContact O-CB 3.46Å; I624-T628 WeakPolarHBondContact O-CG2 3.34Å; I624-T628 PolarHBondContact O-N 3.2Å; I624-T628 PolarHBondContact O-OG1 3.06Å; I624-L635 HydrophobicContact CG2-CD1 3.79Å; I624-L635 HydrophobicContact CG2-CD2 4.47Å; I624-L639 HydrophobicContact CD1-CD2 3.98Å; I624-F665 HydrophobicContact CD1-CB 4.3Å; I624-F665 HydrophobicContact CD1-CD2 3.98Å; I624-F665 HydrophobicContact CD1-CG 4.4Å
625	R	93.3	Very high	91.5	Very high	112 Å²	112	61.4 Å²	61.4	42%	0.423	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-48.9	177.3	-176.6	-177.5	173.7	166	3.2	111.3	M621 E622 E623 A627 G629 E632 L635	M621-R625 WeakPolarHBondContact O-CB 3.38Å; M621-R625 PolarHBondContact O-N 2.89Å; E622-R625 WeakPolarHBondContact O-CB 3.39Å; E622-R625 PolarHBondContact O-N 3.24Å; E623-R625 VanDerWaalsContact C-N 3.35Å; E623-R625 PolarHBondContact O-N 3.42Å; R625-A627 PolarHBondContact O-N 2.96Å; R625-G629 WeakPolarHBondContact O-CA 3.25Å; R625-G629 PolarHBondContact O-N 3.31Å; R625-E632 IonicContact CZ-OE2 2.65Å; R625-E632 IonicContact NH1-OE2 3.67Å; R625-E632 PolarHBondContact NH1-OE2 3.4Å; R625-E632 IonicContact NH2-OE2 2.88Å; R625-L635 HydrophobicContact CB-CD2 3.59Å; R625-L635 HydrophobicContact CG-CD2 4.2Å
626	A	93	Very high	91.5	Very high	75 Å²	75	54.8 Å²	54.8	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-62.6	-43.1	-179.7	0	0	0	0	0	111.9	E622 E623	E622-A626 PolarHBondContact O-N 3.38Å; E623-A626 PolarHBondContact O-N 3.49Å
627	A	92.8	Very high	91.6	Very high	48 Å²	48	56.1 Å²	56.1	40%	0.397	30%	0.297	S	S	.	.	H	α-helix	trans	-69.7	-42.5	-179.2	0	0	0	0	0	112.8	H553 M612 E623 I624 R625	H553-A627 WeakPolarHBondContact CB-O 3.32Å; H553-A627 PolarHBondContact ND1-O 3.46Å; M612-A627 HydrophobicContact CE-CB 3.41Å; M612-A627 VanDerWaalsContact CE-CB 3.41Å; M612-A627 HydrophobicContact SD-CB 3.74Å; E623-A627 WeakPolarHBondContact O-CB 3.34Å; E623-A627 PolarHBondContact O-N 3.17Å; I624-A627 PolarHBondContact O-N 3.31Å; R625-A627 PolarHBondContact O-N 2.96Å
628	T	92.9	Very high	91.8	Very high	3 Å²	3	48 Å²	48	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-90.9	-23.8	-173.2	61.8	0	0	0	0	114.3	H553 L608 V609 M612 I624 I630	H553-T628 PolarHBondContact N-O 3.37Å; L608-T628 HydrophobicContact CB-CG2 3.93Å; V609-T628 HydrophobicContact CG2-CG2 4.33Å; M612-T628 HydrophobicContact SD-CG2 3.72Å; I624-T628 HydrophobicContact CG2-CG2 4.21Å; I624-T628 WeakPolarHBondContact O-CB 3.46Å; I624-T628 WeakPolarHBondContact O-CG2 3.34Å; I624-T628 PolarHBondContact O-N 3.2Å; I624-T628 PolarHBondContact O-OG1 3.06Å; T628-I630 HydrophobicContact CG2-CD1 4.32Å; T628-I630 PolarHBondContact O-N 3.02Å; T628-I630 WeakPolarHBondContact OG1-CD1 3.23Å; T628-I630 WeakPolarHBondContact OG1-CG1 3.34Å
629	G	93.4	Very high	91.7	Very high	28 Å²	28	44.8 Å²	44.8	29%	0.289	24%	0.244	S	C	.	.			trans	73.6	9.4	-175.5	0	0	0	0	0	114.5	R625	R625-G629 WeakPolarHBondContact O-CA 3.25Å; R625-G629 PolarHBondContact O-N 3.31Å
630	I	92.9	Very high	91.4	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.25	C	C	.	.			trans	-73.3	136	-177.3	-58.6	163.5	0	0	0	110.1	M550 V552 F605 V609 T628 E634 L635	M550-I630 HydrophobicContact CE-CG2 4.04Å; V552-I630 HydrophobicContact CG1-CG1 4.25Å; F605-I630 HydrophobicContact CB-CD1 3.84Å; F605-I630 HydrophobicContact CD1-CD1 4.3Å; F605-I630 HydrophobicContact CD1-CG1 4.23Å; F605-I630 HydrophobicContact CG-CD1 4.3Å; V609-I630 HydrophobicContact CG2-CD1 4.2Å; T628-I630 HydrophobicContact CG2-CD1 4.32Å; T628-I630 PolarHBondContact O-N 3.02Å; T628-I630 WeakPolarHBondContact OG1-CD1 3.23Å; T628-I630 WeakPolarHBondContact OG1-CG1 3.34Å; I630-E634 HydrophobicContact CG2-CB 4.25Å; I630-E634 HydrophobicContact CG2-CG 4.47Å; I630-L635 HydrophobicContact CB-CB 4.26Å; I630-L635 HydrophobicContact CB-CD1 4.46Å; I630-L635 HydrophobicContact CD1-CD1 4.3Å; I630-L635 HydrophobicContact CG2-CB 3.87Å
631	E	91.5	Very high	91.2	Very high	123 Å²	123	45.2 Å²	45.2	58%	0.575	25%	0.246	S	C	*	.			trans	-59.6	143.5	174	-70.6	-177.2	-178.1	0	0	112.3	M550 G633 E634 L635	M550-E631 HydrophobicContact CG-CG 4.34Å; M550-E631 HydrophobicContact SD-CB 4.03Å; M550-E631 HydrophobicContact SD-CG 3.87Å; E631-G633 PolarHBondContact O-N 3.36Å; E631-E634 PolarHBondContact O-N 3.02Å; E631-E634 VanDerWaalsContact O-N 3.15Å; E631-L635 WeakPolarHBondContact O-CB 3.28Å; E631-L635 PolarHBondContact O-N 2.86Å
632	E	89.6	Confident	91.1	Very high	69 Å²	69	45 Å²	45	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-55.4	-45.7	-169.6	-165.8	-175.5	133.8	0	0	113.7	M621 R625 E634 L635 R636	M621-E632 HydrophobicContact CE-CG 3.62Å; R625-E632 IonicContact CZ-OE2 2.65Å; R625-E632 IonicContact NH1-OE2 3.67Å; R625-E632 PolarHBondContact NH1-OE2 3.4Å; R625-E632 IonicContact NH2-OE2 2.88Å; E632-E634 PolarHBondContact O-N 2.97Å; E632-L635 PolarHBondContact O-N 2.84Å; E632-R636 WeakPolarHBondContact O-CG 3.14Å; E632-R636 PolarHBondContact O-N 3.04Å; E632-R636 IonicContact OE1-CZ 3.27Å; E632-R636 IonicContact OE1-NE 2.63Å; E632-R636 IonicContact OE1-NH2 3.86Å; E632-R636 PolarHBondContact OE1-NH2 3.42Å
633	G	87.3	Confident	90.9	Very high	51 Å²	51	38.8 Å²	38.8	53%	0.526	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-42.3	-179.7	0	0	0	0	0	113.2	E631 R637	E631-G633 PolarHBondContact O-N 3.36Å; G633-R637 PolarHBondContact O-N 2.87Å
634	E	88	Confident	90.4	Very high	35 Å²	35	35.8 Å²	35.8	16%	0.164	21%	0.205	C	C	.	.	H	α-helix	trans	-77.9	-31.3	178.5	-172	60.4	-163.6	0	0	111.7	F605 I630 E631 E632 R637 T638 Q684	F605-E634 HydrophobicContact CD2-CG 3.58Å; F605-E634 HydrophobicContact CE2-CG 3.6Å; I630-E634 HydrophobicContact CG2-CB 4.25Å; I630-E634 HydrophobicContact CG2-CG 4.47Å; E631-E634 PolarHBondContact O-N 3.02Å; E631-E634 VanDerWaalsContact O-N 3.15Å; E632-E634 PolarHBondContact O-N 2.97Å; E634-R637 PolarHBondContact O-N 3.14Å; E634-R637 IonicContact OE2-CZ 3.12Å; E634-R637 IonicContact OE2-NH1 3.81Å; E634-R637 PolarHBondContact OE2-NH1 2.87Å; E634-T638 WeakPolarHBondContact O-CB 3.39Å; E634-T638 PolarHBondContact O-N 3.48Å; E634-T638 PolarHBondContact O-OG1 2.89Å; E634-Q684 PolarHBondContact OE1-NE2 2.91Å
635	L	91.2	Very high	89.7	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-45.9	174.2	-179.6	59.8	0	0	0	111.4	V609 M621 I624 R625 I630 E631 E632 R637 T638 L639	V609-L635 HydrophobicContact CG2-CD1 4.12Å; M621-L635 HydrophobicContact CE-CD2 4.28Å; M621-L635 HydrophobicContact CG-CD2 4.23Å; I624-L635 HydrophobicContact CG2-CD1 3.79Å; I624-L635 HydrophobicContact CG2-CD2 4.47Å; R625-L635 HydrophobicContact CB-CD2 3.59Å; R625-L635 HydrophobicContact CG-CD2 4.2Å; I630-L635 HydrophobicContact CB-CB 4.26Å; I630-L635 HydrophobicContact CB-CD1 4.46Å; I630-L635 HydrophobicContact CD1-CD1 4.3Å; I630-L635 HydrophobicContact CG2-CB 3.87Å; E631-L635 WeakPolarHBondContact O-CB 3.28Å; E631-L635 PolarHBondContact O-N 2.86Å; E632-L635 PolarHBondContact O-N 2.84Å; L635-R637 VanDerWaalsContact C-N 3.3Å; L635-R637 PolarHBondContact O-N 3.41Å; L635-T638 WeakPolarHBondContact O-CB 3.34Å; L635-T638 PolarHBondContact O-N 2.95Å; L635-T638 VanDerWaalsContact O-N 3.13Å; L635-L639 HydrophobicContact CD1-CD1 3.9Å; L635-L639 HydrophobicContact CD1-CG 3.99Å; L635-L639 HydrophobicContact CD2-CD1 4.48Å; L635-L639 HydrophobicContact CG-CD1 3.85Å; L635-L639 HydrophobicContact CG-CG 4.36Å; L635-L639 WeakPolarHBondContact O-CG 3.35Å; L635-L639 PolarHBondContact O-N 3.34Å
636	R	90.8	Very high	89	Confident	55 Å²	55	41.5 Å²	41.5	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-55.8	-45.7	175.6	-72.5	-173.4	-163.8	-78.5	0.2	111.4	M621 E632 L639 Q640 V659 D661	M621-R636 HydrophobicContact CE-CG 3.54Å; M621-R636 HydrophobicContact SD-CG 4.33Å; E632-R636 WeakPolarHBondContact O-CG 3.14Å; E632-R636 PolarHBondContact O-N 3.04Å; E632-R636 IonicContact OE1-CZ 3.27Å; E632-R636 IonicContact OE1-NE 2.63Å; E632-R636 IonicContact OE1-NH2 3.86Å; E632-R636 PolarHBondContact OE1-NH2 3.42Å; R636-L639 PolarHBondContact O-N 3.49Å; R636-Q640 VanDerWaalsContact O-CB 3.24Å; R636-Q640 WeakPolarHBondContact O-CB 3.26Å; R636-Q640 PolarHBondContact O-N 3.31Å; R636-V659 HydrophobicContact CB-CB 4.46Å; R636-V659 HydrophobicContact CG-CB 4.48Å; R636-V659 HydrophobicContact CG-CG1 4.4Å; R636-V659 PolarHBondContact NH1-O 3.41Å; R636-D661 IonicContact CZ-OD1 2.82Å; R636-D661 IonicContact NH1-OD1 3.28Å; R636-D661 PolarHBondContact NH1-OD1 3.37Å; R636-D661 IonicContact NH2-OD1 3.07Å; R636-D661 PolarHBondContact NH2-OD1 3.09Å; R636-D661 IonicContact NH2-OD2 3.1Å
637	R	87.9	Confident	88.3	Confident	49 Å²	49	38.6 Å²	38.6	19%	0.185	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-41.8	176.5	-70.1	178.9	66.6	-161.1	10.1	112.5	G633 E634 L635 Q640 S641 I683 K686	G633-R637 PolarHBondContact O-N 2.87Å; E634-R637 PolarHBondContact O-N 3.14Å; E634-R637 IonicContact OE2-CZ 3.12Å; E634-R637 IonicContact OE2-NH1 3.81Å; E634-R637 PolarHBondContact OE2-NH1 2.87Å; L635-R637 VanDerWaalsContact C-N 3.3Å; L635-R637 PolarHBondContact O-N 3.41Å; R637-Q640 PolarHBondContact O-N 2.97Å; R637-S641 WeakPolarHBondContact O-CB 3.45Å; R637-S641 PolarHBondContact O-N 2.59Å; R637-I683 HydrophobicContact CB-CG2 4.27Å; R637-I683 PolarHBondContact NH2-O 3.3Å; R637-K686 PolarHBondContact NH2-O 3.48Å
638	T	90.3	Very high	88	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-48.6	177.1	-61.3	0	0	0	0	110.2	F605 Q606 V609 E634 L635 S641 L642	F605-T638 HydrophobicContact CB-CG2 3.95Å; Q606-T638 HydrophobicContact CB-CG2 4.39Å; Q606-T638 HydrophobicContact CG-CG2 3.79Å; V609-T638 HydrophobicContact CG2-CG2 4.22Å; E634-T638 WeakPolarHBondContact O-CB 3.39Å; E634-T638 PolarHBondContact O-N 3.48Å; E634-T638 PolarHBondContact O-OG1 2.89Å; L635-T638 WeakPolarHBondContact O-CB 3.34Å; L635-T638 PolarHBondContact O-N 2.95Å; L635-T638 VanDerWaalsContact O-N 3.13Å; T638-S641 PolarHBondContact O-N 3.45Å; T638-S641 PolarHBondContact O-OG 3.02Å; T638-L642 HydrophobicContact CG2-CD1 4.3Å; T638-L642 WeakPolarHBondContact O-CG 3.34Å; T638-L642 PolarHBondContact O-N 3Å
639	L	91.2	Very high	87.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.7	-39.8	177.4	-68.9	170.3	0	0	0	112.5	V609 M621 I624 L635 R636 S641 L642 A643 V659 F665	V609-L639 HydrophobicContact CG1-CD2 3.81Å; M621-L639 HydrophobicContact CG-CD1 4.1Å; I624-L639 HydrophobicContact CD1-CD2 3.98Å; L635-L639 HydrophobicContact CD1-CD1 3.9Å; L635-L639 HydrophobicContact CD1-CG 3.99Å; L635-L639 HydrophobicContact CD2-CD1 4.48Å; L635-L639 HydrophobicContact CG-CD1 3.85Å; L635-L639 HydrophobicContact CG-CG 4.36Å; L635-L639 WeakPolarHBondContact O-CG 3.35Å; L635-L639 PolarHBondContact O-N 3.34Å; R636-L639 PolarHBondContact O-N 3.49Å; L639-S641 PolarHBondContact O-N 2.84Å; L639-L642 PolarHBondContact O-N 3.45Å; L639-L642 VanDerWaalsContact O-N 3.1Å; L639-A643 WeakPolarHBondContact O-CB 3.47Å; L639-A643 PolarHBondContact O-N 3.13Å; L639-V659 HydrophobicContact CB-CG1 4.37Å; L639-V659 HydrophobicContact CB-CG2 4.06Å; L639-V659 HydrophobicContact CD1-CG1 4.2Å; L639-F665 HydrophobicContact CB-CE1 4.04Å; L639-F665 HydrophobicContact CB-CZ 3.96Å; L639-F665 HydrophobicContact CD1-CD2 4.32Å; L639-F665 HydrophobicContact CD1-CE2 3.77Å; L639-F665 HydrophobicContact CD1-CZ 3.95Å; L639-F665 HydrophobicContact CD2-CD1 4.27Å; L639-F665 HydrophobicContact CD2-CD2 4.3Å; L639-F665 HydrophobicContact CD2-CE1 4.33Å; L639-F665 HydrophobicContact CD2-CE2 4.38Å; L639-F665 HydrophobicContact CD2-CG 4.26Å; L639-F665 HydrophobicContact CD2-CZ 4.39Å; L639-F665 HydrophobicContact CG-CE2 4.48Å; L639-F665 HydrophobicContact CG-CZ 4.33Å
640	Q	89.1	Confident	87.9	Confident	60 Å²	60	41.3 Å²	41.3	28%	0.28	21%	0.207	S	C	.	.	I	π-helix	trans	-57.3	-39	174.5	-169.4	-179.7	48.1	0	0	110.9	R636 R637 C644 G645 K657 V659	R636-Q640 VanDerWaalsContact O-CB 3.24Å; R636-Q640 WeakPolarHBondContact O-CB 3.26Å; R636-Q640 PolarHBondContact O-N 3.31Å; R637-Q640 PolarHBondContact O-N 2.97Å; Q640-C644 HydrophobicContact CG-CB 3.89Å; Q640-C644 CarbonylContact O-C 3.44Å; Q640-C644 WeakPolarHBondContact O-CA 3.46Å; Q640-C644 WeakPolarHBondContact O-CB 3.5Å; Q640-C644 PolarHBondContact O-N 3.5Å; Q640-G645 PolarHBondContact O-N 3.02Å; Q640-G645 VanDerWaalsContact O-N 3.11Å; Q640-K657 PolarHBondContact NE2-O 2.93Å; Q640-V659 HydrophobicContact CB-CG2 4.26Å
641	S	88.4	Confident	87.8	Confident	7 Å²	7	43.3 Å²	43.3	5%	0.049	22%	0.217	C	C	.	.	I	π-helix	trans	-68.3	-33	177.9	78.3	0	0	0	0	114.5	Q606 R637 T638 L639	Q606-S641 PolarHBondContact NE2-OG 3.03Å; R637-S641 WeakPolarHBondContact O-CB 3.45Å; R637-S641 PolarHBondContact O-N 2.59Å; T638-S641 PolarHBondContact O-N 3.45Å; T638-S641 PolarHBondContact O-OG 3.02Å; L639-S641 PolarHBondContact O-N 2.84Å
642	L	90.3	Very high	87.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-85.6	-32.3	-177.7	-66.3	169.4	0	0	0	112.6	Q606 V609 L610 T638 L639 R648 V649 L650 I680	Q606-L642 HydrophobicContact CB-CD1 4.38Å; Q606-L642 HydrophobicContact CB-CD2 4.2Å; Q606-L642 HydrophobicContact CG-CD1 4.25Å; Q606-L642 HydrophobicContact CG-CD2 4.04Å; Q606-L642 HydrophobicContact CG-CG 4.15Å; V609-L642 HydrophobicContact CB-CD1 4.19Å; V609-L642 HydrophobicContact CG1-CD1 3.93Å; L610-L642 HydrophobicContact CD1-CD2 4.02Å; L610-L642 HydrophobicContact CD2-CD2 4.31Å; L610-L642 HydrophobicContact CG-CD1 4.41Å; L610-L642 HydrophobicContact CG-CD2 4.23Å; T638-L642 HydrophobicContact CG2-CD1 4.3Å; T638-L642 WeakPolarHBondContact O-CG 3.34Å; T638-L642 PolarHBondContact O-N 3Å; L639-L642 PolarHBondContact O-N 3.45Å; L639-L642 VanDerWaalsContact O-N 3.1Å; L642-R648 CarbonylContact O-C 3.58Å; L642-R648 WeakPolarHBondContact O-CA 3.29Å; L642-V649 HydrophobicContact CB-CG2 4.03Å; L642-V649 HydrophobicContact CD2-CG2 3.56Å; L642-V649 HydrophobicContact CG-CG2 4.41Å; L642-V649 PolarHBondContact O-N 3.49Å; L642-L650 HydrophobicContact CB-CD1 3.86Å; L642-L650 HydrophobicContact CB-CG 4.16Å; L642-L650 HydrophobicContact CD1-CD1 4.04Å; L642-L650 PolarHBondContact O-N 2.59Å; L642-L650 VanDerWaalsContact O-N 3.16Å; L642-I680 HydrophobicContact CD2-CG2 4.15Å
643	A	88.6	Confident	87.9	Confident	7 Å²	7	37.9 Å²	37.9	6%	0.058	19%	0.194	C	C	.	.	I	π-helix	trans	-113.1	-36	-171.4	0	0	0	0	0	114.9	L639 R648 L650 K652 F665	L639-A643 WeakPolarHBondContact O-CB 3.47Å; L639-A643 PolarHBondContact O-N 3.13Å; A643-R648 WeakPolarHBondContact O-CD 3.01Å; A643-R648 WeakPolarHBondContact O-CG 3.42Å; A643-L650 WeakPolarHBondContact CA-O 3.45Å; A643-L650 HydrophobicContact CB-CB 4.11Å; A643-K652 HydrophobicContact CB-CB 4.13Å; A643-F665 HydrophobicContact CB-CD1 3.92Å; A643-F665 HydrophobicContact CB-CE1 3.84Å
644	C	83	Confident	87.9	Confident	25 Å²	25	39.8 Å²	39.8	17%	0.169	20%	0.197	C	C	.	.	I	π-helix	trans	-101	-15.5	-173.1	-55.8	0	0	0	0	112.9	Q640 G656	Q640-C644 HydrophobicContact CG-CB 3.89Å; Q640-C644 CarbonylContact O-C 3.44Å; Q640-C644 WeakPolarHBondContact O-CA 3.46Å; Q640-C644 WeakPolarHBondContact O-CB 3.5Å; Q640-C644 PolarHBondContact O-N 3.5Å; C644-G656 PolarHBondContact SG-O 3.47Å; C644-G656 VanDerWaalsContact SG-O 3.36Å
645	G	78.4	Confident	87.8	Confident	24 Å²	24	48.1 Å²	48.1	25%	0.247	23%	0.227	C	C	.	.	S	Bend	trans	-72.2	-167.1	-177.1	0	0	0	0	0	115.4	Q640 R648	Q640-G645 PolarHBondContact O-N 3.02Å; Q640-G645 VanDerWaalsContact O-N 3.11Å; G645-R648 WeakPolarHBondContact O-CG 3.41Å; G645-R648 PolarHBondContact O-NE 2.95Å
646	K	77.5	Confident	87.6	Confident	207 Å²	207	50 Å²	50	90%	0.9	25%	0.247	S	C	*	.	S	Bend	trans	-71.3	-37.6	176.2	-68.4	-174	178.9	-177.5	0	112.3
647	A	80.3	Confident	87.2	Confident	14 Å²	14	55.8 Å²	55.8	12%	0.116	27%	0.274	C	S	.	.	S	Bend	trans	-103.7	94.4	177	0	0	0	0	0	108.7	V649 F671 I678 I680	A647-V649 PolarHBondContact O-N 3.5Å; A647-F671 HydrophobicContact CB-CE2 4.27Å; A647-F671 HydrophobicContact CB-CZ 4.2Å; A647-I678 HydrophobicContact CB-CG2 4.35Å; A647-I680 HydrophobicContact CB-CG1 4.24Å
648	R	86.1	Confident	87.1	Confident	136 Å²	136	57.9 Å²	57.9	51%	0.513	29%	0.289	S	S	.	.			trans	-91.1	81.1	-175	-58.3	-175.6	-177.1	174.2	-4.3	110.9	L642 A643 G645 L650 N668 F671	L642-R648 CarbonylContact O-C 3.58Å; L642-R648 WeakPolarHBondContact O-CA 3.29Å; A643-R648 WeakPolarHBondContact O-CD 3.01Å; A643-R648 WeakPolarHBondContact O-CG 3.42Å; G645-R648 WeakPolarHBondContact O-CG 3.41Å; G645-R648 PolarHBondContact O-NE 2.95Å; R648-L650 VanDerWaalsContact C-N 3.29Å; R648-N668 PolarHBondContact O-ND2 2.91Å; R648-F671 VanDerWaalsContact O-CD2 3.27Å; R648-F671 WeakPolarHBondContact O-CD2 3.47Å
649	V	90.4	Very high	87	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.006	29%	0.29	C	S	.	.	S	Bend	trans	-77.4	-19.9	177.6	-67.5	0	0	0	0	112.3	F593 L600 L610 L642 A647 N668 F671 I680	F593-V649 HydrophobicContact CZ-CG1 4.27Å; L600-V649 HydrophobicContact CD1-CG1 4.12Å; L610-V649 HydrophobicContact CD2-CG2 4.13Å; L642-V649 HydrophobicContact CB-CG2 4.03Å; L642-V649 HydrophobicContact CD2-CG2 3.56Å; L642-V649 HydrophobicContact CG-CG2 4.41Å; L642-V649 PolarHBondContact O-N 3.49Å; A647-V649 PolarHBondContact O-N 3.5Å; V649-N668 VanDerWaalsContact O-CB 3.31Å; V649-N668 WeakPolarHBondContact O-CB 3.38Å; V649-N668 PolarHBondContact O-N 3.45Å; V649-F671 HydrophobicContact CG1-CD1 4.41Å; V649-F671 HydrophobicContact CG1-CD2 4.4Å; V649-F671 HydrophobicContact CG1-CE1 4.23Å; V649-F671 HydrophobicContact CG1-CE2 4.23Å; V649-F671 HydrophobicContact CG1-CG 4.48Å; V649-F671 HydrophobicContact CG1-CZ 4.14Å; V649-I680 HydrophobicContact CB-CD1 4.49Å; V649-I680 HydrophobicContact CG1-CD1 3.58Å; V649-I680 HydrophobicContact CG2-CD1 4.05Å
650	L	92.5	Very high	86.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	151.7	170.3	-60	178.8	0	0	0	110	V609 L610 F613 L642 A643 R648 N666	V609-L650 HydrophobicContact CG1-CD1 4.2Å; L610-L650 HydrophobicContact CD2-CD2 4.12Å; L610-L650 HydrophobicContact CD2-CG 4.29Å; F613-L650 HydrophobicContact CD2-CD2 3.93Å; F613-L650 HydrophobicContact CE1-CD2 4.28Å; F613-L650 HydrophobicContact CE2-CD1 3.91Å; F613-L650 HydrophobicContact CE2-CD2 3.62Å; F613-L650 HydrophobicContact CE2-CG 4.44Å; F613-L650 HydrophobicContact CG-CD2 4.38Å; F613-L650 HydrophobicContact CZ-CD1 4.24Å; F613-L650 HydrophobicContact CZ-CD2 3.8Å; L642-L650 HydrophobicContact CB-CD1 3.86Å; L642-L650 HydrophobicContact CB-CG 4.16Å; L642-L650 HydrophobicContact CD1-CD1 4.04Å; L642-L650 PolarHBondContact O-N 2.59Å; L642-L650 VanDerWaalsContact O-N 3.16Å; A643-L650 WeakPolarHBondContact CA-O 3.45Å; A643-L650 HydrophobicContact CB-CB 4.11Å; R648-L650 VanDerWaalsContact C-N 3.29Å; L650-N666 CarbonylContact C-O 3.54Å; L650-N666 VanDerWaalsContact CA-O 3.29Å; L650-N666 WeakPolarHBondContact CA-O 3.46Å
651	N	91.3	Very high	86.7	Confident	43 Å²	43	64.5 Å²	64.5	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139.9	164.8	-49.5	-64.5	0	0	0	110	F665 N666	N651-F665 VanDerWaalsContact O-CA 3.29Å; N651-F665 WeakPolarHBondContact O-CA 3.46Å; N651-N666 WeakPolarHBondContact CB-OD1 3.24Å; N651-N666 PolarHBondContact N-O 2.9Å; N651-N666 PolarHBondContact ND2-OD1 3Å; N651-N666 PolarHBondContact O-N 3.37Å
652	K	93.7	Very high	86.6	Confident	13 Å²	13	67.4 Å²	67.4	6%	0.057	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.8	174.3	-169.6	-179.1	95.5	85.4	0	110.4	A643 P654 R655 D658 V659 D663 R664 F665	A643-K652 HydrophobicContact CB-CB 4.13Å; K652-P654 WeakPolarHBondContact CE-O 3.48Å; K652-P654 WeakPolarHBondContact CG-O 3.4Å; K652-P654 PolarHBondContact NZ-O 2.96Å; K652-P654 CarbonylContact O-C 3.55Å; K652-R655 WeakPolarHBondContact O-CG 3.43Å; K652-R655 PolarHBondContact O-N 3.33Å; K652-D658 WeakPolarHBondContact CE-O 3.36Å; K652-D658 PolarHBondContact NZ-O 3.19Å; K652-V659 HydrophobicContact CD-CG2 4.28Å; K652-D663 HydrophobicContact CD-CB 4.37Å; K652-D663 WeakPolarHBondContact CD-OD2 3.32Å; K652-D663 HydrophobicContact CG-CB 4.13Å; K652-D663 IonicContact NZ-OD1 2.64Å; K652-D663 PolarHBondContact NZ-OD1 3.12Å; K652-D663 IonicContact NZ-OD2 3.95Å; K652-D663 PolarHBondContact NZ-OD2 3.16Å; K652-R664 CarbonylContact C-O 3.54Å; K652-R664 WeakPolarHBondContact CA-O 3.49Å; K652-F665 HydrophobicContact CB-CD1 4.26Å; K652-F665 HydrophobicContact CB-CE1 3.94Å; K652-F665 HydrophobicContact CD-CE1 4.01Å; K652-F665 HydrophobicContact CD-CZ 4.12Å; K652-F665 HydrophobicContact CG-CD1 4.31Å; K652-F665 HydrophobicContact CG-CE1 3.68Å; K652-F665 HydrophobicContact CG-CZ 3.96Å
653	N	89.5	Confident	86.7	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.353	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.1	173.8	-68.7	-23.6	0	0	0	109.2	R664	N653-R664 HydrophobicContact CB-CB 4.48Å; N653-R664 PolarHBondContact N-O 3.24Å; N653-R664 PolarHBondContact O-N 3.26Å
654	P	87.8	Confident	86.9	Confident	91 Å²	91	72.4 Å²	72.4	59%	0.591	37%	0.371	S	S	*	.	S	Bend	cis	-69.4	153.7	-5.4	28.2	-36	0	0	0	113.8	K652 G656 D663	K652-P654 WeakPolarHBondContact CE-O 3.48Å; K652-P654 WeakPolarHBondContact CG-O 3.4Å; K652-P654 PolarHBondContact NZ-O 2.96Å; K652-P654 CarbonylContact O-C 3.55Å; P654-G656 PolarHBondContact O-N 3.42Å; P654-D663 VanDerWaalsContact CD-OD1 3.32Å; P654-D663 WeakPolarHBondContact CD-OD1 3.32Å
655	R	86.4	Confident	87.5	Confident	209 Å²	209	71.2 Å²	71.2	79%	0.789	36%	0.363	S	S	*	.			trans	-69.6	131.6	177.5	-68.8	-178.7	179.5	-178.5	0.1	110.7	K652	K652-R655 WeakPolarHBondContact O-CG 3.43Å; K652-R655 PolarHBondContact O-N 3.33Å
656	G	85.2	Confident	88.2	Confident	41 Å²	41	72 Å²	72	42%	0.423	36%	0.362	S	S	.	.			trans	-163.5	176.1	-179.3	0	0	0	0	0	111.6	C644 P654	C644-G656 PolarHBondContact SG-O 3.47Å; C644-G656 VanDerWaalsContact SG-O 3.36Å; P654-G656 PolarHBondContact O-N 3.42Å
657	K	83.9	Confident	88.9	Confident	175 Å²	175	64.7 Å²	64.7	76%	0.761	33%	0.33	S	S	*	.	S	Bend	trans	-84.2	-29.1	172.7	-72.8	-176.8	179.5	175.2	0	112.3	Q640	Q640-K657 PolarHBondContact NE2-O 2.93Å
658	D	85.4	Confident	89.5	Confident	94 Å²	94	65.1 Å²	65.1	50%	0.503	33%	0.33	S	S	.	.	S	Bend	trans	-110	158.7	-174.8	-55	-54.2	0	0	0	110.5	K652	K652-D658 WeakPolarHBondContact CE-O 3.36Å; K652-D658 PolarHBondContact NZ-O 3.19Å
659	V	87.2	Confident	89.5	Confident	8 Å²	8	62.3 Å²	62.3	5%	0.048	33%	0.326	C	S	.	.			trans	-108.1	119.5	-179.4	174.4	0	0	0	0	108.1	M621 R636 L639 Q640 K652 D663 F665	M621-V659 HydrophobicContact SD-CG1 4.06Å; R636-V659 HydrophobicContact CB-CB 4.46Å; R636-V659 HydrophobicContact CG-CB 4.48Å; R636-V659 HydrophobicContact CG-CG1 4.4Å; R636-V659 PolarHBondContact NH1-O 3.41Å; L639-V659 HydrophobicContact CB-CG1 4.37Å; L639-V659 HydrophobicContact CB-CG2 4.06Å; L639-V659 HydrophobicContact CD1-CG1 4.2Å; Q640-V659 HydrophobicContact CB-CG2 4.26Å; K652-V659 HydrophobicContact CD-CG2 4.28Å; V659-D663 VanDerWaalsContact CA-OD2 3.26Å; V659-D663 WeakPolarHBondContact CA-OD2 3.11Å; V659-F665 HydrophobicContact CB-CZ 4.46Å; V659-F665 HydrophobicContact CG1-CE2 4.21Å; V659-F665 HydrophobicContact CG1-CZ 3.68Å; V659-F665 HydrophobicContact CG2-CE1 4.42Å; V659-F665 HydrophobicContact CG2-CZ 4.02Å
660	E	89.8	Confident	89.3	Confident	111 Å²	111	66.8 Å²	66.8	52%	0.519	35%	0.35	S	S	.	.			trans	-110.8	163.8	-179	-57.2	-58.3	153.2	0	0	110.6	G662 D663	E660-G662 VanDerWaalsContact C-N 3.33Å; E660-G662 PolarHBondContact O-N 3.45Å; E660-D663 PolarHBondContact N-OD2 3.36Å; E660-D663 VanDerWaalsContact O-CB 3.29Å; E660-D663 WeakPolarHBondContact O-CB 3.46Å; E660-D663 PolarHBondContact O-N 2.59Å; E660-D663 VanDerWaalsContact O-N 3.11Å
661	D	84.9	Confident	89	Confident	82 Å²	82	67.5 Å²	67.5	44%	0.439	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-36	-171.7	-63.5	-25.3	0	0	0	114.1	R636 D663	R636-D661 IonicContact CZ-OD1 2.82Å; R636-D661 IonicContact NH1-OD1 3.28Å; R636-D661 PolarHBondContact NH1-OD1 3.37Å; R636-D661 IonicContact NH2-OD1 3.07Å; R636-D661 PolarHBondContact NH2-OD1 3.09Å; R636-D661 IonicContact NH2-OD2 3.1Å; D661-D663 VanDerWaalsContact C-N 3.26Å; D661-D663 PolarHBondContact O-N 2.92Å
662	G	85.7	Confident	88.7	Confident	69 Å²	69	72.2 Å²	72.2	71%	0.711	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	1	179	0	0	0	0	0	114.6	E660	E660-G662 VanDerWaalsContact C-N 3.33Å; E660-G662 PolarHBondContact O-N 3.45Å
663	D	92.7	Very high	88.4	Confident	4 Å²	4	75 Å²	75	2%	0.021	38%	0.384	C	S	.	.			trans	-71.3	138.3	-177.1	-73.6	-32.4	0	0	0	112.1	M621 K652 P654 V659 E660 D661 F665	M621-D663 PolarHBondContact N-O 3.12Å; M621-D663 VanDerWaalsContact N-O 3.1Å; K652-D663 HydrophobicContact CD-CB 4.37Å; K652-D663 WeakPolarHBondContact CD-OD2 3.32Å; K652-D663 HydrophobicContact CG-CB 4.13Å; K652-D663 IonicContact NZ-OD1 2.64Å; K652-D663 PolarHBondContact NZ-OD1 3.12Å; K652-D663 IonicContact NZ-OD2 3.95Å; K652-D663 PolarHBondContact NZ-OD2 3.16Å; P654-D663 VanDerWaalsContact CD-OD1 3.32Å; P654-D663 WeakPolarHBondContact CD-OD1 3.32Å; V659-D663 VanDerWaalsContact CA-OD2 3.26Å; V659-D663 WeakPolarHBondContact CA-OD2 3.11Å; E660-D663 PolarHBondContact N-OD2 3.36Å; E660-D663 VanDerWaalsContact O-CB 3.29Å; E660-D663 WeakPolarHBondContact O-CB 3.46Å; E660-D663 PolarHBondContact O-N 2.59Å; E660-D663 VanDerWaalsContact O-N 3.11Å; D661-D663 VanDerWaalsContact C-N 3.26Å; D661-D663 PolarHBondContact O-N 2.92Å; D663-F665 HydrophobicContact CB-CE2 3.82Å; D663-F665 HydrophobicContact CB-CZ 3.98Å
664	R	93.4	Very high	88.3	Confident	107 Å²	107	81.9 Å²	81.9	40%	0.404	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	143.7	173	-71.6	-175.9	150.2	-126.6	-10.1	111.3	E618 F619 K652 N653	E618-R664 HydrophobicContact CG-CB 4.13Å; E618-R664 IonicContact OE2-CZ 3.7Å; E618-R664 IonicContact OE2-NH1 3.54Å; E618-R664 PolarHBondContact OE2-NH1 3.22Å; F619-R664 WeakPolarHBondContact O-CA 3.32Å; K652-R664 CarbonylContact C-O 3.54Å; K652-R664 WeakPolarHBondContact CA-O 3.49Å; N653-R664 HydrophobicContact CB-CB 4.48Å; N653-R664 PolarHBondContact N-O 3.24Å; N653-R664 PolarHBondContact O-N 3.26Å
665	F	95.3	Very high	88.3	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.6	-176.8	-61.7	-88.7	0	0	0	110.1	F613 E618 F619 M621 I624 L639 A643 N651 K652 V659 D663	F613-F665 WeakPolarHBondContact CE1-O 3.32Å; F613-F665 HydrophobicContact CZ-CB 4.14Å; E618-F665 WeakPolarHBondContact CA-O 3.48Å; F619-F665 PolarHBondContact N-O 3.15Å; F619-F665 PolarHBondContact O-N 2.99Å; M621-F665 HydrophobicContact CB-CE2 4.42Å; I624-F665 HydrophobicContact CD1-CB 4.3Å; I624-F665 HydrophobicContact CD1-CD2 3.98Å; I624-F665 HydrophobicContact CD1-CG 4.4Å; L639-F665 HydrophobicContact CB-CE1 4.04Å; L639-F665 HydrophobicContact CB-CZ 3.96Å; L639-F665 HydrophobicContact CD1-CD2 4.32Å; L639-F665 HydrophobicContact CD1-CE2 3.77Å; L639-F665 HydrophobicContact CD1-CZ 3.95Å; L639-F665 HydrophobicContact CD2-CD1 4.27Å; L639-F665 HydrophobicContact CD2-CD2 4.3Å; L639-F665 HydrophobicContact CD2-CE1 4.33Å; L639-F665 HydrophobicContact CD2-CE2 4.38Å; L639-F665 HydrophobicContact CD2-CG 4.26Å; L639-F665 HydrophobicContact CD2-CZ 4.39Å; L639-F665 HydrophobicContact CG-CE2 4.48Å; L639-F665 HydrophobicContact CG-CZ 4.33Å; A643-F665 HydrophobicContact CB-CD1 3.92Å; A643-F665 HydrophobicContact CB-CE1 3.84Å; N651-F665 VanDerWaalsContact O-CA 3.29Å; N651-F665 WeakPolarHBondContact O-CA 3.46Å; K652-F665 HydrophobicContact CB-CD1 4.26Å; K652-F665 HydrophobicContact CB-CE1 3.94Å; K652-F665 HydrophobicContact CD-CE1 4.01Å; K652-F665 HydrophobicContact CD-CZ 4.12Å; K652-F665 HydrophobicContact CG-CD1 4.31Å; K652-F665 HydrophobicContact CG-CE1 3.68Å; K652-F665 HydrophobicContact CG-CZ 3.96Å; V659-F665 HydrophobicContact CB-CZ 4.46Å; V659-F665 HydrophobicContact CG1-CE2 4.21Å; V659-F665 HydrophobicContact CG1-CZ 3.68Å; V659-F665 HydrophobicContact CG2-CE1 4.42Å; V659-F665 HydrophobicContact CG2-CZ 4.02Å; D663-F665 HydrophobicContact CB-CE2 3.82Å; D663-F665 HydrophobicContact CB-CZ 3.98Å
666	N	93.5	Very high	88.4	Confident	40 Å²	40	78.2 Å²	78.2	21%	0.214	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	157.2	173.5	71.3	28.7	0	0	0	111.9	E617 E618 L650 N651 N668	E617-N666 WeakPolarHBondContact O-CA 3.32Å; E617-N666 WeakPolarHBondContact O-CB 3.18Å; E618-N666 HydrophobicContact CB-CB 4.21Å; E618-N666 HydrophobicContact CG-CB 4.26Å; L650-N666 CarbonylContact C-O 3.54Å; L650-N666 VanDerWaalsContact CA-O 3.29Å; L650-N666 WeakPolarHBondContact CA-O 3.46Å; N651-N666 WeakPolarHBondContact CB-OD1 3.24Å; N651-N666 PolarHBondContact N-O 2.9Å; N651-N666 PolarHBondContact ND2-OD1 3Å; N651-N666 PolarHBondContact O-N 3.37Å; N666-N668 PolarHBondContact O-N 3.37Å
667	F	92.9	Very high	88.5	Confident	54 Å²	54	82.7 Å²	82.7	24%	0.237	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.5	179.3	179	-108.4	0	0	0	111.7	F593 F613 N669	F593-F667 HydrophobicContact CD1-CE1 4.14Å; F593-F667 HydrophobicContact CD1-CE2 4.25Å; F593-F667 AromaticContact CD1-CZ 3.52Å; F593-F667 HydrophobicContact CD1-CZ 3.52Å; F593-F667 HydrophobicContact CE1-CE1 4.25Å; F593-F667 AromaticContact CE1-CE2 3.56Å; F593-F667 HydrophobicContact CE1-CE2 3.56Å; F593-F667 AromaticContact CE1-CZ 3.3Å; F593-F667 HydrophobicContact CE1-CZ 3.3Å; F593-F667 HydrophobicContact CG-CZ 4.47Å; F593-F667 HydrophobicContact CZ-CE2 4.15Å; F593-F667 HydrophobicContact CZ-CZ 4.12Å; F613-F667 HydrophobicContact CB-CB 4.39Å; F613-F667 HydrophobicContact CD1-CB 4.05Å; F613-F667 HydrophobicContact CG-CB 4.38Å; F667-N669 WeakPolarHBondContact CD1-OD1 3.48Å; F667-N669 VanDerWaalsContact CE1-OD1 3.26Å; F667-N669 WeakPolarHBondContact CE1-OD1 3.44Å; F667-N669 PolarHBondContact O-N 3.22Å; F667-N669 VanDerWaalsContact O-N 3.13Å
668	N	91.7	Very high	88.8	Confident	23 Å²	23	74.6 Å²	74.6	12%	0.123	37%	0.366	C	S	.	.			trans	-84.4	88	179.5	-175.1	12.7	0	0	0	111.9	F593 R648 V649 N666 D670 F671	F593-N668 WeakPolarHBondContact CD1-O 3.45Å; R648-N668 PolarHBondContact O-ND2 2.91Å; V649-N668 VanDerWaalsContact O-CB 3.31Å; V649-N668 WeakPolarHBondContact O-CB 3.38Å; V649-N668 PolarHBondContact O-N 3.45Å; N666-N668 PolarHBondContact O-N 3.37Å; N668-D670 PolarHBondContact O-N 2.93Å; N668-D670 PolarHBondContact OD1-N 2.91Å; N668-F671 HydrophobicContact CB-CB 4.42Å; N668-F671 WeakPolarHBondContact O-CB 3.36Å; N668-F671 PolarHBondContact O-N 3.44Å
669	N	86.4	Confident	88.7	Confident	78 Å²	78	72.9 Å²	72.9	42%	0.417	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.9	177	-83.4	-55.6	0	0	0	114.6	K594 F667 F671	K594-N669 HydrophobicContact CD-CB 4.5Å; F667-N669 WeakPolarHBondContact CD1-OD1 3.48Å; F667-N669 VanDerWaalsContact CE1-OD1 3.26Å; F667-N669 WeakPolarHBondContact CE1-OD1 3.44Å; F667-N669 PolarHBondContact O-N 3.22Å; F667-N669 VanDerWaalsContact O-N 3.13Å; N669-F671 VanDerWaalsContact C-N 3.35Å
670	D	86.6	Confident	88.5	Confident	95 Å²	95	73 Å²	73	51%	0.508	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	17.5	-175.9	-54.9	-37.4	0	0	0	112.1	K594 N668 K672	K594-D670 IonicContact NZ-OD1 3.72Å; K594-D670 PolarHBondContact NZ-OD1 3.4Å; N668-D670 PolarHBondContact O-N 2.93Å; N668-D670 PolarHBondContact OD1-N 2.91Å; D670-K672 WeakPolarHBondContact O-CG 3.21Å; D670-K672 PolarHBondContact O-N 3.01Å
671	F	86.9	Confident	87.4	Confident	14 Å²	14	68 Å²	68	6%	0.061	33%	0.33	C	S	.	.			trans	-61.8	125.1	179.4	176.9	-105.2	0	0	0	112.3	F593 A647 R648 V649 N668 N669 H673 I678	F593-F671 HydrophobicContact CD1-CB 3.81Å; F593-F671 HydrophobicContact CD1-CD1 4.37Å; F593-F671 HydrophobicContact CD2-CD1 4.28Å; F593-F671 HydrophobicContact CE1-CB 3.72Å; F593-F671 HydrophobicContact CE1-CD1 4Å; F593-F671 HydrophobicContact CE1-CG 4.17Å; F593-F671 AromaticContact CE2-CD1 3.9Å; F593-F671 HydrophobicContact CE2-CD1 3.9Å; F593-F671 HydrophobicContact CE2-CE1 4.47Å; F593-F671 HydrophobicContact CG-CD1 4.49Å; F593-F671 HydrophobicContact CZ-CB 4.34Å; F593-F671 AromaticContact CZ-CD1 3.76Å; F593-F671 HydrophobicContact CZ-CD1 3.76Å; F593-F671 HydrophobicContact CZ-CE1 4.48Å; F593-F671 HydrophobicContact CZ-CG 4.32Å; A647-F671 HydrophobicContact CB-CE2 4.27Å; A647-F671 HydrophobicContact CB-CZ 4.2Å; R648-F671 VanDerWaalsContact O-CD2 3.27Å; R648-F671 WeakPolarHBondContact O-CD2 3.47Å; V649-F671 HydrophobicContact CG1-CD1 4.41Å; V649-F671 HydrophobicContact CG1-CD2 4.4Å; V649-F671 HydrophobicContact CG1-CE1 4.23Å; V649-F671 HydrophobicContact CG1-CE2 4.23Å; V649-F671 HydrophobicContact CG1-CG 4.48Å; V649-F671 HydrophobicContact CG1-CZ 4.14Å; N668-F671 HydrophobicContact CB-CB 4.42Å; N668-F671 WeakPolarHBondContact O-CB 3.36Å; N668-F671 PolarHBondContact O-N 3.44Å; N669-F671 VanDerWaalsContact C-N 3.35Å; F671-H673 HydrophobicContact CE1-CB 3.83Å; F671-H673 HydrophobicContact CZ-CB 3.85Å; F671-I678 HydrophobicContact CE1-CD1 3.56Å; F671-I678 HydrophobicContact CZ-CD1 3.98Å
672	K	83.7	Confident	86.3	Confident	142 Å²	142	69.6 Å²	69.6	62%	0.617	34%	0.336	S	S	*	.			trans	-117.4	131	179.7	-47.5	-162.4	-176.3	-153.9	0	111.7	E595 D670	E595-K672 VanDerWaalsContact OE1-CD 3.3Å; E595-K672 WeakPolarHBondContact OE1-CD 3.49Å; E595-K672 WeakPolarHBondContact OE1-CE 3.5Å; E595-K672 IonicContact OE1-NZ 2.79Å; E595-K672 PolarHBondContact OE1-NZ 2.89Å; E595-K672 VanDerWaalsContact OE2-CD 3.29Å; E595-K672 WeakPolarHBondContact OE2-CD 3.45Å; E595-K672 VanDerWaalsContact OE2-CG 3.25Å; E595-K672 WeakPolarHBondContact OE2-CG 3.4Å; D670-K672 WeakPolarHBondContact O-CG 3.21Å; D670-K672 PolarHBondContact O-N 3.01Å
673	H	87.6	Confident	85.1	Confident	71 Å²	71	68.4 Å²	68.4	33%	0.329	31%	0.312	S	S	.	.			trans	-151.6	137.4	174.2	-164	-89.7	0	0	0	112.4	K598 F671 L675 I678	K598-H673 PolarHBondContact NZ-O 3.12Å; F671-H673 HydrophobicContact CE1-CB 3.83Å; F671-H673 HydrophobicContact CZ-CB 3.85Å; H673-L675 PolarHBondContact ND1-N 3.32Å; H673-L675 VanDerWaalsContact ND1-N 3.14Å; H673-L675 PolarHBondContact ND1-O 3.45Å; H673-L675 PolarHBondContact O-N 3.18Å; H673-I678 HydrophobicContact CB-CD1 3.56Å; H673-I678 HydrophobicContact CB-CG1 4.45Å
674	K	87.4	Confident	83.5	Confident	211 Å²	211	69.8 Å²	69.8	92%	0.917	32%	0.319	S	S	*	.	S	Bend	trans	-64.8	-38.4	-176.2	-64.8	-175.2	-179.4	-177.3	0	113
675	L	87.8	Confident	81.9	Confident	109 Å²	109	65.2 Å²	65.2	57%	0.571	30%	0.302	S	S	*	.			trans	-83.4	146	-179.7	-54.5	178.6	0	0	0	111.5	H673	H673-L675 PolarHBondContact ND1-N 3.32Å; H673-L675 VanDerWaalsContact ND1-N 3.14Å; H673-L675 PolarHBondContact ND1-O 3.45Å; H673-L675 PolarHBondContact O-N 3.18Å
676	F	88.8	Confident	80.7	Confident	115 Å²	115	72.5 Å²	72.5	50%	0.504	33%	0.334	S	S	.	.	S	Bend	trans	-72.4	-47.6	172	177	-102.6	0	0	0	112	K597 E599	K597-F676 WeakPolarHBondContact O-CD2 3.16Å; K597-F676 VanDerWaalsContact O-CE2 3.25Å; K597-F676 WeakPolarHBondContact O-CE2 3.47Å; E599-F676 HydrophobicContact CB-CE1 4.2Å; E599-F676 HydrophobicContact CG-CD1 4.48Å; E599-F676 HydrophobicContact CG-CE1 3.65Å; E599-F676 HydrophobicContact CG-CZ 3.92Å; E599-F676 PolarHBondContact N-O 3.43Å
677	R	87.9	Confident	79.9	Confident	134 Å²	134	72.8 Å²	72.8	51%	0.506	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.8	177	-167.6	166.4	178.8	174.7	1.2	110.4	E599	E599-R677 HydrophobicContact CB-CB 4.39Å; E599-R677 HydrophobicContact CB-CG 4.17Å; E599-R677 CarbonylContact O-C 3.59Å; E599-R677 WeakPolarHBondContact O-CA 3.49Å
678	I	88.5	Confident	79.3	Confident	6 Å²	6	71.3 Å²	71.3	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.2	-169	-50.6	175.2	0	0	0	108.8	K598 E599 L600 Q601 A647 F671 H673 I680	K598-I678 HydrophobicContact CB-CD1 4.41Å; E599-I678 PolarHBondContact O-N 3.04Å; L600-I678 HydrophobicContact CD2-CB 4.06Å; L600-I678 HydrophobicContact CD2-CD1 4.02Å; L600-I678 HydrophobicContact CD2-CG1 4.41Å; Q601-I678 PolarHBondContact N-O 3.4Å; A647-I678 HydrophobicContact CB-CG2 4.35Å; F671-I678 HydrophobicContact CE1-CD1 3.56Å; F671-I678 HydrophobicContact CZ-CD1 3.98Å; H673-I678 HydrophobicContact CB-CD1 3.56Å; H673-I678 HydrophobicContact CB-CG1 4.45Å; I678-I680 HydrophobicContact CG2-CG1 4.11Å
679	K	84.4	Confident	78.9	Confident	58 Å²	58	75 Å²	75	25%	0.252	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	105.5	179.1	-167.2	165.7	-170.6	160.2	0	110.5	V474 Q601	V474-K679 PolarHBondContact O-NZ 2.84Å; Q601-K679 HydrophobicContact CB-CG 4.45Å
680	I	81.6	Confident	78.6	Confident	10 Å²	10	77.8 Å²	77.8	5%	0.051	36%	0.363	C	S	.	.			trans	-94.4	-10.4	-178.7	-51.2	179.9	0	0	0	111.2	L600 Q601 V602 Q606 L642 A647 V649 I678 Q682	L600-I680 HydrophobicContact CB-CD1 4.39Å; L600-I680 HydrophobicContact CD1-CD1 4.24Å; L600-I680 HydrophobicContact CD2-CD1 4.1Å; L600-I680 HydrophobicContact CG-CD1 4.48Å; Q601-I680 PolarHBondContact O-N 3.35Å; Q601-I680 VanDerWaalsContact O-N 3.09Å; V602-I680 HydrophobicContact CG1-CB 4.21Å; V602-I680 HydrophobicContact CG1-CD1 4.26Å; Q606-I680 PolarHBondContact NE2-O 3.4Å; L642-I680 HydrophobicContact CD2-CG2 4.15Å; A647-I680 HydrophobicContact CB-CG1 4.24Å; V649-I680 HydrophobicContact CB-CD1 4.49Å; V649-I680 HydrophobicContact CG1-CD1 3.58Å; V649-I680 HydrophobicContact CG2-CD1 4.05Å; I678-I680 HydrophobicContact CG2-CG1 4.11Å; I680-Q682 PolarHBondContact O-N 3.08Å
681	N	66.8	Low	78.3	Confident	5 Å²	5	76.3 Å²	76.3	3%	0.027	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	42.1	-177.6	-159.6	-1.2	0	0	0	114.7	Q684	N681-Q684 WeakPolarHBondContact OD1-CB 3.28Å; N681-Q684 PolarHBondContact OD1-OE1 3Å
682	Q	63.6	Low	78.2	Confident	117 Å²	117	77.7 Å²	77.7	55%	0.547	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-28.4	-178.3	-66.5	-173.9	16.7	0	0	113.3	I680	I680-Q682 PolarHBondContact O-N 3.08Å
683	I	60.2	Low	78.4	Confident	43 Å²	43	74.9 Å²	74.9	22%	0.221	35%	0.354	C	S	.	.	S	Bend	trans	-80.3	-34.7	-173.5	-77.4	158.5	0	0	0	112.8	R637 M685 K686	R637-I683 HydrophobicContact CB-CG2 4.27Å; R637-I683 PolarHBondContact NH2-O 3.3Å; I683-M685 PolarHBondContact O-N 3.49Å; I683-K686 PolarHBondContact O-N 2.93Å
684	Q	57.5	Low	78.3	Confident	33 Å²	33	73.6 Å²	73.6	15%	0.154	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.8	175.6	-65.6	-170.3	-28.5	0	0	113.6	S603 F605 E634 N681 K686	S603-Q684 PolarHBondContact OG-NE2 3.37Å; S603-Q684 VanDerWaalsContact OG-NE2 3.09Å; S603-Q684 PolarHBondContact OG-OE1 2.9Å; F605-Q684 VanDerWaalsContact CD2-NE2 3.29Å; E634-Q684 PolarHBondContact OE1-NE2 2.91Å; N681-Q684 WeakPolarHBondContact OD1-CB 3.28Å; N681-Q684 PolarHBondContact OD1-OE1 3Å; Q684-K686 VanDerWaalsContact C-N 3.3Å
685	M	61.2	Low	78.1	Confident	12 Å²	12	64.4 Å²	64.4	6%	0.059	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.5	177.9	-66.1	-155.5	78.3	0	0	113.8	K470 V474 K476 I683	K470-M685 HydrophobicContact CB-CE 4.49Å; V474-M685 HydrophobicContact CB-CE 3.9Å; V474-M685 HydrophobicContact CB-SD 4.2Å; V474-M685 HydrophobicContact CG1-CE 4.01Å; V474-M685 HydrophobicContact CG1-CG 4.26Å; V474-M685 HydrophobicContact CG1-SD 3.61Å; V474-M685 HydrophobicContact CG2-CE 4.35Å; K476-M685 HydrophobicContact CD-CE 3.84Å; K476-M685 HydrophobicContact CD-SD 3.45Å; K476-M685 WeakPolarHBondContact CD-SD 3.44Å; K476-M685 WeakPolarHBondContact CE-SD 3.48Å; K476-M685 HydrophobicContact CG-CE 4.35Å; K476-M685 HydrophobicContact CG-SD 4.32Å; K476-M685 PolarHBondContact NZ-SD 3.46Å; I683-M685 PolarHBondContact O-N 3.49Å
686	K	70.2	Confident	78	Confident	153 Å²	153	60.9 Å²	60.9	67%	0.665	30%	0.298	S	S	*	.	S	Bend	trans	-82.2	124.8	171.2	-69.3	-170.3	176.2	-173.6	0	108.4	R637 I683 Q684	R637-K686 PolarHBondContact NH2-O 3.48Å; I683-K686 PolarHBondContact O-N 2.93Å; Q684-K686 VanDerWaalsContact C-N 3.3Å
687	E	76.2	Confident	77.9	Confident	45 Å²	45	60.5 Å²	60.5	21%	0.21	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-57.9	133.5	165.7	179.5	-170.9	-143.6	0	0	109.3	K422 F463 K466 E691 Q692	K422-E687 WeakPolarHBondContact CE-OE2 3.29Å; K422-E687 IonicContact NZ-OE2 2.8Å; K422-E687 PolarHBondContact NZ-OE2 2.77Å; F463-E687 WeakPolarHBondContact CE1-OE1 3.29Å; K466-E687 IonicContact NZ-OE1 2.88Å; K466-E687 PolarHBondContact NZ-OE1 2.98Å; E687-E691 WeakPolarHBondContact CA-OE2 3.42Å; E687-E691 HydrophobicContact CG-CB 4.03Å; E687-Q692 HydrophobicContact CG-CB 4.24Å; E687-Q692 WeakPolarHBondContact OE1-CA 3.44Å; E687-Q692 WeakPolarHBondContact OE1-CB 3.29Å
688	T	80.3	Confident	77.8	Confident	24 Å²	24	58.5 Å²	58.5	15%	0.147	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-88.2	162.8	172.4	79.1	0	0	0	0	110.8	E690 E691 Q692	T688-E690 WeakPolarHBondContact CB-OE2 3.47Å; T688-E690 PolarHBondContact O-N 3.1Å; T688-E690 PolarHBondContact OG1-N 3.14Å; T688-E690 PolarHBondContact OG1-OE2 3.19Å; T688-E691 PolarHBondContact O-N 3.27Å; T688-E691 PolarHBondContact OG1-N 3.18Å; T688-E691 VanDerWaalsContact OG1-N 3.09Å; T688-Q692 PolarHBondContact O-N 2.76Å
689	V	82.9	Confident	77.8	Confident	99 Å²	99	58.7 Å²	58.7	60%	0.6	29%	0.292	S	S	*	.	H	α-helix	trans	-62.5	-36.8	177.1	-178.8	0	0	0	0	110.1	Q692 V693	V689-Q692 WeakPolarHBondContact O-CB 3.27Å; V689-Q692 PolarHBondContact O-N 2.85Å; V689-V693 HydrophobicContact CG1-CG2 4.4Å; V689-V693 WeakPolarHBondContact O-CG2 3.35Å; V689-V693 PolarHBondContact O-N 3.22Å
690	E	81.4	Confident	77.8	Confident	138 Å²	138	60.2 Å²	60.2	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-64.3	-44.1	176.4	-54	75.1	-159.1	0	0	111.2	T688 Q692 V693 S694	T688-E690 WeakPolarHBondContact CB-OE2 3.47Å; T688-E690 PolarHBondContact O-N 3.1Å; T688-E690 PolarHBondContact OG1-N 3.14Å; T688-E690 PolarHBondContact OG1-OE2 3.19Å; E690-Q692 VanDerWaalsContact C-N 3.3Å; E690-Q692 PolarHBondContact O-N 3.39Å; E690-V693 PolarHBondContact O-N 3.46Å; E690-S694 WeakPolarHBondContact O-CB 3.43Å; E690-S694 PolarHBondContact O-N 3.48Å
691	E	80.3	Confident	78	Confident	63 Å²	63	63.9 Å²	63.9	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-40.3	174.3	-76.7	-174.3	-178.2	0	0	111.8	K470 E687 T688 T695	K470-E691 IonicContact NZ-OE1 3.75Å; K470-E691 IonicContact NZ-OE2 2.72Å; K470-E691 PolarHBondContact NZ-OE2 2.74Å; E687-E691 WeakPolarHBondContact CA-OE2 3.42Å; E687-E691 HydrophobicContact CG-CB 4.03Å; T688-E691 PolarHBondContact O-N 3.27Å; T688-E691 PolarHBondContact OG1-N 3.18Å; T688-E691 VanDerWaalsContact OG1-N 3.09Å; E691-T695 WeakPolarHBondContact O-CB 3.26Å; E691-T695 PolarHBondContact O-N 3.35Å; E691-T695 PolarHBondContact O-OG1 3.29Å
692	Q	84.3	Confident	78.9	Confident	43 Å²	43	67.6 Å²	67.6	20%	0.201	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-46.9	-179.8	-173.3	-175.3	11.1	0	0	111.2	E418 F463 E687 T688 V689 E690 T695 T696	E418-Q692 PolarHBondContact OE1-NE2 3.43Å; F463-Q692 HydrophobicContact CE1-CG 4.15Å; F463-Q692 HydrophobicContact CZ-CG 4.31Å; E687-Q692 HydrophobicContact CG-CB 4.24Å; E687-Q692 WeakPolarHBondContact OE1-CA 3.44Å; E687-Q692 WeakPolarHBondContact OE1-CB 3.29Å; T688-Q692 PolarHBondContact O-N 2.76Å; V689-Q692 WeakPolarHBondContact O-CB 3.27Å; V689-Q692 PolarHBondContact O-N 2.85Å; E690-Q692 VanDerWaalsContact C-N 3.3Å; E690-Q692 PolarHBondContact O-N 3.39Å; Q692-T695 PolarHBondContact O-N 3.02Å; Q692-T696 WeakPolarHBondContact O-CB 3.48Å; Q692-T696 PolarHBondContact O-N 3.22Å; Q692-T696 VanDerWaalsContact O-N 3.08Å; Q692-T696 PolarHBondContact O-OG1 3.36Å
693	V	86.8	Confident	80.1	Confident	84 Å²	84	62.8 Å²	62.8	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-46.9	177.6	172.4	0	0	0	0	110.1	V689 E690 T695 T696 E697	V689-V693 HydrophobicContact CG1-CG2 4.4Å; V689-V693 WeakPolarHBondContact O-CG2 3.35Å; V689-V693 PolarHBondContact O-N 3.22Å; E690-V693 PolarHBondContact O-N 3.46Å; V693-T695 VanDerWaalsContact C-N 3.35Å; V693-T695 PolarHBondContact O-N 2.9Å; V693-T696 WeakPolarHBondContact O-CB 3.48Å; V693-T696 PolarHBondContact O-N 3.49Å; V693-T696 VanDerWaalsContact O-N 3.12Å; V693-E697 WeakPolarHBondContact O-CB 3.38Å; V693-E697 PolarHBondContact O-N 2.89Å
694	S	85.7	Confident	81.5	Confident	44 Å²	44	64.8 Å²	64.8	31%	0.308	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.1	-174.4	0	0	0	0	112.5	E690 T696 E697 R698	E690-S694 WeakPolarHBondContact O-CB 3.43Å; E690-S694 PolarHBondContact O-N 3.48Å; S694-T696 VanDerWaalsContact C-N 3.3Å; S694-T696 PolarHBondContact O-N 3Å; S694-E697 PolarHBondContact O-N 3.25Å; S694-R698 VanDerWaalsContact O-CG 3.31Å; S694-R698 WeakPolarHBondContact O-CG 3.46Å; S694-R698 PolarHBondContact O-N 3.27Å
695	T	84.7	Confident	83	Confident	17 Å²	17	70.6 Å²	70.6	10%	0.104	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-43.9	175.9	-55.3	0	0	0	0	110.5	A462 F463 K466 E691 Q692 V693 V699	A462-T695 HydrophobicContact CB-CG2 4.12Å; F463-T695 HydrophobicContact CD1-CG2 4.19Å; F463-T695 HydrophobicContact CD2-CG2 4.48Å; F463-T695 HydrophobicContact CE1-CG2 4.06Å; F463-T695 HydrophobicContact CE2-CG2 4.35Å; F463-T695 HydrophobicContact CG-CG2 4.4Å; F463-T695 HydrophobicContact CZ-CG2 4.14Å; K466-T695 PolarHBondContact NZ-OG1 3.26Å; E691-T695 WeakPolarHBondContact O-CB 3.26Å; E691-T695 PolarHBondContact O-N 3.35Å; E691-T695 PolarHBondContact O-OG1 3.29Å; Q692-T695 PolarHBondContact O-N 3.02Å; V693-T695 VanDerWaalsContact C-N 3.35Å; V693-T695 PolarHBondContact O-N 2.9Å; T695-V699 WeakPolarHBondContact O-CG2 3.45Å; T695-V699 PolarHBondContact O-N 2.87Å
696	T	85.6	Confident	84.3	Confident	35 Å²	35	74.3 Å²	74.3	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-44.3	-179.4	-54.3	0	0	0	0	111.7	Q692 V693 S694 R698 V699 F700	Q692-T696 WeakPolarHBondContact O-CB 3.48Å; Q692-T696 PolarHBondContact O-N 3.22Å; Q692-T696 VanDerWaalsContact O-N 3.08Å; Q692-T696 PolarHBondContact O-OG1 3.36Å; V693-T696 WeakPolarHBondContact O-CB 3.48Å; V693-T696 PolarHBondContact O-N 3.49Å; V693-T696 VanDerWaalsContact O-N 3.12Å; S694-T696 VanDerWaalsContact C-N 3.3Å; S694-T696 PolarHBondContact O-N 3Å; T696-R698 PolarHBondContact O-N 2.77Å; T696-V699 WeakPolarHBondContact O-CB 3.14Å; T696-V699 PolarHBondContact O-N 3.47Å; T696-F700 HydrophobicContact CG2-CD2 4.02Å; T696-F700 HydrophobicContact CG2-CE2 3.54Å; T696-F700 HydrophobicContact CG2-CZ 4.46Å; T696-F700 WeakPolarHBondContact O-CD2 3.33Å; T696-F700 PolarHBondContact O-N 3.49Å; T696-F700 VanDerWaalsContact O-N 3.16Å
697	E	86.3	Confident	85.3	Confident	108 Å²	108	67.4 Å²	67.4	51%	0.505	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-41.9	178.7	-172.4	174.5	-171.9	0	0	112	V693 S694 V699 F700 Q701	V693-E697 WeakPolarHBondContact O-CB 3.38Å; V693-E697 PolarHBondContact O-N 2.89Å; S694-E697 PolarHBondContact O-N 3.25Å; E697-V699 VanDerWaalsContact C-N 3.32Å; E697-V699 PolarHBondContact O-N 3.38Å; E697-F700 PolarHBondContact O-N 3.06Å; E697-F700 VanDerWaalsContact O-N 3.11Å; E697-Q701 WeakPolarHBondContact O-CG 3.31Å; E697-Q701 PolarHBondContact O-N 3.09Å
698	R	86.3	Confident	86	Confident	92 Å²	92	65.8 Å²	65.8	35%	0.347	32%	0.322	S	S	.	.	H	α-helix	trans	-58.8	-42.1	174.3	-73.9	174.9	-175.3	-179.4	0.8	112.1	S546 S694 T696 F700 Q701 D702	S546-R698 PolarHBondContact O-NH1 3.32Å; S694-R698 VanDerWaalsContact O-CG 3.31Å; S694-R698 WeakPolarHBondContact O-CG 3.46Å; S694-R698 PolarHBondContact O-N 3.27Å; T696-R698 PolarHBondContact O-N 2.77Å; R698-F700 VanDerWaalsContact C-N 3.3Å; R698-F700 PolarHBondContact O-N 2.95Å; R698-Q701 PolarHBondContact O-N 3.33Å; R698-D702 WeakPolarHBondContact O-CB 3.3Å; R698-D702 PolarHBondContact O-N 3.44Å
699	V	87.1	Confident	86.5	Confident	10 Å²	10	67 Å²	67	6%	0.061	34%	0.335	C	S	.	.	H	α-helix	trans	-59.9	-43.2	175.3	175.2	0	0	0	0	110.8	V459 A462 T695 T696 E697 Q701 D702 R703	V459-V699 HydrophobicContact CG2-CG1 3.85Å; A462-V699 HydrophobicContact CB-CG2 3.33Å; T695-V699 WeakPolarHBondContact O-CG2 3.45Å; T695-V699 PolarHBondContact O-N 2.87Å; T696-V699 WeakPolarHBondContact O-CB 3.14Å; T696-V699 PolarHBondContact O-N 3.47Å; E697-V699 VanDerWaalsContact C-N 3.32Å; E697-V699 PolarHBondContact O-N 3.38Å; V699-Q701 PolarHBondContact O-N 3.41Å; V699-D702 PolarHBondContact O-N 3.49Å; V699-R703 WeakPolarHBondContact O-CG 3.32Å; V699-R703 PolarHBondContact O-N 2.92Å
700	F	85.1	Confident	86.9	Confident	90 Å²	90	62.4 Å²	62.4	40%	0.395	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-37.7	177.3	-72.3	-60.2	0	0	0	113.2	N414 T696 E697 R698 Q704	N414-F700 WeakPolarHBondContact ND2-CZ 3.31Å; T696-F700 HydrophobicContact CG2-CD2 4.02Å; T696-F700 HydrophobicContact CG2-CE2 3.54Å; T696-F700 HydrophobicContact CG2-CZ 4.46Å; T696-F700 WeakPolarHBondContact O-CD2 3.33Å; T696-F700 PolarHBondContact O-N 3.49Å; T696-F700 VanDerWaalsContact O-N 3.16Å; E697-F700 PolarHBondContact O-N 3.06Å; E697-F700 VanDerWaalsContact O-N 3.11Å; R698-F700 VanDerWaalsContact C-N 3.3Å; R698-F700 PolarHBondContact O-N 2.95Å; F700-Q704 PolarHBondContact O-N 3.42Å
701	Q	85.9	Confident	87.5	Confident	87 Å²	87	55.9 Å²	55.9	41%	0.407	28%	0.277	S	S	.	.	H	α-helix	trans	-65.9	-45.2	173.9	-68.4	177.3	6.3	0	0	111.2	E697 R698 V699 R703 Q704 Y705	E697-Q701 WeakPolarHBondContact O-CG 3.31Å; E697-Q701 PolarHBondContact O-N 3.09Å; R698-Q701 PolarHBondContact O-N 3.33Å; V699-Q701 PolarHBondContact O-N 3.41Å; Q701-R703 VanDerWaalsContact C-N 3.29Å; Q701-R703 PolarHBondContact O-N 3.06Å; Q701-Q704 WeakPolarHBondContact O-CB 3.27Å; Q701-Q704 PolarHBondContact O-N 3.49Å; Q701-Y705 WeakPolarHBondContact O-CD2 3.32Å; Q701-Y705 PolarHBondContact O-N 2.85Å
702	D	85.9	Confident	88.1	Confident	82 Å²	82	54.4 Å²	54.4	44%	0.439	27%	0.272	S	S	.	.	H	α-helix	trans	-59.4	-38.7	177.4	-80.2	-8	0	0	0	112	R698 V699 Q704 Y705 Q706	R698-D702 WeakPolarHBondContact O-CB 3.3Å; R698-D702 PolarHBondContact O-N 3.44Å; V699-D702 PolarHBondContact O-N 3.49Å; D702-Q704 VanDerWaalsContact C-N 3.25Å; D702-Q704 PolarHBondContact O-N 3.04Å; D702-Y705 PolarHBondContact O-N 3.16Å; D702-Q706 WeakPolarHBondContact O-CG 3.42Å; D702-Q706 PolarHBondContact O-N 2.99Å
703	R	89.1	Confident	88.5	Confident	17 Å²	17	59.9 Å²	59.9	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-37.3	173.9	-75.6	178.7	177.9	176.1	3.8	112.3	N414 D458 V459 V699 Q701 Q706 I707 F736	N414-R703 PolarHBondContact OD1-NH1 2.92Å; N414-R703 PolarHBondContact OD1-NH2 3.47Å; D458-R703 IonicContact OD1-CZ 3.74Å; D458-R703 IonicContact OD1-NE 2.72Å; D458-R703 IonicContact OD1-NH2 2.61Å; D458-R703 PolarHBondContact OD1-NH2 2.95Å; D458-R703 WeakPolarHBondContact OD2-CG 3.39Å; D458-R703 IonicContact OD2-CZ 3.89Å; D458-R703 IonicContact OD2-NE 2.74Å; D458-R703 PolarHBondContact OD2-NE 3.42Å; D458-R703 IonicContact OD2-NH2 2.71Å; D458-R703 PolarHBondContact OD2-NH2 3.06Å; V459-R703 VanDerWaalsContact CG2-NH2 3.34Å; V699-R703 WeakPolarHBondContact O-CG 3.32Å; V699-R703 PolarHBondContact O-N 2.92Å; Q701-R703 VanDerWaalsContact C-N 3.29Å; Q701-R703 PolarHBondContact O-N 3.06Å; R703-Q706 PolarHBondContact O-N 3Å; R703-I707 WeakPolarHBondContact O-CD1 3.44Å; R703-I707 VanDerWaalsContact O-CG1 3.23Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 3.02Å; R703-F736 HydrophobicContact CB-CD2 4.33Å; R703-F736 HydrophobicContact CB-CE1 4.46Å; R703-F736 HydrophobicContact CB-CE2 3.67Å; R703-F736 HydrophobicContact CB-CZ 3.75Å; R703-F736 HydrophobicContact CG-CD1 4.11Å; R703-F736 HydrophobicContact CG-CD2 3.78Å; R703-F736 HydrophobicContact CG-CE1 3.94Å; R703-F736 HydrophobicContact CG-CE2 3.57Å; R703-F736 HydrophobicContact CG-CG 4.05Å; R703-F736 HydrophobicContact CG-CZ 3.67Å
704	Q	88.4	Confident	88.8	Confident	85 Å²	85	56.1 Å²	56.1	40%	0.397	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-43.6	179.1	-60.8	-177.8	24.6	0	0	111.6	F700 Q701 D702 Q706 I707 D708 R746	F700-Q704 PolarHBondContact O-N 3.42Å; Q701-Q704 WeakPolarHBondContact O-CB 3.27Å; Q701-Q704 PolarHBondContact O-N 3.49Å; D702-Q704 VanDerWaalsContact C-N 3.25Å; D702-Q704 PolarHBondContact O-N 3.04Å; Q704-Q706 VanDerWaalsContact C-N 3.33Å; Q704-Q706 PolarHBondContact O-N 3.44Å; Q704-I707 PolarHBondContact O-N 3.21Å; Q704-D708 PolarHBondContact O-N 3.14Å; Q704-R746 VanDerWaalsContact OE1-NH1 3.11Å
705	Y	89.9	Confident	89.2	Confident	154 Å²	154	54.1 Å²	54.1	60%	0.604	25%	0.253	S	S	*	.	H	α-helix	trans	-66.5	-36.1	176.1	-61.3	-58.1	0	0	0	112.3	Q701 D702 D708 A709	Q701-Y705 WeakPolarHBondContact O-CD2 3.32Å; Q701-Y705 PolarHBondContact O-N 2.85Å; D702-Y705 PolarHBondContact O-N 3.16Å; Y705-D708 PolarHBondContact O-N 3.11Å; Y705-A709 WeakPolarHBondContact O-CB 3.06Å; Y705-A709 PolarHBondContact O-N 3.49Å
706	Q	88.5	Confident	89.6	Confident	91 Å²	91	59.2 Å²	59.2	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-66.1	-40.4	174.4	-71.2	-174.7	52.1	0	0	112.3	D702 R703 Q704 A710 F736	D702-Q706 WeakPolarHBondContact O-CG 3.42Å; D702-Q706 PolarHBondContact O-N 2.99Å; R703-Q706 PolarHBondContact O-N 3Å; Q704-Q706 VanDerWaalsContact C-N 3.33Å; Q704-Q706 PolarHBondContact O-N 3.44Å; Q706-A710 VanDerWaalsContact O-CB 3.3Å; Q706-A710 WeakPolarHBondContact O-CB 3.33Å; Q706-A710 PolarHBondContact O-N 3.09Å; Q706-F736 HydrophobicContact CB-CE1 4.24Å; Q706-F736 HydrophobicContact CB-CZ 4.13Å
707	I	90.9	Very high	89.9	Confident	7 Å²	7	63.6 Å²	63.6	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-51.2	173.7	-69	161.4	0	0	0	109.5	R703 Q704 A709 A710 V711 L734 F736 V738 L743 R746	R703-I707 WeakPolarHBondContact O-CD1 3.44Å; R703-I707 VanDerWaalsContact O-CG1 3.23Å; R703-I707 WeakPolarHBondContact O-CG1 3.39Å; R703-I707 PolarHBondContact O-N 3.02Å; Q704-I707 PolarHBondContact O-N 3.21Å; I707-A709 PolarHBondContact O-N 3.04Å; I707-A710 PolarHBondContact O-N 2.92Å; I707-A710 VanDerWaalsContact O-N 3.17Å; I707-V711 HydrophobicContact CG2-CG2 4.19Å; I707-V711 VanDerWaalsContact O-CG2 3.3Å; I707-V711 WeakPolarHBondContact O-CG2 3.38Å; I707-V711 PolarHBondContact O-N 3.42Å; I707-L734 HydrophobicContact CG1-CD1 3.75Å; I707-F736 HydrophobicContact CD1-CE2 4.25Å; I707-F736 HydrophobicContact CG1-CE2 4.17Å; I707-F736 HydrophobicContact CG1-CZ 4.23Å; I707-V738 HydrophobicContact CD1-CG1 3.78Å; I707-V738 HydrophobicContact CD1-CG2 4.07Å; I707-V738 HydrophobicContact CG1-CG1 4.49Å; I707-V738 HydrophobicContact CG1-CG2 4.22Å; I707-L743 HydrophobicContact CG2-CD1 3.89Å; I707-R746 HydrophobicContact CB-CG 4.35Å; I707-R746 HydrophobicContact CG2-CB 3.91Å; I707-R746 HydrophobicContact CG2-CG 3.86Å
708	D	91.4	Very high	90.2	Very high	11 Å²	11	64.9 Å²	64.9	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-55.1	-51.2	178.5	-82.4	10.7	0	0	0	112.3	Q704 Y705 A710 V711 V712 R746 R753	Q704-D708 PolarHBondContact O-N 3.14Å; Y705-D708 PolarHBondContact O-N 3.11Å; D708-A710 VanDerWaalsContact C-N 3.27Å; D708-A710 PolarHBondContact O-N 3.11Å; D708-V711 PolarHBondContact O-N 2.95Å; D708-V712 VanDerWaalsContact O-CG2 3.32Å; D708-V712 WeakPolarHBondContact O-CG2 3.45Å; D708-V712 PolarHBondContact O-N 3.34Å; D708-R746 IonicContact OD1-CZ 3.35Å; D708-R746 VanDerWaalsContact OD1-CZ 3.27Å; D708-R746 IonicContact OD1-NE 2.79Å; D708-R746 PolarHBondContact OD1-NE 2.89Å; D708-R746 IonicContact OD1-NH2 2.71Å; D708-R746 PolarHBondContact OD1-NH2 3.39Å; D708-R746 IonicContact OD2-CZ 2.62Å; D708-R746 IonicContact OD2-NE 3.93Å; D708-R746 IonicContact OD2-NH2 3.27Å; D708-R746 PolarHBondContact OD2-NH2 3.07Å; D708-R753 IonicContact OD1-NH2 2.64Å; D708-R753 IonicContact OD2-CZ 3.69Å; D708-R753 IonicContact OD2-NH1 2.67Å; D708-R753 IonicContact OD2-NH2 2.6Å; D708-R753 PolarHBondContact OD2-NH2 3.42Å
709	A	90.5	Very high	90.5	Very high	50 Å²	50	65.6 Å²	65.6	41%	0.413	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-33.6	-179.2	0	0	0	0	0	112.4	Y705 I707 R713	Y705-A709 WeakPolarHBondContact O-CB 3.06Å; Y705-A709 PolarHBondContact O-N 3.49Å; I707-A709 PolarHBondContact O-N 3.04Å; A709-R713 VanDerWaalsContact O-CB 3.27Å; A709-R713 WeakPolarHBondContact O-CB 3.33Å; A709-R713 PolarHBondContact O-N 2.88Å; A709-R713 VanDerWaalsContact O-N 3.15Å
710	A	91.8	Very high	90.8	Very high	3 Å²	3	68 Å²	68	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-70.3	-47.9	175	0	0	0	0	0	111.4	Q706 I707 D708 V712 R713 I714 L730 L734	Q706-A710 VanDerWaalsContact O-CB 3.3Å; Q706-A710 WeakPolarHBondContact O-CB 3.33Å; Q706-A710 PolarHBondContact O-N 3.09Å; I707-A710 PolarHBondContact O-N 2.92Å; I707-A710 VanDerWaalsContact O-N 3.17Å; D708-A710 VanDerWaalsContact C-N 3.27Å; D708-A710 PolarHBondContact O-N 3.11Å; A710-V712 PolarHBondContact O-N 3.28Å; A710-R713 PolarHBondContact O-N 2.84Å; A710-I714 WeakPolarHBondContact O-CG1 3.49Å; A710-I714 PolarHBondContact O-N 3.2Å; A710-L730 HydrophobicContact CB-CD2 3.72Å; A710-L734 HydrophobicContact CB-CD2 4Å
711	V	92.2	Very high	91.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.8	-50.8	177	175.1	0	0	0	0	110.3	I707 D708 R713 I714 M715 L726 L730 L750 M756	I707-V711 HydrophobicContact CG2-CG2 4.19Å; I707-V711 VanDerWaalsContact O-CG2 3.3Å; I707-V711 WeakPolarHBondContact O-CG2 3.38Å; I707-V711 PolarHBondContact O-N 3.42Å; D708-V711 PolarHBondContact O-N 2.95Å; V711-R713 VanDerWaalsContact C-N 3.3Å; V711-R713 PolarHBondContact O-N 3.27Å; V711-I714 PolarHBondContact O-N 3.05Å; V711-M715 HydrophobicContact CG1-CG 4.12Å; V711-M715 WeakPolarHBondContact O-CB 3.42Å; V711-M715 VanDerWaalsContact O-CG 3.31Å; V711-M715 WeakPolarHBondContact O-CG 3.28Å; V711-M715 PolarHBondContact O-N 3.41Å; V711-L726 HydrophobicContact CG1-CD2 4.44Å; V711-L730 HydrophobicContact CG2-CD1 3.85Å; V711-L730 HydrophobicContact CG2-CD2 3.83Å; V711-L730 HydrophobicContact CG2-CG 4.44Å; V711-L750 HydrophobicContact CB-CD1 3.61Å; V711-L750 HydrophobicContact CG1-CD1 3.43Å; V711-L750 VanDerWaalsContact CG1-CD1 3.43Å; V711-L750 HydrophobicContact CG2-CD1 4.21Å; V711-M756 HydrophobicContact CG1-SD 3.74Å
712	V	93.3	Very high	91.6	Very high	33 Å²	33	62.6 Å²	62.6	20%	0.2	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-41	179.8	172.6	0	0	0	0	111.2	D708 A710 K716 L750 Y755 Y768	D708-V712 VanDerWaalsContact O-CG2 3.32Å; D708-V712 WeakPolarHBondContact O-CG2 3.45Å; D708-V712 PolarHBondContact O-N 3.34Å; A710-V712 PolarHBondContact O-N 3.28Å; V712-K716 WeakPolarHBondContact O-CB 3.49Å; V712-K716 PolarHBondContact O-N 3.01Å; V712-L750 HydrophobicContact CG2-CD1 4.45Å; V712-L750 HydrophobicContact CG2-CD2 3.72Å; V712-Y755 HydrophobicContact CG1-CD1 4.07Å; V712-Y755 HydrophobicContact CG1-CE1 4.41Å; V712-Y755 HydrophobicContact CG2-CD1 3.74Å; V712-Y755 HydrophobicContact CG2-CE1 4.32Å; V712-Y755 HydrophobicContact CG2-CG 4.16Å; V712-Y768 HydrophobicContact CG1-CE2 4.48Å
713	R	93.1	Very high	91.8	Very high	158 Å²	158	61.3 Å²	61.3	60%	0.596	29%	0.288	S	S	*	.	H	α-helix	trans	-65.1	-45	178.9	-168.6	-172.7	-49.4	175.8	2.8	112.3	A709 A710 V711 M717	A709-R713 VanDerWaalsContact O-CB 3.27Å; A709-R713 WeakPolarHBondContact O-CB 3.33Å; A709-R713 PolarHBondContact O-N 2.88Å; A709-R713 VanDerWaalsContact O-N 3.15Å; A710-R713 PolarHBondContact O-N 2.84Å; V711-R713 VanDerWaalsContact C-N 3.3Å; V711-R713 PolarHBondContact O-N 3.27Å; R713-M717 PolarHBondContact O-N 2.79Å
714	I	92.8	Very high	91.9	Very high	5 Å²	5	66.7 Å²	66.7	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-51.9	177.5	-70.1	164.1	0	0	0	109.9	A710 V711 K716 M717 R718 L721 L726 E729 L730	A710-I714 WeakPolarHBondContact O-CG1 3.49Å; A710-I714 PolarHBondContact O-N 3.2Å; V711-I714 PolarHBondContact O-N 3.05Å; I714-K716 VanDerWaalsContact C-N 3.34Å; I714-K716 PolarHBondContact O-N 3.36Å; I714-M717 PolarHBondContact O-N 3.31Å; I714-M717 VanDerWaalsContact O-N 3.09Å; I714-R718 HydrophobicContact CG2-CG 4.32Å; I714-R718 PolarHBondContact O-N 3.48Å; I714-L721 HydrophobicContact CG2-CD2 3.67Å; I714-L726 HydrophobicContact CB-CD1 4.23Å; I714-L726 HydrophobicContact CD1-CD1 4.35Å; I714-L726 HydrophobicContact CG2-CD1 3.74Å; I714-E729 HydrophobicContact CD1-CB 3.88Å; I714-E729 WeakPolarHBondContact CG2-OE2 3.44Å; I714-L730 HydrophobicContact CD1-CD2 3.77Å; I714-L730 HydrophobicContact CD1-CG 4Å
715	M	93.6	Very high	92	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-41.1	-178.6	-71.8	-56.7	-60	0	0	111.6	V711 M717 K719 L721 L726 M756 Y766 Y768	V711-M715 HydrophobicContact CG1-CG 4.12Å; V711-M715 WeakPolarHBondContact O-CB 3.42Å; V711-M715 VanDerWaalsContact O-CG 3.31Å; V711-M715 WeakPolarHBondContact O-CG 3.28Å; V711-M715 PolarHBondContact O-N 3.41Å; M715-M717 VanDerWaalsContact C-N 3.25Å; M715-M717 PolarHBondContact O-N 2.91Å; M715-K719 VanDerWaalsContact O-CA 3.26Å; M715-K719 WeakPolarHBondContact O-CA 3.29Å; M715-K719 PolarHBondContact O-N 3.32Å; M715-L721 HydrophobicContact SD-CB 4.03Å; M715-L726 HydrophobicContact SD-CD1 4.34Å; M715-L726 HydrophobicContact SD-CD2 4.48Å; M715-M756 HydrophobicContact CE-CE 4.24Å; M715-M756 HydrophobicContact CG-CE 4.21Å; M715-M756 HydrophobicContact CG-SD 4.33Å; M715-M756 HydrophobicContact SD-CE 4.24Å; M715-Y766 WeakPolarHBondContact CE-O 3.49Å; M715-Y768 HydrophobicContact CB-CD2 3.79Å; M715-Y768 HydrophobicContact CB-CG 4.34Å; M715-Y768 WeakPolarHBondContact O-CB 3.46Å
716	K	93.8	Very high	92.1	Very high	124 Å²	124	59.5 Å²	59.5	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-35.5	175.6	-177.2	173.4	-178.7	173.5	0	112.8	V712 I714 K719 Y768	V712-K716 WeakPolarHBondContact O-CB 3.49Å; V712-K716 PolarHBondContact O-N 3.01Å; I714-K716 VanDerWaalsContact C-N 3.34Å; I714-K716 PolarHBondContact O-N 3.36Å; K716-K719 WeakPolarHBondContact O-CD 3.34Å; K716-K719 WeakPolarHBondContact O-CE 3.31Å; K716-K719 PolarHBondContact O-NZ 3.45Å; K716-Y768 HydrophobicContact CB-CD2 4.29Å; K716-Y768 HydrophobicContact CB-CE1 4.12Å; K716-Y768 HydrophobicContact CB-CE2 3.84Å; K716-Y768 HydrophobicContact CG-CE1 4.02Å; K716-Y768 HydrophobicContact CG-CE2 4.47Å
717	M	92.8	Very high	92.1	Very high	128 Å²	128	56.5 Å²	56.5	63%	0.631	28%	0.28	S	S	*	.	H	α-helix	trans	-79.3	-47.4	-179.7	-176.3	179.4	70.9	0	0	112.3	R713 I714 M715	R713-M717 PolarHBondContact O-N 2.79Å; I714-M717 PolarHBondContact O-N 3.31Å; I714-M717 VanDerWaalsContact O-N 3.09Å; M715-M717 VanDerWaalsContact C-N 3.25Å; M715-M717 PolarHBondContact O-N 2.91Å
718	R	92.3	Very high	92	Very high	134 Å²	134	59 Å²	59	51%	0.506	30%	0.298	S	S	.	.	H	α-helix	trans	-84.6	-22.2	-174.3	-63.2	-64.6	-165.5	177.2	2.4	113.6	I714 T720 L721 E729	I714-R718 HydrophobicContact CG2-CG 4.32Å; I714-R718 PolarHBondContact O-N 3.48Å; R718-T720 PolarHBondContact O-N 3.31Å; R718-L721 HydrophobicContact CB-CD1 4.14Å; R718-L721 HydrophobicContact CG-CD1 4.11Å; R718-L721 HydrophobicContact CG-CD2 4.47Å; R718-E729 IonicContact CZ-OE1 2.72Å; R718-E729 VanDerWaalsContact CZ-OE1 3.29Å; R718-E729 IonicContact NE-OE1 3.98Å; R718-E729 PolarHBondContact NE-OE1 3.38Å; R718-E729 IonicContact NE-OE2 2.7Å; R718-E729 IonicContact NH2-OE1 3.94Å; R718-E729 PolarHBondContact NH2-OE1 3.37Å
719	K	92.8	Very high	91.9	Very high	108 Å²	108	60.2 Å²	60.2	47%	0.47	30%	0.303	S	S	.	.	S	Bend	trans	63	-43.1	-174.3	-55.7	-56.1	-172.2	-171.6	0	115.3	M715 K716 H767 Y768	M715-K719 VanDerWaalsContact O-CA 3.26Å; M715-K719 WeakPolarHBondContact O-CA 3.29Å; M715-K719 PolarHBondContact O-N 3.32Å; K716-K719 WeakPolarHBondContact O-CD 3.34Å; K716-K719 WeakPolarHBondContact O-CE 3.31Å; K716-K719 PolarHBondContact O-NZ 3.45Å; K719-H767 CarbonylContact O-C 3.53Å; K719-H767 WeakPolarHBondContact O-CA 3.32Å; K719-Y768 HydrophobicContact CD-CD1 4.06Å; K719-Y768 PolarHBondContact O-N 2.65Å
720	T	92.8	Very high	91.8	Very high	59 Å²	59	58 Å²	58	36%	0.362	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.6	178.6	-60.2	0	0	0	0	109.1	R718 Q765 Y766 H767	R718-T720 PolarHBondContact O-N 3.31Å; T720-Q765 HydrophobicContact CG2-CG 3.89Å; T720-Y766 VanDerWaalsContact CA-O 3.31Å; T720-Y766 WeakPolarHBondContact CA-O 3.41Å; T720-H767 PolarHBondContact OG1-ND1 2.92Å
721	L	94.3	Very high	91.3	Very high	12 Å²	12	63.4 Å²	63.4	6%	0.063	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.5	-178.4	-152.9	67.1	0	0	0	111.6	I714 M715 R718 L725 L726 Y766	I714-L721 HydrophobicContact CG2-CD2 3.67Å; M715-L721 HydrophobicContact SD-CB 4.03Å; R718-L721 HydrophobicContact CB-CD1 4.14Å; R718-L721 HydrophobicContact CG-CD1 4.11Å; R718-L721 HydrophobicContact CG-CD2 4.47Å; L721-L725 HydrophobicContact CD1-CB 4.24Å; L721-L725 HydrophobicContact CD1-CD2 3.51Å; L721-L725 HydrophobicContact CD1-CG 3.85Å; L721-L725 HydrophobicContact CG-CB 4.14Å; L721-L725 HydrophobicContact CG-CD2 4.32Å; L721-L725 HydrophobicContact CG-CG 4.23Å; L721-L726 HydrophobicContact CD2-CB 3.8Å; L721-L726 HydrophobicContact CD2-CD1 4.04Å; L721-L726 HydrophobicContact CG-CB 4.41Å; L721-Y766 PolarHBondContact N-O 2.88Å; L721-Y766 PolarHBondContact O-N 2.93Å
722	S	94.1	Very high	90.8	Very high	53 Å²	53	69.1 Å²	69.1	37%	0.371	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	154.7	172.5	71.4	0	0	0	0	111.3	N724 L725 L726 N764	S722-N724 PolarHBondContact O-N 3.48Å; S722-L725 PolarHBondContact O-N 3.2Å; S722-L725 WeakPolarHBondContact OG-CB 3.39Å; S722-L726 WeakPolarHBondContact O-CB 3.49Å; S722-L726 PolarHBondContact O-N 3.18Å; S722-N764 CarbonylContact C-O 3.4Å; S722-N764 VanDerWaalsContact CA-O 3.28Å; S722-N764 WeakPolarHBondContact CA-O 3.46Å
723	H	90.6	Very high	90.4	Very high	55 Å²	55	70.7 Å²	70.7	26%	0.255	34%	0.341	S	S	.	.	H	α-helix	trans	-55.1	-48.8	-179.4	-176.9	85	0	0	0	112.4	L725 L726 V727 N764 Y766	H723-L725 VanDerWaalsContact C-N 3.3Å; H723-L725 PolarHBondContact O-N 3.13Å; H723-L726 PolarHBondContact O-N 2.95Å; H723-V727 WeakPolarHBondContact O-CB 3.32Å; H723-V727 WeakPolarHBondContact O-CG2 3.38Å; H723-V727 PolarHBondContact O-N 2.94Å; H723-N764 PolarHBondContact N-O 2.89Å; H723-Y766 HydrophobicContact CB-CE2 3.79Å; H723-Y766 AromaticContact ND1-CE2 3.57Å; H723-Y766 AromaticContact ND1-CZ 3.73Å; H723-Y766 PolarHBondContact ND1-OH 3.44Å
724	N	90.1	Very high	89.9	Confident	130 Å²	130	64 Å²	64	70%	0.695	32%	0.316	S	S	*	.	H	α-helix	trans	-62.6	-37.1	-179.4	-69.9	-21.9	0	0	0	112.5	S722 S728	S722-N724 PolarHBondContact O-N 3.48Å; N724-S728 WeakPolarHBondContact O-CB 3.27Å; N724-S728 PolarHBondContact O-N 3.27Å
725	L	91.1	Very high	88.9	Confident	87 Å²	87	71.3 Å²	71.3	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-75	-37.2	179.8	-167.9	59	0	0	0	111.5	L721 S722 H723 S728 E729	L721-L725 HydrophobicContact CD1-CB 4.24Å; L721-L725 HydrophobicContact CD1-CD2 3.51Å; L721-L725 HydrophobicContact CD1-CG 3.85Å; L721-L725 HydrophobicContact CG-CB 4.14Å; L721-L725 HydrophobicContact CG-CD2 4.32Å; L721-L725 HydrophobicContact CG-CG 4.23Å; S722-L725 PolarHBondContact O-N 3.2Å; S722-L725 WeakPolarHBondContact OG-CB 3.39Å; H723-L725 VanDerWaalsContact C-N 3.3Å; H723-L725 PolarHBondContact O-N 3.13Å; L725-S728 PolarHBondContact O-N 2.95Å; L725-E729 PolarHBondContact O-N 3.32Å
726	L	90.8	Very high	88.3	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60.3	-48.5	171.5	179.6	61.2	0	0	0	111.3	V711 I714 M715 L721 S722 H723 S728 E729 L730 I747 M756 Y766	V711-L726 HydrophobicContact CG1-CD2 4.44Å; I714-L726 HydrophobicContact CB-CD1 4.23Å; I714-L726 HydrophobicContact CD1-CD1 4.35Å; I714-L726 HydrophobicContact CG2-CD1 3.74Å; M715-L726 HydrophobicContact SD-CD1 4.34Å; M715-L726 HydrophobicContact SD-CD2 4.48Å; L721-L726 HydrophobicContact CD2-CB 3.8Å; L721-L726 HydrophobicContact CD2-CD1 4.04Å; L721-L726 HydrophobicContact CG-CB 4.41Å; S722-L726 WeakPolarHBondContact O-CB 3.49Å; S722-L726 PolarHBondContact O-N 3.18Å; H723-L726 PolarHBondContact O-N 2.95Å; L726-S728 VanDerWaalsContact C-N 3.31Å; L726-S728 PolarHBondContact O-N 3.01Å; L726-E729 PolarHBondContact O-N 3.19Å; L726-L730 HydrophobicContact CD1-CD1 4.25Å; L726-L730 HydrophobicContact CD1-CG 4.35Å; L726-L730 HydrophobicContact CG-CD1 4.02Å; L726-L730 WeakPolarHBondContact O-CB 3.34Å; L726-L730 VanDerWaalsContact O-CG 3.26Å; L726-L730 WeakPolarHBondContact O-CG 3.5Å; L726-L730 PolarHBondContact O-N 3.35Å; L726-I747 HydrophobicContact CD2-CD1 4.11Å; L726-M756 HydrophobicContact CD2-CE 4.39Å; L726-Y766 HydrophobicContact CD2-CD2 4Å; L726-Y766 HydrophobicContact CD2-CE2 4.19Å
727	V	89.1	Confident	87.5	Confident	29 Å²	29	69.4 Å²	69.4	18%	0.176	35%	0.348	C	S	.	.	H	α-helix	trans	-58.3	-44.7	177.3	172.9	0	0	0	0	110.7	H723 L730 Y731 L743	H723-V727 WeakPolarHBondContact O-CB 3.32Å; H723-V727 WeakPolarHBondContact O-CG2 3.38Å; H723-V727 PolarHBondContact O-N 2.94Å; V727-L730 PolarHBondContact O-N 2.61Å; V727-Y731 HydrophobicContact CG1-CD2 3.66Å; V727-Y731 HydrophobicContact CG1-CE2 3.36Å; V727-Y731 WeakPolarHBondContact O-CD2 3.25Å; V727-Y731 PolarHBondContact O-N 3.43Å; V727-L743 HydrophobicContact CB-CD2 4.42Å; V727-L743 HydrophobicContact CG1-CD2 4.43Å; V727-L743 HydrophobicContact CG2-CD2 3.67Å
728	S	88.3	Confident	87	Confident	59 Å²	59	64 Å²	64	41%	0.413	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-45.8	177.3	-173.5	0	0	0	0	112.5	N724 L725 L726 L730 Y731 N732	N724-S728 WeakPolarHBondContact O-CB 3.27Å; N724-S728 PolarHBondContact O-N 3.27Å; L725-S728 PolarHBondContact O-N 2.95Å; L726-S728 VanDerWaalsContact C-N 3.31Å; L726-S728 PolarHBondContact O-N 3.01Å; S728-L730 VanDerWaalsContact C-N 3.33Å; S728-L730 PolarHBondContact O-N 3.08Å; S728-Y731 PolarHBondContact O-N 3.25Å; S728-N732 PolarHBondContact O-N 3.28Å; S728-N732 PolarHBondContact O-ND2 3.22Å; S728-N732 VanDerWaalsContact O-ND2 3.14Å
729	E	89.7	Confident	86.6	Confident	36 Å²	36	64.8 Å²	64.8	17%	0.168	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-37.5	175.8	-74.6	-160.7	-178.5	0	0	112	I714 R718 L725 L726 N732 Q733	I714-E729 HydrophobicContact CD1-CB 3.88Å; I714-E729 WeakPolarHBondContact CG2-OE2 3.44Å; R718-E729 IonicContact CZ-OE1 2.72Å; R718-E729 VanDerWaalsContact CZ-OE1 3.29Å; R718-E729 IonicContact NE-OE1 3.98Å; R718-E729 PolarHBondContact NE-OE1 3.38Å; R718-E729 IonicContact NE-OE2 2.7Å; R718-E729 IonicContact NH2-OE1 3.94Å; R718-E729 PolarHBondContact NH2-OE1 3.37Å; L725-E729 PolarHBondContact O-N 3.32Å; L726-E729 PolarHBondContact O-N 3.19Å; E729-N732 PolarHBondContact O-N 3.47Å; E729-Q733 WeakPolarHBondContact O-CB 3.4Å; E729-Q733 PolarHBondContact O-N 2.96Å
730	L	88.1	Confident	86.1	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-42.3	176.1	-73.4	167.9	0	0	0	112.6	A710 V711 I714 L726 V727 S728 N732 Q733 L734 L743	A710-L730 HydrophobicContact CB-CD2 3.72Å; V711-L730 HydrophobicContact CG2-CD1 3.85Å; V711-L730 HydrophobicContact CG2-CD2 3.83Å; V711-L730 HydrophobicContact CG2-CG 4.44Å; I714-L730 HydrophobicContact CD1-CD2 3.77Å; I714-L730 HydrophobicContact CD1-CG 4Å; L726-L730 HydrophobicContact CD1-CD1 4.25Å; L726-L730 HydrophobicContact CD1-CG 4.35Å; L726-L730 HydrophobicContact CG-CD1 4.02Å; L726-L730 WeakPolarHBondContact O-CB 3.34Å; L726-L730 VanDerWaalsContact O-CG 3.26Å; L726-L730 WeakPolarHBondContact O-CG 3.5Å; L726-L730 PolarHBondContact O-N 3.35Å; V727-L730 PolarHBondContact O-N 2.61Å; S728-L730 VanDerWaalsContact C-N 3.33Å; S728-L730 PolarHBondContact O-N 3.08Å; L730-N732 PolarHBondContact O-N 2.84Å; L730-Q733 PolarHBondContact O-N 3.46Å; L730-L734 HydrophobicContact CB-CD1 4.31Å; L730-L734 HydrophobicContact CD2-CD1 4.27Å; L730-L734 VanDerWaalsContact O-CB 3.29Å; L730-L734 WeakPolarHBondContact O-CB 3.35Å; L730-L734 WeakPolarHBondContact O-CG 3.38Å; L730-L734 PolarHBondContact O-N 3.26Å; L730-L743 HydrophobicContact CD1-CD1 3.48Å; L730-L743 VanDerWaalsContact CD1-CD1 3.48Å; L730-L743 HydrophobicContact CD1-CD2 4.05Å; L730-L743 HydrophobicContact CD1-CG 4.4Å
731	Y	82.3	Confident	85.8	Confident	117 Å²	117	63.7 Å²	63.7	46%	0.459	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-30.9	175.5	-81	-62.2	0	0	0	112.7	V727 S728 V738	V727-Y731 HydrophobicContact CG1-CD2 3.66Å; V727-Y731 HydrophobicContact CG1-CE2 3.36Å; V727-Y731 WeakPolarHBondContact O-CD2 3.25Å; V727-Y731 PolarHBondContact O-N 3.43Å; S728-Y731 PolarHBondContact O-N 3.25Å; Y731-V738 PolarHBondContact OH-O 3.46Å
732	N	82.3	Confident	85.3	Confident	120 Å²	120	66.7 Å²	66.7	64%	0.642	36%	0.358	S	S	*	.	H	α-helix	trans	-74.9	-35.6	175.3	-70.4	-37.6	0	0	0	112.5	S728 E729 L730	S728-N732 PolarHBondContact O-N 3.28Å; S728-N732 PolarHBondContact O-ND2 3.22Å; S728-N732 VanDerWaalsContact O-ND2 3.14Å; E729-N732 PolarHBondContact O-N 3.47Å; L730-N732 PolarHBondContact O-N 2.84Å
733	Q	84.1	Confident	85	Confident	66 Å²	66	64.6 Å²	64.6	31%	0.308	34%	0.342	S	S	.	.	H	α-helix	trans	-84.1	-40.6	-176.5	-169	176.5	-5.7	0	0	113	E729 L730	E729-Q733 WeakPolarHBondContact O-CB 3.4Å; E729-Q733 PolarHBondContact O-N 2.96Å; L730-Q733 PolarHBondContact O-N 3.46Å
734	L	83.1	Confident	84.9	Confident	16 Å²	16	67.7 Å²	67.7	8%	0.084	36%	0.355	C	S	.	.			trans	-80.5	135.4	-177.5	-62.1	173.9	0	0	0	110.4	I707 A710 L730 F736 V738	I707-L734 HydrophobicContact CG1-CD1 3.75Å; A710-L734 HydrophobicContact CB-CD2 4Å; L730-L734 HydrophobicContact CB-CD1 4.31Å; L730-L734 HydrophobicContact CD2-CD1 4.27Å; L730-L734 VanDerWaalsContact O-CB 3.29Å; L730-L734 WeakPolarHBondContact O-CB 3.35Å; L730-L734 WeakPolarHBondContact O-CG 3.38Å; L730-L734 PolarHBondContact O-N 3.26Å; L734-F736 VanDerWaalsContact C-N 3.32Å; L734-F736 HydrophobicContact CB-CZ 4.44Å; L734-F736 HydrophobicContact CD1-CE2 4.45Å; L734-F736 HydrophobicContact CD1-CZ 4.4Å; L734-F736 HydrophobicContact CD2-CE1 4.17Å; L734-F736 HydrophobicContact CD2-CZ 3.93Å; L734-F736 HydrophobicContact CG-CZ 4.5Å; L734-F736 PolarHBondContact O-N 2.91Å; L734-V738 HydrophobicContact CD1-CG2 3.58Å
735	K	71.4	Confident	84.9	Confident	159 Å²	159	68.3 Å²	68.3	69%	0.691	35%	0.352	S	S	*	.	S	Bend	trans	-95.8	23.7	-178.3	-59.2	-60.4	-177.6	-170.1	0	112.7
736	F	80.6	Confident	84.9	Confident	13 Å²	13	65.9 Å²	65.9	6%	0.057	34%	0.336	C	S	.	.	S	Bend	trans	-147.7	156.3	179.3	53.1	-97.2	0	0	0	110.9	R703 Q706 I707 L734 V738	R703-F736 HydrophobicContact CB-CD2 4.33Å; R703-F736 HydrophobicContact CB-CE1 4.46Å; R703-F736 HydrophobicContact CB-CE2 3.67Å; R703-F736 HydrophobicContact CB-CZ 3.75Å; R703-F736 HydrophobicContact CG-CD1 4.11Å; R703-F736 HydrophobicContact CG-CD2 3.78Å; R703-F736 HydrophobicContact CG-CE1 3.94Å; R703-F736 HydrophobicContact CG-CE2 3.57Å; R703-F736 HydrophobicContact CG-CG 4.05Å; R703-F736 HydrophobicContact CG-CZ 3.67Å; Q706-F736 HydrophobicContact CB-CE1 4.24Å; Q706-F736 HydrophobicContact CB-CZ 4.13Å; I707-F736 HydrophobicContact CD1-CE2 4.25Å; I707-F736 HydrophobicContact CG1-CE2 4.17Å; I707-F736 HydrophobicContact CG1-CZ 4.23Å; L734-F736 VanDerWaalsContact C-N 3.32Å; L734-F736 HydrophobicContact CB-CZ 4.44Å; L734-F736 HydrophobicContact CD1-CE2 4.45Å; L734-F736 HydrophobicContact CD1-CZ 4.4Å; L734-F736 HydrophobicContact CD2-CE1 4.17Å; L734-F736 HydrophobicContact CD2-CZ 3.93Å; L734-F736 HydrophobicContact CG-CZ 4.5Å; L734-F736 PolarHBondContact O-N 2.91Å; F736-V738 HydrophobicContact CD2-CG2 3.95Å; F736-V738 HydrophobicContact CE2-CG2 3.71Å; F736-V738 PolarHBondContact O-N 2.9Å
737	P	77.6	Confident	84.9	Confident	73 Å²	73	65.9 Å²	65.9	47%	0.474	34%	0.337	S	S	.	.			trans	-67.2	129.9	177.3	-17.1	31.1	0	0	0	111.2	H455	H455-P737 HydrophobicContact CB-CG 4Å
738	V	81.8	Confident	85	Confident	14 Å²	14	67.7 Å²	67.7	9%	0.085	34%	0.343	C	S	.	.			trans	-110.2	125.6	174	-175.3	0	0	0	0	108.9	I707 Y731 L734 F736 L743	I707-V738 HydrophobicContact CD1-CG1 3.78Å; I707-V738 HydrophobicContact CD1-CG2 4.07Å; I707-V738 HydrophobicContact CG1-CG1 4.49Å; I707-V738 HydrophobicContact CG1-CG2 4.22Å; Y731-V738 PolarHBondContact OH-O 3.46Å; L734-V738 HydrophobicContact CD1-CG2 3.58Å; F736-V738 HydrophobicContact CD2-CG2 3.95Å; F736-V738 HydrophobicContact CE2-CG2 3.71Å; F736-V738 PolarHBondContact O-N 2.9Å; V738-L743 HydrophobicContact CG1-CB 3.96Å
739	K	83.5	Confident	85.2	Confident	150 Å²	150	66.6 Å²	66.6	65%	0.652	34%	0.335	S	S	*	.			trans	-73.1	138.1	174.3	-63.2	179.5	179.9	176.7	0	109.3	G741 D742 L743	K739-G741 PolarHBondContact O-N 2.93Å; K739-G741 VanDerWaalsContact O-N 3.14Å; K739-D742 HydrophobicContact CB-CB 4.46Å; K739-D742 WeakPolarHBondContact CB-OD2 3.45Å; K739-D742 PolarHBondContact O-N 3.25Å; K739-L743 PolarHBondContact O-N 3.09Å; K739-L743 VanDerWaalsContact O-N 3.11Å
740	P	83.9	Confident	85.4	Confident	100 Å²	100	64.9 Å²	64.9	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-54	-36.6	178.1	-28.6	35.1	0	0	0	113.8	L743 K744	P740-L743 PolarHBondContact O-N 3.45Å; P740-K744 PolarHBondContact O-N 3.05Å
741	G	84.9	Confident	85.6	Confident	45 Å²	45	66.4 Å²	66.4	46%	0.464	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-37.9	176.9	0	0	0	0	0	113.7	K739 K745	K739-G741 PolarHBondContact O-N 2.93Å; K739-G741 VanDerWaalsContact O-N 3.14Å; G741-K745 WeakPolarHBondContact O-CG 3.41Å; G741-K745 PolarHBondContact O-N 2.87Å
742	D	84.8	Confident	86.1	Confident	74 Å²	74	67.2 Å²	67.2	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-71.2	-40.6	178.2	-63.3	-29.8	0	0	0	110.3	K739 K744 K745 R746	K739-D742 HydrophobicContact CB-CB 4.46Å; K739-D742 WeakPolarHBondContact CB-OD2 3.45Å; K739-D742 PolarHBondContact O-N 3.25Å; D742-K744 PolarHBondContact O-N 3.4Å; D742-K745 PolarHBondContact O-N 3.42Å; D742-R746 WeakPolarHBondContact O-CG 3.33Å; D742-R746 PolarHBondContact O-N 3.44Å
743	L	87.4	Confident	86.6	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-61.3	-44.3	176.1	-178.7	60.9	0	0	0	112	I707 V727 L730 V738 K739 P740 K745 R746 I747	I707-L743 HydrophobicContact CG2-CD1 3.89Å; V727-L743 HydrophobicContact CB-CD2 4.42Å; V727-L743 HydrophobicContact CG1-CD2 4.43Å; V727-L743 HydrophobicContact CG2-CD2 3.67Å; L730-L743 HydrophobicContact CD1-CD1 3.48Å; L730-L743 VanDerWaalsContact CD1-CD1 3.48Å; L730-L743 HydrophobicContact CD1-CD2 4.05Å; L730-L743 HydrophobicContact CD1-CG 4.4Å; V738-L743 HydrophobicContact CG1-CB 3.96Å; K739-L743 PolarHBondContact O-N 3.09Å; K739-L743 VanDerWaalsContact O-N 3.11Å; P740-L743 PolarHBondContact O-N 3.45Å; L743-K745 VanDerWaalsContact C-N 3.34Å; L743-K745 PolarHBondContact O-N 3.42Å; L743-R746 PolarHBondContact O-N 3.18Å; L743-R746 VanDerWaalsContact O-N 3.15Å; L743-I747 HydrophobicContact CD1-CD1 4.22Å; L743-I747 HydrophobicContact CD1-CG1 4.33Å; L743-I747 HydrophobicContact CG-CD1 3.99Å; L743-I747 HydrophobicContact CG-CG1 4.5Å; L743-I747 WeakPolarHBondContact O-CG1 3.35Å; L743-I747 PolarHBondContact O-N 3.07Å
744	K	87.7	Confident	87	Confident	121 Å²	121	69.2 Å²	69.2	53%	0.526	35%	0.352	S	S	.	.	H	α-helix	trans	-57.5	-47.3	176.6	-177.7	177	173.4	-178.7	0	111.4	P740 D742 R746 I747 E748	P740-K744 PolarHBondContact O-N 3.05Å; D742-K744 PolarHBondContact O-N 3.4Å; K744-R746 VanDerWaalsContact C-N 3.3Å; K744-R746 PolarHBondContact O-N 3.08Å; K744-I747 PolarHBondContact O-N 3.07Å; K744-E748 WeakPolarHBondContact CE-OE1 3.33Å; K744-E748 WeakPolarHBondContact O-CG 3.23Å; K744-E748 PolarHBondContact O-N 3.22Å
745	K	90.3	Very high	87.3	Confident	142 Å²	142	73 Å²	73	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-59.5	-39.5	175.9	-71.9	176.9	179.1	-180	0	112.4	G741 D742 L743 S749	G741-K745 WeakPolarHBondContact O-CG 3.41Å; G741-K745 PolarHBondContact O-N 2.87Å; D742-K745 PolarHBondContact O-N 3.42Å; L743-K745 VanDerWaalsContact C-N 3.34Å; L743-K745 PolarHBondContact O-N 3.42Å; K745-S749 WeakPolarHBondContact O-CB 3.28Å; K745-S749 PolarHBondContact O-N 3.29Å
746	R	91.4	Very high	88.3	Confident	36 Å²	36	65.6 Å²	65.6	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-68.2	-41.6	177.6	-64.7	-39.8	-55.3	173.9	16.6	112.3	Q704 I707 D708 D742 L743 K744 S749 L750	Q704-R746 VanDerWaalsContact OE1-NH1 3.11Å; I707-R746 HydrophobicContact CB-CG 4.35Å; I707-R746 HydrophobicContact CG2-CB 3.91Å; I707-R746 HydrophobicContact CG2-CG 3.86Å; D708-R746 IonicContact OD1-CZ 3.35Å; D708-R746 VanDerWaalsContact OD1-CZ 3.27Å; D708-R746 IonicContact OD1-NE 2.79Å; D708-R746 PolarHBondContact OD1-NE 2.89Å; D708-R746 IonicContact OD1-NH2 2.71Å; D708-R746 PolarHBondContact OD1-NH2 3.39Å; D708-R746 IonicContact OD2-CZ 2.62Å; D708-R746 IonicContact OD2-NE 3.93Å; D708-R746 IonicContact OD2-NH2 3.27Å; D708-R746 PolarHBondContact OD2-NH2 3.07Å; D742-R746 WeakPolarHBondContact O-CG 3.33Å; D742-R746 PolarHBondContact O-N 3.44Å; L743-R746 PolarHBondContact O-N 3.18Å; L743-R746 VanDerWaalsContact O-N 3.15Å; K744-R746 VanDerWaalsContact C-N 3.3Å; K744-R746 PolarHBondContact O-N 3.08Å; R746-S749 PolarHBondContact O-N 2.66Å; R746-L750 WeakPolarHBondContact O-CG 3.44Å; R746-L750 PolarHBondContact O-N 3.35Å
747	I	90.4	Very high	88.9	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-45.1	175.7	-67.3	169.5	0	0	0	110.4	L726 L743 K744 S749 L750 I751 M756 Y766	L726-I747 HydrophobicContact CD2-CD1 4.11Å; L743-I747 HydrophobicContact CD1-CD1 4.22Å; L743-I747 HydrophobicContact CD1-CG1 4.33Å; L743-I747 HydrophobicContact CG-CD1 3.99Å; L743-I747 HydrophobicContact CG-CG1 4.5Å; L743-I747 WeakPolarHBondContact O-CG1 3.35Å; L743-I747 PolarHBondContact O-N 3.07Å; K744-I747 PolarHBondContact O-N 3.07Å; I747-S749 PolarHBondContact O-N 3.39Å; I747-L750 PolarHBondContact O-N 2.9Å; I747-L750 VanDerWaalsContact O-N 3.12Å; I747-I751 HydrophobicContact CG2-CD1 3.91Å; I747-I751 WeakPolarHBondContact O-CG1 3.35Å; I747-I751 PolarHBondContact O-N 3.35Å; I747-M756 HydrophobicContact CG2-CE 4.09Å; I747-M756 HydrophobicContact CG2-SD 4.35Å; I747-Y766 HydrophobicContact CD1-CE2 4.47Å; I747-Y766 HydrophobicContact CG2-CE1 3.88Å; I747-Y766 HydrophobicContact CG2-CE2 4.45Å
748	E	91.2	Very high	89.6	Confident	67 Å²	67	71 Å²	71	31%	0.313	35%	0.348	S	S	.	.	H	α-helix	trans	-57.7	-47.7	175.1	-72.9	167.6	175.2	0	0	111	K744 L750 I751 D752	K744-E748 WeakPolarHBondContact CE-OE1 3.33Å; K744-E748 WeakPolarHBondContact O-CG 3.23Å; K744-E748 PolarHBondContact O-N 3.22Å; E748-L750 VanDerWaalsContact C-N 3.26Å; E748-L750 PolarHBondContact O-N 3.14Å; E748-I751 PolarHBondContact O-N 3.08Å; E748-I751 VanDerWaalsContact O-N 3.07Å; E748-D752 VanDerWaalsContact O-CG 3.27Å; E748-D752 PolarHBondContact O-N 2.9Å
749	S	93	Very high	90.1	Very high	35 Å²	35	72 Å²	72	25%	0.245	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-28.3	175.4	177.7	0	0	0	0	114.3	K745 R746 I747 R753	K745-S749 WeakPolarHBondContact O-CB 3.28Å; K745-S749 PolarHBondContact O-N 3.29Å; R746-S749 PolarHBondContact O-N 2.66Å; I747-S749 PolarHBondContact O-N 3.39Å; S749-R753 WeakPolarHBondContact O-CB 2.93Å; S749-R753 VanDerWaalsContact O-CG 3.25Å; S749-R753 WeakPolarHBondContact O-CG 3.46Å; S749-R753 PolarHBondContact O-N 3.34Å; S749-R753 PolarHBondContact O-NE 3.2Å
750	L	93.5	Very high	90.2	Very high	1 Å²	1	74.1 Å²	74.1	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-80.1	-29	175.4	-74.9	168.6	0	0	0	112.4	V711 V712 R746 I747 E748 D754 Y755 M756	V711-L750 HydrophobicContact CB-CD1 3.61Å; V711-L750 HydrophobicContact CG1-CD1 3.43Å; V711-L750 VanDerWaalsContact CG1-CD1 3.43Å; V711-L750 HydrophobicContact CG2-CD1 4.21Å; V712-L750 HydrophobicContact CG2-CD1 4.45Å; V712-L750 HydrophobicContact CG2-CD2 3.72Å; R746-L750 WeakPolarHBondContact O-CG 3.44Å; R746-L750 PolarHBondContact O-N 3.35Å; I747-L750 PolarHBondContact O-N 2.9Å; I747-L750 VanDerWaalsContact O-N 3.12Å; E748-L750 VanDerWaalsContact C-N 3.26Å; E748-L750 PolarHBondContact O-N 3.14Å; L750-D754 PolarHBondContact O-N 3.03Å; L750-Y755 HydrophobicContact CD2-CD2 4.04Å; L750-Y755 HydrophobicContact CD2-CG 4.05Å; L750-Y755 PolarHBondContact O-N 2.91Å; L750-M756 HydrophobicContact CB-CG 4.07Å; L750-M756 HydrophobicContact CB-SD 4Å; L750-M756 HydrophobicContact CD1-SD 4.38Å
751	I	92.2	Very high	90.4	Very high	36 Å²	36	77.9 Å²	77.9	19%	0.185	37%	0.371	C	S	.	.	H	α-helix	trans	-69.5	-47.5	171.6	-65.5	163.1	0	0	0	110.2	I747 E748 R753 D754 M756 R758 Y766	I747-I751 HydrophobicContact CG2-CD1 3.91Å; I747-I751 WeakPolarHBondContact O-CG1 3.35Å; I747-I751 PolarHBondContact O-N 3.35Å; E748-I751 PolarHBondContact O-N 3.08Å; E748-I751 VanDerWaalsContact O-N 3.07Å; I751-R753 PolarHBondContact O-N 3.36Å; I751-R753 VanDerWaalsContact O-N 3.12Å; I751-D754 PolarHBondContact O-N 3.29Å; I751-M756 VanDerWaalsContact CA-O 3.26Å; I751-M756 WeakPolarHBondContact CA-O 3.42Å; I751-M756 HydrophobicContact CG1-CG 3.89Å; I751-M756 WeakPolarHBondContact CG1-O 3.48Å; I751-R758 HydrophobicContact CD1-CG 3.92Å; I751-Y766 HydrophobicContact CD1-CD1 4.49Å; I751-Y766 HydrophobicContact CD1-CE1 4.23Å
752	D	92.7	Very high	90.6	Very high	133 Å²	133	79.7 Å²	79.7	71%	0.711	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.2	178.9	-62.6	-21.8	0	0	0	113.2	E748	E748-D752 VanDerWaalsContact O-CG 3.27Å; E748-D752 PolarHBondContact O-N 2.9Å
753	R	93.2	Very high	90.4	Very high	109 Å²	109	80.3 Å²	80.3	41%	0.411	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	12.4	176.4	-70	-176	-65.5	165.2	-4.2	113.2	D708 S749 I751 Y755	D708-R753 IonicContact OD1-NH2 2.64Å; D708-R753 IonicContact OD2-CZ 3.69Å; D708-R753 IonicContact OD2-NH1 2.67Å; D708-R753 IonicContact OD2-NH2 2.6Å; D708-R753 PolarHBondContact OD2-NH2 3.42Å; S749-R753 WeakPolarHBondContact O-CB 2.93Å; S749-R753 VanDerWaalsContact O-CG 3.25Å; S749-R753 WeakPolarHBondContact O-CG 3.46Å; S749-R753 PolarHBondContact O-N 3.34Å; S749-R753 PolarHBondContact O-NE 3.2Å; I751-R753 PolarHBondContact O-N 3.36Å; I751-R753 VanDerWaalsContact O-N 3.12Å; R753-Y755 HydrophobicContact CB-CD2 3.76Å; R753-Y755 HydrophobicContact CB-CE2 4.03Å; R753-Y755 WeakPolarHBondContact O-CD2 3.48Å; R753-Y755 PolarHBondContact O-N 3.32Å
754	D	91.7	Very high	90.5	Very high	119 Å²	119	85.2 Å²	85.2	64%	0.636	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	25.7	176.9	-57.8	-50.7	0	0	0	115.3	L750 I751	L750-D754 PolarHBondContact O-N 3.03Å; I751-D754 PolarHBondContact O-N 3.29Å
755	Y	90.6	Very high	90.7	Very high	95 Å²	95	81.9 Å²	81.9	37%	0.373	39%	0.39	S	S	.	.	S	Bend	trans	-79.4	-28.2	172.2	-79	-90.4	0	0	0	112.3	V712 L750 R753 Y768 V769 A770	V712-Y755 HydrophobicContact CG1-CD1 4.07Å; V712-Y755 HydrophobicContact CG1-CE1 4.41Å; V712-Y755 HydrophobicContact CG2-CD1 3.74Å; V712-Y755 HydrophobicContact CG2-CE1 4.32Å; V712-Y755 HydrophobicContact CG2-CG 4.16Å; L750-Y755 HydrophobicContact CD2-CD2 4.04Å; L750-Y755 HydrophobicContact CD2-CG 4.05Å; L750-Y755 PolarHBondContact O-N 2.91Å; R753-Y755 HydrophobicContact CB-CD2 3.76Å; R753-Y755 HydrophobicContact CB-CE2 4.03Å; R753-Y755 WeakPolarHBondContact O-CD2 3.48Å; R753-Y755 PolarHBondContact O-N 3.32Å; Y755-Y768 WeakPolarHBondContact O-CD2 3.44Å; Y755-V769 PolarHBondContact O-N 3.05Å; Y755-A770 HydrophobicContact CD1-CB 4.22Å
756	M	92.4	Very high	90.9	Very high	4 Å²	4	75.6 Å²	75.6	2%	0.02	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	157.4	-179	58.6	-172.3	-65	0	0	110.4	V711 M715 L726 I747 L750 I751 Y766 H767	V711-M756 HydrophobicContact CG1-SD 3.74Å; M715-M756 HydrophobicContact CE-CE 4.24Å; M715-M756 HydrophobicContact CG-CE 4.21Å; M715-M756 HydrophobicContact CG-SD 4.33Å; M715-M756 HydrophobicContact SD-CE 4.24Å; L726-M756 HydrophobicContact CD2-CE 4.39Å; I747-M756 HydrophobicContact CG2-CE 4.09Å; I747-M756 HydrophobicContact CG2-SD 4.35Å; L750-M756 HydrophobicContact CB-CG 4.07Å; L750-M756 HydrophobicContact CB-SD 4Å; L750-M756 HydrophobicContact CD1-SD 4.38Å; I751-M756 VanDerWaalsContact CA-O 3.26Å; I751-M756 WeakPolarHBondContact CA-O 3.42Å; I751-M756 HydrophobicContact CG1-CG 3.89Å; I751-M756 WeakPolarHBondContact CG1-O 3.48Å; M756-Y766 HydrophobicContact CE-CD1 3.65Å; M756-Y766 HydrophobicContact CE-CD2 3.85Å; M756-Y766 HydrophobicContact CE-CE1 4.37Å; M756-Y766 HydrophobicContact CE-CG 3.35Å; M756-H767 CarbonylContact C-O 3.55Å; M756-H767 WeakPolarHBondContact CA-O 3.41Å; M756-H767 VanDerWaalsContact CB-O 3.22Å; M756-H767 WeakPolarHBondContact CB-O 3.44Å
757	E	92.6	Very high	91	Very high	91 Å²	91	75.9 Å²	75.9	43%	0.425	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	162.9	175.5	66.5	-178.7	-172.6	0	0	111	Y766 H767 V769	E757-Y766 CarbonylContact O-C 3.53Å; E757-Y766 VanDerWaalsContact O-CA 3.25Å; E757-Y766 WeakPolarHBondContact O-CA 3.45Å; E757-H767 HydrophobicContact CG-CB 3.99Å; E757-H767 PolarHBondContact N-O 3.49Å; E757-H767 PolarHBondContact O-N 3.4Å; E757-V769 HydrophobicContact CB-CG2 3.78Å; E757-V769 HydrophobicContact CG-CG2 3.5Å
758	R	93.2	Very high	91.1	Very high	108 Å²	108	77.8 Å²	77.8	41%	0.408	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	141.3	170.1	-65.9	-174.3	-170.6	-166.5	5.9	109.3	I751 Y766	I751-R758 HydrophobicContact CD1-CG 3.92Å; R758-Y766 HydrophobicContact CG-CD1 3.92Å; R758-Y766 HydrophobicContact CG-CE1 3.8Å
759	D	91.9	Very high	91	Very high	35 Å²	35	78 Å²	78	19%	0.187	38%	0.378	C	S	.	.			trans	-57.2	141.2	169.6	-172.5	-64.1	0	0	0	109.8	E761 I762 Q765 H767	D759-E761 VanDerWaalsContact C-N 3.31Å; D759-E761 PolarHBondContact O-N 2.95Å; D759-E761 PolarHBondContact OD1-N 3.12Å; D759-I762 HydrophobicContact CB-CB 4.32Å; D759-I762 WeakPolarHBondContact CB-O 3.27Å; D759-I762 PolarHBondContact OD1-N 3.3Å; D759-Q765 HydrophobicContact CB-CB 3.84Å; D759-Q765 HydrophobicContact CB-CG 4.12Å; D759-Q765 PolarHBondContact N-O 3.06Å; D759-H767 VanDerWaalsContact CB-NE2 3.29Å; D759-H767 WeakPolarHBondContact CB-NE2 3.34Å; D759-H767 IonicContact OD2-CE1 3.43Å; D759-H767 PolarHBondContact OD2-CE1 3.11Å; D759-H767 IonicContact OD2-NE2 2.92Å; D759-H767 PolarHBondContact OD2-NE2 2.94Å
760	K	85.8	Confident	90.2	Very high	196 Å²	196	80.8 Å²	80.8	85%	0.852	40%	0.404	S	S	*	.	S	Bend	trans	-72.4	-26.1	-174.4	-65.3	179.1	-178.2	174.4	0	112.7
761	E	87.4	Confident	90	Very high	179 Å²	179	84.8 Å²	84.8	84%	0.836	42%	0.424	S	S	*	.	S	Bend	trans	-106.2	-30	-177.8	-60.1	-173.9	177.1	0	0	111.5	D759	D759-E761 VanDerWaalsContact C-N 3.31Å; D759-E761 PolarHBondContact O-N 2.95Å; D759-E761 PolarHBondContact OD1-N 3.12Å
762	I	89	Confident	89.9	Confident	82 Å²	82	87.4 Å²	87.4	42%	0.421	44%	0.436	S	S	.	.			trans	-119.7	98.2	-174	-54.6	172.9	0	0	0	111.4	D759 N764 Q765	D759-I762 HydrophobicContact CB-CB 4.32Å; D759-I762 WeakPolarHBondContact CB-O 3.27Å; D759-I762 PolarHBondContact OD1-N 3.3Å; I762-N764 PolarHBondContact O-N 3Å; I762-Q765 HydrophobicContact CB-CB 4.06Å; I762-Q765 HydrophobicContact CG2-CB 3.88Å; I762-Q765 PolarHBondContact O-N 2.98Å
763	P	81.3	Confident	89.7	Confident	87 Å²	87	84.8 Å²	84.8	57%	0.565	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.2	-176.5	-26.1	34.1	0	0	0	115.8	Q765	P763-Q765 VanDerWaalsContact C-N 3.34Å
764	N	89	Confident	89.5	Confident	113 Å²	113	83.4 Å²	83.4	60%	0.604	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	11.9	-179.6	-70.5	-22.8	0	0	0	113.3	S722 H723 I762	S722-N764 CarbonylContact C-O 3.4Å; S722-N764 VanDerWaalsContact CA-O 3.28Å; S722-N764 WeakPolarHBondContact CA-O 3.46Å; H723-N764 PolarHBondContact N-O 2.89Å; I762-N764 PolarHBondContact O-N 3Å
765	Q	92.8	Very high	89.4	Confident	50 Å²	50	81.2 Å²	81.2	23%	0.234	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.3	-178.1	-174.8	164	-7.5	0	0	110.4	T720 D759 I762 P763	T720-Q765 HydrophobicContact CG2-CG 3.89Å; D759-Q765 HydrophobicContact CB-CB 3.84Å; D759-Q765 HydrophobicContact CB-CG 4.12Å; D759-Q765 PolarHBondContact N-O 3.06Å; I762-Q765 HydrophobicContact CB-CB 4.06Å; I762-Q765 HydrophobicContact CG2-CB 3.88Å; I762-Q765 PolarHBondContact O-N 2.98Å; P763-Q765 VanDerWaalsContact C-N 3.34Å
766	Y	94.3	Very high	89.3	Confident	11 Å²	11	80.3 Å²	80.3	4%	0.043	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.1	-179.5	-55.4	-66.9	0	0	0	110.9	M715 T720 L721 H723 L726 I747 I751 M756 E757 R758	M715-Y766 WeakPolarHBondContact CE-O 3.49Å; T720-Y766 VanDerWaalsContact CA-O 3.31Å; T720-Y766 WeakPolarHBondContact CA-O 3.41Å; L721-Y766 PolarHBondContact N-O 2.88Å; L721-Y766 PolarHBondContact O-N 2.93Å; H723-Y766 HydrophobicContact CB-CE2 3.79Å; H723-Y766 AromaticContact ND1-CE2 3.57Å; H723-Y766 AromaticContact ND1-CZ 3.73Å; H723-Y766 PolarHBondContact ND1-OH 3.44Å; L726-Y766 HydrophobicContact CD2-CD2 4Å; L726-Y766 HydrophobicContact CD2-CE2 4.19Å; I747-Y766 HydrophobicContact CD1-CE2 4.47Å; I747-Y766 HydrophobicContact CG2-CE1 3.88Å; I747-Y766 HydrophobicContact CG2-CE2 4.45Å; I751-Y766 HydrophobicContact CD1-CD1 4.49Å; I751-Y766 HydrophobicContact CD1-CE1 4.23Å; M756-Y766 HydrophobicContact CE-CD1 3.65Å; M756-Y766 HydrophobicContact CE-CD2 3.85Å; M756-Y766 HydrophobicContact CE-CE1 4.37Å; M756-Y766 HydrophobicContact CE-CG 3.35Å; E757-Y766 CarbonylContact O-C 3.53Å; E757-Y766 VanDerWaalsContact O-CA 3.25Å; E757-Y766 WeakPolarHBondContact O-CA 3.45Å; R758-Y766 HydrophobicContact CG-CD1 3.92Å; R758-Y766 HydrophobicContact CG-CE1 3.8Å
767	H	92.4	Very high	89.1	Confident	41 Å²	41	85.7 Å²	85.7	19%	0.19	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.5	171.4	-55.6	-69.6	0	0	0	110.7	K719 T720 M756 E757 D759	K719-H767 CarbonylContact O-C 3.53Å; K719-H767 WeakPolarHBondContact O-CA 3.32Å; T720-H767 PolarHBondContact OG1-ND1 2.92Å; M756-H767 CarbonylContact C-O 3.55Å; M756-H767 WeakPolarHBondContact CA-O 3.41Å; M756-H767 VanDerWaalsContact CB-O 3.22Å; M756-H767 WeakPolarHBondContact CB-O 3.44Å; E757-H767 HydrophobicContact CG-CB 3.99Å; E757-H767 PolarHBondContact N-O 3.49Å; E757-H767 PolarHBondContact O-N 3.4Å; D759-H767 VanDerWaalsContact CB-NE2 3.29Å; D759-H767 WeakPolarHBondContact CB-NE2 3.34Å; D759-H767 IonicContact OD2-CE1 3.43Å; D759-H767 PolarHBondContact OD2-CE1 3.11Å; D759-H767 IonicContact OD2-NE2 2.92Å; D759-H767 PolarHBondContact OD2-NE2 2.94Å
768	Y	93.9	Very high	88.8	Confident	41 Å²	41	85.3 Å²	85.3	16%	0.161	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.1	174.3	178.3	-102.7	0	0	0	110.5	V712 M715 K716 K719 Y755 A770	V712-Y768 HydrophobicContact CG1-CE2 4.48Å; M715-Y768 HydrophobicContact CB-CD2 3.79Å; M715-Y768 HydrophobicContact CB-CG 4.34Å; M715-Y768 WeakPolarHBondContact O-CB 3.46Å; K716-Y768 HydrophobicContact CB-CD2 4.29Å; K716-Y768 HydrophobicContact CB-CE1 4.12Å; K716-Y768 HydrophobicContact CB-CE2 3.84Å; K716-Y768 HydrophobicContact CG-CE1 4.02Å; K716-Y768 HydrophobicContact CG-CE2 4.47Å; K719-Y768 HydrophobicContact CD-CD1 4.06Å; K719-Y768 PolarHBondContact O-N 2.65Å; Y755-Y768 WeakPolarHBondContact O-CD2 3.44Å; Y768-A770 WeakPolarHBondContact CE1-O 3.35Å; Y768-A770 HydrophobicContact CE2-CB 4.22Å; Y768-A770 PolarHBondContact OH-O 3.35Å
769	V	88.6	Confident	88.4	Confident	71 Å²	71	83.4 Å²	83.4	43%	0.43	44%	0.442	S	S	.	.			trans	-113.6	-23.1	-168.2	-176.6	0	0	0	0	113.3	Y755 E757	Y755-V769 PolarHBondContact O-N 3.05Å; E757-V769 HydrophobicContact CB-CG2 3.78Å; E757-V769 HydrophobicContact CG-CG2 3.5Å
770	A	75.1	Confident	88.1	Confident	95 Å²	95	87.8 Å²	87.8	79%	0.785	47%	0.466	S	S	*	.			trans	-88.1	0	-167.8	0	0	0	0	0	117.7	Y755 Y768	Y755-A770 HydrophobicContact CD1-CB 4.22Å; Y768-A770 WeakPolarHBondContact CE1-O 3.35Å; Y768-A770 HydrophobicContact CE2-CB 4.22Å; Y768-A770 PolarHBondContact OH-O 3.35Å

Retrieved 770 of 770 residues in 582.2 ms (Link to these results)

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