A0A087X170_HUMAN Loading...

Transient receptor potential cation channel subfamily V member 3

Non-selective calcium permeant cation channel. It is activated by innocuous (warm) temperatures and shows an increased response at noxious temperatures greater than 39 degrees Celsius. Activation exhibits an outward rectification. The channel pore can dilate to provide permeability to larger cations. May associate with TRPV1 and may modulate its activity. Is a negative regulator of hair growth and cycling: TRPV3-coupled signaling suppresses keratinocyte proliferation in hair follicles and induces apoptosis and premature hair follicle regression (catagen).

AlphaFold DB , UniProt , Accession A0A087X170, Species HUMAN (Homo sapiens, Human), Gene TRPV3, Length 775 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	30.6	Very low	236 Å²	236	144.9 Å²	144.9	100%	1.163	80%	0.798	S	S	*	*				0	95.6	0	-70.8	162.8	171.7	0	0	106.4
2	S	27.4	Very low	30.8	Very low	91 Å²	91	143.6 Å²	143.6	64%	0.636	79%	0.789	S	S	*	*				80.6	101.1	70.1	64.9	0	0	0	0	113.2
3	H	27.6	Very low	31.2	Very low	162 Å²	162	144.5 Å²	144.5	75%	0.75	79%	0.791	S	S	*	*			trans	56	151.4	144.5	-59.7	-79.1	0	0	0	118.9
4	H	28.8	Very low	31.8	Very low	156 Å²	156	142.9 Å²	142.9	72%	0.722	78%	0.781	S	S	*	*			cis	-161	174.5	-6.3	-109.2	-41.1	0	0	0	106
5	T	28	Very low	32	Very low	119 Å²	119	144.5 Å²	144.5	73%	0.73	78%	0.778	S	S	*	*			cis	-152.4	-173.8	11.9	-14.5	0	0	0	0	110.4
6	W	24.4	Very low	32	Very low	238 Å²	238	139.6 Å²	139.6	90%	0.902	76%	0.763	S	S	*	*			trans	-104.6	-167.4	164.7	-72.6	33.5	0	0	0	109.8
7	P	38.3	Very low	32.5	Very low	113 Å²	113	137 Å²	137	73%	0.734	75%	0.753	S	S	*	*			cis	-129.9	172.2	-21.4	16	8.7	0	0	0	114.7
8	S	29.5	Very low	32.7	Very low	113 Å²	113	140.1 Å²	140.1	79%	0.79	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-98.7	137.3	160.9	52.4	0	0	0	0	112
9	P	33.3	Very low	32.8	Very low	121 Å²	121	138.9 Å²	138.9	79%	0.786	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-91.1	135.5	168.4	34	-29.8	0	0	0	111.8
10	A	36.7	Very low	33	Very low	94 Å²	94	139.5 Å²	139.5	78%	0.777	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-87.9	146.7	162.6	0	0	0	0	0	109.7
11	L	30.3	Very low	33	Very low	151 Å²	151	142.9 Å²	142.9	79%	0.791	75%	0.75	S	S	*	*			trans	-158	114.4	164.6	-109.2	139.9	0	0	0	112.7
12	N	32	Very low	33	Very low	129 Å²	129	138.7 Å²	138.7	69%	0.69	73%	0.732	S	S	*	*			trans	53.5	100.6	151.6	-60.4	5.1	0	0	0	120.2
13	L	36.8	Very low	33.2	Very low	155 Å²	155	141.7 Å²	141.7	81%	0.812	74%	0.74	S	S	*	*	S	Bend	trans	-87.5	-0.3	163.5	-147.9	78.2	0	0	0	113.4	F15	L13-F15 PolarHBondContact O-N 3.24Å
14	D	38.6	Very low	33.5	Very low	122 Å²	122	137.4 Å²	137.4	65%	0.652	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	2.5	-166.8	-65.4	-45.6	0	0	0	115.8
15	F	34.9	Very low	33.5	Very low	168 Å²	168	134 Å²	134	74%	0.737	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-19	177.5	-135.8	-93	0	0	0	113.6	L13	L13-F15 PolarHBondContact O-N 3.24Å
16	A	33.3	Very low	33.8	Very low	65 Å²	65	136.7 Å²	136.7	54%	0.537	74%	0.743	S	S	.	*	H	α-helix	trans	-83.3	-28.4	-179.3	0	0	0	0	0	113.1
17	T	40.2	Very low	33.9	Very low	96 Å²	96	134.4 Å²	134.4	59%	0.589	74%	0.739	S	S	*	*	H	α-helix	trans	-77.6	-23.3	-179.7	40.4	0	0	0	0	113.6
18	Y	36.5	Very low	33.4	Very low	193 Å²	193	137.5 Å²	137.5	76%	0.757	74%	0.741	S	S	*	*	H	α-helix	trans	-80.1	-33.1	177.1	-114.1	-85.3	0	0	0	113.3
19	L	34.4	Very low	33.4	Very low	118 Å²	118	138.3 Å²	138.3	62%	0.618	74%	0.736	S	S	*	*	H	α-helix	trans	-79.2	-19.4	-178.3	-100.9	158.5	0	0	0	114.4
20	L	36	Very low	33.2	Very low	149 Å²	149	140.8 Å²	140.8	78%	0.78	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-2.7	-179.8	-88	162.7	0	0	0	114.4
21	R	33.7	Very low	32.8	Very low	212 Å²	212	144.1 Å²	144.1	80%	0.8	74%	0.74	S	S	*	*	S	Bend	trans	-92.7	-25.6	-175.9	-167.1	169.3	174.8	177.3	-3.4	114.5
22	D	33.3	Very low	32.6	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	75%	0.746	S	S	*	*	S	Bend	trans	-98.6	0.6	-173.3	-75.8	-11.8	0	0	0	115
23	L	31.7	Very low	32.3	Very low	154 Å²	154	143.2 Å²	143.2	81%	0.806	75%	0.745	S	S	*	*	S	Bend	trans	-115.5	5	-176.5	-92.5	154.9	0	0	0	114.8
24	G	32.1	Very low	31.7	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	75%	0.75	S	S	*	*	S	Bend	trans	-118.7	15.5	-172.3	0	0	0	0	0	116.4
25	A	30.1	Very low	31.2	Very low	85 Å²	85	147.8 Å²	147.8	70%	0.702	76%	0.756	S	S	*	*	S	Bend	trans	-108.9	6.5	-171.6	0	0	0	0	0	115.4
26	H	33.9	Very low	30.9	Very low	175 Å²	175	145.9 Å²	145.9	81%	0.81	76%	0.76	S	S	*	*	S	Bend	trans	-135.3	136.9	170.6	-73.5	-68.2	0	0	0	109.4
27	F	26.7	Very low	30.5	Very low	191 Å²	191	149.8 Å²	149.8	84%	0.838	77%	0.772	S	S	*	*	S	Bend	trans	94.8	118.8	-176	-75.3	-88.2	0	0	0	117.3
28	F	26.5	Very low	30.6	Very low	177 Å²	177	150.4 Å²	150.4	78%	0.776	78%	0.778	S	S	*	*			trans	69	139.1	168.7	-75.4	-111.5	0	0	0	117.8
29	L	30.4	Very low	30	Very low	130 Å²	130	148.1 Å²	148.1	68%	0.681	78%	0.784	S	S	*	*			cis	-160.4	155.3	-22.9	-131	-171.5	0	0	0	107.9
30	E	29	Very low	29.6	Very low	173 Å²	173	149.3 Å²	149.3	81%	0.808	80%	0.796	S	S	*	*			trans	-67.8	137.5	164	-69.3	162	132.5	0	0	110.4
31	I	27.8	Very low	29	Very low	164 Å²	164	146.9 Å²	146.9	84%	0.841	80%	0.798	S	S	*	*			trans	-134.3	96.3	163.3	-59.9	-179.1	0	0	0	106.8
32	E	27.6	Very low	28.8	Very low	196 Å²	196	146.1 Å²	146.1	92%	0.916	80%	0.8	S	S	*	*			trans	-78.3	145.2	162	-71.4	-167.3	135	0	0	109.9
33	G	25.2	Very low	28.4	Very low	65 Å²	65	145.8 Å²	145.8	67%	0.67	80%	0.804	S	S	*	*			trans	163.5	71.9	174.6	0	0	0	0	0	114.9
34	F	24.6	Very low	28.2	Very low	208 Å²	208	143.6 Å²	143.6	91%	0.912	80%	0.801	S	S	*	*			trans	-156.8	107.5	154	-108.3	-72.1	0	0	0	111.4
35	E	27.3	Very low	27.8	Very low	166 Å²	166	145.6 Å²	145.6	78%	0.776	80%	0.801	S	S	*	*			trans	-75.9	153.3	165.2	-66.4	-174.8	147.2	0	0	111.1
36	P	28.9	Very low	27.7	Very low	127 Å²	127	146 Å²	146	83%	0.825	80%	0.797	S	S	*	*			trans	-128.5	143.5	132.7	34.4	-25.6	0	0	0	113.7
37	N	25.7	Very low	27.5	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	79%	0.794	S	S	*	*			trans	-76.1	172.9	-175.3	-107	-32.7	0	0	0	113.9
38	P	41.5	Very low	28	Very low	110 Å²	110	140 Å²	140	71%	0.714	78%	0.778	S	S	*	*			trans	-111.2	156.4	-141.1	40.8	-36.2	0	0	0	115.6
39	T	24.2	Very low	28	Very low	145 Å²	145	136.3 Å²	136.3	89%	0.89	77%	0.774	S	S	*	*			trans	-138.4	120.9	160.3	50.4	0	0	0	0	113.3
40	V	26.4	Very low	27.7	Very low	142 Å²	142	137.9 Å²	137.9	86%	0.861	78%	0.776	S	S	*	*			trans	-32.7	127.7	172.2	-179.2	0	0	0	0	116.9
41	A	23	Very low	27.5	Very low	99 Å²	99	134.5 Å²	134.5	82%	0.818	77%	0.769	S	S	*	*			trans	-152.2	141.3	141	0	0	0	0	0	110.9
42	K	28.7	Very low	27.7	Very low	196 Å²	196	131.2 Å²	131.2	85%	0.852	75%	0.751	S	S	*	*			trans	-88.5	126.2	-178.7	-62	168.3	178.5	174.4	0	110.8
43	T	26.1	Very low	27.8	Very low	141 Å²	141	127.2 Å²	127.2	87%	0.865	74%	0.736	S	S	*	*			trans	-176.3	149.3	135.7	25.9	0	0	0	0	109.5
44	S	25.8	Very low	28	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-57.2	134.2	176.5	47.3	0	0	0	0	112.9
45	P	24.1	Very low	28.1	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-73.3	140.3	170.1	31.3	-33.1	0	0	0	110.3
46	P	27.4	Very low	28.2	Very low	93 Å²	93	122.5 Å²	122.5	60%	0.604	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-71.9	129.4	168.5	30	-31.8	0	0	0	109.6	F48	P46-F48 PolarHBondContact O-N 3.45Å; P46-F48 VanDerWaalsContact O-N 3.12Å
47	V	29.9	Very low	28.1	Very low	123 Å²	123	127.3 Å²	127.3	75%	0.745	72%	0.716	S	S	*	*	S	Bend	trans	-66.5	-11.7	-179.9	174.8	0	0	0	0	112.8
48	F	38.3	Very low	28	Very low	116 Å²	116	129.7 Å²	129.7	51%	0.509	72%	0.723	S	S	.	*			trans	-119.3	99.5	172.6	-74	-94	0	0	0	110.3	P46	P46-F48 PolarHBondContact O-N 3.45Å; P46-F48 VanDerWaalsContact O-N 3.12Å
49	S	25.8	Very low	27.1	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	73%	0.729	S	S	*	*			trans	-140.9	42	168.3	77.8	0	0	0	0	112.8
50	K	24.6	Very low	27.2	Very low	163 Å²	163	131.1 Å²	131.1	71%	0.709	73%	0.725	S	S	*	*	S	Bend	trans	-136.4	125.7	155.8	-70.4	-170.5	178.4	179.8	0	108.4
51	P	24.6	Very low	27.3	Very low	103 Å²	103	129.7 Å²	129.7	67%	0.669	72%	0.722	S	S	*	*			trans	-67.1	164	169.7	30.3	-34	0	0	0	110.2	D53	P51-D53 PolarHBondContact O-N 2.79Å
52	M	32.7	Very low	27.5	Very low	94 Å²	94	128.5 Å²	128.5	46%	0.463	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	4.5	-164.3	-139.9	163.2	179.3	0	0	115.7	Y197 F233	M52-Y197 HydrophobicContact CE-CE1 3.92Å; M52-F233 HydrophobicContact CE-CD1 4.32Å; M52-F233 HydrophobicContact CE-CE1 3.57Å; M52-F233 HydrophobicContact CE-CE2 4.29Å; M52-F233 HydrophobicContact CE-CZ 3.55Å
53	D	29.4	Very low	27.2	Very low	113 Å²	113	126.1 Å²	126.1	60%	0.604	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	-0.8	-165.2	-58.5	-56.8	0	0	0	115.2	P51 N55	P51-D53 PolarHBondContact O-N 2.79Å; D53-N55 VanDerWaalsContact C-N 3.26Å; D53-N55 PolarHBondContact O-N 3.03Å; D53-N55 VanDerWaalsContact O-N 3.09Å
54	S	28.4	Very low	27.1	Very low	69 Å²	69	125.9 Å²	125.9	48%	0.483	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	0.4	-166.2	78.5	0	0	0	0	117
55	N	26.2	Very low	27.1	Very low	141 Å²	141	127.2 Å²	127.2	75%	0.754	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	21.1	-172.3	-75.8	3.4	0	0	0	114.5	D53	D53-N55 VanDerWaalsContact C-N 3.26Å; D53-N55 PolarHBondContact O-N 3.03Å; D53-N55 VanDerWaalsContact O-N 3.09Å
56	I	30.4	Very low	27.2	Very low	130 Å²	130	129 Å²	129	67%	0.667	72%	0.721	S	S	*	*	S	Bend	trans	-87.5	136.6	168.1	-59.2	179.1	0	0	0	109.5
57	R	26.8	Very low	27.2	Very low	228 Å²	228	132.8 Å²	132.8	86%	0.86	73%	0.732	S	S	*	*			trans	-51.7	141.6	-177.2	-74.7	177.7	172.3	173.2	-2.5	112.6	C59	R57-C59 PolarHBondContact O-N 3.12Å
58	Q	23.6	Very low	27.1	Very low	197 Å²	197	133.1 Å²	133.1	92%	0.921	73%	0.73	S	S	*	*			trans	-57.1	109.9	168.3	-73.7	177.9	-27.7	0	0	111.2
59	C	23.1	Very low	26.5	Very low	127 Å²	127	132.8 Å²	132.8	86%	0.858	74%	0.742	S	S	*	*			trans	-89.6	133.6	159	-79.7	0	0	0	0	109.3	R57	R57-C59 PolarHBondContact O-N 3.12Å
60	I	26	Very low	26.7	Very low	157 Å²	157	134.1 Å²	134.1	81%	0.805	75%	0.748	S	S	*	*			trans	-80.1	145.5	-177.2	-68.2	169.9	0	0	0	110.2
61	S	27.2	Very low	27	Very low	113 Å²	113	130.8 Å²	130.8	79%	0.79	74%	0.735	S	S	*	*	S	Bend	trans	73.1	98	170.9	63.7	0	0	0	0	118.9
62	G	28	Very low	27.2	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	72%	0.722	S	S	*	*				76.8	59	107.1	0	0	0	0	0	119.4
63	N	22.2	Very low	27.2	Very low	146 Å²	146	129.9 Å²	129.9	78%	0.781	74%	0.738	S	S	*	*			trans	-163.3	141.4	133.2	-109	9.5	0	0	0	109.4
64	C	25.3	Very low	27.3	Very low	135 Å²	135	132.1 Å²	132.1	91%	0.912	74%	0.744	S	S	*	*			trans	-104.2	86.4	177.5	-60.9	0	0	0	0	109.2
65	D	24.6	Very low	27.5	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	75%	0.745	S	S	*	*			trans	-121.7	150.3	164.8	-70	-55.4	0	0	0	108.2
66	D	26.1	Very low	28.1	Very low	151 Å²	151	129.9 Å²	129.9	81%	0.807	73%	0.727	S	S	*	*			trans	-49.3	137.5	-164	-58.4	-62.7	0	0	0	116.7	D68	D66-D68 PolarHBondContact O-N 2.94Å
67	M	27.1	Very low	28.3	Very low	171 Å²	171	129.9 Å²	129.9	84%	0.842	73%	0.733	S	S	*	*			trans	-77	61.7	170	-74	-81.2	-79.1	0	0	111.6
68	D	28.5	Very low	28.6	Very low	130 Å²	130	125.5 Å²	125.5	70%	0.695	73%	0.732	S	S	*	*			trans	-97.1	122.2	156.3	-104.7	-14.4	0	0	0	107.6	D66	D66-D68 PolarHBondContact O-N 2.94Å
69	S	26.7	Very low	28.9	Very low	109 Å²	109	122.4 Å²	122.4	76%	0.762	72%	0.717	S	S	*	*			trans	-55.5	128.8	172.9	-67.1	0	0	0	0	110.2	Q71	S69-Q71 PolarHBondContact O-N 3.25Å
70	P	29	Very low	29.2	Very low	128 Å²	128	122.6 Å²	122.6	83%	0.831	71%	0.714	S	S	*	*			trans	-67.9	102.7	178.7	26.7	-33.2	0	0	0	109.6	S72	P70-S72 PolarHBondContact O-N 2.85Å
71	Q	31.7	Very low	29.6	Very low	94 Å²	94	120.9 Å²	120.9	44%	0.439	71%	0.713	S	S	.	*			trans	-49	130.5	174.7	-59.3	-174	-76	0	0	110	S69 D150	S69-Q71 PolarHBondContact O-N 3.25Å; Q71-D150 PolarHBondContact NE2-OD2 3.36Å
72	S	28.5	Very low	29.9	Very low	55 Å²	55	121.4 Å²	121.4	39%	0.385	72%	0.717	S	S	.	*			trans	-67.7	150.6	-168.4	80.1	0	0	0	0	112	P70 Q74	P70-S72 PolarHBondContact O-N 2.85Å; S72-Q74 PolarHBondContact O-N 3.42Å
73	P	31.7	Very low	30.2	Very low	123 Å²	123	125 Å²	125	80%	0.799	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	7.5	177.2	-18.7	32.8	0	0	0	115.2
74	Q	31.3	Very low	31.1	Very low	159 Å²	159	123.1 Å²	123.1	74%	0.743	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-9.3	-164	-72.3	-176.1	-34.5	0	0	115.5	S72 D76	S72-Q74 PolarHBondContact O-N 3.42Å; Q74-D76 PolarHBondContact O-N 3.48Å
75	D	33.4	Very low	31.7	Very low	94 Å²	94	123.8 Å²	123.8	50%	0.503	71%	0.709	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	4.9	177	-89.7	2.6	0	0	0	115.2	S149	D75-S149 WeakPolarHBondContact OD2-CB 3.49Å; D75-S149 PolarHBondContact OD2-OG 3.01Å
76	D	38.2	Very low	32.7	Very low	70 Å²	70	119.9 Å²	119.9	37%	0.374	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	3.7	-166.8	-103.3	-45.7	0	0	0	116.4	Q74 R97 R101	Q74-D76 PolarHBondContact O-N 3.48Å; D76-R97 IonicContact OD1-CZ 3.61Å; D76-R97 IonicContact OD1-NH1 2.78Å; D76-R97 PolarHBondContact OD1-NH1 3.05Å; D76-R101 IonicContact OD1-NH2 3.53Å; D76-R101 PolarHBondContact OD1-NH2 3.37Å; D76-R101 VanDerWaalsContact OD1-NH2 3.09Å; D76-R101 IonicContact OD2-CZ 2.66Å; D76-R101 IonicContact OD2-NH1 2.62Å; D76-R101 PolarHBondContact OD2-NH1 2.81Å; D76-R101 IonicContact OD2-NH2 3.71Å; D76-R101 PolarHBondContact OD2-NH2 2.87Å
77	V	35.9	Very low	33.8	Very low	130 Å²	130	117.3 Å²	117.3	79%	0.788	68%	0.684	S	S	*	*	S	Bend	trans	-108.4	-26.6	-167.4	-173.4	0	0	0	0	116.3
78	T	31.5	Very low	34.7	Very low	136 Å²	136	113.2 Å²	113.2	83%	0.834	67%	0.672	S	S	*	*			trans	-104.2	4.2	-158.6	20.7	0	0	0	0	118.8
79	E	29.9	Very low	35.5	Very low	131 Å²	131	108.6 Å²	108.6	61%	0.612	65%	0.652	S	S	*	*	S	Bend	trans	-100	86.4	174	-78.5	-169.2	-170.7	0	0	114.1
80	T	30.7	Very low	36.5	Very low	131 Å²	131	110 Å²	110	80%	0.804	65%	0.647	S	S	*	*			trans	71.8	159.7	150.4	65.2	0	0	0	0	119.3
81	P	33.3	Very low	37.3	Very low	121 Å²	121	109.3 Å²	109.3	79%	0.786	64%	0.635	S	S	*	*			trans	-86	161	-139.4	33.5	-37.8	0	0	0	116.4	N83	P81-N83 PolarHBondContact O-N 3.2Å
82	S	34.1	Very low	38.1	Very low	124 Å²	124	107.3 Å²	107.3	87%	0.867	64%	0.635	S	S	*	*			trans	-61.8	114.5	177.8	55.2	0	0	0	0	113.1
83	N	33.9	Very low	39.1	Very low	150 Å²	150	111.3 Å²	111.3	80%	0.802	65%	0.646	S	S	*	*			trans	-137.6	110.2	158.2	-158.7	-0.4	0	0	0	109.3	P81	P81-N83 PolarHBondContact O-N 3.2Å
84	P	42.5	Very low	40	Very low	106 Å²	106	109.6 Å²	109.6	69%	0.688	63%	0.627	S	S	*	*			trans	-87.1	114.6	-172.6	32.4	-31.3	0	0	0	111
85	N	37.4	Very low	41.1	Very low	150 Å²	150	107.1 Å²	107.1	80%	0.802	62%	0.615	S	S	*	*			trans	-156.2	130.9	158.6	-100.5	-40.5	0	0	0	113.6
86	S	44.8	Very low	42.2	Very low	55 Å²	55	107.7 Å²	107.7	39%	0.385	62%	0.615	S	S	.	*			trans	67.9	124.3	179.9	76.8	0	0	0	0	118.2	S88 A89 Q90	S86-S88 VanDerWaalsContact C-N 3.28Å; S86-S88 PolarHBondContact O-N 2.7Å; S86-A89 PolarHBondContact O-N 2.91Å; S86-A89 WeakPolarHBondContact OG-CB 3.35Å; S86-A89 PolarHBondContact OG-N 2.89Å; S86-Q90 PolarHBondContact O-N 2.88Å
87	P	49.9	Very low	43	Very low	97 Å²	97	110.5 Å²	110.5	63%	0.63	62%	0.62	S	S	*	*	H	α-helix	trans	-64.3	-29.5	170.7	-22.1	33.6	0	0	0	113.7	Q90 L91	P87-Q90 PolarHBondContact O-N 3.16Å; P87-L91 PolarHBondContact O-N 3.42Å
88	S	46.6	Very low	44.2	Very low	84 Å²	84	111.4 Å²	111.4	59%	0.587	61%	0.61	S	S	*	*	H	α-helix	trans	-66.2	-36.8	177.1	46.9	0	0	0	0	112.5	S86 Q90 A92	S86-S88 VanDerWaalsContact C-N 3.28Å; S86-S88 PolarHBondContact O-N 2.7Å; S88-Q90 VanDerWaalsContact C-N 3.35Å; S88-A92 VanDerWaalsContact O-CB 3.31Å; S88-A92 WeakPolarHBondContact O-CB 3.1Å; S88-A92 PolarHBondContact O-N 3.21Å
89	A	44.3	Very low	45.6	Very low	33 Å²	33	110.7 Å²	110.7	27%	0.273	60%	0.595	S	S	.	*	H	α-helix	trans	-70.1	-30.7	172.4	0	0	0	0	0	112.4	S86 K93	S86-A89 PolarHBondContact O-N 2.91Å; S86-A89 WeakPolarHBondContact OG-CB 3.35Å; S86-A89 PolarHBondContact OG-N 2.89Å; A89-K93 VanDerWaalsContact O-CB 3.23Å; A89-K93 WeakPolarHBondContact O-CB 3.44Å; A89-K93 WeakPolarHBondContact O-CD 3.33Å; A89-K93 WeakPolarHBondContact O-CG 3.19Å; A89-K93 PolarHBondContact O-N 3.11Å
90	Q	47.3	Very low	47	Very low	138 Å²	138	107.7 Å²	107.7	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-67.8	-48.4	172	-75.7	-178.9	-41.1	0	0	111.3	S86 P87 S88 A92 K93 E94	S86-Q90 PolarHBondContact O-N 2.88Å; P87-Q90 PolarHBondContact O-N 3.16Å; S88-Q90 VanDerWaalsContact C-N 3.35Å; Q90-A92 PolarHBondContact O-N 2.78Å; Q90-K93 CarbonylContact O-C 3.6Å; Q90-K93 PolarHBondContact O-N 2.79Å; Q90-E94 WeakPolarHBondContact O-CB 3.43Å; Q90-E94 PolarHBondContact O-N 2.75Å
91	L	45.8	Very low	48.6	Very low	114 Å²	114	107.8 Å²	107.8	60%	0.597	57%	0.565	S	S	*	*	H	α-helix	trans	-59.1	-44.7	175.3	-79.8	161.2	0	0	0	112.4	P87 E94 E95	P87-L91 PolarHBondContact O-N 3.42Å; L91-E94 PolarHBondContact O-N 2.91Å; L91-E95 WeakPolarHBondContact O-CB 3.37Å; L91-E95 PolarHBondContact O-N 2.8Å
92	A	48.5	Very low	50.6	Low	53 Å²	53	110.1 Å²	110.1	44%	0.438	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-43.7	176	0	0	0	0	0	111.9	S88 Q90 E94 E95 Q96	S88-A92 VanDerWaalsContact O-CB 3.31Å; S88-A92 WeakPolarHBondContact O-CB 3.1Å; S88-A92 PolarHBondContact O-N 3.21Å; Q90-A92 PolarHBondContact O-N 2.78Å; A92-E94 VanDerWaalsContact C-N 3.33Å; A92-E94 PolarHBondContact O-N 3.4Å; A92-E95 PolarHBondContact O-N 2.83Å; A92-Q96 WeakPolarHBondContact O-CB 3.47Å; A92-Q96 PolarHBondContact O-N 3.1Å
93	K	49.5	Very low	52.8	Low	138 Å²	138	104.6 Å²	104.6	60%	0.6	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-36.3	174.2	-76.1	172.5	-179.7	-175.7	0	112.1	A89 Q90 R97	A89-K93 VanDerWaalsContact O-CB 3.23Å; A89-K93 WeakPolarHBondContact O-CB 3.44Å; A89-K93 WeakPolarHBondContact O-CD 3.33Å; A89-K93 WeakPolarHBondContact O-CG 3.19Å; A89-K93 PolarHBondContact O-N 3.11Å; Q90-K93 CarbonylContact O-C 3.6Å; Q90-K93 PolarHBondContact O-N 2.79Å; K93-R97 WeakPolarHBondContact O-CB 3.46Å; K93-R97 VanDerWaalsContact O-CG 3.29Å; K93-R97 WeakPolarHBondContact O-CG 3.39Å; K93-R97 PolarHBondContact O-N 2.64Å
94	E	50.4	Low	55	Low	88 Å²	88	98.9 Å²	98.9	41%	0.411	49%	0.487	S	S	.	.	H	α-helix	trans	-71.4	-42.5	177.8	-163	-167.1	149.6	0	0	111.6	Q90 L91 A92 Q96 R97 R98	Q90-E94 WeakPolarHBondContact O-CB 3.43Å; Q90-E94 PolarHBondContact O-N 2.75Å; L91-E94 PolarHBondContact O-N 2.91Å; A92-E94 VanDerWaalsContact C-N 3.33Å; A92-E94 PolarHBondContact O-N 3.4Å; E94-Q96 VanDerWaalsContact C-N 3.32Å; E94-Q96 PolarHBondContact O-N 2.74Å; E94-R97 CarbonylContact O-C 3.42Å; E94-R97 WeakPolarHBondContact O-CB 3.4Å; E94-R97 PolarHBondContact O-N 3Å; E94-R98 WeakPolarHBondContact O-CG 2.9Å; E94-R98 PolarHBondContact O-N 2.89Å; E94-R98 IonicContact OE1-CZ 2.63Å; E94-R98 IonicContact OE1-NE 2.75Å; E94-R98 PolarHBondContact OE1-NE 2.77Å; E94-R98 IonicContact OE1-NH2 3.34Å; E94-R98 PolarHBondContact OE1-NH2 3.2Å
95	E	54	Low	57	Low	106 Å²	106	100.2 Å²	100.2	50%	0.495	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-39.2	173.5	-163.9	-170.8	145.5	0	0	111.1	L91 A92 R98 K99	L91-E95 WeakPolarHBondContact O-CB 3.37Å; L91-E95 PolarHBondContact O-N 2.8Å; A92-E95 PolarHBondContact O-N 2.83Å; E95-R98 PolarHBondContact O-N 2.9Å; E95-K99 WeakPolarHBondContact O-CG 3.16Å; E95-K99 PolarHBondContact O-N 3.02Å; E95-K99 VanDerWaalsContact OE1-CE 3.23Å; E95-K99 WeakPolarHBondContact OE1-CE 2.96Å; E95-K99 IonicContact OE1-NZ 3.18Å; E95-K99 PolarHBondContact OE1-NZ 3.25Å
96	Q	56.6	Low	59.4	Low	106 Å²	106	100.4 Å²	100.4	50%	0.495	47%	0.472	S	S	.	.	H	α-helix	trans	-69.5	-34	174.9	-157	170.1	16.6	0	0	111.9	A92 E94 K100	A92-Q96 WeakPolarHBondContact O-CB 3.47Å; A92-Q96 PolarHBondContact O-N 3.1Å; E94-Q96 VanDerWaalsContact C-N 3.32Å; E94-Q96 PolarHBondContact O-N 2.74Å; Q96-K100 WeakPolarHBondContact O-CB 3.32Å; Q96-K100 VanDerWaalsContact O-CG 3.26Å; Q96-K100 WeakPolarHBondContact O-CG 3.39Å; Q96-K100 PolarHBondContact O-N 3.48Å
97	R	56.8	Low	61.4	Low	129 Å²	129	97.9 Å²	97.9	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-43.9	167.1	-80.3	176.8	177.3	-161.6	2.6	111.2	D76 K93 E94 K100 R101	D76-R97 IonicContact OD1-CZ 3.61Å; D76-R97 IonicContact OD1-NH1 2.78Å; D76-R97 PolarHBondContact OD1-NH1 3.05Å; K93-R97 WeakPolarHBondContact O-CB 3.46Å; K93-R97 VanDerWaalsContact O-CG 3.29Å; K93-R97 WeakPolarHBondContact O-CG 3.39Å; K93-R97 PolarHBondContact O-N 2.64Å; E94-R97 CarbonylContact O-C 3.42Å; E94-R97 WeakPolarHBondContact O-CB 3.4Å; E94-R97 PolarHBondContact O-N 3Å; R97-K100 PolarHBondContact O-N 2.68Å; R97-R101 WeakPolarHBondContact O-CB 3.33Å; R97-R101 WeakPolarHBondContact O-CG 3.31Å; R97-R101 PolarHBondContact O-N 2.88Å
98	R	60.4	Low	63.2	Low	150 Å²	150	94.7 Å²	94.7	57%	0.566	43%	0.43	S	S	*	.	H	α-helix	trans	-62.7	-42.9	175.7	-72.4	179.2	-171.9	-162.1	3.6	111.9	E94 E95 R101 R102	E94-R98 WeakPolarHBondContact O-CG 2.9Å; E94-R98 PolarHBondContact O-N 2.89Å; E94-R98 IonicContact OE1-CZ 2.63Å; E94-R98 IonicContact OE1-NE 2.75Å; E94-R98 PolarHBondContact OE1-NE 2.77Å; E94-R98 IonicContact OE1-NH2 3.34Å; E94-R98 PolarHBondContact OE1-NH2 3.2Å; E95-R98 PolarHBondContact O-N 2.9Å; R98-R101 PolarHBondContact O-N 2.83Å; R98-R102 WeakPolarHBondContact O-CB 3.45Å; R98-R102 WeakPolarHBondContact O-CG 3.33Å; R98-R102 PolarHBondContact O-N 3.41Å
99	K	61.1	Low	65.1	Low	121 Å²	121	92.2 Å²	92.2	53%	0.526	42%	0.415	S	S	.	.	H	α-helix	trans	-61.5	-47.9	173.3	-73.3	175.7	-175.3	165.4	0	111.3	E95 R101 R102 L103	E95-K99 WeakPolarHBondContact O-CG 3.16Å; E95-K99 PolarHBondContact O-N 3.02Å; E95-K99 VanDerWaalsContact OE1-CE 3.23Å; E95-K99 WeakPolarHBondContact OE1-CE 2.96Å; E95-K99 IonicContact OE1-NZ 3.18Å; E95-K99 PolarHBondContact OE1-NZ 3.25Å; K99-R101 PolarHBondContact O-N 3.47Å; K99-R102 PolarHBondContact O-N 3.37Å; K99-L103 PolarHBondContact O-N 2.62Å
100	K	59.9	Low	67.2	Low	67 Å²	67	90.8 Å²	90.8	29%	0.291	40%	0.403	S	S	.	.	H	α-helix	trans	-60.2	-38.5	175.1	-74	175.3	177.9	-171.2	0	113.6	Q96 R97 K104 L129	Q96-K100 WeakPolarHBondContact O-CB 3.32Å; Q96-K100 VanDerWaalsContact O-CG 3.26Å; Q96-K100 WeakPolarHBondContact O-CG 3.39Å; Q96-K100 PolarHBondContact O-N 3.48Å; R97-K100 PolarHBondContact O-N 2.68Å; K100-K104 PolarHBondContact O-N 3.01Å; K100-L129 HydrophobicContact CG-CD1 4.48Å
101	R	62.3	Low	69.2	Low	133 Å²	133	84.2 Å²	84.2	50%	0.502	37%	0.372	S	S	.	.	H	α-helix	trans	-68.1	-39	174.3	-76.2	-178.2	176.2	166.5	5.1	112	D76 R97 R98 K99 K105	D76-R101 IonicContact OD1-NH2 3.53Å; D76-R101 PolarHBondContact OD1-NH2 3.37Å; D76-R101 VanDerWaalsContact OD1-NH2 3.09Å; D76-R101 IonicContact OD2-CZ 2.66Å; D76-R101 IonicContact OD2-NH1 2.62Å; D76-R101 PolarHBondContact OD2-NH1 2.81Å; D76-R101 IonicContact OD2-NH2 3.71Å; D76-R101 PolarHBondContact OD2-NH2 2.87Å; R97-R101 WeakPolarHBondContact O-CB 3.33Å; R97-R101 WeakPolarHBondContact O-CG 3.31Å; R97-R101 PolarHBondContact O-N 2.88Å; R98-R101 PolarHBondContact O-N 2.83Å; K99-R101 PolarHBondContact O-N 3.47Å; R101-K105 PolarHBondContact O-N 3.02Å
102	R	75.8	Confident	71.2	Confident	171 Å²	171	79.9 Å²	79.9	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-66.5	-39.9	174.8	-75.2	175.7	177.3	-174.4	-2.1	112.7	R98 K99 K105 R106	R98-R102 WeakPolarHBondContact O-CB 3.45Å; R98-R102 WeakPolarHBondContact O-CG 3.33Å; R98-R102 PolarHBondContact O-N 3.41Å; K99-R102 PolarHBondContact O-N 3.37Å; R102-K105 PolarHBondContact O-N 2.75Å; R102-R106 WeakPolarHBondContact O-CB 3.42Å; R102-R106 WeakPolarHBondContact O-CG 3.23Å; R102-R106 PolarHBondContact O-N 3.27Å
103	L	80.5	Confident	73.1	Confident	8 Å²	8	83.5 Å²	83.5	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-50.2	178.9	-178.8	59.5	0	0	0	111.7	K99 K105 R106 I107 L122 L126 L129	K99-L103 PolarHBondContact O-N 2.62Å; L103-K105 PolarHBondContact O-N 2.75Å; L103-R106 PolarHBondContact O-N 3.38Å; L103-I107 HydrophobicContact CD1-CD1 4.09Å; L103-I107 HydrophobicContact CD1-CG1 4.37Å; L103-I107 HydrophobicContact CG-CD1 4.03Å; L103-I107 WeakPolarHBondContact O-CG1 3.5Å; L103-I107 PolarHBondContact O-N 2.89Å; L103-L122 HydrophobicContact CD1-CB 4.37Å; L103-L122 HydrophobicContact CD1-CD2 3.68Å; L103-L126 HydrophobicContact CD2-CD1 4.22Å; L103-L129 HydrophobicContact CD2-CD1 3.63Å
104	K	81.4	Confident	74.9	Confident	30 Å²	30	77.1 Å²	77.1	13%	0.13	33%	0.333	C	S	.	.	H	α-helix	trans	-55	-51.5	175.1	-174.8	169.9	-175.1	168.5	0	111.2	K100 R106 I107 F108 H144 T147	K100-K104 PolarHBondContact O-N 3.01Å; K104-R106 VanDerWaalsContact C-N 3.34Å; K104-R106 PolarHBondContact O-N 2.88Å; K104-I107 PolarHBondContact O-N 2.81Å; K104-F108 HydrophobicContact CG-CD2 4.08Å; K104-F108 HydrophobicContact CG-CE2 4.13Å; K104-F108 WeakPolarHBondContact O-CD2 3.23Å; K104-F108 PolarHBondContact O-N 2.58Å; K104-H144 PolarHBondContact NZ-O 3.5Å; K104-T147 WeakPolarHBondContact CE-O 3.3Å; K104-T147 PolarHBondContact NZ-O 3.11Å
105	K	84.3	Confident	76.8	Confident	133 Å²	133	75 Å²	75	58%	0.578	33%	0.327	S	S	*	.	H	α-helix	trans	-61.8	-38.2	179.4	-67.2	-164.6	176.1	-149.5	0	113.1	R101 R102 L103 F108 A109	R101-K105 PolarHBondContact O-N 3.02Å; R102-K105 PolarHBondContact O-N 2.75Å; L103-K105 PolarHBondContact O-N 2.75Å; K105-F108 PolarHBondContact O-N 3.43Å; K105-A109 WeakPolarHBondContact O-CB 3.26Å; K105-A109 PolarHBondContact O-N 3.25Å
106	R	86.4	Confident	78.5	Confident	154 Å²	154	71.8 Å²	71.8	58%	0.581	31%	0.314	S	S	*	.	H	α-helix	trans	-65	-43.3	174.9	-79	178.2	169	-172.8	-10.1	112.9	R102 L103 K104 F108 A109 A110 L122	R102-R106 WeakPolarHBondContact O-CB 3.42Å; R102-R106 WeakPolarHBondContact O-CG 3.23Å; R102-R106 PolarHBondContact O-N 3.27Å; L103-R106 PolarHBondContact O-N 3.38Å; K104-R106 VanDerWaalsContact C-N 3.34Å; K104-R106 PolarHBondContact O-N 2.88Å; R106-F108 VanDerWaalsContact C-N 3.35Å; R106-F108 PolarHBondContact O-N 2.68Å; R106-A109 PolarHBondContact O-N 2.96Å; R106-A110 WeakPolarHBondContact O-CB 3.4Å; R106-A110 PolarHBondContact O-N 2.81Å; R106-L122 HydrophobicContact CB-CD1 3.92Å; R106-L122 HydrophobicContact CB-CD2 3.95Å
107	I	86.7	Confident	80	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-47.5	175.2	-66.3	163.3	0	0	0	109.9	L103 K104 A109 A110 V111 L119 L122 L126 C155	L103-I107 HydrophobicContact CD1-CD1 4.09Å; L103-I107 HydrophobicContact CD1-CG1 4.37Å; L103-I107 HydrophobicContact CG-CD1 4.03Å; L103-I107 WeakPolarHBondContact O-CG1 3.5Å; L103-I107 PolarHBondContact O-N 2.89Å; K104-I107 PolarHBondContact O-N 2.81Å; I107-A109 VanDerWaalsContact C-N 3.3Å; I107-A109 PolarHBondContact O-N 3.27Å; I107-A110 PolarHBondContact O-N 3.37Å; I107-V111 WeakPolarHBondContact O-CG1 3.31Å; I107-V111 WeakPolarHBondContact O-CG2 3.39Å; I107-V111 PolarHBondContact O-N 3.12Å; I107-V111 VanDerWaalsContact O-N 3.08Å; I107-L119 HydrophobicContact CG2-CD1 4.37Å; I107-L122 HydrophobicContact CG1-CB 3.9Å; I107-L122 HydrophobicContact CG1-CD1 4.39Å; I107-L126 HydrophobicContact CD1-CD2 4.3Å; I107-C155 HydrophobicContact CG2-CB 4.37Å
108	F	88.1	Confident	81.5	Confident	31 Å²	31	73.6 Å²	73.6	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-65.4	-28.7	178	-86.1	-92.9	0	0	0	113.8	K104 K105 R106 V111 S112 L146 C155 K158	K104-F108 HydrophobicContact CG-CD2 4.08Å; K104-F108 HydrophobicContact CG-CE2 4.13Å; K104-F108 WeakPolarHBondContact O-CD2 3.23Å; K104-F108 PolarHBondContact O-N 2.58Å; K105-F108 PolarHBondContact O-N 3.43Å; R106-F108 VanDerWaalsContact C-N 3.35Å; R106-F108 PolarHBondContact O-N 2.68Å; F108-V111 WeakPolarHBondContact O-CG2 3.18Å; F108-S112 WeakPolarHBondContact O-CB 3.48Å; F108-S112 PolarHBondContact O-OG 3.39Å; F108-L146 WeakPolarHBondContact CZ-O 3.42Å; F108-C155 HydrophobicContact CE1-CB 4.43Å; F108-C155 HydrophobicContact CE2-CB 4.44Å; F108-C155 HydrophobicContact CZ-CB 4.26Å; F108-K158 HydrophobicContact CD1-CB 3.92Å; F108-K158 HydrophobicContact CD1-CD 4.49Å; F108-K158 HydrophobicContact CD1-CG 4Å; F108-K158 HydrophobicContact CE1-CB 4.13Å
109	A	87.9	Confident	82.9	Confident	32 Å²	32	66.4 Å²	66.4	26%	0.264	30%	0.301	S	S	.	.	H	α-helix	trans	-73.3	-52.5	172.2	0	0	0	0	0	111.6	K105 R106 I107 V111 S112 E113	K105-A109 WeakPolarHBondContact O-CB 3.26Å; K105-A109 PolarHBondContact O-N 3.25Å; R106-A109 PolarHBondContact O-N 2.96Å; I107-A109 VanDerWaalsContact C-N 3.3Å; I107-A109 PolarHBondContact O-N 3.27Å; A109-V111 VanDerWaalsContact C-N 3.35Å; A109-V111 PolarHBondContact O-N 3.24Å; A109-S112 WeakPolarHBondContact CA-OG 3.49Å; A109-S112 CarbonylContact O-C 3.57Å; A109-S112 WeakPolarHBondContact O-CA 3.27Å; A109-S112 WeakPolarHBondContact O-CB 3.06Å; A109-S112 PolarHBondContact O-N 3.4Å; A109-S112 PolarHBondContact O-OG 3.44Å; A109-E113 PolarHBondContact O-N 2.59Å
110	A	87.8	Confident	84.3	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-57.4	-42.2	-179	0	0	0	0	0	112.8	R106 I107 S112 G114 C115 L119 L122	R106-A110 WeakPolarHBondContact O-CB 3.4Å; R106-A110 PolarHBondContact O-N 2.81Å; I107-A110 PolarHBondContact O-N 3.37Å; A110-S112 VanDerWaalsContact C-N 3.25Å; A110-S112 PolarHBondContact O-N 2.94Å; A110-G114 PolarHBondContact O-N 3.48Å; A110-C115 PolarHBondContact O-N 3.24Å; A110-L119 HydrophobicContact CB-CB 4.43Å; A110-L122 HydrophobicContact CB-CD1 4.08Å
111	V	89.1	Confident	85.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.3	-23.5	174.3	-58.2	0	0	0	0	113.3	I107 F108 A109 L119 C155 K158 A159 I170 L174	I107-V111 WeakPolarHBondContact O-CG1 3.31Å; I107-V111 WeakPolarHBondContact O-CG2 3.39Å; I107-V111 PolarHBondContact O-N 3.12Å; I107-V111 VanDerWaalsContact O-N 3.08Å; F108-V111 WeakPolarHBondContact O-CG2 3.18Å; A109-V111 VanDerWaalsContact C-N 3.35Å; A109-V111 PolarHBondContact O-N 3.24Å; V111-L119 HydrophobicContact CG1-CD1 3.68Å; V111-L119 HydrophobicContact CG1-CD2 4.04Å; V111-C155 HydrophobicContact CG2-CB 4.45Å; V111-K158 HydrophobicContact CG2-CB 4.15Å; V111-K158 HydrophobicContact CG2-CG 4Å; V111-A159 HydrophobicContact CB-CB 4.19Å; V111-I170 HydrophobicContact CB-CG2 4.37Å; V111-I170 HydrophobicContact CG1-CG2 4.2Å; V111-L174 HydrophobicContact CG1-CD1 4.21Å
112	S	87.6	Confident	86.8	Confident	23 Å²	23	61.9 Å²	61.9	16%	0.161	29%	0.293	C	S	.	.	H	α-helix	trans	-88.8	-28.6	179.8	73.1	0	0	0	0	113.8	F108 A109 A110 N164	F108-S112 WeakPolarHBondContact O-CB 3.48Å; F108-S112 PolarHBondContact O-OG 3.39Å; A109-S112 WeakPolarHBondContact CA-OG 3.49Å; A109-S112 CarbonylContact O-C 3.57Å; A109-S112 WeakPolarHBondContact O-CA 3.27Å; A109-S112 WeakPolarHBondContact O-CB 3.06Å; A109-S112 PolarHBondContact O-N 3.4Å; A109-S112 PolarHBondContact O-OG 3.44Å; A110-S112 VanDerWaalsContact C-N 3.25Å; A110-S112 PolarHBondContact O-N 2.94Å; S112-N164 PolarHBondContact O-ND2 3.19Å
113	E	88.9	Confident	87.3	Confident	130 Å²	130	54 Å²	54	61%	0.607	26%	0.264	S	S	*	.	H	α-helix	trans	-88.7	-25.5	177	-68.9	171.2	-151.1	0	0	112	A109 N164	A109-E113 PolarHBondContact O-N 2.59Å; E113-N164 VanDerWaalsContact C-ND2 3.31Å; E113-N164 PolarHBondContact O-ND2 2.73Å
114	G	87.5	Confident	87.6	Confident	4 Å²	4	57.2 Å²	57.2	4%	0.041	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	15.6	177.9	0	0	0	0	0	114.8	A110 V116 N164 N166	A110-G114 PolarHBondContact O-N 3.48Å; G114-V116 PolarHBondContact O-N 2.87Å; G114-V116 VanDerWaalsContact O-N 3.14Å; G114-N164 PolarHBondContact N-ND2 3.04Å; G114-N166 PolarHBondContact O-ND2 3.18Å
115	C	89.7	Confident	87.8	Confident	43 Å²	43	60.1 Å²	60.1	29%	0.291	30%	0.298	S	S	.	.			trans	-77.5	92.7	-176.8	-62.6	0	0	0	0	111.4	A110 E118 L119	A110-C115 PolarHBondContact O-N 3.24Å; C115-E118 HydrophobicContact CB-CB 4.1Å; C115-E118 HydrophobicContact CB-CG 4.18Å; C115-L119 WeakPolarHBondContact O-CB 3.46Å; C115-L119 PolarHBondContact O-N 3.02Å; C115-L119 VanDerWaalsContact O-N 3.07Å
116	V	89.8	Confident	87.8	Confident	38 Å²	38	53.8 Å²	53.8	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-43.9	-176	-177.6	0	0	0	0	112.3	G114 L119 V120 N166 I170 I173	G114-V116 PolarHBondContact O-N 2.87Å; G114-V116 VanDerWaalsContact O-N 3.14Å; V116-L119 PolarHBondContact O-N 3.15Å; V116-V120 WeakPolarHBondContact O-CG2 3.46Å; V116-V120 PolarHBondContact O-N 2.9Å; V116-N166 HydrophobicContact CG2-CB 3.89Å; V116-I170 HydrophobicContact CG2-CD1 4.46Å; V116-I170 HydrophobicContact CG2-CG1 4.09Å; V116-I173 HydrophobicContact CG1-CD1 3.52Å
117	E	89	Confident	87.6	Confident	168 Å²	168	48.5 Å²	48.5	79%	0.785	25%	0.252	S	S	*	.	H	α-helix	trans	-63.5	-51.3	-177	-65.1	168	173.7	0	0	110.9	L119 V120 E121	E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 2.94Å; E117-V120 PolarHBondContact O-N 3.44Å; E117-E121 PolarHBondContact O-N 3.3Å; E117-E121 VanDerWaalsContact O-N 3.13Å
118	E	87.8	Confident	87.3	Confident	105 Å²	105	53.8 Å²	53.8	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-60.2	-38.3	174.9	-60.2	-171	158.3	0	0	112.3	C115 V120 E121 L122	C115-E118 HydrophobicContact CB-CB 4.1Å; C115-E118 HydrophobicContact CB-CG 4.18Å; E118-V120 PolarHBondContact O-N 3.13Å; E118-E121 PolarHBondContact O-N 2.81Å; E118-L122 WeakPolarHBondContact O-CB 3.39Å; E118-L122 WeakPolarHBondContact O-CD1 3.16Å; E118-L122 WeakPolarHBondContact O-CG 3.17Å; E118-L122 PolarHBondContact O-N 2.81Å
119	L	89.8	Confident	86.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-43.7	177.3	179.5	63.4	0	0	0	111.8	I107 A110 V111 C115 V116 E117 L122 L123 I170	I107-L119 HydrophobicContact CG2-CD1 4.37Å; A110-L119 HydrophobicContact CB-CB 4.43Å; V111-L119 HydrophobicContact CG1-CD1 3.68Å; V111-L119 HydrophobicContact CG1-CD2 4.04Å; C115-L119 WeakPolarHBondContact O-CB 3.46Å; C115-L119 PolarHBondContact O-N 3.02Å; C115-L119 VanDerWaalsContact O-N 3.07Å; V116-L119 PolarHBondContact O-N 3.15Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 2.94Å; L119-L122 PolarHBondContact O-N 3.05Å; L119-L123 HydrophobicContact CD1-CD1 4.27Å; L119-L123 HydrophobicContact CD1-CG 4.23Å; L119-L123 HydrophobicContact CG-CD1 4.07Å; L119-L123 HydrophobicContact CG-CG 4.44Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 VanDerWaalsContact O-CG 3.27Å; L119-L123 WeakPolarHBondContact O-CG 3.38Å; L119-L123 PolarHBondContact O-N 2.98Å; L119-I170 HydrophobicContact CD2-CB 4.29Å; L119-I170 HydrophobicContact CD2-CG1 4.08Å; L119-I170 HydrophobicContact CD2-CG2 3.73Å
120	V	89.6	Confident	86.2	Confident	66 Å²	66	52.8 Å²	52.8	40%	0.4	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-43.6	178	173.9	0	0	0	0	110.7	V116 E117 E118 L122 L123 V124 I173	V116-V120 WeakPolarHBondContact O-CG2 3.46Å; V116-V120 PolarHBondContact O-N 2.9Å; E117-V120 PolarHBondContact O-N 3.44Å; E118-V120 PolarHBondContact O-N 3.13Å; V120-L122 PolarHBondContact O-N 2.77Å; V120-L123 PolarHBondContact O-N 3.07Å; V120-V124 WeakPolarHBondContact O-CG2 3.34Å; V120-V124 PolarHBondContact O-N 3.17Å; V120-I173 HydrophobicContact CG2-CD1 4.19Å; V120-I173 HydrophobicContact CG2-CG2 4.17Å
121	E	89	Confident	85.5	Confident	145 Å²	145	61 Å²	61	68%	0.678	30%	0.3	S	S	*	.	H	α-helix	trans	-59.1	-44.7	174.6	-69	-173	174.5	0	0	112.2	E117 E118 L123 V124 E125	E117-E121 PolarHBondContact O-N 3.3Å; E117-E121 VanDerWaalsContact O-N 3.13Å; E118-E121 PolarHBondContact O-N 2.81Å; E121-L123 PolarHBondContact O-N 2.8Å; E121-V124 PolarHBondContact O-N 2.93Å; E121-E125 PolarHBondContact O-N 2.86Å
122	L	86.9	Confident	84.5	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-68.8	-31.7	179.7	-66.8	164.7	0	0	0	112.9	L103 R106 I107 A110 E118 L119 V120 L126	L103-L122 HydrophobicContact CD1-CB 4.37Å; L103-L122 HydrophobicContact CD1-CD2 3.68Å; R106-L122 HydrophobicContact CB-CD1 3.92Å; R106-L122 HydrophobicContact CB-CD2 3.95Å; I107-L122 HydrophobicContact CG1-CB 3.9Å; I107-L122 HydrophobicContact CG1-CD1 4.39Å; A110-L122 HydrophobicContact CB-CD1 4.08Å; E118-L122 WeakPolarHBondContact O-CB 3.39Å; E118-L122 WeakPolarHBondContact O-CD1 3.16Å; E118-L122 WeakPolarHBondContact O-CG 3.17Å; E118-L122 PolarHBondContact O-N 2.81Å; L119-L122 PolarHBondContact O-N 3.05Å; V120-L122 PolarHBondContact O-N 2.77Å; L122-L126 WeakPolarHBondContact O-CB 3.45Å; L122-L126 PolarHBondContact O-N 3.31Å
123	L	85.6	Confident	83.5	Confident	6 Å²	6	73.5 Å²	73.5	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-71.3	-37.5	173.8	-72.3	173.7	0	0	0	111.7	L119 V120 E121 L126 Q127 I173 L174 F177	L119-L123 HydrophobicContact CD1-CD1 4.27Å; L119-L123 HydrophobicContact CD1-CG 4.23Å; L119-L123 HydrophobicContact CG-CD1 4.07Å; L119-L123 HydrophobicContact CG-CG 4.44Å; L119-L123 WeakPolarHBondContact O-CB 3.47Å; L119-L123 VanDerWaalsContact O-CG 3.27Å; L119-L123 WeakPolarHBondContact O-CG 3.38Å; L119-L123 PolarHBondContact O-N 2.98Å; V120-L123 PolarHBondContact O-N 3.07Å; E121-L123 PolarHBondContact O-N 2.8Å; L123-L126 WeakPolarHBondContact O-CB 3.42Å; L123-L126 PolarHBondContact O-N 3Å; L123-Q127 PolarHBondContact O-N 2.96Å; L123-I173 HydrophobicContact CD1-CG2 3.76Å; L123-L174 HydrophobicContact CD1-CD2 4.33Å; L123-L174 HydrophobicContact CD2-CD2 4.4Å; L123-F177 HydrophobicContact CB-CD2 4.08Å; L123-F177 HydrophobicContact CB-CE2 4.07Å; L123-F177 HydrophobicContact CD1-CB 4.37Å; L123-F177 HydrophobicContact CD1-CD2 4.49Å; L123-F177 HydrophobicContact CD1-CG 4.35Å; L123-F177 HydrophobicContact CD2-CD1 3.91Å; L123-F177 HydrophobicContact CD2-CD2 4.23Å; L123-F177 HydrophobicContact CD2-CE1 3.95Å; L123-F177 HydrophobicContact CD2-CE2 4.26Å; L123-F177 HydrophobicContact CD2-CG 4.05Å; L123-F177 HydrophobicContact CD2-CZ 4.13Å; L123-F177 HydrophobicContact CG-CD2 4.5Å
124	V	87	Confident	81.9	Confident	75 Å²	75	76 Å²	76	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-67	-43	171.9	174.6	0	0	0	0	111.1	V120 E121 L126 Q127 E128	V120-V124 WeakPolarHBondContact O-CG2 3.34Å; V120-V124 PolarHBondContact O-N 3.17Å; E121-V124 PolarHBondContact O-N 2.93Å; V124-L126 VanDerWaalsContact C-N 3.27Å; V124-L126 PolarHBondContact O-N 3.43Å; V124-Q127 PolarHBondContact O-N 3.42Å; V124-Q127 VanDerWaalsContact O-N 3.15Å; V124-E128 PolarHBondContact O-N 2.74Å
125	E	84.7	Confident	80.4	Confident	91 Å²	91	78.6 Å²	78.6	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-59	-39.8	173.4	-169.3	-174.4	175.7	0	0	111.2	E121 L129	E121-E125 PolarHBondContact O-N 2.86Å; E125-L129 WeakPolarHBondContact O-CB 3.44Å; E125-L129 PolarHBondContact O-N 2.72Å; E125-L129 VanDerWaalsContact O-N 3.08Å
126	L	84.2	Confident	78.8	Confident	1 Å²	1	85.6 Å²	85.6	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-63.9	-44.4	174.5	-176	64.2	0	0	0	111.6	L103 I107 L122 L123 V124 L129 C130 K145 L146 F177	L103-L126 HydrophobicContact CD2-CD1 4.22Å; I107-L126 HydrophobicContact CD1-CD2 4.3Å; L122-L126 WeakPolarHBondContact O-CB 3.45Å; L122-L126 PolarHBondContact O-N 3.31Å; L123-L126 WeakPolarHBondContact O-CB 3.42Å; L123-L126 PolarHBondContact O-N 3Å; V124-L126 VanDerWaalsContact C-N 3.27Å; V124-L126 PolarHBondContact O-N 3.43Å; L126-L129 WeakPolarHBondContact O-CA 3.35Å; L126-L129 VanDerWaalsContact O-CB 3.27Å; L126-L129 WeakPolarHBondContact O-CB 3.5Å; L126-L129 PolarHBondContact O-N 3.18Å; L126-L129 VanDerWaalsContact O-N 3.14Å; L126-C130 PolarHBondContact O-N 2.85Å; L126-C130 PolarHBondContact O-SG 2.99Å; L126-K145 HydrophobicContact CD1-CB 4.14Å; L126-K145 HydrophobicContact CD1-CG 4.4Å; L126-L146 HydrophobicContact CD2-CD2 3.88Å; L126-L146 HydrophobicContact CD2-CG 4.35Å; L126-F177 HydrophobicContact CD2-CE1 4.24Å; L126-F177 HydrophobicContact CD2-CZ 4.12Å
127	Q	82.4	Confident	77.8	Confident	43 Å²	43	88.6 Å²	88.6	20%	0.201	41%	0.41	C	S	.	.	H	α-helix	trans	-64.5	-40.1	178.9	-158.5	-176.3	36.2	0	0	112.2	L123 V124 L129 C130 R131 F177	L123-Q127 PolarHBondContact O-N 2.96Å; V124-Q127 PolarHBondContact O-N 3.42Å; V124-Q127 VanDerWaalsContact O-N 3.15Å; Q127-L129 VanDerWaalsContact C-N 3.3Å; Q127-L129 PolarHBondContact O-N 3.3Å; Q127-C130 PolarHBondContact O-N 3.39Å; Q127-R131 PolarHBondContact O-N 3.21Å; Q127-F177 HydrophobicContact CB-CE2 4.33Å
128	E	81.7	Confident	77.3	Confident	113 Å²	113	82.9 Å²	82.9	53%	0.528	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-35.8	171.4	-73.8	-159.3	148.5	0	0	112.7	V124 C130 R131 R132	V124-E128 PolarHBondContact O-N 2.74Å; E128-C130 VanDerWaalsContact C-N 3.3Å; E128-R131 PolarHBondContact O-N 3.34Å; E128-R132 PolarHBondContact O-N 3.28Å
129	L	78.1	Confident	77	Confident	33 Å²	33	80.5 Å²	80.5	17%	0.173	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-35.6	174.5	-119.4	167.1	0	0	0	112	K100 L103 E125 L126 Q127	K100-L129 HydrophobicContact CG-CD1 4.48Å; L103-L129 HydrophobicContact CD2-CD1 3.63Å; E125-L129 WeakPolarHBondContact O-CB 3.44Å; E125-L129 PolarHBondContact O-N 2.72Å; E125-L129 VanDerWaalsContact O-N 3.08Å; L126-L129 WeakPolarHBondContact O-CA 3.35Å; L126-L129 VanDerWaalsContact O-CB 3.27Å; L126-L129 WeakPolarHBondContact O-CB 3.5Å; L126-L129 PolarHBondContact O-N 3.18Å; L126-L129 VanDerWaalsContact O-N 3.14Å; Q127-L129 VanDerWaalsContact C-N 3.3Å; Q127-L129 PolarHBondContact O-N 3.3Å
130	C	74	Confident	76.6	Confident	8 Å²	8	84.2 Å²	84.2	5%	0.054	40%	0.401	C	S	.	.	H	α-helix	trans	-72.7	-42.5	175.9	-62	0	0	0	0	112	L126 Q127 E128 R132 R133 V138 L142	L126-C130 PolarHBondContact O-N 2.85Å; L126-C130 PolarHBondContact O-SG 2.99Å; Q127-C130 PolarHBondContact O-N 3.39Å; E128-C130 VanDerWaalsContact C-N 3.3Å; C130-R132 PolarHBondContact O-N 2.93Å; C130-R133 PolarHBondContact O-N 3.35Å; C130-V138 HydrophobicContact CB-CG1 4.32Å; C130-L142 HydrophobicContact CB-CD1 4.08Å; C130-L142 WeakPolarHBondContact SG-CD1 3.36Å
131	R	73.1	Confident	76.3	Confident	176 Å²	176	82 Å²	82	66%	0.664	39%	0.386	S	S	*	.	H	α-helix	trans	-60.1	-18.3	174.9	-73	-178.1	-178.9	168.9	5	114.4	Q127 E128	Q127-R131 PolarHBondContact O-N 3.21Å; E128-R131 PolarHBondContact O-N 3.34Å
132	R	69.1	Low	76	Confident	201 Å²	201	75.1 Å²	75.1	76%	0.758	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.8	173.7	-79	179	167.7	145.5	-0.2	114.3	E128 C130	E128-R132 PolarHBondContact O-N 3.28Å; C130-R132 PolarHBondContact O-N 2.93Å
133	R	65.3	Low	75.9	Confident	83 Å²	83	75.1 Å²	75.1	31%	0.313	35%	0.353	S	S	.	.			trans	-97.9	146.8	168.4	-91.6	-172.4	141	149.1	0.2	110	C130 D135 F141	C130-R133 PolarHBondContact O-N 3.35Å; R133-D135 WeakPolarHBondContact CB-OD1 3.28Å; R133-D135 WeakPolarHBondContact CD-OD2 3.47Å; R133-D135 WeakPolarHBondContact CG-OD1 3.48Å; R133-D135 IonicContact CZ-OD2 2.95Å; R133-D135 IonicContact NE-OD1 3.05Å; R133-D135 IonicContact NE-OD2 2.73Å; R133-D135 PolarHBondContact NE-OD2 3.43Å; R133-D135 IonicContact NH2-OD2 2.67Å; R133-F141 VanDerWaalsContact NH1-CE2 3.32Å
134	H	56.3	Low	75.9	Confident	184 Å²	184	78.2 Å²	78.2	85%	0.852	37%	0.368	S	S	*	.			trans	-130.6	11.4	-178.4	-75.5	-12.7	0	0	0	111.7
135	D	54.6	Low	75.7	Confident	58 Å²	58	76.3 Å²	76.3	31%	0.31	35%	0.353	S	S	.	.	S	Bend	trans	-83.8	142.6	170.9	26.8	-33.4	0	0	0	109.6	R133 D137 V138	R133-D135 WeakPolarHBondContact CB-OD1 3.28Å; R133-D135 WeakPolarHBondContact CD-OD2 3.47Å; R133-D135 WeakPolarHBondContact CG-OD1 3.48Å; R133-D135 IonicContact CZ-OD2 2.95Å; R133-D135 IonicContact NE-OD1 3.05Å; R133-D135 IonicContact NE-OD2 2.73Å; R133-D135 PolarHBondContact NE-OD2 3.43Å; R133-D135 IonicContact NH2-OD2 2.67Å; D135-D137 PolarHBondContact O-N 3.19Å; D135-V138 WeakPolarHBondContact O-CG2 3.38Å
136	E	56.3	Low	75.7	Confident	190 Å²	190	72.1 Å²	72.1	89%	0.888	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-8.5	-177	-64.7	-162.7	155.9	0	0	113.5	V138	E136-V138 PolarHBondContact O-N 3.19Å; E136-V138 VanDerWaalsContact O-N 3.09Å
137	D	70.2	Confident	75.9	Confident	100 Å²	100	73.3 Å²	73.3	54%	0.535	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	17.6	-176.9	-48.5	-38.3	0	0	0	114.1	D135 D140 F141	D135-D137 PolarHBondContact O-N 3.19Å; D137-D140 PolarHBondContact O-N 3.4Å; D137-F141 WeakPolarHBondContact O-CB 3.31Å; D137-F141 PolarHBondContact O-N 2.85Å
138	V	78.3	Confident	76	Confident	48 Å²	48	71.9 Å²	71.9	29%	0.291	34%	0.337	S	S	.	.	H	α-helix	trans	-51.6	-54.1	179.6	179.1	0	0	0	0	113	C130 D135 E136 D140 F141 L142	C130-V138 HydrophobicContact CB-CG1 4.32Å; D135-V138 WeakPolarHBondContact O-CG2 3.38Å; E136-V138 PolarHBondContact O-N 3.19Å; E136-V138 VanDerWaalsContact O-N 3.09Å; V138-D140 VanDerWaalsContact C-N 3.32Å; V138-D140 PolarHBondContact O-N 3.09Å; V138-F141 PolarHBondContact O-N 3.16Å; V138-L142 HydrophobicContact CG1-CD1 3.59Å; V138-L142 WeakPolarHBondContact O-CD1 3.37Å; V138-L142 PolarHBondContact O-N 3.42Å
139	P	80.8	Confident	75.9	Confident	55 Å²	55	68.7 Å²	68.7	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-36.6	-179.9	23.8	-34.5	0	0	0	113	L142 M143 I183	P139-L142 PolarHBondContact O-N 2.85Å; P139-M143 WeakPolarHBondContact O-CG 3.39Å; P139-M143 PolarHBondContact O-N 3.31Å; P139-I183 HydrophobicContact CB-CG2 3.44Å; P139-I183 VanDerWaalsContact CB-CG2 3.44Å
140	D	82	Confident	76.1	Confident	79 Å²	79	70.3 Å²	70.3	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-67.1	-37.6	175.9	-86.9	17.7	0	0	0	111.9	D137 V138 M143 H144 R186	D137-D140 PolarHBondContact O-N 3.4Å; V138-D140 VanDerWaalsContact C-N 3.32Å; V138-D140 PolarHBondContact O-N 3.09Å; D140-M143 WeakPolarHBondContact O-CB 3.46Å; D140-M143 PolarHBondContact O-N 2.99Å; D140-H144 WeakPolarHBondContact O-CB 3.22Å; D140-H144 PolarHBondContact O-N 3.31Å; D140-R186 IonicContact OD1-CZ 2.74Å; D140-R186 IonicContact OD1-NH1 2.78Å; D140-R186 PolarHBondContact OD1-NH1 3.33Å; D140-R186 IonicContact OD1-NH2 3.85Å
141	F	82.9	Confident	76.6	Confident	19 Å²	19	71.6 Å²	71.6	8%	0.083	34%	0.343	C	S	.	.	H	α-helix	trans	-66.8	-41.3	173.8	177.5	-108.1	0	0	0	112.6	R133 D137 V138 K145	R133-F141 VanDerWaalsContact NH1-CE2 3.32Å; D137-F141 WeakPolarHBondContact O-CB 3.31Å; D137-F141 PolarHBondContact O-N 2.85Å; V138-F141 PolarHBondContact O-N 3.16Å; F141-K145 HydrophobicContact CD2-CG 4.46Å; F141-K145 HydrophobicContact CE1-CG 4.36Å; F141-K145 HydrophobicContact CE2-CD 4.4Å; F141-K145 HydrophobicContact CE2-CG 4.06Å; F141-K145 HydrophobicContact CZ-CD 4.36Å; F141-K145 HydrophobicContact CZ-CG 4Å; F141-K145 VanDerWaalsContact O-CG 3.29Å; F141-K145 WeakPolarHBondContact O-CG 3.35Å; F141-K145 PolarHBondContact O-N 3.29Å
142	L	83.3	Confident	77.2	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-47.8	172.3	-86.4	86.9	0	0	0	110.5	C130 V138 P139 H144 K145 L146 F177 N181 I183	C130-L142 HydrophobicContact CB-CD1 4.08Å; C130-L142 WeakPolarHBondContact SG-CD1 3.36Å; V138-L142 HydrophobicContact CG1-CD1 3.59Å; V138-L142 WeakPolarHBondContact O-CD1 3.37Å; V138-L142 PolarHBondContact O-N 3.42Å; P139-L142 PolarHBondContact O-N 2.85Å; L142-H144 PolarHBondContact O-N 2.92Å; L142-K145 PolarHBondContact O-N 3.49Å; L142-L146 WeakPolarHBondContact O-CG 3.45Å; L142-L146 PolarHBondContact O-N 3.48Å; L142-F177 HydrophobicContact CD2-CE1 3.85Å; L142-F177 HydrophobicContact CD2-CZ 4.07Å; L142-N181 HydrophobicContact CD2-CB 3.9Å; L142-I183 HydrophobicContact CB-CD1 4.03Å; L142-I183 HydrophobicContact CD2-CD1 3.76Å
143	M	84.7	Confident	78.1	Confident	13 Å²	13	56.3 Å²	56.3	6%	0.064	29%	0.29	C	S	.	.	H	α-helix	trans	-52.6	-56.2	177	-78.1	-70.8	153.7	0	0	111.6	P139 D140 K145 L146 T147 I183 R186 F187	P139-M143 WeakPolarHBondContact O-CG 3.39Å; P139-M143 PolarHBondContact O-N 3.31Å; D140-M143 WeakPolarHBondContact O-CB 3.46Å; D140-M143 PolarHBondContact O-N 2.99Å; M143-K145 PolarHBondContact O-N 2.87Å; M143-L146 PolarHBondContact O-N 3.35Å; M143-T147 WeakPolarHBondContact O-CG2 3.42Å; M143-T147 PolarHBondContact O-N 3.49Å; M143-T147 PolarHBondContact O-OG1 3.26Å; M143-I183 HydrophobicContact CE-CB 3.62Å; M143-I183 HydrophobicContact CE-CD1 4.27Å; M143-I183 HydrophobicContact CE-CG1 4.37Å; M143-I183 HydrophobicContact CE-CG2 4.16Å; M143-I183 WeakPolarHBondContact CE-O 3.28Å; M143-R186 HydrophobicContact CE-CB 3.9Å; M143-R186 HydrophobicContact CE-CG 4.03Å; M143-R186 HydrophobicContact SD-CG 4.1Å; M143-F187 HydrophobicContact CE-CB 3.66Å; M143-F187 HydrophobicContact CE-CD2 4.4Å
144	H	84.2	Confident	79.4	Confident	72 Å²	72	52.3 Å²	52.3	33%	0.333	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-16.9	-179.9	179.3	-138.7	0	0	0	114.3	K104 D140 L142	K104-H144 PolarHBondContact NZ-O 3.5Å; D140-H144 WeakPolarHBondContact O-CB 3.22Å; D140-H144 PolarHBondContact O-N 3.31Å; L142-H144 PolarHBondContact O-N 2.92Å
145	K	83.1	Confident	81	Confident	35 Å²	35	43.6 Å²	43.6	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-90.6	-35.2	173.4	-68.8	-73.6	159.7	-104	0	112.9	L126 F141 L142 M143	L126-K145 HydrophobicContact CD1-CB 4.14Å; L126-K145 HydrophobicContact CD1-CG 4.4Å; F141-K145 HydrophobicContact CD2-CG 4.46Å; F141-K145 HydrophobicContact CE1-CG 4.36Å; F141-K145 HydrophobicContact CE2-CD 4.4Å; F141-K145 HydrophobicContact CE2-CG 4.06Å; F141-K145 HydrophobicContact CZ-CD 4.36Å; F141-K145 HydrophobicContact CZ-CG 4Å; F141-K145 VanDerWaalsContact O-CG 3.29Å; F141-K145 WeakPolarHBondContact O-CG 3.35Å; F141-K145 PolarHBondContact O-N 3.29Å; L142-K145 PolarHBondContact O-N 3.49Å; M143-K145 PolarHBondContact O-N 2.87Å
146	L	85.6	Confident	82.8	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-86.3	-18.9	179.9	-63	172	0	0	0	113.6	F108 L126 L142 M143 T154 C155 F177 I183 F187	F108-L146 WeakPolarHBondContact CZ-O 3.42Å; L126-L146 HydrophobicContact CD2-CD2 3.88Å; L126-L146 HydrophobicContact CD2-CG 4.35Å; L142-L146 WeakPolarHBondContact O-CG 3.45Å; L142-L146 PolarHBondContact O-N 3.48Å; M143-L146 PolarHBondContact O-N 3.35Å; L146-T154 CarbonylContact O-C 3.51Å; L146-T154 WeakPolarHBondContact O-CA 3.41Å; L146-C155 PolarHBondContact O-N 3.01Å; L146-F177 HydrophobicContact CD1-CE1 4.31Å; L146-I183 HydrophobicContact CD1-CD1 4.05Å; L146-F187 HydrophobicContact CB-CE2 4.02Å; L146-F187 HydrophobicContact CD1-CD2 4.49Å; L146-F187 HydrophobicContact CD1-CE2 4.24Å
147	T	87.2	Confident	84.6	Confident	26 Å²	26	31.8 Å²	31.8	16%	0.16	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-100.2	146.7	173.1	65.2	0	0	0	0	111.5	K104 M143 K153 T154	K104-T147 WeakPolarHBondContact CE-O 3.3Å; K104-T147 PolarHBondContact NZ-O 3.11Å; M143-T147 WeakPolarHBondContact O-CG2 3.42Å; M143-T147 PolarHBondContact O-N 3.49Å; M143-T147 PolarHBondContact O-OG1 3.26Å; T147-K153 CarbonylContact C-O 3.58Å; T147-K153 WeakPolarHBondContact CA-O 3.3Å; T147-T154 HydrophobicContact CG2-CG2 3.86Å
148	A	85.9	Confident	85.6	Confident	14 Å²	14	29.1 Å²	29.1	12%	0.116	16%	0.161	C	C	.	.			trans	-72	137.8	167.7	0	0	0	0	0	110.2	G152 K153	A148-G152 WeakPolarHBondContact O-CA 3.44Å; A148-G152 PolarHBondContact O-N 3.14Å; A148-G152 VanDerWaalsContact O-N 3.13Å; A148-K153 HydrophobicContact CB-CB 4.08Å; A148-K153 PolarHBondContact N-O 2.9Å
149	S	80.1	Confident	86.2	Confident	45 Å²	45	26.8 Å²	26.8	32%	0.315	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-31.1	179.1	22.4	0	0	0	0	112.2	D75	D75-S149 WeakPolarHBondContact OD2-CB 3.49Å; D75-S149 PolarHBondContact OD2-OG 3.01Å
150	D	81.8	Confident	86.8	Confident	68 Å²	68	24.2 Å²	24.2	36%	0.364	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-37.1	-173.9	-42.2	-93.9	0	0	0	113.6	Q71	Q71-D150 PolarHBondContact NE2-OD2 3.36Å
151	T	83.4	Confident	87.3	Confident	34 Å²	34	22 Å²	22	21%	0.209	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-3.6	-171	59.3	0	0	0	0	115.3	K153 Y192 T193 E194	T151-K153 PolarHBondContact O-N 3.34Å; T151-K153 WeakPolarHBondContact OG1-CB 3.47Å; T151-Y192 WeakPolarHBondContact O-CD1 3.01Å; T151-T193 VanDerWaalsContact C-OG1 3.32Å; T151-T193 PolarHBondContact O-N 2.82Å; T151-T193 PolarHBondContact O-OG1 3.36Å; T151-E194 HydrophobicContact CG2-CB 4.36Å
152	G	85.3	Confident	87.7	Confident	12 Å²	12	24.1 Å²	24.1	12%	0.124	13%	0.131	C	C	.	.			trans	81.1	-10.8	-173	0	0	0	0	0	114.9	A148 T154	A148-G152 WeakPolarHBondContact O-CA 3.44Å; A148-G152 PolarHBondContact O-N 3.14Å; A148-G152 VanDerWaalsContact O-N 3.13Å; G152-T154 PolarHBondContact O-N 3.3Å
153	K	88.8	Confident	88.1	Confident	44 Å²	44	27.2 Å²	27.2	19%	0.191	15%	0.147	C	C	.	.			trans	-49.9	119.4	-175.6	-176.5	175.1	-167.7	158.5	0	114	T147 A148 T151 M157 L161 Y192	T147-K153 CarbonylContact C-O 3.58Å; T147-K153 WeakPolarHBondContact CA-O 3.3Å; A148-K153 HydrophobicContact CB-CB 4.08Å; A148-K153 PolarHBondContact N-O 2.9Å; T151-K153 PolarHBondContact O-N 3.34Å; T151-K153 WeakPolarHBondContact OG1-CB 3.47Å; K153-M157 HydrophobicContact CG-CB 4.07Å; K153-M157 HydrophobicContact CG-SD 4.47Å; K153-L161 VanDerWaalsContact CE-CD1 3.46Å; K153-Y192 HydrophobicContact CB-CE1 3.76Å; K153-Y192 HydrophobicContact CD-CE1 4.39Å; K153-Y192 VanDerWaalsContact CD-OH 3.3Å; K153-Y192 WeakPolarHBondContact CD-OH 3.21Å; K153-Y192 WeakPolarHBondContact CE-OH 3.42Å; K153-Y192 HydrophobicContact CG-CE1 4.2Å; K153-Y192 WeakPolarHBondContact CG-OH 3.5Å
154	T	92	Very high	88.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-78.9	161	175.8	66.7	0	0	0	0	112.9	L146 T147 G152 L156 M157 K158 F187 A190	L146-T154 CarbonylContact O-C 3.51Å; L146-T154 WeakPolarHBondContact O-CA 3.41Å; T147-T154 HydrophobicContact CG2-CG2 3.86Å; G152-T154 PolarHBondContact O-N 3.3Å; T154-L156 PolarHBondContact O-N 2.95Å; T154-L156 PolarHBondContact OG1-N 3.44Å; T154-M157 HydrophobicContact CG2-SD 4.27Å; T154-M157 PolarHBondContact N-SD 2.91Å; T154-M157 WeakPolarHBondContact O-CB 3.27Å; T154-M157 PolarHBondContact O-N 3.26Å; T154-M157 VanDerWaalsContact OG1-CG 3.29Å; T154-M157 WeakPolarHBondContact OG1-CG 3.38Å; T154-M157 PolarHBondContact OG1-N 3.43Å; T154-K158 PolarHBondContact O-N 2.9Å; T154-F187 HydrophobicContact CG2-CD2 4.45Å; T154-F187 HydrophobicContact CG2-CE2 4.28Å; T154-A190 HydrophobicContact CG2-CB 3.47Å; T154-A190 VanDerWaalsContact CG2-CB 3.47Å
155	C	90.2	Very high	88.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-29.3	167.7	59.2	0	0	0	0	112.5	I107 F108 V111 L146 K158 A159 F187	I107-C155 HydrophobicContact CG2-CB 4.37Å; F108-C155 HydrophobicContact CE1-CB 4.43Å; F108-C155 HydrophobicContact CE2-CB 4.44Å; F108-C155 HydrophobicContact CZ-CB 4.26Å; V111-C155 HydrophobicContact CG2-CB 4.45Å; L146-C155 PolarHBondContact O-N 3.01Å; C155-K158 PolarHBondContact O-N 3.26Å; C155-A159 WeakPolarHBondContact O-CB 3.18Å; C155-A159 PolarHBondContact O-N 2.71Å; C155-F187 VanDerWaalsContact SG-CZ 3.59Å
156	L	93.1	Very high	89.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-45.9	170.7	178.5	62.8	0	0	0	111.5	T154 K158 A159 L160 V171 F187 A202 L218	T154-L156 PolarHBondContact O-N 2.95Å; T154-L156 PolarHBondContact OG1-N 3.44Å; L156-K158 VanDerWaalsContact C-N 3.35Å; L156-K158 PolarHBondContact O-N 3.37Å; L156-A159 PolarHBondContact O-N 3.43Å; L156-L160 HydrophobicContact CD1-CD1 4.2Å; L156-L160 HydrophobicContact CD1-CG 4.41Å; L156-L160 HydrophobicContact CG-CD1 4.14Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 3.05Å; L156-V171 HydrophobicContact CD1-CB 4.41Å; L156-V171 HydrophobicContact CD1-CG1 3.93Å; L156-V171 HydrophobicContact CD1-CG2 3.88Å; L156-F187 HydrophobicContact CB-CE1 3.87Å; L156-F187 HydrophobicContact CB-CZ 3.73Å; L156-F187 HydrophobicContact CD2-CE1 4.17Å; L156-A202 HydrophobicContact CD2-CB 3.78Å; L156-A202 HydrophobicContact CG-CB 4.03Å; L156-L218 HydrophobicContact CD2-CD2 4.06Å
157	M	93.3	Very high	89.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-39.3	173.9	-67.9	162	171.7	0	0	112.1	K153 T154 L160 L161 A190 Y192 Q200 A202 I205	K153-M157 HydrophobicContact CG-CB 4.07Å; K153-M157 HydrophobicContact CG-SD 4.47Å; T154-M157 HydrophobicContact CG2-SD 4.27Å; T154-M157 PolarHBondContact N-SD 2.91Å; T154-M157 WeakPolarHBondContact O-CB 3.27Å; T154-M157 PolarHBondContact O-N 3.26Å; T154-M157 VanDerWaalsContact OG1-CG 3.29Å; T154-M157 WeakPolarHBondContact OG1-CG 3.38Å; T154-M157 PolarHBondContact OG1-N 3.43Å; M157-L160 PolarHBondContact O-N 3.07Å; M157-L161 WeakPolarHBondContact O-CB 3.25Å; M157-L161 VanDerWaalsContact O-CG 3.29Å; M157-L161 WeakPolarHBondContact O-CG 3.28Å; M157-L161 PolarHBondContact O-N 3.45Å; M157-A190 WeakPolarHBondContact CE-O 3.4Å; M157-Y192 HydrophobicContact CB-CE2 4.39Å; M157-Y192 HydrophobicContact CE-CD2 3.82Å; M157-Y192 HydrophobicContact CE-CE2 4.11Å; M157-Y192 HydrophobicContact CG-CE2 4.18Å; M157-Y192 HydrophobicContact SD-CD2 3.69Å; M157-Y192 HydrophobicContact SD-CE2 3.43Å; M157-Y192 WeakPolarHBondContact SD-CE2 3.4Å; M157-Q200 WeakPolarHBondContact CE-O 3.15Å; M157-A202 HydrophobicContact CG-CB 4.39Å; M157-I205 HydrophobicContact CB-CD1 3.82Å; M157-I205 HydrophobicContact CG-CD1 3.8Å
158	K	91.5	Very high	89.7	Confident	44 Å²	44	35.7 Å²	35.7	19%	0.191	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-42.1	174.7	-174.9	76.4	175.9	-171.2	0	111.7	F108 V111 T154 C155 L156 L160 L161 N162	F108-K158 HydrophobicContact CD1-CB 3.92Å; F108-K158 HydrophobicContact CD1-CD 4.49Å; F108-K158 HydrophobicContact CD1-CG 4Å; F108-K158 HydrophobicContact CE1-CB 4.13Å; V111-K158 HydrophobicContact CG2-CB 4.15Å; V111-K158 HydrophobicContact CG2-CG 4Å; T154-K158 PolarHBondContact O-N 2.9Å; C155-K158 PolarHBondContact O-N 3.26Å; L156-K158 VanDerWaalsContact C-N 3.35Å; L156-K158 PolarHBondContact O-N 3.37Å; K158-L160 VanDerWaalsContact C-N 3.34Å; K158-L160 PolarHBondContact O-N 3.39Å; K158-L161 PolarHBondContact O-N 3.49Å; K158-N162 PolarHBondContact O-N 2.9Å
159	A	91.8	Very high	90	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-34.5	176.9	0	0	0	0	0	113.1	V111 C155 L156 N162 T167 I170	V111-A159 HydrophobicContact CB-CB 4.19Å; C155-A159 WeakPolarHBondContact O-CB 3.18Å; C155-A159 PolarHBondContact O-N 2.71Å; L156-A159 PolarHBondContact O-N 3.43Å; A159-N162 VanDerWaalsContact O-O 3.14Å; A159-T167 VanDerWaalsContact O-CG2 3.3Å; A159-T167 WeakPolarHBondContact O-CG2 3.48Å; A159-I170 HydrophobicContact CB-CG2 4.16Å
160	L	92.6	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-78.6	-32.4	177.3	-68.6	170.6	0	0	0	112.9	L156 M157 K158 I163 V171 A202 I205 A206 R209 I214 L218	L156-L160 HydrophobicContact CD1-CD1 4.2Å; L156-L160 HydrophobicContact CD1-CG 4.41Å; L156-L160 HydrophobicContact CG-CD1 4.14Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 3.05Å; M157-L160 PolarHBondContact O-N 3.07Å; K158-L160 VanDerWaalsContact C-N 3.34Å; K158-L160 PolarHBondContact O-N 3.39Å; L160-I163 WeakPolarHBondContact O-CD1 3.26Å; L160-V171 HydrophobicContact CD2-CG2 4.26Å; L160-A202 HydrophobicContact CD1-CB 3.85Å; L160-A202 WeakPolarHBondContact CD1-O 3.15Å; L160-I205 HydrophobicContact CB-CB 4.26Å; L160-I205 HydrophobicContact CB-CG2 3.69Å; L160-A206 HydrophobicContact CD1-CB 4.34Å; L160-A206 HydrophobicContact CD2-CB 4.19Å; L160-R209 WeakPolarHBondContact O-CG 3.48Å; L160-I214 HydrophobicContact CD2-CD1 4.46Å; L160-I214 HydrophobicContact CD2-CG2 3.86Å; L160-L218 HydrophobicContact CD1-CD1 4.27Å
161	L	92.8	Very high	91.1	Very high	33 Å²	33	33.8 Å²	33.8	17%	0.173	18%	0.181	C	C	.	.	H	α-helix	trans	-68.4	-37.8	175.4	-76.1	165.2	0	0	0	112.3	K153 M157 K158 I205 R209	K153-L161 VanDerWaalsContact CE-CD1 3.46Å; M157-L161 WeakPolarHBondContact O-CB 3.25Å; M157-L161 VanDerWaalsContact O-CG 3.29Å; M157-L161 WeakPolarHBondContact O-CG 3.28Å; M157-L161 PolarHBondContact O-N 3.45Å; K158-L161 PolarHBondContact O-N 3.49Å; L161-I205 HydrophobicContact CD2-CG2 3.84Å; L161-I205 HydrophobicContact CG-CD1 4.26Å; L161-I205 HydrophobicContact CG-CG2 3.91Å; L161-R209 PolarHBondContact O-NE 3.32Å; L161-R209 VanDerWaalsContact O-NE 3.12Å
162	N	92.4	Very high	91.6	Very high	63 Å²	63	37.6 Å²	37.6	34%	0.337	19%	0.191	S	C	.	.	S	Bend	trans	-103.8	84.2	-178.8	-70	23.8	0	0	0	110.4	K158 A159 N164	K158-N162 PolarHBondContact O-N 2.9Å; A159-N162 VanDerWaalsContact O-O 3.14Å; N162-N164 PolarHBondContact O-N 3.01Å
163	I	91.7	Very high	92	Very high	66 Å²	66	38.8 Å²	38.8	34%	0.338	19%	0.194	S	C	.	.			trans	-74.4	117.6	-176.8	-59.4	-61.5	0	0	0	111.6	L160 T167 R209 Q211	L160-I163 WeakPolarHBondContact O-CD1 3.26Å; I163-T167 HydrophobicContact CD1-CG2 4.2Å; I163-R209 HydrophobicContact CD1-CB 4.19Å; I163-R209 HydrophobicContact CD1-CG 4.48Å; I163-R209 HydrophobicContact CG1-CB 4.09Å; I163-R209 HydrophobicContact CG1-CG 4.19Å; I163-Q211 HydrophobicContact CD1-CG 3.84Å
164	N	91.1	Very high	92.1	Very high	44 Å²	44	36.8 Å²	36.8	24%	0.235	19%	0.186	C	C	.	.			trans	-121.1	160.3	177.8	-64.8	-24.3	0	0	0	109.3	S112 E113 G114 N162 N166 T167	S112-N164 PolarHBondContact O-ND2 3.19Å; E113-N164 VanDerWaalsContact C-ND2 3.31Å; E113-N164 PolarHBondContact O-ND2 2.73Å; G114-N164 PolarHBondContact N-ND2 3.04Å; N162-N164 PolarHBondContact O-N 3.01Å; N164-N166 PolarHBondContact O-N 3.05Å; N164-N166 VanDerWaalsContact O-N 3.12Å; N164-T167 PolarHBondContact N-OG1 2.97Å; N164-T167 WeakPolarHBondContact O-CB 3.28Å; N164-T167 PolarHBondContact O-N 3.37Å; N164-T167 PolarHBondContact O-OG1 3.26Å; N164-T167 VanDerWaalsContact O-OG1 3.11Å
165	P	90.5	Very high	92.1	Very high	132 Å²	132	37.2 Å²	37.2	86%	0.857	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.5	176.6	23.7	-34.6	0	0	0	113.1
166	N	92.1	Very high	92.2	Very high	74 Å²	74	39.2 Å²	39.2	40%	0.396	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-5.4	179	-62.8	-13.2	0	0	0	113.8	G114 V116 N164 K168 E169 I170	G114-N166 PolarHBondContact O-ND2 3.18Å; V116-N166 HydrophobicContact CG2-CB 3.89Å; N164-N166 PolarHBondContact O-N 3.05Å; N164-N166 VanDerWaalsContact O-N 3.12Å; N166-K168 VanDerWaalsContact C-N 3.29Å; N166-K168 PolarHBondContact O-N 3.15Å; N166-E169 PolarHBondContact O-N 2.57Å; N166-I170 HydrophobicContact CB-CD1 4.12Å; N166-I170 PolarHBondContact O-N 3.4Å
167	T	91.8	Very high	92.1	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-57.9	-37.9	-172.5	-65.1	0	0	0	0	112.6	A159 I163 N164 E169 I170 V171 I214	A159-T167 VanDerWaalsContact O-CG2 3.3Å; A159-T167 WeakPolarHBondContact O-CG2 3.48Å; I163-T167 HydrophobicContact CD1-CG2 4.2Å; N164-T167 PolarHBondContact N-OG1 2.97Å; N164-T167 WeakPolarHBondContact O-CB 3.28Å; N164-T167 PolarHBondContact O-N 3.37Å; N164-T167 PolarHBondContact O-OG1 3.26Å; N164-T167 VanDerWaalsContact O-OG1 3.11Å; T167-E169 VanDerWaalsContact C-N 3.28Å; T167-E169 PolarHBondContact O-N 3.03Å; T167-I170 PolarHBondContact O-N 3.03Å; T167-V171 HydrophobicContact CG2-CG2 4.16Å; T167-V171 WeakPolarHBondContact O-CB 3.17Å; T167-V171 VanDerWaalsContact O-CG2 3.27Å; T167-V171 WeakPolarHBondContact O-CG2 3.46Å; T167-V171 PolarHBondContact O-N 3.35Å; T167-I214 HydrophobicContact CG2-CD1 4.13Å
168	K	92.1	Very high	91.9	Very high	74 Å²	74	40 Å²	40	32%	0.322	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-35.5	177.4	-172.3	173.2	-176.1	176.4	0	112.7	N166 R172 D213 I214	N166-K168 VanDerWaalsContact C-N 3.29Å; N166-K168 PolarHBondContact O-N 3.15Å; K168-R172 WeakPolarHBondContact O-CG 3.12Å; K168-R172 PolarHBondContact O-N 2.69Å; K168-D213 IonicContact NZ-OD2 2.61Å; K168-D213 PolarHBondContact NZ-OD2 3.44Å; K168-I214 HydrophobicContact CB-CD1 4.47Å
169	E	92.4	Very high	91.9	Very high	87 Å²	87	44.1 Å²	44.1	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-80.8	-38.7	179	-158.4	59.5	-159	0	0	111.6	N166 T167 V171 R172 I173	N166-E169 PolarHBondContact O-N 2.57Å; T167-E169 VanDerWaalsContact C-N 3.28Å; T167-E169 PolarHBondContact O-N 3.03Å; E169-V171 VanDerWaalsContact C-N 3.33Å; E169-V171 PolarHBondContact O-N 3.05Å; E169-R172 WeakPolarHBondContact O-CB 3.13Å; E169-R172 PolarHBondContact O-N 3.03Å; E169-R172 WeakPolarHBondContact OE2-CD 3.44Å; E169-R172 IonicContact OE2-CZ 2.88Å; E169-R172 IonicContact OE2-NE 2.62Å; E169-R172 IonicContact OE2-NH1 3.47Å; E169-R172 PolarHBondContact OE2-NH1 2.72Å; E169-I173 HydrophobicContact CG-CD1 4.3Å; E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 3.36Å
170	I	92.1	Very high	91.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-44.8	172.1	-71.7	167.7	0	0	0	111.1	V111 V116 L119 A159 N166 T167 R172 I173 L174	V111-I170 HydrophobicContact CB-CG2 4.37Å; V111-I170 HydrophobicContact CG1-CG2 4.2Å; V116-I170 HydrophobicContact CG2-CD1 4.46Å; V116-I170 HydrophobicContact CG2-CG1 4.09Å; L119-I170 HydrophobicContact CD2-CB 4.29Å; L119-I170 HydrophobicContact CD2-CG1 4.08Å; L119-I170 HydrophobicContact CD2-CG2 3.73Å; A159-I170 HydrophobicContact CB-CG2 4.16Å; N166-I170 HydrophobicContact CB-CD1 4.12Å; N166-I170 PolarHBondContact O-N 3.4Å; T167-I170 PolarHBondContact O-N 3.03Å; I170-R172 PolarHBondContact O-N 3.47Å; I170-I173 PolarHBondContact O-N 3.44Å; I170-L174 HydrophobicContact CG2-CD1 3.87Å; I170-L174 HydrophobicContact CG2-CG 4.43Å; I170-L174 WeakPolarHBondContact O-CB 3.12Å; I170-L174 VanDerWaalsContact O-CG 3.28Å; I170-L174 WeakPolarHBondContact O-CG 3.23Å; I170-L174 PolarHBondContact O-N 2.9Å
171	V	93.1	Very high	91.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-40.8	176.9	172.1	0	0	0	0	111.2	L156 L160 T167 E169 L174 L175 I214	L156-V171 HydrophobicContact CD1-CB 4.41Å; L156-V171 HydrophobicContact CD1-CG1 3.93Å; L156-V171 HydrophobicContact CD1-CG2 3.88Å; L160-V171 HydrophobicContact CD2-CG2 4.26Å; T167-V171 HydrophobicContact CG2-CG2 4.16Å; T167-V171 WeakPolarHBondContact O-CB 3.17Å; T167-V171 VanDerWaalsContact O-CG2 3.27Å; T167-V171 WeakPolarHBondContact O-CG2 3.46Å; T167-V171 PolarHBondContact O-N 3.35Å; E169-V171 VanDerWaalsContact C-N 3.33Å; E169-V171 PolarHBondContact O-N 3.05Å; V171-L174 PolarHBondContact O-N 3.49Å; V171-L175 HydrophobicContact CG1-CD1 3.65Å; V171-L175 HydrophobicContact CG1-CG 4.25Å; V171-L175 WeakPolarHBondContact O-CB 3.31Å; V171-L175 WeakPolarHBondContact O-CG 3.38Å; V171-L175 PolarHBondContact O-N 2.85Å; V171-I214 HydrophobicContact CB-CG2 4.46Å; V171-I214 HydrophobicContact CG1-CG2 3.94Å; V171-I214 HydrophobicContact CG2-CG2 4.33Å
172	R	93.5	Very high	91.2	Very high	113 Å²	113	58.4 Å²	58.4	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-47.6	173.8	-76.3	165.1	172.4	170.2	-7.7	112.5	K168 E169 I170 L174 L175 A176 L217	K168-R172 WeakPolarHBondContact O-CG 3.12Å; K168-R172 PolarHBondContact O-N 2.69Å; E169-R172 WeakPolarHBondContact O-CB 3.13Å; E169-R172 PolarHBondContact O-N 3.03Å; E169-R172 WeakPolarHBondContact OE2-CD 3.44Å; E169-R172 IonicContact OE2-CZ 2.88Å; E169-R172 IonicContact OE2-NE 2.62Å; E169-R172 IonicContact OE2-NH1 3.47Å; E169-R172 PolarHBondContact OE2-NH1 2.72Å; I170-R172 PolarHBondContact O-N 3.47Å; R172-L174 VanDerWaalsContact C-N 3.35Å; R172-L174 PolarHBondContact O-N 2.9Å; R172-L175 PolarHBondContact O-N 3.27Å; R172-A176 WeakPolarHBondContact O-CB 3.35Å; R172-A176 PolarHBondContact O-N 2.71Å; R172-L217 HydrophobicContact CG-CD1 3.76Å
173	I	92.9	Very high	91	Very high	37 Å²	37	55.7 Å²	55.7	19%	0.19	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-42.9	179.6	-68.3	163.5	0	0	0	110.7	V116 V120 L123 E169 I170 F177	V116-I173 HydrophobicContact CG1-CD1 3.52Å; V120-I173 HydrophobicContact CG2-CD1 4.19Å; V120-I173 HydrophobicContact CG2-CG2 4.17Å; L123-I173 HydrophobicContact CD1-CG2 3.76Å; E169-I173 HydrophobicContact CG-CD1 4.3Å; E169-I173 WeakPolarHBondContact O-CG1 3.44Å; E169-I173 PolarHBondContact O-N 3.36Å; I170-I173 PolarHBondContact O-N 3.44Å; I173-F177 VanDerWaalsContact O-CB 3.29Å; I173-F177 WeakPolarHBondContact O-CB 3.11Å; I173-F177 PolarHBondContact O-N 3.46Å
174	L	91.3	Very high	91	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-37.6	176.7	-72.4	172.4	0	0	0	112.8	V111 L123 I170 V171 R172 A178	V111-L174 HydrophobicContact CG1-CD1 4.21Å; L123-L174 HydrophobicContact CD1-CD2 4.33Å; L123-L174 HydrophobicContact CD2-CD2 4.4Å; I170-L174 HydrophobicContact CG2-CD1 3.87Å; I170-L174 HydrophobicContact CG2-CG 4.43Å; I170-L174 WeakPolarHBondContact O-CB 3.12Å; I170-L174 VanDerWaalsContact O-CG 3.28Å; I170-L174 WeakPolarHBondContact O-CG 3.23Å; I170-L174 PolarHBondContact O-N 2.9Å; V171-L174 PolarHBondContact O-N 3.49Å; R172-L174 VanDerWaalsContact C-N 3.35Å; R172-L174 PolarHBondContact O-N 2.9Å; L174-A178 WeakPolarHBondContact O-CB 3.33Å; L174-A178 PolarHBondContact O-N 2.81Å
175	L	92.7	Very high	90.8	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-73.5	-42.1	177.7	-68.3	169.3	0	0	0	111.8	V171 R172 F177 A178 E179 L184 I188 L217 L218	V171-L175 HydrophobicContact CG1-CD1 3.65Å; V171-L175 HydrophobicContact CG1-CG 4.25Å; V171-L175 WeakPolarHBondContact O-CB 3.31Å; V171-L175 WeakPolarHBondContact O-CG 3.38Å; V171-L175 PolarHBondContact O-N 2.85Å; R172-L175 PolarHBondContact O-N 3.27Å; L175-F177 VanDerWaalsContact C-N 3.34Å; L175-F177 PolarHBondContact O-N 2.89Å; L175-A178 CarbonylContact O-C 3.56Å; L175-A178 PolarHBondContact O-N 3.28Å; L175-A178 VanDerWaalsContact O-N 3.11Å; L175-E179 WeakPolarHBondContact O-CB 3.27Å; L175-E179 PolarHBondContact O-N 3.42Å; L175-L184 HydrophobicContact CB-CD1 4.31Å; L175-L184 HydrophobicContact CD2-CD1 3.63Å; L175-I188 HydrophobicContact CD2-CD1 4.13Å; L175-L217 HydrophobicContact CD1-CD2 3.42Å; L175-L217 VanDerWaalsContact CD1-CD2 3.42Å; L175-L218 HydrophobicContact CD1-CD2 4.26Å; L175-L218 HydrophobicContact CD2-CD2 4.47Å
176	A	92.2	Very high	90.8	Very high	42 Å²	42	54.8 Å²	54.8	35%	0.347	27%	0.274	S	S	.	.	H	α-helix	trans	-60.3	-43.2	172.9	0	0	0	0	0	111.5	R172 A178 E179 E180	R172-A176 WeakPolarHBondContact O-CB 3.35Å; R172-A176 PolarHBondContact O-N 2.71Å; A176-A178 VanDerWaalsContact C-N 3.32Å; A176-A178 PolarHBondContact O-N 3.43Å; A176-E179 PolarHBondContact O-N 2.98Å; A176-E180 WeakPolarHBondContact O-CG 3.3Å; A176-E180 PolarHBondContact O-N 3.01Å
177	F	90.6	Very high	90.8	Very high	15 Å²	15	51.4 Å²	51.4	7%	0.066	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-37.2	173.1	-178.4	-94.4	0	0	0	112.5	L123 L126 Q127 L142 L146 I173 L175 N181	L123-F177 HydrophobicContact CB-CD2 4.08Å; L123-F177 HydrophobicContact CB-CE2 4.07Å; L123-F177 HydrophobicContact CD1-CB 4.37Å; L123-F177 HydrophobicContact CD1-CD2 4.49Å; L123-F177 HydrophobicContact CD1-CG 4.35Å; L123-F177 HydrophobicContact CD2-CD1 3.91Å; L123-F177 HydrophobicContact CD2-CD2 4.23Å; L123-F177 HydrophobicContact CD2-CE1 3.95Å; L123-F177 HydrophobicContact CD2-CE2 4.26Å; L123-F177 HydrophobicContact CD2-CG 4.05Å; L123-F177 HydrophobicContact CD2-CZ 4.13Å; L123-F177 HydrophobicContact CG-CD2 4.5Å; L126-F177 HydrophobicContact CD2-CE1 4.24Å; L126-F177 HydrophobicContact CD2-CZ 4.12Å; Q127-F177 HydrophobicContact CB-CE2 4.33Å; L142-F177 HydrophobicContact CD2-CE1 3.85Å; L142-F177 HydrophobicContact CD2-CZ 4.07Å; L146-F177 HydrophobicContact CD1-CE1 4.31Å; I173-F177 VanDerWaalsContact O-CB 3.29Å; I173-F177 WeakPolarHBondContact O-CB 3.11Å; I173-F177 PolarHBondContact O-N 3.46Å; L175-F177 VanDerWaalsContact C-N 3.34Å; L175-F177 PolarHBondContact O-N 2.89Å; F177-N181 PolarHBondContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3Å
178	A	89.6	Confident	90.9	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-72.8	-29.4	177	0	0	0	0	0	113	L174 L175 A176 I183 L184 F187	L174-A178 WeakPolarHBondContact O-CB 3.33Å; L174-A178 PolarHBondContact O-N 2.81Å; L175-A178 CarbonylContact O-C 3.56Å; L175-A178 PolarHBondContact O-N 3.28Å; L175-A178 VanDerWaalsContact O-N 3.11Å; A176-A178 VanDerWaalsContact C-N 3.32Å; A176-A178 PolarHBondContact O-N 3.43Å; A178-I183 HydrophobicContact CB-CD1 4.45Å; A178-I183 HydrophobicContact CB-CG1 4.03Å; A178-I183 VanDerWaalsContact O-CG1 3.32Å; A178-I183 WeakPolarHBondContact O-CG1 3.3Å; A178-I183 PolarHBondContact O-N 2.71Å; A178-L184 HydrophobicContact CB-CB 4.36Å; A178-L184 HydrophobicContact CB-CD1 3.96Å; A178-L184 PolarHBondContact O-N 2.91Å; A178-F187 HydrophobicContact CB-CB 4.35Å; A178-F187 HydrophobicContact CB-CD1 3.77Å; A178-F187 HydrophobicContact CB-CE1 4.45Å; A178-F187 HydrophobicContact CB-CG 4.28Å
179	E	91.3	Very high	91	Very high	131 Å²	131	50.5 Å²	50.5	61%	0.612	25%	0.254	S	S	*	.	H	α-helix	trans	-70.7	-47.5	172.6	-170.9	175	-161.3	0	0	111.3	L175 A176 N181 D182 L184	L175-E179 WeakPolarHBondContact O-CB 3.27Å; L175-E179 PolarHBondContact O-N 3.42Å; A176-E179 PolarHBondContact O-N 2.98Å; E179-N181 PolarHBondContact O-N 3.11Å; E179-D182 PolarHBondContact O-N 2.9Å; E179-D182 VanDerWaalsContact O-N 3.15Å; E179-L184 HydrophobicContact CB-CD2 4.31Å
180	E	89.3	Confident	91	Very high	137 Å²	137	47 Å²	47	64%	0.64	24%	0.241	S	C	*	.	H	α-helix	trans	-57.8	-20.9	176.6	-79.3	-175.9	-166	0	0	114.8	A176	A176-E180 WeakPolarHBondContact O-CG 3.3Å; A176-E180 PolarHBondContact O-N 3.01Å
181	N	86	Confident	91.1	Very high	36 Å²	36	51.5 Å²	51.5	19%	0.193	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	15	-177	-65.1	-87.8	0	0	0	113	L142 F177 E179 I183	L142-N181 HydrophobicContact CD2-CB 3.9Å; F177-N181 PolarHBondContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3Å; E179-N181 PolarHBondContact O-N 3.11Å; N181-I183 HydrophobicContact CB-CD1 4.39Å; N181-I183 HydrophobicContact CB-CG1 4.11Å; N181-I183 WeakPolarHBondContact O-CG2 3.47Å; N181-I183 PolarHBondContact O-N 3.12Å
182	D	86.1	Confident	91	Very high	161 Å²	161	52.2 Å²	52.2	86%	0.861	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	21.5	179.6	-69.3	-49	0	0	0	115.3	E179	E179-D182 PolarHBondContact O-N 2.9Å; E179-D182 VanDerWaalsContact O-N 3.15Å
183	I	88.9	Confident	90.8	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.031	27%	0.274	C	S	.	.			trans	-102.2	-6.7	-177.5	55.7	169.5	0	0	0	114.2	P139 L142 M143 L146 A178 N181 G185 R186 F187	P139-I183 HydrophobicContact CB-CG2 3.44Å; P139-I183 VanDerWaalsContact CB-CG2 3.44Å; L142-I183 HydrophobicContact CB-CD1 4.03Å; L142-I183 HydrophobicContact CD2-CD1 3.76Å; M143-I183 HydrophobicContact CE-CB 3.62Å; M143-I183 HydrophobicContact CE-CD1 4.27Å; M143-I183 HydrophobicContact CE-CG1 4.37Å; M143-I183 HydrophobicContact CE-CG2 4.16Å; M143-I183 WeakPolarHBondContact CE-O 3.28Å; L146-I183 HydrophobicContact CD1-CD1 4.05Å; A178-I183 HydrophobicContact CB-CD1 4.45Å; A178-I183 HydrophobicContact CB-CG1 4.03Å; A178-I183 VanDerWaalsContact O-CG1 3.32Å; A178-I183 WeakPolarHBondContact O-CG1 3.3Å; A178-I183 PolarHBondContact O-N 2.71Å; N181-I183 HydrophobicContact CB-CD1 4.39Å; N181-I183 HydrophobicContact CB-CG1 4.11Å; N181-I183 WeakPolarHBondContact O-CG2 3.47Å; N181-I183 PolarHBondContact O-N 3.12Å; I183-G185 PolarHBondContact O-N 3Å; I183-R186 PolarHBondContact O-N 3.21Å; I183-R186 VanDerWaalsContact O-N 3.14Å; I183-F187 WeakPolarHBondContact O-CB 3.42Å; I183-F187 PolarHBondContact O-N 2.97Å
184	L	90.4	Very high	90.6	Very high	32 Å²	32	52.7 Å²	52.7	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-46.1	-54.2	-171.4	-175.1	64.5	0	0	0	114	L175 A178 E179 R186 F187 I188	L175-L184 HydrophobicContact CB-CD1 4.31Å; L175-L184 HydrophobicContact CD2-CD1 3.63Å; A178-L184 HydrophobicContact CB-CB 4.36Å; A178-L184 HydrophobicContact CB-CD1 3.96Å; A178-L184 PolarHBondContact O-N 2.91Å; E179-L184 HydrophobicContact CB-CD2 4.31Å; L184-R186 VanDerWaalsContact C-N 3.32Å; L184-R186 PolarHBondContact O-N 3.35Å; L184-F187 PolarHBondContact O-N 2.9Å; L184-I188 WeakPolarHBondContact O-CG2 3.47Å; L184-I188 PolarHBondContact O-N 3.06Å
185	G	87.9	Confident	90.4	Very high	45 Å²	45	60.9 Å²	60.9	46%	0.464	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-32.6	-175.5	0	0	0	0	0	114.4	I183 N189	I183-G185 PolarHBondContact O-N 3Å; G185-N189 WeakPolarHBondContact O-CB 3.26Å; G185-N189 PolarHBondContact O-ND2 3.5Å
186	R	90	Very high	90.2	Very high	146 Å²	146	62.3 Å²	62.3	55%	0.551	33%	0.329	S	S	*	.	H	α-helix	trans	-83.1	-25.5	174.4	-175	174.4	177.6	-173.5	-4.8	112.3	D140 M143 I183 L184 A190	D140-R186 IonicContact OD1-CZ 2.74Å; D140-R186 IonicContact OD1-NH1 2.78Å; D140-R186 PolarHBondContact OD1-NH1 3.33Å; D140-R186 IonicContact OD1-NH2 3.85Å; M143-R186 HydrophobicContact CE-CB 3.9Å; M143-R186 HydrophobicContact CE-CG 4.03Å; M143-R186 HydrophobicContact SD-CG 4.1Å; I183-R186 PolarHBondContact O-N 3.21Å; I183-R186 VanDerWaalsContact O-N 3.14Å; L184-R186 VanDerWaalsContact C-N 3.32Å; L184-R186 PolarHBondContact O-N 3.35Å; R186-A190 PolarHBondContact O-N 3.23Å
187	F	92.6	Very high	90.1	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.009	32%	0.323	C	S	.	.	H	α-helix	trans	-78.1	-41.8	-177.6	-178.5	-116.5	0	0	0	111.5	M143 L146 T154 C155 L156 A178 I183 L184	M143-F187 HydrophobicContact CE-CB 3.66Å; M143-F187 HydrophobicContact CE-CD2 4.4Å; L146-F187 HydrophobicContact CB-CE2 4.02Å; L146-F187 HydrophobicContact CD1-CD2 4.49Å; L146-F187 HydrophobicContact CD1-CE2 4.24Å; T154-F187 HydrophobicContact CG2-CD2 4.45Å; T154-F187 HydrophobicContact CG2-CE2 4.28Å; C155-F187 VanDerWaalsContact SG-CZ 3.59Å; L156-F187 HydrophobicContact CB-CE1 3.87Å; L156-F187 HydrophobicContact CB-CZ 3.73Å; L156-F187 HydrophobicContact CD2-CE1 4.17Å; A178-F187 HydrophobicContact CB-CB 4.35Å; A178-F187 HydrophobicContact CB-CD1 3.77Å; A178-F187 HydrophobicContact CB-CE1 4.45Å; A178-F187 HydrophobicContact CB-CG 4.28Å; I183-F187 WeakPolarHBondContact O-CB 3.42Å; I183-F187 PolarHBondContact O-N 2.97Å; L184-F187 PolarHBondContact O-N 2.9Å
188	I	93.9	Very high	90.2	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-75.3	-36.5	-179.3	-158.1	168.1	0	0	0	112.1	L175 L184 A190 L218 A221 A223	L175-I188 HydrophobicContact CD2-CD1 4.13Å; L184-I188 WeakPolarHBondContact O-CG2 3.47Å; L184-I188 PolarHBondContact O-N 3.06Å; I188-A190 VanDerWaalsContact C-N 3.32Å; I188-L218 HydrophobicContact CD1-CB 4.19Å; I188-L218 HydrophobicContact CD1-CD2 3.69Å; I188-L218 WeakPolarHBondContact CD1-O 3.41Å; I188-L218 HydrophobicContact CG1-CD2 3.87Å; I188-A221 HydrophobicContact CD1-CB 3.75Å; I188-A223 HydrophobicContact CD1-CB 3.85Å; I188-A223 HydrophobicContact CG1-CB 3.97Å
189	N	93.5	Very high	90.2	Very high	56 Å²	56	67.1 Å²	67.1	30%	0.299	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	21.8	177.8	-57.3	-41.3	0	0	0	112.7	G185 G222 A223 D224	G185-N189 WeakPolarHBondContact O-CB 3.26Å; G185-N189 PolarHBondContact O-ND2 3.5Å; N189-G222 PolarHBondContact ND2-O 2.86Å; N189-A223 WeakPolarHBondContact OD1-CA 3.41Å; N189-D224 PolarHBondContact OD1-N 3.06Å
190	A	92.9	Very high	90.4	Very high	14 Å²	14	61.8 Å²	61.8	12%	0.116	32%	0.318	C	S	.	.			trans	-67.3	135	167.8	0	0	0	0	0	109.4	T154 M157 R186 I188	T154-A190 HydrophobicContact CG2-CB 3.47Å; T154-A190 VanDerWaalsContact CG2-CB 3.47Å; M157-A190 WeakPolarHBondContact CE-O 3.4Å; R186-A190 PolarHBondContact O-N 3.23Å; I188-A190 VanDerWaalsContact C-N 3.32Å
191	E	93.7	Very high	90.6	Very high	93 Å²	93	55.4 Å²	55.4	44%	0.435	29%	0.289	S	S	.	.			trans	-108.3	152.1	177.8	-70.3	177	-173.6	0	0	110.7	Q200 T201	E191-Q200 WeakPolarHBondContact CA-O 3.22Å; E191-T201 HydrophobicContact CG-CG2 3.86Å
192	Y	92.3	Very high	91	Very high	16 Å²	16	53.8 Å²	53.8	6%	0.063	28%	0.28	C	S	.	.			trans	-65	135.8	164.5	-90.2	-89.6	0	0	0	111.2	T151 K153 M157 E194 Y197 E198 G199 Q200 I205	T151-Y192 WeakPolarHBondContact O-CD1 3.01Å; K153-Y192 HydrophobicContact CB-CE1 3.76Å; K153-Y192 HydrophobicContact CD-CE1 4.39Å; K153-Y192 VanDerWaalsContact CD-OH 3.3Å; K153-Y192 WeakPolarHBondContact CD-OH 3.21Å; K153-Y192 WeakPolarHBondContact CE-OH 3.42Å; K153-Y192 HydrophobicContact CG-CE1 4.2Å; K153-Y192 WeakPolarHBondContact CG-OH 3.5Å; M157-Y192 HydrophobicContact CB-CE2 4.39Å; M157-Y192 HydrophobicContact CE-CD2 3.82Å; M157-Y192 HydrophobicContact CE-CE2 4.11Å; M157-Y192 HydrophobicContact CG-CE2 4.18Å; M157-Y192 HydrophobicContact SD-CD2 3.69Å; M157-Y192 HydrophobicContact SD-CE2 3.43Å; M157-Y192 WeakPolarHBondContact SD-CE2 3.4Å; Y192-E194 HydrophobicContact CD1-CG 4.07Å; Y192-E194 WeakPolarHBondContact CD1-OE1 3.29Å; Y192-E194 WeakPolarHBondContact CE1-OE1 3.33Å; Y192-Y197 WeakPolarHBondContact CB-O 3.33Å; Y192-E198 WeakPolarHBondContact O-CA 3.36Å; Y192-G199 PolarHBondContact O-N 2.93Å; Y192-Q200 HydrophobicContact CD2-CB 3.94Å; Y192-Q200 HydrophobicContact CD2-CG 4.27Å; Y192-Q200 WeakPolarHBondContact CD2-O 3.32Å; Y192-Q200 HydrophobicContact CG-CB 4.49Å; Y192-Q200 PolarHBondContact N-O 2.89Å; Y192-I205 HydrophobicContact CE2-CD1 4.27Å
193	T	88.9	Confident	91.5	Very high	104 Å²	104	46.2 Å²	46.2	64%	0.638	24%	0.24	S	C	*	.			trans	-103.4	1.4	-177.7	61.2	0	0	0	0	113.6	T151	T151-T193 VanDerWaalsContact C-OG1 3.32Å; T151-T193 PolarHBondContact O-N 2.82Å; T151-T193 PolarHBondContact O-OG1 3.36Å
194	E	89.3	Confident	91.7	Very high	56 Å²	56	46 Å²	46	26%	0.262	24%	0.239	S	C	.	.	S	Bend	trans	-84.4	137.2	179.7	63.1	-174	134.9	0	0	111.8	T151 Y192 A196 Y197 E198	T151-E194 HydrophobicContact CG2-CB 4.36Å; Y192-E194 HydrophobicContact CD1-CG 4.07Å; Y192-E194 WeakPolarHBondContact CD1-OE1 3.29Å; Y192-E194 WeakPolarHBondContact CE1-OE1 3.33Å; E194-A196 PolarHBondContact O-N 3.07Å; E194-Y197 HydrophobicContact CG-CD2 4.06Å; E194-Y197 CarbonylContact O-C 3.58Å; E194-Y197 PolarHBondContact O-N 3.39Å; E194-E198 PolarHBondContact O-N 3.3Å
195	E	87.3	Confident	91.9	Very high	173 Å²	173	44.5 Å²	44.5	81%	0.808	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-27.8	-174.5	-59.8	-177.2	168.3	0	0	114	A232	E195-A232 PolarHBondContact O-N 3.21Å; E195-A232 VanDerWaalsContact O-N 3.1Å
196	A	87.9	Confident	92.2	Very high	40 Å²	40	42.4 Å²	42.4	33%	0.331	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-38	178.4	0	0	0	0	0	113.1	E194 G231 A232 F233	E194-A196 PolarHBondContact O-N 3.07Å; A196-G231 CarbonylContact O-C 3.45Å; A196-G231 VanDerWaalsContact O-C 3.27Å; A196-G231 WeakPolarHBondContact O-CA 3.5Å; A196-A232 PolarHBondContact O-N 3.13Å; A196-A232 VanDerWaalsContact O-N 3.15Å; A196-F233 VanDerWaalsContact O-CB 3.24Å; A196-F233 WeakPolarHBondContact O-CB 3.43Å; A196-F233 PolarHBondContact O-N 3.2Å
197	Y	90.4	Very high	92.5	Very high	54 Å²	54	35.4 Å²	35.4	21%	0.212	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.3	18	-169.8	-59.3	-74.2	0	0	0	113.4	M52 Y192 E194 G199 Q200 F233 F234	M52-Y197 HydrophobicContact CE-CE1 3.92Å; Y192-Y197 WeakPolarHBondContact CB-O 3.33Å; E194-Y197 HydrophobicContact CG-CD2 4.06Å; E194-Y197 CarbonylContact O-C 3.58Å; E194-Y197 PolarHBondContact O-N 3.39Å; Y197-G199 PolarHBondContact O-N 3.37Å; Y197-Q200 VanDerWaalsContact O-CB 3.26Å; Y197-Q200 WeakPolarHBondContact O-CB 3.32Å; Y197-Q200 PolarHBondContact O-N 3.14Å; Y197-F233 HydrophobicContact CD1-CB 3.9Å; Y197-F233 HydrophobicContact CD1-CD1 4.1Å; Y197-F233 HydrophobicContact CD1-CG 4.08Å; Y197-F233 HydrophobicContact CE1-CB 3.66Å; Y197-F233 AromaticContact CE1-CD1 3.62Å; Y197-F233 HydrophobicContact CE1-CD1 3.62Å; Y197-F233 AromaticContact CE1-CD2 3.94Å; Y197-F233 HydrophobicContact CE1-CD2 3.94Å; Y197-F233 HydrophobicContact CE1-CE1 4.25Å; Y197-F233 AromaticContact CE1-CG 3.45Å; Y197-F233 HydrophobicContact CE1-CG 3.45Å; Y197-F233 VanDerWaalsContact CE1-CG 3.45Å; Y197-F234 AromaticContact CD1-CE2 3.95Å; Y197-F234 HydrophobicContact CD1-CE2 3.95Å; Y197-F234 AromaticContact CD1-CZ 3.85Å; Y197-F234 HydrophobicContact CD1-CZ 3.85Å
198	E	92.2	Very high	92.5	Very high	103 Å²	103	37.3 Å²	37.3	48%	0.481	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43	128.6	179.4	-169.3	-171.8	166.2	0	0	112.5	Y192 E194 Q200 A229 K230 G231	Y192-E198 WeakPolarHBondContact O-CA 3.36Å; E194-E198 PolarHBondContact O-N 3.3Å; E198-Q200 VanDerWaalsContact C-N 3.33Å; E198-Q200 PolarHBondContact O-N 3.3Å; E198-A229 CarbonylContact O-C 3.56Å; E198-K230 PolarHBondContact O-N 3.33Å; E198-G231 PolarHBondContact O-N 2.76Å
199	G	90.5	Very high	92.5	Very high	2 Å²	2	41 Å²	41	2%	0.021	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	4.3	179	0	0	0	0	0	115.5	Y192 Y197 T201	Y192-G199 PolarHBondContact O-N 2.93Å; Y197-G199 PolarHBondContact O-N 3.37Å; G199-T201 PolarHBondContact O-N 3.36Å
200	Q	94.1	Very high	92.6	Very high	19 Å²	19	44.3 Å²	44.3	9%	0.089	21%	0.213	C	C	.	.			trans	-71.8	123	173.3	-173.5	176.1	17.1	0	0	111.1	M157 E191 Y192 Y197 E198 N204 I205 F234	M157-Q200 WeakPolarHBondContact CE-O 3.15Å; E191-Q200 WeakPolarHBondContact CA-O 3.22Å; Y192-Q200 HydrophobicContact CD2-CB 3.94Å; Y192-Q200 HydrophobicContact CD2-CG 4.27Å; Y192-Q200 WeakPolarHBondContact CD2-O 3.32Å; Y192-Q200 HydrophobicContact CG-CB 4.49Å; Y192-Q200 PolarHBondContact N-O 2.89Å; Y197-Q200 VanDerWaalsContact O-CB 3.26Å; Y197-Q200 WeakPolarHBondContact O-CB 3.32Å; Y197-Q200 PolarHBondContact O-N 3.14Å; E198-Q200 VanDerWaalsContact C-N 3.33Å; E198-Q200 PolarHBondContact O-N 3.3Å; Q200-N204 HydrophobicContact CG-CB 4.31Å; Q200-I205 HydrophobicContact CG-CG1 4.42Å; Q200-F234 HydrophobicContact CB-CE2 4Å; Q200-F234 HydrophobicContact CB-CZ 4.22Å; Q200-F234 HydrophobicContact CG-CE2 4.48Å; Q200-F234 HydrophobicContact CG-CZ 4.19Å
201	T	94.4	Very high	92.6	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	22%	0.221	C	C	.	.			trans	-101.1	169.3	176.3	62	0	0	0	0	112.6	E191 G199 L203 N204 A227	E191-T201 HydrophobicContact CG-CG2 3.86Å; G199-T201 PolarHBondContact O-N 3.36Å; T201-L203 VanDerWaalsContact C-N 3.25Å; T201-L203 PolarHBondContact O-N 2.92Å; T201-N204 PolarHBondContact O-N 3.03Å; T201-A227 HydrophobicContact CG2-CB 3.6Å
202	A	94.1	Very high	92.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-34.6	172.7	0	0	0	0	0	113.1	L156 M157 L160 N204 I205 A206	L156-A202 HydrophobicContact CD2-CB 3.78Å; L156-A202 HydrophobicContact CG-CB 4.03Å; M157-A202 HydrophobicContact CG-CB 4.39Å; L160-A202 HydrophobicContact CD1-CB 3.85Å; L160-A202 WeakPolarHBondContact CD1-O 3.15Å; A202-N204 PolarHBondContact O-N 3.32Å; A202-I205 PolarHBondContact O-N 3.24Å; A202-A206 PolarHBondContact O-N 3.22Å
203	L	95.3	Very high	92.6	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-43.2	179.3	-177.3	60.7	0	0	0	111.9	T201 I205 A206 I207 A215 L218 I219 A223 V225 P249	T201-L203 VanDerWaalsContact C-N 3.25Å; T201-L203 PolarHBondContact O-N 2.92Å; L203-I205 VanDerWaalsContact C-N 3.29Å; L203-I205 PolarHBondContact O-N 3.49Å; L203-A206 PolarHBondContact O-N 3.39Å; L203-I207 HydrophobicContact CD1-CD1 4.28Å; L203-I207 HydrophobicContact CD1-CG1 4.49Å; L203-I207 HydrophobicContact CG-CD1 4.09Å; L203-I207 WeakPolarHBondContact O-CG1 3.37Å; L203-I207 PolarHBondContact O-N 2.88Å; L203-A215 HydrophobicContact CD1-CB 4.21Å; L203-L218 HydrophobicContact CD1-CB 4.43Å; L203-I219 HydrophobicContact CD1-CD1 4.47Å; L203-I219 HydrophobicContact CD1-CG1 4.13Å; L203-A223 HydrophobicContact CD2-CB 4.45Å; L203-V225 HydrophobicContact CD2-CG1 4.39Å; L203-P249 HydrophobicContact CD2-CB 4.11Å; L203-P249 HydrophobicContact CD2-CG 4.18Å; L203-P249 HydrophobicContact CG-CB 4.44Å
204	N	94.4	Very high	92.9	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.011	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-39.1	177	-75.1	-25.5	0	0	0	112.1	Q200 T201 A202 I207 E208 P249 L252	Q200-N204 HydrophobicContact CG-CB 4.31Å; T201-N204 PolarHBondContact O-N 3.03Å; A202-N204 PolarHBondContact O-N 3.32Å; N204-I207 PolarHBondContact O-N 2.79Å; N204-E208 WeakPolarHBondContact O-CB 3.33Å; N204-E208 PolarHBondContact O-N 2.9Å; N204-P249 WeakPolarHBondContact OD1-CA 3.47Å; N204-P249 WeakPolarHBondContact OD1-CG 3.5Å; N204-L252 HydrophobicContact CB-CD2 4.09Å; N204-L252 WeakPolarHBondContact O-CD2 3.41Å
205	I	94.1	Very high	93.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.3	-42.4	177.7	-55.3	171.2	0	0	0	111	M157 L160 L161 Y192 Q200 A202 L203 I207 E208 R209	M157-I205 HydrophobicContact CB-CD1 3.82Å; M157-I205 HydrophobicContact CG-CD1 3.8Å; L160-I205 HydrophobicContact CB-CB 4.26Å; L160-I205 HydrophobicContact CB-CG2 3.69Å; L161-I205 HydrophobicContact CD2-CG2 3.84Å; L161-I205 HydrophobicContact CG-CD1 4.26Å; L161-I205 HydrophobicContact CG-CG2 3.91Å; Y192-I205 HydrophobicContact CE2-CD1 4.27Å; Q200-I205 HydrophobicContact CG-CG1 4.42Å; A202-I205 PolarHBondContact O-N 3.24Å; L203-I205 VanDerWaalsContact C-N 3.29Å; L203-I205 PolarHBondContact O-N 3.49Å; I205-I207 VanDerWaalsContact C-N 3.28Å; I205-I207 PolarHBondContact O-N 2.71Å; I205-E208 PolarHBondContact O-N 2.97Å; I205-R209 HydrophobicContact CG2-CG 4.33Å; I205-R209 WeakPolarHBondContact O-CB 3.49Å; I205-R209 WeakPolarHBondContact O-CG 3.46Å; I205-R209 PolarHBondContact O-N 3.27Å
206	A	94.9	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.5	-38.8	177.1	0	0	0	0	0	112	L160 A202 L203 R210 Q211 A215 L218	L160-A206 HydrophobicContact CD1-CB 4.34Å; L160-A206 HydrophobicContact CD2-CB 4.19Å; A202-A206 PolarHBondContact O-N 3.22Å; L203-A206 PolarHBondContact O-N 3.39Å; A206-R210 PolarHBondContact O-N 3.38Å; A206-Q211 PolarHBondContact O-N 2.93Å; A206-A215 HydrophobicContact CB-CB 4.49Å; A206-L218 HydrophobicContact CB-CD1 3.84Å
207	I	95.1	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.4	-48.2	174.8	-63.9	171.6	0	0	0	110.7	L203 N204 I205 R209 R210 P249 L252 A253 Q258 I261 L265	L203-I207 HydrophobicContact CD1-CD1 4.28Å; L203-I207 HydrophobicContact CD1-CG1 4.49Å; L203-I207 HydrophobicContact CG-CD1 4.09Å; L203-I207 WeakPolarHBondContact O-CG1 3.37Å; L203-I207 PolarHBondContact O-N 2.88Å; N204-I207 PolarHBondContact O-N 2.79Å; I205-I207 VanDerWaalsContact C-N 3.28Å; I205-I207 PolarHBondContact O-N 2.71Å; I207-R209 VanDerWaalsContact C-N 3.28Å; I207-R209 PolarHBondContact O-N 3.32Å; I207-R210 WeakPolarHBondContact O-CA 3.35Å; I207-R210 PolarHBondContact O-N 3.49Å; I207-P249 HydrophobicContact CD1-CB 3.83Å; I207-L252 HydrophobicContact CB-CD2 4.24Å; I207-L252 HydrophobicContact CG2-CB 4.47Å; I207-L252 HydrophobicContact CG2-CD2 4.11Å; I207-L252 HydrophobicContact CG2-CG 3.95Å; I207-A253 HydrophobicContact CG2-CB 3.81Å; I207-Q258 PolarHBondContact O-NE2 3.25Å; I207-I261 HydrophobicContact CD1-CG2 4.3Å; I207-I261 HydrophobicContact CG1-CD1 4.47Å; I207-I261 HydrophobicContact CG1-CG2 4.15Å; I207-L265 HydrophobicContact CD1-CD1 4.37Å
208	E	93.7	Very high	94	Very high	42 Å²	42	31.2 Å²	31.2	20%	0.196	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-39.6	178.1	-174.5	-106.4	161.3	0	0	112.2	N204 I205 R210	N204-E208 WeakPolarHBondContact O-CB 3.33Å; N204-E208 PolarHBondContact O-N 2.9Å; I205-E208 PolarHBondContact O-N 2.97Å; E208-R210 VanDerWaalsContact C-N 3.26Å; E208-R210 PolarHBondContact O-N 3.04Å
209	R	94	Very high	94	Very high	81 Å²	81	26.9 Å²	26.9	31%	0.306	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	7	175.4	-67.5	-77.9	-176.3	-91.1	-9.5	114.7	L160 L161 I163 I205 I207 Q211	L160-R209 WeakPolarHBondContact O-CG 3.48Å; L161-R209 PolarHBondContact O-NE 3.32Å; L161-R209 VanDerWaalsContact O-NE 3.12Å; I163-R209 HydrophobicContact CD1-CB 4.19Å; I163-R209 HydrophobicContact CD1-CG 4.48Å; I163-R209 HydrophobicContact CG1-CB 4.09Å; I163-R209 HydrophobicContact CG1-CG 4.19Å; I205-R209 HydrophobicContact CG2-CG 4.33Å; I205-R209 WeakPolarHBondContact O-CB 3.49Å; I205-R209 WeakPolarHBondContact O-CG 3.46Å; I205-R209 PolarHBondContact O-N 3.27Å; I207-R209 VanDerWaalsContact C-N 3.28Å; I207-R209 PolarHBondContact O-N 3.32Å; R209-Q211 VanDerWaalsContact C-N 3.29Å; R209-Q211 HydrophobicContact CB-CG 4.14Å; R209-Q211 PolarHBondContact O-N 3.36Å; R209-Q211 PolarHBondContact O-NE2 3.46Å
210	R	94.3	Very high	94.1	Very high	125 Å²	125	31.2 Å²	31.2	47%	0.472	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	31.8	177.3	-52	-173.8	172.3	-146.4	-10.6	115.4	A206 I207 E208 G212 T256 Q258	A206-R210 PolarHBondContact O-N 3.38Å; I207-R210 WeakPolarHBondContact O-CA 3.35Å; I207-R210 PolarHBondContact O-N 3.49Å; E208-R210 VanDerWaalsContact C-N 3.26Å; E208-R210 PolarHBondContact O-N 3.04Å; R210-G212 PolarHBondContact O-N 2.94Å; R210-T256 PolarHBondContact NH2-O 3.43Å; R210-T256 VanDerWaalsContact NH2-O 3.14Å; R210-Q258 VanDerWaalsContact CA-OE1 3.26Å
211	Q	94.1	Very high	94	Very high	57 Å²	57	31.6 Å²	31.6	27%	0.266	18%	0.179	S	C	.	.			trans	-91.3	69.4	-177.5	-59.9	-55.3	-53.6	0	0	111.4	I163 A206 R209 D213 I214 A215	I163-Q211 HydrophobicContact CD1-CG 3.84Å; A206-Q211 PolarHBondContact O-N 2.93Å; R209-Q211 VanDerWaalsContact C-N 3.29Å; R209-Q211 HydrophobicContact CB-CG 4.14Å; R209-Q211 PolarHBondContact O-N 3.36Å; R209-Q211 PolarHBondContact O-NE2 3.46Å; Q211-D213 VanDerWaalsContact C-N 3.33Å; Q211-D213 PolarHBondContact O-N 2.74Å; Q211-I214 HydrophobicContact CB-CB 3.95Å; Q211-I214 HydrophobicContact CB-CD1 3.99Å; Q211-I214 HydrophobicContact CB-CG1 4.04Å; Q211-I214 HydrophobicContact CG-CD1 4.19Å; Q211-I214 PolarHBondContact O-N 3.01Å; Q211-A215 PolarHBondContact O-N 3.41Å
212	G	92.9	Very high	93.8	Very high	29 Å²	29	33.4 Å²	33.4	30%	0.299	20%	0.198	S	C	.	.	H	α-helix	trans	-53.3	-44.7	-178.2	0	0	0	0	0	114	R210 I214 A215 A216	R210-G212 PolarHBondContact O-N 2.94Å; G212-I214 VanDerWaalsContact C-N 3.28Å; G212-I214 PolarHBondContact O-N 2.87Å; G212-A215 PolarHBondContact O-N 3.47Å; G212-A216 WeakPolarHBondContact O-CB 3.35Å; G212-A216 PolarHBondContact O-N 2.98Å
213	D	93.8	Very high	93.8	Very high	102 Å²	102	33.5 Å²	33.5	55%	0.545	20%	0.199	S	C	.	.	H	α-helix	trans	-56	-39.4	174.4	-80.4	16.7	0	0	0	113.4	K168 Q211 L217	K168-D213 IonicContact NZ-OD2 2.61Å; K168-D213 PolarHBondContact NZ-OD2 3.44Å; Q211-D213 VanDerWaalsContact C-N 3.33Å; Q211-D213 PolarHBondContact O-N 2.74Å; D213-L217 PolarHBondContact O-N 3.31Å
214	I	94.5	Very high	93.8	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-82	-38.6	-177.2	-53.8	-178.5	0	0	0	109.6	L160 T167 K168 V171 Q211 G212 A216 L217 L218	L160-I214 HydrophobicContact CD2-CD1 4.46Å; L160-I214 HydrophobicContact CD2-CG2 3.86Å; T167-I214 HydrophobicContact CG2-CD1 4.13Å; K168-I214 HydrophobicContact CB-CD1 4.47Å; V171-I214 HydrophobicContact CB-CG2 4.46Å; V171-I214 HydrophobicContact CG1-CG2 3.94Å; V171-I214 HydrophobicContact CG2-CG2 4.33Å; Q211-I214 HydrophobicContact CB-CB 3.95Å; Q211-I214 HydrophobicContact CB-CD1 3.99Å; Q211-I214 HydrophobicContact CB-CG1 4.04Å; Q211-I214 HydrophobicContact CG-CD1 4.19Å; Q211-I214 PolarHBondContact O-N 3.01Å; G212-I214 VanDerWaalsContact C-N 3.28Å; G212-I214 PolarHBondContact O-N 2.87Å; I214-A216 VanDerWaalsContact C-N 3.31Å; I214-A216 PolarHBondContact O-N 3.4Å; I214-L217 WeakPolarHBondContact O-CB 3.43Å; I214-L217 PolarHBondContact O-N 3.3Å; I214-L217 VanDerWaalsContact O-N 3.16Å; I214-L218 HydrophobicContact CG2-CD1 4.22Å; I214-L218 HydrophobicContact CG2-CG 4.31Å; I214-L218 VanDerWaalsContact O-CG 3.28Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.08Å
215	A	94.4	Very high	93.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-43.9	171.5	0	0	0	0	0	111.3	L203 A206 Q211 G212 L217 L218 I219	L203-A215 HydrophobicContact CD1-CB 4.21Å; A206-A215 HydrophobicContact CB-CB 4.49Å; Q211-A215 PolarHBondContact O-N 3.41Å; G212-A215 PolarHBondContact O-N 3.47Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 2.84Å; A215-L218 PolarHBondContact O-N 2.99Å; A215-I219 WeakPolarHBondContact O-CD1 3.43Å; A215-I219 WeakPolarHBondContact O-CG1 3.41Å; A215-I219 PolarHBondContact O-N 2.76Å
216	A	94.4	Very high	93.7	Very high	38 Å²	38	38.2 Å²	38.2	31%	0.314	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-39.8	175	0	0	0	0	0	113.1	G212 I214 A220 L264	G212-A216 WeakPolarHBondContact O-CB 3.35Å; G212-A216 PolarHBondContact O-N 2.98Å; I214-A216 VanDerWaalsContact C-N 3.31Å; I214-A216 PolarHBondContact O-N 3.4Å; A216-A220 WeakPolarHBondContact O-CB 3.31Å; A216-A220 PolarHBondContact O-N 3.34Å; A216-L264 HydrophobicContact CB-CD2 3.66Å
217	L	94.4	Very high	93.6	Very high	47 Å²	47	38.3 Å²	38.3	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-43.1	175.3	-154.8	173.9	0	0	0	111.1	R172 L175 D213 I214 A215 A220 A221	R172-L217 HydrophobicContact CG-CD1 3.76Å; L175-L217 HydrophobicContact CD1-CD2 3.42Å; L175-L217 VanDerWaalsContact CD1-CD2 3.42Å; D213-L217 PolarHBondContact O-N 3.31Å; I214-L217 WeakPolarHBondContact O-CB 3.43Å; I214-L217 PolarHBondContact O-N 3.3Å; I214-L217 VanDerWaalsContact O-N 3.16Å; A215-L217 VanDerWaalsContact C-N 3.34Å; A215-L217 PolarHBondContact O-N 2.84Å; L217-A220 PolarHBondContact O-N 3.05Å; L217-A221 WeakPolarHBondContact O-CB 3.49Å; L217-A221 PolarHBondContact O-N 3.01Å
218	L	93.8	Very high	93.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-43.8	177.6	-68.6	170.5	0	0	0	112	L156 L160 L175 I188 L203 A206 I214 A215 A221 G222 A223	L156-L218 HydrophobicContact CD2-CD2 4.06Å; L160-L218 HydrophobicContact CD1-CD1 4.27Å; L175-L218 HydrophobicContact CD1-CD2 4.26Å; L175-L218 HydrophobicContact CD2-CD2 4.47Å; I188-L218 HydrophobicContact CD1-CB 4.19Å; I188-L218 HydrophobicContact CD1-CD2 3.69Å; I188-L218 WeakPolarHBondContact CD1-O 3.41Å; I188-L218 HydrophobicContact CG1-CD2 3.87Å; L203-L218 HydrophobicContact CD1-CB 4.43Å; A206-L218 HydrophobicContact CB-CD1 3.84Å; I214-L218 HydrophobicContact CG2-CD1 4.22Å; I214-L218 HydrophobicContact CG2-CG 4.31Å; I214-L218 VanDerWaalsContact O-CG 3.28Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.08Å; A215-L218 PolarHBondContact O-N 2.99Å; L218-A221 CarbonylContact O-C 3.54Å; L218-A221 PolarHBondContact O-N 3.5Å; L218-G222 PolarHBondContact O-N 3.27Å; L218-A223 HydrophobicContact CB-CB 4.17Å; L218-A223 WeakPolarHBondContact O-CB 3.46Å; L218-A223 PolarHBondContact O-N 3.11Å
219	I	93.6	Very high	93.6	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.062	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-46.1	175.8	-64.7	159.3	0	0	0	110	L203 A215 A221 G222 V225 L264 L265	L203-I219 HydrophobicContact CD1-CD1 4.47Å; L203-I219 HydrophobicContact CD1-CG1 4.13Å; A215-I219 WeakPolarHBondContact O-CD1 3.43Å; A215-I219 WeakPolarHBondContact O-CG1 3.41Å; A215-I219 PolarHBondContact O-N 2.76Å; I219-A221 PolarHBondContact O-N 3.04Å; I219-G222 PolarHBondContact O-N 3.38Å; I219-V225 HydrophobicContact CG1-CG1 4.16Å; I219-V225 HydrophobicContact CG2-CG1 4.3Å; I219-L264 HydrophobicContact CD1-CD2 3.93Å; I219-L264 HydrophobicContact CD1-CG 4.29Å; I219-L265 HydrophobicContact CD1-CD2 3.63Å; I219-L265 HydrophobicContact CD1-CG 4.33Å; I219-L265 HydrophobicContact CG1-CD2 4.33Å
220	A	92.1	Very high	93.4	Very high	92 Å²	92	40.4 Å²	40.4	76%	0.76	24%	0.237	S	C	*	.	H	α-helix	trans	-62.8	-26.6	176.1	0	0	0	0	0	113.7	A216 L217 G222	A216-A220 WeakPolarHBondContact O-CB 3.31Å; A216-A220 PolarHBondContact O-N 3.34Å; L217-A220 PolarHBondContact O-N 3.05Å; A220-G222 VanDerWaalsContact C-N 3.31Å
221	A	91.4	Very high	93.2	Very high	27 Å²	27	34.5 Å²	34.5	22%	0.223	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	6.9	175.1	0	0	0	0	0	114.1	I188 L217 L218 I219	I188-A221 HydrophobicContact CD1-CB 3.75Å; L217-A221 WeakPolarHBondContact O-CB 3.49Å; L217-A221 PolarHBondContact O-N 3.01Å; L218-A221 CarbonylContact O-C 3.54Å; L218-A221 PolarHBondContact O-N 3.5Å; I219-A221 PolarHBondContact O-N 3.04Å
222	G	91.2	Very high	92.9	Very high	42 Å²	42	35 Å²	35	43%	0.433	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	30.6	176.5	0	0	0	0	0	115.2	N189 L218 I219 A220	N189-G222 PolarHBondContact ND2-O 2.86Å; L218-G222 PolarHBondContact O-N 3.27Å; I219-G222 PolarHBondContact O-N 3.38Å; A220-G222 VanDerWaalsContact C-N 3.31Å
223	A	93.7	Very high	92.8	Very high	3 Å²	3	36 Å²	36	3%	0.025	23%	0.225	C	C	.	.			trans	-66.1	138.3	168.4	0	0	0	0	0	111.8	I188 N189 L203 L218 V225	I188-A223 HydrophobicContact CD1-CB 3.85Å; I188-A223 HydrophobicContact CG1-CB 3.97Å; N189-A223 WeakPolarHBondContact OD1-CA 3.41Å; L203-A223 HydrophobicContact CD2-CB 4.45Å; L218-A223 HydrophobicContact CB-CB 4.17Å; L218-A223 WeakPolarHBondContact O-CB 3.46Å; L218-A223 PolarHBondContact O-N 3.11Å; A223-V225 PolarHBondContact O-N 3.19Å
224	D	93.9	Very high	92.6	Very high	65 Å²	65	31.7 Å²	31.7	35%	0.348	20%	0.201	S	C	.	.			trans	-70.6	112	174.8	-176.3	11.5	0	0	0	110.8	N189 N226 A227	N189-D224 PolarHBondContact OD1-N 3.06Å; D224-N226 VanDerWaalsContact C-N 3.27Å; D224-N226 WeakPolarHBondContact OD1-CA 3.5Å; D224-N226 PolarHBondContact OD1-N 3.44Å; D224-A227 HydrophobicContact CB-CB 4.43Å; D224-A227 PolarHBondContact OD2-N 3Å
225	V	93.7	Very high	92.3	Very high	2 Å²	2	34 Å²	34	1%	0.012	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-12.9	177.3	-66.8	0	0	0	0	113.4	L203 I219 A223 P249 L265 Q270 T271	L203-V225 HydrophobicContact CD2-CG1 4.39Å; I219-V225 HydrophobicContact CG1-CG1 4.16Å; I219-V225 HydrophobicContact CG2-CG1 4.3Å; A223-V225 PolarHBondContact O-N 3.19Å; V225-P249 WeakPolarHBondContact O-CG 3.37Å; V225-L265 HydrophobicContact CB-CD2 4.1Å; V225-L265 HydrophobicContact CG1-CD2 3.67Å; V225-Q270 HydrophobicContact CG2-CB 4.28Å; V225-T271 VanDerWaalsContact CG2-OG1 3.26Å; V225-T271 WeakPolarHBondContact CG2-OG1 3.29Å
226	N	93.8	Very high	91.9	Very high	37 Å²	37	34.6 Å²	34.6	20%	0.198	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	11.8	-178.1	-54	-52.3	0	0	0	113.1	D224 H228 Q270 D272	D224-N226 VanDerWaalsContact C-N 3.27Å; D224-N226 WeakPolarHBondContact OD1-CA 3.5Å; D224-N226 PolarHBondContact OD1-N 3.44Å; N226-H228 PolarHBondContact O-CE1 3.23Å; N226-H228 PolarHBondContact O-ND1 3.38Å; N226-H228 PolarHBondContact O-NE2 2.99Å; N226-Q270 PolarHBondContact ND2-O 2.9Å; N226-D272 PolarHBondContact OD1-N 3.49Å
227	A	93.1	Very high	91.3	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	24%	0.241	C	C	.	.			trans	-57.5	143.8	177	0	0	0	0	0	111.8	T201 D224 P249	T201-A227 HydrophobicContact CG2-CB 3.6Å; D224-A227 HydrophobicContact CB-CB 4.43Å; D224-A227 PolarHBondContact OD2-N 3Å; A227-P249 VanDerWaalsContact O-CD 3.24Å; A227-P249 WeakPolarHBondContact O-CD 3.38Å
228	H	94.1	Very high	90.4	Very high	54 Å²	54	46.4 Å²	46.4	25%	0.25	26%	0.256	C	S	.	.			trans	-116.4	109.5	-174.6	-72.5	80.2	0	0	0	112	N226 K230 E247 S275	N226-H228 PolarHBondContact O-CE1 3.23Å; N226-H228 PolarHBondContact O-ND1 3.38Å; N226-H228 PolarHBondContact O-NE2 2.99Å; H228-K230 HydrophobicContact CB-CD 4.42Å; H228-K230 HydrophobicContact CB-CG 4.15Å; H228-K230 PolarHBondContact O-N 3.39Å; H228-E247 CarbonylContact C-O 3.59Å; H228-E247 WeakPolarHBondContact CA-O 3.48Å; H228-S275 PolarHBondContact NE2-OG 3.33Å
229	A	93.6	Very high	89.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.298	C	S	.	.			trans	-81.9	92	174.5	0	0	0	0	0	110.6	E198 F234 F245 E247	E198-A229 CarbonylContact O-C 3.56Å; A229-F234 HydrophobicContact CB-CD2 3.67Å; A229-F234 HydrophobicContact CB-CE2 3.86Å; A229-F234 HydrophobicContact CB-CG 4.15Å; A229-F234 HydrophobicContact CB-CZ 4.48Å; A229-F234 WeakPolarHBondContact O-CB 3.36Å; A229-F245 HydrophobicContact CB-CZ 4.45Å; A229-E247 PolarHBondContact N-O 3.02Å; A229-E247 WeakPolarHBondContact O-CB 3.14Å; A229-E247 WeakPolarHBondContact O-CG 3.49Å
230	K	91.3	Very high	88.7	Confident	112 Å²	112	61.5 Å²	61.5	49%	0.487	33%	0.327	S	S	.	.			trans	-94.3	-9.4	-171.5	-65.1	165.4	-171.7	154	0	114.4	E198 H228	E198-K230 PolarHBondContact O-N 3.33Å; H228-K230 HydrophobicContact CB-CD 4.42Å; H228-K230 HydrophobicContact CB-CG 4.15Å; H228-K230 PolarHBondContact O-N 3.39Å
231	G	89	Confident	88.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.01	31%	0.313	C	S	.	.	S	Bend	trans	-52.8	155.6	-175.7	0	0	0	0	0	114.4	A196 E198 F233 F234 N235	A196-G231 CarbonylContact O-C 3.45Å; A196-G231 VanDerWaalsContact O-C 3.27Å; A196-G231 WeakPolarHBondContact O-CA 3.5Å; E198-G231 PolarHBondContact O-N 2.76Å; G231-F233 PolarHBondContact O-N 3.02Å; G231-F234 PolarHBondContact O-N 3.25Å; G231-N235 PolarHBondContact O-N 3.07Å; G231-N235 VanDerWaalsContact O-N 3.16Å
232	A	88.6	Confident	87.9	Confident	67 Å²	67	61.4 Å²	61.4	55%	0.554	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.4	-172.8	0	0	0	0	0	114.5	E195 A196 N235	E195-A232 PolarHBondContact O-N 3.21Å; E195-A232 VanDerWaalsContact O-N 3.1Å; A196-A232 PolarHBondContact O-N 3.13Å; A196-A232 VanDerWaalsContact O-N 3.15Å; A232-N235 CarbonylContact O-C 3.58Å
233	F	90.1	Very high	87.7	Confident	52 Å²	52	63.6 Å²	63.6	23%	0.228	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-33.7	174.9	179.6	-92.8	0	0	0	113.3	M52 A196 Y197 G231 G242 F243	M52-F233 HydrophobicContact CE-CD1 4.32Å; M52-F233 HydrophobicContact CE-CE1 3.57Å; M52-F233 HydrophobicContact CE-CE2 4.29Å; M52-F233 HydrophobicContact CE-CZ 3.55Å; A196-F233 VanDerWaalsContact O-CB 3.24Å; A196-F233 WeakPolarHBondContact O-CB 3.43Å; A196-F233 PolarHBondContact O-N 3.2Å; Y197-F233 HydrophobicContact CD1-CB 3.9Å; Y197-F233 HydrophobicContact CD1-CD1 4.1Å; Y197-F233 HydrophobicContact CD1-CG 4.08Å; Y197-F233 HydrophobicContact CE1-CB 3.66Å; Y197-F233 AromaticContact CE1-CD1 3.62Å; Y197-F233 HydrophobicContact CE1-CD1 3.62Å; Y197-F233 AromaticContact CE1-CD2 3.94Å; Y197-F233 HydrophobicContact CE1-CD2 3.94Å; Y197-F233 HydrophobicContact CE1-CE1 4.25Å; Y197-F233 AromaticContact CE1-CG 3.45Å; Y197-F233 HydrophobicContact CE1-CG 3.45Å; Y197-F233 VanDerWaalsContact CE1-CG 3.45Å; G231-F233 PolarHBondContact O-N 3.02Å; F233-G242 CarbonylContact O-C 3.54Å; F233-G242 WeakPolarHBondContact O-CA 3.42Å; F233-F243 HydrophobicContact CE1-CB 4.47Å; F233-F243 PolarHBondContact O-N 3.1Å
234	F	89.9	Confident	87.6	Confident	11 Å²	11	64.5 Å²	64.5	5%	0.048	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-21.8	179.5	-55.5	-59.3	0	0	0	112.4	Y197 Q200 A229 G231 P236 Y244 F245	Y197-F234 AromaticContact CD1-CE2 3.95Å; Y197-F234 HydrophobicContact CD1-CE2 3.95Å; Y197-F234 AromaticContact CD1-CZ 3.85Å; Y197-F234 HydrophobicContact CD1-CZ 3.85Å; Q200-F234 HydrophobicContact CB-CE2 4Å; Q200-F234 HydrophobicContact CB-CZ 4.22Å; Q200-F234 HydrophobicContact CG-CE2 4.48Å; Q200-F234 HydrophobicContact CG-CZ 4.19Å; A229-F234 HydrophobicContact CB-CD2 3.67Å; A229-F234 HydrophobicContact CB-CE2 3.86Å; A229-F234 HydrophobicContact CB-CG 4.15Å; A229-F234 HydrophobicContact CB-CZ 4.48Å; A229-F234 WeakPolarHBondContact O-CB 3.36Å; G231-F234 PolarHBondContact O-N 3.25Å; F234-P236 VanDerWaalsContact O-CD 3.31Å; F234-P236 WeakPolarHBondContact O-CD 3.45Å; F234-Y244 WeakPolarHBondContact O-CA 3.33Å; F234-Y244 WeakPolarHBondContact O-CD2 3.45Å; F234-F245 HydrophobicContact CD1-CD1 4.37Å; F234-F245 AromaticContact CD1-CE1 3.4Å; F234-F245 HydrophobicContact CD1-CE1 3.4Å; F234-F245 AromaticContact CD1-CZ 3.96Å; F234-F245 HydrophobicContact CD1-CZ 3.96Å; F234-F245 AromaticContact CE1-CE1 3.84Å; F234-F245 HydrophobicContact CE1-CE1 3.84Å; F234-F245 HydrophobicContact CE1-CZ 4.3Å; F234-F245 HydrophobicContact CG-CE1 4.25Å
235	N	88.6	Confident	87.4	Confident	49 Å²	49	61.7 Å²	61.7	26%	0.262	30%	0.295	S	S	.	.	S	Bend	trans	-119.2	55.6	177.8	-163.3	-2.9	0	0	0	112.4	G231 A232 E247 S278 R279	G231-N235 PolarHBondContact O-N 3.07Å; G231-N235 VanDerWaalsContact O-N 3.16Å; A232-N235 CarbonylContact O-C 3.58Å; N235-E247 PolarHBondContact ND2-OE1 3Å; N235-S278 PolarHBondContact ND2-OG 2.98Å; N235-R279 PolarHBondContact OD1-NE 2.98Å; N235-R279 PolarHBondContact OD1-NH2 3.26Å
236	P	86.3	Confident	87.2	Confident	13 Å²	13	61.8 Å²	61.8	8%	0.084	30%	0.297	C	S	.	.			trans	-70.4	155.7	-174.2	32.4	-38.4	0	0	0	112.1	F234 E241 R279	F234-P236 VanDerWaalsContact O-CD 3.31Å; F234-P236 WeakPolarHBondContact O-CD 3.45Å; P236-E241 HydrophobicContact CB-CB 4.07Å; P236-R279 PolarHBondContact O-NH2 2.92Å
237	K	80.9	Confident	87.1	Confident	186 Å²	186	60 Å²	60	81%	0.809	29%	0.288	S	S	*	.	S	Bend	trans	-79.9	-36.9	175.4	-67.7	179.8	-178	172.5	0	111.3	E241	K237-E241 PolarHBondContact N-OE2 2.77Å
238	Y	76.8	Confident	87.1	Confident	147 Å²	147	60.8 Å²	60.8	58%	0.576	29%	0.292	S	S	*	.	S	Bend	trans	-121.3	148.5	176.2	-53.2	-74	0	0	0	111.6	H240 E241	Y238-H240 PolarHBondContact O-N 3.05Å; Y238-E241 PolarHBondContact N-OE2 3.31Å; Y238-E241 PolarHBondContact O-N 2.91Å
239	Q	73.9	Confident	87.2	Confident	186 Å²	186	58.2 Å²	58.2	87%	0.869	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.5	-173.9	-71	178.1	-20.2	0	0	115.5
240	H	76.6	Confident	87.3	Confident	144 Å²	144	58.6 Å²	58.6	67%	0.667	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-4.8	-176.4	60.7	-95.9	0	0	0	114.1	Y238	Y238-H240 PolarHBondContact O-N 3.05Å
241	E	82.1	Confident	87.4	Confident	100 Å²	100	53.3 Å²	53.3	47%	0.467	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-22.5	-178.6	-63.1	175.2	139.6	0	0	113.1	P236 K237 Y238	P236-E241 HydrophobicContact CB-CB 4.07Å; K237-E241 PolarHBondContact N-OE2 2.77Å; Y238-E241 PolarHBondContact N-OE2 3.31Å; Y238-E241 PolarHBondContact O-N 2.91Å
242	G	84.9	Confident	87.6	Confident	16 Å²	16	53.6 Å²	53.6	17%	0.165	26%	0.261	C	S	.	.	S	Bend	trans	-174	-169.7	-174	0	0	0	0	0	111.6	F233	F233-G242 CarbonylContact O-C 3.54Å; F233-G242 WeakPolarHBondContact O-CA 3.42Å
243	F	87.3	Confident	87.9	Confident	89 Å²	89	50.4 Å²	50.4	39%	0.39	23%	0.234	S	C	.	.			trans	-127.1	111.4	-175.4	-179.9	-112.7	0	0	0	111.9	F233 F245	F233-F243 HydrophobicContact CE1-CB 4.47Å; F233-F243 PolarHBondContact O-N 3.1Å; F243-F245 HydrophobicContact CD1-CB 4.39Å; F243-F245 AromaticContact CD1-CD1 3.74Å; F243-F245 HydrophobicContact CD1-CD1 3.74Å; F243-F245 HydrophobicContact CE1-CB 3.82Å; F243-F245 AromaticContact CE1-CD1 3.89Å; F243-F245 HydrophobicContact CE1-CD1 3.89Å; F243-F245 HydrophobicContact CE1-CG 4.3Å; F243-F245 HydrophobicContact CZ-CB 4.36Å
244	Y	91.6	Very high	88	Confident	22 Å²	22	48 Å²	48	9%	0.086	22%	0.223	C	C	.	.			trans	-89.1	123	176.9	175	-98.5	0	0	0	111.5	F234 D277 N281 T289	F234-Y244 WeakPolarHBondContact O-CA 3.33Å; F234-Y244 WeakPolarHBondContact O-CD2 3.45Å; Y244-D277 WeakPolarHBondContact CE2-OD2 3.3Å; Y244-D277 VanDerWaalsContact CZ-OD2 3.24Å; Y244-D277 PolarHBondContact OH-OD2 3.12Å; Y244-N281 WeakPolarHBondContact OH-CB 3.06Å; Y244-N281 PolarHBondContact OH-ND2 2.96Å; Y244-T289 HydrophobicContact CD1-CG2 4.25Å; Y244-T289 WeakPolarHBondContact CD1-OG1 3.35Å; Y244-T289 HydrophobicContact CE1-CG2 3.81Å; Y244-T289 WeakPolarHBondContact CE1-OG1 3.49Å
245	F	90.3	Very high	88.1	Confident	5 Å²	5	47.8 Å²	47.8	2%	0.022	22%	0.224	C	C	.	.	S	Bend	trans	-130.5	9.2	177	60.3	-99.3	0	0	0	114	A229 F234 F243 A251 L252 C255 A286	A229-F245 HydrophobicContact CB-CZ 4.45Å; F234-F245 HydrophobicContact CD1-CD1 4.37Å; F234-F245 AromaticContact CD1-CE1 3.4Å; F234-F245 HydrophobicContact CD1-CE1 3.4Å; F234-F245 AromaticContact CD1-CZ 3.96Å; F234-F245 HydrophobicContact CD1-CZ 3.96Å; F234-F245 AromaticContact CE1-CE1 3.84Å; F234-F245 HydrophobicContact CE1-CE1 3.84Å; F234-F245 HydrophobicContact CE1-CZ 4.3Å; F234-F245 HydrophobicContact CG-CE1 4.25Å; F243-F245 HydrophobicContact CD1-CB 4.39Å; F243-F245 AromaticContact CD1-CD1 3.74Å; F243-F245 HydrophobicContact CD1-CD1 3.74Å; F243-F245 HydrophobicContact CE1-CB 3.82Å; F243-F245 AromaticContact CE1-CD1 3.89Å; F243-F245 HydrophobicContact CE1-CD1 3.89Å; F243-F245 HydrophobicContact CE1-CG 4.3Å; F243-F245 HydrophobicContact CZ-CB 4.36Å; F245-A251 WeakPolarHBondContact O-CB 3.36Å; F245-L252 HydrophobicContact CB-CD1 4.49Å; F245-L252 HydrophobicContact CD1-CD1 3.84Å; F245-L252 HydrophobicContact CD2-CB 3.66Å; F245-L252 HydrophobicContact CD2-CD1 4.14Å; F245-L252 HydrophobicContact CD2-CG 4.43Å; F245-L252 HydrophobicContact CE1-CD1 3.96Å; F245-L252 HydrophobicContact CE2-CB 3.76Å; F245-L252 HydrophobicContact CE2-CD1 4.3Å; F245-L252 HydrophobicContact CE2-CD2 4.45Å; F245-L252 HydrophobicContact CE2-CG 4.39Å; F245-L252 HydrophobicContact CG-CB 4.25Å; F245-L252 HydrophobicContact CG-CD1 3.91Å; F245-L252 HydrophobicContact CZ-CB 4.38Å; F245-L252 HydrophobicContact CZ-CD1 4.22Å; F245-L252 HydrophobicContact CZ-CD2 4.32Å; F245-C255 HydrophobicContact CB-CB 4.37Å; F245-A286 WeakPolarHBondContact O-CB 3.11Å
246	G	88.7	Confident	88.2	Confident	5 Å²	5	46.1 Å²	46.1	5%	0.052	22%	0.215	C	C	.	.			trans	83	30.1	-177	0	0	0	0	0	115	T248	G246-T248 PolarHBondContact O-N 3.46Å; G246-T248 PolarHBondContact O-OG1 2.91Å; G246-T248 VanDerWaalsContact O-OG1 3.13Å
247	E	92.6	Very high	88.4	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	59.6	-7.7	165.2	-53.8	-179.2	171.9	0	0	117.6	H228 A229 N235 D277 S278	H228-E247 CarbonylContact C-O 3.59Å; H228-E247 WeakPolarHBondContact CA-O 3.48Å; A229-E247 PolarHBondContact N-O 3.02Å; A229-E247 WeakPolarHBondContact O-CB 3.14Å; A229-E247 WeakPolarHBondContact O-CG 3.49Å; N235-E247 PolarHBondContact ND2-OE1 3Å; E247-D277 HydrophobicContact CB-CB 4.05Å; E247-D277 HydrophobicContact CG-CB 3.93Å; E247-S278 VanDerWaalsContact OE1-CB 3.31Å; E247-S278 WeakPolarHBondContact OE1-CB 3.44Å; E247-S278 PolarHBondContact OE1-OG 3.43Å; E247-S278 WeakPolarHBondContact OE2-CB 3.38Å; E247-S278 PolarHBondContact OE2-N 3.21Å
248	T	93.4	Very high	89	Confident	17 Å²	17	40.7 Å²	40.7	10%	0.104	19%	0.194	C	C	.	.	S	Bend	trans	-113.2	148.6	-171.1	52.1	0	0	0	0	113.5	G246 L250 A251 L252	G246-T248 PolarHBondContact O-N 3.46Å; G246-T248 PolarHBondContact O-OG1 2.91Å; G246-T248 VanDerWaalsContact O-OG1 3.13Å; T248-L250 VanDerWaalsContact C-N 3.32Å; T248-L250 PolarHBondContact O-N 3.4Å; T248-A251 PolarHBondContact O-N 3.37Å; T248-A251 VanDerWaalsContact OG1-CB 3.25Å; T248-A251 WeakPolarHBondContact OG1-CB 3.13Å; T248-L252 PolarHBondContact O-N 2.96Å
249	P	94.7	Very high	89.8	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.5	-40.3	178.6	-24.7	30.6	0	0	0	113.6	L203 N204 I207 V225 A227 L252 A253	L203-P249 HydrophobicContact CD2-CB 4.11Å; L203-P249 HydrophobicContact CD2-CG 4.18Å; L203-P249 HydrophobicContact CG-CB 4.44Å; N204-P249 WeakPolarHBondContact OD1-CA 3.47Å; N204-P249 WeakPolarHBondContact OD1-CG 3.5Å; I207-P249 HydrophobicContact CD1-CB 3.83Å; V225-P249 WeakPolarHBondContact O-CG 3.37Å; A227-P249 VanDerWaalsContact O-CD 3.24Å; A227-P249 WeakPolarHBondContact O-CD 3.38Å; P249-L252 PolarHBondContact O-N 3.2Å; P249-A253 PolarHBondContact O-N 2.8Å
250	L	95.1	Very high	90.8	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-64.5	-43.8	178.9	-175.9	70.4	0	0	0	111.7	T248 A253 A254 V262 L265 M266 T271 I273 I283	T248-L250 VanDerWaalsContact C-N 3.32Å; T248-L250 PolarHBondContact O-N 3.4Å; L250-A253 PolarHBondContact O-N 2.83Å; L250-A254 WeakPolarHBondContact O-CB 3.44Å; L250-A254 PolarHBondContact O-N 3.35Å; L250-A254 VanDerWaalsContact O-N 3.08Å; L250-V262 HydrophobicContact CD1-CG1 4.32Å; L250-L265 HydrophobicContact CB-CD1 4.34Å; L250-L265 HydrophobicContact CD1-CB 3.61Å; L250-L265 HydrophobicContact CD1-CD1 4.05Å; L250-L265 HydrophobicContact CD1-CG 4.5Å; L250-M266 HydrophobicContact CD1-CG 3.96Å; L250-T271 HydrophobicContact CD2-CG2 4.08Å; L250-I273 HydrophobicContact CD2-CG1 4.27Å; L250-I283 HydrophobicContact CB-CD1 4.38Å; L250-I283 HydrophobicContact CD2-CD1 3.82Å; L250-I283 HydrophobicContact CG-CD1 3.62Å
251	A	94.2	Very high	91.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.3	-35.6	177.6	0	0	0	0	0	111.8	F245 T248 A254 C255 I283 A286	F245-A251 WeakPolarHBondContact O-CB 3.36Å; T248-A251 PolarHBondContact O-N 3.37Å; T248-A251 VanDerWaalsContact OG1-CB 3.25Å; T248-A251 WeakPolarHBondContact OG1-CB 3.13Å; A251-A254 PolarHBondContact O-N 2.86Å; A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.17Å; A251-C255 PolarHBondContact O-SG 3Å; A251-I283 HydrophobicContact CB-CB 4.46Å; A251-I283 HydrophobicContact CB-CD1 4.25Å; A251-I283 HydrophobicContact CB-CG1 3.99Å; A251-A286 HydrophobicContact CB-CB 4.39Å
252	L	94.1	Very high	92.2	Very high	8 Å²	8	21.1 Å²	21.1	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-59.3	-48.3	172.1	-178.8	60.3	0	0	0	112	N204 I207 F245 T248 P249 A254 C255 T256	N204-L252 HydrophobicContact CB-CD2 4.09Å; N204-L252 WeakPolarHBondContact O-CD2 3.41Å; I207-L252 HydrophobicContact CB-CD2 4.24Å; I207-L252 HydrophobicContact CG2-CB 4.47Å; I207-L252 HydrophobicContact CG2-CD2 4.11Å; I207-L252 HydrophobicContact CG2-CG 3.95Å; F245-L252 HydrophobicContact CB-CD1 4.49Å; F245-L252 HydrophobicContact CD1-CD1 3.84Å; F245-L252 HydrophobicContact CD2-CB 3.66Å; F245-L252 HydrophobicContact CD2-CD1 4.14Å; F245-L252 HydrophobicContact CD2-CG 4.43Å; F245-L252 HydrophobicContact CE1-CD1 3.96Å; F245-L252 HydrophobicContact CE2-CB 3.76Å; F245-L252 HydrophobicContact CE2-CD1 4.3Å; F245-L252 HydrophobicContact CE2-CD2 4.45Å; F245-L252 HydrophobicContact CE2-CG 4.39Å; F245-L252 HydrophobicContact CG-CB 4.25Å; F245-L252 HydrophobicContact CG-CD1 3.91Å; F245-L252 HydrophobicContact CZ-CB 4.38Å; F245-L252 HydrophobicContact CZ-CD1 4.22Å; F245-L252 HydrophobicContact CZ-CD2 4.32Å; T248-L252 PolarHBondContact O-N 2.96Å; P249-L252 PolarHBondContact O-N 3.2Å; L252-A254 VanDerWaalsContact C-N 3.3Å; L252-A254 PolarHBondContact O-N 3.03Å; L252-C255 PolarHBondContact O-N 3.24Å; L252-T256 HydrophobicContact CD1-CG2 4.02Å; L252-T256 WeakPolarHBondContact O-CB 3.36Å; L252-T256 WeakPolarHBondContact O-CG2 3.44Å; L252-T256 PolarHBondContact O-N 3.34Å; L252-T256 PolarHBondContact O-OG1 3.18Å
253	A	94.3	Very high	92.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.3	-37.5	177.5	0	0	0	0	0	112.1	I207 P249 L250 T256 Q258 I261 V262 L265	I207-A253 HydrophobicContact CG2-CB 3.81Å; P249-A253 PolarHBondContact O-N 2.8Å; L250-A253 PolarHBondContact O-N 2.83Å; A253-T256 PolarHBondContact O-OG1 3.14Å; A253-Q258 PolarHBondContact O-N 3.22Å; A253-Q258 VanDerWaalsContact O-N 3.09Å; A253-I261 HydrophobicContact CB-CB 4.21Å; A253-I261 HydrophobicContact CB-CG2 3.85Å; A253-V262 HydrophobicContact CB-CG2 3.57Å; A253-L265 HydrophobicContact CB-CD1 4.43Å
254	A	92.6	Very high	92.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-70	-44.2	176.9	0	0	0	0	0	112.9	L250 A251 L252 T256 N257 V262 I283 L287 M304 I308	L250-A254 WeakPolarHBondContact O-CB 3.44Å; L250-A254 PolarHBondContact O-N 3.35Å; L250-A254 VanDerWaalsContact O-N 3.08Å; A251-A254 PolarHBondContact O-N 2.86Å; L252-A254 VanDerWaalsContact C-N 3.3Å; L252-A254 PolarHBondContact O-N 3.03Å; A254-T256 VanDerWaalsContact C-N 3.31Å; A254-T256 PolarHBondContact O-N 2.82Å; A254-N257 PolarHBondContact O-N 2.82Å; A254-V262 HydrophobicContact CB-CG2 4.03Å; A254-I283 HydrophobicContact CB-CD1 4.16Å; A254-L287 HydrophobicContact CB-CD2 4.09Å; A254-M304 HydrophobicContact CB-CE 4.28Å; A254-I308 HydrophobicContact CB-CD1 3.9Å
255	C	91.1	Very high	93.1	Very high	8 Å²	8	21.8 Å²	21.8	5%	0.054	11%	0.113	C	C	.	.	H	α-helix	trans	-69.1	-27.8	179.2	-64.5	0	0	0	0	112.7	F245 A251 L252 N257 V290	F245-C255 HydrophobicContact CB-CB 4.37Å; A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.17Å; A251-C255 PolarHBondContact O-SG 3Å; L252-C255 PolarHBondContact O-N 3.24Å; C255-N257 VanDerWaalsContact C-N 3.34Å; C255-V290 HydrophobicContact CB-CG1 4.29Å; C255-V290 HydrophobicContact CB-CG2 4.12Å
256	T	90	Very high	93.1	Very high	13 Å²	13	22.5 Å²	22.5	8%	0.08	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	4.8	179.2	54.1	0	0	0	0	114.6	R210 L252 A253 A254 Q258	R210-T256 PolarHBondContact NH2-O 3.43Å; R210-T256 VanDerWaalsContact NH2-O 3.14Å; L252-T256 HydrophobicContact CD1-CG2 4.02Å; L252-T256 WeakPolarHBondContact O-CB 3.36Å; L252-T256 WeakPolarHBondContact O-CG2 3.44Å; L252-T256 PolarHBondContact O-N 3.34Å; L252-T256 PolarHBondContact O-OG1 3.18Å; A253-T256 PolarHBondContact O-OG1 3.14Å; A254-T256 VanDerWaalsContact C-N 3.31Å; A254-T256 PolarHBondContact O-N 2.82Å; T256-Q258 PolarHBondContact OG1-NE2 3.22Å
257	N	92.1	Very high	93.3	Very high	73 Å²	73	27.8 Å²	27.8	39%	0.39	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	56.4	-179.1	-170.8	24	0	0	0	113.4	A254 C255 P259 F300	A254-N257 PolarHBondContact O-N 2.82Å; C255-N257 VanDerWaalsContact C-N 3.34Å; N257-P259 WeakPolarHBondContact O-CD 3.42Å; N257-F300 HydrophobicContact CB-CB 4.31Å; N257-F300 HydrophobicContact CB-CD2 3.6Å; N257-F300 HydrophobicContact CB-CE2 4.06Å; N257-F300 HydrophobicContact CB-CG 3.96Å
258	Q	93.5	Very high	93.2	Very high	13 Å²	13	30.5 Å²	30.5	6%	0.061	15%	0.153	C	C	.	.			trans	-123	74.6	178.8	-62.7	-173.9	80.1	0	0	111.2	I207 R210 A253 T256 E260 I261 V262	I207-Q258 PolarHBondContact O-NE2 3.25Å; R210-Q258 VanDerWaalsContact CA-OE1 3.26Å; A253-Q258 PolarHBondContact O-N 3.22Å; A253-Q258 VanDerWaalsContact O-N 3.09Å; T256-Q258 PolarHBondContact OG1-NE2 3.22Å; Q258-E260 VanDerWaalsContact C-N 3.26Å; Q258-E260 PolarHBondContact O-N 2.94Å; Q258-I261 HydrophobicContact CB-CB 4.37Å; Q258-I261 HydrophobicContact CB-CD1 4.35Å; Q258-I261 HydrophobicContact CB-CG1 4.4Å; Q258-I261 PolarHBondContact O-N 3.28Å; Q258-I261 VanDerWaalsContact OE1-CD1 3.3Å; Q258-V262 PolarHBondContact O-N 3.02Å; Q258-V262 VanDerWaalsContact O-N 3.14Å
259	P	93.7	Very high	93	Very high	28 Å²	28	39.3 Å²	39.3	18%	0.182	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-29.9	-174.1	23.8	-32.2	0	0	0	113.7	N257 V262 Q263 M304 M307	N257-P259 WeakPolarHBondContact O-CD 3.42Å; P259-V262 PolarHBondContact O-N 2.79Å; P259-Q263 VanDerWaalsContact O-CG 3.31Å; P259-Q263 WeakPolarHBondContact O-CG 3.33Å; P259-Q263 PolarHBondContact O-N 2.65Å; P259-M304 HydrophobicContact CB-CE 4.43Å; P259-M304 HydrophobicContact CB-SD 3.97Å; P259-M307 HydrophobicContact CB-CE 3.64Å; P259-M307 HydrophobicContact CB-SD 4Å
260	E	94	Very high	92.7	Very high	133 Å²	133	45.4 Å²	45.4	62%	0.621	22%	0.221	S	C	*	.	H	α-helix	trans	-65.9	-43.8	179.2	-59.3	74.5	-163.8	0	0	111.4	Q258 Q263 L264	Q258-E260 VanDerWaalsContact C-N 3.26Å; Q258-E260 PolarHBondContact O-N 2.94Å; E260-Q263 PolarHBondContact O-N 3.33Å; E260-L264 WeakPolarHBondContact O-CB 3.46Å; E260-L264 PolarHBondContact O-N 3.46Å
261	I	94.1	Very high	92.6	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-69.1	-38.1	176.1	-59.2	-176	0	0	0	110.4	I207 A253 Q258 L264 L265	I207-I261 HydrophobicContact CD1-CG2 4.3Å; I207-I261 HydrophobicContact CG1-CD1 4.47Å; I207-I261 HydrophobicContact CG1-CG2 4.15Å; A253-I261 HydrophobicContact CB-CB 4.21Å; A253-I261 HydrophobicContact CB-CG2 3.85Å; Q258-I261 HydrophobicContact CB-CB 4.37Å; Q258-I261 HydrophobicContact CB-CD1 4.35Å; Q258-I261 HydrophobicContact CB-CG1 4.4Å; Q258-I261 PolarHBondContact O-N 3.28Å; Q258-I261 VanDerWaalsContact OE1-CD1 3.3Å; I261-L264 PolarHBondContact O-N 2.97Å; I261-L265 HydrophobicContact CG2-CD1 3.93Å; I261-L265 HydrophobicContact CG2-CG 4.32Å; I261-L265 WeakPolarHBondContact O-CB 3.27Å; I261-L265 WeakPolarHBondContact O-CG 3.47Å; I261-L265 PolarHBondContact O-N 3.25Å
262	V	94.8	Very high	92.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-39.1	176.4	168.6	0	0	0	0	111.6	L250 A253 A254 Q258 P259 M266 M304 I308	L250-V262 HydrophobicContact CD1-CG1 4.32Å; A253-V262 HydrophobicContact CB-CG2 3.57Å; A254-V262 HydrophobicContact CB-CG2 4.03Å; Q258-V262 PolarHBondContact O-N 3.02Å; Q258-V262 VanDerWaalsContact O-N 3.14Å; P259-V262 PolarHBondContact O-N 2.79Å; V262-M266 HydrophobicContact CG1-CE 3.63Å; V262-M266 HydrophobicContact CG1-SD 4.13Å; V262-M266 WeakPolarHBondContact O-CB 3.35Å; V262-M266 VanDerWaalsContact O-CG 3.27Å; V262-M266 WeakPolarHBondContact O-CG 3.5Å; V262-M266 PolarHBondContact O-N 2.92Å; V262-M304 HydrophobicContact CB-CE 3.78Å; V262-M304 HydrophobicContact CG1-CE 3.68Å; V262-M304 HydrophobicContact CG2-CE 3.71Å; V262-I308 HydrophobicContact CG1-CG1 4.11Å
263	Q	93.7	Very high	92.2	Very high	75 Å²	75	50.5 Å²	50.5	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-47.7	172.4	-73.7	171.3	21.7	0	0	111.7	P259 E260 L265 M266 E267 M307	P259-Q263 VanDerWaalsContact O-CG 3.31Å; P259-Q263 WeakPolarHBondContact O-CG 3.33Å; P259-Q263 PolarHBondContact O-N 2.65Å; E260-Q263 PolarHBondContact O-N 3.33Å; Q263-L265 VanDerWaalsContact C-N 3.35Å; Q263-L265 PolarHBondContact O-N 2.91Å; Q263-M266 PolarHBondContact O-N 2.83Å; Q263-E267 WeakPolarHBondContact O-CB 3.48Å; Q263-E267 VanDerWaalsContact O-CG 3.31Å; Q263-E267 WeakPolarHBondContact O-CG 3.37Å; Q263-E267 PolarHBondContact O-N 2.87Å; Q263-M307 HydrophobicContact CG-SD 3.87Å; Q263-M307 PolarHBondContact NE2-SD 2.96Å
264	L	93.4	Very high	92	Very high	65 Å²	65	53.6 Å²	53.6	34%	0.34	27%	0.268	S	S	.	.	H	α-helix	trans	-57.5	-44.5	177.9	-179.5	68.4	0	0	0	112.6	A216 I219 E260 I261 E267 H268	A216-L264 HydrophobicContact CB-CD2 3.66Å; I219-L264 HydrophobicContact CD1-CD2 3.93Å; I219-L264 HydrophobicContact CD1-CG 4.29Å; E260-L264 WeakPolarHBondContact O-CB 3.46Å; E260-L264 PolarHBondContact O-N 3.46Å; I261-L264 PolarHBondContact O-N 2.97Å; L264-E267 PolarHBondContact O-N 3.44Å; L264-H268 PolarHBondContact O-N 3.04Å
265	L	93.9	Very high	92	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-42.9	176.6	-71.9	170	0	0	0	111.8	I207 I219 V225 L250 A253 I261 Q263 E267 H268 T271	I207-L265 HydrophobicContact CD1-CD1 4.37Å; I219-L265 HydrophobicContact CD1-CD2 3.63Å; I219-L265 HydrophobicContact CD1-CG 4.33Å; I219-L265 HydrophobicContact CG1-CD2 4.33Å; V225-L265 HydrophobicContact CB-CD2 4.1Å; V225-L265 HydrophobicContact CG1-CD2 3.67Å; L250-L265 HydrophobicContact CB-CD1 4.34Å; L250-L265 HydrophobicContact CD1-CB 3.61Å; L250-L265 HydrophobicContact CD1-CD1 4.05Å; L250-L265 HydrophobicContact CD1-CG 4.5Å; A253-L265 HydrophobicContact CB-CD1 4.43Å; I261-L265 HydrophobicContact CG2-CD1 3.93Å; I261-L265 HydrophobicContact CG2-CG 4.32Å; I261-L265 WeakPolarHBondContact O-CB 3.27Å; I261-L265 WeakPolarHBondContact O-CG 3.47Å; I261-L265 PolarHBondContact O-N 3.25Å; Q263-L265 VanDerWaalsContact C-N 3.35Å; Q263-L265 PolarHBondContact O-N 2.91Å; L265-E267 PolarHBondContact O-N 2.9Å; L265-H268 WeakPolarHBondContact O-CB 3.36Å; L265-H268 PolarHBondContact O-N 3.19Å; L265-H268 VanDerWaalsContact O-N 3.17Å; L265-T271 VanDerWaalsContact O-CB 3.28Å; L265-T271 WeakPolarHBondContact O-CB 3.33Å; L265-T271 PolarHBondContact O-OG1 3.37Å
266	M	91.8	Very high	92.1	Very high	21 Å²	21	59.7 Å²	59.7	10%	0.103	29%	0.293	C	S	.	.	H	α-helix	trans	-71.5	-13.5	177.3	-68.7	-174.1	-53.7	0	0	114.3	L250 V262 Q263 I273 M307 I308 R311	L250-M266 HydrophobicContact CD1-CG 3.96Å; V262-M266 HydrophobicContact CG1-CE 3.63Å; V262-M266 HydrophobicContact CG1-SD 4.13Å; V262-M266 WeakPolarHBondContact O-CB 3.35Å; V262-M266 VanDerWaalsContact O-CG 3.27Å; V262-M266 WeakPolarHBondContact O-CG 3.5Å; V262-M266 PolarHBondContact O-N 2.92Å; Q263-M266 PolarHBondContact O-N 2.83Å; M266-I273 HydrophobicContact CG-CD1 4.21Å; M266-M307 HydrophobicContact CE-CG 4.23Å; M266-I308 HydrophobicContact SD-CB 4.42Å; M266-I308 HydrophobicContact SD-CG1 4.05Å; M266-R311 HydrophobicContact CB-CG 4.03Å; M266-R311 HydrophobicContact CE-CB 3.91Å; M266-R311 HydrophobicContact CE-CG 3.92Å; M266-R311 HydrophobicContact SD-CB 3.95Å; M266-R311 HydrophobicContact SD-CG 3.94Å
267	E	91.4	Very high	92.3	Very high	116 Å²	116	59.6 Å²	59.6	54%	0.542	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.8	173.4	-75	171.2	-173.2	0	0	112.5	Q263 L264 L265 R311	Q263-E267 WeakPolarHBondContact O-CB 3.48Å; Q263-E267 VanDerWaalsContact O-CG 3.31Å; Q263-E267 WeakPolarHBondContact O-CG 3.37Å; Q263-E267 PolarHBondContact O-N 2.87Å; L264-E267 PolarHBondContact O-N 3.44Å; L265-E267 PolarHBondContact O-N 2.9Å; E267-R311 IonicContact OE1-CZ 2.78Å; E267-R311 VanDerWaalsContact OE1-CZ 3.23Å; E267-R311 IonicContact OE1-NH1 3.53Å; E267-R311 PolarHBondContact OE1-NH1 3.41Å; E267-R311 IonicContact OE1-NH2 3.23Å; E267-R311 PolarHBondContact OE1-NH2 2.7Å
268	H	92	Very high	92.2	Very high	56 Å²	56	58.7 Å²	58.7	26%	0.259	29%	0.291	S	S	.	.	S	Bend	trans	-87.3	123.3	176.8	-169.1	-113.4	0	0	0	111.4	L264 L265 Q270 T271	L264-H268 PolarHBondContact O-N 3.04Å; L265-H268 WeakPolarHBondContact O-CB 3.36Å; L265-H268 PolarHBondContact O-N 3.19Å; L265-H268 VanDerWaalsContact O-N 3.17Å; H268-Q270 PolarHBondContact CE1-OE1 2.87Å; H268-Q270 PolarHBondContact O-N 3.12Å; H268-T271 PolarHBondContact O-N 2.87Å; H268-T271 VanDerWaalsContact O-N 3.13Å
269	E	87.8	Confident	92.1	Very high	202 Å²	202	62 Å²	62	94%	0.944	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.9	-172	-62.4	-169.8	164.6	0	0	114.6
270	Q	89.4	Confident	92.1	Very high	128 Å²	128	60.9 Å²	60.9	60%	0.598	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.4	-179.6	-57.6	-177.1	-18.1	0	0	113.9	V225 N226 H268 D272	V225-Q270 HydrophobicContact CG2-CB 4.28Å; N226-Q270 PolarHBondContact ND2-O 2.9Å; H268-Q270 PolarHBondContact CE1-OE1 2.87Å; H268-Q270 PolarHBondContact O-N 3.12Å; Q270-D272 PolarHBondContact O-N 3.4Å
271	T	91.8	Very high	92.1	Very high	20 Å²	20	55.1 Å²	55.1	12%	0.123	27%	0.27	C	S	.	.			trans	-81.4	118.4	-174.1	-67.6	0	0	0	0	112.2	V225 L250 L265 H268 I273	V225-T271 VanDerWaalsContact CG2-OG1 3.26Å; V225-T271 WeakPolarHBondContact CG2-OG1 3.29Å; L250-T271 HydrophobicContact CD2-CG2 4.08Å; L265-T271 VanDerWaalsContact O-CB 3.28Å; L265-T271 WeakPolarHBondContact O-CB 3.33Å; L265-T271 PolarHBondContact O-OG1 3.37Å; H268-T271 PolarHBondContact O-N 2.87Å; H268-T271 VanDerWaalsContact O-N 3.13Å; T271-I273 PolarHBondContact O-N 2.95Å
272	D	91.1	Very high	92.1	Very high	71 Å²	71	55 Å²	55	38%	0.38	27%	0.27	S	S	.	.			trans	-89.9	101	175.3	-179.4	14.8	0	0	0	111.7	N226 Q270 T274 S275	N226-D272 PolarHBondContact OD1-N 3.49Å; Q270-D272 PolarHBondContact O-N 3.4Å; D272-T274 PolarHBondContact O-N 2.86Å; D272-T274 WeakPolarHBondContact OD1-CA 3.03Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 PolarHBondContact OD1-N 2.94Å; D272-T274 PolarHBondContact OD1-OG1 3.08Å; D272-S275 VanDerWaalsContact CG-N 3.33Å; D272-S275 VanDerWaalsContact O-CB 3.31Å; D272-S275 WeakPolarHBondContact O-CB 3.27Å; D272-S275 PolarHBondContact O-N 3.3Å; D272-S275 PolarHBondContact OD1-N 3.45Å; D272-S275 WeakPolarHBondContact OD2-CA 3.49Å; D272-S275 PolarHBondContact OD2-N 3.34Å
273	I	90.1	Very high	92.1	Very high	33 Å²	33	55.4 Å²	55.4	17%	0.169	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.1	175.3	-50.9	176.1	0	0	0	111.5	L250 M266 T271 I283 I308 L317	L250-I273 HydrophobicContact CD2-CG1 4.27Å; M266-I273 HydrophobicContact CG-CD1 4.21Å; T271-I273 PolarHBondContact O-N 2.95Å; I273-I283 HydrophobicContact CG2-CG2 4.43Å; I273-I308 HydrophobicContact CG2-CG2 4.28Å; I273-L317 HydrophobicContact CG2-CD1 4.34Å; I273-L317 HydrophobicContact CG2-CD2 4.08Å; I273-L317 WeakPolarHBondContact O-CD1 3.47Å
274	T	90.6	Very high	92.1	Very high	65 Å²	65	51.8 Å²	51.8	40%	0.399	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-3.3	-178.5	69.8	0	0	0	0	113.9	D272	D272-T274 PolarHBondContact O-N 2.86Å; D272-T274 WeakPolarHBondContact OD1-CA 3.03Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 PolarHBondContact OD1-N 2.94Å; D272-T274 PolarHBondContact OD1-OG1 3.08Å
275	S	92.6	Very high	92.2	Very high	20 Å²	20	48.8 Å²	48.8	14%	0.14	24%	0.239	C	C	.	.			trans	-53.1	151.9	175.5	-174	0	0	0	0	112.1	H228 D272	H228-S275 PolarHBondContact NE2-OG 3.33Å; D272-S275 VanDerWaalsContact CG-N 3.33Å; D272-S275 VanDerWaalsContact O-CB 3.31Å; D272-S275 WeakPolarHBondContact O-CB 3.27Å; D272-S275 PolarHBondContact O-N 3.3Å; D272-S275 PolarHBondContact OD1-N 3.45Å; D272-S275 WeakPolarHBondContact OD2-CA 3.49Å; D272-S275 PolarHBondContact OD2-N 3.34Å
276	R	93.1	Very high	92.2	Very high	116 Å²	116	48.8 Å²	48.8	44%	0.438	24%	0.239	S	C	.	.			trans	-131.2	141.1	-175.3	-56.8	-174.5	-170.4	-166.1	3.9	111.1	N281 R321	R276-N281 WeakPolarHBondContact CA-O 3.45Å; R276-R321 PolarHBondContact NH1-O 3.49Å
277	D	92.5	Very high	92.2	Very high	12 Å²	12	47.8 Å²	47.8	6%	0.064	23%	0.234	C	C	.	.			trans	-77.9	-178.3	176.2	80	-11.3	0	0	0	112.9	Y244 E247 R279 G280 N281	Y244-D277 WeakPolarHBondContact CE2-OD2 3.3Å; Y244-D277 VanDerWaalsContact CZ-OD2 3.24Å; Y244-D277 PolarHBondContact OH-OD2 3.12Å; E247-D277 HydrophobicContact CB-CB 4.05Å; E247-D277 HydrophobicContact CG-CB 3.93Å; D277-R279 PolarHBondContact O-N 3.49Å; D277-R279 VanDerWaalsContact O-N 3.14Å; D277-R279 VanDerWaalsContact OD1-C 3.29Å; D277-R279 VanDerWaalsContact OD1-CA 3.26Å; D277-R279 WeakPolarHBondContact OD1-CA 3.37Å; D277-R279 WeakPolarHBondContact OD1-CB 3.41Å; D277-R279 PolarHBondContact OD1-N 2.9Å; D277-G280 PolarHBondContact O-N 2.93Å; D277-G280 PolarHBondContact OD1-N 2.73Å; D277-N281 PolarHBondContact N-O 3.36Å; D277-N281 WeakPolarHBondContact OD1-CA 3.37Å; D277-N281 WeakPolarHBondContact OD1-CB 3.33Å; D277-N281 PolarHBondContact OD1-N 3.13Å
278	S	91.9	Very high	92.3	Very high	54 Å²	54	42.2 Å²	42.2	38%	0.378	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.1	174.4	70	0	0	0	0	115.1	N235 E247 G280 N323	N235-S278 PolarHBondContact ND2-OG 2.98Å; E247-S278 VanDerWaalsContact OE1-CB 3.31Å; E247-S278 WeakPolarHBondContact OE1-CB 3.44Å; E247-S278 PolarHBondContact OE1-OG 3.43Å; E247-S278 WeakPolarHBondContact OE2-CB 3.38Å; E247-S278 PolarHBondContact OE2-N 3.21Å; S278-G280 VanDerWaalsContact C-N 3.34Å; S278-N323 PolarHBondContact O-ND2 2.85Å
279	R	90.8	Very high	92.2	Very high	82 Å²	82	40.9 Å²	40.9	31%	0.309	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-2.2	177.2	-56.9	-179.5	176.9	-168.4	-6.8	112.3	N235 P236 D277 N281 N323	N235-R279 PolarHBondContact OD1-NE 2.98Å; N235-R279 PolarHBondContact OD1-NH2 3.26Å; P236-R279 PolarHBondContact O-NH2 2.92Å; D277-R279 PolarHBondContact O-N 3.49Å; D277-R279 VanDerWaalsContact O-N 3.14Å; D277-R279 VanDerWaalsContact OD1-C 3.29Å; D277-R279 VanDerWaalsContact OD1-CA 3.26Å; D277-R279 WeakPolarHBondContact OD1-CA 3.37Å; D277-R279 WeakPolarHBondContact OD1-CB 3.41Å; D277-R279 PolarHBondContact OD1-N 2.9Å; R279-N281 PolarHBondContact O-N 2.92Å; R279-N323 VanDerWaalsContact C-CG 3.49Å; R279-N323 VanDerWaalsContact O-CB 3.31Å; R279-N323 WeakPolarHBondContact O-CB 3.41Å; R279-N323 PolarHBondContact O-N 2.18Å; R279-N323 VanDerWaalsContact O-N 3.12Å; R279-N323 PolarHBondContact O-ND2 3.43Å
280	G	93.1	Very high	92.2	Very high	5 Å²	5	32.8 Å²	32.8	5%	0.052	17%	0.168	C	C	.	.	S	Bend	trans	72.7	8.1	-172.4	0	0	0	0	0	113.5	D277 S278 N322	D277-G280 PolarHBondContact O-N 2.93Å; D277-G280 PolarHBondContact OD1-N 2.73Å; S278-G280 VanDerWaalsContact C-N 3.34Å; G280-N322 VanDerWaalsContact O-CA 3.32Å; G280-N322 WeakPolarHBondContact O-CA 3.4Å
281	N	94.8	Very high	92	Very high	11 Å²	11	26.8 Å²	26.8	6%	0.059	14%	0.14	C	C	.	.			trans	-75.3	143.5	177.7	-73.6	-24	0	0	0	109.9	Y244 R276 D277 R279 H285 N322	Y244-N281 WeakPolarHBondContact OH-CB 3.06Å; Y244-N281 PolarHBondContact OH-ND2 2.96Å; R276-N281 WeakPolarHBondContact CA-O 3.45Å; D277-N281 PolarHBondContact N-O 3.36Å; D277-N281 WeakPolarHBondContact OD1-CA 3.37Å; D277-N281 WeakPolarHBondContact OD1-CB 3.33Å; D277-N281 PolarHBondContact OD1-N 3.13Å; R279-N281 PolarHBondContact O-N 2.92Å; N281-H285 HydrophobicContact CB-CB 3.64Å; N281-N322 WeakPolarHBondContact OD1-CB 3.27Å; N281-N322 PolarHBondContact OD1-ND2 3.37Å
282	N	93.9	Very high	91.5	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.152	C	C	.	.			trans	-98.7	-179.4	168.7	74.3	12.6	0	0	0	110.8	L284 H285 A286 L317 T320	N282-L284 VanDerWaalsContact C-N 3.28Å; N282-L284 PolarHBondContact O-N 2.91Å; N282-L284 WeakPolarHBondContact OD1-CA 3.39Å; N282-L284 WeakPolarHBondContact OD1-CB 3.45Å; N282-L284 PolarHBondContact OD1-N 3.29Å; N282-H285 VanDerWaalsContact CG-ND1 3.28Å; N282-H285 PolarHBondContact N-ND1 3.08Å; N282-H285 WeakPolarHBondContact O-CB 3.4Å; N282-H285 PolarHBondContact O-N 2.95Å; N282-H285 PolarHBondContact OD1-N 3.05Å; N282-H285 PolarHBondContact OD1-ND1 2.95Å; N282-A286 PolarHBondContact O-N 2.99Å; N282-L317 HydrophobicContact CB-CD1 4.35Å; N282-L317 PolarHBondContact ND2-O 3.14Å; N282-T320 PolarHBondContact ND2-OG1 3.03Å
283	I	94.6	Very high	90.5	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.036	15%	0.152	C	C	.	.	H	α-helix	trans	-55.1	-34.9	178.1	-171.1	161.3	0	0	0	114.8	L250 A251 A254 I273 A286 L287 I308 L317	L250-I283 HydrophobicContact CB-CD1 4.38Å; L250-I283 HydrophobicContact CD2-CD1 3.82Å; L250-I283 HydrophobicContact CG-CD1 3.62Å; A251-I283 HydrophobicContact CB-CB 4.46Å; A251-I283 HydrophobicContact CB-CD1 4.25Å; A251-I283 HydrophobicContact CB-CG1 3.99Å; A254-I283 HydrophobicContact CB-CD1 4.16Å; I273-I283 HydrophobicContact CG2-CG2 4.43Å; I283-A286 PolarHBondContact O-N 3.15Å; I283-L287 WeakPolarHBondContact O-CG 3.25Å; I283-L287 PolarHBondContact O-N 3.08Å; I283-I308 HydrophobicContact CD1-CD1 3.63Å; I283-I308 HydrophobicContact CD1-CG1 4.44Å; I283-I308 HydrophobicContact CG1-CD1 4.03Å; I283-I308 HydrophobicContact CG2-CG2 4.06Å; I283-L317 HydrophobicContact CG2-CD1 4.41Å; I283-L317 HydrophobicContact CG2-CD2 4.24Å
284	L	94.4	Very high	89.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-72.3	-34.1	177.6	-57.9	-174.8	0	0	0	112	N282 L287 V288 Y305 I308 L317 E318 P328	N282-L284 VanDerWaalsContact C-N 3.28Å; N282-L284 PolarHBondContact O-N 2.91Å; N282-L284 WeakPolarHBondContact OD1-CA 3.39Å; N282-L284 WeakPolarHBondContact OD1-CB 3.45Å; N282-L284 PolarHBondContact OD1-N 3.29Å; L284-L287 HydrophobicContact CD2-CD1 4.47Å; L284-V288 VanDerWaalsContact O-CG2 3.32Å; L284-V288 WeakPolarHBondContact O-CG2 3.43Å; L284-V288 PolarHBondContact O-N 3.45Å; L284-V288 VanDerWaalsContact O-N 3.09Å; L284-Y305 HydrophobicContact CB-CE2 3.95Å; L284-Y305 HydrophobicContact CD1-CE1 4.36Å; L284-Y305 HydrophobicContact CD1-CE2 4.4Å; L284-Y305 HydrophobicContact CD2-CD1 4.43Å; L284-Y305 HydrophobicContact CD2-CD2 3.98Å; L284-Y305 HydrophobicContact CD2-CE1 4.33Å; L284-Y305 HydrophobicContact CD2-CE2 3.9Å; L284-Y305 HydrophobicContact CD2-CG 4.25Å; L284-Y305 HydrophobicContact CG-CE2 4.3Å; L284-I308 HydrophobicContact CD2-CG2 4.32Å; L284-L317 HydrophobicContact CD1-CB 4.2Å; L284-L317 HydrophobicContact CD1-CD2 3.79Å; L284-L317 HydrophobicContact CD1-CG 3.68Å; L284-L317 HydrophobicContact CD2-CD2 4.18Å; L284-L317 HydrophobicContact CG-CD2 3.79Å; L284-L317 HydrophobicContact CG-CG 3.88Å; L284-E318 HydrophobicContact CD1-CG 4.04Å; L284-P328 HydrophobicContact CB-CB 4.07Å; L284-P328 HydrophobicContact CB-CG 3.88Å
285	H	94.7	Very high	88.2	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-43	171.6	-64.5	86.9	0	0	0	110.5	N281 N282 V288 T289 T320 L326 T327 P328 L331	N281-H285 HydrophobicContact CB-CB 3.64Å; N282-H285 VanDerWaalsContact CG-ND1 3.28Å; N282-H285 PolarHBondContact N-ND1 3.08Å; N282-H285 WeakPolarHBondContact O-CB 3.4Å; N282-H285 PolarHBondContact O-N 2.95Å; N282-H285 PolarHBondContact OD1-N 3.05Å; N282-H285 PolarHBondContact OD1-ND1 2.95Å; H285-V288 WeakPolarHBondContact O-CB 3.24Å; H285-V288 PolarHBondContact O-N 3.43Å; H285-V288 VanDerWaalsContact O-N 3.16Å; H285-T289 VanDerWaalsContact O-CG2 3.27Å; H285-T289 WeakPolarHBondContact O-CG2 3.4Å; H285-T289 PolarHBondContact O-N 3.34Å; H285-T320 PolarHBondContact CE1-O 3.05Å; H285-L326 PolarHBondContact NE2-O 3.22Å; H285-L326 VanDerWaalsContact NE2-O 3.11Å; H285-T327 VanDerWaalsContact NE2-C 3.34Å; H285-P328 VanDerWaalsContact CE1-CD 3.45Å; H285-P328 WeakPolarHBondContact CE1-CD 3.3Å; H285-P328 WeakPolarHBondContact NE2-CD 3.39Å; H285-L331 HydrophobicContact CB-CD2 3.83Å
286	A	93.3	Very high	86.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.9	-48.3	175.9	0	0	0	0	0	112	F245 A251 N282 I283 V288 T289 V290	F245-A286 WeakPolarHBondContact O-CB 3.11Å; A251-A286 HydrophobicContact CB-CB 4.39Å; N282-A286 PolarHBondContact O-N 2.99Å; I283-A286 PolarHBondContact O-N 3.15Å; A286-V288 VanDerWaalsContact C-N 3.27Å; A286-V288 PolarHBondContact O-N 3.38Å; A286-T289 PolarHBondContact O-N 3.21Å; A286-T289 PolarHBondContact O-OG1 3.2Å; A286-V290 PolarHBondContact O-N 3.46Å
287	L	92.6	Very high	85.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-37.1	174.2	-73.8	175.1	0	0	0	113	A254 I283 L284 V290 A291 V301 M304 Y305 I308	A254-L287 HydrophobicContact CB-CD2 4.09Å; I283-L287 WeakPolarHBondContact O-CG 3.25Å; I283-L287 PolarHBondContact O-N 3.08Å; L284-L287 HydrophobicContact CD2-CD1 4.47Å; L287-V290 PolarHBondContact O-N 2.96Å; L287-A291 PolarHBondContact O-N 3.02Å; L287-V301 HydrophobicContact CB-CG1 4.19Å; L287-V301 HydrophobicContact CD2-CG1 4.38Å; L287-M304 HydrophobicContact CD1-CB 4.45Å; L287-M304 HydrophobicContact CD2-CB 4.42Å; L287-Y305 HydrophobicContact CD1-CD2 4.37Å; L287-I308 HydrophobicContact CD1-CD1 3.88Å
288	V	92.8	Very high	84.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.1	-34.9	173.8	165.8	0	0	0	0	112	L284 H285 A286 Y305 L331 A332 M335 I340	L284-V288 VanDerWaalsContact O-CG2 3.32Å; L284-V288 WeakPolarHBondContact O-CG2 3.43Å; L284-V288 PolarHBondContact O-N 3.45Å; L284-V288 VanDerWaalsContact O-N 3.09Å; H285-V288 WeakPolarHBondContact O-CB 3.24Å; H285-V288 PolarHBondContact O-N 3.43Å; H285-V288 VanDerWaalsContact O-N 3.16Å; A286-V288 VanDerWaalsContact C-N 3.27Å; A286-V288 PolarHBondContact O-N 3.38Å; V288-Y305 HydrophobicContact CG2-CE2 4.5Å; V288-L331 HydrophobicContact CG1-CB 4.33Å; V288-L331 HydrophobicContact CG1-CD2 4.26Å; V288-L331 HydrophobicContact CG1-CG 4.08Å; V288-A332 HydrophobicContact CG1-CB 3.77Å; V288-A332 HydrophobicContact CG2-CB 4.31Å; V288-M335 HydrophobicContact CG1-SD 4.44Å; V288-I340 HydrophobicContact CG2-CG1 4.42Å
289	T	90.2	Very high	83.5	Confident	27 Å²	27	40.8 Å²	40.8	17%	0.166	20%	0.202	C	C	.	.	H	α-helix	trans	-71.2	-32.8	176.2	68.7	0	0	0	0	113.4	Y244 H285 A286 L331 M335	Y244-T289 HydrophobicContact CD1-CG2 4.25Å; Y244-T289 WeakPolarHBondContact CD1-OG1 3.35Å; Y244-T289 HydrophobicContact CE1-CG2 3.81Å; Y244-T289 WeakPolarHBondContact CE1-OG1 3.49Å; H285-T289 VanDerWaalsContact O-CG2 3.27Å; H285-T289 WeakPolarHBondContact O-CG2 3.4Å; H285-T289 PolarHBondContact O-N 3.34Å; A286-T289 PolarHBondContact O-N 3.21Å; A286-T289 PolarHBondContact O-OG1 3.2Å; T289-L331 HydrophobicContact CG2-CD2 4.12Å; T289-M335 HydrophobicContact CG2-CE 3.51Å; T289-M335 HydrophobicContact CG2-SD 3.85Å
290	V	88.6	Confident	83.4	Confident	33 Å²	33	38.9 Å²	38.9	20%	0.2	20%	0.196	C	C	.	.	H	α-helix	trans	-83.3	-20.4	179.1	173.5	0	0	0	0	112.3	C255 A286 L287 E292	C255-V290 HydrophobicContact CB-CG1 4.29Å; C255-V290 HydrophobicContact CB-CG2 4.12Å; A286-V290 PolarHBondContact O-N 3.46Å; L287-V290 PolarHBondContact O-N 2.96Å; V290-E292 PolarHBondContact O-N 3.2Å
291	A	85.1	Confident	83.3	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.008	19%	0.194	C	C	.	.			trans	-56.5	130.9	175.4	0	0	0	0	0	111.7	L287 V301 K337 I340	L287-A291 PolarHBondContact O-N 3.02Å; A291-V301 HydrophobicContact CB-CG1 4.26Å; A291-K337 VanDerWaalsContact O-CD 3.3Å; A291-K337 WeakPolarHBondContact O-CD 3.47Å; A291-K337 WeakPolarHBondContact O-CE 3.47Å; A291-K337 PolarHBondContact O-NZ 3.14Å; A291-I340 HydrophobicContact CB-CB 4.41Å; A291-I340 HydrophobicContact CB-CG2 4.17Å
292	E	81.3	Confident	83.1	Confident	80 Å²	80	39.7 Å²	39.7	37%	0.374	20%	0.198	S	C	.	.			trans	-87.1	170.4	172.8	-70.5	-165.5	171.6	0	0	110.9	V290 Q297 N298	V290-E292 PolarHBondContact O-N 3.2Å; E292-Q297 PolarHBondContact OE1-NE2 3.1Å; E292-Q297 VanDerWaalsContact OE1-NE2 3.13Å; E292-Q297 WeakPolarHBondContact OE2-CG 3.48Å; E292-Q297 PolarHBondContact OE2-NE2 3.36Å; E292-N298 PolarHBondContact N-OD1 3.47Å; E292-N298 VanDerWaalsContact N-OD1 3.1Å; E292-N298 VanDerWaalsContact O-CG 3.29Å; E292-N298 PolarHBondContact O-ND2 3Å; E292-N298 PolarHBondContact O-OD1 3.38Å
293	D	69	Low	82.9	Confident	71 Å²	71	47.2 Å²	47.2	38%	0.38	23%	0.226	S	C	.	.	S	Bend	trans	-91.1	-11.6	173.3	-64.6	-77.6	0	0	0	112	G336 K337 N399	D293-G336 VanDerWaalsContact OD1-O 3.07Å; D293-K337 WeakPolarHBondContact OD1-CA 3.32Å; D293-K337 WeakPolarHBondContact OD1-CD 3.42Å; D293-K337 WeakPolarHBondContact OD2-CD 3.34Å; D293-K337 IonicContact OD2-NZ 3.49Å; D293-K337 PolarHBondContact OD2-NZ 3.48Å; D293-N399 PolarHBondContact OD1-ND2 3.39Å
294	F	68.4	Low	82.8	Confident	136 Å²	136	47 Å²	47	60%	0.596	23%	0.225	S	C	*	.	S	Bend	trans	-88.1	140.9	-178.1	-158.7	-101	0	0	0	113.2	T296 N298	F294-T296 VanDerWaalsContact C-N 3.33Å; F294-T296 HydrophobicContact CD1-CG2 4.33Å; F294-T296 VanDerWaalsContact CD1-OG1 3.3Å; F294-T296 WeakPolarHBondContact CD1-OG1 3.5Å; F294-T296 HydrophobicContact CE1-CG2 3.92Å; F294-T296 PolarHBondContact O-N 3Å; F294-N298 PolarHBondContact O-ND2 2.76Å; F294-N298 VanDerWaalsContact O-ND2 3.08Å
295	K	65.6	Low	82.7	Confident	124 Å²	124	47 Å²	47	54%	0.539	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-28.8	-165	-69.8	173.3	178.9	168.6	0	114.5	E339 E402	K295-E339 HydrophobicContact CG-CG 4.47Å; K295-E402 IonicContact NZ-OE1 2.69Å
296	T	61.5	Low	82.5	Confident	107 Å²	107	48.8 Å²	48.8	66%	0.656	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-22.5	-170.9	56.7	0	0	0	0	114.8	F294	F294-T296 VanDerWaalsContact C-N 3.33Å; F294-T296 HydrophobicContact CD1-CG2 4.33Å; F294-T296 VanDerWaalsContact CD1-OG1 3.3Å; F294-T296 WeakPolarHBondContact CD1-OG1 3.5Å; F294-T296 HydrophobicContact CE1-CG2 3.92Å; F294-T296 PolarHBondContact O-N 3Å
297	Q	62.1	Low	82.5	Confident	88 Å²	88	51.1 Å²	51.1	41%	0.411	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-22.4	-178.3	-57.2	-147.5	57.1	0	0	113	E292 D299 F300	E292-Q297 PolarHBondContact OE1-NE2 3.1Å; E292-Q297 VanDerWaalsContact OE1-NE2 3.13Å; E292-Q297 WeakPolarHBondContact OE2-CG 3.48Å; E292-Q297 PolarHBondContact OE2-NE2 3.36Å; Q297-D299 VanDerWaalsContact C-N 3.28Å; Q297-D299 PolarHBondContact O-N 3.03Å; Q297-F300 WeakPolarHBondContact O-CD1 3.48Å; Q297-F300 VanDerWaalsContact O-CE1 3.26Å; Q297-F300 WeakPolarHBondContact O-CE1 3.45Å
298	N	67.9	Low	82.4	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-73.2	-12.5	-171.7	-75.2	-34.2	0	0	0	115.8	E292 F294 F300 V301 K302 E339	E292-N298 PolarHBondContact N-OD1 3.47Å; E292-N298 VanDerWaalsContact N-OD1 3.1Å; E292-N298 VanDerWaalsContact O-CG 3.29Å; E292-N298 PolarHBondContact O-ND2 3Å; E292-N298 PolarHBondContact O-OD1 3.38Å; F294-N298 PolarHBondContact O-ND2 2.76Å; F294-N298 VanDerWaalsContact O-ND2 3.08Å; N298-F300 VanDerWaalsContact C-N 3.33Å; N298-F300 PolarHBondContact O-N 3.12Å; N298-V301 PolarHBondContact O-N 2.81Å; N298-K302 VanDerWaalsContact O-CG 3.31Å; N298-K302 WeakPolarHBondContact O-CG 3.5Å; N298-K302 PolarHBondContact O-N 3.25Å; N298-E339 HydrophobicContact CB-CB 4.49Å; N298-E339 WeakPolarHBondContact ND2-CB 3.29Å
299	D	79.9	Confident	82.4	Confident	78 Å²	78	51.2 Å²	51.2	42%	0.417	25%	0.246	S	C	.	.	H	α-helix	trans	-68.9	-28.5	-174.6	-80.4	1.6	0	0	0	113.8	Q297 R303	Q297-D299 VanDerWaalsContact C-N 3.28Å; Q297-D299 PolarHBondContact O-N 3.03Å; D299-R303 WeakPolarHBondContact O-CG 3.46Å; D299-R303 PolarHBondContact O-N 2.95Å; D299-R303 PolarHBondContact O-NE 2.68Å
300	F	88	Confident	82.4	Confident	42 Å²	42	53.2 Å²	53.2	18%	0.184	26%	0.255	C	S	.	.	H	α-helix	trans	-75.7	-42.9	173.1	83.1	-94.3	0	0	0	110.8	N257 Q297 N298 K302 R303 M304	N257-F300 HydrophobicContact CB-CB 4.31Å; N257-F300 HydrophobicContact CB-CD2 3.6Å; N257-F300 HydrophobicContact CB-CE2 4.06Å; N257-F300 HydrophobicContact CB-CG 3.96Å; Q297-F300 WeakPolarHBondContact O-CD1 3.48Å; Q297-F300 VanDerWaalsContact O-CE1 3.26Å; Q297-F300 WeakPolarHBondContact O-CE1 3.45Å; N298-F300 VanDerWaalsContact C-N 3.33Å; N298-F300 PolarHBondContact O-N 3.12Å; F300-K302 VanDerWaalsContact C-N 3.31Å; F300-K302 PolarHBondContact O-N 3.48Å; F300-R303 PolarHBondContact O-N 2.65Å; F300-R303 VanDerWaalsContact O-N 3.11Å; F300-M304 HydrophobicContact CD2-CG 4.44Å; F300-M304 WeakPolarHBondContact O-CG 3.32Å; F300-M304 PolarHBondContact O-N 3Å
301	V	91.1	Very high	82.4	Confident	2 Å²	2	57 Å²	57	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-58.1	-45.1	178.3	-176.2	0	0	0	0	110.7	L287 A291 N298 R303 M304 Y305 I340	L287-V301 HydrophobicContact CB-CG1 4.19Å; L287-V301 HydrophobicContact CD2-CG1 4.38Å; A291-V301 HydrophobicContact CB-CG1 4.26Å; N298-V301 PolarHBondContact O-N 2.81Å; V301-R303 PolarHBondContact O-N 2.95Å; V301-M304 PolarHBondContact O-N 3.32Å; V301-Y305 VanDerWaalsContact O-CB 3.3Å; V301-Y305 WeakPolarHBondContact O-CB 3.41Å; V301-Y305 PolarHBondContact O-N 3.33Å; V301-I340 HydrophobicContact CG1-CD1 4.4Å
302	K	90.4	Very high	82.4	Confident	31 Å²	31	58.1 Å²	58.1	14%	0.135	27%	0.274	C	S	.	.	H	α-helix	trans	-57.5	-48.3	174.7	-69.5	167.1	-177.9	172	0	111.7	N298 F300 Y305 D306 E339 I340 Y343	N298-K302 VanDerWaalsContact O-CG 3.31Å; N298-K302 WeakPolarHBondContact O-CG 3.5Å; N298-K302 PolarHBondContact O-N 3.25Å; F300-K302 VanDerWaalsContact C-N 3.31Å; F300-K302 PolarHBondContact O-N 3.48Å; K302-Y305 WeakPolarHBondContact O-CB 3.38Å; K302-Y305 PolarHBondContact O-N 3.34Å; K302-D306 PolarHBondContact O-N 3.34Å; K302-D306 VanDerWaalsContact O-N 3.07Å; K302-E339 IonicContact NZ-OE2 3.76Å; K302-E339 PolarHBondContact NZ-OE2 2.73Å; K302-I340 HydrophobicContact CG-CD1 4.19Å; K302-Y343 HydrophobicContact CB-CD1 4.38Å; K302-Y343 HydrophobicContact CB-CG 4.36Å; K302-Y343 HydrophobicContact CD-CD2 4.39Å; K302-Y343 HydrophobicContact CD-CG 4.33Å; K302-Y343 HydrophobicContact CG-CD1 4.24Å; K302-Y343 HydrophobicContact CG-CD2 4.33Å; K302-Y343 HydrophobicContact CG-CG 3.9Å
303	R	90.4	Very high	82.4	Confident	161 Å²	161	55.1 Å²	55.1	61%	0.608	26%	0.264	S	S	*	.	H	α-helix	trans	-64	-40.3	177.7	-75.5	177.9	-111.9	173.5	-10.4	113.4	D299 F300 V301 D306 M307	D299-R303 WeakPolarHBondContact O-CG 3.46Å; D299-R303 PolarHBondContact O-N 2.95Å; D299-R303 PolarHBondContact O-NE 2.68Å; F300-R303 PolarHBondContact O-N 2.65Å; F300-R303 VanDerWaalsContact O-N 3.11Å; V301-R303 PolarHBondContact O-N 2.95Å; R303-D306 PolarHBondContact O-N 3.39Å; R303-M307 WeakPolarHBondContact O-CB 3.35Å; R303-M307 PolarHBondContact O-N 3.38Å
304	M	92	Very high	83	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-41.3	177.3	-67.3	-48.5	-54.7	0	0	111.3	A254 P259 V262 L287 F300 V301 D306 M307 I308	A254-M304 HydrophobicContact CB-CE 4.28Å; P259-M304 HydrophobicContact CB-CE 4.43Å; P259-M304 HydrophobicContact CB-SD 3.97Å; V262-M304 HydrophobicContact CB-CE 3.78Å; V262-M304 HydrophobicContact CG1-CE 3.68Å; V262-M304 HydrophobicContact CG2-CE 3.71Å; L287-M304 HydrophobicContact CD1-CB 4.45Å; L287-M304 HydrophobicContact CD2-CB 4.42Å; F300-M304 HydrophobicContact CD2-CG 4.44Å; F300-M304 WeakPolarHBondContact O-CG 3.32Å; F300-M304 PolarHBondContact O-N 3Å; V301-M304 PolarHBondContact O-N 3.32Å; M304-D306 VanDerWaalsContact C-N 3.33Å; M304-D306 PolarHBondContact O-N 3.08Å; M304-M307 HydrophobicContact CE-SD 4.27Å; M304-M307 PolarHBondContact O-N 2.8Å; M304-I308 WeakPolarHBondContact O-CD1 3.45Å; M304-I308 WeakPolarHBondContact O-CG1 3.47Å; M304-I308 PolarHBondContact O-N 3.36Å
305	Y	92.4	Very high	83.6	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-56.9	-46.8	174.6	-162.5	-73.8	0	0	0	111.2	L284 L287 V288 V301 K302 L309 I340 I344	L284-Y305 HydrophobicContact CB-CE2 3.95Å; L284-Y305 HydrophobicContact CD1-CE1 4.36Å; L284-Y305 HydrophobicContact CD1-CE2 4.4Å; L284-Y305 HydrophobicContact CD2-CD1 4.43Å; L284-Y305 HydrophobicContact CD2-CD2 3.98Å; L284-Y305 HydrophobicContact CD2-CE1 4.33Å; L284-Y305 HydrophobicContact CD2-CE2 3.9Å; L284-Y305 HydrophobicContact CD2-CG 4.25Å; L284-Y305 HydrophobicContact CG-CE2 4.3Å; L287-Y305 HydrophobicContact CD1-CD2 4.37Å; V288-Y305 HydrophobicContact CG2-CE2 4.5Å; V301-Y305 VanDerWaalsContact O-CB 3.3Å; V301-Y305 WeakPolarHBondContact O-CB 3.41Å; V301-Y305 PolarHBondContact O-N 3.33Å; K302-Y305 WeakPolarHBondContact O-CB 3.38Å; K302-Y305 PolarHBondContact O-N 3.34Å; Y305-L309 HydrophobicContact CE1-CD2 4.34Å; Y305-L309 VanDerWaalsContact O-CB 3.25Å; Y305-L309 WeakPolarHBondContact O-CB 3.29Å; Y305-L309 PolarHBondContact O-N 3.3Å; Y305-I340 HydrophobicContact CD2-CD1 4.28Å; Y305-I344 HydrophobicContact CE1-CG1 4.21Å; Y305-I344 HydrophobicContact CE2-CD1 4.1Å; Y305-I344 HydrophobicContact CE2-CG1 4.41Å
306	D	90.8	Very high	84.6	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.203	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-47.3	174.7	-73.1	-29.6	0	0	0	112.5	K302 R303 M304 I308 L309 L310 Y343	K302-D306 PolarHBondContact O-N 3.34Å; K302-D306 VanDerWaalsContact O-N 3.07Å; R303-D306 PolarHBondContact O-N 3.39Å; M304-D306 VanDerWaalsContact C-N 3.33Å; M304-D306 PolarHBondContact O-N 3.08Å; D306-I308 VanDerWaalsContact C-N 3.32Å; D306-I308 PolarHBondContact O-N 3.39Å; D306-L309 PolarHBondContact O-N 3.39Å; D306-L310 HydrophobicContact CB-CD1 4.27Å; D306-L310 VanDerWaalsContact O-CB 3.23Å; D306-L310 WeakPolarHBondContact O-CB 3.48Å; D306-L310 WeakPolarHBondContact O-CD1 3.25Å; D306-L310 WeakPolarHBondContact O-CG 3.22Å; D306-L310 PolarHBondContact O-N 2.9Å; D306-Y343 VanDerWaalsContact OD1-CE1 3.23Å; D306-Y343 WeakPolarHBondContact OD1-CE1 3.44Å; D306-Y343 VanDerWaalsContact OD1-CZ 3.25Å; D306-Y343 PolarHBondContact OD1-OH 3.33Å; D306-Y343 PolarHBondContact OD2-OH 3.37Å
307	M	91.4	Very high	85.9	Confident	49 Å²	49	47.2 Å²	47.2	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-44.8	-177.2	-172.1	179.6	-59.8	0	0	111.8	P259 Q263 M266 R303 M304 R311	P259-M307 HydrophobicContact CB-CE 3.64Å; P259-M307 HydrophobicContact CB-SD 4Å; Q263-M307 HydrophobicContact CG-SD 3.87Å; Q263-M307 PolarHBondContact NE2-SD 2.96Å; M266-M307 HydrophobicContact CE-CG 4.23Å; R303-M307 WeakPolarHBondContact O-CB 3.35Å; R303-M307 PolarHBondContact O-N 3.38Å; M304-M307 HydrophobicContact CE-SD 4.27Å; M304-M307 PolarHBondContact O-N 2.8Å; M307-R311 VanDerWaalsContact O-CB 3.26Å; M307-R311 WeakPolarHBondContact O-CB 3.19Å; M307-R311 PolarHBondContact O-N 2.99Å; M307-R311 VanDerWaalsContact O-N 3.12Å
308	I	92.3	Very high	87.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.3	-45	178.5	-67.4	158	0	0	0	110.6	A254 V262 M266 I273 I283 L284 L287 M304 D306 R311 S312 L317	A254-I308 HydrophobicContact CB-CD1 3.9Å; V262-I308 HydrophobicContact CG1-CG1 4.11Å; M266-I308 HydrophobicContact SD-CB 4.42Å; M266-I308 HydrophobicContact SD-CG1 4.05Å; I273-I308 HydrophobicContact CG2-CG2 4.28Å; I283-I308 HydrophobicContact CD1-CD1 3.63Å; I283-I308 HydrophobicContact CD1-CG1 4.44Å; I283-I308 HydrophobicContact CG1-CD1 4.03Å; I283-I308 HydrophobicContact CG2-CG2 4.06Å; L284-I308 HydrophobicContact CD2-CG2 4.32Å; L287-I308 HydrophobicContact CD1-CD1 3.88Å; M304-I308 WeakPolarHBondContact O-CD1 3.45Å; M304-I308 WeakPolarHBondContact O-CG1 3.47Å; M304-I308 PolarHBondContact O-N 3.36Å; D306-I308 VanDerWaalsContact C-N 3.32Å; D306-I308 PolarHBondContact O-N 3.39Å; I308-R311 PolarHBondContact O-N 3.09Å; I308-S312 VanDerWaalsContact O-CB 3.28Å; I308-S312 WeakPolarHBondContact O-CB 3.45Å; I308-S312 PolarHBondContact O-N 2.96Å; I308-L317 HydrophobicContact CG2-CD2 4.02Å
309	L	91.4	Very high	88.2	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-68.1	-42.2	-178	-170.4	68.8	0	0	0	112.6	Y305 D306 G313 E318 L357	Y305-L309 HydrophobicContact CE1-CD2 4.34Å; Y305-L309 VanDerWaalsContact O-CB 3.25Å; Y305-L309 WeakPolarHBondContact O-CB 3.29Å; Y305-L309 PolarHBondContact O-N 3.3Å; D306-L309 PolarHBondContact O-N 3.39Å; L309-G313 PolarHBondContact O-N 3.16Å; L309-E318 HydrophobicContact CD1-CG 4.28Å; L309-L357 HydrophobicContact CD1-CD2 4.19Å; L309-L357 HydrophobicContact CG-CD1 4.35Å; L309-L357 HydrophobicContact CG-CD2 4.42Å
310	L	89.9	Confident	88.8	Confident	68 Å²	68	43.8 Å²	43.8	36%	0.356	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-36.9	176.8	-69.6	168	0	0	0	111.9	D306 I349 L354	D306-L310 HydrophobicContact CB-CD1 4.27Å; D306-L310 VanDerWaalsContact O-CB 3.23Å; D306-L310 WeakPolarHBondContact O-CB 3.48Å; D306-L310 WeakPolarHBondContact O-CD1 3.25Å; D306-L310 WeakPolarHBondContact O-CG 3.22Å; D306-L310 PolarHBondContact O-N 2.9Å; L310-I349 HydrophobicContact CD2-CD1 4.2Å; L310-I349 HydrophobicContact CD2-CG2 4.37Å; L310-L354 HydrophobicContact CB-CD1 4.41Å; L310-L354 HydrophobicContact CD2-CD1 3.67Å
311	R	89.1	Confident	89.1	Confident	112 Å²	112	46.2 Å²	46.2	42%	0.423	22%	0.217	S	C	.	.	H	α-helix	trans	-72.9	-41.7	176.6	-174.5	65.8	71.2	124.8	5.7	112	M266 E267 M307 I308	M266-R311 HydrophobicContact CB-CG 4.03Å; M266-R311 HydrophobicContact CE-CB 3.91Å; M266-R311 HydrophobicContact CE-CG 3.92Å; M266-R311 HydrophobicContact SD-CB 3.95Å; M266-R311 HydrophobicContact SD-CG 3.94Å; E267-R311 IonicContact OE1-CZ 2.78Å; E267-R311 VanDerWaalsContact OE1-CZ 3.23Å; E267-R311 IonicContact OE1-NH1 3.53Å; E267-R311 PolarHBondContact OE1-NH1 3.41Å; E267-R311 IonicContact OE1-NH2 3.23Å; E267-R311 PolarHBondContact OE1-NH2 2.7Å; M307-R311 VanDerWaalsContact O-CB 3.26Å; M307-R311 WeakPolarHBondContact O-CB 3.19Å; M307-R311 PolarHBondContact O-N 2.99Å; M307-R311 VanDerWaalsContact O-N 3.12Å; I308-R311 PolarHBondContact O-N 3.09Å
312	S	85.8	Confident	89.2	Confident	25 Å²	25	46.9 Å²	46.9	18%	0.175	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-41.1	176.3	176	0	0	0	0	112.2	I308 N314	I308-S312 VanDerWaalsContact O-CB 3.28Å; I308-S312 WeakPolarHBondContact O-CB 3.45Å; I308-S312 PolarHBondContact O-N 2.96Å; S312-N314 PolarHBondContact O-N 2.77Å
313	G	81.4	Confident	89.4	Confident	17 Å²	17	51.1 Å²	51.1	18%	0.175	25%	0.245	C	C	.	.			trans	71.8	-11.7	177.4	0	0	0	0	0	115.7	L309	L309-G313 PolarHBondContact O-N 3.16Å
314	N	81.5	Confident	89.4	Confident	87 Å²	87	48.4 Å²	48.4	47%	0.465	24%	0.242	S	C	.	.			trans	-105	141.4	-171.9	-69.6	-11.4	0	0	0	112.4	S312 E316	S312-N314 PolarHBondContact O-N 2.77Å; N314-E316 PolarHBondContact O-N 2.86Å
315	W	80.4	Confident	89.5	Confident	68 Å²	68	49.4 Å²	49.4	26%	0.258	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.3	176.8	-172.6	-103.8	0	0	0	113.1	L317 E318 T319 S356 L357 R359 R713	W315-L317 VanDerWaalsContact C-N 3.28Å; W315-L317 PolarHBondContact O-N 2.97Å; W315-E318 PolarHBondContact O-N 3.15Å; W315-E318 VanDerWaalsContact O-N 3.14Å; W315-T319 HydrophobicContact CG-CG2 4.3Å; W315-T319 PolarHBondContact O-N 3.26Å; W315-S356 WeakPolarHBondContact CZ3-O 3.5Å; W315-L357 HydrophobicContact CE3-CD2 4.19Å; W315-R359 HydrophobicContact CH2-CG 4.23Å; W315-R713 VanDerWaalsContact CZ3-NH1 3.32Å
316	E	86.5	Confident	89.5	Confident	116 Å²	116	49.5 Å²	49.5	54%	0.542	25%	0.254	S	S	.	.	H	α-helix	trans	-53.1	-43.4	-175.4	-65	179.3	161.8	0	0	112.5	N314 E318 T319 T320	N314-E316 PolarHBondContact O-N 2.86Å; E316-E318 PolarHBondContact O-N 3.39Å; E316-T319 WeakPolarHBondContact CA-OG1 3.47Å; E316-T319 CarbonylContact O-C 3.51Å; E316-T319 WeakPolarHBondContact O-CA 3.39Å; E316-T319 PolarHBondContact O-N 3.46Å; E316-T319 PolarHBondContact O-OG1 2.96Å; E316-T320 PolarHBondContact O-N 3.44Å
317	L	88.6	Confident	89.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-24.9	-176.4	-160.3	68.1	0	0	0	113.9	I273 N282 I283 L284 I308 W315 T320	I273-L317 HydrophobicContact CG2-CD1 4.34Å; I273-L317 HydrophobicContact CG2-CD2 4.08Å; I273-L317 WeakPolarHBondContact O-CD1 3.47Å; N282-L317 HydrophobicContact CB-CD1 4.35Å; N282-L317 PolarHBondContact ND2-O 3.14Å; I283-L317 HydrophobicContact CG2-CD1 4.41Å; I283-L317 HydrophobicContact CG2-CD2 4.24Å; L284-L317 HydrophobicContact CD1-CB 4.2Å; L284-L317 HydrophobicContact CD1-CD2 3.79Å; L284-L317 HydrophobicContact CD1-CG 3.68Å; L284-L317 HydrophobicContact CD2-CD2 4.18Å; L284-L317 HydrophobicContact CG-CD2 3.79Å; L284-L317 HydrophobicContact CG-CG 3.88Å; I308-L317 HydrophobicContact CG2-CD2 4.02Å; W315-L317 VanDerWaalsContact C-N 3.28Å; W315-L317 PolarHBondContact O-N 2.97Å; L317-T320 PolarHBondContact O-OG1 3.04Å
318	E	89.4	Confident	89.9	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-88.9	-19.6	171.2	-71.1	-161.8	175.7	0	0	113.5	L284 L309 W315 E316 P328 R347 R359	L284-E318 HydrophobicContact CD1-CG 4.04Å; L309-E318 HydrophobicContact CD1-CG 4.28Å; W315-E318 PolarHBondContact O-N 3.15Å; W315-E318 VanDerWaalsContact O-N 3.14Å; E316-E318 PolarHBondContact O-N 3.39Å; E318-P328 WeakPolarHBondContact O-CD 3.38Å; E318-R347 VanDerWaalsContact CD-NH2 3.32Å; E318-R347 IonicContact OE1-CZ 3.79Å; E318-R347 IonicContact OE1-NH1 3.56Å; E318-R347 PolarHBondContact OE1-NH1 3.49Å; E318-R347 IonicContact OE1-NH2 2.74Å; E318-R347 PolarHBondContact OE1-NH2 3.38Å; E318-R347 IonicContact OE2-NH2 3.53Å; E318-R347 PolarHBondContact OE2-NH2 3.23Å; E318-R359 IonicContact OE2-CZ 3.74Å; E318-R359 VanDerWaalsContact OE2-CZ 3.25Å; E318-R359 IonicContact OE2-NE 3.87Å; E318-R359 PolarHBondContact OE2-NE 3.05Å; E318-R359 IonicContact OE2-NH2 3.93Å; E318-R359 PolarHBondContact OE2-NH2 3.34Å
319	T	89.8	Confident	90	Very high	67 Å²	67	45.7 Å²	45.7	41%	0.411	23%	0.234	S	C	.	.	H	α-helix	trans	-93	-22.5	-179.2	62	0	0	0	0	114.3	W315 E316 R321	W315-T319 HydrophobicContact CG-CG2 4.3Å; W315-T319 PolarHBondContact O-N 3.26Å; E316-T319 WeakPolarHBondContact CA-OG1 3.47Å; E316-T319 CarbonylContact O-C 3.51Å; E316-T319 WeakPolarHBondContact O-CA 3.39Å; E316-T319 PolarHBondContact O-N 3.46Å; E316-T319 PolarHBondContact O-OG1 2.96Å; T319-R321 PolarHBondContact O-N 2.79Å
320	T	92.4	Very high	90.1	Very high	22 Å²	22	45.6 Å²	45.6	14%	0.135	23%	0.234	C	C	.	.			trans	-56.7	124.9	174.7	49.6	0	0	0	0	109.7	N282 H285 E316 L317	N282-T320 PolarHBondContact ND2-OG1 3.03Å; H285-T320 PolarHBondContact CE1-O 3.05Å; E316-T320 PolarHBondContact O-N 3.44Å; L317-T320 PolarHBondContact O-OG1 3.04Å
321	R	93.6	Very high	90.3	Very high	94 Å²	94	42.7 Å²	42.7	36%	0.355	22%	0.219	S	C	.	.			trans	-94.2	142.6	174.7	-66.4	177.5	178.6	-144.1	12.1	110.5	R276 T319 G325 L326 T327 D384	R276-R321 PolarHBondContact NH1-O 3.49Å; T319-R321 PolarHBondContact O-N 2.79Å; R321-G325 VanDerWaalsContact CD-O 3.29Å; R321-G325 WeakPolarHBondContact CD-O 3.46Å; R321-G325 PolarHBondContact NH1-O 3.4Å; R321-L326 CarbonylContact C-O 3.49Å; R321-L326 VanDerWaalsContact CA-O 3.24Å; R321-L326 WeakPolarHBondContact CA-O 3.36Å; R321-T327 HydrophobicContact CG-CG2 4.04Å; R321-D384 IonicContact NH1-OD2 3.42Å; R321-D384 PolarHBondContact NH1-OD2 3Å; R321-D384 IonicContact NH2-OD1 3.88Å
322	N	94.4	Very high	90.6	Very high	15 Å²	15	37.3 Å²	37.3	8%	0.08	20%	0.199	C	C	.	.			trans	-79.3	-174.7	172.2	74.5	-5.3	0	0	0	112.8	G280 N281 D324 G325 L326	G280-N322 VanDerWaalsContact O-CA 3.32Å; G280-N322 WeakPolarHBondContact O-CA 3.4Å; N281-N322 WeakPolarHBondContact OD1-CB 3.27Å; N281-N322 PolarHBondContact OD1-ND2 3.37Å; N322-D324 PolarHBondContact O-N 3.05Å; N322-D324 WeakPolarHBondContact OD1-CA 3.43Å; N322-D324 WeakPolarHBondContact OD1-CB 3.35Å; N322-D324 PolarHBondContact OD1-N 3.34Å; N322-D324 VanDerWaalsContact OD1-N 3.13Å; N322-G325 WeakPolarHBondContact O-CA 3.29Å; N322-G325 PolarHBondContact O-N 3.42Å; N322-G325 PolarHBondContact OD1-N 3.03Å; N322-L326 PolarHBondContact N-O 3.48Å; N322-L326 WeakPolarHBondContact OD1-CB 3.47Å; N322-L326 PolarHBondContact OD1-N 3.13Å; N322-L326 PolarHBondContact OD1-O 3.4Å
323	N	94.9	Very high	90.9	Very high	120 Å²	120	36.1 Å²	36.1	64%	0.642	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.6	-178.7	-66.1	-10.6	0	0	0	113.4	S278 R279 G325	S278-N323 PolarHBondContact O-ND2 2.85Å; R279-N323 VanDerWaalsContact C-CG 3.49Å; R279-N323 VanDerWaalsContact O-CB 3.31Å; R279-N323 WeakPolarHBondContact O-CB 3.41Å; R279-N323 PolarHBondContact O-N 2.18Å; R279-N323 VanDerWaalsContact O-N 3.12Å; R279-N323 PolarHBondContact O-ND2 3.43Å; N323-G325 PolarHBondContact O-N 3.05Å
324	D	89.9	Confident	91.4	Very high	104 Å²	104	39.6 Å²	39.6	56%	0.556	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.8	170.8	-86.5	1.5	0	0	0	112.9	N322 L326 K334	N322-D324 PolarHBondContact O-N 3.05Å; N322-D324 WeakPolarHBondContact OD1-CA 3.43Å; N322-D324 WeakPolarHBondContact OD1-CB 3.35Å; N322-D324 PolarHBondContact OD1-N 3.34Å; N322-D324 VanDerWaalsContact OD1-N 3.13Å; D324-L326 VanDerWaalsContact C-N 3.34Å; D324-L326 HydrophobicContact CB-CD1 3.71Å; D324-L326 HydrophobicContact CB-CG 3.82Å; D324-K334 IonicContact OD2-NZ 2.74Å; D324-K334 PolarHBondContact OD2-NZ 3.49Å
325	G	92.8	Very high	91.8	Very high	24 Å²	24	39.1 Å²	39.1	25%	0.247	20%	0.197	C	C	.	.	S	Bend	trans	76.6	16.7	-175.3	0	0	0	0	0	114.6	R321 N322 N323	R321-G325 VanDerWaalsContact CD-O 3.29Å; R321-G325 WeakPolarHBondContact CD-O 3.46Å; R321-G325 PolarHBondContact NH1-O 3.4Å; N322-G325 WeakPolarHBondContact O-CA 3.29Å; N322-G325 PolarHBondContact O-N 3.42Å; N322-G325 PolarHBondContact OD1-N 3.03Å; N323-G325 PolarHBondContact O-N 3.05Å
326	L	94.4	Very high	92.2	Very high	3 Å²	3	36 Å²	36	2%	0.016	19%	0.185	C	C	.	.			trans	-97.9	140.9	-176.2	-54.7	168.7	0	0	0	111.4	H285 R321 N322 D324 Q330 L331 K334 N385 I390	H285-L326 PolarHBondContact NE2-O 3.22Å; H285-L326 VanDerWaalsContact NE2-O 3.11Å; R321-L326 CarbonylContact C-O 3.49Å; R321-L326 VanDerWaalsContact CA-O 3.24Å; R321-L326 WeakPolarHBondContact CA-O 3.36Å; N322-L326 PolarHBondContact N-O 3.48Å; N322-L326 WeakPolarHBondContact OD1-CB 3.47Å; N322-L326 PolarHBondContact OD1-N 3.13Å; N322-L326 PolarHBondContact OD1-O 3.4Å; D324-L326 VanDerWaalsContact C-N 3.34Å; D324-L326 HydrophobicContact CB-CD1 3.71Å; D324-L326 HydrophobicContact CB-CG 3.82Å; L326-Q330 HydrophobicContact CB-CB 4.21Å; L326-Q330 HydrophobicContact CD2-CB 4.01Å; L326-L331 HydrophobicContact CD1-CD1 4.11Å; L326-K334 HydrophobicContact CD1-CD 3.41Å; L326-K334 VanDerWaalsContact CD1-CD 3.41Å; L326-N385 VanDerWaalsContact CD2-ND2 3.27Å; L326-N385 WeakPolarHBondContact CD2-ND2 3.39Å; L326-I390 HydrophobicContact CD2-CD1 4.37Å
327	T	94.2	Very high	92.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	17%	0.165	C	C	.	.			trans	-81.8	166	163	56.9	0	0	0	0	111.3	H285 R321 L329 Q330 L331	H285-T327 VanDerWaalsContact NE2-C 3.34Å; R321-T327 HydrophobicContact CG-CG2 4.04Å; T327-L329 PolarHBondContact O-N 3.26Å; T327-L329 VanDerWaalsContact O-N 3.16Å; T327-Q330 PolarHBondContact O-N 2.92Å; T327-Q330 WeakPolarHBondContact OG1-CG 3.44Å; T327-Q330 PolarHBondContact OG1-N 3.42Å; T327-Q330 PolarHBondContact OG1-OE1 2.97Å; T327-L331 PolarHBondContact O-N 3.05Å
328	P	94.7	Very high	92.5	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-34.7	177.5	-24	32.8	0	0	0	113.1	L284 H285 E318 L331 A332	L284-P328 HydrophobicContact CB-CB 4.07Å; L284-P328 HydrophobicContact CB-CG 3.88Å; H285-P328 VanDerWaalsContact CE1-CD 3.45Å; H285-P328 WeakPolarHBondContact CE1-CD 3.3Å; H285-P328 WeakPolarHBondContact NE2-CD 3.39Å; E318-P328 WeakPolarHBondContact O-CD 3.38Å; P328-L331 PolarHBondContact O-N 3.05Å; P328-A332 PolarHBondContact O-N 3.16Å
329	L	94.8	Very high	92.5	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-45.3	175.9	-178.7	72.2	0	0	0	112.2	T327 L331 A332 A333 L341 I344 L345 V379 V387	T327-L329 PolarHBondContact O-N 3.26Å; T327-L329 VanDerWaalsContact O-N 3.16Å; L329-L331 VanDerWaalsContact C-N 3.34Å; L329-A332 PolarHBondContact O-N 3.4Å; L329-A333 PolarHBondContact O-N 2.71Å; L329-A333 VanDerWaalsContact O-N 3.15Å; L329-L341 HydrophobicContact CD1-CD1 3.53Å; L329-L341 HydrophobicContact CG-CD1 4.44Å; L329-I344 HydrophobicContact CD1-CB 4.22Å; L329-I344 HydrophobicContact CD1-CG2 3.73Å; L329-L345 HydrophobicContact CD1-CD2 4.05Å; L329-L345 HydrophobicContact CD1-CG 4.26Å; L329-V379 HydrophobicContact CD2-CG2 4.29Å; L329-V387 HydrophobicContact CD2-CG2 3.74Å; L329-V387 HydrophobicContact CG-CG2 3.67Å
330	Q	94.6	Very high	92.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.2	-32.8	176	-72.2	161.9	-50.8	0	0	111.6	L326 T327 A333 K334 N385 V387 I390	L326-Q330 HydrophobicContact CB-CB 4.21Å; L326-Q330 HydrophobicContact CD2-CB 4.01Å; T327-Q330 PolarHBondContact O-N 2.92Å; T327-Q330 WeakPolarHBondContact OG1-CG 3.44Å; T327-Q330 PolarHBondContact OG1-N 3.42Å; T327-Q330 PolarHBondContact OG1-OE1 2.97Å; Q330-A333 WeakPolarHBondContact O-CB 3.49Å; Q330-A333 PolarHBondContact O-N 3.36Å; Q330-K334 WeakPolarHBondContact O-CB 3.46Å; Q330-K334 PolarHBondContact O-N 2.99Å; Q330-N385 PolarHBondContact NE2-O 3.08Å; Q330-V387 HydrophobicContact CG-CG2 4.39Å; Q330-I390 HydrophobicContact CB-CD1 3.75Å; Q330-I390 HydrophobicContact CG-CD1 3.93Å
331	L	94.4	Very high	92.5	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-66.4	-44.1	174.1	-173.8	63.5	0	0	0	111.4	H285 V288 T289 L326 T327 P328 L329 A333 K334 M335	H285-L331 HydrophobicContact CB-CD2 3.83Å; V288-L331 HydrophobicContact CG1-CB 4.33Å; V288-L331 HydrophobicContact CG1-CD2 4.26Å; V288-L331 HydrophobicContact CG1-CG 4.08Å; T289-L331 HydrophobicContact CG2-CD2 4.12Å; L326-L331 HydrophobicContact CD1-CD1 4.11Å; T327-L331 PolarHBondContact O-N 3.05Å; P328-L331 PolarHBondContact O-N 3.05Å; L329-L331 VanDerWaalsContact C-N 3.34Å; L331-A333 VanDerWaalsContact C-N 3.25Å; L331-A333 PolarHBondContact O-N 3.11Å; L331-K334 PolarHBondContact O-N 3.49Å; L331-M335 HydrophobicContact CD1-CE 3.87Å; L331-M335 HydrophobicContact CD1-CG 4.16Å; L331-M335 HydrophobicContact CD1-SD 4.06Å; L331-M335 HydrophobicContact CD2-CE 4.44Å; L331-M335 HydrophobicContact CD2-SD 4.37Å; L331-M335 HydrophobicContact CG-CE 4.3Å; L331-M335 HydrophobicContact CG-CG 4.4Å; L331-M335 HydrophobicContact CG-SD 3.97Å; L331-M335 WeakPolarHBondContact O-CB 3.46Å; L331-M335 PolarHBondContact O-N 2.99Å
332	A	93.4	Very high	92.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-38.6	174.9	0	0	0	0	0	111.6	V288 P328 L329 G336 K337 I340 L341	V288-A332 HydrophobicContact CG1-CB 3.77Å; V288-A332 HydrophobicContact CG2-CB 4.31Å; P328-A332 PolarHBondContact O-N 3.16Å; L329-A332 PolarHBondContact O-N 3.4Å; A332-G336 PolarHBondContact O-N 3.21Å; A332-G336 VanDerWaalsContact O-N 3.14Å; A332-K337 PolarHBondContact O-N 3.13Å; A332-I340 HydrophobicContact CB-CG2 4.12Å; A332-L341 HydrophobicContact CB-CB 4.39Å
333	A	92.8	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-39.8	172.4	0	0	0	0	0	113.2	L329 Q330 L331 V387 I390 T391	L329-A333 PolarHBondContact O-N 2.71Å; L329-A333 VanDerWaalsContact O-N 3.15Å; Q330-A333 WeakPolarHBondContact O-CB 3.49Å; Q330-A333 PolarHBondContact O-N 3.36Å; L331-A333 VanDerWaalsContact C-N 3.25Å; L331-A333 PolarHBondContact O-N 3.11Å; A333-V387 HydrophobicContact CB-CG1 4.02Å; A333-I390 HydrophobicContact CB-CB 4.26Å; A333-I390 HydrophobicContact CB-CG2 3.9Å; A333-T391 HydrophobicContact CB-CG2 3.95Å
334	K	92.1	Very high	92.2	Very high	89 Å²	89	25.2 Å²	25.2	39%	0.387	13%	0.126	S	C	.	.	H	α-helix	trans	-73.1	-28.7	179.2	-175.3	178.5	175.2	179.2	0	113.1	D324 L326 Q330 L331 I390 N394	D324-K334 IonicContact OD2-NZ 2.74Å; D324-K334 PolarHBondContact OD2-NZ 3.49Å; L326-K334 HydrophobicContact CD1-CD 3.41Å; L326-K334 VanDerWaalsContact CD1-CD 3.41Å; Q330-K334 WeakPolarHBondContact O-CB 3.46Å; Q330-K334 PolarHBondContact O-N 2.99Å; L331-K334 PolarHBondContact O-N 3.49Å; K334-I390 HydrophobicContact CB-CG2 4.03Å; K334-N394 PolarHBondContact O-ND2 3.34Å
335	M	89.2	Confident	92.3	Very high	78 Å²	78	20.6 Å²	20.6	38%	0.384	10%	0.101	S	C	.	.	H	α-helix	trans	-93	-7	179	-71.1	-176.1	161.5	0	0	114.3	V288 T289 L331 K337	V288-M335 HydrophobicContact CG1-SD 4.44Å; T289-M335 HydrophobicContact CG2-CE 3.51Å; T289-M335 HydrophobicContact CG2-SD 3.85Å; L331-M335 HydrophobicContact CD1-CE 3.87Å; L331-M335 HydrophobicContact CD1-CG 4.16Å; L331-M335 HydrophobicContact CD1-SD 4.06Å; L331-M335 HydrophobicContact CD2-CE 4.44Å; L331-M335 HydrophobicContact CD2-SD 4.37Å; L331-M335 HydrophobicContact CG-CE 4.3Å; L331-M335 HydrophobicContact CG-CG 4.4Å; L331-M335 HydrophobicContact CG-SD 3.97Å; L331-M335 WeakPolarHBondContact O-CB 3.46Å; L331-M335 PolarHBondContact O-N 2.99Å; M335-K337 HydrophobicContact CB-CG 3.91Å
336	G	90	Very high	92.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.01	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	10	178.7	0	0	0	0	0	115.5	D293 A332 A338 N399	D293-G336 VanDerWaalsContact OD1-O 3.07Å; A332-G336 PolarHBondContact O-N 3.21Å; A332-G336 VanDerWaalsContact O-N 3.14Å; G336-A338 VanDerWaalsContact C-N 3.31Å; G336-A338 PolarHBondContact O-N 2.97Å; G336-N399 PolarHBondContact O-ND2 3.26Å; G336-N399 PolarHBondContact O-OD1 3.4Å; G336-N399 VanDerWaalsContact O-OD1 3.08Å
337	K	90.8	Very high	91.9	Very high	28 Å²	28	21.5 Å²	21.5	12%	0.122	10%	0.104	C	C	.	.			trans	-75.7	78.9	-170.8	-55.4	-56.5	-175.9	168.3	0	112	A291 D293 A332 M335 E339 I340 L341	A291-K337 VanDerWaalsContact O-CD 3.3Å; A291-K337 WeakPolarHBondContact O-CD 3.47Å; A291-K337 WeakPolarHBondContact O-CE 3.47Å; A291-K337 PolarHBondContact O-NZ 3.14Å; D293-K337 WeakPolarHBondContact OD1-CA 3.32Å; D293-K337 WeakPolarHBondContact OD1-CD 3.42Å; D293-K337 WeakPolarHBondContact OD2-CD 3.34Å; D293-K337 IonicContact OD2-NZ 3.49Å; D293-K337 PolarHBondContact OD2-NZ 3.48Å; A332-K337 PolarHBondContact O-N 3.13Å; M335-K337 HydrophobicContact CB-CG 3.91Å; K337-E339 PolarHBondContact O-N 2.67Å; K337-I340 HydrophobicContact CB-CG2 3.48Å; K337-I340 VanDerWaalsContact CB-CG2 3.48Å; K337-I340 WeakPolarHBondContact O-CG2 3.4Å; K337-I340 PolarHBondContact O-N 3.05Å; K337-L341 VanDerWaalsContact O-CB 3.27Å; K337-L341 WeakPolarHBondContact O-CB 3.38Å; K337-L341 PolarHBondContact O-N 2.61Å
338	A	89.4	Confident	91.6	Very high	9 Å²	9	24.2 Å²	24.2	7%	0.074	12%	0.116	C	C	.	.	H	α-helix	trans	-62	-39.7	-169.2	0	0	0	0	0	113.5	G336 K342 M403	G336-A338 VanDerWaalsContact C-N 3.31Å; G336-A338 PolarHBondContact O-N 2.97Å; A338-K342 VanDerWaalsContact O-CB 3.22Å; A338-K342 WeakPolarHBondContact O-CB 3.49Å; A338-K342 PolarHBondContact O-N 2.76Å; A338-M403 HydrophobicContact CB-CG 3.8Å
339	E	89.1	Confident	91.1	Very high	22 Å²	22	25.1 Å²	25.1	10%	0.103	12%	0.121	C	C	.	.	H	α-helix	trans	-71.2	-39.6	-177.6	-83.3	-68.8	159.3	0	0	113.4	K295 N298 K302 K337 Y343	K295-E339 HydrophobicContact CG-CG 4.47Å; N298-E339 HydrophobicContact CB-CB 4.49Å; N298-E339 WeakPolarHBondContact ND2-CB 3.29Å; K302-E339 IonicContact NZ-OE2 3.76Å; K302-E339 PolarHBondContact NZ-OE2 2.73Å; K337-E339 PolarHBondContact O-N 2.67Å; E339-Y343 WeakPolarHBondContact O-CB 3.43Å; E339-Y343 PolarHBondContact O-N 3.21Å
340	I	91.1	Very high	90.4	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-75.3	-35	174.1	-166.8	64.5	0	0	0	111	V288 A291 V301 K302 Y305 A332 K337 Y343 I344	V288-I340 HydrophobicContact CG2-CG1 4.42Å; A291-I340 HydrophobicContact CB-CB 4.41Å; A291-I340 HydrophobicContact CB-CG2 4.17Å; V301-I340 HydrophobicContact CG1-CD1 4.4Å; K302-I340 HydrophobicContact CG-CD1 4.19Å; Y305-I340 HydrophobicContact CD2-CD1 4.28Å; A332-I340 HydrophobicContact CB-CG2 4.12Å; K337-I340 HydrophobicContact CB-CG2 3.48Å; K337-I340 VanDerWaalsContact CB-CG2 3.48Å; K337-I340 WeakPolarHBondContact O-CG2 3.4Å; K337-I340 PolarHBondContact O-N 3.05Å; I340-Y343 HydrophobicContact CD1-CD1 4.29Å; I340-Y343 WeakPolarHBondContact O-CB 3.49Å; I340-Y343 PolarHBondContact O-N 2.95Å; I340-I344 HydrophobicContact CG1-CD1 4.12Å; I340-I344 HydrophobicContact CG1-CG1 4.48Å; I340-I344 VanDerWaalsContact O-CG1 3.32Å; I340-I344 WeakPolarHBondContact O-CG1 3.48Å; I340-I344 PolarHBondContact O-N 3.29Å
341	L	92.6	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-45.7	173.2	179.7	62.1	0	0	0	111.7	L329 A332 K337 Y343 I344 L345 V387 T391 M403 L406	L329-L341 HydrophobicContact CD1-CD1 3.53Å; L329-L341 HydrophobicContact CG-CD1 4.44Å; A332-L341 HydrophobicContact CB-CB 4.39Å; K337-L341 VanDerWaalsContact O-CB 3.27Å; K337-L341 WeakPolarHBondContact O-CB 3.38Å; K337-L341 PolarHBondContact O-N 2.61Å; L341-Y343 VanDerWaalsContact C-N 3.29Å; L341-Y343 PolarHBondContact O-N 3.04Å; L341-I344 PolarHBondContact O-N 2.94Å; L341-L345 HydrophobicContact CD1-CD1 3.94Å; L341-L345 HydrophobicContact CD1-CG 4.17Å; L341-L345 HydrophobicContact CG-CD1 3.99Å; L341-L345 WeakPolarHBondContact O-CB 3.38Å; L341-L345 VanDerWaalsContact O-CG 3.32Å; L341-L345 WeakPolarHBondContact O-CG 3.5Å; L341-L345 PolarHBondContact O-N 3.28Å; L341-V387 HydrophobicContact CD1-CG1 4.29Å; L341-T391 HydrophobicContact CD2-CG2 4.45Å; L341-M403 HydrophobicContact CD2-CE 3.47Å; L341-M403 VanDerWaalsContact CD2-CE 3.47Å; L341-L406 HydrophobicContact CD2-CD1 4.09Å; L341-L406 HydrophobicContact CG-CD1 4.03Å
342	K	91.6	Very high	88.8	Confident	103 Å²	103	43.5 Å²	43.5	45%	0.448	20%	0.202	S	C	.	.	H	α-helix	trans	-55.5	-45.9	171.2	179.6	176.5	177.2	-174.2	0	111.2	A338 S346 L406	A338-K342 VanDerWaalsContact O-CB 3.22Å; A338-K342 WeakPolarHBondContact O-CB 3.49Å; A338-K342 PolarHBondContact O-N 2.76Å; K342-S346 VanDerWaalsContact O-CB 3.3Å; K342-S346 WeakPolarHBondContact O-CB 3.26Å; K342-S346 PolarHBondContact O-N 2.87Å; K342-S346 PolarHBondContact O-OG 2.73Å; K342-L406 HydrophobicContact CB-CD1 4.41Å; K342-L406 HydrophobicContact CB-CD2 3.57Å; K342-L406 HydrophobicContact CD-CD2 3.98Å; K342-L406 HydrophobicContact CG-CD2 3.68Å
343	Y	91	Very high	88.2	Confident	52 Å²	52	53.2 Å²	53.2	20%	0.204	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-55.4	179.5	-174.9	-105.5	0	0	0	111.7	K302 D306 E339 I340 L341 L345 S346 R347	K302-Y343 HydrophobicContact CB-CD1 4.38Å; K302-Y343 HydrophobicContact CB-CG 4.36Å; K302-Y343 HydrophobicContact CD-CD2 4.39Å; K302-Y343 HydrophobicContact CD-CG 4.33Å; K302-Y343 HydrophobicContact CG-CD1 4.24Å; K302-Y343 HydrophobicContact CG-CD2 4.33Å; K302-Y343 HydrophobicContact CG-CG 3.9Å; D306-Y343 VanDerWaalsContact OD1-CE1 3.23Å; D306-Y343 WeakPolarHBondContact OD1-CE1 3.44Å; D306-Y343 VanDerWaalsContact OD1-CZ 3.25Å; D306-Y343 PolarHBondContact OD1-OH 3.33Å; D306-Y343 PolarHBondContact OD2-OH 3.37Å; E339-Y343 WeakPolarHBondContact O-CB 3.43Å; E339-Y343 PolarHBondContact O-N 3.21Å; I340-Y343 HydrophobicContact CD1-CD1 4.29Å; I340-Y343 WeakPolarHBondContact O-CB 3.49Å; I340-Y343 PolarHBondContact O-N 2.95Å; L341-Y343 VanDerWaalsContact C-N 3.29Å; L341-Y343 PolarHBondContact O-N 3.04Å; Y343-L345 PolarHBondContact O-N 3.01Å; Y343-S346 PolarHBondContact O-N 2.91Å; Y343-S346 PolarHBondContact O-OG 3.21Å; Y343-R347 PolarHBondContact O-N 3.42Å
344	I	92.4	Very high	87.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-46	-180	-61.5	162.2	0	0	0	111.2	Y305 L329 I340 L341 S346 R359	Y305-I344 HydrophobicContact CE1-CG1 4.21Å; Y305-I344 HydrophobicContact CE2-CD1 4.1Å; Y305-I344 HydrophobicContact CE2-CG1 4.41Å; L329-I344 HydrophobicContact CD1-CB 4.22Å; L329-I344 HydrophobicContact CD1-CG2 3.73Å; I340-I344 HydrophobicContact CG1-CD1 4.12Å; I340-I344 HydrophobicContact CG1-CG1 4.48Å; I340-I344 VanDerWaalsContact O-CG1 3.32Å; I340-I344 WeakPolarHBondContact O-CG1 3.48Å; I340-I344 PolarHBondContact O-N 3.29Å; L341-I344 PolarHBondContact O-N 2.94Å; I344-S346 VanDerWaalsContact C-N 3.33Å; I344-S346 PolarHBondContact O-N 3.26Å; I344-R359 WeakPolarHBondContact O-CD 3.45Å
345	L	92.1	Very high	87.2	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-67.2	-29.6	-179	-70.9	174.6	0	0	0	113.9	L329 L341 Y343 Y374 V379 L406 P408	L329-L345 HydrophobicContact CD1-CD2 4.05Å; L329-L345 HydrophobicContact CD1-CG 4.26Å; L341-L345 HydrophobicContact CD1-CD1 3.94Å; L341-L345 HydrophobicContact CD1-CG 4.17Å; L341-L345 HydrophobicContact CG-CD1 3.99Å; L341-L345 WeakPolarHBondContact O-CB 3.38Å; L341-L345 VanDerWaalsContact O-CG 3.32Å; L341-L345 WeakPolarHBondContact O-CG 3.5Å; L341-L345 PolarHBondContact O-N 3.28Å; Y343-L345 PolarHBondContact O-N 3.01Å; L345-Y374 WeakPolarHBondContact O-CD1 3.47Å; L345-V379 HydrophobicContact CD2-CG2 3.78Å; L345-L406 HydrophobicContact CD1-CD1 4.15Å; L345-P408 HydrophobicContact CB-CG 4.37Å; L345-P408 HydrophobicContact CD1-CG 4.3Å
346	S	90.1	Very high	86.9	Confident	44 Å²	44	49.3 Å²	49.3	31%	0.308	22%	0.223	S	C	.	.	H	α-helix	trans	-99.5	1.1	-177.3	67.8	0	0	0	0	114.8	K342 Y343 I344 E348 K360	K342-S346 VanDerWaalsContact O-CB 3.3Å; K342-S346 WeakPolarHBondContact O-CB 3.26Å; K342-S346 PolarHBondContact O-N 2.87Å; K342-S346 PolarHBondContact O-OG 2.73Å; Y343-S346 PolarHBondContact O-N 2.91Å; Y343-S346 PolarHBondContact O-OG 3.21Å; I344-S346 VanDerWaalsContact C-N 3.33Å; I344-S346 PolarHBondContact O-N 3.26Å; S346-E348 PolarHBondContact O-N 3.03Å; S346-K360 WeakPolarHBondContact O-CB 3.19Å
347	R	89.9	Confident	86.7	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.008	22%	0.223	C	C	.	.			trans	-58.2	120.9	-175.2	-175	175.3	63.3	-128.4	-0.6	111.9	E318 Y343 I349 L357 S358 R359 K360	E318-R347 VanDerWaalsContact CD-NH2 3.32Å; E318-R347 IonicContact OE1-CZ 3.79Å; E318-R347 IonicContact OE1-NH1 3.56Å; E318-R347 PolarHBondContact OE1-NH1 3.49Å; E318-R347 IonicContact OE1-NH2 2.74Å; E318-R347 PolarHBondContact OE1-NH2 3.38Å; E318-R347 IonicContact OE2-NH2 3.53Å; E318-R347 PolarHBondContact OE2-NH2 3.23Å; Y343-R347 PolarHBondContact O-N 3.42Å; R347-I349 HydrophobicContact CG-CD1 4.49Å; R347-I349 HydrophobicContact CG-CG1 4.21Å; R347-L357 VanDerWaalsContact CZ-O 3.31Å; R347-L357 PolarHBondContact NE-O 3.24Å; R347-L357 PolarHBondContact NH2-O 2.95Å; R347-S358 PolarHBondContact O-OG 2.85Å; R347-R359 PolarHBondContact O-N 3.38Å; R347-K360 PolarHBondContact O-N 2.92Å
348	E	87.4	Confident	86.6	Confident	58 Å²	58	48.1 Å²	48.1	27%	0.271	22%	0.218	S	C	.	.			trans	-123.1	101.8	-179	-164.2	-162.7	171.7	0	0	110.9	S346 K350 S358 K360 T362	S346-E348 PolarHBondContact O-N 3.03Å; E348-K350 IonicContact OE1-NZ 2.75Å; E348-K350 PolarHBondContact OE1-NZ 3.05Å; E348-K350 WeakPolarHBondContact OE2-CE 3.26Å; E348-K350 IonicContact OE2-NZ 2.79Å; E348-K350 PolarHBondContact OE2-NZ 3.28Å; E348-S358 WeakPolarHBondContact CA-OG 3.41Å; E348-K360 HydrophobicContact CB-CB 4.34Å; E348-T362 WeakPolarHBondContact OE1-CG2 3.22Å; E348-T362 PolarHBondContact OE1-OG1 3.15Å; E348-T362 VanDerWaalsContact OE1-OG1 3.1Å
349	I	84.8	Confident	86.6	Confident	21 Å²	21	48.1 Å²	48.1	11%	0.108	22%	0.216	C	C	.	.			trans	-91.9	122.3	-179.9	-61.9	168.8	0	0	0	109.6	L310 R347 E351 L354 L357 S358	L310-I349 HydrophobicContact CD2-CD1 4.2Å; L310-I349 HydrophobicContact CD2-CG2 4.37Å; R347-I349 HydrophobicContact CG-CD1 4.49Å; R347-I349 HydrophobicContact CG-CG1 4.21Å; I349-E351 HydrophobicContact CG2-CB 4.32Å; I349-L354 HydrophobicContact CG2-CB 4.01Å; I349-L357 HydrophobicContact CD1-CB 3.63Å; I349-S358 PolarHBondContact N-OG 2.86Å
350	K	79	Confident	86.6	Confident	91 Å²	91	48.1 Å²	48.1	40%	0.396	22%	0.216	S	C	.	.			trans	-79.7	-27.8	-175.7	-56.9	-65.8	172.4	175.8	0	113.4	E348	E348-K350 IonicContact OE1-NZ 2.75Å; E348-K350 PolarHBondContact OE1-NZ 3.05Å; E348-K350 WeakPolarHBondContact OE2-CE 3.26Å; E348-K350 IonicContact OE2-NZ 2.79Å; E348-K350 PolarHBondContact OE2-NZ 3.28Å
351	E	80	Confident	86.4	Confident	120 Å²	120	48.5 Å²	48.5	56%	0.561	22%	0.217	S	C	*	.			trans	-68.1	131.6	179.9	-66.6	-172.8	-175	0	0	112.4	I349 R353 L354 R355	I349-E351 HydrophobicContact CG2-CB 4.32Å; E351-R353 PolarHBondContact O-N 3.42Å; E351-L354 PolarHBondContact O-N 2.95Å; E351-R355 PolarHBondContact O-N 3.03Å
352	K	77.1	Confident	86	Confident	186 Å²	186	49.1 Å²	49.1	81%	0.809	22%	0.221	S	C	*	.	S	Bend	trans	-64.3	-37.5	-177.6	-67.7	-173.6	177.3	-175.3	0	113.2	R355	K352-R355 WeakPolarHBondContact O-CB 3.43Å; K352-R355 PolarHBondContact O-N 3.43Å
353	R	79.2	Confident	85.4	Confident	203 Å²	203	44.3 Å²	44.3	77%	0.766	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-38.5	-178	-165.1	-175.8	85.6	103.4	-1.1	112.6	E351	E351-R353 PolarHBondContact O-N 3.42Å
354	L	82.1	Confident	84.8	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.063	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	10.2	-176.5	-61.1	179.2	0	0	0	112.7	L310 I349 E351 S356 L357	L310-L354 HydrophobicContact CB-CD1 4.41Å; L310-L354 HydrophobicContact CD2-CD1 3.67Å; I349-L354 HydrophobicContact CG2-CB 4.01Å; E351-L354 PolarHBondContact O-N 2.95Å; L354-S356 PolarHBondContact O-N 3.05Å; L354-L357 HydrophobicContact CB-CD1 4.33Å; L354-L357 HydrophobicContact CD2-CD1 4.1Å; L354-L357 WeakPolarHBondContact O-CB 3.01Å; L354-L357 PolarHBondContact O-N 3.1Å
355	R	82.5	Confident	84.2	Confident	40 Å²	40	45 Å²	45	15%	0.151	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-63.2	-26	-177.4	-178.9	171.1	-82.1	-155.7	-14.3	113.3	E351 K352 L357 S358 F361 V707 S731	E351-R355 PolarHBondContact O-N 3.03Å; K352-R355 WeakPolarHBondContact O-CB 3.43Å; K352-R355 PolarHBondContact O-N 3.43Å; R355-L357 PolarHBondContact O-N 3.24Å; R355-S358 WeakPolarHBondContact O-CB 3.47Å; R355-S358 PolarHBondContact O-N 2.77Å; R355-F361 HydrophobicContact CG-CD1 4.37Å; R355-F361 HydrophobicContact CG-CE1 4.03Å; R355-V707 HydrophobicContact CG-CG1 4.38Å; R355-S731 PolarHBondContact NH2-O 3.42Å
356	S	83	Confident	83.6	Confident	34 Å²	34	53 Å²	53	24%	0.238	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-63.2	-22.9	172.3	52.7	0	0	0	0	113.4	W315 L354 S358 R713	W315-S356 WeakPolarHBondContact CZ3-O 3.5Å; L354-S356 PolarHBondContact O-N 3.05Å; S356-S358 VanDerWaalsContact C-N 3.31Å; S356-R713 PolarHBondContact O-NH1 3.32Å; S356-R713 PolarHBondContact O-NH2 3.24Å
357	L	85.9	Confident	83.1	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-82.6	-8.3	174.2	-60.6	168.2	0	0	0	112.6	L309 W315 R347 I349 L354 R355	L309-L357 HydrophobicContact CD1-CD2 4.19Å; L309-L357 HydrophobicContact CG-CD1 4.35Å; L309-L357 HydrophobicContact CG-CD2 4.42Å; W315-L357 HydrophobicContact CE3-CD2 4.19Å; R347-L357 VanDerWaalsContact CZ-O 3.31Å; R347-L357 PolarHBondContact NE-O 3.24Å; R347-L357 PolarHBondContact NH2-O 2.95Å; I349-L357 HydrophobicContact CD1-CB 3.63Å; L354-L357 HydrophobicContact CB-CD1 4.33Å; L354-L357 HydrophobicContact CD2-CD1 4.1Å; L354-L357 WeakPolarHBondContact O-CB 3.01Å; L354-L357 PolarHBondContact O-N 3.1Å; R355-L357 PolarHBondContact O-N 3.24Å
358	S	88.8	Confident	82.8	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	25%	0.249	C	C	.	.			trans	-74.9	146.5	178.7	-154.4	0	0	0	0	111	R347 E348 I349 R355 S356 K360 F361	R347-S358 PolarHBondContact O-OG 2.85Å; E348-S358 WeakPolarHBondContact CA-OG 3.41Å; I349-S358 PolarHBondContact N-OG 2.86Å; R355-S358 WeakPolarHBondContact O-CB 3.47Å; R355-S358 PolarHBondContact O-N 2.77Å; S356-S358 VanDerWaalsContact C-N 3.31Å; S358-K360 PolarHBondContact OG-O 2.9Å; S358-F361 WeakPolarHBondContact O-CZ 3.46Å
359	R	88.8	Confident	82.6	Confident	9 Å²	9	53.1 Å²	53.1	3%	0.034	25%	0.25	C	S	.	.	S	Bend	trans	-115	-26.3	176.4	-76	173.3	173	-89.7	3.7	112.5	W315 E318 I344 R347 D375	W315-R359 HydrophobicContact CH2-CG 4.23Å; E318-R359 IonicContact OE2-CZ 3.74Å; E318-R359 VanDerWaalsContact OE2-CZ 3.25Å; E318-R359 IonicContact OE2-NE 3.87Å; E318-R359 PolarHBondContact OE2-NE 3.05Å; E318-R359 IonicContact OE2-NH2 3.93Å; E318-R359 PolarHBondContact OE2-NH2 3.34Å; I344-R359 WeakPolarHBondContact O-CD 3.45Å; R347-R359 PolarHBondContact O-N 3.38Å; R359-D375 HydrophobicContact CB-CB 4.38Å; R359-D375 HydrophobicContact CG-CB 4.47Å; R359-D375 PolarHBondContact O-N 2.95Å
360	K	89.9	Confident	82.6	Confident	23 Å²	23	53.2 Å²	53.2	10%	0.1	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.9	165.2	-175.4	170.8	-174.3	156.4	0	109.3	S346 R347 E348 S358 S372 Y374 E407 E720	S346-K360 WeakPolarHBondContact O-CB 3.19Å; R347-K360 PolarHBondContact O-N 2.92Å; E348-K360 HydrophobicContact CB-CB 4.34Å; S358-K360 PolarHBondContact OG-O 2.9Å; K360-S372 WeakPolarHBondContact CE-OG 3.35Å; K360-S372 PolarHBondContact NZ-OG 2.99Å; K360-Y374 HydrophobicContact CB-CD1 4.36Å; K360-Y374 HydrophobicContact CB-CE1 4.16Å; K360-Y374 HydrophobicContact CD-CE1 3.92Å; K360-Y374 HydrophobicContact CD-CE2 4.47Å; K360-Y374 WeakPolarHBondContact CE-OH 3.15Å; K360-Y374 HydrophobicContact CG-CE1 4.09Å; K360-Y374 PolarHBondContact NZ-OH 3.15Å; K360-E407 IonicContact NZ-OE2 3.98Å; K360-E720 WeakPolarHBondContact CE-OE1 3.2Å; K360-E720 IonicContact NZ-OE1 2.86Å; K360-E720 PolarHBondContact NZ-OE1 3.39Å; K360-E720 IonicContact NZ-OE2 2.65Å
361	F	86.1	Confident	83	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.3	171.7	-51.6	-84.7	0	0	0	109	R355 S358 D363 S372 L373 V707	R355-F361 HydrophobicContact CG-CD1 4.37Å; R355-F361 HydrophobicContact CG-CE1 4.03Å; S358-F361 WeakPolarHBondContact O-CZ 3.46Å; F361-D363 PolarHBondContact O-N 2.86Å; F361-S372 CarbonylContact O-C 3.57Å; F361-S372 WeakPolarHBondContact O-CA 3.37Å; F361-L373 HydrophobicContact CB-CB 4.31Å; F361-L373 PolarHBondContact N-O 2.95Å; F361-L373 PolarHBondContact O-N 2.91Å; F361-V707 HydrophobicContact CD1-CG1 4.3Å; F361-V707 HydrophobicContact CD2-CG2 4.33Å; F361-V707 HydrophobicContact CE1-CB 4.31Å; F361-V707 HydrophobicContact CE1-CG1 3.34Å; F361-V707 HydrophobicContact CE1-CG2 4.04Å; F361-V707 HydrophobicContact CE2-CG1 4.42Å; F361-V707 HydrophobicContact CE2-CG2 3.75Å; F361-V707 HydrophobicContact CZ-CB 4.17Å; F361-V707 HydrophobicContact CZ-CG1 3.43Å; F361-V707 VanDerWaalsContact CZ-CG1 3.43Å; F361-V707 HydrophobicContact CZ-CG2 3.58Å
362	T	84.6	Confident	83.3	Confident	14 Å²	14	43.2 Å²	43.2	9%	0.086	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	112.2	169	50.7	0	0	0	0	109.2	E348 V730 L733	E348-T362 WeakPolarHBondContact OE1-CG2 3.22Å; E348-T362 PolarHBondContact OE1-OG1 3.15Å; E348-T362 VanDerWaalsContact OE1-OG1 3.1Å; T362-V730 VanDerWaalsContact CB-CG1 3.46Å; T362-V730 HydrophobicContact CG2-CG1 3.87Å; T362-V730 WeakPolarHBondContact OG1-CG1 2.97Å; T362-L733 PolarHBondContact O-N 3.39Å
363	D	78.9	Confident	83.9	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.011	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-61.6	-178.5	-167.2	9	0	0	0	110	F361 S371 L373 R717 L733 N734	F361-D363 PolarHBondContact O-N 2.86Å; D363-S371 WeakPolarHBondContact CB-O 3.46Å; D363-S371 PolarHBondContact N-O 3.22Å; D363-L373 HydrophobicContact CB-CD1 3.86Å; D363-L373 HydrophobicContact CB-CG 4.23Å; D363-R717 IonicContact OD2-CZ 2.64Å; D363-R717 VanDerWaalsContact OD2-CZ 3.23Å; D363-R717 IonicContact OD2-NH1 3.65Å; D363-R717 PolarHBondContact OD2-NH1 3.02Å; D363-R717 IonicContact OD2-NH2 3.23Å; D363-R717 PolarHBondContact OD2-NH2 2.97Å; D363-L733 PolarHBondContact O-N 3.19Å; D363-N734 PolarHBondContact O-N 2.74Å; D363-N734 VanDerWaalsContact O-N 3.12Å; D363-N734 PolarHBondContact OD1-ND2 3.48Å
364	W	79	Confident	84.5	Confident	41 Å²	41	25.1 Å²	25.1	16%	0.155	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.1	170.9	61.3	-95.5	0	0	0	109.8	V369 S371 P737	W364-V369 HydrophobicContact CH2-CG1 3.67Å; W364-V369 HydrophobicContact CZ3-CB 4.31Å; W364-V369 HydrophobicContact CZ3-CG1 3.9Å; W364-S371 VanDerWaalsContact CE2-CB 3.5Å; W364-S371 VanDerWaalsContact NE1-CB 3.33Å; W364-S371 PolarHBondContact O-N 3.05Å; W364-P737 HydrophobicContact CD2-CB 4.24Å; W364-P737 HydrophobicContact CE3-CB 4.12Å
365	A	79.6	Confident	84.9	Confident	26 Å²	26	24.8 Å²	24.8	22%	0.215	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	138.4	167.9	0	0	0	0	0	110.6	V369 V730 F732	A365-V369 CarbonylContact C-O 3.59Å; A365-V369 WeakPolarHBondContact CA-O 3.43Å; A365-V730 HydrophobicContact CB-CG1 4.46Å; A365-V730 HydrophobicContact CB-CG2 4.42Å; A365-F732 HydrophobicContact CB-CE1 3.94Å; A365-F732 VanDerWaalsContact N-CE1 3.31Å
366	Y	78.3	Confident	85.2	Confident	174 Å²	174	23.2 Å²	23.2	68%	0.682	13%	0.127	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134	102	180	-174.4	-94.3	0	0	0	109.5	V369	Y366-V369 PolarHBondContact N-O 3.39Å; Y366-V369 PolarHBondContact O-N 2.83Å; Y366-V369 VanDerWaalsContact O-N 3.11Å
367	G	80.5	Confident	85.4	Confident	40 Å²	40	24 Å²	24	41%	0.412	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	-122.5	-174.3	0	0	0	0	0	111.5	V369	G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.05Å
368	P	82.8	Confident	85.5	Confident	19 Å²	19	25.8 Å²	25.8	12%	0.123	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.2	-179.8	34.1	-36.8	0	0	0	114.2	V721 K722 W723	P368-V721 CarbonylContact O-C 3.54Å; P368-V721 WeakPolarHBondContact O-CA 3.44Å; P368-K722 PolarHBondContact O-N 2.55Å; P368-W723 HydrophobicContact CB-CD2 4.15Å; P368-W723 HydrophobicContact CB-CE3 4.05Å; P368-W723 HydrophobicContact CG-CD2 4.23Å; P368-W723 HydrophobicContact CG-CE3 3.84Å; P368-W723 HydrophobicContact CG-CH2 4.15Å; P368-W723 HydrophobicContact CG-CZ3 3.8Å
369	V	84	Confident	85.7	Confident	48 Å²	48	25.7 Å²	25.7	29%	0.291	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.8	-177.5	-172.6	0	0	0	0	109.9	W364 A365 Y366 G367 V721	W364-V369 HydrophobicContact CH2-CG1 3.67Å; W364-V369 HydrophobicContact CZ3-CB 4.31Å; W364-V369 HydrophobicContact CZ3-CG1 3.9Å; A365-V369 CarbonylContact C-O 3.59Å; A365-V369 WeakPolarHBondContact CA-O 3.43Å; Y366-V369 PolarHBondContact N-O 3.39Å; Y366-V369 PolarHBondContact O-N 2.83Å; Y366-V369 VanDerWaalsContact O-N 3.11Å; G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.05Å; V369-V721 HydrophobicContact CG1-CG2 4.35Å; V369-V721 HydrophobicContact CG2-CG1 4.4Å; V369-V721 HydrophobicContact CG2-CG2 4.24Å
370	S	84.6	Confident	85.7	Confident	23 Å²	23	25.6 Å²	25.6	16%	0.161	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.9	175.6	59.2	0	0	0	0	112.5	N719 E720	S370-N719 CarbonylContact O-C 3.54Å; S370-N719 WeakPolarHBondContact O-CA 2.91Å; S370-E720 PolarHBondContact N-O 3.24Å; S370-E720 PolarHBondContact O-N 3.03Å
371	S	86.8	Confident	85.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109.8	172	169.5	0	0	0	0	109.2	D363 W364 R717	D363-S371 WeakPolarHBondContact CB-O 3.46Å; D363-S371 PolarHBondContact N-O 3.22Å; W364-S371 VanDerWaalsContact CE2-CB 3.5Å; W364-S371 VanDerWaalsContact NE1-CB 3.33Å; W364-S371 PolarHBondContact O-N 3.05Å; S371-R717 PolarHBondContact OG-NH1 3.45Å
372	S	87.9	Confident	85.3	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.4	175	-64.5	0	0	0	0	111.1	K360 F361 R717 I718 E720	K360-S372 WeakPolarHBondContact CE-OG 3.35Å; K360-S372 PolarHBondContact NZ-OG 2.99Å; F361-S372 CarbonylContact O-C 3.57Å; F361-S372 WeakPolarHBondContact O-CA 3.37Å; S372-R717 CarbonylContact O-C 3.52Å; S372-R717 WeakPolarHBondContact O-CA 3.36Å; S372-I718 PolarHBondContact N-O 3.47Å; S372-I718 PolarHBondContact O-N 2.93Å; S372-E720 VanDerWaalsContact CB-OE1 3.27Å; S372-E720 WeakPolarHBondContact CB-OE1 3.26Å; S372-E720 PolarHBondContact OG-OE1 3.16Å
373	L	89.4	Confident	85.2	Confident	3 Å²	3	30 Å²	30	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.5	170.1	-64.6	163.7	0	0	0	108.4	F361 D363 C715 L716 R717 L733	F361-L373 HydrophobicContact CB-CB 4.31Å; F361-L373 PolarHBondContact N-O 2.95Å; F361-L373 PolarHBondContact O-N 2.91Å; D363-L373 HydrophobicContact CB-CD1 3.86Å; D363-L373 HydrophobicContact CB-CG 4.23Å; L373-C715 HydrophobicContact CB-CB 4.07Å; L373-C715 HydrophobicContact CD2-CB 4.49Å; L373-L716 WeakPolarHBondContact CA-O 3.27Å; L373-R717 HydrophobicContact CD2-CB 3.75Å; L373-R717 HydrophobicContact CD2-CG 4.17Å; L373-L733 HydrophobicContact CD1-CD2 4.14Å
374	Y	91.3	Very high	85.3	Confident	6 Å²	6	34.6 Å²	34.6	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.9	-180	-78.4	-87.1	0	0	0	111.2	L345 K360 L376 E407 P408 C715 L716 I718	L345-Y374 WeakPolarHBondContact O-CD1 3.47Å; K360-Y374 HydrophobicContact CB-CD1 4.36Å; K360-Y374 HydrophobicContact CB-CE1 4.16Å; K360-Y374 HydrophobicContact CD-CE1 3.92Å; K360-Y374 HydrophobicContact CD-CE2 4.47Å; K360-Y374 WeakPolarHBondContact CE-OH 3.15Å; K360-Y374 HydrophobicContact CG-CE1 4.09Å; K360-Y374 PolarHBondContact NZ-OH 3.15Å; Y374-L376 PolarHBondContact O-N 3.07Å; Y374-E407 PolarHBondContact OH-OE2 3.49Å; Y374-P408 HydrophobicContact CD1-CB 4.19Å; Y374-P408 HydrophobicContact CD1-CG 4.12Å; Y374-P408 HydrophobicContact CE1-CG 4.33Å; Y374-P408 HydrophobicContact CG-CB 4.12Å; Y374-C715 CarbonylContact O-C 3.59Å; Y374-C715 WeakPolarHBondContact O-CA 3.46Å; Y374-C715 WeakPolarHBondContact O-CB 3.42Å; Y374-L716 PolarHBondContact N-O 3.42Å; Y374-L716 PolarHBondContact O-N 2.68Å; Y374-I718 HydrophobicContact CD2-CB 4.39Å; Y374-I718 HydrophobicContact CD2-CD1 3.51Å; Y374-I718 HydrophobicContact CD2-CG1 4.05Å; Y374-I718 HydrophobicContact CE2-CB 4.41Å; Y374-I718 HydrophobicContact CE2-CD1 3.73Å; Y374-I718 HydrophobicContact CE2-CG1 4.42Å; Y374-I718 HydrophobicContact CG-CD1 4.43Å
375	D	90.7	Very high	85.8	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.032	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	126.1	174.9	-168.5	-18.2	0	0	0	111.6	R359 T377 R713	R359-D375 HydrophobicContact CB-CB 4.38Å; R359-D375 HydrophobicContact CG-CB 4.47Å; R359-D375 PolarHBondContact O-N 2.95Å; D375-T377 VanDerWaalsContact OD1-CB 3.31Å; D375-T377 WeakPolarHBondContact OD1-CB 3.19Å; D375-T377 VanDerWaalsContact OD1-CG2 3.23Å; D375-T377 WeakPolarHBondContact OD1-CG2 3.43Å; D375-T377 PolarHBondContact OD1-N 3.38Å; D375-T377 PolarHBondContact OD1-OG1 2.97Å; D375-T377 PolarHBondContact OD2-OG1 2.92Å; D375-R713 WeakPolarHBondContact OD2-CD 3.39Å; D375-R713 IonicContact OD2-CZ 2.89Å; D375-R713 IonicContact OD2-NE 2.73Å; D375-R713 IonicContact OD2-NH1 3.11Å; D375-R713 PolarHBondContact OD2-NH1 3.21Å
376	L	89	Confident	86.4	Confident	6 Å²	6	34.5 Å²	34.5	3%	0.031	19%	0.193	C	C	.	.			trans	-95.6	2	180	-66.7	-179.8	0	0	0	114.1	Y374 N378 V379 D380 L412 L714 L716	Y374-L376 PolarHBondContact O-N 3.07Å; L376-N378 PolarHBondContact O-N 3.26Å; L376-V379 PolarHBondContact O-N 2.93Å; L376-D380 PolarHBondContact O-N 3.45Å; L376-L412 HydrophobicContact CD2-CD2 4.4Å; L376-L714 WeakPolarHBondContact CB-O 3.49Å; L376-L714 PolarHBondContact N-O 3.47Å; L376-L716 HydrophobicContact CD1-CB 4.1Å; L376-L716 HydrophobicContact CD2-CB 3.98Å; L376-L716 HydrophobicContact CD2-CD2 4.49Å; L376-L716 HydrophobicContact CG-CB 4.1Å
377	T	87.3	Confident	87.1	Confident	52 Å²	52	26.2 Å²	26.2	32%	0.319	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	123	179.6	48.9	0	0	0	0	112.2	D375 V379	D375-T377 VanDerWaalsContact OD1-CB 3.31Å; D375-T377 WeakPolarHBondContact OD1-CB 3.19Å; D375-T377 VanDerWaalsContact OD1-CG2 3.23Å; D375-T377 WeakPolarHBondContact OD1-CG2 3.43Å; D375-T377 PolarHBondContact OD1-N 3.38Å; D375-T377 PolarHBondContact OD1-OG1 2.97Å; D375-T377 PolarHBondContact OD2-OG1 2.92Å; T377-V379 PolarHBondContact O-N 3.4Å
378	N	88.1	Confident	87.7	Confident	37 Å²	37	24.3 Å²	24.3	20%	0.198	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	2.7	-172.9	-52.3	-25.8	0	0	0	115.6	L376 S386 V387	L376-N378 PolarHBondContact O-N 3.26Å; N378-S386 WeakPolarHBondContact O-CA 3.38Å; N378-V387 WeakPolarHBondContact O-CG2 3.49Å; N378-V387 PolarHBondContact O-N 3.14Å
379	V	91.4	Very high	88.1	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-46.8	178.1	-178.7	0	0	0	0	110.9	L329 L345 L376 T377 L388 L409	L329-V379 HydrophobicContact CD2-CG2 4.29Å; L345-V379 HydrophobicContact CD2-CG2 3.78Å; L376-V379 PolarHBondContact O-N 2.93Å; T377-V379 PolarHBondContact O-N 3.4Å; V379-L388 WeakPolarHBondContact O-CB 3.43Å; V379-L388 PolarHBondContact O-N 2.91Å; V379-L409 HydrophobicContact CG1-CD2 3.59Å
380	D	88.8	Confident	88.5	Confident	7 Å²	7	24.1 Å²	24.1	4%	0.037	14%	0.136	C	C	.	.	S	Bend	trans	-79.3	154.1	177.2	-161.7	20.8	0	0	0	111.9	L376 T382 S386 L412 K416	L376-D380 PolarHBondContact O-N 3.45Å; D380-T382 PolarHBondContact O-N 3.48Å; D380-S386 WeakPolarHBondContact O-CB 3.37Å; D380-L412 HydrophobicContact CB-CD2 4.28Å; D380-K416 VanDerWaalsContact OD1-CE 3.22Å; D380-K416 WeakPolarHBondContact OD1-CE 3.49Å; D380-K416 IonicContact OD1-NZ 2.72Å; D380-K416 PolarHBondContact OD1-NZ 2.94Å
381	T	86.9	Confident	88.8	Confident	29 Å²	29	23 Å²	23	18%	0.178	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	16.9	178.3	39	0	0	0	0	115	K416 L685 E688	T381-K416 PolarHBondContact OG1-NZ 3.35Å; T381-L685 HydrophobicContact CG2-CD2 3.65Å; T381-E688 PolarHBondContact OG1-OE1 3.46Å; T381-E688 PolarHBondContact OG1-OE2 3.09Å
382	T	82.1	Confident	88.9	Confident	68 Å²	68	23.2 Å²	23.2	42%	0.417	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-25	173.3	53.9	0	0	0	0	112.7	D380 R700	D380-T382 PolarHBondContact O-N 3.48Å; T382-R700 HydrophobicContact CG2-CG 4.27Å
383	T	82.8	Confident	88.9	Confident	40 Å²	40	26.3 Å²	26.3	25%	0.245	14%	0.141	C	C	.	.	S	Bend	trans	-99.8	159	175.3	60	0	0	0	0	111.1
384	D	80.2	Confident	88.7	Confident	100 Å²	100	27.4 Å²	27.4	54%	0.535	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	137.3	162.6	58	-44	0	0	0	110.6	R321 S386	R321-D384 IonicContact NH1-OD2 3.42Å; R321-D384 PolarHBondContact NH1-OD2 3Å; R321-D384 IonicContact NH2-OD1 3.88Å; D384-S386 PolarHBondContact O-N 3.06Å
385	N	88.6	Confident	88.1	Confident	65 Å²	65	28.9 Å²	28.9	35%	0.348	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	49	171.6	-157.5	22.6	0	0	0	113.3	L326 Q330 I390	L326-N385 VanDerWaalsContact CD2-ND2 3.27Å; L326-N385 WeakPolarHBondContact CD2-ND2 3.39Å; Q330-N385 PolarHBondContact NE2-O 3.08Å; N385-I390 WeakPolarHBondContact O-CD1 3.44Å; N385-I390 WeakPolarHBondContact OD1-CG1 3.36Å
386	S	92.4	Very high	87.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.			trans	-66.4	157.9	-177.5	74	0	0	0	0	112.6	N378 D380 D384 L388 E389 I390	N378-S386 WeakPolarHBondContact O-CA 3.38Å; D380-S386 WeakPolarHBondContact O-CB 3.37Å; D384-S386 PolarHBondContact O-N 3.06Å; S386-L388 PolarHBondContact O-N 3.2Å; S386-E389 WeakPolarHBondContact O-CB 3.48Å; S386-E389 PolarHBondContact O-N 3.48Å; S386-E389 WeakPolarHBondContact OG-CB 3.48Å; S386-E389 PolarHBondContact OG-N 2.63Å; S386-I390 WeakPolarHBondContact O-CG1 3.33Å; S386-I390 PolarHBondContact O-N 3.17Å
387	V	93.6	Very high	87.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.2	-41.2	176.5	172.3	0	0	0	0	111.6	L329 Q330 A333 L341 N378 E389 T391 L409	L329-V387 HydrophobicContact CD2-CG2 3.74Å; L329-V387 HydrophobicContact CG-CG2 3.67Å; Q330-V387 HydrophobicContact CG-CG2 4.39Å; A333-V387 HydrophobicContact CB-CG1 4.02Å; L341-V387 HydrophobicContact CD1-CG1 4.29Å; N378-V387 WeakPolarHBondContact O-CG2 3.49Å; N378-V387 PolarHBondContact O-N 3.14Å; V387-E389 VanDerWaalsContact C-N 3.34Å; V387-T391 HydrophobicContact CG1-CG2 4.37Å; V387-T391 WeakPolarHBondContact O-CB 3.4Å; V387-T391 WeakPolarHBondContact O-CG2 3.46Å; V387-T391 PolarHBondContact O-N 2.87Å; V387-T391 PolarHBondContact O-OG1 3.26Å; V387-L409 HydrophobicContact CG1-CD2 4.47Å
388	L	93.1	Very high	86.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-35.1	177.6	-175.5	63.8	0	0	0	112.2	V379 S386 T391 V392 L404 L409 L412 L413 L685	V379-L388 WeakPolarHBondContact O-CB 3.43Å; V379-L388 PolarHBondContact O-N 2.91Å; S386-L388 PolarHBondContact O-N 3.2Å; L388-T391 PolarHBondContact O-OG1 3.09Å; L388-V392 HydrophobicContact CD1-CG2 4.24Å; L388-V392 WeakPolarHBondContact O-CB 3.15Å; L388-V392 VanDerWaalsContact O-CG2 3.27Å; L388-V392 WeakPolarHBondContact O-CG2 3.37Å; L388-V392 PolarHBondContact O-N 3.06Å; L388-L404 HydrophobicContact CD1-CD2 4.23Å; L388-L409 HydrophobicContact CB-CD2 4.35Å; L388-L409 HydrophobicContact CD1-CD2 4.21Å; L388-L412 HydrophobicContact CD2-CD2 4.16Å; L388-L413 HydrophobicContact CD1-CD1 3.99Å; L388-L413 HydrophobicContact CD1-CD2 4.04Å; L388-L413 HydrophobicContact CD1-CG 3.93Å; L388-L413 HydrophobicContact CD2-CD2 4.09Å; L388-L413 HydrophobicContact CD2-CG 4.42Å; L388-L685 HydrophobicContact CD2-CD2 3.96Å; L388-L685 HydrophobicContact CG-CD1 4.49Å; L388-L685 HydrophobicContact CG-CD2 4.15Å
389	E	91.5	Very high	86.7	Confident	47 Å²	47	39.2 Å²	39.2	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-68.4	-49	174.8	-171.5	173	-157.1	0	0	111.4	S386 V387 T391 V392 Y393 K689	S386-E389 WeakPolarHBondContact O-CB 3.48Å; S386-E389 PolarHBondContact O-N 3.48Å; S386-E389 WeakPolarHBondContact OG-CB 3.48Å; S386-E389 PolarHBondContact OG-N 2.63Å; V387-E389 VanDerWaalsContact C-N 3.34Å; E389-T391 PolarHBondContact O-N 3.37Å; E389-V392 PolarHBondContact O-N 2.82Å; E389-Y393 HydrophobicContact CG-CD2 3.64Å; E389-Y393 HydrophobicContact CG-CE2 3.98Å; E389-Y393 WeakPolarHBondContact O-CD2 3.35Å; E389-Y393 PolarHBondContact O-N 3.06Å; E389-K689 WeakPolarHBondContact OE1-CE 3.48Å; E389-K689 IonicContact OE1-NZ 3.5Å; E389-K689 PolarHBondContact OE1-NZ 3.38Å
390	I	91.2	Very high	86.4	Confident	15 Å²	15	40.7 Å²	40.7	8%	0.077	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-52.5	178.1	-65.4	167.4	0	0	0	110.5	L326 Q330 A333 K334 N385 S386 V392 N394	L326-I390 HydrophobicContact CD2-CD1 4.37Å; Q330-I390 HydrophobicContact CB-CD1 3.75Å; Q330-I390 HydrophobicContact CG-CD1 3.93Å; A333-I390 HydrophobicContact CB-CB 4.26Å; A333-I390 HydrophobicContact CB-CG2 3.9Å; K334-I390 HydrophobicContact CB-CG2 4.03Å; N385-I390 WeakPolarHBondContact O-CD1 3.44Å; N385-I390 WeakPolarHBondContact OD1-CG1 3.36Å; S386-I390 WeakPolarHBondContact O-CG1 3.33Å; S386-I390 PolarHBondContact O-N 3.17Å; I390-V392 VanDerWaalsContact C-N 3.28Å; I390-V392 PolarHBondContact O-N 3.46Å; I390-N394 WeakPolarHBondContact O-CB 3.34Å; I390-N394 PolarHBondContact O-N 2.89Å
391	T	91.4	Very high	86.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-29.2	-175.3	47.8	0	0	0	0	114.2	A333 L341 V387 L388 E389 M403	A333-T391 HydrophobicContact CB-CG2 3.95Å; L341-T391 HydrophobicContact CD2-CG2 4.45Å; V387-T391 HydrophobicContact CG1-CG2 4.37Å; V387-T391 WeakPolarHBondContact O-CB 3.4Å; V387-T391 WeakPolarHBondContact O-CG2 3.46Å; V387-T391 PolarHBondContact O-N 2.87Å; V387-T391 PolarHBondContact O-OG1 3.26Å; L388-T391 PolarHBondContact O-OG1 3.09Å; E389-T391 PolarHBondContact O-N 3.37Å; T391-M403 HydrophobicContact CG2-CB 4.46Å; T391-M403 HydrophobicContact CG2-CE 3.76Å; T391-M403 HydrophobicContact CG2-SD 4.32Å
392	V	89.4	Confident	86.1	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-89.6	-37.9	-178.5	175.4	0	0	0	0	112.8	L388 E389 I390 L404 L678 A681 R682 L685	L388-V392 HydrophobicContact CD1-CG2 4.24Å; L388-V392 WeakPolarHBondContact O-CB 3.15Å; L388-V392 VanDerWaalsContact O-CG2 3.27Å; L388-V392 WeakPolarHBondContact O-CG2 3.37Å; L388-V392 PolarHBondContact O-N 3.06Å; E389-V392 PolarHBondContact O-N 2.82Å; I390-V392 VanDerWaalsContact C-N 3.28Å; I390-V392 PolarHBondContact O-N 3.46Å; V392-L404 HydrophobicContact CG2-CD1 4.23Å; V392-L404 HydrophobicContact CG2-CD2 3.9Å; V392-L678 HydrophobicContact CG1-CD1 4.48Å; V392-A681 HydrophobicContact CG1-CB 4.38Å; V392-A681 HydrophobicContact CG2-CB 3.96Å; V392-R682 HydrophobicContact CG1-CB 3.79Å; V392-L685 HydrophobicContact CB-CD1 3.61Å; V392-L685 HydrophobicContact CG1-CD1 3.76Å; V392-L685 HydrophobicContact CG2-CD1 3.87Å
393	Y	86.7	Confident	86.3	Confident	67 Å²	67	41.4 Å²	41.4	26%	0.263	21%	0.212	S	C	.	.	H	α-helix	trans	-91.1	-14.1	-178.6	-70.2	-72.1	0	0	0	114.3	E389 R682 L685 K689	E389-Y393 HydrophobicContact CG-CD2 3.64Å; E389-Y393 HydrophobicContact CG-CE2 3.98Å; E389-Y393 WeakPolarHBondContact O-CD2 3.35Å; E389-Y393 PolarHBondContact O-N 3.06Å; Y393-R682 HydrophobicContact CE1-CG 4.32Å; Y393-L685 HydrophobicContact CD2-CD1 4.25Å; Y393-L685 HydrophobicContact CE2-CB 4.01Å; Y393-L685 HydrophobicContact CE2-CD1 3.76Å; Y393-K689 VanDerWaalsContact CE2-NZ 3.34Å
394	N	85.5	Confident	86.7	Confident	25 Å²	25	40 Å²	40	13%	0.134	20%	0.203	C	C	.	.			trans	-65.1	139.8	171.3	-163.4	-19.3	0	0	0	109.9	K334 I390 N396 I397 R400	K334-N394 PolarHBondContact O-ND2 3.34Å; I390-N394 WeakPolarHBondContact O-CB 3.34Å; I390-N394 PolarHBondContact O-N 2.89Å; N394-N396 PolarHBondContact OD1-N 3.44Å; N394-N396 VanDerWaalsContact OD1-N 3.11Å; N394-I397 HydrophobicContact CB-CD1 4.18Å; N394-I397 WeakPolarHBondContact ND2-CD1 3.49Å; N394-R400 WeakPolarHBondContact O-CD 3.27Å; N394-R400 PolarHBondContact O-NE 2.77Å; N394-R400 PolarHBondContact O-NH1 2.87Å
395	T	79.4	Confident	87	Confident	38 Å²	38	38.8 Å²	38.8	23%	0.233	20%	0.199	C	C	.	.			trans	-112.4	-25	-171.4	34.6	0	0	0	0	112	I397 D496 S499	T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 2.92Å; T395-D496 WeakPolarHBondContact CB-OD2 3.46Å; T395-D496 PolarHBondContact OG1-OD2 2.91Å; T395-S499 VanDerWaalsContact CG2-OG 3.29Å; T395-S499 WeakPolarHBondContact CG2-OG 3.26Å
396	N	80.7	Confident	87.1	Confident	128 Å²	128	36.6 Å²	36.6	68%	0.684	19%	0.187	S	C	*	.	S	Bend	trans	-86.8	5.8	-170.2	-62.2	-14.6	0	0	0	113.8	N394	N394-N396 PolarHBondContact OD1-N 3.44Å; N394-N396 VanDerWaalsContact OD1-N 3.11Å
397	I	82.1	Confident	86.8	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.072	20%	0.203	C	C	.	.			trans	-119.6	129.5	-173.3	-60.1	167.2	0	0	0	109.5	N394 T395 N399 R400 M403	N394-I397 HydrophobicContact CB-CD1 4.18Å; N394-I397 WeakPolarHBondContact ND2-CD1 3.49Å; T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 2.92Å; I397-N399 WeakPolarHBondContact CG2-OD1 3.48Å; I397-R400 HydrophobicContact CB-CG 3.78Å; I397-R400 HydrophobicContact CG2-CG 3.85Å; I397-R400 WeakPolarHBondContact O-CD 3.48Å; I397-R400 VanDerWaalsContact O-CG 3.31Å; I397-R400 WeakPolarHBondContact O-CG 3.47Å; I397-R400 PolarHBondContact O-NE 3.33Å; I397-M403 HydrophobicContact CG2-SD 4.48Å
398	D	79.4	Confident	86.6	Confident	146 Å²	146	40.2 Å²	40.2	78%	0.781	21%	0.205	S	C	*	.	S	Bend	trans	-86.4	-35.9	177	-59.7	-47.1	0	0	0	112.9	R400 H401	D398-R400 PolarHBondContact O-N 3.44Å; D398-R400 VanDerWaalsContact O-N 3.13Å; D398-H401 PolarHBondContact O-ND1 3.05Å; D398-H401 VanDerWaalsContact O-ND1 3.15Å
399	N	83.8	Confident	86.6	Confident	30 Å²	30	40.2 Å²	40.2	16%	0.16	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	10.9	-177.6	74	2.8	0	0	0	114.9	D293 G336 I397 H401 E402 M403	D293-N399 PolarHBondContact OD1-ND2 3.39Å; G336-N399 PolarHBondContact O-ND2 3.26Å; G336-N399 PolarHBondContact O-OD1 3.4Å; G336-N399 VanDerWaalsContact O-OD1 3.08Å; I397-N399 WeakPolarHBondContact CG2-OD1 3.48Å; N399-H401 PolarHBondContact O-N 2.9Å; N399-E402 PolarHBondContact O-N 2.84Å; N399-M403 PolarHBondContact O-N 2.86Å
400	R	84.7	Confident	86.6	Confident	32 Å²	32	41.2 Å²	41.2	12%	0.121	21%	0.209	C	C	.	.	H	α-helix	trans	-46.1	-38.3	177.5	-72.7	179	-72.1	162	1.8	113.1	N394 I397 D398 M403 L404 D503	N394-R400 WeakPolarHBondContact O-CD 3.27Å; N394-R400 PolarHBondContact O-NE 2.77Å; N394-R400 PolarHBondContact O-NH1 2.87Å; I397-R400 HydrophobicContact CB-CG 3.78Å; I397-R400 HydrophobicContact CG2-CG 3.85Å; I397-R400 WeakPolarHBondContact O-CD 3.48Å; I397-R400 VanDerWaalsContact O-CG 3.31Å; I397-R400 WeakPolarHBondContact O-CG 3.47Å; I397-R400 PolarHBondContact O-NE 3.33Å; D398-R400 PolarHBondContact O-N 3.44Å; D398-R400 VanDerWaalsContact O-N 3.13Å; R400-M403 PolarHBondContact O-N 2.87Å; R400-L404 WeakPolarHBondContact O-CG 3.34Å; R400-L404 PolarHBondContact O-N 2.5Å; R400-L404 VanDerWaalsContact O-N 3.08Å; R400-D503 IonicContact NH1-OD2 3.66Å
401	H	83.3	Confident	86.5	Confident	41 Å²	41	42.1 Å²	42.1	19%	0.19	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-36.9	-179.5	61.8	-94.4	0	0	0	113.4	D398 N399 L404 T405 R674	D398-H401 PolarHBondContact O-ND1 3.05Å; D398-H401 VanDerWaalsContact O-ND1 3.15Å; N399-H401 PolarHBondContact O-N 2.9Å; H401-L404 PolarHBondContact O-N 2.84Å; H401-T405 WeakPolarHBondContact O-CG2 3.39Å; H401-T405 PolarHBondContact O-N 2.95Å; H401-R674 HydrophobicContact CB-CB 3.72Å; H401-R674 HydrophobicContact CB-CG 4.31Å; H401-R674 VanDerWaalsContact CD2-CD 3.49Å; H401-R674 WeakPolarHBondContact CD2-CD 3.38Å; H401-R674 PolarHBondContact NE2-NH1 3.01Å
402	E	85.4	Confident	86.5	Confident	78 Å²	78	42.1 Å²	42.1	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-68.1	-42.2	177	-173	165	-158.2	0	0	109.9	K295 N399 L404 T405	K295-E402 IonicContact NZ-OE1 2.69Å; N399-E402 PolarHBondContact O-N 2.84Å; E402-L404 VanDerWaalsContact C-N 3.3Å; E402-L404 PolarHBondContact O-N 2.77Å; E402-T405 PolarHBondContact O-N 2.88Å; E402-T405 PolarHBondContact O-OG1 3.25Å
403	M	88.1	Confident	86.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.3	-39.8	174.3	-53.3	171.1	85.7	0	0	112.1	A338 L341 T391 I397 N399 R400 T405 L406 L409	A338-M403 HydrophobicContact CB-CG 3.8Å; L341-M403 HydrophobicContact CD2-CE 3.47Å; L341-M403 VanDerWaalsContact CD2-CE 3.47Å; T391-M403 HydrophobicContact CG2-CB 4.46Å; T391-M403 HydrophobicContact CG2-CE 3.76Å; T391-M403 HydrophobicContact CG2-SD 4.32Å; I397-M403 HydrophobicContact CG2-SD 4.48Å; N399-M403 PolarHBondContact O-N 2.86Å; R400-M403 PolarHBondContact O-N 2.87Å; M403-T405 VanDerWaalsContact C-N 3.26Å; M403-T405 PolarHBondContact O-N 3.1Å; M403-L406 WeakPolarHBondContact O-CB 3.4Å; M403-L406 WeakPolarHBondContact O-CD1 3.27Å; M403-L406 WeakPolarHBondContact O-CG 3.11Å; M403-L406 PolarHBondContact O-N 3.42Å; M403-L409 WeakPolarHBondContact O-CD1 3.47Å
404	L	89.6	Confident	86.9	Confident	11 Å²	11	44 Å²	44	6%	0.058	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.7	176.6	-67	179.6	0	0	0	114.6	L388 V392 R400 H401 E402 L413 L678 A681	L388-L404 HydrophobicContact CD1-CD2 4.23Å; V392-L404 HydrophobicContact CG2-CD1 4.23Å; V392-L404 HydrophobicContact CG2-CD2 3.9Å; R400-L404 WeakPolarHBondContact O-CG 3.34Å; R400-L404 PolarHBondContact O-N 2.5Å; R400-L404 VanDerWaalsContact O-N 3.08Å; H401-L404 PolarHBondContact O-N 2.84Å; E402-L404 VanDerWaalsContact C-N 3.3Å; E402-L404 PolarHBondContact O-N 2.77Å; L404-L413 HydrophobicContact CD2-CD1 4.11Å; L404-L678 HydrophobicContact CD1-CB 4.34Å; L404-L678 HydrophobicContact CD1-CD1 3.57Å; L404-A681 HydrophobicContact CD1-CB 4.16Å
405	T	88.1	Confident	87.2	Confident	73 Å²	73	46.4 Å²	46.4	45%	0.448	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.3	170	66	0	0	0	0	113.9	H401 E402 M403 E407	H401-T405 WeakPolarHBondContact O-CG2 3.39Å; H401-T405 PolarHBondContact O-N 2.95Å; E402-T405 PolarHBondContact O-N 2.88Å; E402-T405 PolarHBondContact O-OG1 3.25Å; M403-T405 VanDerWaalsContact C-N 3.26Å; M403-T405 PolarHBondContact O-N 3.1Å; T405-E407 PolarHBondContact O-N 3.24Å
406	L	89.4	Confident	87.8	Confident	19 Å²	19	44.8 Å²	44.8	10%	0.099	23%	0.228	C	C	.	.	S	Bend	trans	-59.6	131	177.5	-62	176.5	0	0	0	111	L341 K342 L345 M403 L409 H410	L341-L406 HydrophobicContact CD2-CD1 4.09Å; L341-L406 HydrophobicContact CG-CD1 4.03Å; K342-L406 HydrophobicContact CB-CD1 4.41Å; K342-L406 HydrophobicContact CB-CD2 3.57Å; K342-L406 HydrophobicContact CD-CD2 3.98Å; K342-L406 HydrophobicContact CG-CD2 3.68Å; L345-L406 HydrophobicContact CD1-CD1 4.15Å; M403-L406 WeakPolarHBondContact O-CB 3.4Å; M403-L406 WeakPolarHBondContact O-CD1 3.27Å; M403-L406 WeakPolarHBondContact O-CG 3.11Å; M403-L406 PolarHBondContact O-N 3.42Å; L406-L409 HydrophobicContact CB-CD1 4.5Å; L406-L409 HydrophobicContact CD1-CD1 4.47Å; L406-L409 PolarHBondContact O-N 3.04Å; L406-H410 WeakPolarHBondContact O-CB 3.36Å; L406-H410 PolarHBondContact O-N 2.88Å
407	E	86.1	Confident	88.3	Confident	70 Å²	70	40.3 Å²	40.3	33%	0.327	20%	0.201	S	C	.	.	H	α-helix	trans	-42.3	-53	-171.1	-64.7	179.5	177.5	0	0	114.5	K360 Y374 T405 T411 K722	K360-E407 IonicContact NZ-OE2 3.98Å; Y374-E407 PolarHBondContact OH-OE2 3.49Å; T405-E407 PolarHBondContact O-N 3.24Å; E407-T411 WeakPolarHBondContact O-CB 3.44Å; E407-T411 WeakPolarHBondContact O-CG2 3.24Å; E407-T411 PolarHBondContact O-N 2.8Å; E407-T411 VanDerWaalsContact O-N 3.1Å; E407-T411 PolarHBondContact O-OG1 2.96Å; E407-K722 IonicContact OE1-NZ 2.75Å; E407-K722 PolarHBondContact OE1-NZ 3.31Å
408	P	90.2	Very high	88.8	Confident	7 Å²	7	47.2 Å²	47.2	5%	0.045	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-40.1	-179.8	25.9	-34.7	0	0	0	113.8	L345 Y374 T411 L412	L345-P408 HydrophobicContact CB-CG 4.37Å; L345-P408 HydrophobicContact CD1-CG 4.3Å; Y374-P408 HydrophobicContact CD1-CB 4.19Å; Y374-P408 HydrophobicContact CD1-CG 4.12Å; Y374-P408 HydrophobicContact CE1-CG 4.33Å; Y374-P408 HydrophobicContact CG-CB 4.12Å; P408-T411 PolarHBondContact O-OG1 3.36Å; P408-L412 WeakPolarHBondContact O-CB 3.31Å; P408-L412 PolarHBondContact O-N 2.95Å
409	L	91.8	Very high	89.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69	-42.5	179.8	-64.4	178.2	0	0	0	111.1	V379 V387 L388 M403 L406 L413	V379-L409 HydrophobicContact CG1-CD2 3.59Å; V387-L409 HydrophobicContact CG1-CD2 4.47Å; L388-L409 HydrophobicContact CB-CD2 4.35Å; L388-L409 HydrophobicContact CD1-CD2 4.21Å; M403-L409 WeakPolarHBondContact O-CD1 3.47Å; L406-L409 HydrophobicContact CB-CD1 4.5Å; L406-L409 HydrophobicContact CD1-CD1 4.47Å; L406-L409 PolarHBondContact O-N 3.04Å; L409-L413 WeakPolarHBondContact O-CB 3.41Å; L409-L413 WeakPolarHBondContact O-CG 3.21Å; L409-L413 PolarHBondContact O-N 3.12Å
410	H	91.3	Very high	89.7	Confident	67 Å²	67	43.2 Å²	43.2	31%	0.31	21%	0.205	S	C	.	.	H	α-helix	trans	-62.8	-49.1	179.4	-175.1	70.8	0	0	0	112	L406 H414	L406-H410 WeakPolarHBondContact O-CB 3.36Å; L406-H410 PolarHBondContact O-N 2.88Å; H410-H414 WeakPolarHBondContact O-CB 3.38Å; H410-H414 PolarHBondContact O-N 3.02Å
411	T	90.6	Very high	90	Very high	34 Å²	34	41.7 Å²	41.7	21%	0.209	20%	0.199	C	C	.	.	H	α-helix	trans	-66.9	-40.6	179.1	51.9	0	0	0	0	112.2	E407 P408 H414 M415 L716 I718	E407-T411 WeakPolarHBondContact O-CB 3.44Å; E407-T411 WeakPolarHBondContact O-CG2 3.24Å; E407-T411 PolarHBondContact O-N 2.8Å; E407-T411 VanDerWaalsContact O-N 3.1Å; E407-T411 PolarHBondContact O-OG1 2.96Å; P408-T411 PolarHBondContact O-OG1 3.36Å; T411-H414 PolarHBondContact O-N 3.2Å; T411-M415 WeakPolarHBondContact O-CB 3.5Å; T411-M415 WeakPolarHBondContact O-CG 3.32Å; T411-M415 PolarHBondContact O-N 3.34Å; T411-L716 WeakPolarHBondContact OG1-CD2 3.44Å; T411-I718 HydrophobicContact CG2-CD1 3.96Å; T411-I718 HydrophobicContact CG2-CG1 4.34Å; T411-I718 HydrophobicContact CG2-CG2 4.25Å; T411-I718 WeakPolarHBondContact OG1-CD1 3.31Å
412	L	91.9	Very high	90.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-48.3	176	-177	61.8	0	0	0	111.6	L376 D380 L388 P408 H414 M415 K416 M701 L716	L376-L412 HydrophobicContact CD2-CD2 4.4Å; D380-L412 HydrophobicContact CB-CD2 4.28Å; L388-L412 HydrophobicContact CD2-CD2 4.16Å; P408-L412 WeakPolarHBondContact O-CB 3.31Å; P408-L412 PolarHBondContact O-N 2.95Å; L412-H414 PolarHBondContact O-N 2.94Å; L412-M415 PolarHBondContact O-N 3.36Å; L412-K416 WeakPolarHBondContact O-CG 3.49Å; L412-K416 PolarHBondContact O-N 2.84Å; L412-M701 HydrophobicContact CD1-CB 3.97Å; L412-M701 HydrophobicContact CD1-CG 4.09Å; L412-L716 HydrophobicContact CB-CD2 4.18Å
413	L	92.3	Very high	90.7	Very high	15 Å²	15	47.9 Å²	47.9	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-43	174.7	-77.8	172.8	0	0	0	112.3	L388 L404 L409 K416 W417 A681 I684	L388-L413 HydrophobicContact CD1-CD1 3.99Å; L388-L413 HydrophobicContact CD1-CD2 4.04Å; L388-L413 HydrophobicContact CD1-CG 3.93Å; L388-L413 HydrophobicContact CD2-CD2 4.09Å; L388-L413 HydrophobicContact CD2-CG 4.42Å; L404-L413 HydrophobicContact CD2-CD1 4.11Å; L409-L413 WeakPolarHBondContact O-CB 3.41Å; L409-L413 WeakPolarHBondContact O-CG 3.21Å; L409-L413 PolarHBondContact O-N 3.12Å; L413-K416 PolarHBondContact O-N 3.13Å; L413-W417 WeakPolarHBondContact O-CB 3.48Å; L413-W417 PolarHBondContact O-N 3.27Å; L413-A681 HydrophobicContact CD1-CB 3.68Å; L413-A681 HydrophobicContact CD2-CB 4.03Å; L413-I684 HydrophobicContact CD2-CB 4.46Å; L413-I684 HydrophobicContact CD2-CD1 4.2Å; L413-I684 HydrophobicContact CD2-CG2 4.26Å
414	H	91.6	Very high	91	Very high	96 Å²	96	50.3 Å²	50.3	44%	0.444	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-42.4	177.7	-178.9	-114	0	0	0	112.4	H410 T411 L412 W417 K418	H410-H414 WeakPolarHBondContact O-CB 3.38Å; H410-H414 PolarHBondContact O-N 3.02Å; T411-H414 PolarHBondContact O-N 3.2Å; L412-H414 PolarHBondContact O-N 2.94Å; H414-W417 WeakPolarHBondContact O-CB 3.46Å; H414-W417 PolarHBondContact O-N 3.4Å; H414-K418 PolarHBondContact O-N 2.92Å
415	M	90.6	Very high	91.1	Very high	76 Å²	76	50.5 Å²	50.5	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-66	-42.5	176.2	-71.8	-179.3	68.2	0	0	112	T411 L412 W417 K418 K419 M701 L716	T411-M415 WeakPolarHBondContact O-CB 3.5Å; T411-M415 WeakPolarHBondContact O-CG 3.32Å; T411-M415 PolarHBondContact O-N 3.34Å; L412-M415 PolarHBondContact O-N 3.36Å; M415-W417 VanDerWaalsContact C-N 3.33Å; M415-W417 PolarHBondContact O-N 3.03Å; M415-K418 PolarHBondContact O-N 3.08Å; M415-K419 VanDerWaalsContact O-CB 3.3Å; M415-K419 WeakPolarHBondContact O-CB 3.45Å; M415-K419 PolarHBondContact O-N 3.28Å; M415-M701 HydrophobicContact CB-CE 3.7Å; M415-M701 HydrophobicContact CB-SD 4.34Å; M415-M701 HydrophobicContact CE-SD 4.1Å; M415-M701 WeakPolarHBondContact O-CE 3.45Å; M415-L716 HydrophobicContact CE-CD1 4.32Å; M415-L716 HydrophobicContact SD-CD1 3.78Å
416	K	92.4	Very high	91.4	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-41.6	175.3	-72.7	-175.8	177.8	-168.7	0	111.8	D380 T381 L412 L413 K419 F420 A421 I684 E688 M701	D380-K416 VanDerWaalsContact OD1-CE 3.22Å; D380-K416 WeakPolarHBondContact OD1-CE 3.49Å; D380-K416 IonicContact OD1-NZ 2.72Å; D380-K416 PolarHBondContact OD1-NZ 2.94Å; T381-K416 PolarHBondContact OG1-NZ 3.35Å; L412-K416 WeakPolarHBondContact O-CG 3.49Å; L412-K416 PolarHBondContact O-N 2.84Å; L413-K416 PolarHBondContact O-N 3.13Å; K416-K419 PolarHBondContact O-N 3.43Å; K416-F420 HydrophobicContact CB-CE1 3.72Å; K416-F420 HydrophobicContact CB-CZ 4.18Å; K416-F420 HydrophobicContact CD-CE1 4.42Å; K416-F420 HydrophobicContact CG-CE1 3.93Å; K416-F420 WeakPolarHBondContact O-CD1 3.31Å; K416-F420 PolarHBondContact O-N 3.36Å; K416-F420 VanDerWaalsContact O-N 3.13Å; K416-A421 PolarHBondContact O-N 3.45Å; K416-I684 HydrophobicContact CB-CG2 3.79Å; K416-I684 HydrophobicContact CD-CG2 4.27Å; K416-E688 WeakPolarHBondContact CD-OE2 3.4Å; K416-E688 WeakPolarHBondContact CE-OE2 3.34Å; K416-E688 VanDerWaalsContact NZ-CD 3.29Å; K416-E688 IonicContact NZ-OE1 2.89Å; K416-E688 PolarHBondContact NZ-OE1 2.8Å; K416-E688 IonicContact NZ-OE2 3.25Å; K416-E688 PolarHBondContact NZ-OE2 3.31Å; K416-M701 HydrophobicContact CG-CE 4.07Å
417	W	92.3	Very high	91.6	Very high	34 Å²	34	57.1 Å²	57.1	13%	0.129	26%	0.264	C	S	.	.	I	π-helix	trans	-57.7	-52	173.5	-176.9	-107.7	0	0	0	112.6	L413 H414 M415 K419 A421 K422 F425 R680 I684	L413-W417 WeakPolarHBondContact O-CB 3.48Å; L413-W417 PolarHBondContact O-N 3.27Å; H414-W417 WeakPolarHBondContact O-CB 3.46Å; H414-W417 PolarHBondContact O-N 3.4Å; M415-W417 VanDerWaalsContact C-N 3.33Å; M415-W417 PolarHBondContact O-N 3.03Å; W417-K419 PolarHBondContact O-N 3.1Å; W417-A421 HydrophobicContact CE3-CB 3.89Å; W417-A421 HydrophobicContact CZ3-CB 4.38Å; W417-K422 HydrophobicContact CD2-CB 4.42Å; W417-K422 HydrophobicContact CZ2-CB 4.4Å; W417-K422 VanDerWaalsContact O-CB 3.32Å; W417-K422 WeakPolarHBondContact O-CB 3.48Å; W417-K422 PolarHBondContact O-N 2.88Å; W417-F425 HydrophobicContact CH2-CB 4.21Å; W417-F425 HydrophobicContact CH2-CD1 4.3Å; W417-F425 HydrophobicContact CH2-CG 4.13Å; W417-F425 HydrophobicContact CZ3-CB 4.4Å; W417-R680 HydrophobicContact CE3-CG 4.23Å; W417-R680 HydrophobicContact CZ3-CG 4.21Å; W417-I684 HydrophobicContact CB-CD1 4.01Å; W417-I684 HydrophobicContact CE3-CD1 4.03Å; W417-I684 HydrophobicContact CE3-CG1 3.79Å; W417-I684 HydrophobicContact CZ3-CG1 4.48Å
418	K	91.6	Very high	91.9	Very high	158 Å²	158	55.6 Å²	55.6	69%	0.687	26%	0.261	S	S	*	.	I	π-helix	trans	-66.3	-36.1	-178.6	-168.7	171.5	-178.2	174.4	0	112.8	H414 M415	H414-K418 PolarHBondContact O-N 2.92Å; M415-K418 PolarHBondContact O-N 3.08Å
419	K	90.5	Very high	92.1	Very high	84 Å²	84	58.6 Å²	58.6	37%	0.365	27%	0.274	S	S	.	.	I	π-helix	trans	-78.3	-47.7	-174.3	-162.8	175.8	-174	-173.5	0	113.2	M415 K416 W417 F699 R700 M701	M415-K419 VanDerWaalsContact O-CB 3.3Å; M415-K419 WeakPolarHBondContact O-CB 3.45Å; M415-K419 PolarHBondContact O-N 3.28Å; K416-K419 PolarHBondContact O-N 3.43Å; W417-K419 PolarHBondContact O-N 3.1Å; K419-F699 HydrophobicContact CD-CD1 4.08Å; K419-F699 HydrophobicContact CG-CD1 4Å; K419-F699 HydrophobicContact CG-CE1 4.32Å; K419-F699 PolarHBondContact NZ-O 2.96Å; K419-R700 PolarHBondContact NZ-O 2.98Å; K419-M701 HydrophobicContact CB-CE 3.81Å; K419-M701 HydrophobicContact CD-CE 3.34Å; K419-M701 HydrophobicContact CD-SD 3.63Å; K419-M701 HydrophobicContact CG-CE 4.24Å; K419-M701 PolarHBondContact NZ-SD 3.17Å; K419-M701 VanDerWaalsContact NZ-SD 3.44Å
420	F	91.4	Very high	92.2	Very high	9 Å²	9	60 Å²	60	4%	0.039	28%	0.283	C	S	.	.	I	π-helix	trans	-134.2	-43.7	-176.6	72.4	-91.3	0	0	0	114.8	K416 K422 H423 M424 I684 F687 E688 L691 F699	K416-F420 HydrophobicContact CB-CE1 3.72Å; K416-F420 HydrophobicContact CB-CZ 4.18Å; K416-F420 HydrophobicContact CD-CE1 4.42Å; K416-F420 HydrophobicContact CG-CE1 3.93Å; K416-F420 WeakPolarHBondContact O-CD1 3.31Å; K416-F420 PolarHBondContact O-N 3.36Å; K416-F420 VanDerWaalsContact O-N 3.13Å; F420-K422 PolarHBondContact O-N 3.08Å; F420-H423 WeakPolarHBondContact O-CB 3.39Å; F420-H423 PolarHBondContact O-N 3Å; F420-M424 HydrophobicContact CD2-SD 3.79Å; F420-M424 HydrophobicContact CE2-SD 4.45Å; F420-M424 PolarHBondContact O-N 2.95Å; F420-M424 VanDerWaalsContact O-N 3.1Å; F420-I684 HydrophobicContact CZ-CG2 4.44Å; F420-F687 HydrophobicContact CE2-CB 4.33Å; F420-E688 HydrophobicContact CE2-CB 4.3Å; F420-E688 HydrophobicContact CZ-CB 4Å; F420-E688 HydrophobicContact CZ-CG 4.28Å; F420-L691 HydrophobicContact CD2-CD1 3.93Å; F420-L691 HydrophobicContact CE2-CD1 3.9Å; F420-L691 HydrophobicContact CG-CD1 4.36Å; F420-L691 HydrophobicContact CZ-CD1 4.29Å; F420-F699 HydrophobicContact CB-CD2 4.34Å; F420-F699 HydrophobicContact CB-CE1 4.39Å; F420-F699 HydrophobicContact CB-CE2 4.09Å; F420-F699 HydrophobicContact CB-CZ 4.15Å; F420-F699 HydrophobicContact CD1-CG 4.48Å
421	A	91.7	Very high	92.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-68.1	-31.6	-165.3	0	0	0	0	0	113.4	K416 W417 H423 M424 F425 I684 F687	K416-A421 PolarHBondContact O-N 3.45Å; W417-A421 HydrophobicContact CE3-CB 3.89Å; W417-A421 HydrophobicContact CZ3-CB 4.38Å; A421-H423 VanDerWaalsContact C-N 3.29Å; A421-H423 PolarHBondContact O-N 3.42Å; A421-M424 PolarHBondContact O-N 2.94Å; A421-F425 WeakPolarHBondContact O-CB 3.23Å; A421-F425 PolarHBondContact O-N 3.38Å; A421-I684 HydrophobicContact CB-CB 4.48Å; A421-I684 HydrophobicContact CB-CG1 3.95Å; A421-I684 HydrophobicContact CB-CG2 4.44Å; A421-F687 HydrophobicContact CB-CD2 4.24Å
422	K	92.3	Very high	92.5	Very high	126 Å²	126	59.4 Å²	59.4	55%	0.548	28%	0.277	S	S	.	.	H	α-helix	trans	-56.7	-42.3	171.1	-177.5	-178.9	177.8	-177.3	0	112.1	W417 F420 F426	W417-K422 HydrophobicContact CD2-CB 4.42Å; W417-K422 HydrophobicContact CZ2-CB 4.4Å; W417-K422 VanDerWaalsContact O-CB 3.32Å; W417-K422 WeakPolarHBondContact O-CB 3.48Å; W417-K422 PolarHBondContact O-N 2.88Å; F420-K422 PolarHBondContact O-N 3.08Å; K422-F426 WeakPolarHBondContact O-CB 3.03Å; K422-F426 PolarHBondContact O-N 3.46Å; K422-F426 VanDerWaalsContact O-N 3.08Å
423	H	92	Very high	92.7	Very high	123 Å²	123	62.9 Å²	62.9	57%	0.569	29%	0.292	S	S	*	.	H	α-helix	trans	-72.1	-42.5	-179.5	-59.6	103	0	0	0	111.7	F420 A421 F426 L427	F420-H423 WeakPolarHBondContact O-CB 3.39Å; F420-H423 PolarHBondContact O-N 3Å; A421-H423 VanDerWaalsContact C-N 3.29Å; A421-H423 PolarHBondContact O-N 3.42Å; H423-F426 PolarHBondContact O-N 2.89Å; H423-L427 VanDerWaalsContact O-CB 3.31Å; H423-L427 WeakPolarHBondContact O-CB 3.37Å; H423-L427 PolarHBondContact O-N 3.34Å
424	M	92.5	Very high	92.8	Very high	50 Å²	50	67.6 Å²	67.6	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-40.4	176	-69.5	-178.1	68.2	0	0	112.4	F420 A421 L427 S428 F687 L691	F420-M424 HydrophobicContact CD2-SD 3.79Å; F420-M424 HydrophobicContact CE2-SD 4.45Å; F420-M424 PolarHBondContact O-N 2.95Å; F420-M424 VanDerWaalsContact O-N 3.1Å; A421-M424 PolarHBondContact O-N 2.94Å; M424-L427 PolarHBondContact O-N 3.32Å; M424-S428 WeakPolarHBondContact O-CB 3.08Å; M424-S428 PolarHBondContact O-N 3Å; M424-F687 HydrophobicContact CB-CD1 4.15Å; M424-F687 HydrophobicContact CB-CD2 4.47Å; M424-F687 HydrophobicContact CB-CE1 4.49Å; M424-F687 HydrophobicContact CB-CG 4.15Å; M424-F687 HydrophobicContact CE-CB 3.91Å; M424-F687 HydrophobicContact CE-CD1 4.02Å; M424-F687 HydrophobicContact CE-CG 4.28Å; M424-F687 HydrophobicContact SD-CB 4.09Å; M424-L691 HydrophobicContact CE-CD2 4.09Å; M424-L691 HydrophobicContact CE-CG 4.48Å; M424-L691 HydrophobicContact SD-CD2 3.67Å; M424-L691 HydrophobicContact SD-CG 4.18Å
425	F	93.3	Very high	93	Very high	15 Å²	15	63 Å²	63	7%	0.066	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-47.5	175.8	-175	-95.8	0	0	0	111.7	W417 A421 L427 S428 F429 Y549 F687	W417-F425 HydrophobicContact CH2-CB 4.21Å; W417-F425 HydrophobicContact CH2-CD1 4.3Å; W417-F425 HydrophobicContact CH2-CG 4.13Å; W417-F425 HydrophobicContact CZ3-CB 4.4Å; A421-F425 WeakPolarHBondContact O-CB 3.23Å; A421-F425 PolarHBondContact O-N 3.38Å; F425-L427 PolarHBondContact O-N 3.28Å; F425-S428 PolarHBondContact O-N 3.15Å; F425-F429 WeakPolarHBondContact O-CB 2.99Å; F425-F429 PolarHBondContact O-N 2.88Å; F425-Y549 HydrophobicContact CE1-CD1 4.36Å; F425-Y549 HydrophobicContact CE2-CD1 4.06Å; F425-Y549 AromaticContact CZ-CD1 3.91Å; F425-Y549 HydrophobicContact CZ-CD1 3.91Å; F425-Y549 VanDerWaalsContact CZ-O 3.31Å; F425-Y549 WeakPolarHBondContact CZ-O 3.47Å; F425-F687 HydrophobicContact CB-CE2 3.78Å; F425-F687 HydrophobicContact CB-CZ 4.08Å; F425-F687 AromaticContact CD2-CE2 3.84Å; F425-F687 HydrophobicContact CD2-CE2 3.84Å; F425-F687 AromaticContact CD2-CZ 3.96Å; F425-F687 HydrophobicContact CD2-CZ 3.96Å; F425-F687 HydrophobicContact CG-CE2 4.33Å
426	F	93.4	Very high	93.2	Very high	135 Å²	135	59.5 Å²	59.5	59%	0.592	27%	0.274	S	S	*	.	H	α-helix	trans	-62.2	-42.3	176	-177.6	-103.5	0	0	0	112.1	K422 H423 F429 C430	K422-F426 WeakPolarHBondContact O-CB 3.03Å; K422-F426 PolarHBondContact O-N 3.46Å; K422-F426 VanDerWaalsContact O-N 3.08Å; H423-F426 PolarHBondContact O-N 2.89Å; F426-F429 WeakPolarHBondContact O-CB 3.26Å; F426-F429 PolarHBondContact O-N 3.35Å; F426-C430 PolarHBondContact O-N 3.43Å; F426-C430 PolarHBondContact O-SG 3.4Å; F426-C430 VanDerWaalsContact O-SG 3.34Å
427	L	93.3	Very high	93.4	Very high	96 Å²	96	61.9 Å²	61.9	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-43.2	177.2	-174.6	62.6	0	0	0	112.2	H423 M424 F425 C430 F431	H423-L427 VanDerWaalsContact O-CB 3.31Å; H423-L427 WeakPolarHBondContact O-CB 3.37Å; H423-L427 PolarHBondContact O-N 3.34Å; M424-L427 PolarHBondContact O-N 3.32Å; F425-L427 PolarHBondContact O-N 3.28Å; L427-C430 PolarHBondContact O-N 2.75Å; L427-F431 HydrophobicContact CD1-CD2 4Å; L427-F431 HydrophobicContact CD1-CE2 3.55Å; L427-F431 HydrophobicContact CD1-CZ 4.36Å; L427-F431 HydrophobicContact CD2-CE2 4.19Å; L427-F431 HydrophobicContact CG-CD2 3.91Å; L427-F431 HydrophobicContact CG-CE2 3.66Å; L427-F431 VanDerWaalsContact O-CD2 3.27Å; L427-F431 WeakPolarHBondContact O-CD2 3.45Å; L427-F431 PolarHBondContact O-N 2.66Å
428	S	92.6	Very high	93.4	Very high	38 Å²	38	61.7 Å²	61.7	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-44.6	174.1	-172.5	0	0	0	0	111.5	M424 F425 F431 Y432 Y549	M424-S428 WeakPolarHBondContact O-CB 3.08Å; M424-S428 PolarHBondContact O-N 3Å; F425-S428 PolarHBondContact O-N 3.15Å; S428-F431 PolarHBondContact O-N 2.85Å; S428-Y432 WeakPolarHBondContact O-CB 3.41Å; S428-Y432 PolarHBondContact O-N 2.95Å; S428-Y549 PolarHBondContact O-OH 2.98Å; S428-Y549 PolarHBondContact OG-OH 3.27Å; S428-Y549 VanDerWaalsContact OG-OH 3.05Å
429	F	94	Very high	93.4	Very high	70 Å²	70	54.2 Å²	54.2	31%	0.307	26%	0.257	S	S	.	.	H	α-helix	trans	-57.9	-48.8	174.8	167.5	-101.7	0	0	0	111.4	F425 F426 Y432 F433 M546 Y549	F425-F429 WeakPolarHBondContact O-CB 2.99Å; F425-F429 PolarHBondContact O-N 2.88Å; F426-F429 WeakPolarHBondContact O-CB 3.26Å; F426-F429 PolarHBondContact O-N 3.35Å; F429-Y432 PolarHBondContact O-N 3.45Å; F429-F433 VanDerWaalsContact O-CB 3.24Å; F429-F433 WeakPolarHBondContact O-CB 3.24Å; F429-F433 PolarHBondContact O-N 2.91Å; F429-M546 HydrophobicContact CD2-CE 4.06Å; F429-M546 HydrophobicContact CE2-CE 3.49Å; F429-M546 VanDerWaalsContact CE2-CE 3.49Å; F429-M546 HydrophobicContact CZ-CE 4.32Å; F429-Y549 HydrophobicContact CB-CD1 3.64Å; F429-Y549 HydrophobicContact CB-CE1 3.91Å; F429-Y549 HydrophobicContact CB-CG 4.18Å; F429-Y549 HydrophobicContact CD2-CD1 4.08Å; F429-Y549 HydrophobicContact CD2-CD2 4.23Å; F429-Y549 AromaticContact CD2-CG 3.72Å; F429-Y549 HydrophobicContact CD2-CG 3.72Å; F429-Y549 HydrophobicContact CG-CD1 4.36Å; F429-Y549 HydrophobicContact CG-CG 4.45Å
430	C	94.9	Very high	93.5	Very high	29 Å²	29	51.7 Å²	51.7	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-48.8	178	-71.1	0	0	0	0	112.2	F426 L427 Y432 F433 F434	F426-C430 PolarHBondContact O-N 3.43Å; F426-C430 PolarHBondContact O-SG 3.4Å; F426-C430 VanDerWaalsContact O-SG 3.34Å; L427-C430 PolarHBondContact O-N 2.75Å; C430-Y432 PolarHBondContact O-N 3.34Å; C430-F433 PolarHBondContact O-N 3.46Å; C430-F434 HydrophobicContact CB-CD2 4.48Å; C430-F434 HydrophobicContact CB-CE2 4.26Å; C430-F434 WeakPolarHBondContact O-CD2 3.37Å; C430-F434 WeakPolarHBondContact O-CG 3.34Å; C430-F434 PolarHBondContact O-N 3.17Å
431	F	94	Very high	93.4	Very high	86 Å²	86	55.1 Å²	55.1	38%	0.377	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-43.6	178	-80.8	-63.7	0	0	0	112.5	L427 S428 F434 Y435 W477	L427-F431 HydrophobicContact CD1-CD2 4Å; L427-F431 HydrophobicContact CD1-CE2 3.55Å; L427-F431 HydrophobicContact CD1-CZ 4.36Å; L427-F431 HydrophobicContact CD2-CE2 4.19Å; L427-F431 HydrophobicContact CG-CD2 3.91Å; L427-F431 HydrophobicContact CG-CE2 3.66Å; L427-F431 VanDerWaalsContact O-CD2 3.27Å; L427-F431 WeakPolarHBondContact O-CD2 3.45Å; L427-F431 PolarHBondContact O-N 2.66Å; S428-F431 PolarHBondContact O-N 2.85Å; F431-F434 PolarHBondContact O-N 2.64Å; F431-Y435 WeakPolarHBondContact O-CB 3.36Å; F431-Y435 PolarHBondContact O-N 2.62Å; F431-W477 HydrophobicContact CB-CH2 3.6Å; F431-W477 HydrophobicContact CB-CZ2 3.48Å; F431-W477 VanDerWaalsContact CB-CZ2 3.48Å; F431-W477 HydrophobicContact CB-CZ3 4.4Å; F431-W477 HydrophobicContact CD1-CH2 4.24Å; F431-W477 HydrophobicContact CD1-CZ3 4.32Å; F431-W477 HydrophobicContact CD2-CH2 4.12Å; F431-W477 AromaticContact CG-CH2 3.76Å; F431-W477 HydrophobicContact CG-CH2 3.76Å; F431-W477 HydrophobicContact CG-CZ2 4.17Å; F431-W477 HydrophobicContact CG-CZ3 4.29Å
432	Y	94.7	Very high	93.1	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-69.8	-35.5	179.5	-172.2	-100.9	0	0	0	112.7	S428 F429 C430 Y435 N436 I481 F510 Q513 G542 N545 M546 Y549	S428-Y432 WeakPolarHBondContact O-CB 3.41Å; S428-Y432 PolarHBondContact O-N 2.95Å; F429-Y432 PolarHBondContact O-N 3.45Å; C430-Y432 PolarHBondContact O-N 3.34Å; Y432-Y435 HydrophobicContact CD2-CD1 4.02Å; Y432-Y435 AromaticContact CE2-CD1 3.86Å; Y432-Y435 HydrophobicContact CE2-CD1 3.86Å; Y432-Y435 HydrophobicContact CE2-CE1 4.15Å; Y432-Y435 WeakPolarHBondContact O-CB 3.34Å; Y432-Y435 PolarHBondContact O-N 2.67Å; Y432-N436 WeakPolarHBondContact CE1-ND2 3.15Å; Y432-N436 PolarHBondContact O-N 2.92Å; Y432-I481 HydrophobicContact CD2-CD1 4.13Å; Y432-I481 HydrophobicContact CE2-CD1 4.14Å; Y432-F510 HydrophobicContact CD2-CE1 4.26Å; Y432-F510 AromaticContact CE1-CE1 4Å; Y432-F510 HydrophobicContact CE1-CE1 4Å; Y432-F510 HydrophobicContact CE2-CD1 4Å; Y432-F510 AromaticContact CE2-CE1 3.69Å; Y432-F510 HydrophobicContact CE2-CE1 3.69Å; Y432-F510 AromaticContact CZ-CE1 3.56Å; Y432-Q513 PolarHBondContact OH-NE2 3.39Å; Y432-Q513 PolarHBondContact OH-OE1 3.28Å; Y432-G542 WeakPolarHBondContact OH-CA 3.44Å; Y432-G542 PolarHBondContact OH-O 3.44Å; Y432-N545 HydrophobicContact CE1-CB 4.25Å; Y432-N545 WeakPolarHBondContact OH-CB 3.39Å; Y432-M546 HydrophobicContact CD1-SD 3.49Å; Y432-M546 WeakPolarHBondContact CD1-SD 3.3Å; Y432-M546 HydrophobicContact CE1-CG 4.33Å; Y432-M546 HydrophobicContact CE1-SD 3.58Å; Y432-M546 VanDerWaalsContact CE1-SD 3.58Å; Y432-Y549 WeakPolarHBondContact CB-OH 3.28Å; Y432-Y549 HydrophobicContact CD1-CD2 4.17Å; Y432-Y549 AromaticContact CD1-CE2 3.45Å; Y432-Y549 HydrophobicContact CD1-CE2 3.45Å; Y432-Y549 VanDerWaalsContact CD1-CE2 3.45Å; Y432-Y549 HydrophobicContact CE1-CE2 4.22Å; Y432-Y549 AromaticContact CG-CE2 3.81Å; Y432-Y549 HydrophobicContact CG-CE2 3.81Å
433	F	95.6	Very high	92.8	Very high	72 Å²	72	51.6 Å²	51.6	32%	0.316	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-47.9	171.9	-179	-109.1	0	0	0	111.5	F429 C430 Y435 N436 I437 W543 M546	F429-F433 VanDerWaalsContact O-CB 3.24Å; F429-F433 WeakPolarHBondContact O-CB 3.24Å; F429-F433 PolarHBondContact O-N 2.91Å; C430-F433 PolarHBondContact O-N 3.46Å; F433-Y435 VanDerWaalsContact C-N 3.29Å; F433-Y435 PolarHBondContact O-N 3.29Å; F433-N436 PolarHBondContact O-N 2.86Å; F433-I437 HydrophobicContact CD1-CG1 4.34Å; F433-I437 HydrophobicContact CD2-CG1 4.49Å; F433-I437 HydrophobicContact CE1-CG1 4.01Å; F433-I437 HydrophobicContact CE2-CD1 4.31Å; F433-I437 HydrophobicContact CE2-CG1 4.18Å; F433-I437 HydrophobicContact CZ-CD1 4.05Å; F433-I437 HydrophobicContact CZ-CG1 3.93Å; F433-I437 WeakPolarHBondContact O-CG1 3.47Å; F433-I437 PolarHBondContact O-N 3.04Å; F433-W543 HydrophobicContact CD2-CH2 4.47Å; F433-W543 HydrophobicContact CD2-CZ3 4.42Å; F433-W543 HydrophobicContact CE2-CH2 4.08Å; F433-W543 HydrophobicContact CE2-CZ3 4.16Å; F433-M546 HydrophobicContact CB-CE 4.17Å; F433-M546 HydrophobicContact CD2-CE 3.79Å; F433-M546 HydrophobicContact CG-CE 4.46Å
434	F	95	Very high	92.5	Very high	115 Å²	115	54.1 Å²	54.1	50%	0.504	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-32.3	175.2	-69.1	-54.4	0	0	0	112.7	C430 F431 T438	C430-F434 HydrophobicContact CB-CD2 4.48Å; C430-F434 HydrophobicContact CB-CE2 4.26Å; C430-F434 WeakPolarHBondContact O-CD2 3.37Å; C430-F434 WeakPolarHBondContact O-CG 3.34Å; C430-F434 PolarHBondContact O-N 3.17Å; F431-F434 PolarHBondContact O-N 2.64Å; F434-T438 WeakPolarHBondContact O-CB 3.49Å; F434-T438 WeakPolarHBondContact O-CG2 3.43Å; F434-T438 PolarHBondContact O-N 3.25Å; F434-T438 PolarHBondContact O-OG1 2.73Å
435	Y	95.3	Very high	91.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-48.1	171.3	169.8	-107.2	0	0	0	112.1	F431 Y432 F433 T438 L439 V474 W477 A478 I481	F431-Y435 WeakPolarHBondContact O-CB 3.36Å; F431-Y435 PolarHBondContact O-N 2.62Å; Y432-Y435 HydrophobicContact CD2-CD1 4.02Å; Y432-Y435 AromaticContact CE2-CD1 3.86Å; Y432-Y435 HydrophobicContact CE2-CD1 3.86Å; Y432-Y435 HydrophobicContact CE2-CE1 4.15Å; Y432-Y435 WeakPolarHBondContact O-CB 3.34Å; Y432-Y435 PolarHBondContact O-N 2.67Å; F433-Y435 VanDerWaalsContact C-N 3.29Å; F433-Y435 PolarHBondContact O-N 3.29Å; Y435-T438 WeakPolarHBondContact CA-OG1 3.48Å; Y435-T438 PolarHBondContact O-N 2.89Å; Y435-T438 PolarHBondContact O-OG1 2.94Å; Y435-L439 VanDerWaalsContact O-CB 3.26Å; Y435-L439 WeakPolarHBondContact O-CB 3.38Å; Y435-L439 PolarHBondContact O-N 2.99Å; Y435-V474 HydrophobicContact CD2-CG2 4.37Å; Y435-V474 HydrophobicContact CE2-CB 4.3Å; Y435-V474 HydrophobicContact CE2-CG1 4Å; Y435-V474 HydrophobicContact CE2-CG2 4.4Å; Y435-W477 AromaticContact CD1-CD1 3.9Å; Y435-W477 HydrophobicContact CD2-CB 3.75Å; Y435-W477 AromaticContact CD2-CD1 3.44Å; Y435-W477 VanDerWaalsContact CD2-CD1 3.44Å; Y435-W477 AromaticContact CD2-CG 3.89Å; Y435-W477 HydrophobicContact CD2-CG 3.89Å; Y435-W477 HydrophobicContact CE2-CB 4.07Å; Y435-W477 AromaticContact CE2-CD1 3.99Å; Y435-W477 HydrophobicContact CE2-CG 4.45Å; Y435-W477 AromaticContact CG-CD1 3.37Å; Y435-W477 HydrophobicContact CG-CG 4.19Å; Y435-A478 HydrophobicContact CE2-CB 4.48Å; Y435-I481 HydrophobicContact CE1-CD1 4.31Å
436	N	95.2	Very high	90.9	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-39.5	175.7	-80.2	-25.6	0	0	0	112.5	Y432 F433 L439 T440 Q513 G542 W543 M546	Y432-N436 WeakPolarHBondContact CE1-ND2 3.15Å; Y432-N436 PolarHBondContact O-N 2.92Å; F433-N436 PolarHBondContact O-N 2.86Å; N436-L439 PolarHBondContact O-N 3.24Å; N436-T440 WeakPolarHBondContact O-CG2 3.03Å; N436-T440 PolarHBondContact O-N 2.93Å; N436-T440 PolarHBondContact O-OG1 3.05Å; N436-Q513 PolarHBondContact OD1-NE2 3.13Å; N436-G542 PolarHBondContact ND2-O 3.3Å; N436-W543 HydrophobicContact CB-CH2 4.4Å; N436-W543 HydrophobicContact CB-CZ2 4.14Å; N436-M546 PolarHBondContact ND2-SD 2.89Å; N436-M546 VanDerWaalsContact ND2-SD 3.38Å
437	I	95	Very high	89.8	Confident	54 Å²	54	57.7 Å²	57.7	28%	0.277	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-43.4	175	-68	-70.3	0	0	0	111.5	F433 T440 L441 W543	F433-I437 HydrophobicContact CD1-CG1 4.34Å; F433-I437 HydrophobicContact CD2-CG1 4.49Å; F433-I437 HydrophobicContact CE1-CG1 4.01Å; F433-I437 HydrophobicContact CE2-CD1 4.31Å; F433-I437 HydrophobicContact CE2-CG1 4.18Å; F433-I437 HydrophobicContact CZ-CD1 4.05Å; F433-I437 HydrophobicContact CZ-CG1 3.93Å; F433-I437 WeakPolarHBondContact O-CG1 3.47Å; F433-I437 PolarHBondContact O-N 3.04Å; I437-T440 PolarHBondContact O-N 3.15Å; I437-T440 PolarHBondContact O-OG1 3.35Å; I437-L441 HydrophobicContact CG2-CD1 3.86Å; I437-L441 HydrophobicContact CG2-CG 4.39Å; I437-L441 WeakPolarHBondContact O-CB 3.31Å; I437-L441 WeakPolarHBondContact O-CG 3.11Å; I437-L441 PolarHBondContact O-N 3.13Å; I437-W543 HydrophobicContact CD1-CH2 3.79Å; I437-W543 HydrophobicContact CD1-CZ2 4.06Å; I437-W543 HydrophobicContact CG1-CH2 4.31Å
438	T	92.4	Very high	88.2	Confident	31 Å²	31	64.9 Å²	64.9	19%	0.19	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-37.4	176.7	47.7	0	0	0	0	111.6	F434 Y435 L441 V442 F473	F434-T438 WeakPolarHBondContact O-CB 3.49Å; F434-T438 WeakPolarHBondContact O-CG2 3.43Å; F434-T438 PolarHBondContact O-N 3.25Å; F434-T438 PolarHBondContact O-OG1 2.73Å; Y435-T438 WeakPolarHBondContact CA-OG1 3.48Å; Y435-T438 PolarHBondContact O-N 2.89Å; Y435-T438 PolarHBondContact O-OG1 2.94Å; T438-L441 PolarHBondContact O-N 3.33Å; T438-V442 WeakPolarHBondContact O-CB 3.4Å; T438-V442 VanDerWaalsContact O-CG2 3.23Å; T438-V442 WeakPolarHBondContact O-CG2 3.23Å; T438-V442 PolarHBondContact O-N 3.03Å; T438-F473 HydrophobicContact CG2-CD1 4Å; T438-F473 HydrophobicContact CG2-CE1 4.25Å; T438-F473 WeakPolarHBondContact OG1-CD1 3.47Å; T438-F473 WeakPolarHBondContact OG1-CE1 3.48Å
439	L	92.4	Very high	86.4	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-44.4	172.8	-175.6	64.3	0	0	0	112.5	Y435 N436 S443 V474 V517 L535 M539	Y435-L439 VanDerWaalsContact O-CB 3.26Å; Y435-L439 WeakPolarHBondContact O-CB 3.38Å; Y435-L439 PolarHBondContact O-N 2.99Å; N436-L439 PolarHBondContact O-N 3.24Å; L439-S443 WeakPolarHBondContact O-CB 3.31Å; L439-S443 PolarHBondContact O-N 2.81Å; L439-V474 HydrophobicContact CB-CG2 4.39Å; L439-V474 HydrophobicContact CD1-CG1 3.98Å; L439-V517 HydrophobicContact CD1-CG2 4.35Å; L439-V517 HydrophobicContact CD2-CG2 4.32Å; L439-L535 HydrophobicContact CD1-CD1 3.68Å; L439-M539 HydrophobicContact CD2-CB 4.37Å
440	T	92.7	Very high	84.2	Confident	30 Å²	30	73.4 Å²	73.4	18%	0.184	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-44.9	175.5	56.9	0	0	0	0	111.6	N436 I437 S443 Y444 M539 W543	N436-T440 WeakPolarHBondContact O-CG2 3.03Å; N436-T440 PolarHBondContact O-N 2.93Å; N436-T440 PolarHBondContact O-OG1 3.05Å; I437-T440 PolarHBondContact O-N 3.15Å; I437-T440 PolarHBondContact O-OG1 3.35Å; T440-S443 PolarHBondContact O-N 3.37Å; T440-Y444 VanDerWaalsContact O-CB 3.22Å; T440-Y444 WeakPolarHBondContact O-CB 3.47Å; T440-Y444 PolarHBondContact O-N 3.35Å; T440-M539 HydrophobicContact CG2-CG 3.8Å; T440-M539 HydrophobicContact CG2-SD 3.77Å; T440-W543 HydrophobicContact CG2-CZ2 3.86Å
441	L	89.5	Confident	82.2	Confident	81 Å²	81	80.1 Å²	80.1	42%	0.424	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-44	179	-69.5	171.4	0	0	0	112	I437 T438 S443 Y444 Y445	I437-L441 HydrophobicContact CG2-CD1 3.86Å; I437-L441 HydrophobicContact CG2-CG 4.39Å; I437-L441 WeakPolarHBondContact O-CB 3.31Å; I437-L441 WeakPolarHBondContact O-CG 3.11Å; I437-L441 PolarHBondContact O-N 3.13Å; T438-L441 PolarHBondContact O-N 3.33Å; L441-S443 VanDerWaalsContact C-N 3.32Å; L441-S443 PolarHBondContact O-N 3.02Å; L441-Y444 PolarHBondContact O-N 3.17Å; L441-Y445 HydrophobicContact CD2-CD2 3.84Å; L441-Y445 HydrophobicContact CD2-CE2 3.58Å; L441-Y445 WeakPolarHBondContact O-CB 3.38Å; L441-Y445 PolarHBondContact O-N 3.4Å
442	V	85.6	Confident	80.1	Confident	34 Å²	34	80 Å²	80	21%	0.206	38%	0.379	C	S	.	.	H	α-helix	trans	-64.2	-36.5	177	167.6	0	0	0	0	111.7	T438 R471	T438-V442 WeakPolarHBondContact O-CB 3.4Å; T438-V442 VanDerWaalsContact O-CG2 3.23Å; T438-V442 WeakPolarHBondContact O-CG2 3.23Å; T438-V442 PolarHBondContact O-N 3.03Å; V442-R471 HydrophobicContact CG1-CG 4.05Å
443	S	85.5	Confident	78.1	Confident	18 Å²	18	84.1 Å²	84.1	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-79	-34.7	178.1	-172.2	0	0	0	0	113.5	L439 T440 L441 M539	L439-S443 WeakPolarHBondContact O-CB 3.31Å; L439-S443 PolarHBondContact O-N 2.81Å; T440-S443 PolarHBondContact O-N 3.37Å; L441-S443 VanDerWaalsContact C-N 3.32Å; L441-S443 PolarHBondContact O-N 3.02Å; S443-M539 WeakPolarHBondContact OG-CE 3.37Å
444	Y	85.6	Confident	76	Confident	177 Å²	177	83.1 Å²	83.1	69%	0.694	40%	0.4	S	S	*	.	H	α-helix	trans	-82.9	-48.4	-175.7	-178	-93.6	0	0	0	112.6	T440 L441 R446	T440-Y444 VanDerWaalsContact O-CB 3.22Å; T440-Y444 WeakPolarHBondContact O-CB 3.47Å; T440-Y444 PolarHBondContact O-N 3.35Å; L441-Y444 PolarHBondContact O-N 3.17Å; Y444-R446 PolarHBondContact O-N 3.16Å; Y444-R446 VanDerWaalsContact O-N 3.09Å
445	Y	80.3	Confident	74	Confident	149 Å²	149	85.5 Å²	85.5	58%	0.584	41%	0.413	S	S	*	.	S	Bend	trans	-80.4	19.9	177.8	-70.8	-72.1	0	0	0	113.4	L441 Q467	L441-Y445 HydrophobicContact CD2-CD2 3.84Å; L441-Y445 HydrophobicContact CD2-CE2 3.58Å; L441-Y445 WeakPolarHBondContact O-CB 3.38Å; L441-Y445 PolarHBondContact O-N 3.4Å; Y445-Q467 PolarHBondContact O-NE2 3.38Å
446	R	72.7	Confident	72	Confident	57 Å²	57	87.6 Å²	87.6	22%	0.215	43%	0.427	C	S	.	.	S	Bend	trans	-71.9	131.1	171.6	-172.9	178.5	173.5	-128.8	-16	109.1	Y444 R448 Y531	Y444-R446 PolarHBondContact O-N 3.16Å; Y444-R446 VanDerWaalsContact O-N 3.09Å; R446-R448 PolarHBondContact O-N 3.33Å; R446-Y531 VanDerWaalsContact NH1-CE2 3.32Å; R446-Y531 PolarHBondContact NH1-OH 2.78Å; R446-Y531 PolarHBondContact NH2-OH 3.24Å
447	P	69	Low	70.3	Confident	68 Å²	68	93.5 Å²	93.5	44%	0.442	46%	0.458	S	S	.	.			trans	-58.1	125.5	170.4	25.1	-33.3	0	0	0	109.5	E449	P447-E449 HydrophobicContact CB-CG 4.47Å; P447-E449 PolarHBondContact O-N 2.87Å; P447-E449 VanDerWaalsContact O-N 3.15Å
448	R	59.4	Low	68.3	Low	247 Å²	247	94.1 Å²	94.1	93%	0.932	47%	0.47	S	S	*	.			trans	-77.4	93.6	170	-71	-177.4	179.1	179.5	-1	107.5	R446	R446-R448 PolarHBondContact O-N 3.33Å
449	E	55.4	Low	66.6	Low	85 Å²	85	95.7 Å²	95.7	40%	0.397	48%	0.478	S	S	.	.			trans	-83.2	113.2	177.8	-75.7	160.2	166.1	0	0	110.4	P447 P454	P447-E449 HydrophobicContact CB-CG 4.47Å; P447-E449 PolarHBondContact O-N 2.87Å; P447-E449 VanDerWaalsContact O-N 3.15Å; E449-P454 VanDerWaalsContact OE1-CG 3.26Å; E449-P454 WeakPolarHBondContact OE1-CG 3.42Å; E449-P454 WeakPolarHBondContact OE2-CD 3.12Å
450	E	48.9	Very low	64.8	Low	202 Å²	202	101.2 Å²	101.2	94%	0.944	51%	0.511	S	S	*	.	S	Bend	trans	-78.7	-11.7	156	-71.4	-171.9	143.1	0	0	111.6
451	E	51.3	Low	63.1	Low	170 Å²	170	107.6 Å²	107.6	79%	0.794	54%	0.539	S	S	*	.	S	Bend	trans	-126.8	120.1	-177.2	-64.3	-170.7	150.4	0	0	112.6
452	A	49.9	Very low	61.5	Low	84 Å²	84	113.5 Å²	113.5	69%	0.694	56%	0.561	S	S	*	*			trans	50.4	122.7	166.6	0	0	0	0	0	118.7	P454	A452-P454 WeakPolarHBondContact O-CD 3.31Å; A452-P454 WeakPolarHBondContact O-CG 3.31Å
453	I	54.4	Low	60.3	Low	91 Å²	91	117.9 Å²	117.9	47%	0.467	58%	0.581	S	S	.	*			trans	-61	107.7	165.2	-55.6	171.7	0	0	0	108.1	A527	I453-A527 HydrophobicContact CD1-CB 4.02Å; I453-A527 VanDerWaalsContact CD1-O 3.31Å; I453-A527 WeakPolarHBondContact CD1-O 3.29Å; I453-A527 HydrophobicContact CG2-CB 4.15Å
454	P	50.1	Low	59.6	Low	50 Å²	50	117.4 Å²	117.4	33%	0.325	58%	0.578	S	S	.	*			trans	-78.8	161	178.9	-4.8	24.6	0	0	0	109	E449 A452 A458	E449-P454 VanDerWaalsContact OE1-CG 3.26Å; E449-P454 WeakPolarHBondContact OE1-CG 3.42Å; E449-P454 WeakPolarHBondContact OE2-CD 3.12Å; A452-P454 WeakPolarHBondContact O-CD 3.31Å; A452-P454 WeakPolarHBondContact O-CG 3.31Å; P454-A458 HydrophobicContact CB-CB 4.5Å
455	H	53.1	Low	59.2	Low	166 Å²	166	117.4 Å²	117.4	77%	0.769	58%	0.577	S	S	*	*			trans	-49.7	133.8	172.5	-63.7	-69.9	0	0	0	110.5	L457 A458	H455-L457 PolarHBondContact O-N 3.05Å; H455-A458 PolarHBondContact O-N 3.33Å
456	P	54.3	Low	59.1	Low	44 Å²	44	115.9 Å²	115.9	29%	0.286	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-3.6	-158.1	20.8	-33.3	0	0	0	116.5	R471 Y524 L525	P456-R471 PolarHBondContact O-NH1 3.44Å; P456-Y524 HydrophobicContact CB-CD1 4.23Å; P456-Y524 HydrophobicContact CB-CE1 3.64Å; P456-L525 HydrophobicContact CB-CD2 4.45Å; P456-L525 HydrophobicContact CG-CD2 4.33Å
457	L	57.7	Low	59.4	Low	125 Å²	125	115.5 Å²	115.5	65%	0.654	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	21.4	178.2	-72.8	94.5	0	0	0	113.7	H455 L459 L468	H455-L457 PolarHBondContact O-N 3.05Å; L457-L459 PolarHBondContact O-N 2.89Å; L457-L468 HydrophobicContact CD2-CD1 4.29Å
458	A	54.1	Low	60.1	Low	66 Å²	66	114.8 Å²	114.8	55%	0.545	57%	0.571	S	S	.	*			trans	-63.9	97.1	175.1	0	0	0	0	0	111.2	P454 H455 T460	P454-A458 HydrophobicContact CB-CB 4.5Å; H455-A458 PolarHBondContact O-N 3.33Å; A458-T460 PolarHBondContact O-N 2.86Å
459	L	55.8	Low	61.4	Low	65 Å²	65	108.9 Å²	108.9	34%	0.34	56%	0.558	S	S	.	*			trans	-80	83.5	-168.3	-152.2	85.1	0	0	0	111.9	L457 H461 W465 L468	L457-L459 PolarHBondContact O-N 2.89Å; L459-H461 PolarHBondContact O-N 3.19Å; L459-W465 HydrophobicContact CD2-CD2 4.25Å; L459-W465 HydrophobicContact CD2-CG 4.28Å; L459-W465 HydrophobicContact CD2-CZ2 4.35Å; L459-L468 HydrophobicContact CD1-CB 4.42Å; L459-L468 HydrophobicContact CD1-CD2 4.28Å
460	T	55.9	Low	62.9	Low	117 Å²	117	105.3 Å²	105.3	72%	0.718	54%	0.544	S	S	*	.			trans	-61.9	123	175.5	31.9	0	0	0	0	111.3	A458 K462	A458-T460 PolarHBondContact O-N 2.86Å; T460-K462 PolarHBondContact O-N 3.46Å
461	H	55.7	Low	64.8	Low	163 Å²	163	99.5 Å²	99.5	76%	0.755	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	99.1	-159.5	-123.3	-95.3	0	0	0	113.1	L459	L459-H461 PolarHBondContact O-N 3.19Å
462	K	57.3	Low	66.6	Low	205 Å²	205	96 Å²	96	89%	0.891	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.3	-31.9	144.5	-93.9	167.7	-175.3	-178.3	0	111.5	T460	T460-K462 PolarHBondContact O-N 3.46Å
463	M	61	Low	68.7	Low	127 Å²	127	95 Å²	95	63%	0.626	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-15.8	179	-152.3	72.2	80.9	0	0	113.7	W465 L466 Q467	M463-W465 VanDerWaalsContact C-N 3.33Å; M463-W465 PolarHBondContact O-N 2.76Å; M463-L466 PolarHBondContact O-N 3.16Å; M463-Q467 PolarHBondContact O-N 3.32Å
464	G	70.2	Confident	70.5	Confident	7 Å²	7	91 Å²	91	7%	0.072	46%	0.458	C	S	.	.	H	α-helix	trans	-59.6	-33	-173.7	0	0	0	0	0	115.5	L466 Q467 L468	G464-L466 PolarHBondContact O-N 2.99Å; G464-Q467 PolarHBondContact O-N 3.03Å; G464-L468 WeakPolarHBondContact O-CB 3.46Å; G464-L468 PolarHBondContact O-N 3.37Å
465	W	75.9	Confident	72.5	Confident	177 Å²	177	91.3 Å²	91.3	67%	0.67	46%	0.456	S	S	*	.	H	α-helix	trans	-63.2	-41.1	177.5	-79	99.1	0	0	0	113.1	L459 M463 L468 L469	L459-W465 HydrophobicContact CD2-CD2 4.25Å; L459-W465 HydrophobicContact CD2-CG 4.28Å; L459-W465 HydrophobicContact CD2-CZ2 4.35Å; M463-W465 VanDerWaalsContact C-N 3.33Å; M463-W465 PolarHBondContact O-N 2.76Å; W465-L468 PolarHBondContact O-N 2.91Å; W465-L469 WeakPolarHBondContact O-CB 3.35Å; W465-L469 PolarHBondContact O-N 2.74Å
466	L	80.1	Confident	74.5	Confident	117 Å²	117	88.5 Å²	88.5	61%	0.613	45%	0.446	S	S	*	.	H	α-helix	trans	-68.7	-39.3	177.9	-178.3	61.8	0	0	0	111.1	M463 G464 L469 G470	M463-L466 PolarHBondContact O-N 3.16Å; G464-L466 PolarHBondContact O-N 2.99Å; L466-L469 PolarHBondContact O-N 3.24Å; L466-G470 PolarHBondContact O-N 3.34Å
467	Q	78.6	Confident	76.4	Confident	50 Å²	50	89.1 Å²	89.1	23%	0.234	44%	0.443	C	S	.	.	H	α-helix	trans	-66.6	-39.1	175	-66.7	-177.1	-11.9	0	0	112.1	Y445 M463 G464 G470 R471	Y445-Q467 PolarHBondContact O-NE2 3.38Å; M463-Q467 PolarHBondContact O-N 3.32Å; G464-Q467 PolarHBondContact O-N 3.03Å; Q467-G470 PolarHBondContact O-N 2.95Å; Q467-R471 WeakPolarHBondContact O-CB 3.42Å; Q467-R471 VanDerWaalsContact O-CG 3.28Å; Q467-R471 WeakPolarHBondContact O-CG 3.43Å; Q467-R471 PolarHBondContact O-N 2.56Å
468	L	82.2	Confident	78.2	Confident	52 Å²	52	83.2 Å²	83.2	27%	0.272	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-46	175.2	-174.8	65.3	0	0	0	111.2	L457 L459 G464 W465 G470 R471 M472	L457-L468 HydrophobicContact CD2-CD1 4.29Å; L459-L468 HydrophobicContact CD1-CB 4.42Å; L459-L468 HydrophobicContact CD1-CD2 4.28Å; G464-L468 WeakPolarHBondContact O-CB 3.46Å; G464-L468 PolarHBondContact O-N 3.37Å; W465-L468 PolarHBondContact O-N 2.91Å; L468-G470 VanDerWaalsContact C-N 3.33Å; L468-G470 PolarHBondContact O-N 2.98Å; L468-R471 PolarHBondContact O-N 2.85Å; L468-M472 WeakPolarHBondContact O-CG 3.45Å; L468-M472 PolarHBondContact O-N 2.95Å
469	L	87.6	Confident	80.1	Confident	123 Å²	123	84.4 Å²	84.4	64%	0.644	41%	0.407	S	S	*	.	H	α-helix	trans	-57.2	-46.3	174.6	-171.6	78.1	0	0	0	111.3	W465 L466 M472 F473	W465-L469 WeakPolarHBondContact O-CB 3.35Å; W465-L469 PolarHBondContact O-N 2.74Å; L466-L469 PolarHBondContact O-N 3.24Å; L469-M472 PolarHBondContact O-N 3.15Å; L469-F473 WeakPolarHBondContact O-CB 3.27Å; L469-F473 PolarHBondContact O-N 2.84Å
470	G	87.5	Confident	81.9	Confident	10 Å²	10	84.6 Å²	84.6	10%	0.103	41%	0.413	C	S	.	.	H	α-helix	trans	-60.6	-46	176.3	0	0	0	0	0	113	L466 Q467 L468 M472 F473 V474	L466-G470 PolarHBondContact O-N 3.34Å; Q467-G470 PolarHBondContact O-N 2.95Å; L468-G470 VanDerWaalsContact C-N 3.33Å; L468-G470 PolarHBondContact O-N 2.98Å; G470-M472 PolarHBondContact O-N 2.82Å; G470-F473 PolarHBondContact O-N 3.14Å; G470-V474 WeakPolarHBondContact O-CB 3.4Å; G470-V474 VanDerWaalsContact O-CG2 3.3Å; G470-V474 WeakPolarHBondContact O-CG2 3.39Å; G470-V474 PolarHBondContact O-N 3.14Å
471	R	87.3	Confident	83.7	Confident	81 Å²	81	79.7 Å²	79.7	31%	0.306	38%	0.383	S	S	.	.	H	α-helix	trans	-60.9	-43.6	175.7	-73.1	173.2	-174.4	-162.6	2.6	112.1	V442 P456 Q467 L468 L475 Y524	V442-R471 HydrophobicContact CG1-CG 4.05Å; P456-R471 PolarHBondContact O-NH1 3.44Å; Q467-R471 WeakPolarHBondContact O-CB 3.42Å; Q467-R471 VanDerWaalsContact O-CG 3.28Å; Q467-R471 WeakPolarHBondContact O-CG 3.43Å; Q467-R471 PolarHBondContact O-N 2.56Å; L468-R471 PolarHBondContact O-N 2.85Å; R471-L475 WeakPolarHBondContact O-CB 3.03Å; R471-L475 PolarHBondContact O-N 3.3Å; R471-Y524 PolarHBondContact NH1-OH 3.43Å
472	M	90.1	Very high	85.5	Confident	97 Å²	97	73 Å²	73	48%	0.478	35%	0.354	S	S	.	.	H	α-helix	trans	-64.8	-44.4	177.6	-70	-56.3	-61.4	0	0	111.9	L468 L469 G470 L475 I476	L468-M472 WeakPolarHBondContact O-CG 3.45Å; L468-M472 PolarHBondContact O-N 2.95Å; L469-M472 PolarHBondContact O-N 3.15Å; G470-M472 PolarHBondContact O-N 2.82Å; M472-L475 PolarHBondContact O-N 3.36Å; M472-I476 HydrophobicContact CE-CD1 4.49Å; M472-I476 WeakPolarHBondContact O-CB 3.37Å; M472-I476 WeakPolarHBondContact O-CD1 3.04Å; M472-I476 VanDerWaalsContact O-CG1 3.23Å; M472-I476 WeakPolarHBondContact O-CG1 3.49Å; M472-I476 PolarHBondContact O-N 2.61Å
473	F	93.1	Very high	87.3	Confident	62 Å²	62	67.3 Å²	67.3	27%	0.272	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-47.8	176.4	175.2	-113.2	0	0	0	111.9	T438 L469 G470 L475 I476 W477	T438-F473 HydrophobicContact CG2-CD1 4Å; T438-F473 HydrophobicContact CG2-CE1 4.25Å; T438-F473 WeakPolarHBondContact OG1-CD1 3.47Å; T438-F473 WeakPolarHBondContact OG1-CE1 3.48Å; L469-F473 WeakPolarHBondContact O-CB 3.27Å; L469-F473 PolarHBondContact O-N 2.84Å; G470-F473 PolarHBondContact O-N 3.14Å; F473-L475 PolarHBondContact O-N 3.45Å; F473-I476 PolarHBondContact O-N 3.07Å; F473-W477 VanDerWaalsContact O-CB 3.28Å; F473-W477 WeakPolarHBondContact O-CB 3.44Å; F473-W477 PolarHBondContact O-N 2.89Å
474	V	93.4	Very high	88.7	Confident	8 Å²	8	65.2 Å²	65.2	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-44.8	176.5	166.7	0	0	0	0	111.3	Y435 L439 G470 A478 V517	Y435-V474 HydrophobicContact CD2-CG2 4.37Å; Y435-V474 HydrophobicContact CE2-CB 4.3Å; Y435-V474 HydrophobicContact CE2-CG1 4Å; Y435-V474 HydrophobicContact CE2-CG2 4.4Å; L439-V474 HydrophobicContact CB-CG2 4.39Å; L439-V474 HydrophobicContact CD1-CG1 3.98Å; G470-V474 WeakPolarHBondContact O-CB 3.4Å; G470-V474 VanDerWaalsContact O-CG2 3.3Å; G470-V474 WeakPolarHBondContact O-CG2 3.39Å; G470-V474 PolarHBondContact O-N 3.14Å; V474-A478 WeakPolarHBondContact O-CB 3.48Å; V474-A478 PolarHBondContact O-N 3.49Å; V474-V517 HydrophobicContact CG1-CG1 3.67Å
475	L	92.5	Very high	89.6	Confident	55 Å²	55	65.3 Å²	65.3	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-65.8	-47.9	179.5	-178.8	61.8	0	0	0	112.4	R471 M472 F473 W477 A478 M479 V521	R471-L475 WeakPolarHBondContact O-CB 3.03Å; R471-L475 PolarHBondContact O-N 3.3Å; M472-L475 PolarHBondContact O-N 3.36Å; F473-L475 PolarHBondContact O-N 3.45Å; L475-W477 VanDerWaalsContact C-N 3.32Å; L475-W477 PolarHBondContact O-N 3.49Å; L475-A478 PolarHBondContact O-N 2.99Å; L475-M479 HydrophobicContact CD1-CG 4.4Å; L475-M479 VanDerWaalsContact O-CG 3.31Å; L475-M479 WeakPolarHBondContact O-CG 3.45Å; L475-M479 PolarHBondContact O-N 3.01Å; L475-V521 HydrophobicContact CD1-CG1 4.33Å; L475-V521 HydrophobicContact CD1-CG2 4.4Å
476	I	94	Very high	90.2	Very high	108 Å²	108	58 Å²	58	55%	0.554	30%	0.302	S	S	*	.	H	α-helix	trans	-61.4	-43.2	179.4	-68	164.7	0	0	0	110.4	M472 F473 M479 C480	M472-I476 HydrophobicContact CE-CD1 4.49Å; M472-I476 WeakPolarHBondContact O-CB 3.37Å; M472-I476 WeakPolarHBondContact O-CD1 3.04Å; M472-I476 VanDerWaalsContact O-CG1 3.23Å; M472-I476 WeakPolarHBondContact O-CG1 3.49Å; M472-I476 PolarHBondContact O-N 2.61Å; F473-I476 PolarHBondContact O-N 3.07Å; I476-M479 PolarHBondContact O-N 3.27Å; I476-C480 WeakPolarHBondContact O-CB 3.43Å; I476-C480 PolarHBondContact O-N 3.18Å
477	W	94.9	Very high	90.6	Very high	57 Å²	57	57.1 Å²	57.1	22%	0.216	30%	0.297	C	S	.	.	H	α-helix	trans	-70.6	-40.1	-179.6	-160.1	-102.3	0	0	0	112.4	F431 Y435 F473 L475 M479 C480 I481	F431-W477 HydrophobicContact CB-CH2 3.6Å; F431-W477 HydrophobicContact CB-CZ2 3.48Å; F431-W477 VanDerWaalsContact CB-CZ2 3.48Å; F431-W477 HydrophobicContact CB-CZ3 4.4Å; F431-W477 HydrophobicContact CD1-CH2 4.24Å; F431-W477 HydrophobicContact CD1-CZ3 4.32Å; F431-W477 HydrophobicContact CD2-CH2 4.12Å; F431-W477 AromaticContact CG-CH2 3.76Å; F431-W477 HydrophobicContact CG-CH2 3.76Å; F431-W477 HydrophobicContact CG-CZ2 4.17Å; F431-W477 HydrophobicContact CG-CZ3 4.29Å; Y435-W477 AromaticContact CD1-CD1 3.9Å; Y435-W477 HydrophobicContact CD2-CB 3.75Å; Y435-W477 AromaticContact CD2-CD1 3.44Å; Y435-W477 VanDerWaalsContact CD2-CD1 3.44Å; Y435-W477 AromaticContact CD2-CG 3.89Å; Y435-W477 HydrophobicContact CD2-CG 3.89Å; Y435-W477 HydrophobicContact CE2-CB 4.07Å; Y435-W477 AromaticContact CE2-CD1 3.99Å; Y435-W477 HydrophobicContact CE2-CG 4.45Å; Y435-W477 AromaticContact CG-CD1 3.37Å; Y435-W477 HydrophobicContact CG-CG 4.19Å; F473-W477 VanDerWaalsContact O-CB 3.28Å; F473-W477 WeakPolarHBondContact O-CB 3.44Å; F473-W477 PolarHBondContact O-N 2.89Å; L475-W477 VanDerWaalsContact C-N 3.32Å; L475-W477 PolarHBondContact O-N 3.49Å; W477-M479 PolarHBondContact O-N 2.92Å; W477-C480 WeakPolarHBondContact O-CB 3.44Å; W477-C480 PolarHBondContact O-N 3.38Å; W477-I481 WeakPolarHBondContact O-CG1 3.29Å; W477-I481 PolarHBondContact O-N 2.65Å
478	A	94.9	Very high	90.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.8	0	0	0	0	0	111.9	Y435 V474 L475 C480 I481 S482 V517 I518	Y435-A478 HydrophobicContact CE2-CB 4.48Å; V474-A478 WeakPolarHBondContact O-CB 3.48Å; V474-A478 PolarHBondContact O-N 3.49Å; L475-A478 PolarHBondContact O-N 2.99Å; A478-C480 PolarHBondContact O-N 3.44Å; A478-I481 PolarHBondContact O-N 3.34Å; A478-S482 VanDerWaalsContact O-CB 3.32Å; A478-S482 WeakPolarHBondContact O-CB 3.19Å; A478-S482 PolarHBondContact O-N 3.32Å; A478-V517 HydrophobicContact CB-CB 4.17Å; A478-V517 HydrophobicContact CB-CG1 3.9Å; A478-I518 HydrophobicContact CB-CG1 4.14Å
479	M	94.3	Very high	90.9	Very high	92 Å²	92	55.6 Å²	55.6	45%	0.453	29%	0.294	S	S	.	.	H	α-helix	trans	-61.8	-41.8	174.1	-69.9	-62.4	-61.4	0	0	111.8	L475 I476 W477 S482 V483 I518	L475-M479 HydrophobicContact CD1-CG 4.4Å; L475-M479 VanDerWaalsContact O-CG 3.31Å; L475-M479 WeakPolarHBondContact O-CG 3.45Å; L475-M479 PolarHBondContact O-N 3.01Å; I476-M479 PolarHBondContact O-N 3.27Å; W477-M479 PolarHBondContact O-N 2.92Å; M479-S482 PolarHBondContact O-N 3.38Å; M479-V483 WeakPolarHBondContact O-CG2 3.38Å; M479-V483 PolarHBondContact O-N 2.91Å; M479-I518 HydrophobicContact CG-CD1 4.47Å; M479-I518 HydrophobicContact SD-CD1 3.55Å; M479-I518 VanDerWaalsContact SD-CD1 3.55Å; M479-I518 HydrophobicContact SD-CG1 3.89Å; M479-I518 HydrophobicContact SD-CG2 4.45Å
480	C	93.9	Very high	90.8	Very high	69 Å²	69	58.3 Å²	58.3	47%	0.466	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-46.4	177.4	-172.7	0	0	0	0	112.4	I476 W477 A478 V483 K484	I476-C480 WeakPolarHBondContact O-CB 3.43Å; I476-C480 PolarHBondContact O-N 3.18Å; W477-C480 WeakPolarHBondContact O-CB 3.44Å; W477-C480 PolarHBondContact O-N 3.38Å; A478-C480 PolarHBondContact O-N 3.44Å; C480-V483 PolarHBondContact O-N 2.9Å; C480-K484 WeakPolarHBondContact O-CB 3.26Å; C480-K484 PolarHBondContact O-N 3.35Å
481	I	93.1	Very high	90.3	Very high	14 Å²	14	64 Å²	64	7%	0.072	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-48.6	173.9	-66.7	172.6	0	0	0	110.2	Y432 Y435 W477 A478 V483 K484 E485 F510 A514	Y432-I481 HydrophobicContact CD2-CD1 4.13Å; Y432-I481 HydrophobicContact CE2-CD1 4.14Å; Y435-I481 HydrophobicContact CE1-CD1 4.31Å; W477-I481 WeakPolarHBondContact O-CG1 3.29Å; W477-I481 PolarHBondContact O-N 2.65Å; A478-I481 PolarHBondContact O-N 3.34Å; I481-V483 VanDerWaalsContact C-N 3.28Å; I481-V483 PolarHBondContact O-N 3Å; I481-K484 PolarHBondContact O-N 3.06Å; I481-K484 VanDerWaalsContact O-N 3.16Å; I481-E485 HydrophobicContact CG2-CG 3.91Å; I481-E485 WeakPolarHBondContact O-CG 3.18Å; I481-E485 PolarHBondContact O-N 3.19Å; I481-F510 HydrophobicContact CG2-CB 4.21Å; I481-A514 HydrophobicContact CB-CB 4.15Å; I481-A514 HydrophobicContact CG2-CB 3.89Å
482	S	94.1	Very high	89.5	Confident	23 Å²	23	62.9 Å²	62.9	16%	0.161	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-37.8	-178.4	-170.8	0	0	0	0	112.7	A478 M479 G486	A478-S482 VanDerWaalsContact O-CB 3.32Å; A478-S482 WeakPolarHBondContact O-CB 3.19Å; A478-S482 PolarHBondContact O-N 3.32Å; M479-S482 PolarHBondContact O-N 3.38Å; S482-G486 WeakPolarHBondContact O-CA 3.25Å; S482-G486 PolarHBondContact O-N 3.09Å
483	V	93.7	Very high	88.2	Confident	85 Å²	85	68.1 Å²	68.1	52%	0.515	34%	0.342	S	S	.	.	H	α-helix	trans	-73	-45.6	175.2	172.3	0	0	0	0	111.1	M479 C480 I481 G486 I487	M479-V483 WeakPolarHBondContact O-CG2 3.38Å; M479-V483 PolarHBondContact O-N 2.91Å; C480-V483 PolarHBondContact O-N 2.9Å; I481-V483 VanDerWaalsContact C-N 3.28Å; I481-V483 PolarHBondContact O-N 3Å; V483-G486 PolarHBondContact O-N 2.88Å; V483-I487 HydrophobicContact CG1-CD1 3.83Å; V483-I487 VanDerWaalsContact O-CG1 3.3Å; V483-I487 WeakPolarHBondContact O-CG1 3.31Å; V483-I487 PolarHBondContact O-N 3.15Å
484	K	90.4	Very high	86.5	Confident	82 Å²	82	70.4 Å²	70.4	36%	0.357	36%	0.363	S	S	.	.	H	α-helix	trans	-60.3	-50.2	179.9	-168.7	-170.2	73.7	69.6	0	111.8	C480 I481 A488 M690	C480-K484 WeakPolarHBondContact O-CB 3.26Å; C480-K484 PolarHBondContact O-N 3.35Å; I481-K484 PolarHBondContact O-N 3.06Å; I481-K484 VanDerWaalsContact O-N 3.16Å; K484-A488 PolarHBondContact O-N 3.27Å; K484-A488 VanDerWaalsContact O-N 3.13Å; K484-M690 HydrophobicContact CD-CE 4Å; K484-M690 HydrophobicContact CD-SD 4.44Å
485	E	90.6	Very high	84.7	Confident	9 Å²	9	74.3 Å²	74.3	4%	0.042	39%	0.391	C	S	.	.	H	α-helix	trans	-73.5	-32.9	179.9	-54.1	-54	161.7	0	0	111.8	I481 I487 A488 I489 H507 F510 F511	I481-E485 HydrophobicContact CG2-CG 3.91Å; I481-E485 WeakPolarHBondContact O-CG 3.18Å; I481-E485 PolarHBondContact O-N 3.19Å; E485-I487 PolarHBondContact O-N 2.88Å; E485-A488 PolarHBondContact O-N 3.5Å; E485-I489 WeakPolarHBondContact O-CB 3.16Å; E485-I489 VanDerWaalsContact O-CG1 3.28Å; E485-I489 WeakPolarHBondContact O-CG1 3.15Å; E485-I489 PolarHBondContact O-N 2.99Å; E485-H507 IonicContact OE2-CE1 3.59Å; E485-H507 IonicContact OE2-CG 3.75Å; E485-H507 IonicContact OE2-ND1 2.81Å; E485-H507 PolarHBondContact OE2-ND1 3.26Å; E485-F510 HydrophobicContact CG-CB 3.83Å; E485-F511 HydrophobicContact CB-CB 3.98Å; E485-F511 HydrophobicContact CB-CD2 4.27Å
486	G	88.9	Confident	82.8	Confident	25 Å²	25	73.6 Å²	73.6	26%	0.258	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-42.7	173.5	0	0	0	0	0	112.7	S482 V483 F490	S482-G486 WeakPolarHBondContact O-CA 3.25Å; S482-G486 PolarHBondContact O-N 3.09Å; V483-G486 PolarHBondContact O-N 2.88Å; G486-F490 WeakPolarHBondContact O-CB 3.39Å; G486-F490 PolarHBondContact O-N 3.44Å
487	I	87.8	Confident	80.8	Confident	97 Å²	97	74.9 Å²	74.9	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-43.1	173.2	-67.7	165.4	0	0	0	110.7	V483 E485 F490 L491	V483-I487 HydrophobicContact CG1-CD1 3.83Å; V483-I487 VanDerWaalsContact O-CG1 3.3Å; V483-I487 WeakPolarHBondContact O-CG1 3.31Å; V483-I487 PolarHBondContact O-N 3.15Å; E485-I487 PolarHBondContact O-N 2.88Å; I487-F490 PolarHBondContact O-N 2.97Å; I487-L491 HydrophobicContact CG2-CD1 3.73Å; I487-L491 HydrophobicContact CG2-CG 4.32Å; I487-L491 WeakPolarHBondContact O-CB 3.35Å; I487-L491 WeakPolarHBondContact O-CG 3.44Å; I487-L491 PolarHBondContact O-N 3.33Å
488	A	83.6	Confident	79	Confident	24 Å²	24	80.8 Å²	80.8	20%	0.198	42%	0.424	C	S	.	.	H	α-helix	trans	-59.9	-49.5	177.6	0	0	0	0	0	111.6	K484 E485 F490 L491 L492	K484-A488 PolarHBondContact O-N 3.27Å; K484-A488 VanDerWaalsContact O-N 3.13Å; E485-A488 PolarHBondContact O-N 3.5Å; A488-F490 VanDerWaalsContact C-N 3.34Å; A488-F490 PolarHBondContact O-N 2.91Å; A488-L491 PolarHBondContact O-N 2.95Å; A488-L492 WeakPolarHBondContact O-CD1 3.37Å; A488-L492 PolarHBondContact O-N 3.4Å; A488-L492 VanDerWaalsContact O-N 3.09Å
489	I	84.3	Confident	77.4	Confident	47 Å²	47	81.8 Å²	81.8	24%	0.241	43%	0.432	C	S	.	.	H	α-helix	trans	-62.9	-38.9	179.1	-66.6	164.7	0	0	0	111.3	E485 L492 H507 F508 F511	E485-I489 WeakPolarHBondContact O-CB 3.16Å; E485-I489 VanDerWaalsContact O-CG1 3.28Å; E485-I489 WeakPolarHBondContact O-CG1 3.15Å; E485-I489 PolarHBondContact O-N 2.99Å; I489-L492 PolarHBondContact O-N 3.34Å; I489-H507 HydrophobicContact CG1-CB 4.33Å; I489-F508 HydrophobicContact CD1-CD1 3.91Å; I489-F508 HydrophobicContact CD1-CE1 4.17Å; I489-F508 HydrophobicContact CG1-CD1 4.31Å; I489-F508 HydrophobicContact CG1-CE1 4.15Å; I489-F508 HydrophobicContact CG2-CE1 3.96Å; I489-F511 HydrophobicContact CD1-CB 3.82Å; I489-F511 HydrophobicContact CD1-CD1 4.24Å; I489-F511 HydrophobicContact CD1-CD2 4.37Å; I489-F511 HydrophobicContact CD1-CG 3.9Å
490	F	83.8	Confident	75.8	Confident	180 Å²	180	78.6 Å²	78.6	79%	0.789	42%	0.416	S	S	*	.	H	α-helix	trans	-69.9	-33.2	178.3	-176.4	-97.2	0	0	0	113.6	G486 I487 A488	G486-F490 WeakPolarHBondContact O-CB 3.39Å; G486-F490 PolarHBondContact O-N 3.44Å; I487-F490 PolarHBondContact O-N 2.97Å; A488-F490 VanDerWaalsContact C-N 3.34Å; A488-F490 PolarHBondContact O-N 2.91Å
491	L	77.5	Confident	74.2	Confident	129 Å²	129	79.2 Å²	79.2	68%	0.675	41%	0.414	S	S	*	.	H	α-helix	trans	-83.6	-12.6	177.6	-66.4	176.7	0	0	0	113.5	I487 A488	I487-L491 HydrophobicContact CG2-CD1 3.73Å; I487-L491 HydrophobicContact CG2-CG 4.32Å; I487-L491 WeakPolarHBondContact O-CB 3.35Å; I487-L491 WeakPolarHBondContact O-CG 3.44Å; I487-L491 PolarHBondContact O-N 3.33Å; A488-L491 PolarHBondContact O-N 2.95Å
492	L	69.8	Low	72.9	Confident	57 Å²	57	80.8 Å²	80.8	30%	0.298	43%	0.427	S	S	.	.	S	Bend	trans	-72.3	126.3	171	-103.5	74.7	0	0	0	110.3	A488 I489 I500 A504	A488-L492 WeakPolarHBondContact O-CD1 3.37Å; A488-L492 PolarHBondContact O-N 3.4Å; A488-L492 VanDerWaalsContact O-N 3.09Å; I489-L492 PolarHBondContact O-N 3.34Å; L492-I500 HydrophobicContact CD2-CG1 4.42Å; L492-A504 HydrophobicContact CD2-CB 3.55Å
493	R	63.6	Low	71.7	Confident	208 Å²	208	81.3 Å²	81.3	79%	0.785	43%	0.427	S	S	*	.			trans	-69.7	139.8	175.5	-96.5	-177.2	177.6	165.5	0.4	111.2	S495 I500	R493-S495 VanDerWaalsContact C-N 3.29Å; R493-S495 PolarHBondContact O-N 3.26Å; R493-I500 WeakPolarHBondContact O-CD1 3.37Å
494	P	57.3	Low	70.9	Confident	109 Å²	109	77.3 Å²	77.3	71%	0.708	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-74.1	-6.7	-178.3	-19.6	33.1	0	0	0	116.5	D496	P494-D496 PolarHBondContact O-N 3.21Å
495	S	55.1	Low	70.5	Confident	90 Å²	90	79.1 Å²	79.1	63%	0.629	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-67	-21.3	-166.8	47.8	0	0	0	0	114.6	R493	R493-S495 VanDerWaalsContact C-N 3.29Å; R493-S495 PolarHBondContact O-N 3.26Å
496	D	53.5	Low	70.3	Confident	40 Å²	40	79.6 Å²	79.6	21%	0.214	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-119	47.1	-163.3	-49	2.7	0	0	0	111.6	T395 P494 Q498 S499 I500	T395-D496 WeakPolarHBondContact CB-OD2 3.46Å; T395-D496 PolarHBondContact OG1-OD2 2.91Å; P494-D496 PolarHBondContact O-N 3.21Å; D496-Q498 PolarHBondContact O-N 3.25Å; D496-S499 WeakPolarHBondContact CB-OG 3.35Å; D496-S499 PolarHBondContact O-N 2.81Å; D496-S499 PolarHBondContact O-OG 2.8Å; D496-S499 VanDerWaalsContact O-OG 3.11Å; D496-I500 VanDerWaalsContact O-CG1 3.29Å; D496-I500 WeakPolarHBondContact O-CG1 3.43Å; D496-I500 PolarHBondContact O-N 3.24Å
497	L	52.6	Low	70.3	Confident	135 Å²	135	79.3 Å²	79.3	71%	0.707	40%	0.402	S	S	*	.	H	α-helix	trans	-50.2	-30.9	-170	-140.1	96.9	0	0	0	114.6	L501	L497-L501 PolarHBondContact O-N 2.85Å
498	Q	56.7	Low	70.3	Confident	181 Å²	181	78.1 Å²	78.1	85%	0.846	39%	0.394	S	S	*	.	H	α-helix	trans	-73.7	-41.3	177.7	-67.8	179.8	-15.3	0	0	113.6	D496	D496-Q498 PolarHBondContact O-N 3.25Å
499	S	61	Low	70.7	Confident	22 Å²	22	77.6 Å²	77.6	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-76	-30.1	175.8	73.4	0	0	0	0	111.4	T395 D496 L501 S502 D503	T395-S499 VanDerWaalsContact CG2-OG 3.29Å; T395-S499 WeakPolarHBondContact CG2-OG 3.26Å; D496-S499 WeakPolarHBondContact CB-OG 3.35Å; D496-S499 PolarHBondContact O-N 2.81Å; D496-S499 PolarHBondContact O-OG 2.8Å; D496-S499 VanDerWaalsContact O-OG 3.11Å; S499-L501 VanDerWaalsContact C-N 3.32Å; S499-L501 PolarHBondContact O-N 2.9Å; S499-S502 PolarHBondContact O-N 3.47Å; S499-S502 PolarHBondContact O-OG 3.48Å; S499-S502 VanDerWaalsContact O-OG 3.08Å; S499-D503 PolarHBondContact O-N 2.94Å
500	I	59.8	Low	71.1	Confident	24 Å²	24	75.9 Å²	75.9	12%	0.123	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-40	173.4	-67.8	168.8	0	0	0	110.8	L492 R493 D496 S502 A504 W505 F508	L492-I500 HydrophobicContact CD2-CG1 4.42Å; R493-I500 WeakPolarHBondContact O-CD1 3.37Å; D496-I500 VanDerWaalsContact O-CG1 3.29Å; D496-I500 WeakPolarHBondContact O-CG1 3.43Å; D496-I500 PolarHBondContact O-N 3.24Å; I500-S502 VanDerWaalsContact C-N 3.34Å; I500-S502 PolarHBondContact O-N 3.47Å; I500-A504 HydrophobicContact CG2-CB 4.16Å; I500-A504 CarbonylContact O-C 3.57Å; I500-A504 WeakPolarHBondContact O-CA 3.44Å; I500-A504 VanDerWaalsContact O-CB 3.28Å; I500-A504 WeakPolarHBondContact O-CB 3.34Å; I500-A504 PolarHBondContact O-N 2.97Å; I500-W505 PolarHBondContact O-N 3.19Å; I500-F508 HydrophobicContact CG2-CE2 3.71Å; I500-F508 HydrophobicContact CG2-CZ 4.04Å
501	L	61.6	Low	71.7	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.435	36%	0.355	S	S	.	.	H	α-helix	trans	-68.1	-30	179.1	-162.7	74.2	0	0	0	113.1	L497 S499 W505 L568	L497-L501 PolarHBondContact O-N 2.85Å; S499-L501 VanDerWaalsContact C-N 3.32Å; S499-L501 PolarHBondContact O-N 2.9Å; L501-W505 HydrophobicContact CD1-CE3 4.15Å; L501-W505 HydrophobicContact CD1-CZ3 4.36Å; L501-L568 HydrophobicContact CD2-CD2 3.91Å; L501-L568 HydrophobicContact CG-CD2 4.2Å
502	S	65.6	Low	72.4	Confident	47 Å²	47	68.4 Å²	68.4	33%	0.329	34%	0.343	S	S	.	.	H	α-helix	trans	-89.5	-44.7	177.9	54.5	0	0	0	0	113.1	S499 I500 Q564	S499-S502 PolarHBondContact O-N 3.47Å; S499-S502 PolarHBondContact O-OG 3.48Å; S499-S502 VanDerWaalsContact O-OG 3.08Å; I500-S502 VanDerWaalsContact C-N 3.34Å; I500-S502 PolarHBondContact O-N 3.47Å; S502-Q564 PolarHBondContact O-NE2 2.96Å
503	D	69.2	Low	73.7	Confident	33 Å²	33	65.7 Å²	65.7	18%	0.176	33%	0.329	C	S	.	.	H	α-helix	trans	-91.9	-29.6	-174.4	-78.2	-20.6	0	0	0	113.6	R400 S499	R400-D503 IonicContact NH1-OD2 3.66Å; S499-D503 PolarHBondContact O-N 2.94Å
504	A	75.4	Confident	75.2	Confident	2 Å²	2	55.8 Å²	55.8	2%	0.017	29%	0.292	C	S	.	.	S	Bend	trans	-108.2	-1.8	-171.9	0	0	0	0	0	115.6	L492 I500 F506 H507 F508	L492-A504 HydrophobicContact CD2-CB 3.55Å; I500-A504 HydrophobicContact CG2-CB 4.16Å; I500-A504 CarbonylContact O-C 3.57Å; I500-A504 WeakPolarHBondContact O-CA 3.44Å; I500-A504 VanDerWaalsContact O-CB 3.28Å; I500-A504 WeakPolarHBondContact O-CB 3.34Å; I500-A504 PolarHBondContact O-N 2.97Å; A504-F506 VanDerWaalsContact C-N 3.26Å; A504-F506 PolarHBondContact O-N 2.75Å; A504-F506 VanDerWaalsContact O-N 3.1Å; A504-H507 WeakPolarHBondContact O-CB 3.4Å; A504-H507 PolarHBondContact O-N 3.28Å; A504-F508 HydrophobicContact CB-CE2 4.45Å
505	W	82.9	Confident	77	Confident	120 Å²	120	53.4 Å²	53.4	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-42.3	-48.2	179.8	174.3	-103.2	0	0	0	114.1	I500 L501 H507 F508 V509	I500-W505 PolarHBondContact O-N 3.19Å; L501-W505 HydrophobicContact CD1-CE3 4.15Å; L501-W505 HydrophobicContact CD1-CZ3 4.36Å; W505-H507 VanDerWaalsContact C-N 3.3Å; W505-H507 PolarHBondContact O-N 3.27Å; W505-F508 WeakPolarHBondContact O-CB 3.29Å; W505-F508 PolarHBondContact O-N 2.96Å; W505-F508 VanDerWaalsContact O-N 3.08Å; W505-V509 HydrophobicContact CD2-CG2 4.06Å; W505-V509 VanDerWaalsContact CE2-CG2 3.49Å; W505-V509 HydrophobicContact CG-CG2 4.28Å; W505-V509 HydrophobicContact CZ2-CG2 3.85Å; W505-V509 WeakPolarHBondContact O-CG2 3.46Å; W505-V509 PolarHBondContact O-N 3.31Å; W505-V509 VanDerWaalsContact O-N 3.14Å
506	F	86.2	Confident	78.9	Confident	18 Å²	18	50.9 Å²	50.9	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-34.3	-177.4	-73.6	-82.3	0	0	0	113.6	A504 F508 V509 F510 Y548 R551	A504-F506 VanDerWaalsContact C-N 3.26Å; A504-F506 PolarHBondContact O-N 2.75Å; A504-F506 VanDerWaalsContact O-N 3.1Å; F506-F508 VanDerWaalsContact C-N 3.3Å; F506-F508 PolarHBondContact O-N 2.79Å; F506-V509 PolarHBondContact O-N 2.95Å; F506-F510 HydrophobicContact CB-CD2 4.25Å; F506-F510 HydrophobicContact CB-CE2 4.18Å; F506-F510 HydrophobicContact CD1-CE2 4.46Å; F506-F510 WeakPolarHBondContact O-CD2 3.28Å; F506-F510 PolarHBondContact O-N 2.93Å; F506-Y548 HydrophobicContact CB-CD2 3.87Å; F506-Y548 HydrophobicContact CB-CE2 4.27Å; F506-Y548 AromaticContact CD1-CD2 3.8Å; F506-Y548 HydrophobicContact CD1-CD2 3.8Å; F506-Y548 HydrophobicContact CD1-CG 4.24Å; F506-Y548 HydrophobicContact CD2-CD2 4.08Å; F506-Y548 HydrophobicContact CE1-CD2 4.35Å; F506-Y548 AromaticContact CG-CD2 3.64Å; F506-Y548 HydrophobicContact CG-CD2 3.64Å; F506-Y548 HydrophobicContact CG-CE2 4.41Å; F506-R551 VanDerWaalsContact CE2-NH2 3.34Å
507	H	88.4	Confident	80.9	Confident	19 Å²	19	49 Å²	49	9%	0.088	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-42.1	175.8	-62.1	-66.6	0	0	0	111	E485 I489 A504 W505 F511 R682 E686	E485-H507 IonicContact OE2-CE1 3.59Å; E485-H507 IonicContact OE2-CG 3.75Å; E485-H507 IonicContact OE2-ND1 2.81Å; E485-H507 PolarHBondContact OE2-ND1 3.26Å; I489-H507 HydrophobicContact CG1-CB 4.33Å; A504-H507 WeakPolarHBondContact O-CB 3.4Å; A504-H507 PolarHBondContact O-N 3.28Å; W505-H507 VanDerWaalsContact C-N 3.3Å; W505-H507 PolarHBondContact O-N 3.27Å; H507-F511 VanDerWaalsContact O-CB 3.24Å; H507-F511 WeakPolarHBondContact O-CB 3.35Å; H507-F511 PolarHBondContact O-N 3.22Å; H507-R682 PolarHBondContact NE2-NH2 3.05Å; H507-R682 VanDerWaalsContact NE2-NH2 3.13Å; H507-E686 IonicContact NE2-OE1 3.09Å
508	F	89.5	Confident	82.8	Confident	73 Å²	73	43.6 Å²	43.6	32%	0.32	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-43	175	-63.1	-74.7	0	0	0	112.1	I489 I500 A504 W505 F506 F511 I512	I489-F508 HydrophobicContact CD1-CD1 3.91Å; I489-F508 HydrophobicContact CD1-CE1 4.17Å; I489-F508 HydrophobicContact CG1-CD1 4.31Å; I489-F508 HydrophobicContact CG1-CE1 4.15Å; I489-F508 HydrophobicContact CG2-CE1 3.96Å; I500-F508 HydrophobicContact CG2-CE2 3.71Å; I500-F508 HydrophobicContact CG2-CZ 4.04Å; A504-F508 HydrophobicContact CB-CE2 4.45Å; W505-F508 WeakPolarHBondContact O-CB 3.29Å; W505-F508 PolarHBondContact O-N 2.96Å; W505-F508 VanDerWaalsContact O-N 3.08Å; F506-F508 VanDerWaalsContact C-N 3.3Å; F506-F508 PolarHBondContact O-N 2.79Å; F508-F511 PolarHBondContact O-N 3.31Å; F508-I512 WeakPolarHBondContact O-CB 3.27Å; F508-I512 WeakPolarHBondContact O-CD1 3.46Å; F508-I512 VanDerWaalsContact O-CG1 3.23Å; F508-I512 WeakPolarHBondContact O-CG1 3.24Å; F508-I512 PolarHBondContact O-N 3.01Å
509	V	91.4	Very high	84.6	Confident	12 Å²	12	38.6 Å²	38.6	7%	0.073	20%	0.195	C	C	.	.	H	α-helix	trans	-71.4	-36.8	-178.1	-164.9	0	0	0	0	112.4	W505 F506 Q513 L541 N545	W505-V509 HydrophobicContact CD2-CG2 4.06Å; W505-V509 VanDerWaalsContact CE2-CG2 3.49Å; W505-V509 HydrophobicContact CG-CG2 4.28Å; W505-V509 HydrophobicContact CZ2-CG2 3.85Å; W505-V509 WeakPolarHBondContact O-CG2 3.46Å; W505-V509 PolarHBondContact O-N 3.31Å; W505-V509 VanDerWaalsContact O-N 3.14Å; F506-V509 PolarHBondContact O-N 2.95Å; V509-Q513 WeakPolarHBondContact O-CB 3.01Å; V509-Q513 PolarHBondContact O-N 2.99Å; V509-L541 HydrophobicContact CG1-CD1 3.5Å; V509-L541 HydrophobicContact CG1-CD2 3.86Å; V509-L541 HydrophobicContact CG1-CG 3.62Å; V509-N545 WeakPolarHBondContact CB-OD1 3.47Å; V509-N545 WeakPolarHBondContact CG1-OD1 3.44Å; V509-N545 PolarHBondContact O-ND2 3.11Å
510	F	93.3	Very high	86	Confident	11 Å²	11	37.9 Å²	37.9	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-40.9	170.6	-77.4	-63.9	0	0	0	111.7	Y432 I481 E485 F506 Q513 A514 N545 Y548 Y549	Y432-F510 HydrophobicContact CD2-CE1 4.26Å; Y432-F510 AromaticContact CE1-CE1 4Å; Y432-F510 HydrophobicContact CE1-CE1 4Å; Y432-F510 HydrophobicContact CE2-CD1 4Å; Y432-F510 AromaticContact CE2-CE1 3.69Å; Y432-F510 HydrophobicContact CE2-CE1 3.69Å; Y432-F510 AromaticContact CZ-CE1 3.56Å; I481-F510 HydrophobicContact CG2-CB 4.21Å; E485-F510 HydrophobicContact CG-CB 3.83Å; F506-F510 HydrophobicContact CB-CD2 4.25Å; F506-F510 HydrophobicContact CB-CE2 4.18Å; F506-F510 HydrophobicContact CD1-CE2 4.46Å; F506-F510 WeakPolarHBondContact O-CD2 3.28Å; F506-F510 PolarHBondContact O-N 2.93Å; F510-Q513 PolarHBondContact O-N 2.87Å; F510-A514 WeakPolarHBondContact O-CB 3.39Å; F510-A514 PolarHBondContact O-N 3.41Å; F510-N545 HydrophobicContact CD1-CB 4.18Å; F510-N545 HydrophobicContact CE1-CB 3.71Å; F510-N545 HydrophobicContact CZ-CB 4.16Å; F510-Y548 HydrophobicContact CE2-CD1 4.09Å; F510-Y548 HydrophobicContact CE2-CD2 4.06Å; F510-Y548 AromaticContact CE2-CG 3.8Å; F510-Y548 HydrophobicContact CE2-CG 3.8Å; F510-Y548 HydrophobicContact CZ-CD1 4.06Å; F510-Y548 AromaticContact CZ-CG 3.97Å; F510-Y548 HydrophobicContact CZ-CG 3.97Å; F510-Y549 HydrophobicContact CZ-CE2 4.4Å
511	F	94.4	Very high	87.4	Confident	66 Å²	66	39 Å²	39	29%	0.289	20%	0.197	S	C	.	.	H	α-helix	trans	-63.3	-48.8	176	-176.2	-102.8	0	0	0	112	E485 I489 H507 F508 Q513 A514 V515	E485-F511 HydrophobicContact CB-CB 3.98Å; E485-F511 HydrophobicContact CB-CD2 4.27Å; I489-F511 HydrophobicContact CD1-CB 3.82Å; I489-F511 HydrophobicContact CD1-CD1 4.24Å; I489-F511 HydrophobicContact CD1-CD2 4.37Å; I489-F511 HydrophobicContact CD1-CG 3.9Å; H507-F511 VanDerWaalsContact O-CB 3.24Å; H507-F511 WeakPolarHBondContact O-CB 3.35Å; H507-F511 PolarHBondContact O-N 3.22Å; F508-F511 PolarHBondContact O-N 3.31Å; F511-Q513 VanDerWaalsContact C-N 3.33Å; F511-Q513 PolarHBondContact O-N 2.63Å; F511-A514 PolarHBondContact O-N 3.19Å; F511-V515 HydrophobicContact CD1-CG2 4.17Å; F511-V515 HydrophobicContact CD2-CG2 4.47Å; F511-V515 HydrophobicContact CE1-CG2 3.82Å; F511-V515 HydrophobicContact CE2-CG2 4.16Å; F511-V515 HydrophobicContact CG-CG2 4.48Å; F511-V515 HydrophobicContact CZ-CG2 3.81Å; F511-V515 WeakPolarHBondContact O-CB 3.47Å; F511-V515 WeakPolarHBondContact O-CG2 3.28Å; F511-V515 PolarHBondContact O-N 3.11Å
512	I	94.3	Very high	88.8	Confident	86 Å²	86	40.2 Å²	40.2	44%	0.441	20%	0.2	S	C	.	.	H	α-helix	trans	-59	-43.9	176.7	-69.2	163.1	0	0	0	110.7	F508 A514 V515 L516 L541	F508-I512 WeakPolarHBondContact O-CB 3.27Å; F508-I512 WeakPolarHBondContact O-CD1 3.46Å; F508-I512 VanDerWaalsContact O-CG1 3.23Å; F508-I512 WeakPolarHBondContact O-CG1 3.24Å; F508-I512 PolarHBondContact O-N 3.01Å; I512-A514 PolarHBondContact O-N 2.57Å; I512-V515 PolarHBondContact O-N 3.1Å; I512-L516 HydrophobicContact CG2-CD1 3.91Å; I512-L516 HydrophobicContact CG2-CG 4.31Å; I512-L516 WeakPolarHBondContact O-CB 3.46Å; I512-L516 VanDerWaalsContact O-CG 3.28Å; I512-L516 WeakPolarHBondContact O-CG 3.24Å; I512-L516 PolarHBondContact O-N 3.09Å; I512-L541 HydrophobicContact CB-CD2 4.32Å; I512-L541 HydrophobicContact CG2-CD2 3.82Å
513	Q	95.6	Very high	89.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-49.1	176.1	-170.1	-158	-3.6	0	0	111.6	Y432 N436 V509 F510 F511 L516 V517 A538 L541 G542 N545	Y432-Q513 PolarHBondContact OH-NE2 3.39Å; Y432-Q513 PolarHBondContact OH-OE1 3.28Å; N436-Q513 PolarHBondContact OD1-NE2 3.13Å; V509-Q513 WeakPolarHBondContact O-CB 3.01Å; V509-Q513 PolarHBondContact O-N 2.99Å; F510-Q513 PolarHBondContact O-N 2.87Å; F511-Q513 VanDerWaalsContact C-N 3.33Å; F511-Q513 PolarHBondContact O-N 2.63Å; Q513-L516 PolarHBondContact O-N 3.08Å; Q513-V517 PolarHBondContact O-N 3.27Å; Q513-V517 VanDerWaalsContact O-N 3.1Å; Q513-A538 WeakPolarHBondContact CG-O 3.29Å; Q513-L541 HydrophobicContact CB-CD2 4.14Å; Q513-G542 VanDerWaalsContact CD-CA 3.45Å; Q513-N545 PolarHBondContact OE1-ND2 3.22Å; Q513-N545 VanDerWaalsContact OE1-ND2 3.13Å
514	A	95.3	Very high	90.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-44.6	-179.9	0	0	0	0	0	111.9	I481 F510 F511 I512 L516 V517 I518	I481-A514 HydrophobicContact CB-CB 4.15Å; I481-A514 HydrophobicContact CG2-CB 3.89Å; F510-A514 WeakPolarHBondContact O-CB 3.39Å; F510-A514 PolarHBondContact O-N 3.41Å; F511-A514 PolarHBondContact O-N 3.19Å; I512-A514 PolarHBondContact O-N 2.57Å; A514-L516 PolarHBondContact O-N 3.19Å; A514-V517 PolarHBondContact O-N 3.14Å; A514-I518 WeakPolarHBondContact O-CD1 3.12Å; A514-I518 VanDerWaalsContact O-CG1 3.29Å; A514-I518 WeakPolarHBondContact O-CG1 3.23Å; A514-I518 PolarHBondContact O-N 3.35Å
515	V	95.4	Very high	91	Very high	59 Å²	59	45.1 Å²	45.1	36%	0.358	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-41.6	176.4	171.2	0	0	0	0	111.6	F511 I512 V517 I518 L519	F511-V515 HydrophobicContact CD1-CG2 4.17Å; F511-V515 HydrophobicContact CD2-CG2 4.47Å; F511-V515 HydrophobicContact CE1-CG2 3.82Å; F511-V515 HydrophobicContact CE2-CG2 4.16Å; F511-V515 HydrophobicContact CG-CG2 4.48Å; F511-V515 HydrophobicContact CZ-CG2 3.81Å; F511-V515 WeakPolarHBondContact O-CB 3.47Å; F511-V515 WeakPolarHBondContact O-CG2 3.28Å; F511-V515 PolarHBondContact O-N 3.11Å; I512-V515 PolarHBondContact O-N 3.1Å; V515-V517 PolarHBondContact O-N 2.86Å; V515-I518 PolarHBondContact O-N 3.05Å; V515-L519 WeakPolarHBondContact O-CB 3.24Å; V515-L519 PolarHBondContact O-N 3.46Å
516	L	95.1	Very high	91.1	Very high	37 Å²	37	46.3 Å²	46.3	19%	0.194	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-38	176.2	-73.3	171.1	0	0	0	112.5	I512 Q513 A514 S520 L537 A538 L541	I512-L516 HydrophobicContact CG2-CD1 3.91Å; I512-L516 HydrophobicContact CG2-CG 4.31Å; I512-L516 WeakPolarHBondContact O-CB 3.46Å; I512-L516 VanDerWaalsContact O-CG 3.28Å; I512-L516 WeakPolarHBondContact O-CG 3.24Å; I512-L516 PolarHBondContact O-N 3.09Å; Q513-L516 PolarHBondContact O-N 3.08Å; A514-L516 PolarHBondContact O-N 3.19Å; L516-S520 WeakPolarHBondContact O-CB 3.21Å; L516-S520 PolarHBondContact O-N 3.41Å; L516-L537 HydrophobicContact CD1-CB 4.35Å; L516-A538 HydrophobicContact CB-CB 3.79Å; L516-L541 HydrophobicContact CD1-CD2 4.47Å
517	V	94.6	Very high	90.8	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-49.6	173.8	173.8	0	0	0	0	110.8	L439 V474 A478 Q513 A514 V515 L519 S520 V521 A538	L439-V517 HydrophobicContact CD1-CG2 4.35Å; L439-V517 HydrophobicContact CD2-CG2 4.32Å; V474-V517 HydrophobicContact CG1-CG1 3.67Å; A478-V517 HydrophobicContact CB-CB 4.17Å; A478-V517 HydrophobicContact CB-CG1 3.9Å; Q513-V517 PolarHBondContact O-N 3.27Å; Q513-V517 VanDerWaalsContact O-N 3.1Å; A514-V517 PolarHBondContact O-N 3.14Å; V515-V517 PolarHBondContact O-N 2.86Å; V517-L519 VanDerWaalsContact C-N 3.33Å; V517-L519 PolarHBondContact O-N 3.13Å; V517-S520 PolarHBondContact O-N 2.92Å; V517-S520 VanDerWaalsContact O-N 3.14Å; V517-S520 PolarHBondContact O-OG 3.42Å; V517-V521 PolarHBondContact O-N 2.82Å; V517-A538 HydrophobicContact CG2-CB 3.63Å
518	I	93.8	Very high	90.6	Very high	21 Å²	21	53 Å²	53	11%	0.108	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-45.1	178.8	-67.7	161.3	0	0	0	110.7	A478 M479 A514 V515 S520 V521 F522	A478-I518 HydrophobicContact CB-CG1 4.14Å; M479-I518 HydrophobicContact CG-CD1 4.47Å; M479-I518 HydrophobicContact SD-CD1 3.55Å; M479-I518 VanDerWaalsContact SD-CD1 3.55Å; M479-I518 HydrophobicContact SD-CG1 3.89Å; M479-I518 HydrophobicContact SD-CG2 4.45Å; A514-I518 WeakPolarHBondContact O-CD1 3.12Å; A514-I518 VanDerWaalsContact O-CG1 3.29Å; A514-I518 WeakPolarHBondContact O-CG1 3.23Å; A514-I518 PolarHBondContact O-N 3.35Å; V515-I518 PolarHBondContact O-N 3.05Å; I518-S520 PolarHBondContact O-N 3.06Å; I518-V521 PolarHBondContact O-N 3.14Å; I518-F522 HydrophobicContact CG2-CD2 3.78Å; I518-F522 HydrophobicContact CG2-CE2 3.45Å; I518-F522 VanDerWaalsContact CG2-CE2 3.45Å; I518-F522 VanDerWaalsContact O-CD2 3.27Å; I518-F522 WeakPolarHBondContact O-CD2 3.14Å; I518-F522 PolarHBondContact O-N 3.48Å
519	L	94.3	Very high	90.2	Very high	77 Å²	77	57.6 Å²	57.6	40%	0.403	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.3	-178.6	62.8	0	0	0	111.9	V515 V517 V521 F522 L523	V515-L519 WeakPolarHBondContact O-CB 3.24Å; V515-L519 PolarHBondContact O-N 3.46Å; V517-L519 VanDerWaalsContact C-N 3.33Å; V517-L519 PolarHBondContact O-N 3.13Å; L519-V521 VanDerWaalsContact C-N 3.3Å; L519-V521 PolarHBondContact O-N 3.33Å; L519-F522 PolarHBondContact O-N 3.45Å; L519-L523 HydrophobicContact CD1-CD1 4.36Å; L519-L523 HydrophobicContact CD1-CG 4.28Å; L519-L523 HydrophobicContact CG-CD1 4.03Å; L519-L523 HydrophobicContact CG-CG 4.39Å; L519-L523 WeakPolarHBondContact O-CB 3.4Å; L519-L523 WeakPolarHBondContact O-CG 3.41Å; L519-L523 PolarHBondContact O-N 2.95Å
520	S	90.5	Very high	89.9	Confident	7 Å²	7	62.4 Å²	62.4	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-62.1	-36.6	176	78.4	0	0	0	0	112.3	L516 V517 I518 Y524 Y531	L516-S520 WeakPolarHBondContact O-CB 3.21Å; L516-S520 PolarHBondContact O-N 3.41Å; V517-S520 PolarHBondContact O-N 2.92Å; V517-S520 VanDerWaalsContact O-N 3.14Å; V517-S520 PolarHBondContact O-OG 3.42Å; I518-S520 PolarHBondContact O-N 3.06Å; S520-Y524 VanDerWaalsContact O-CB 3.31Å; S520-Y524 WeakPolarHBondContact O-CB 3.35Å; S520-Y524 PolarHBondContact O-N 2.78Å; S520-Y531 VanDerWaalsContact O-CB 3.27Å; S520-Y531 WeakPolarHBondContact O-CB 3.28Å
521	V	89.3	Confident	89.7	Confident	46 Å²	46	63.2 Å²	63.2	28%	0.279	31%	0.306	S	S	.	.	H	α-helix	trans	-68.6	-42.7	175.6	174.8	0	0	0	0	111	L475 V517 I518 L519 Y524 L525	L475-V521 HydrophobicContact CD1-CG1 4.33Å; L475-V521 HydrophobicContact CD1-CG2 4.4Å; V517-V521 PolarHBondContact O-N 2.82Å; I518-V521 PolarHBondContact O-N 3.14Å; L519-V521 VanDerWaalsContact C-N 3.3Å; L519-V521 PolarHBondContact O-N 3.33Å; V521-Y524 PolarHBondContact O-N 2.98Å; V521-L525 WeakPolarHBondContact O-CG 3.34Å; V521-L525 PolarHBondContact O-N 3.35Å
522	F	90.1	Very high	89.3	Confident	110 Å²	110	63.6 Å²	63.6	48%	0.482	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-46.9	173.9	-76.4	-60	0	0	0	112.4	I518 L519 Y524 L525 F526	I518-F522 HydrophobicContact CG2-CD2 3.78Å; I518-F522 HydrophobicContact CG2-CE2 3.45Å; I518-F522 VanDerWaalsContact CG2-CE2 3.45Å; I518-F522 VanDerWaalsContact O-CD2 3.27Å; I518-F522 WeakPolarHBondContact O-CD2 3.14Å; I518-F522 PolarHBondContact O-N 3.48Å; L519-F522 PolarHBondContact O-N 3.45Å; F522-Y524 VanDerWaalsContact C-N 3.27Å; F522-Y524 PolarHBondContact O-N 3.37Å; F522-L525 WeakPolarHBondContact O-CB 3.29Å; F522-L525 PolarHBondContact O-N 3.32Å; F522-L525 VanDerWaalsContact O-N 3.12Å; F522-F526 HydrophobicContact CB-CE2 4.49Å; F522-F526 WeakPolarHBondContact O-CD2 3.21Å; F522-F526 PolarHBondContact O-N 3.26Å
523	L	88.9	Confident	89.1	Confident	33 Å²	33	62.3 Å²	62.3	17%	0.173	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-34.4	177.2	-71.5	173.5	0	0	0	112.3	L519 F526 A527 Y528	L519-L523 HydrophobicContact CD1-CD1 4.36Å; L519-L523 HydrophobicContact CD1-CG 4.28Å; L519-L523 HydrophobicContact CG-CD1 4.03Å; L519-L523 HydrophobicContact CG-CG 4.39Å; L519-L523 WeakPolarHBondContact O-CB 3.4Å; L519-L523 WeakPolarHBondContact O-CG 3.41Å; L519-L523 PolarHBondContact O-N 2.95Å; L523-F526 PolarHBondContact O-N 3.32Å; L523-A527 PolarHBondContact O-N 3.49Å; L523-Y528 HydrophobicContact CD2-CD2 3.64Å; L523-Y528 HydrophobicContact CD2-CE2 4.45Å; L523-Y528 HydrophobicContact CD2-CG 4.14Å; L523-Y528 PolarHBondContact O-N 2.87Å; L523-Y528 VanDerWaalsContact O-N 3.15Å
524	Y	84	Confident	89	Confident	54 Å²	54	63.3 Å²	63.3	21%	0.212	32%	0.32	C	S	.	.	H	α-helix	trans	-67	-39.5	173	-178.5	-102.7	0	0	0	112.4	P456 R471 S520 V521 F522 A527 Y531	P456-Y524 HydrophobicContact CB-CD1 4.23Å; P456-Y524 HydrophobicContact CB-CE1 3.64Å; R471-Y524 PolarHBondContact NH1-OH 3.43Å; S520-Y524 VanDerWaalsContact O-CB 3.31Å; S520-Y524 WeakPolarHBondContact O-CB 3.35Å; S520-Y524 PolarHBondContact O-N 2.78Å; V521-Y524 PolarHBondContact O-N 2.98Å; F522-Y524 VanDerWaalsContact C-N 3.27Å; F522-Y524 PolarHBondContact O-N 3.37Å; Y524-A527 PolarHBondContact O-N 3Å; Y524-Y531 HydrophobicContact CD2-CD1 4.43Å; Y524-Y531 HydrophobicContact CD2-CD2 4.19Å; Y524-Y531 HydrophobicContact CD2-CE1 4.35Å; Y524-Y531 HydrophobicContact CD2-CE2 4.11Å; Y524-Y531 HydrophobicContact CD2-CG 4.41Å
525	L	83.5	Confident	88.8	Confident	97 Å²	97	64.3 Å²	64.3	51%	0.508	33%	0.325	S	S	.	.	H	α-helix	trans	-66.3	-35.7	174.4	-70	173.6	0	0	0	112.7	P456 V521 F522 A527	P456-L525 HydrophobicContact CB-CD2 4.45Å; P456-L525 HydrophobicContact CG-CD2 4.33Å; V521-L525 WeakPolarHBondContact O-CG 3.34Å; V521-L525 PolarHBondContact O-N 3.35Å; F522-L525 WeakPolarHBondContact O-CB 3.29Å; F522-L525 PolarHBondContact O-N 3.32Å; F522-L525 VanDerWaalsContact O-N 3.12Å; L525-A527 VanDerWaalsContact C-N 3.25Å; L525-A527 PolarHBondContact O-N 3.3Å
526	F	84.9	Confident	88.6	Confident	145 Å²	145	65 Å²	65	64%	0.636	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	3.4	176	-69.4	-60.6	0	0	0	114.3	F522 L523 Y528	F522-F526 HydrophobicContact CB-CE2 4.49Å; F522-F526 WeakPolarHBondContact O-CD2 3.21Å; F522-F526 PolarHBondContact O-N 3.26Å; L523-F526 PolarHBondContact O-N 3.32Å; F526-Y528 HydrophobicContact CB-CD2 3.47Å; F526-Y528 VanDerWaalsContact CB-CD2 3.47Å; F526-Y528 HydrophobicContact CB-CE2 3.5Å; F526-Y528 HydrophobicContact CG-CD2 4.46Å; F526-Y528 HydrophobicContact CG-CE2 4.17Å; F526-Y528 PolarHBondContact O-N 2.84Å
527	A	79.9	Confident	88.6	Confident	51 Å²	51	68.5 Å²	68.5	42%	0.421	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	25.7	179.9	0	0	0	0	0	115.2	I453 L523 Y524 L525	I453-A527 HydrophobicContact CD1-CB 4.02Å; I453-A527 VanDerWaalsContact CD1-O 3.31Å; I453-A527 WeakPolarHBondContact CD1-O 3.29Å; I453-A527 HydrophobicContact CG2-CB 4.15Å; L523-A527 PolarHBondContact O-N 3.49Å; Y524-A527 PolarHBondContact O-N 3Å; L525-A527 VanDerWaalsContact C-N 3.25Å; L525-A527 PolarHBondContact O-N 3.3Å
528	Y	84.9	Confident	88.5	Confident	127 Å²	127	68.4 Å²	68.4	50%	0.498	35%	0.347	S	S	.	.			trans	-66.3	162.2	166.9	-72.9	-62.5	0	0	0	110.4	L523 F526 E530 Y531	L523-Y528 HydrophobicContact CD2-CD2 3.64Å; L523-Y528 HydrophobicContact CD2-CE2 4.45Å; L523-Y528 HydrophobicContact CD2-CG 4.14Å; L523-Y528 PolarHBondContact O-N 2.87Å; L523-Y528 VanDerWaalsContact O-N 3.15Å; F526-Y528 HydrophobicContact CB-CD2 3.47Å; F526-Y528 VanDerWaalsContact CB-CD2 3.47Å; F526-Y528 HydrophobicContact CB-CE2 3.5Å; F526-Y528 HydrophobicContact CG-CD2 4.46Å; F526-Y528 HydrophobicContact CG-CE2 4.17Å; F526-Y528 PolarHBondContact O-N 2.84Å; Y528-E530 WeakPolarHBondContact CB-OE2 3.29Å; Y528-Y531 WeakPolarHBondContact O-CD1 3.39Å; Y528-Y531 WeakPolarHBondContact O-CE1 3.15Å
529	K	80.6	Confident	88.6	Confident	169 Å²	169	69.2 Å²	69.2	74%	0.735	35%	0.351	S	S	*	.	S	Bend	trans	-92.8	-17.4	178.5	-68.1	-173.1	177.9	-175.7	0	112.5	Y531	K529-Y531 PolarHBondContact O-N 3.27Å
530	E	86.3	Confident	88.6	Confident	113 Å²	113	68.5 Å²	68.5	53%	0.528	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-13.6	-168.1	-65.4	72.7	-164.1	0	0	113.9	Y528 L532 A533 C534	Y528-E530 WeakPolarHBondContact CB-OE2 3.29Å; E530-L532 PolarHBondContact O-N 2.96Å; E530-A533 WeakPolarHBondContact O-CB 3.49Å; E530-A533 PolarHBondContact O-N 3.45Å; E530-C534 PolarHBondContact O-N 2.94Å
531	Y	87.3	Confident	88.7	Confident	29 Å²	29	70.5 Å²	70.5	11%	0.114	37%	0.366	C	S	.	.	H	α-helix	trans	-55.4	-29.9	178.4	63	-89	0	0	0	112.7	R446 S520 Y524 Y528 K529 A533 C534 L535	R446-Y531 VanDerWaalsContact NH1-CE2 3.32Å; R446-Y531 PolarHBondContact NH1-OH 2.78Å; R446-Y531 PolarHBondContact NH2-OH 3.24Å; S520-Y531 VanDerWaalsContact O-CB 3.27Å; S520-Y531 WeakPolarHBondContact O-CB 3.28Å; Y524-Y531 HydrophobicContact CD2-CD1 4.43Å; Y524-Y531 HydrophobicContact CD2-CD2 4.19Å; Y524-Y531 HydrophobicContact CD2-CE1 4.35Å; Y524-Y531 HydrophobicContact CD2-CE2 4.11Å; Y524-Y531 HydrophobicContact CD2-CG 4.41Å; Y528-Y531 WeakPolarHBondContact O-CD1 3.39Å; Y528-Y531 WeakPolarHBondContact O-CE1 3.15Å; K529-Y531 PolarHBondContact O-N 3.27Å; Y531-A533 VanDerWaalsContact C-N 3.33Å; Y531-A533 PolarHBondContact O-N 2.92Å; Y531-C534 PolarHBondContact O-N 3.23Å; Y531-L535 VanDerWaalsContact O-CB 3.29Å; Y531-L535 WeakPolarHBondContact O-CB 3.11Å; Y531-L535 PolarHBondContact O-N 3.45Å
532	L	87.3	Confident	89	Confident	74 Å²	74	68.3 Å²	68.3	39%	0.387	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-36.7	179	-176.8	61.2	0	0	0	111.7	E530 L535 V536	E530-L532 PolarHBondContact O-N 2.96Å; L532-L535 PolarHBondContact O-N 3.39Å; L532-V536 HydrophobicContact CD1-CG2 4.21Å; L532-V536 WeakPolarHBondContact O-CG2 3.44Å; L532-V536 PolarHBondContact O-N 3.32Å
533	A	90.5	Very high	89.2	Confident	58 Å²	58	67.8 Å²	67.8	48%	0.479	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-47.2	176.4	0	0	0	0	0	110.8	E530 Y531 L535 V536 L537	E530-A533 WeakPolarHBondContact O-CB 3.49Å; E530-A533 PolarHBondContact O-N 3.45Å; Y531-A533 VanDerWaalsContact C-N 3.33Å; Y531-A533 PolarHBondContact O-N 2.92Å; A533-L535 VanDerWaalsContact C-N 3.32Å; A533-L535 PolarHBondContact O-N 3.4Å; A533-V536 PolarHBondContact O-N 2.64Å; A533-L537 WeakPolarHBondContact O-CB 3.14Å; A533-L537 WeakPolarHBondContact O-CG 3.49Å; A533-L537 PolarHBondContact O-N 3.1Å
534	C	92.1	Very high	89.3	Confident	21 Å²	21	69.1 Å²	69.1	14%	0.142	36%	0.363	C	S	.	.	H	α-helix	trans	-59.1	-41.6	174.6	-61.8	0	0	0	0	112.2	E530 Y531 A538	E530-C534 PolarHBondContact O-N 2.94Å; Y531-C534 PolarHBondContact O-N 3.23Å; C534-A538 VanDerWaalsContact O-CB 3.31Å; C534-A538 WeakPolarHBondContact O-CB 3.11Å; C534-A538 PolarHBondContact O-N 3.04Å
535	L	90.8	Very high	89.8	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-66.3	-43.5	-179.7	-174	67.1	0	0	0	112.5	L439 Y531 L532 A533 A538 M539	L439-L535 HydrophobicContact CD1-CD1 3.68Å; Y531-L535 VanDerWaalsContact O-CB 3.29Å; Y531-L535 WeakPolarHBondContact O-CB 3.11Å; Y531-L535 PolarHBondContact O-N 3.45Å; L532-L535 PolarHBondContact O-N 3.39Å; A533-L535 VanDerWaalsContact C-N 3.32Å; A533-L535 PolarHBondContact O-N 3.4Å; L535-A538 PolarHBondContact O-N 2.72Å; L535-M539 WeakPolarHBondContact O-CB 3.44Å; L535-M539 PolarHBondContact O-N 3.09Å
536	V	92.5	Very high	90.1	Very high	74 Å²	74	63.5 Å²	63.5	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-41.9	177.8	171.9	0	0	0	0	111	L532 A533 M539 A540	L532-V536 HydrophobicContact CD1-CG2 4.21Å; L532-V536 WeakPolarHBondContact O-CG2 3.44Å; L532-V536 PolarHBondContact O-N 3.32Å; A533-V536 PolarHBondContact O-N 2.64Å; V536-M539 PolarHBondContact O-N 2.84Å; V536-A540 PolarHBondContact O-N 2.95Å
537	L	93.6	Very high	90.4	Very high	109 Å²	109	59.7 Å²	59.7	57%	0.571	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-44.9	173.8	-72.2	170.9	0	0	0	111.6	L516 A533 M539 A540 L541	L516-L537 HydrophobicContact CD1-CB 4.35Å; A533-L537 WeakPolarHBondContact O-CB 3.14Å; A533-L537 WeakPolarHBondContact O-CG 3.49Å; A533-L537 PolarHBondContact O-N 3.1Å; L537-M539 VanDerWaalsContact C-N 3.31Å; L537-M539 PolarHBondContact O-N 3.3Å; L537-A540 PolarHBondContact O-N 3.05Å; L537-L541 VanDerWaalsContact O-CB 3.27Å; L537-L541 WeakPolarHBondContact O-CB 3.33Å; L537-L541 PolarHBondContact O-N 3.38Å
538	A	94.2	Very high	90.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-36	176.3	0	0	0	0	0	113.2	Q513 L516 V517 C534 L535 G542	Q513-A538 WeakPolarHBondContact CG-O 3.29Å; L516-A538 HydrophobicContact CB-CB 3.79Å; V517-A538 HydrophobicContact CG2-CB 3.63Å; C534-A538 VanDerWaalsContact O-CB 3.31Å; C534-A538 WeakPolarHBondContact O-CB 3.11Å; C534-A538 PolarHBondContact O-N 3.04Å; L535-A538 PolarHBondContact O-N 2.72Å; A538-G542 PolarHBondContact O-N 2.91Å
539	M	94	Very high	91.1	Very high	37 Å²	37	53.4 Å²	53.4	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-69	-48.2	176.4	-173.8	-156.4	-51.7	0	0	111.8	L439 T440 S443 L535 V536 L537 L541 G542 W543	L439-M539 HydrophobicContact CD2-CB 4.37Å; T440-M539 HydrophobicContact CG2-CG 3.8Å; T440-M539 HydrophobicContact CG2-SD 3.77Å; S443-M539 WeakPolarHBondContact OG-CE 3.37Å; L535-M539 WeakPolarHBondContact O-CB 3.44Å; L535-M539 PolarHBondContact O-N 3.09Å; V536-M539 PolarHBondContact O-N 2.84Å; L537-M539 VanDerWaalsContact C-N 3.31Å; L537-M539 PolarHBondContact O-N 3.3Å; M539-L541 VanDerWaalsContact C-N 3.33Å; M539-L541 PolarHBondContact O-N 3.04Å; M539-G542 PolarHBondContact O-N 3.2Å; M539-G542 VanDerWaalsContact O-N 3.15Å; M539-W543 VanDerWaalsContact O-CD1 3.27Å; M539-W543 PolarHBondContact O-N 2.94Å; M539-W543 VanDerWaalsContact O-N 3.09Å
540	A	94.4	Very high	91.5	Very high	63 Å²	63	46.9 Å²	46.9	52%	0.521	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-44.5	178.1	0	0	0	0	0	111.2	V536 L537 G542 W543 A544	V536-A540 PolarHBondContact O-N 2.95Å; L537-A540 PolarHBondContact O-N 3.05Å; A540-G542 VanDerWaalsContact C-N 3.31Å; A540-G542 PolarHBondContact O-N 2.71Å; A540-W543 PolarHBondContact O-N 3.07Å; A540-A544 PolarHBondContact O-N 3.41Å; A540-A544 VanDerWaalsContact O-N 3.11Å
541	L	93.9	Very high	91.5	Very high	48 Å²	48	42.3 Å²	42.3	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-34.7	175.3	-161.7	65	0	0	0	112.2	V509 I512 Q513 L516 L537 M539 A544 N545	V509-L541 HydrophobicContact CG1-CD1 3.5Å; V509-L541 HydrophobicContact CG1-CD2 3.86Å; V509-L541 HydrophobicContact CG1-CG 3.62Å; I512-L541 HydrophobicContact CB-CD2 4.32Å; I512-L541 HydrophobicContact CG2-CD2 3.82Å; Q513-L541 HydrophobicContact CB-CD2 4.14Å; L516-L541 HydrophobicContact CD1-CD2 4.47Å; L537-L541 VanDerWaalsContact O-CB 3.27Å; L537-L541 WeakPolarHBondContact O-CB 3.33Å; L537-L541 PolarHBondContact O-N 3.38Å; M539-L541 VanDerWaalsContact C-N 3.33Å; M539-L541 PolarHBondContact O-N 3.04Å; L541-A544 WeakPolarHBondContact O-CB 3.46Å; L541-A544 PolarHBondContact O-N 2.95Å; L541-N545 WeakPolarHBondContact O-CB 3.35Å; L541-N545 PolarHBondContact O-N 2.98Å
542	G	94.2	Very high	91.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-41.4	175	0	0	0	0	0	114	Y432 N436 Q513 A538 M539 A540 N545 M546	Y432-G542 WeakPolarHBondContact OH-CA 3.44Å; Y432-G542 PolarHBondContact OH-O 3.44Å; N436-G542 PolarHBondContact ND2-O 3.3Å; Q513-G542 VanDerWaalsContact CD-CA 3.45Å; A538-G542 PolarHBondContact O-N 2.91Å; M539-G542 PolarHBondContact O-N 3.2Å; M539-G542 VanDerWaalsContact O-N 3.15Å; A540-G542 VanDerWaalsContact C-N 3.31Å; A540-G542 PolarHBondContact O-N 2.71Å; G542-N545 WeakPolarHBondContact O-CB 3.34Å; G542-N545 PolarHBondContact O-N 3.08Å; G542-M546 PolarHBondContact O-N 3.19Å
543	W	95.3	Very high	91.2	Very high	100 Å²	100	44.8 Å²	44.8	38%	0.379	25%	0.253	S	S	.	.	H	α-helix	trans	-69.5	-36.6	173.3	-73.3	107.8	0	0	0	112.5	F433 N436 I437 T440 M539 A540 N545 M546	F433-W543 HydrophobicContact CD2-CH2 4.47Å; F433-W543 HydrophobicContact CD2-CZ3 4.42Å; F433-W543 HydrophobicContact CE2-CH2 4.08Å; F433-W543 HydrophobicContact CE2-CZ3 4.16Å; N436-W543 HydrophobicContact CB-CH2 4.4Å; N436-W543 HydrophobicContact CB-CZ2 4.14Å; I437-W543 HydrophobicContact CD1-CH2 3.79Å; I437-W543 HydrophobicContact CD1-CZ2 4.06Å; I437-W543 HydrophobicContact CG1-CH2 4.31Å; T440-W543 HydrophobicContact CG2-CZ2 3.86Å; M539-W543 VanDerWaalsContact O-CD1 3.27Å; M539-W543 PolarHBondContact O-N 2.94Å; M539-W543 VanDerWaalsContact O-N 3.09Å; A540-W543 PolarHBondContact O-N 3.07Å; W543-N545 VanDerWaalsContact C-N 3.32Å; W543-N545 PolarHBondContact O-N 3.2Å; W543-M546 HydrophobicContact CE3-CG 3.83Å; W543-M546 HydrophobicContact CZ3-CG 4.22Å; W543-M546 VanDerWaalsContact O-CB 3.29Å; W543-M546 WeakPolarHBondContact O-CB 3.44Å; W543-M546 PolarHBondContact O-N 3.19Å
544	A	92.1	Very high	90.9	Very high	60 Å²	60	46.6 Å²	46.6	50%	0.496	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-41.6	171.9	0	0	0	0	0	111.8	A540 L541 M546 L547	A540-A544 PolarHBondContact O-N 3.41Å; A540-A544 VanDerWaalsContact O-N 3.11Å; L541-A544 WeakPolarHBondContact O-CB 3.46Å; L541-A544 PolarHBondContact O-N 2.95Å; A544-M546 PolarHBondContact O-N 2.85Å; A544-L547 WeakPolarHBondContact O-CB 3.34Å; A544-L547 PolarHBondContact O-N 3.45Å
545	N	92.4	Very high	90.6	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-19.2	176.1	-81.6	-17.4	0	0	0	114.1	Y432 V509 F510 Q513 L541 G542 W543 L547 Y548	Y432-N545 HydrophobicContact CE1-CB 4.25Å; Y432-N545 WeakPolarHBondContact OH-CB 3.39Å; V509-N545 WeakPolarHBondContact CB-OD1 3.47Å; V509-N545 WeakPolarHBondContact CG1-OD1 3.44Å; V509-N545 PolarHBondContact O-ND2 3.11Å; F510-N545 HydrophobicContact CD1-CB 4.18Å; F510-N545 HydrophobicContact CE1-CB 3.71Å; F510-N545 HydrophobicContact CZ-CB 4.16Å; Q513-N545 PolarHBondContact OE1-ND2 3.22Å; Q513-N545 VanDerWaalsContact OE1-ND2 3.13Å; L541-N545 WeakPolarHBondContact O-CB 3.35Å; L541-N545 PolarHBondContact O-N 2.98Å; G542-N545 WeakPolarHBondContact O-CB 3.34Å; G542-N545 PolarHBondContact O-N 3.08Å; W543-N545 VanDerWaalsContact C-N 3.32Å; W543-N545 PolarHBondContact O-N 3.2Å; N545-L547 PolarHBondContact O-N 3.21Å; N545-Y548 VanDerWaalsContact O-CB 3.27Å; N545-Y548 WeakPolarHBondContact O-CB 3.28Å; N545-Y548 PolarHBondContact O-N 3.1Å; N545-Y548 VanDerWaalsContact O-N 3.14Å
546	M	91.5	Very high	90.5	Very high	30 Å²	30	52.3 Å²	52.3	15%	0.148	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.3	-25.9	171.2	-66.3	-65.2	-56	0	0	112.3	F429 Y432 F433 N436 G542 W543 A544 Y548 Y549	F429-M546 HydrophobicContact CD2-CE 4.06Å; F429-M546 HydrophobicContact CE2-CE 3.49Å; F429-M546 VanDerWaalsContact CE2-CE 3.49Å; F429-M546 HydrophobicContact CZ-CE 4.32Å; Y432-M546 HydrophobicContact CD1-SD 3.49Å; Y432-M546 WeakPolarHBondContact CD1-SD 3.3Å; Y432-M546 HydrophobicContact CE1-CG 4.33Å; Y432-M546 HydrophobicContact CE1-SD 3.58Å; Y432-M546 VanDerWaalsContact CE1-SD 3.58Å; F433-M546 HydrophobicContact CB-CE 4.17Å; F433-M546 HydrophobicContact CD2-CE 3.79Å; F433-M546 HydrophobicContact CG-CE 4.46Å; N436-M546 PolarHBondContact ND2-SD 2.89Å; N436-M546 VanDerWaalsContact ND2-SD 3.38Å; G542-M546 PolarHBondContact O-N 3.19Å; W543-M546 HydrophobicContact CE3-CG 3.83Å; W543-M546 HydrophobicContact CZ3-CG 4.22Å; W543-M546 VanDerWaalsContact O-CB 3.29Å; W543-M546 WeakPolarHBondContact O-CB 3.44Å; W543-M546 PolarHBondContact O-N 3.19Å; A544-M546 PolarHBondContact O-N 2.85Å; M546-Y548 PolarHBondContact O-N 3.32Å; M546-Y549 PolarHBondContact O-N 3.47Å; M546-Y549 VanDerWaalsContact O-N 3.09Å
547	L	90.1	Very high	90.2	Very high	64 Å²	64	48.8 Å²	48.8	34%	0.335	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-57	-30.7	176.5	-174.2	62.8	0	0	0	112.3	A544 N545 Y549 T550	A544-L547 WeakPolarHBondContact O-CB 3.34Å; A544-L547 PolarHBondContact O-N 3.45Å; N545-L547 PolarHBondContact O-N 3.21Å; L547-Y549 PolarHBondContact O-N 3.4Å; L547-T550 HydrophobicContact CD1-CG2 3.95Å; L547-T550 WeakPolarHBondContact O-CB 3.37Å; L547-T550 WeakPolarHBondContact O-CG2 3.23Å; L547-T550 PolarHBondContact O-N 2.9Å; L547-T550 VanDerWaalsContact O-N 3.08Å; L547-T550 PolarHBondContact O-OG1 3.38Å
548	Y	89.1	Confident	89.9	Confident	28 Å²	28	45.9 Å²	45.9	11%	0.11	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-52.1	-40.3	175.1	176.4	-99.2	0	0	0	112.9	F506 F510 N545 M546 T550 R551	F506-Y548 HydrophobicContact CB-CD2 3.87Å; F506-Y548 HydrophobicContact CB-CE2 4.27Å; F506-Y548 AromaticContact CD1-CD2 3.8Å; F506-Y548 HydrophobicContact CD1-CD2 3.8Å; F506-Y548 HydrophobicContact CD1-CG 4.24Å; F506-Y548 HydrophobicContact CD2-CD2 4.08Å; F506-Y548 HydrophobicContact CE1-CD2 4.35Å; F506-Y548 AromaticContact CG-CD2 3.64Å; F506-Y548 HydrophobicContact CG-CD2 3.64Å; F506-Y548 HydrophobicContact CG-CE2 4.41Å; F510-Y548 HydrophobicContact CE2-CD1 4.09Å; F510-Y548 HydrophobicContact CE2-CD2 4.06Å; F510-Y548 AromaticContact CE2-CG 3.8Å; F510-Y548 HydrophobicContact CE2-CG 3.8Å; F510-Y548 HydrophobicContact CZ-CD1 4.06Å; F510-Y548 AromaticContact CZ-CG 3.97Å; F510-Y548 HydrophobicContact CZ-CG 3.97Å; N545-Y548 VanDerWaalsContact O-CB 3.27Å; N545-Y548 WeakPolarHBondContact O-CB 3.28Å; N545-Y548 PolarHBondContact O-N 3.1Å; N545-Y548 VanDerWaalsContact O-N 3.14Å; M546-Y548 PolarHBondContact O-N 3.32Å; Y548-T550 PolarHBondContact O-N 3.25Å; Y548-R551 WeakPolarHBondContact O-CB 3.34Å; Y548-R551 WeakPolarHBondContact O-CD 3.42Å; Y548-R551 VanDerWaalsContact O-CG 3.28Å; Y548-R551 WeakPolarHBondContact O-CG 3.47Å; Y548-R551 PolarHBondContact O-N 3.36Å
549	Y	90.3	Very high	89.5	Confident	18 Å²	18	52.9 Å²	52.9	7%	0.071	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-76.1	-7.5	-175.3	-69.1	-81.1	0	0	0	113.8	F425 S428 F429 Y432 F510 M546 L547 R551 G552	F425-Y549 HydrophobicContact CE1-CD1 4.36Å; F425-Y549 HydrophobicContact CE2-CD1 4.06Å; F425-Y549 AromaticContact CZ-CD1 3.91Å; F425-Y549 HydrophobicContact CZ-CD1 3.91Å; F425-Y549 VanDerWaalsContact CZ-O 3.31Å; F425-Y549 WeakPolarHBondContact CZ-O 3.47Å; S428-Y549 PolarHBondContact O-OH 2.98Å; S428-Y549 PolarHBondContact OG-OH 3.27Å; S428-Y549 VanDerWaalsContact OG-OH 3.05Å; F429-Y549 HydrophobicContact CB-CD1 3.64Å; F429-Y549 HydrophobicContact CB-CE1 3.91Å; F429-Y549 HydrophobicContact CB-CG 4.18Å; F429-Y549 HydrophobicContact CD2-CD1 4.08Å; F429-Y549 HydrophobicContact CD2-CD2 4.23Å; F429-Y549 AromaticContact CD2-CG 3.72Å; F429-Y549 HydrophobicContact CD2-CG 3.72Å; F429-Y549 HydrophobicContact CG-CD1 4.36Å; F429-Y549 HydrophobicContact CG-CG 4.45Å; Y432-Y549 WeakPolarHBondContact CB-OH 3.28Å; Y432-Y549 HydrophobicContact CD1-CD2 4.17Å; Y432-Y549 AromaticContact CD1-CE2 3.45Å; Y432-Y549 HydrophobicContact CD1-CE2 3.45Å; Y432-Y549 VanDerWaalsContact CD1-CE2 3.45Å; Y432-Y549 HydrophobicContact CE1-CE2 4.22Å; Y432-Y549 AromaticContact CG-CE2 3.81Å; Y432-Y549 HydrophobicContact CG-CE2 3.81Å; F510-Y549 HydrophobicContact CZ-CE2 4.4Å; M546-Y549 PolarHBondContact O-N 3.47Å; M546-Y549 VanDerWaalsContact O-N 3.09Å; L547-Y549 PolarHBondContact O-N 3.4Å; Y549-R551 PolarHBondContact O-N 2.97Å; Y549-G552 PolarHBondContact O-N 3.35Å
550	T	89.4	Confident	89.2	Confident	33 Å²	33	51.2 Å²	51.2	20%	0.202	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-64.7	-25	171.1	63.1	0	0	0	0	112.8	L547 Y548 G552 F553 M556 G557 S560	L547-T550 HydrophobicContact CD1-CG2 3.95Å; L547-T550 WeakPolarHBondContact O-CB 3.37Å; L547-T550 WeakPolarHBondContact O-CG2 3.23Å; L547-T550 PolarHBondContact O-N 2.9Å; L547-T550 VanDerWaalsContact O-N 3.08Å; L547-T550 PolarHBondContact O-OG1 3.38Å; Y548-T550 PolarHBondContact O-N 3.25Å; T550-G552 PolarHBondContact O-N 3.4Å; T550-F553 PolarHBondContact O-N 2.6Å; T550-M556 HydrophobicContact CG2-CB 4.29Å; T550-G557 PolarHBondContact O-N 3.43Å; T550-S560 WeakPolarHBondContact OG1-CB 3.44Å
551	R	85.8	Confident	88.8	Confident	16 Å²	16	48.3 Å²	48.3	6%	0.06	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-54.5	-22.3	177.2	-68.7	173.9	167.3	-166.6	-7.8	114.2	F506 Y548 Y549 F553 W676	F506-R551 VanDerWaalsContact CE2-NH2 3.34Å; Y548-R551 WeakPolarHBondContact O-CB 3.34Å; Y548-R551 WeakPolarHBondContact O-CD 3.42Å; Y548-R551 VanDerWaalsContact O-CG 3.28Å; Y548-R551 WeakPolarHBondContact O-CG 3.47Å; Y548-R551 PolarHBondContact O-N 3.36Å; Y549-R551 PolarHBondContact O-N 2.97Å; R551-F553 VanDerWaalsContact C-N 3.31Å; R551-F553 PolarHBondContact O-N 3.38Å; R551-W676 PolarHBondContact O-NE1 2.81Å
552	G	82.8	Confident	88.5	Confident	16 Å²	16	47.4 Å²	47.4	17%	0.165	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-69.7	-23.9	177.6	0	0	0	0	0	114.5	Y549 T550	Y549-G552 PolarHBondContact O-N 3.35Å; T550-G552 PolarHBondContact O-N 3.4Å
553	F	85.3	Confident	88.2	Confident	139 Å²	139	51.3 Å²	51.3	61%	0.61	26%	0.256	S	S	*	.	S	Bend	trans	-105.7	141.4	179.9	-59.5	-81.1	0	0	0	110.4	T550 R551 M556 G557	T550-F553 PolarHBondContact O-N 2.6Å; R551-F553 VanDerWaalsContact C-N 3.31Å; R551-F553 PolarHBondContact O-N 3.38Å; F553-M556 HydrophobicContact CB-CB 4.37Å; F553-G557 WeakPolarHBondContact O-CA 3.48Å; F553-G557 PolarHBondContact O-N 3.09Å
554	Q	84.8	Confident	87.7	Confident	97 Å²	97	47.7 Å²	47.7	45%	0.453	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-51.8	-178.1	-176.3	166.5	-8	0	0	112.2	M558 W676	Q554-M558 HydrophobicContact CG-CE 4.28Å; Q554-M558 WeakPolarHBondContact O-CE 3.1Å; Q554-M558 WeakPolarHBondContact O-CG 3.46Å; Q554-M558 PolarHBondContact O-N 2.78Å; Q554-W676 VanDerWaalsContact CA-CZ2 3.47Å; Q554-W676 HydrophobicContact CB-CH2 3.51Å; Q554-W676 HydrophobicContact CB-CZ2 3.74Å; Q554-W676 HydrophobicContact CB-CZ3 3.95Å; Q554-W676 HydrophobicContact CG-CE3 4.02Å; Q554-W676 HydrophobicContact CG-CH2 3.72Å; Q554-W676 HydrophobicContact CG-CZ2 4.28Å; Q554-W676 HydrophobicContact CG-CZ3 3.58Å
555	S	85.8	Confident	87.4	Confident	62 Å²	62	48.6 Å²	48.6	43%	0.434	24%	0.237	S	C	.	.	H	α-helix	trans	-57.8	-54.5	179.8	49.4	0	0	0	0	112.2	Y559	S555-Y559 WeakPolarHBondContact O-CD2 3.5Å
556	M	88.1	Confident	87.2	Confident	100 Å²	100	49 Å²	49	49%	0.493	24%	0.239	S	C	.	.	H	α-helix	trans	-74	-31.2	-175.7	-57.9	-62.5	164.3	0	0	113.1	T550 F553 Y559 S560	T550-M556 HydrophobicContact CG2-CB 4.29Å; F553-M556 HydrophobicContact CB-CB 4.37Å; M556-Y559 PolarHBondContact O-N 2.85Å; M556-S560 PolarHBondContact O-N 2.86Å
557	G	86.4	Confident	87.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-39.5	175.9	0	0	0	0	0	112.9	T550 F553 S560 V561	T550-G557 PolarHBondContact O-N 3.43Å; F553-G557 WeakPolarHBondContact O-CA 3.48Å; F553-G557 PolarHBondContact O-N 3.09Å; G557-S560 PolarHBondContact O-N 3.31Å; G557-V561 WeakPolarHBondContact O-CG2 3.06Å; G557-V561 PolarHBondContact O-N 3.45Å; G557-V561 VanDerWaalsContact O-N 3.16Å
558	M	87.1	Confident	86.8	Confident	49 Å²	49	50.9 Å²	50.9	24%	0.241	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-46.3	174.7	-67.9	-177.3	-61.4	0	0	111.6	Q554 S560 V561 M562 E673	Q554-M558 HydrophobicContact CG-CE 4.28Å; Q554-M558 WeakPolarHBondContact O-CE 3.1Å; Q554-M558 WeakPolarHBondContact O-CG 3.46Å; Q554-M558 PolarHBondContact O-N 2.78Å; M558-S560 VanDerWaalsContact C-N 3.34Å; M558-S560 PolarHBondContact O-N 3.01Å; M558-V561 PolarHBondContact O-N 2.74Å; M558-V561 VanDerWaalsContact O-N 3.17Å; M558-M562 WeakPolarHBondContact O-CG 3.5Å; M558-M562 PolarHBondContact O-N 3.44Å; M558-E673 HydrophobicContact SD-CB 4.42Å
559	Y	86.7	Confident	86.6	Confident	146 Å²	146	54.3 Å²	54.3	57%	0.573	27%	0.265	S	S	*	.	H	α-helix	trans	-60.8	-39.3	175.7	-70.9	-66.2	0	0	0	113	S555 M556 V561 M562 I563	S555-Y559 WeakPolarHBondContact O-CD2 3.5Å; M556-Y559 PolarHBondContact O-N 2.85Å; Y559-V561 VanDerWaalsContact C-N 3.31Å; Y559-V561 PolarHBondContact O-N 2.88Å; Y559-M562 HydrophobicContact CD1-SD 4.18Å; Y559-M562 PolarHBondContact O-N 2.97Å; Y559-I563 WeakPolarHBondContact O-CG1 3.31Å; Y559-I563 PolarHBondContact O-N 3.4Å
560	S	87.5	Confident	86.6	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-35.2	176.2	-178.1	0	0	0	0	112.8	T550 M556 G557 M558 Q564	T550-S560 WeakPolarHBondContact OG1-CB 3.44Å; M556-S560 PolarHBondContact O-N 2.86Å; G557-S560 PolarHBondContact O-N 3.31Å; M558-S560 VanDerWaalsContact C-N 3.34Å; M558-S560 PolarHBondContact O-N 3.01Å; S560-Q564 WeakPolarHBondContact O-CB 3.04Å; S560-Q564 PolarHBondContact O-N 3.43Å
561	V	86.6	Confident	86.7	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-68	-42.6	174.5	171.9	0	0	0	0	110.7	G557 M558 Y559 Q564 K565 V668 I675	G557-V561 WeakPolarHBondContact O-CG2 3.06Å; G557-V561 PolarHBondContact O-N 3.45Å; G557-V561 VanDerWaalsContact O-N 3.16Å; M558-V561 PolarHBondContact O-N 2.74Å; M558-V561 VanDerWaalsContact O-N 3.17Å; Y559-V561 VanDerWaalsContact C-N 3.31Å; Y559-V561 PolarHBondContact O-N 2.88Å; V561-Q564 PolarHBondContact O-N 3.43Å; V561-K565 PolarHBondContact O-N 2.92Å; V561-V668 HydrophobicContact CG1-CG1 4.4Å; V561-I675 HydrophobicContact CG1-CB 4.03Å; V561-I675 HydrophobicContact CG1-CD1 3.83Å; V561-I675 HydrophobicContact CG1-CG2 3.71Å; V561-I675 HydrophobicContact CG2-CB 4.49Å; V561-I675 HydrophobicContact CG2-CG2 3.9Å
562	M	86.8	Confident	86.8	Confident	29 Å²	29	58 Å²	58	14%	0.143	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-51	177.7	-66.5	166.2	70.6	0	0	111.5	M558 Y559 Q564 K565 V566 V665 V668	M558-M562 WeakPolarHBondContact O-CG 3.5Å; M558-M562 PolarHBondContact O-N 3.44Å; Y559-M562 HydrophobicContact CD1-SD 4.18Å; Y559-M562 PolarHBondContact O-N 2.97Å; M562-Q564 PolarHBondContact O-N 2.86Å; M562-K565 PolarHBondContact O-N 3.13Å; M562-V566 WeakPolarHBondContact O-CB 3.42Å; M562-V566 VanDerWaalsContact O-CG2 3.24Å; M562-V566 WeakPolarHBondContact O-CG2 3.45Å; M562-V566 PolarHBondContact O-N 3.16Å; M562-V665 HydrophobicContact CE-CB 4.21Å; M562-V665 HydrophobicContact CE-CG1 3.63Å; M562-V665 HydrophobicContact CE-CG2 4.01Å; M562-V668 HydrophobicContact CB-CG1 4.47Å; M562-V668 HydrophobicContact CG-CB 4.5Å; M562-V668 HydrophobicContact CG-CG1 3.75Å
563	I	87.9	Confident	87.1	Confident	82 Å²	82	62.6 Å²	62.6	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-54.3	-44.3	176.6	-69.1	166.5	0	0	0	110.6	Y559 I567	Y559-I563 WeakPolarHBondContact O-CG1 3.31Å; Y559-I563 PolarHBondContact O-N 3.4Å; I563-I567 HydrophobicContact CG2-CD1 3.66Å; I563-I567 HydrophobicContact CG2-CG1 4.5Å; I563-I567 WeakPolarHBondContact O-CB 3.39Å; I563-I567 VanDerWaalsContact O-CG1 3.24Å; I563-I567 WeakPolarHBondContact O-CG1 3.48Å; I563-I567 PolarHBondContact O-N 2.98Å
564	Q	84.8	Confident	87.5	Confident	24 Å²	24	57.7 Å²	57.7	11%	0.112	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-47.5	-179.2	-168.7	178.7	2.2	0	0	112.8	S502 S560 V561 M562 L568	S502-Q564 PolarHBondContact O-NE2 2.96Å; S560-Q564 WeakPolarHBondContact O-CB 3.04Å; S560-Q564 PolarHBondContact O-N 3.43Å; V561-Q564 PolarHBondContact O-N 3.43Å; M562-Q564 PolarHBondContact O-N 2.86Å; Q564-L568 HydrophobicContact CG-CD1 4.23Å; Q564-L568 WeakPolarHBondContact O-CG 3.23Å; Q564-L568 PolarHBondContact O-N 3.47Å
565	K	85.9	Confident	87.8	Confident	79 Å²	79	56.5 Å²	56.5	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-45.4	178.2	-84	-165.8	169.1	-165.8	0	111.7	V561 M562 L568 H569 V668 E671 I675	V561-K565 PolarHBondContact O-N 2.92Å; M562-K565 PolarHBondContact O-N 3.13Å; K565-L568 PolarHBondContact O-N 3.49Å; K565-H569 VanDerWaalsContact O-CB 3.29Å; K565-H569 WeakPolarHBondContact O-CB 3.45Å; K565-H569 PolarHBondContact O-N 3.38Å; K565-V668 HydrophobicContact CB-CG2 4.16Å; K565-V668 HydrophobicContact CD-CG1 4.09Å; K565-V668 HydrophobicContact CD-CG2 3.52Å; K565-V668 HydrophobicContact CG-CG2 4.46Å; K565-E671 IonicContact NZ-OE1 3.3Å; K565-E671 IonicContact NZ-OE2 3.49Å; K565-E671 PolarHBondContact NZ-OE2 2.92Å; K565-I675 HydrophobicContact CD-CD1 4.35Å
566	V	89.4	Confident	88.2	Confident	11 Å²	11	60.7 Å²	60.7	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-43.1	-178.8	172.6	0	0	0	0	112	M562 D570 V571 M661 V665	M562-V566 WeakPolarHBondContact O-CB 3.42Å; M562-V566 VanDerWaalsContact O-CG2 3.24Å; M562-V566 WeakPolarHBondContact O-CG2 3.45Å; M562-V566 PolarHBondContact O-N 3.16Å; V566-D570 WeakPolarHBondContact O-CB 3.39Å; V566-D570 PolarHBondContact O-N 2.94Å; V566-V571 HydrophobicContact CG1-CG2 4.49Å; V566-V571 PolarHBondContact O-N 3.42Å; V566-M661 HydrophobicContact CG1-CE 3.91Å; V566-M661 HydrophobicContact CG1-CG 3.76Å; V566-M661 HydrophobicContact CG1-SD 4.25Å; V566-V665 HydrophobicContact CG2-CG2 4.16Å
567	I	87.6	Confident	88.4	Confident	84 Å²	84	58.8 Å²	58.8	43%	0.431	28%	0.282	S	S	.	.	I	π-helix	trans	-62	-47.4	177	-71.7	171.1	0	0	0	110.9	I563 V571 L572	I563-I567 HydrophobicContact CG2-CD1 3.66Å; I563-I567 HydrophobicContact CG2-CG1 4.5Å; I563-I567 WeakPolarHBondContact O-CB 3.39Å; I563-I567 VanDerWaalsContact O-CG1 3.24Å; I563-I567 WeakPolarHBondContact O-CG1 3.48Å; I563-I567 PolarHBondContact O-N 2.98Å; I567-V571 HydrophobicContact CG1-CG2 4.48Å; I567-L572 PolarHBondContact O-N 3.27Å
568	L	84	Confident	88.7	Confident	51 Å²	51	59.3 Å²	59.3	27%	0.267	29%	0.285	S	S	.	.	I	π-helix	trans	-69.7	-38.9	-177.1	-71.2	175.4	0	0	0	113.1	L501 Q564 K565 L572	L501-L568 HydrophobicContact CD2-CD2 3.91Å; L501-L568 HydrophobicContact CG-CD2 4.2Å; Q564-L568 HydrophobicContact CG-CD1 4.23Å; Q564-L568 WeakPolarHBondContact O-CG 3.23Å; Q564-L568 PolarHBondContact O-N 3.47Å; K565-L568 PolarHBondContact O-N 3.49Å; L568-L572 HydrophobicContact CD2-CD1 4.09Å
569	H	84.9	Confident	89	Confident	99 Å²	99	60.4 Å²	60.4	46%	0.458	29%	0.291	S	S	.	.	I	π-helix	trans	-89.4	-41.9	-172.9	-172.2	-96.3	0	0	0	113.9	K565 K573	K565-H569 VanDerWaalsContact O-CB 3.29Å; K565-H569 WeakPolarHBondContact O-CB 3.45Å; K565-H569 PolarHBondContact O-N 3.38Å; H569-K573 PolarHBondContact CD2-NZ 3.02Å; H569-K573 VanDerWaalsContact CD2-NZ 3.3Å; H569-K573 PolarHBondContact CE1-NZ 3.03Å; H569-K573 PolarHBondContact NE2-NZ 3.29Å; H569-K573 WeakPolarHBondContact O-CD 3.24Å; H569-K573 WeakPolarHBondContact O-CE 3.28Å; H569-K573 VanDerWaalsContact O-CG 3.31Å; H569-K573 WeakPolarHBondContact O-CG 3.48Å; H569-K573 PolarHBondContact O-NZ 3.25Å
570	D	91.3	Very high	89.4	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.043	29%	0.286	C	S	.	.	I	π-helix	trans	-105.4	-52.1	-169	-52.7	-38.1	0	0	0	111.1	V566 L572 K573 F574 L657 M661 T664	V566-D570 WeakPolarHBondContact O-CB 3.39Å; V566-D570 PolarHBondContact O-N 2.94Å; D570-L572 PolarHBondContact O-N 3.42Å; D570-K573 PolarHBondContact O-N 3.22Å; D570-F574 WeakPolarHBondContact O-CB 3.41Å; D570-F574 PolarHBondContact O-N 2.97Å; D570-L657 HydrophobicContact CB-CD1 4.21Å; D570-M661 HydrophobicContact CB-CG 4.38Å; D570-T664 WeakPolarHBondContact OD1-CG2 3.27Å; D570-T664 WeakPolarHBondContact OD2-CB 3.42Å; D570-T664 VanDerWaalsContact OD2-CG2 3.28Å; D570-T664 WeakPolarHBondContact OD2-CG2 3.29Å; D570-T664 PolarHBondContact OD2-OG1 2.93Å
571	V	91	Very high	89.7	Confident	48 Å²	48	60.4 Å²	60.4	29%	0.291	30%	0.3	S	S	.	.	I	π-helix	trans	-64.8	-40.5	-174.6	-177.3	0	0	0	0	111.6	V566 I567 L575	V566-V571 HydrophobicContact CG1-CG2 4.49Å; V566-V571 PolarHBondContact O-N 3.42Å; I567-V571 HydrophobicContact CG1-CG2 4.48Å; V571-L575 WeakPolarHBondContact O-CB 3.2Å; V571-L575 PolarHBondContact O-N 3.27Å
572	L	88.5	Confident	90	Very high	89 Å²	89	61 Å²	61	47%	0.466	30%	0.303	S	S	.	.	H	α-helix	trans	-65.2	-39.5	177.2	-71.5	-179.7	0	0	0	113.1	I567 L568 D570 L575 F576	I567-L572 PolarHBondContact O-N 3.27Å; L568-L572 HydrophobicContact CD2-CD1 4.09Å; D570-L572 PolarHBondContact O-N 3.42Å; L572-L575 PolarHBondContact O-N 3.11Å; L572-F576 PolarHBondContact O-N 2.97Å
573	K	89.2	Confident	90.4	Very high	112 Å²	112	63.4 Å²	63.4	49%	0.487	32%	0.316	S	S	.	.	H	α-helix	trans	-67.7	-44.9	177	-66	179.2	-165.1	157.1	0	111.3	H569 D570 F576 V577	H569-K573 PolarHBondContact CD2-NZ 3.02Å; H569-K573 VanDerWaalsContact CD2-NZ 3.3Å; H569-K573 PolarHBondContact CE1-NZ 3.03Å; H569-K573 PolarHBondContact NE2-NZ 3.29Å; H569-K573 WeakPolarHBondContact O-CD 3.24Å; H569-K573 WeakPolarHBondContact O-CE 3.28Å; H569-K573 VanDerWaalsContact O-CG 3.31Å; H569-K573 WeakPolarHBondContact O-CG 3.48Å; H569-K573 PolarHBondContact O-NZ 3.25Å; D570-K573 PolarHBondContact O-N 3.22Å; K573-F576 PolarHBondContact O-N 3.3Å; K573-V577 PolarHBondContact O-N 3.23Å
574	F	92.5	Very high	90.7	Very high	37 Å²	37	61.7 Å²	61.7	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-47.5	172.7	164.5	-88.1	0	0	0	111.4	D570 F576 V577 Y578 L653 L654 L657	D570-F574 WeakPolarHBondContact O-CB 3.41Å; D570-F574 PolarHBondContact O-N 2.97Å; F574-F576 VanDerWaalsContact C-N 3.28Å; F574-F576 PolarHBondContact O-N 2.9Å; F574-V577 PolarHBondContact O-N 3.25Å; F574-Y578 HydrophobicContact CE1-CG 4.37Å; F574-Y578 HydrophobicContact CZ-CG 4.42Å; F574-Y578 VanDerWaalsContact O-CB 3.3Å; F574-Y578 WeakPolarHBondContact O-CB 3.47Å; F574-Y578 PolarHBondContact O-N 3.14Å; F574-L653 HydrophobicContact CD2-CB 4.42Å; F574-L653 HydrophobicContact CE2-CB 3.83Å; F574-L654 HydrophobicContact CE2-CD2 4.21Å; F574-L654 HydrophobicContact CZ-CD2 3.8Å; F574-L657 HydrophobicContact CB-CD1 3.93Å; F574-L657 HydrophobicContact CB-CD2 4.42Å; F574-L657 HydrophobicContact CD1-CD2 3.89Å; F574-L657 HydrophobicContact CD2-CB 3.79Å; F574-L657 HydrophobicContact CD2-CD1 4.46Å; F574-L657 HydrophobicContact CD2-CD2 3.91Å; F574-L657 HydrophobicContact CD2-CG 4.26Å; F574-L657 HydrophobicContact CE1-CD2 4.11Å; F574-L657 HydrophobicContact CE2-CB 4.14Å; F574-L657 HydrophobicContact CE2-CD2 4.07Å; F574-L657 HydrophobicContact CG-CB 4.35Å; F574-L657 HydrophobicContact CG-CD1 4.19Å; F574-L657 HydrophobicContact CG-CD2 3.81Å; F574-L657 HydrophobicContact CG-CG 4.33Å; F574-L657 HydrophobicContact CZ-CD2 4.19Å
575	L	91.8	Very high	91	Very high	72 Å²	72	62.1 Å²	62.1	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-36.8	-177.4	-176	66	0	0	0	111.5	V571 L572 Y578 I579	V571-L575 WeakPolarHBondContact O-CB 3.2Å; V571-L575 PolarHBondContact O-N 3.27Å; L572-L575 PolarHBondContact O-N 3.11Å; L575-Y578 HydrophobicContact CD1-CD1 4.36Å; L575-I579 HydrophobicContact CD1-CD1 3.98Å; L575-I579 HydrophobicContact CD1-CG1 4.14Å; L575-I579 HydrophobicContact CD2-CD1 4.4Å; L575-I579 HydrophobicContact CG-CD1 3.78Å; L575-I579 HydrophobicContact CG-CG1 4.32Å; L575-I579 VanDerWaalsContact O-CB 3.31Å; L575-I579 WeakPolarHBondContact O-CB 3.43Å; L575-I579 WeakPolarHBondContact O-CG1 3.23Å; L575-I579 PolarHBondContact O-N 3.44Å
576	F	93.5	Very high	91.3	Very high	150 Å²	150	58.4 Å²	58.4	66%	0.658	30%	0.303	S	S	*	.	H	α-helix	trans	-60.1	-52.3	173.8	179.7	-100	0	0	0	112	L572 K573 F574 Y578 I579 V580	L572-F576 PolarHBondContact O-N 2.97Å; K573-F576 PolarHBondContact O-N 3.3Å; F574-F576 VanDerWaalsContact C-N 3.28Å; F574-F576 PolarHBondContact O-N 2.9Å; F576-Y578 PolarHBondContact O-N 3.38Å; F576-I579 PolarHBondContact O-N 3.15Å; F576-V580 WeakPolarHBondContact O-CG2 3.45Å; F576-V580 PolarHBondContact O-N 3.29Å; F576-V580 VanDerWaalsContact O-N 3.14Å
577	V	93.2	Very high	91.4	Very high	59 Å²	59	62 Å²	62	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-43.8	178	178.5	0	0	0	0	111.2	K573 F574 I579 V580 F581 L653	K573-V577 PolarHBondContact O-N 3.23Å; F574-V577 PolarHBondContact O-N 3.25Å; V577-I579 PolarHBondContact O-N 3.35Å; V577-V580 PolarHBondContact O-N 3.09Å; V577-F581 HydrophobicContact CG1-CE2 4.14Å; V577-F581 HydrophobicContact CG1-CZ 4.24Å; V577-F581 PolarHBondContact O-N 2.88Å; V577-F581 VanDerWaalsContact O-N 3.13Å; V577-L653 HydrophobicContact CG1-CD1 4.39Å; V577-L653 HydrophobicContact CG1-CD2 4.17Å
578	Y	93.6	Very high	91.6	Very high	12 Å²	12	59.3 Å²	59.3	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-43.1	178.3	175.1	-105.3	0	0	0	112.4	F574 L575 F576 F581 L582 F617 T620 Y645 T649	F574-Y578 HydrophobicContact CE1-CG 4.37Å; F574-Y578 HydrophobicContact CZ-CG 4.42Å; F574-Y578 VanDerWaalsContact O-CB 3.3Å; F574-Y578 WeakPolarHBondContact O-CB 3.47Å; F574-Y578 PolarHBondContact O-N 3.14Å; L575-Y578 HydrophobicContact CD1-CD1 4.36Å; F576-Y578 PolarHBondContact O-N 3.38Å; Y578-F581 PolarHBondContact O-N 3.47Å; Y578-L582 HydrophobicContact CE1-CB 4.49Å; Y578-L582 HydrophobicContact CE1-CD2 3.91Å; Y578-L582 VanDerWaalsContact O-CB 3.25Å; Y578-L582 WeakPolarHBondContact O-CB 3.21Å; Y578-L582 PolarHBondContact O-N 3.14Å; Y578-F617 HydrophobicContact CE1-CD2 4.41Å; Y578-T620 HydrophobicContact CE2-CG2 3.81Å; Y578-T620 PolarHBondContact OH-OG1 3.3Å; Y578-Y645 PolarHBondContact OH-OH 2.92Å; Y578-T649 HydrophobicContact CD2-CG2 4.13Å; Y578-T649 HydrophobicContact CE2-CG2 3.99Å
579	I	93.4	Very high	91.8	Very high	72 Å²	72	56.9 Å²	56.9	37%	0.369	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-42.9	176.5	-74.9	171.5	0	0	0	110.7	L575 F576 V577 F581 L582 L583	L575-I579 HydrophobicContact CD1-CD1 3.98Å; L575-I579 HydrophobicContact CD1-CG1 4.14Å; L575-I579 HydrophobicContact CD2-CD1 4.4Å; L575-I579 HydrophobicContact CG-CD1 3.78Å; L575-I579 HydrophobicContact CG-CG1 4.32Å; L575-I579 VanDerWaalsContact O-CB 3.31Å; L575-I579 WeakPolarHBondContact O-CB 3.43Å; L575-I579 WeakPolarHBondContact O-CG1 3.23Å; L575-I579 PolarHBondContact O-N 3.44Å; F576-I579 PolarHBondContact O-N 3.15Å; V577-I579 PolarHBondContact O-N 3.35Å; I579-F581 VanDerWaalsContact C-N 3.32Å; I579-F581 PolarHBondContact O-N 3.13Å; I579-L582 PolarHBondContact O-N 2.85Å; I579-L583 HydrophobicContact CG2-CD1 3.63Å; I579-L583 HydrophobicContact CG2-CG 4.03Å; I579-L583 WeakPolarHBondContact O-CB 3.35Å; I579-L583 WeakPolarHBondContact O-CG 3.35Å; I579-L583 PolarHBondContact O-N 3.33Å
580	V	94.8	Very high	91.8	Very high	78 Å²	78	53.4 Å²	53.4	47%	0.473	29%	0.291	S	S	.	.	H	α-helix	trans	-58.2	-44.6	177	171.7	0	0	0	0	111.2	F576 V577 G584	F576-V580 WeakPolarHBondContact O-CG2 3.45Å; F576-V580 PolarHBondContact O-N 3.29Å; F576-V580 VanDerWaalsContact O-N 3.14Å; V577-V580 PolarHBondContact O-N 3.09Å; V580-G584 PolarHBondContact O-N 2.92Å
581	F	93.5	Very high	91.6	Very high	69 Å²	69	57.2 Å²	57.2	30%	0.303	32%	0.319	S	S	.	.	H	α-helix	trans	-68.8	-42.7	175.4	-68.3	-8.9	0	0	0	112.7	V577 Y578 I579 L583 G584 F585 L653	V577-F581 HydrophobicContact CG1-CE2 4.14Å; V577-F581 HydrophobicContact CG1-CZ 4.24Å; V577-F581 PolarHBondContact O-N 2.88Å; V577-F581 VanDerWaalsContact O-N 3.13Å; Y578-F581 PolarHBondContact O-N 3.47Å; I579-F581 VanDerWaalsContact C-N 3.32Å; I579-F581 PolarHBondContact O-N 3.13Å; F581-L583 VanDerWaalsContact C-N 3.35Å; F581-L583 PolarHBondContact O-N 3.35Å; F581-G584 PolarHBondContact O-N 2.88Å; F581-F585 HydrophobicContact CB-CD2 4.35Å; F581-F585 WeakPolarHBondContact O-CB 3.26Å; F581-F585 WeakPolarHBondContact O-CD2 3.47Å; F581-F585 PolarHBondContact O-N 3.01Å; F581-L653 HydrophobicContact CD2-CD1 3.66Å; F581-L653 HydrophobicContact CE2-CD1 3.84Å
582	L	93.6	Very high	91.4	Very high	16 Å²	16	56.2 Å²	56.2	8%	0.084	31%	0.312	C	S	.	.	H	α-helix	trans	-59.6	-43.5	178.7	-178.4	66.5	0	0	0	112	Y578 I579 G586 V613 L616 Y645	Y578-L582 HydrophobicContact CE1-CB 4.49Å; Y578-L582 HydrophobicContact CE1-CD2 3.91Å; Y578-L582 VanDerWaalsContact O-CB 3.25Å; Y578-L582 WeakPolarHBondContact O-CB 3.21Å; Y578-L582 PolarHBondContact O-N 3.14Å; I579-L582 PolarHBondContact O-N 2.85Å; L582-G586 WeakPolarHBondContact O-CA 3.35Å; L582-G586 PolarHBondContact O-N 2.89Å; L582-V613 HydrophobicContact CD1-CG1 4.32Å; L582-V613 HydrophobicContact CD2-CG1 3.93Å; L582-V613 HydrophobicContact CG-CG1 4Å; L582-L616 HydrophobicContact CD1-CB 3.59Å; L582-L616 HydrophobicContact CD1-CD1 4.34Å; L582-Y645 WeakPolarHBondContact CD1-OH 3.2Å
583	L	93.3	Very high	91.1	Very high	80 Å²	80	52.9 Å²	52.9	42%	0.419	29%	0.294	S	S	.	.	H	α-helix	trans	-68.4	-46.4	175.9	-62.1	172.3	0	0	0	111	I579 F581 G586 V587 F609	I579-L583 HydrophobicContact CG2-CD1 3.63Å; I579-L583 HydrophobicContact CG2-CG 4.03Å; I579-L583 WeakPolarHBondContact O-CB 3.35Å; I579-L583 WeakPolarHBondContact O-CG 3.35Å; I579-L583 PolarHBondContact O-N 3.33Å; F581-L583 VanDerWaalsContact C-N 3.35Å; F581-L583 PolarHBondContact O-N 3.35Å; L583-G586 PolarHBondContact O-N 3.38Å; L583-V587 WeakPolarHBondContact O-CG2 3.5Å; L583-V587 PolarHBondContact O-N 3.31Å; L583-F609 HydrophobicContact CD2-CE1 4.36Å; L583-F609 HydrophobicContact CD2-CZ 3.66Å
584	G	94.3	Very high	90.3	Very high	45 Å²	45	52 Å²	52	46%	0.464	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-52.2	-178.9	0	0	0	0	0	113.4	V580 F581 G586 A588	V580-G584 PolarHBondContact O-N 2.92Å; F581-G584 PolarHBondContact O-N 2.88Å; G584-G586 VanDerWaalsContact C-N 3.34Å; G584-A588 WeakPolarHBondContact O-CB 3.43Å; G584-A588 PolarHBondContact O-N 3.08Å; G584-A588 VanDerWaalsContact O-N 3.11Å
585	F	92.9	Very high	89.2	Confident	34 Å²	34	60.2 Å²	60.2	15%	0.149	33%	0.327	C	S	.	.	H	α-helix	trans	-69.1	-31.7	175.3	-77.4	-88.6	0	0	0	112.1	F581 A588 L589 L616 L641 T644 Y645 L648	F581-F585 HydrophobicContact CB-CD2 4.35Å; F581-F585 WeakPolarHBondContact O-CB 3.26Å; F581-F585 WeakPolarHBondContact O-CD2 3.47Å; F581-F585 PolarHBondContact O-N 3.01Å; F585-A588 PolarHBondContact O-N 3.4Å; F585-L589 WeakPolarHBondContact O-CB 3.32Å; F585-L589 WeakPolarHBondContact O-CG 3.31Å; F585-L589 PolarHBondContact O-N 2.87Å; F585-L616 HydrophobicContact CB-CD1 4Å; F585-L641 HydrophobicContact CE1-CD2 4.25Å; F585-T644 HydrophobicContact CE1-CG2 4.44Å; F585-T644 HydrophobicContact CZ-CG2 4.26Å; F585-Y645 HydrophobicContact CB-CD2 3.77Å; F585-Y645 HydrophobicContact CB-CE2 4.36Å; F585-Y645 HydrophobicContact CD1-CD2 4.36Å; F585-Y645 AromaticContact CD2-CD2 3.83Å; F585-Y645 HydrophobicContact CD2-CD2 3.83Å; F585-Y645 AromaticContact CG-CD2 3.74Å; F585-Y645 HydrophobicContact CG-CD2 3.74Å; F585-Y645 HydrophobicContact CG-CG 4.4Å; F585-L648 HydrophobicContact CE2-CD1 4.14Å; F585-L648 HydrophobicContact CZ-CD1 3.96Å
586	G	91.6	Very high	88	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-47.2	175.2	0	0	0	0	0	113	L582 L583 G584 A590	L582-G586 WeakPolarHBondContact O-CA 3.35Å; L582-G586 PolarHBondContact O-N 2.89Å; L583-G586 PolarHBondContact O-N 3.38Å; G584-G586 VanDerWaalsContact C-N 3.34Å; G586-A590 VanDerWaalsContact O-CB 3.25Å; G586-A590 WeakPolarHBondContact O-CB 3.3Å; G586-A590 PolarHBondContact O-N 3.37Å; G586-A590 VanDerWaalsContact O-N 3.1Å
587	V	91.9	Very high	86.5	Confident	86 Å²	86	55.8 Å²	55.8	52%	0.521	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-43.3	174	176.7	0	0	0	0	110.8	L583 A590 S591 F609	L583-V587 WeakPolarHBondContact O-CG2 3.5Å; L583-V587 PolarHBondContact O-N 3.31Å; V587-A590 PolarHBondContact O-N 3.43Å; V587-S591 WeakPolarHBondContact O-CB 3.41Å; V587-S591 PolarHBondContact O-N 2.98Å; V587-F609 HydrophobicContact CB-CE2 4.44Å; V587-F609 HydrophobicContact CG2-CD2 3.7Å; V587-F609 HydrophobicContact CG2-CE2 3.43Å; V587-F609 VanDerWaalsContact CG2-CE2 3.43Å; V587-F609 HydrophobicContact CG2-CZ 4.21Å
588	A	91.3	Very high	84.7	Confident	29 Å²	29	62.7 Å²	62.7	24%	0.24	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-54.2	179.5	0	0	0	0	0	111.8	G584 F585 A590 S591 L592 L641	G584-A588 WeakPolarHBondContact O-CB 3.43Å; G584-A588 PolarHBondContact O-N 3.08Å; G584-A588 VanDerWaalsContact O-N 3.11Å; F585-A588 PolarHBondContact O-N 3.4Å; A588-A590 PolarHBondContact O-N 2.98Å; A588-S591 PolarHBondContact O-N 3.02Å; A588-S591 VanDerWaalsContact O-N 3.15Å; A588-S591 PolarHBondContact O-OG 3.45Å; A588-L592 WeakPolarHBondContact O-CD1 3.4Å; A588-L592 PolarHBondContact O-N 3.23Å; A588-L641 HydrophobicContact CB-CD1 4.48Å
589	L	87.4	Confident	83	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-38.9	-178.9	-66.8	176.9	0	0	0	112.8	F585 S591 L592 Y606 L616 F638 L641 L642	F585-L589 WeakPolarHBondContact O-CB 3.32Å; F585-L589 WeakPolarHBondContact O-CG 3.31Å; F585-L589 PolarHBondContact O-N 2.87Å; L589-S591 PolarHBondContact O-N 3.49Å; L589-L592 PolarHBondContact O-N 3Å; L589-Y606 HydrophobicContact CD1-CE1 4.41Å; L589-L616 HydrophobicContact CD1-CD1 4.15Å; L589-L616 HydrophobicContact CD1-CD2 3.65Å; L589-L616 HydrophobicContact CD1-CG 4.17Å; L589-F638 HydrophobicContact CB-CE2 4Å; L589-F638 HydrophobicContact CD2-CD2 3.67Å; L589-F638 HydrophobicContact CD2-CE2 3.7Å; L589-F638 HydrophobicContact CD2-CG 4.28Å; L589-F638 HydrophobicContact CD2-CZ 4.32Å; L589-F638 HydrophobicContact CG-CE2 4.32Å; L589-L641 HydrophobicContact CD2-CB 3.82Å; L589-L641 HydrophobicContact CD2-CD1 4.42Å; L589-L642 HydrophobicContact CD1-CD1 3.87Å
590	A	86.5	Confident	81.5	Confident	25 Å²	25	71.6 Å²	71.6	21%	0.207	39%	0.392	C	S	.	.	H	α-helix	trans	-63.2	-29.8	174.6	0	0	0	0	0	112.6	G586 V587 A588 A612	G586-A590 VanDerWaalsContact O-CB 3.25Å; G586-A590 WeakPolarHBondContact O-CB 3.3Å; G586-A590 PolarHBondContact O-N 3.37Å; G586-A590 VanDerWaalsContact O-N 3.1Å; V587-A590 PolarHBondContact O-N 3.43Å; A588-A590 PolarHBondContact O-N 2.98Å; A590-A612 HydrophobicContact CB-CB 4.05Å
591	S	87	Confident	79.8	Confident	88 Å²	88	77.3 Å²	77.3	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-76.9	-21	177.5	76.6	0	0	0	0	114.4	V587 A588 L589 I593	V587-S591 WeakPolarHBondContact O-CB 3.41Å; V587-S591 PolarHBondContact O-N 2.98Å; A588-S591 PolarHBondContact O-N 3.02Å; A588-S591 VanDerWaalsContact O-N 3.15Å; A588-S591 PolarHBondContact O-OG 3.45Å; L589-S591 PolarHBondContact O-N 3.49Å; S591-I593 VanDerWaalsContact C-N 3.28Å; S591-I593 PolarHBondContact O-N 3.41Å
592	L	85.5	Confident	78.2	Confident	28 Å²	28	81.9 Å²	81.9	15%	0.147	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.7	-179.6	-96.5	79.4	0	0	0	113.8	A588 L589 S632 L637 F638 L641	A588-L592 WeakPolarHBondContact O-CD1 3.4Å; A588-L592 PolarHBondContact O-N 3.23Å; L589-L592 PolarHBondContact O-N 3Å; L592-S632 PolarHBondContact O-OG 2.98Å; L592-L637 HydrophobicContact CD2-CB 4.12Å; L592-L637 HydrophobicContact CD2-CD2 4.07Å; L592-L637 HydrophobicContact CD2-CG 3.92Å; L592-F638 HydrophobicContact CB-CD2 4.28Å; L592-F638 HydrophobicContact CD2-CB 3.99Å; L592-L641 HydrophobicContact CD1-CD1 4.24Å; L592-L641 HydrophobicContact CD2-CD1 4.17Å
593	I	82.1	Confident	76.8	Confident	19 Å²	19	82.9 Å²	82.9	10%	0.097	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-111.7	128.6	-173.3	-71.8	172.2	0	0	0	109.6	S591 Y606 Q629 F638	S591-I593 VanDerWaalsContact C-N 3.28Å; S591-I593 PolarHBondContact O-N 3.41Å; I593-Y606 VanDerWaalsContact CD1-CB 3.42Å; I593-Y606 HydrophobicContact CD1-CD2 4.32Å; I593-Y606 HydrophobicContact CD1-CG 4.1Å; I593-Q629 HydrophobicContact CD1-CG 4.46Å; I593-F638 HydrophobicContact CD1-CD2 4.37Å; I593-F638 HydrophobicContact CD1-CE2 3.67Å; I593-F638 HydrophobicContact CD1-CZ 4.3Å; I593-F638 HydrophobicContact CG1-CD2 4.46Å; I593-F638 HydrophobicContact CG1-CE2 4.24Å
594	E	72.8	Confident	75.5	Confident	92 Å²	92	80.2 Å²	80.2	43%	0.43	43%	0.434	S	S	.	.			trans	-77.2	140.8	-178.5	-60.2	-161.7	161.8	0	0	110.5	C596 N631 K633	E594-C596 PolarHBondContact O-N 2.91Å; E594-C596 VanDerWaalsContact O-N 3.08Å; E594-N631 PolarHBondContact N-O 3.41Å; E594-N631 PolarHBondContact O-ND2 2.97Å; E594-K633 HydrophobicContact CG-CB 4.35Å; E594-K633 WeakPolarHBondContact OE1-CD 3.28Å; E594-K633 WeakPolarHBondContact OE1-CG 3.29Å; E594-K633 IonicContact OE1-NZ 2.67Å; E594-K633 PolarHBondContact OE1-NZ 3.01Å
595	K	69.6	Low	74.3	Confident	210 Å²	210	81 Å²	81	91%	0.913	43%	0.433	S	S	*	.			trans	-69.5	109.8	-172.4	-166.1	167.6	-168.9	165.2	0	110.3
596	C	65.8	Low	73.5	Confident	29 Å²	29	80.1 Å²	80.1	20%	0.196	43%	0.429	C	S	.	.			trans	-52.8	143.2	-177.3	-72	0	0	0	0	113.5	E594 C603 S604 N631	E594-C596 PolarHBondContact O-N 2.91Å; E594-C596 VanDerWaalsContact O-N 3.08Å; C596-C603 HydrophobicContact CB-CB 3.71Å; C596-C603 WeakPolarHBondContact CB-SG 3.23Å; C596-C603 VanDerWaalsContact SG-C 3.53Å; C596-C603 WeakPolarHBondContact SG-CB 3.45Å; C596-C603 CovalentContact SG-SG 2.04Å; C596-C603 PolarHBondContact SG-SG 3.37Å; C596-S604 PolarHBondContact SG-OG 3.48Å; C596-N631 PolarHBondContact SG-ND2 3.41Å
597	P	61.6	Low	72.7	Confident	100 Å²	100	82.4 Å²	82.4	65%	0.649	45%	0.453	S	S	*	.			trans	-61.7	146.1	168.4	27.9	-33.6	0	0	0	110.2	D599	P597-D599 PolarHBondContact O-N 2.91Å
598	K	57.3	Low	72.3	Confident	205 Å²	205	80.3 Å²	80.3	89%	0.891	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-9.4	-153.1	-70.9	-176.3	175.9	178.8	0	117.7
599	D	56.6	Low	72.1	Confident	152 Å²	152	83.2 Å²	83.2	81%	0.813	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-14.8	-168.4	-61	-43	0	0	0	115.2	P597	P597-D599 PolarHBondContact O-N 2.91Å
600	N	61.5	Low	72	Confident	118 Å²	118	87 Å²	87	63%	0.631	48%	0.475	S	S	*	.			trans	-102.1	100.3	177.7	-78.4	-5.8	0	0	0	111.6	D602 C603	N600-D602 VanDerWaalsContact C-N 3.27Å; N600-D602 PolarHBondContact O-N 3.41Å; N600-C603 HydrophobicContact CB-CB 3.95Å; N600-C603 WeakPolarHBondContact O-CB 3.44Å; N600-C603 PolarHBondContact O-N 3.49Å
601	K	58.8	Low	72	Confident	198 Å²	198	89.1 Å²	89.1	86%	0.861	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-66.8	-26.3	177.2	-68.9	-175.7	179.2	178.8	0	113.7	C603	K601-C603 VanDerWaalsContact C-N 3.26Å; K601-C603 PolarHBondContact O-N 2.87Å
602	D	61.1	Low	72	Confident	165 Å²	165	84.9 Å²	84.9	88%	0.882	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-86.7	5.8	-177	-48	-39.2	0	0	0	113.1	N600 S604	N600-D602 VanDerWaalsContact C-N 3.27Å; N600-D602 PolarHBondContact O-N 3.41Å; D602-S604 PolarHBondContact O-N 3.21Å
603	C	63.8	Low	72.3	Confident	37 Å²	37	85 Å²	85	25%	0.25	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-74.1	-22.2	-170.4	168.4	0	0	0	0	114.9	C596 N600 K601	C596-C603 HydrophobicContact CB-CB 3.71Å; C596-C603 WeakPolarHBondContact CB-SG 3.23Å; C596-C603 VanDerWaalsContact SG-C 3.53Å; C596-C603 WeakPolarHBondContact SG-CB 3.45Å; C596-C603 CovalentContact SG-SG 2.04Å; C596-C603 PolarHBondContact SG-SG 3.37Å; N600-C603 HydrophobicContact CB-CB 3.95Å; N600-C603 WeakPolarHBondContact O-CB 3.44Å; N600-C603 PolarHBondContact O-N 3.49Å; K601-C603 VanDerWaalsContact C-N 3.26Å; K601-C603 PolarHBondContact O-N 2.87Å
604	S	66.1	Low	72.6	Confident	24 Å²	24	88.3 Å²	88.3	17%	0.168	47%	0.473	C	S	.	.			trans	-159.4	116.7	177.3	59.4	0	0	0	0	113.2	C596 D602 Y606 G607	C596-S604 PolarHBondContact SG-OG 3.48Å; D602-S604 PolarHBondContact O-N 3.21Å; S604-Y606 PolarHBondContact O-N 3Å; S604-G607 PolarHBondContact O-N 3.27Å; S604-G607 VanDerWaalsContact OG-CA 3.26Å; S604-G607 WeakPolarHBondContact OG-CA 3.43Å
605	S	69.7	Low	73.3	Confident	63 Å²	63	85.8 Å²	85.8	44%	0.441	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.8	176.7	-37.8	0	0	0	0	114	Q629	S605-Q629 PolarHBondContact OG-NE2 3.06Å
606	Y	76.3	Confident	74.3	Confident	14 Å²	14	75.8 Å²	75.8	6%	0.055	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	26	-177.8	-62.7	-104	0	0	0	111.1	L589 I593 S604 S608 A612 E615 Q629 F638	L589-Y606 HydrophobicContact CD1-CE1 4.41Å; I593-Y606 VanDerWaalsContact CD1-CB 3.42Å; I593-Y606 HydrophobicContact CD1-CD2 4.32Å; I593-Y606 HydrophobicContact CD1-CG 4.1Å; S604-Y606 PolarHBondContact O-N 3Å; Y606-S608 PolarHBondContact O-N 3Å; Y606-S608 VanDerWaalsContact O-N 3.16Å; Y606-A612 HydrophobicContact CD1-CB 3.76Å; Y606-A612 HydrophobicContact CG-CB 4.44Å; Y606-E615 HydrophobicContact CD1-CB 4.28Å; Y606-E615 HydrophobicContact CE1-CB 3.69Å; Y606-E615 HydrophobicContact CE2-CB 4.42Å; Y606-Q629 HydrophobicContact CD2-CG 4.1Å; Y606-Q629 HydrophobicContact CE2-CG 4.24Å; Y606-F638 HydrophobicContact CD2-CZ 4.13Å; Y606-F638 AromaticContact CE2-CZ 4Å; Y606-F638 HydrophobicContact CE2-CZ 4Å; Y606-F638 HydrophobicContact CG-CZ 4.46Å
607	G	74.7	Confident	75.5	Confident	49 Å²	49	79.1 Å²	79.1	51%	0.505	43%	0.429	S	S	.	.	S	Bend	trans	-66.8	-13.1	-171.4	0	0	0	0	0	115.6	S604	S604-G607 PolarHBondContact O-N 3.27Å; S604-G607 VanDerWaalsContact OG-CA 3.26Å; S604-G607 WeakPolarHBondContact OG-CA 3.43Å
608	S	82.1	Confident	76.8	Confident	42 Å²	42	77.6 Å²	77.6	29%	0.294	41%	0.412	S	S	.	.	S	Bend	trans	-134.7	163.2	169.2	81.6	0	0	0	0	111.1	Y606 S610 D611 A612	Y606-S608 PolarHBondContact O-N 3Å; Y606-S608 VanDerWaalsContact O-N 3.16Å; S608-S610 VanDerWaalsContact C-N 3.31Å; S608-S610 PolarHBondContact O-N 2.95Å; S608-S610 PolarHBondContact OG-OG 3.45Å; S608-D611 VanDerWaalsContact CB-OD2 3.31Å; S608-D611 WeakPolarHBondContact CB-OD2 3.35Å; S608-D611 PolarHBondContact N-OD2 2.93Å; S608-D611 PolarHBondContact O-N 3.45Å; S608-D611 PolarHBondContact OG-N 3.5Å; S608-D611 PolarHBondContact OG-OD2 3.41Å; S608-A612 WeakPolarHBondContact O-CB 3.47Å; S608-A612 PolarHBondContact O-N 2.9Å
609	F	86.9	Confident	78.3	Confident	90 Å²	90	68.8 Å²	68.8	40%	0.395	38%	0.375	S	S	.	.	H	α-helix	trans	-59	-39.4	176.6	172.9	-112.9	0	0	0	113	L583 V587 A612 V613	L583-F609 HydrophobicContact CD2-CE1 4.36Å; L583-F609 HydrophobicContact CD2-CZ 3.66Å; V587-F609 HydrophobicContact CB-CE2 4.44Å; V587-F609 HydrophobicContact CG2-CD2 3.7Å; V587-F609 HydrophobicContact CG2-CE2 3.43Å; V587-F609 VanDerWaalsContact CG2-CE2 3.43Å; V587-F609 HydrophobicContact CG2-CZ 4.21Å; F609-A612 PolarHBondContact O-N 3.44Å; F609-V613 HydrophobicContact CD2-CG2 4.04Å; F609-V613 HydrophobicContact CE1-CG2 4.25Å; F609-V613 HydrophobicContact CE2-CG2 3.53Å; F609-V613 HydrophobicContact CZ-CG2 3.67Å; F609-V613 WeakPolarHBondContact O-CB 3.14Å; F609-V613 WeakPolarHBondContact O-CG2 3.3Å; F609-V613 PolarHBondContact O-N 3.02Å
610	S	87	Confident	79.8	Confident	78 Å²	78	62.1 Å²	62.1	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-66.8	-38.6	177.5	43	0	0	0	0	112.3	S608 L614	S608-S610 VanDerWaalsContact C-N 3.31Å; S608-S610 PolarHBondContact O-N 2.95Å; S608-S610 PolarHBondContact OG-OG 3.45Å; S610-L614 WeakPolarHBondContact O-CB 3.27Å; S610-L614 PolarHBondContact O-N 2.96Å
611	D	85.3	Confident	81.1	Confident	70 Å²	70	60.8 Å²	60.8	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-69.9	-42.1	178.3	-50.3	-39.1	0	0	0	110	S608 V613 L614 E615	S608-D611 VanDerWaalsContact CB-OD2 3.31Å; S608-D611 WeakPolarHBondContact CB-OD2 3.35Å; S608-D611 PolarHBondContact N-OD2 2.93Å; S608-D611 PolarHBondContact O-N 3.45Å; S608-D611 PolarHBondContact OG-N 3.5Å; S608-D611 PolarHBondContact OG-OD2 3.41Å; D611-V613 PolarHBondContact O-N 3.49Å; D611-L614 PolarHBondContact O-N 3.39Å; D611-L614 VanDerWaalsContact O-N 3.16Å; D611-E615 WeakPolarHBondContact O-CG 3.22Å; D611-E615 PolarHBondContact O-N 2.99Å
612	A	87.7	Confident	82.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-43.7	175.3	0	0	0	0	0	112.8	A590 Y606 S608 F609 L614 L616	A590-A612 HydrophobicContact CB-CB 4.05Å; Y606-A612 HydrophobicContact CD1-CB 3.76Å; Y606-A612 HydrophobicContact CG-CB 4.44Å; S608-A612 WeakPolarHBondContact O-CB 3.47Å; S608-A612 PolarHBondContact O-N 2.9Å; F609-A612 PolarHBondContact O-N 3.44Å; A612-L614 VanDerWaalsContact C-N 3.34Å; A612-L616 WeakPolarHBondContact O-CB 3.19Å; A612-L616 VanDerWaalsContact O-CG 3.29Å; A612-L616 WeakPolarHBondContact O-CG 3.46Å; A612-L616 PolarHBondContact O-N 2.96Å
613	V	91.3	Very high	83.4	Confident	31 Å²	31	52.7 Å²	52.7	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-38.7	174.3	165.6	0	0	0	0	111.4	L582 F609 D611 F617	L582-V613 HydrophobicContact CD1-CG1 4.32Å; L582-V613 HydrophobicContact CD2-CG1 3.93Å; L582-V613 HydrophobicContact CG-CG1 4Å; F609-V613 HydrophobicContact CD2-CG2 4.04Å; F609-V613 HydrophobicContact CE1-CG2 4.25Å; F609-V613 HydrophobicContact CE2-CG2 3.53Å; F609-V613 HydrophobicContact CZ-CG2 3.67Å; F609-V613 WeakPolarHBondContact O-CB 3.14Å; F609-V613 WeakPolarHBondContact O-CG2 3.3Å; F609-V613 PolarHBondContact O-N 3.02Å; D611-V613 PolarHBondContact O-N 3.49Å; V613-F617 WeakPolarHBondContact O-CB 3.31Å; V613-F617 PolarHBondContact O-N 3.49Å
614	L	89.3	Confident	84	Confident	87 Å²	87	51.8 Å²	51.8	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-43.6	177.4	-177.5	63.9	0	0	0	112.3	S610 D611 A612 F617 K618	S610-L614 WeakPolarHBondContact O-CB 3.27Å; S610-L614 PolarHBondContact O-N 2.96Å; D611-L614 PolarHBondContact O-N 3.39Å; D611-L614 VanDerWaalsContact O-N 3.16Å; A612-L614 VanDerWaalsContact C-N 3.34Å; L614-F617 PolarHBondContact O-N 3.49Å; L614-K618 WeakPolarHBondContact O-CG 3.49Å; L614-K618 PolarHBondContact O-N 3.23Å
615	E	87.1	Confident	84.5	Confident	40 Å²	40	56.7 Å²	56.7	19%	0.187	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-38.7	176.2	-67.4	-50.5	140.8	0	0	112.2	Y606 D611 F617 K618 L619	Y606-E615 HydrophobicContact CD1-CB 4.28Å; Y606-E615 HydrophobicContact CE1-CB 3.69Å; Y606-E615 HydrophobicContact CE2-CB 4.42Å; D611-E615 WeakPolarHBondContact O-CG 3.22Å; D611-E615 PolarHBondContact O-N 2.99Å; E615-F617 VanDerWaalsContact C-N 3.34Å; E615-F617 PolarHBondContact O-N 2.96Å; E615-K618 PolarHBondContact O-N 3.42Å; E615-K618 IonicContact OE1-NZ 2.64Å; E615-K618 PolarHBondContact OE1-NZ 3.39Å; E615-K618 VanDerWaalsContact OE2-CD 3.29Å; E615-K618 WeakPolarHBondContact OE2-CD 3.28Å; E615-K618 IonicContact OE2-NZ 3.58Å; E615-L619 VanDerWaalsContact O-CB 3.3Å; E615-L619 WeakPolarHBondContact O-CB 3.44Å; E615-L619 PolarHBondContact O-N 2.96Å
616	L	89.9	Confident	84.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-38.5	171.9	-75.5	-176.6	0	0	0	112.7	L582 F585 L589 A612 L619 T620 L642 Y645	L582-L616 HydrophobicContact CD1-CB 3.59Å; L582-L616 HydrophobicContact CD1-CD1 4.34Å; F585-L616 HydrophobicContact CB-CD1 4Å; L589-L616 HydrophobicContact CD1-CD1 4.15Å; L589-L616 HydrophobicContact CD1-CD2 3.65Å; L589-L616 HydrophobicContact CD1-CG 4.17Å; A612-L616 WeakPolarHBondContact O-CB 3.19Å; A612-L616 VanDerWaalsContact O-CG 3.29Å; A612-L616 WeakPolarHBondContact O-CG 3.46Å; A612-L616 PolarHBondContact O-N 2.96Å; L616-L619 PolarHBondContact O-N 3.43Å; L616-T620 PolarHBondContact O-N 2.93Å; L616-T620 PolarHBondContact O-OG1 2.97Å; L616-L642 HydrophobicContact CD2-CD1 3.9Å; L616-Y645 HydrophobicContact CB-CE1 4.1Å; L616-Y645 HydrophobicContact CD1-CE2 4.32Å; L616-Y645 HydrophobicContact CD2-CD1 3.68Å; L616-Y645 HydrophobicContact CD2-CD2 4.5Å; L616-Y645 HydrophobicContact CD2-CE1 3.68Å; L616-Y645 HydrophobicContact CD2-CE2 4.5Å; L616-Y645 HydrophobicContact CD2-CG 4.09Å; L616-Y645 HydrophobicContact CG-CE1 4.4Å; L616-Y645 PolarHBondContact O-OH 3.35Å
617	F	91.1	Very high	84.3	Confident	98 Å²	98	63 Å²	63	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-65.3	-47.9	174.1	178.2	-97.8	0	0	0	111.6	Y578 V613 L614 E615 L619 T620 I621	Y578-F617 HydrophobicContact CE1-CD2 4.41Å; V613-F617 WeakPolarHBondContact O-CB 3.31Å; V613-F617 PolarHBondContact O-N 3.49Å; L614-F617 PolarHBondContact O-N 3.49Å; E615-F617 VanDerWaalsContact C-N 3.34Å; E615-F617 PolarHBondContact O-N 2.96Å; F617-L619 VanDerWaalsContact C-N 3.28Å; F617-L619 PolarHBondContact O-N 3.43Å; F617-T620 PolarHBondContact O-N 2.79Å; F617-I621 HydrophobicContact CD1-CD1 4.33Å; F617-I621 HydrophobicContact CE1-CD1 3.89Å; F617-I621 HydrophobicContact CZ-CG2 4.28Å; F617-I621 WeakPolarHBondContact O-CG1 3.44Å; F617-I621 PolarHBondContact O-N 3.49Å
618	K	89.3	Confident	83.9	Confident	68 Å²	68	66.3 Å²	66.3	30%	0.296	37%	0.367	S	S	.	.	H	α-helix	trans	-55.1	-43.1	173.4	-74.4	169.5	178.7	177.1	0	111.7	L614 E615 I621 G622 L623 G624	L614-K618 WeakPolarHBondContact O-CG 3.49Å; L614-K618 PolarHBondContact O-N 3.23Å; E615-K618 PolarHBondContact O-N 3.42Å; E615-K618 IonicContact OE1-NZ 2.64Å; E615-K618 PolarHBondContact OE1-NZ 3.39Å; E615-K618 VanDerWaalsContact OE2-CD 3.29Å; E615-K618 WeakPolarHBondContact OE2-CD 3.28Å; E615-K618 IonicContact OE2-NZ 3.58Å; K618-I621 WeakPolarHBondContact O-CG1 3.39Å; K618-I621 PolarHBondContact O-N 3.12Å; K618-G622 PolarHBondContact O-N 2.99Å; K618-L623 HydrophobicContact CB-CB 4.39Å; K618-L623 PolarHBondContact O-N 3.44Å; K618-G624 PolarHBondContact O-N 3.21Å
619	L	89.2	Confident	83	Confident	21 Å²	21	65.2 Å²	65.2	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-64.2	-41.5	179	-174.4	62.7	0	0	0	111.9	E615 L616 F617 I621 G622 L626 L642 V646	E615-L619 VanDerWaalsContact O-CB 3.3Å; E615-L619 WeakPolarHBondContact O-CB 3.44Å; E615-L619 PolarHBondContact O-N 2.96Å; L616-L619 PolarHBondContact O-N 3.43Å; F617-L619 VanDerWaalsContact C-N 3.28Å; F617-L619 PolarHBondContact O-N 3.43Å; L619-I621 VanDerWaalsContact C-N 3.31Å; L619-I621 PolarHBondContact O-N 3.36Å; L619-G622 PolarHBondContact O-N 2.82Å; L619-G622 VanDerWaalsContact O-N 3.08Å; L619-L626 HydrophobicContact CD1-CD2 3.69Å; L619-L626 HydrophobicContact CD1-CG 3.93Å; L619-L626 HydrophobicContact CD2-CD2 3.89Å; L619-L626 HydrophobicContact CG-CD2 4.44Å; L619-L642 HydrophobicContact CD2-CD1 3.62Å; L619-L642 HydrophobicContact CD2-CG 4.12Å; L619-V646 HydrophobicContact CD1-CG2 4.42Å; L619-V646 HydrophobicContact CD2-CG2 3.56Å; L619-V646 HydrophobicContact CG-CG2 3.9Å
620	T	88.4	Confident	81.9	Confident	11 Å²	11	70.3 Å²	70.3	7%	0.067	38%	0.382	C	S	.	.	H	α-helix	trans	-63.6	-33.9	177.5	-64.6	0	0	0	0	113	Y578 L616 F617 G622 Y645 T649	Y578-T620 HydrophobicContact CE2-CG2 3.81Å; Y578-T620 PolarHBondContact OH-OG1 3.3Å; L616-T620 PolarHBondContact O-N 2.93Å; L616-T620 PolarHBondContact O-OG1 2.97Å; F617-T620 PolarHBondContact O-N 2.79Å; T620-G622 VanDerWaalsContact C-N 3.33Å; T620-Y645 WeakPolarHBondContact OG1-CE1 3.34Å; T620-Y645 PolarHBondContact OG1-OH 3.34Å; T620-T649 PolarHBondContact OG1-OG1 3.39Å
621	I	87.3	Confident	81	Confident	91 Å²	91	69.2 Å²	69.2	47%	0.467	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	3.4	174.9	63.3	178	0	0	0	113.9	F617 K618 L619 L623	F617-I621 HydrophobicContact CD1-CD1 4.33Å; F617-I621 HydrophobicContact CE1-CD1 3.89Å; F617-I621 HydrophobicContact CZ-CG2 4.28Å; F617-I621 WeakPolarHBondContact O-CG1 3.44Å; F617-I621 PolarHBondContact O-N 3.49Å; K618-I621 WeakPolarHBondContact O-CG1 3.39Å; K618-I621 PolarHBondContact O-N 3.12Å; L619-I621 VanDerWaalsContact C-N 3.31Å; L619-I621 PolarHBondContact O-N 3.36Å; I621-L623 HydrophobicContact CD1-CB 4.45Å; I621-L623 HydrophobicContact CD1-CD1 3.66Å; I621-L623 HydrophobicContact CD1-CG 4.05Å; I621-L623 HydrophobicContact CG1-CB 4.21Å; I621-L623 HydrophobicContact CG1-CD1 4.19Å; I621-L623 HydrophobicContact CG1-CG 4Å
622	G	84.1	Confident	80.5	Confident	60 Å²	60	66.4 Å²	66.4	62%	0.619	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	17.6	178.9	0	0	0	0	0	115.7	K618 L619 T620	K618-G622 PolarHBondContact O-N 2.99Å; L619-G622 PolarHBondContact O-N 2.82Å; L619-G622 VanDerWaalsContact O-N 3.08Å; T620-G622 VanDerWaalsContact C-N 3.33Å
623	L	84.3	Confident	79.8	Confident	133 Å²	133	72.4 Å²	72.4	70%	0.696	38%	0.382	S	S	*	.			trans	-101.4	-2.1	175.7	-63.6	-175.2	0	0	0	114	K618 I621	K618-L623 HydrophobicContact CB-CB 4.39Å; K618-L623 PolarHBondContact O-N 3.44Å; I621-L623 HydrophobicContact CD1-CB 4.45Å; I621-L623 HydrophobicContact CD1-CD1 3.66Å; I621-L623 HydrophobicContact CD1-CG 4.05Å; I621-L623 HydrophobicContact CG1-CB 4.21Å; I621-L623 HydrophobicContact CG1-CD1 4.19Å; I621-L623 HydrophobicContact CG1-CG 4Å
624	G	76.8	Confident	79.5	Confident	17 Å²	17	77.8 Å²	77.8	18%	0.175	40%	0.4	C	S	.	.			trans	-97.2	132	-177.4	0	0	0	0	0	113.1	K618	K618-G624 PolarHBondContact O-N 3.21Å
625	D	76.5	Confident	79.2	Confident	127 Å²	127	76.4 Å²	76.4	68%	0.679	40%	0.396	S	S	*	.			trans	-79.7	128.3	173.5	-73.9	-30.6	0	0	0	111.5	N627	D625-N627 WeakPolarHBondContact CB-ND2 3.44Å; D625-N627 PolarHBondContact O-N 3.33Å
626	L	72	Confident	79.1	Confident	101 Å²	101	81.4 Å²	81.4	53%	0.529	42%	0.422	S	S	.	.			trans	-77.1	55.2	173.6	-71.3	172.8	0	0	0	112.2	L619 L642	L619-L626 HydrophobicContact CD1-CD2 3.69Å; L619-L626 HydrophobicContact CD1-CG 3.93Å; L619-L626 HydrophobicContact CD2-CD2 3.89Å; L619-L626 HydrophobicContact CG-CD2 4.44Å; L626-L642 HydrophobicContact CD2-CD2 3.61Å; L626-L642 HydrophobicContact CD2-CG 4.01Å
627	N	69.8	Low	79.1	Confident	109 Å²	109	85.3 Å²	85.3	58%	0.583	44%	0.443	S	S	*	.			trans	-76.9	124.5	177.6	-73.7	-36.9	0	0	0	111	D625 Q629	D625-N627 WeakPolarHBondContact CB-ND2 3.44Å; D625-N627 PolarHBondContact O-N 3.33Å; N627-Q629 PolarHBondContact O-N 3.32Å
628	I	65.6	Low	78.9	Confident	119 Å²	119	81 Å²	81	61%	0.61	42%	0.424	S	S	*	.			trans	-65.2	107.4	177.3	-57.4	174.1	0	0	0	108.9	Q630	I628-Q630 PolarHBondContact O-N 3.41Å
629	Q	64.4	Low	78.8	Confident	19 Å²	19	80.8 Å²	80.8	9%	0.089	43%	0.426	C	S	.	.			trans	-63	105.3	178	-68.7	-82.3	-52.4	0	0	110.1	I593 S605 Y606 N627 N631 S632 F638	I593-Q629 HydrophobicContact CD1-CG 4.46Å; S605-Q629 PolarHBondContact OG-NE2 3.06Å; Y606-Q629 HydrophobicContact CD2-CG 4.1Å; Y606-Q629 HydrophobicContact CE2-CG 4.24Å; N627-Q629 PolarHBondContact O-N 3.32Å; Q629-N631 PolarHBondContact O-N 2.96Å; Q629-N631 VanDerWaalsContact O-N 3.16Å; Q629-S632 PolarHBondContact O-N 3.27Å; Q629-F638 HydrophobicContact CB-CD1 4.48Å; Q629-F638 HydrophobicContact CB-CE1 4.15Å; Q629-F638 HydrophobicContact CB-CZ 4.38Å; Q629-F638 HydrophobicContact CG-CE1 3.74Å; Q629-F638 HydrophobicContact CG-CE2 4.47Å; Q629-F638 HydrophobicContact CG-CZ 3.7Å
630	Q	64.4	Low	78.9	Confident	197 Å²	197	85.9 Å²	85.9	92%	0.921	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.2	176	-63.4	-171.1	2.6	0	0	113.2	I628	I628-Q630 PolarHBondContact O-N 3.41Å
631	N	67.9	Low	79	Confident	54 Å²	54	87 Å²	87	29%	0.289	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	12.8	-175.4	-158.2	41.2	0	0	0	114.1	E594 C596 Q629	E594-N631 PolarHBondContact N-O 3.41Å; E594-N631 PolarHBondContact O-ND2 2.97Å; C596-N631 PolarHBondContact SG-ND2 3.41Å; Q629-N631 PolarHBondContact O-N 2.96Å; Q629-N631 VanDerWaalsContact O-N 3.16Å
632	S	73.3	Confident	79.1	Confident	11 Å²	11	82.9 Å²	82.9	8%	0.077	43%	0.432	C	S	.	.	B	Isolated β-bridge	trans	-90.8	135.6	169.4	-177.4	0	0	0	0	110.9	L592 Q629 Y634	L592-S632 PolarHBondContact O-OG 2.98Å; Q629-S632 PolarHBondContact O-N 3.27Å; S632-Y634 PolarHBondContact O-N 3.43Å; S632-Y634 PolarHBondContact OG-N 2.92Å
633	K	74.4	Confident	79.4	Confident	126 Å²	126	84 Å²	84	55%	0.548	42%	0.423	S	S	.	.	S	Bend	trans	-60.9	-28.6	175.7	-158.8	-171.4	-158.4	89	0	113.1	E594	E594-K633 HydrophobicContact CG-CB 4.35Å; E594-K633 WeakPolarHBondContact OE1-CD 3.28Å; E594-K633 WeakPolarHBondContact OE1-CG 3.29Å; E594-K633 IonicContact OE1-NZ 2.67Å; E594-K633 PolarHBondContact OE1-NZ 3.01Å
634	Y	85.2	Confident	79.8	Confident	144 Å²	144	79.6 Å²	79.6	57%	0.565	40%	0.401	S	S	*	.			trans	-133.6	75.1	-178.3	-62.8	-65.5	0	0	0	110.1	S632 I636 L637 F638	S632-Y634 PolarHBondContact O-N 3.43Å; S632-Y634 PolarHBondContact OG-N 2.92Å; Y634-I636 PolarHBondContact O-N 3.34Å; Y634-L637 PolarHBondContact O-N 2.9Å; Y634-F638 PolarHBondContact O-N 3.49Å
635	P	82.4	Confident	80.6	Confident	58 Å²	58	78.8 Å²	78.8	38%	0.377	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-29.7	-171.8	24.8	-34.4	0	0	0	112.9	L639	P635-L639 VanDerWaalsContact O-CB 3.29Å; P635-L639 WeakPolarHBondContact O-CB 3.37Å; P635-L639 PolarHBondContact O-N 3.1Å
636	I	85.6	Confident	81.3	Confident	145 Å²	145	74.6 Å²	74.6	74%	0.744	37%	0.372	S	S	*	.	H	α-helix	trans	-66.7	-43	175.7	-58.3	172.5	0	0	0	111	Y634 F640	Y634-I636 PolarHBondContact O-N 3.34Å; I636-F640 VanDerWaalsContact O-CB 3.3Å; I636-F640 WeakPolarHBondContact O-CB 3.34Å; I636-F640 PolarHBondContact O-N 3.4Å
637	L	88.4	Confident	82.2	Confident	83 Å²	83	74.3 Å²	74.3	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-71.4	-38.6	178.6	-176.9	62.2	0	0	0	111.4	L592 Y634 F640 L641	L592-L637 HydrophobicContact CD2-CB 4.12Å; L592-L637 HydrophobicContact CD2-CD2 4.07Å; L592-L637 HydrophobicContact CD2-CG 3.92Å; Y634-L637 PolarHBondContact O-N 2.9Å; L637-F640 HydrophobicContact CD1-CD1 4.47Å; L637-F640 PolarHBondContact O-N 3.41Å; L637-L641 HydrophobicContact CD1-CG 4.48Å; L637-L641 HydrophobicContact CG-CD1 4.35Å; L637-L641 WeakPolarHBondContact O-CB 3.37Å; L637-L641 WeakPolarHBondContact O-CG 3.49Å; L637-L641 PolarHBondContact O-N 2.98Å
638	F	87.8	Confident	83.2	Confident	6 Å²	6	71.7 Å²	71.7	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-50.8	172.9	-178.5	-88.8	0	0	0	111.2	L589 L592 I593 Y606 Q629 Y634 F640 L641 L642	L589-F638 HydrophobicContact CB-CE2 4Å; L589-F638 HydrophobicContact CD2-CD2 3.67Å; L589-F638 HydrophobicContact CD2-CE2 3.7Å; L589-F638 HydrophobicContact CD2-CG 4.28Å; L589-F638 HydrophobicContact CD2-CZ 4.32Å; L589-F638 HydrophobicContact CG-CE2 4.32Å; L592-F638 HydrophobicContact CB-CD2 4.28Å; L592-F638 HydrophobicContact CD2-CB 3.99Å; I593-F638 HydrophobicContact CD1-CD2 4.37Å; I593-F638 HydrophobicContact CD1-CE2 3.67Å; I593-F638 HydrophobicContact CD1-CZ 4.3Å; I593-F638 HydrophobicContact CG1-CD2 4.46Å; I593-F638 HydrophobicContact CG1-CE2 4.24Å; Y606-F638 HydrophobicContact CD2-CZ 4.13Å; Y606-F638 AromaticContact CE2-CZ 4Å; Y606-F638 HydrophobicContact CE2-CZ 4Å; Y606-F638 HydrophobicContact CG-CZ 4.46Å; Q629-F638 HydrophobicContact CB-CD1 4.48Å; Q629-F638 HydrophobicContact CB-CE1 4.15Å; Q629-F638 HydrophobicContact CB-CZ 4.38Å; Q629-F638 HydrophobicContact CG-CE1 3.74Å; Q629-F638 HydrophobicContact CG-CE2 4.47Å; Q629-F638 HydrophobicContact CG-CZ 3.7Å; Y634-F638 PolarHBondContact O-N 3.49Å; F638-F640 PolarHBondContact O-N 2.9Å; F638-L641 PolarHBondContact O-N 3.47Å; F638-L642 HydrophobicContact CE1-CD2 4.14Å; F638-L642 WeakPolarHBondContact O-CB 3.37Å; F638-L642 PolarHBondContact O-N 2.82Å
639	L	87.6	Confident	84.4	Confident	65 Å²	65	66.1 Å²	66.1	34%	0.34	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-40.5	177.6	-176.9	63.2	0	0	0	112	P635 L642 I643	P635-L639 VanDerWaalsContact O-CB 3.29Å; P635-L639 WeakPolarHBondContact O-CB 3.37Å; P635-L639 PolarHBondContact O-N 3.1Å; L639-L642 PolarHBondContact O-N 3.48Å; L639-I643 HydrophobicContact CD1-CD1 3.94Å; L639-I643 HydrophobicContact CD1-CG1 4.18Å; L639-I643 HydrophobicContact CD2-CD1 4.46Å; L639-I643 HydrophobicContact CG-CD1 3.8Å; L639-I643 HydrophobicContact CG-CG1 4.42Å; L639-I643 WeakPolarHBondContact O-CB 3.35Å; L639-I643 VanDerWaalsContact O-CG1 3.29Å; L639-I643 WeakPolarHBondContact O-CG1 3.29Å; L639-I643 PolarHBondContact O-N 3.21Å
640	F	90.6	Very high	85.5	Confident	127 Å²	127	70.6 Å²	70.6	56%	0.557	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-46.2	176.4	176.3	-98.5	0	0	0	112.4	I636 L637 F638 L642 T644	I636-F640 VanDerWaalsContact O-CB 3.3Å; I636-F640 WeakPolarHBondContact O-CB 3.34Å; I636-F640 PolarHBondContact O-N 3.4Å; L637-F640 HydrophobicContact CD1-CD1 4.47Å; L637-F640 PolarHBondContact O-N 3.41Å; F638-F640 PolarHBondContact O-N 2.9Å; F640-L642 VanDerWaalsContact C-N 3.35Å; F640-T644 VanDerWaalsContact O-CB 3.31Å; F640-T644 WeakPolarHBondContact O-CB 3.47Å; F640-T644 PolarHBondContact O-N 2.97Å; F640-T644 PolarHBondContact O-OG1 3.26Å
641	L	91.1	Very high	86.7	Confident	36 Å²	36	65.1 Å²	65.1	19%	0.188	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-40.3	176.4	-73.9	172.5	0	0	0	111.8	F585 A588 L589 L592 L637 F638 T644 Y645	F585-L641 HydrophobicContact CE1-CD2 4.25Å; A588-L641 HydrophobicContact CB-CD1 4.48Å; L589-L641 HydrophobicContact CD2-CB 3.82Å; L589-L641 HydrophobicContact CD2-CD1 4.42Å; L592-L641 HydrophobicContact CD1-CD1 4.24Å; L592-L641 HydrophobicContact CD2-CD1 4.17Å; L637-L641 HydrophobicContact CD1-CG 4.48Å; L637-L641 HydrophobicContact CG-CD1 4.35Å; L637-L641 WeakPolarHBondContact O-CB 3.37Å; L637-L641 WeakPolarHBondContact O-CG 3.49Å; L637-L641 PolarHBondContact O-N 2.98Å; F638-L641 PolarHBondContact O-N 3.47Å; L641-T644 PolarHBondContact O-N 3.47Å; L641-Y645 WeakPolarHBondContact O-CB 3.36Å; L641-Y645 PolarHBondContact O-N 3.2Å
642	L	89.4	Confident	87.7	Confident	4 Å²	4	67 Å²	67	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-66.3	-45	178.2	-168.5	67.9	0	0	0	112.3	L589 L616 L619 L626 F638 L639 F640 Y645 V646	L589-L642 HydrophobicContact CD1-CD1 3.87Å; L616-L642 HydrophobicContact CD2-CD1 3.9Å; L619-L642 HydrophobicContact CD2-CD1 3.62Å; L619-L642 HydrophobicContact CD2-CG 4.12Å; L626-L642 HydrophobicContact CD2-CD2 3.61Å; L626-L642 HydrophobicContact CD2-CG 4.01Å; F638-L642 HydrophobicContact CE1-CD2 4.14Å; F638-L642 WeakPolarHBondContact O-CB 3.37Å; F638-L642 PolarHBondContact O-N 2.82Å; L639-L642 PolarHBondContact O-N 3.48Å; F640-L642 VanDerWaalsContact C-N 3.35Å; L642-Y645 WeakPolarHBondContact O-CB 3.26Å; L642-Y645 PolarHBondContact O-N 3.47Å; L642-V646 WeakPolarHBondContact O-CG2 3.5Å; L642-V646 PolarHBondContact O-N 3.36Å
643	I	90.5	Very high	88.6	Confident	83 Å²	83	67.2 Å²	67.2	43%	0.426	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-43	174.6	-70	170.5	0	0	0	110.7	L639 Y645 V646 I647	L639-I643 HydrophobicContact CD1-CD1 3.94Å; L639-I643 HydrophobicContact CD1-CG1 4.18Å; L639-I643 HydrophobicContact CD2-CD1 4.46Å; L639-I643 HydrophobicContact CG-CD1 3.8Å; L639-I643 HydrophobicContact CG-CG1 4.42Å; L639-I643 WeakPolarHBondContact O-CB 3.35Å; L639-I643 VanDerWaalsContact O-CG1 3.29Å; L639-I643 WeakPolarHBondContact O-CG1 3.29Å; L639-I643 PolarHBondContact O-N 3.21Å; I643-Y645 VanDerWaalsContact C-N 3.32Å; I643-Y645 PolarHBondContact O-N 3.28Å; I643-V646 PolarHBondContact O-N 3.05Å; I643-I647 HydrophobicContact CG2-CD1 3.78Å; I643-I647 HydrophobicContact CG2-CG1 4.4Å; I643-I647 WeakPolarHBondContact O-CG1 3.21Å; I643-I647 PolarHBondContact O-N 3.36Å
644	T	92.1	Very high	89.3	Confident	41 Å²	41	63.5 Å²	63.5	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-59.4	-44.2	176.3	-58.1	0	0	0	0	111.1	F585 F640 L641 I647 L648	F585-T644 HydrophobicContact CE1-CG2 4.44Å; F585-T644 HydrophobicContact CZ-CG2 4.26Å; F640-T644 VanDerWaalsContact O-CB 3.31Å; F640-T644 WeakPolarHBondContact O-CB 3.47Å; F640-T644 PolarHBondContact O-N 2.97Å; F640-T644 PolarHBondContact O-OG1 3.26Å; L641-T644 PolarHBondContact O-N 3.47Å; T644-I647 PolarHBondContact O-N 2.86Å; T644-L648 HydrophobicContact CG2-CD1 3.97Å; T644-L648 HydrophobicContact CG2-CG 4.48Å; T644-L648 WeakPolarHBondContact O-CB 3.31Å; T644-L648 VanDerWaalsContact O-CG 3.29Å; T644-L648 WeakPolarHBondContact O-CG 3.43Å; T644-L648 PolarHBondContact O-N 2.92Å
645	Y	92.8	Very high	89.5	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-50.1	173.7	175.6	-94.9	0	0	0	111.9	Y578 L582 F585 L616 T620 L641 L642 I643 I647 L648 T649	Y578-Y645 PolarHBondContact OH-OH 2.92Å; L582-Y645 WeakPolarHBondContact CD1-OH 3.2Å; F585-Y645 HydrophobicContact CB-CD2 3.77Å; F585-Y645 HydrophobicContact CB-CE2 4.36Å; F585-Y645 HydrophobicContact CD1-CD2 4.36Å; F585-Y645 AromaticContact CD2-CD2 3.83Å; F585-Y645 HydrophobicContact CD2-CD2 3.83Å; F585-Y645 AromaticContact CG-CD2 3.74Å; F585-Y645 HydrophobicContact CG-CD2 3.74Å; F585-Y645 HydrophobicContact CG-CG 4.4Å; L616-Y645 HydrophobicContact CB-CE1 4.1Å; L616-Y645 HydrophobicContact CD1-CE2 4.32Å; L616-Y645 HydrophobicContact CD2-CD1 3.68Å; L616-Y645 HydrophobicContact CD2-CD2 4.5Å; L616-Y645 HydrophobicContact CD2-CE1 3.68Å; L616-Y645 HydrophobicContact CD2-CE2 4.5Å; L616-Y645 HydrophobicContact CD2-CG 4.09Å; L616-Y645 HydrophobicContact CG-CE1 4.4Å; L616-Y645 PolarHBondContact O-OH 3.35Å; T620-Y645 WeakPolarHBondContact OG1-CE1 3.34Å; T620-Y645 PolarHBondContact OG1-OH 3.34Å; L641-Y645 WeakPolarHBondContact O-CB 3.36Å; L641-Y645 PolarHBondContact O-N 3.2Å; L642-Y645 WeakPolarHBondContact O-CB 3.26Å; L642-Y645 PolarHBondContact O-N 3.47Å; I643-Y645 VanDerWaalsContact C-N 3.32Å; I643-Y645 PolarHBondContact O-N 3.28Å; Y645-I647 VanDerWaalsContact C-N 3.34Å; Y645-I647 PolarHBondContact O-N 3.25Å; Y645-L648 PolarHBondContact O-N 3.05Å; Y645-T649 HydrophobicContact CD1-CG2 4.48Å; Y645-T649 HydrophobicContact CD2-CG2 3.97Å; Y645-T649 HydrophobicContact CE1-CG2 4.13Å; Y645-T649 HydrophobicContact CE2-CG2 3.57Å; Y645-T649 HydrophobicContact CG-CG2 4.42Å; Y645-T649 PolarHBondContact O-N 2.92Å; Y645-T649 PolarHBondContact O-OG1 3.28Å; Y645-T649 VanDerWaalsContact O-OG1 3.12Å
646	V	91.4	Very high	89.9	Confident	39 Å²	39	63.2 Å²	63.2	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-42	179.4	171.5	0	0	0	0	112	L619 L642 I643 F650	L619-V646 HydrophobicContact CD1-CG2 4.42Å; L619-V646 HydrophobicContact CD2-CG2 3.56Å; L619-V646 HydrophobicContact CG-CG2 3.9Å; L642-V646 WeakPolarHBondContact O-CG2 3.5Å; L642-V646 PolarHBondContact O-N 3.36Å; I643-V646 PolarHBondContact O-N 3.05Å; V646-F650 HydrophobicContact CG1-CB 4.38Å; V646-F650 VanDerWaalsContact O-CB 3.26Å; V646-F650 WeakPolarHBondContact O-CB 3.32Å; V646-F650 PolarHBondContact O-N 3.42Å
647	I	91.4	Very high	90.2	Very high	95 Å²	95	57.3 Å²	57.3	49%	0.487	30%	0.295	S	S	.	.	I	π-helix	trans	-63.3	-46	176.3	-67	167.8	0	0	0	110.4	I643 T644 Y645 V651 L652	I643-I647 HydrophobicContact CG2-CD1 3.78Å; I643-I647 HydrophobicContact CG2-CG1 4.4Å; I643-I647 WeakPolarHBondContact O-CG1 3.21Å; I643-I647 PolarHBondContact O-N 3.36Å; T644-I647 PolarHBondContact O-N 2.86Å; Y645-I647 VanDerWaalsContact C-N 3.34Å; Y645-I647 PolarHBondContact O-N 3.25Å; I647-V651 WeakPolarHBondContact O-CB 3.46Å; I647-V651 PolarHBondContact O-N 2.85Å; I647-L652 PolarHBondContact O-N 3.18Å; I647-L652 VanDerWaalsContact O-N 3.12Å
648	L	91.5	Very high	90.4	Very high	54 Å²	54	58.8 Å²	58.8	28%	0.283	30%	0.302	S	S	.	.	I	π-helix	trans	-66.5	-44	-179.5	-70.5	172.5	0	0	0	112.8	F585 T644 Y645 L652 L653	F585-L648 HydrophobicContact CE2-CD1 4.14Å; F585-L648 HydrophobicContact CZ-CD1 3.96Å; T644-L648 HydrophobicContact CG2-CD1 3.97Å; T644-L648 HydrophobicContact CG2-CG 4.48Å; T644-L648 WeakPolarHBondContact O-CB 3.31Å; T644-L648 VanDerWaalsContact O-CG 3.29Å; T644-L648 WeakPolarHBondContact O-CG 3.43Å; T644-L648 PolarHBondContact O-N 2.92Å; Y645-L648 PolarHBondContact O-N 3.05Å; L648-L652 WeakPolarHBondContact O-CB 3.32Å; L648-L653 WeakPolarHBondContact O-CG 3.29Å; L648-L653 PolarHBondContact O-N 3.08Å
649	T	90.6	Very high	90.6	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.012	33%	0.327	C	S	.	.	I	π-helix	trans	-82.1	-55.2	-176.9	61.2	0	0	0	0	112.5	Y578 T620 Y645 L653 L654	Y578-T649 HydrophobicContact CD2-CG2 4.13Å; Y578-T649 HydrophobicContact CE2-CG2 3.99Å; T620-T649 PolarHBondContact OG1-OG1 3.39Å; Y645-T649 HydrophobicContact CD1-CG2 4.48Å; Y645-T649 HydrophobicContact CD2-CG2 3.97Å; Y645-T649 HydrophobicContact CE1-CG2 4.13Å; Y645-T649 HydrophobicContact CE2-CG2 3.57Å; Y645-T649 HydrophobicContact CG-CG2 4.42Å; Y645-T649 PolarHBondContact O-N 2.92Å; Y645-T649 PolarHBondContact O-OG1 3.28Å; Y645-T649 VanDerWaalsContact O-OG1 3.12Å; T649-L653 PolarHBondContact O-N 3.2Å; T649-L654 PolarHBondContact O-N 3.39Å
650	F	87.6	Confident	90.8	Very high	113 Å²	113	61.9 Å²	61.9	50%	0.496	33%	0.328	S	S	.	.	I	π-helix	trans	-78.6	-44.5	-171.1	-175.6	-95.5	0	0	0	112.6	V646 L654	V646-F650 HydrophobicContact CG1-CB 4.38Å; V646-F650 VanDerWaalsContact O-CB 3.26Å; V646-F650 WeakPolarHBondContact O-CB 3.32Å; V646-F650 PolarHBondContact O-N 3.42Å; F650-L654 HydrophobicContact CD2-CD1 3.85Å; F650-L654 HydrophobicContact CE2-CD1 4.46Å
651	V	88.5	Confident	90.9	Very high	82 Å²	82	59 Å²	59	50%	0.497	32%	0.317	S	S	.	.	I	π-helix	trans	-83.2	-39.1	-176.6	-174.1	0	0	0	0	111.9	I647 N655	I647-V651 WeakPolarHBondContact O-CB 3.46Å; I647-V651 PolarHBondContact O-N 2.85Å; V651-N655 PolarHBondContact O-ND2 3.47Å
652	L	90.3	Very high	91	Very high	94 Å²	94	59.3 Å²	59.3	49%	0.492	33%	0.328	S	S	.	.	I	π-helix	trans	-95.7	-64.4	-176.7	-172.2	148.6	0	0	0	112.7	I647 L648 L654 N655 M656	I647-L652 PolarHBondContact O-N 3.18Å; I647-L652 VanDerWaalsContact O-N 3.12Å; L648-L652 WeakPolarHBondContact O-CB 3.32Å; L652-L654 PolarHBondContact O-N 3Å; L652-N655 PolarHBondContact O-N 3.46Å; L652-M656 VanDerWaalsContact O-CB 3.28Å; L652-M656 WeakPolarHBondContact O-CB 3.27Å; L652-M656 PolarHBondContact O-N 3.2Å
653	L	90.4	Very high	91.1	Very high	14 Å²	14	64.9 Å²	64.9	7%	0.073	36%	0.355	C	S	.	.	I	π-helix	trans	-66.8	-41.6	-169.8	-71.3	176.7	0	0	0	113.9	F574 V577 F581 L648 T649 M656 L657	F574-L653 HydrophobicContact CD2-CB 4.42Å; F574-L653 HydrophobicContact CE2-CB 3.83Å; V577-L653 HydrophobicContact CG1-CD1 4.39Å; V577-L653 HydrophobicContact CG1-CD2 4.17Å; F581-L653 HydrophobicContact CD2-CD1 3.66Å; F581-L653 HydrophobicContact CE2-CD1 3.84Å; L648-L653 WeakPolarHBondContact O-CG 3.29Å; L648-L653 PolarHBondContact O-N 3.08Å; T649-L653 PolarHBondContact O-N 3.2Å; L653-M656 PolarHBondContact O-N 3.03Å; L653-L657 WeakPolarHBondContact O-CB 3.39Å; L653-L657 PolarHBondContact O-N 2.83Å
654	L	89.6	Confident	91.1	Very high	48 Å²	48	62.1 Å²	62.1	25%	0.251	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-43.4	178.2	-71.7	-178.9	0	0	0	112.3	F574 T649 F650 L652 L657 I658	F574-L654 HydrophobicContact CE2-CD2 4.21Å; F574-L654 HydrophobicContact CZ-CD2 3.8Å; T649-L654 PolarHBondContact O-N 3.39Å; F650-L654 HydrophobicContact CD2-CD1 3.85Å; F650-L654 HydrophobicContact CE2-CD1 4.46Å; L652-L654 PolarHBondContact O-N 3Å; L654-L657 PolarHBondContact O-N 3.49Å; L654-I658 WeakPolarHBondContact O-CG1 3.19Å; L654-I658 PolarHBondContact O-N 3.13Å
655	N	90.1	Very high	91.1	Very high	92 Å²	92	62.9 Å²	62.9	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-68.4	-36.4	178.3	-70.8	-39.7	0	0	0	112	V651 L652 I658 A659	V651-N655 PolarHBondContact O-ND2 3.47Å; L652-N655 PolarHBondContact O-N 3.46Å; N655-I658 PolarHBondContact O-N 3.14Å; N655-A659 PolarHBondContact O-N 2.93Å
656	M	90.7	Very high	91	Very high	105 Å²	105	68.1 Å²	68.1	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-41.6	171.6	179	-176.2	155	0	0	112	L652 L653 A659 L660	L652-M656 VanDerWaalsContact O-CB 3.28Å; L652-M656 WeakPolarHBondContact O-CB 3.27Å; L652-M656 PolarHBondContact O-N 3.2Å; L653-M656 PolarHBondContact O-N 3.03Å; M656-A659 PolarHBondContact O-N 3.3Å; M656-L660 HydrophobicContact CE-CD1 3.83Å; M656-L660 HydrophobicContact CG-CD1 4.24Å; M656-L660 WeakPolarHBondContact O-CG 3.31Å; M656-L660 PolarHBondContact O-N 2.82Å
657	L	91.6	Very high	90.9	Very high	21 Å²	21	70.2 Å²	70.2	11%	0.11	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-44.9	174.8	175.6	63.2	0	0	0	111.4	D570 F574 L653 L654 A659 L660 M661	D570-L657 HydrophobicContact CB-CD1 4.21Å; F574-L657 HydrophobicContact CB-CD1 3.93Å; F574-L657 HydrophobicContact CB-CD2 4.42Å; F574-L657 HydrophobicContact CD1-CD2 3.89Å; F574-L657 HydrophobicContact CD2-CB 3.79Å; F574-L657 HydrophobicContact CD2-CD1 4.46Å; F574-L657 HydrophobicContact CD2-CD2 3.91Å; F574-L657 HydrophobicContact CD2-CG 4.26Å; F574-L657 HydrophobicContact CE1-CD2 4.11Å; F574-L657 HydrophobicContact CE2-CB 4.14Å; F574-L657 HydrophobicContact CE2-CD2 4.07Å; F574-L657 HydrophobicContact CG-CB 4.35Å; F574-L657 HydrophobicContact CG-CD1 4.19Å; F574-L657 HydrophobicContact CG-CD2 3.81Å; F574-L657 HydrophobicContact CG-CG 4.33Å; F574-L657 HydrophobicContact CZ-CD2 4.19Å; L653-L657 WeakPolarHBondContact O-CB 3.39Å; L653-L657 PolarHBondContact O-N 2.83Å; L654-L657 PolarHBondContact O-N 3.49Å; L657-A659 VanDerWaalsContact C-N 3.31Å; L657-A659 PolarHBondContact O-N 3.5Å; L657-L660 PolarHBondContact O-N 3.37Å; L657-M661 HydrophobicContact CD1-CG 3.99Å; L657-M661 HydrophobicContact CD1-SD 3.92Å; L657-M661 HydrophobicContact CD2-SD 4.33Å; L657-M661 HydrophobicContact CG-CG 4.31Å; L657-M661 HydrophobicContact CG-SD 3.79Å; L657-M661 WeakPolarHBondContact O-CB 3.32Å; L657-M661 VanDerWaalsContact O-CG 3.23Å; L657-M661 WeakPolarHBondContact O-CG 3.43Å; L657-M661 PolarHBondContact O-N 2.85Å
658	I	92.5	Very high	90.7	Very high	114 Å²	114	66.2 Å²	66.2	59%	0.585	36%	0.36	S	S	*	.	H	α-helix	trans	-61.3	-40.7	177.5	-66.9	164.6	0	0	0	111.1	L654 N655 M661 G662	L654-I658 WeakPolarHBondContact O-CG1 3.19Å; L654-I658 PolarHBondContact O-N 3.13Å; N655-I658 PolarHBondContact O-N 3.14Å; I658-M661 PolarHBondContact O-N 3.4Å; I658-G662 PolarHBondContact O-N 3.42Å
659	A	93.2	Very high	90.5	Very high	67 Å²	67	66.5 Å²	66.5	55%	0.554	37%	0.367	S	S	*	.	H	α-helix	trans	-63.5	-48.6	176.8	0	0	0	0	0	112.3	N655 M656 L657 M661 G662 E663	N655-A659 PolarHBondContact O-N 2.93Å; M656-A659 PolarHBondContact O-N 3.3Å; L657-A659 VanDerWaalsContact C-N 3.31Å; L657-A659 PolarHBondContact O-N 3.5Å; A659-M661 PolarHBondContact O-N 3.14Å; A659-G662 PolarHBondContact O-N 2.98Å; A659-G662 VanDerWaalsContact O-N 3.14Å; A659-E663 PolarHBondContact O-N 3.2Å
660	L	91.4	Very high	90.3	Very high	69 Å²	69	72.3 Å²	72.3	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-44.4	176.1	-71.1	171.1	0	0	0	111.8	M656 L657 G662 E663 T664	M656-L660 HydrophobicContact CE-CD1 3.83Å; M656-L660 HydrophobicContact CG-CD1 4.24Å; M656-L660 WeakPolarHBondContact O-CG 3.31Å; M656-L660 PolarHBondContact O-N 2.82Å; L657-L660 PolarHBondContact O-N 3.37Å; L660-G662 VanDerWaalsContact C-N 3.25Å; L660-G662 PolarHBondContact O-N 3.4Å; L660-E663 PolarHBondContact O-N 3.09Å; L660-T664 PolarHBondContact O-N 3.14Å; L660-T664 PolarHBondContact O-OG1 3.22Å
661	M	92.4	Very high	90.2	Very high	67 Å²	67	70.1 Å²	70.1	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-61.1	-33.5	175.6	-74.8	177.7	58.9	0	0	112.4	V566 D570 L657 I658 A659 T664 V665	V566-M661 HydrophobicContact CG1-CE 3.91Å; V566-M661 HydrophobicContact CG1-CG 3.76Å; V566-M661 HydrophobicContact CG1-SD 4.25Å; D570-M661 HydrophobicContact CB-CG 4.38Å; L657-M661 HydrophobicContact CD1-CG 3.99Å; L657-M661 HydrophobicContact CD1-SD 3.92Å; L657-M661 HydrophobicContact CD2-SD 4.33Å; L657-M661 HydrophobicContact CG-CG 4.31Å; L657-M661 HydrophobicContact CG-SD 3.79Å; L657-M661 WeakPolarHBondContact O-CB 3.32Å; L657-M661 VanDerWaalsContact O-CG 3.23Å; L657-M661 WeakPolarHBondContact O-CG 3.43Å; L657-M661 PolarHBondContact O-N 2.85Å; I658-M661 PolarHBondContact O-N 3.4Å; A659-M661 PolarHBondContact O-N 3.14Å; M661-T664 PolarHBondContact O-OG1 3.02Å; M661-V665 WeakPolarHBondContact O-CB 3.43Å; M661-V665 WeakPolarHBondContact O-CG2 3.31Å; M661-V665 PolarHBondContact O-N 3.47Å
662	G	92.3	Very high	89.9	Confident	41 Å²	41	66.4 Å²	66.4	42%	0.423	36%	0.361	S	S	.	.	H	α-helix	trans	-63.8	-47.9	175.1	0	0	0	0	0	112.2	I658 A659 L660 V665 E666	I658-G662 PolarHBondContact O-N 3.42Å; A659-G662 PolarHBondContact O-N 2.98Å; A659-G662 VanDerWaalsContact O-N 3.14Å; L660-G662 VanDerWaalsContact C-N 3.25Å; L660-G662 PolarHBondContact O-N 3.4Å; G662-V665 PolarHBondContact O-N 3.41Å; G662-E666 PolarHBondContact O-N 2.9Å
663	E	92.4	Very high	89.7	Confident	122 Å²	122	65.2 Å²	65.2	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-65.6	-43.7	178.4	-173	179.5	177.1	0	0	112.1	A659 L660 E666 N667	A659-E663 PolarHBondContact O-N 3.2Å; L660-E663 PolarHBondContact O-N 3.09Å; E663-E666 PolarHBondContact O-N 2.69Å; E663-N667 WeakPolarHBondContact O-CB 3.4Å; E663-N667 PolarHBondContact O-N 3.27Å; E663-N667 PolarHBondContact O-ND2 2.95Å
664	T	90.9	Very high	89.4	Confident	25 Å²	25	70.5 Å²	70.5	15%	0.153	37%	0.372	C	S	.	.	H	α-helix	trans	-68.6	-36.1	177.2	60.3	0	0	0	0	112.2	D570 L660 M661 V668	D570-T664 WeakPolarHBondContact OD1-CG2 3.27Å; D570-T664 WeakPolarHBondContact OD2-CB 3.42Å; D570-T664 VanDerWaalsContact OD2-CG2 3.28Å; D570-T664 WeakPolarHBondContact OD2-CG2 3.29Å; D570-T664 PolarHBondContact OD2-OG1 2.93Å; L660-T664 PolarHBondContact O-N 3.14Å; L660-T664 PolarHBondContact O-OG1 3.22Å; M661-T664 PolarHBondContact O-OG1 3.02Å; T664-V668 VanDerWaalsContact O-CB 3.25Å; T664-V668 WeakPolarHBondContact O-CB 3.48Å; T664-V668 WeakPolarHBondContact O-CG2 3.45Å; T664-V668 PolarHBondContact O-N 3.4Å
665	V	91.8	Very high	89.1	Confident	57 Å²	57	69.3 Å²	69.3	35%	0.345	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-45.1	171.4	156.3	0	0	0	0	111.6	M562 V566 M661 G662 S669	M562-V665 HydrophobicContact CE-CB 4.21Å; M562-V665 HydrophobicContact CE-CG1 3.63Å; M562-V665 HydrophobicContact CE-CG2 4.01Å; V566-V665 HydrophobicContact CG2-CG2 4.16Å; M661-V665 WeakPolarHBondContact O-CB 3.43Å; M661-V665 WeakPolarHBondContact O-CG2 3.31Å; M661-V665 PolarHBondContact O-N 3.47Å; G662-V665 PolarHBondContact O-N 3.41Å; V665-S669 WeakPolarHBondContact O-CB 3.37Å; V665-S669 PolarHBondContact O-N 2.88Å
666	E	90.7	Very high	89	Confident	110 Å²	110	65.3 Å²	65.3	51%	0.514	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-48.1	179	-162.1	-161.4	131	0	0	111.2	G662 E663 S669 K670	G662-E666 PolarHBondContact O-N 2.9Å; E663-E666 PolarHBondContact O-N 2.69Å; E666-S669 PolarHBondContact O-N 3.05Å; E666-S669 PolarHBondContact O-OG 3.02Å; E666-K670 WeakPolarHBondContact OE1-CE 3.3Å; E666-K670 IonicContact OE1-NZ 2.65Å; E666-K670 PolarHBondContact OE1-NZ 3.19Å
667	N	89	Confident	88.8	Confident	83 Å²	83	64.2 Å²	64.2	44%	0.444	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-42.4	-180	-73.4	-30.1	0	0	0	112.3	E663 S669 K670	E663-N667 WeakPolarHBondContact O-CB 3.4Å; E663-N667 PolarHBondContact O-N 3.27Å; E663-N667 PolarHBondContact O-ND2 2.95Å; N667-S669 VanDerWaalsContact C-N 3.33Å; N667-S669 PolarHBondContact O-N 3.42Å; N667-K670 PolarHBondContact O-N 3.02Å
668	V	87.3	Confident	88.6	Confident	11 Å²	11	64 Å²	64	7%	0.067	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-31.5	176.7	175.8	0	0	0	0	111.5	V561 M562 K565 T664 K670 E671 S672	V561-V668 HydrophobicContact CG1-CG1 4.4Å; M562-V668 HydrophobicContact CB-CG1 4.47Å; M562-V668 HydrophobicContact CG-CB 4.5Å; M562-V668 HydrophobicContact CG-CG1 3.75Å; K565-V668 HydrophobicContact CB-CG2 4.16Å; K565-V668 HydrophobicContact CD-CG1 4.09Å; K565-V668 HydrophobicContact CD-CG2 3.52Å; K565-V668 HydrophobicContact CG-CG2 4.46Å; T664-V668 VanDerWaalsContact O-CB 3.25Å; T664-V668 WeakPolarHBondContact O-CB 3.48Å; T664-V668 WeakPolarHBondContact O-CG2 3.45Å; T664-V668 PolarHBondContact O-N 3.4Å; V668-K670 VanDerWaalsContact C-N 3.25Å; V668-K670 PolarHBondContact O-N 3.34Å; V668-E671 CarbonylContact O-C 3.27Å; V668-E671 PolarHBondContact O-N 3.44Å; V668-S672 WeakPolarHBondContact O-CA 3.43Å; V668-S672 VanDerWaalsContact O-CB 3.26Å; V668-S672 WeakPolarHBondContact O-CB 3.45Å; V668-S672 PolarHBondContact O-N 3.44Å
669	S	86.6	Confident	88.3	Confident	59 Å²	59	59.2 Å²	59.2	41%	0.413	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-35.7	177.2	76.8	0	0	0	0	113.1	V665 E666 N667 E671 S672	V665-S669 WeakPolarHBondContact O-CB 3.37Å; V665-S669 PolarHBondContact O-N 2.88Å; E666-S669 PolarHBondContact O-N 3.05Å; E666-S669 PolarHBondContact O-OG 3.02Å; N667-S669 VanDerWaalsContact C-N 3.33Å; N667-S669 PolarHBondContact O-N 3.42Å; S669-E671 VanDerWaalsContact C-N 3.28Å; S669-E671 PolarHBondContact O-N 3.27Å; S669-S672 PolarHBondContact O-OG 2.82Å; S669-S672 VanDerWaalsContact O-OG 3.1Å
670	K	87.3	Confident	88.1	Confident	125 Å²	125	58 Å²	58	54%	0.543	29%	0.289	S	S	.	.	H	α-helix	trans	-70.4	-24.2	177.9	-61.2	164.3	-168.9	163.7	0	112.4	E666 N667 V668	E666-K670 WeakPolarHBondContact OE1-CE 3.3Å; E666-K670 IonicContact OE1-NZ 2.65Å; E666-K670 PolarHBondContact OE1-NZ 3.19Å; N667-K670 PolarHBondContact O-N 3.02Å; V668-K670 VanDerWaalsContact C-N 3.25Å; V668-K670 PolarHBondContact O-N 3.34Å
671	E	84.3	Confident	88.1	Confident	66 Å²	66	54.8 Å²	54.8	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-105.4	-19.3	-177.8	-155.4	-159	165.4	0	0	113.2	K565 V668 S669 E673 R674 I675	K565-E671 IonicContact NZ-OE1 3.3Å; K565-E671 IonicContact NZ-OE2 3.49Å; K565-E671 PolarHBondContact NZ-OE2 2.92Å; V668-E671 CarbonylContact O-C 3.27Å; V668-E671 PolarHBondContact O-N 3.44Å; S669-E671 VanDerWaalsContact C-N 3.28Å; S669-E671 PolarHBondContact O-N 3.27Å; E671-E673 VanDerWaalsContact C-N 3.29Å; E671-E673 PolarHBondContact O-N 3.23Å; E671-E673 VanDerWaalsContact O-N 3.15Å; E671-R674 VanDerWaalsContact O-CB 3.26Å; E671-R674 WeakPolarHBondContact O-CB 3.36Å; E671-R674 PolarHBondContact O-N 2.99Å; E671-I675 HydrophobicContact CB-CD1 4.36Å; E671-I675 HydrophobicContact CG-CD1 4.04Å; E671-I675 HydrophobicContact CG-CG1 4.26Å; E671-I675 PolarHBondContact O-N 2.88Å
672	S	83.1	Confident	87.9	Confident	5 Å²	5	53.5 Å²	53.5	4%	0.035	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-35.5	-164.6	57.7	0	0	0	0	113.3	V668 S669 R674 W676	V668-S672 WeakPolarHBondContact O-CA 3.43Å; V668-S672 VanDerWaalsContact O-CB 3.26Å; V668-S672 WeakPolarHBondContact O-CB 3.45Å; V668-S672 PolarHBondContact O-N 3.44Å; S669-S672 PolarHBondContact O-OG 2.82Å; S669-S672 VanDerWaalsContact O-OG 3.1Å; S672-R674 VanDerWaalsContact C-N 3.32Å; S672-R674 PolarHBondContact O-N 3.44Å; S672-W676 VanDerWaalsContact O-CB 3.23Å; S672-W676 WeakPolarHBondContact O-CB 3.21Å; S672-W676 PolarHBondContact O-N 2.91Å
673	E	85.3	Confident	87.8	Confident	69 Å²	69	51.8 Å²	51.8	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-38.6	176.6	-159.7	-159.5	170.2	0	0	111.9	M558 E671 W676 R677	M558-E673 HydrophobicContact SD-CB 4.42Å; E671-E673 VanDerWaalsContact C-N 3.29Å; E671-E673 PolarHBondContact O-N 3.23Å; E671-E673 VanDerWaalsContact O-N 3.15Å; E673-W676 HydrophobicContact CG-CE3 4.23Å; E673-W676 PolarHBondContact O-N 2.94Å; E673-R677 WeakPolarHBondContact O-CB 3.29Å; E673-R677 WeakPolarHBondContact O-CG 3.46Å; E673-R677 PolarHBondContact O-N 2.87Å; E673-R677 IonicContact OE1-CZ 2.9Å; E673-R677 IonicContact OE1-NE 2.71Å; E673-R677 PolarHBondContact OE1-NE 3.03Å; E673-R677 IonicContact OE1-NH2 3.27Å; E673-R677 PolarHBondContact OE1-NH2 3.22Å; E673-R677 IonicContact OE2-NH2 3.85Å
674	R	84.4	Confident	87.8	Confident	124 Å²	124	46 Å²	46	47%	0.468	22%	0.218	S	C	.	.	H	α-helix	trans	-65.6	-47.4	-180	-63.3	167.1	-176.6	-152.4	12.2	110.4	H401 E671 S672 R677 L678	H401-R674 HydrophobicContact CB-CB 3.72Å; H401-R674 HydrophobicContact CB-CG 4.31Å; H401-R674 VanDerWaalsContact CD2-CD 3.49Å; H401-R674 WeakPolarHBondContact CD2-CD 3.38Å; H401-R674 PolarHBondContact NE2-NH1 3.01Å; E671-R674 VanDerWaalsContact O-CB 3.26Å; E671-R674 WeakPolarHBondContact O-CB 3.36Å; E671-R674 PolarHBondContact O-N 2.99Å; S672-R674 VanDerWaalsContact C-N 3.32Å; S672-R674 PolarHBondContact O-N 3.44Å; R674-R677 PolarHBondContact O-N 3.29Å; R674-L678 PolarHBondContact O-N 2.72Å; R674-L678 VanDerWaalsContact O-N 3.09Å
675	I	83.5	Confident	87.7	Confident	24 Å²	24	45 Å²	45	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-43.5	177	-59.6	163.2	0	0	0	110.6	V561 K565 E671 R677 L678 Q679	V561-I675 HydrophobicContact CG1-CB 4.03Å; V561-I675 HydrophobicContact CG1-CD1 3.83Å; V561-I675 HydrophobicContact CG1-CG2 3.71Å; V561-I675 HydrophobicContact CG2-CB 4.49Å; V561-I675 HydrophobicContact CG2-CG2 3.9Å; K565-I675 HydrophobicContact CD-CD1 4.35Å; E671-I675 HydrophobicContact CB-CD1 4.36Å; E671-I675 HydrophobicContact CG-CD1 4.04Å; E671-I675 HydrophobicContact CG-CG1 4.26Å; E671-I675 PolarHBondContact O-N 2.88Å; I675-R677 PolarHBondContact O-N 3.42Å; I675-L678 WeakPolarHBondContact O-CB 3.39Å; I675-L678 PolarHBondContact O-N 3.35Å; I675-Q679 HydrophobicContact CG2-CG 4.38Å; I675-Q679 WeakPolarHBondContact O-CG 3.25Å; I675-Q679 PolarHBondContact O-N 3.12Å
676	W	87.9	Confident	87.5	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.027	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-43.9	176.6	168.1	68	0	0	0	112.1	R551 Q554 S672 E673 L678 Q679 R680	R551-W676 PolarHBondContact O-NE1 2.81Å; Q554-W676 VanDerWaalsContact CA-CZ2 3.47Å; Q554-W676 HydrophobicContact CB-CH2 3.51Å; Q554-W676 HydrophobicContact CB-CZ2 3.74Å; Q554-W676 HydrophobicContact CB-CZ3 3.95Å; Q554-W676 HydrophobicContact CG-CE3 4.02Å; Q554-W676 HydrophobicContact CG-CH2 3.72Å; Q554-W676 HydrophobicContact CG-CZ2 4.28Å; Q554-W676 HydrophobicContact CG-CZ3 3.58Å; S672-W676 VanDerWaalsContact O-CB 3.23Å; S672-W676 WeakPolarHBondContact O-CB 3.21Å; S672-W676 PolarHBondContact O-N 2.91Å; E673-W676 HydrophobicContact CG-CE3 4.23Å; E673-W676 PolarHBondContact O-N 2.94Å; W676-L678 VanDerWaalsContact C-N 3.33Å; W676-L678 PolarHBondContact O-N 3.35Å; W676-Q679 PolarHBondContact O-N 3.33Å; W676-R680 WeakPolarHBondContact O-CB 3.04Å; W676-R680 PolarHBondContact O-N 3.24Å
677	R	87.1	Confident	87.5	Confident	82 Å²	82	39.8 Å²	39.8	31%	0.309	18%	0.184	S	C	.	.	H	α-helix	trans	-59.4	-42.1	174.6	-73.7	168.3	178.4	-146.4	5.3	111.6	E673 R674 I675 R680 A681	E673-R677 WeakPolarHBondContact O-CB 3.29Å; E673-R677 WeakPolarHBondContact O-CG 3.46Å; E673-R677 PolarHBondContact O-N 2.87Å; E673-R677 IonicContact OE1-CZ 2.9Å; E673-R677 IonicContact OE1-NE 2.71Å; E673-R677 PolarHBondContact OE1-NE 3.03Å; E673-R677 IonicContact OE1-NH2 3.27Å; E673-R677 PolarHBondContact OE1-NH2 3.22Å; E673-R677 IonicContact OE2-NH2 3.85Å; R674-R677 PolarHBondContact O-N 3.29Å; I675-R677 PolarHBondContact O-N 3.42Å; R677-R680 PolarHBondContact O-N 3.38Å; R677-A681 WeakPolarHBondContact O-CB 3.45Å; R677-A681 PolarHBondContact O-N 3.33Å
678	L	87.8	Confident	87.6	Confident	17 Å²	17	36.9 Å²	36.9	9%	0.089	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-47.3	175.5	175.9	63	0	0	0	112.2	V392 L404 R674 I675 W676 R680 A681 R682	V392-L678 HydrophobicContact CG1-CD1 4.48Å; L404-L678 HydrophobicContact CD1-CB 4.34Å; L404-L678 HydrophobicContact CD1-CD1 3.57Å; R674-L678 PolarHBondContact O-N 2.72Å; R674-L678 VanDerWaalsContact O-N 3.09Å; I675-L678 WeakPolarHBondContact O-CB 3.39Å; I675-L678 PolarHBondContact O-N 3.35Å; W676-L678 VanDerWaalsContact C-N 3.33Å; W676-L678 PolarHBondContact O-N 3.35Å; L678-R680 VanDerWaalsContact C-N 3.3Å; L678-R680 PolarHBondContact O-N 3.43Å; L678-A681 WeakPolarHBondContact O-CB 3.02Å; L678-A681 PolarHBondContact O-N 2.88Å; L678-A681 VanDerWaalsContact O-N 3.15Å; L678-R682 PolarHBondContact O-N 3.36Å
679	Q	85.9	Confident	87.6	Confident	13 Å²	13	41.2 Å²	41.2	6%	0.061	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-41.6	175.4	-71.8	-175.8	-0.7	0	0	111.4	I675 W676 R682 T683	I675-Q679 HydrophobicContact CG2-CG 4.38Å; I675-Q679 WeakPolarHBondContact O-CG 3.25Å; I675-Q679 PolarHBondContact O-N 3.12Å; W676-Q679 PolarHBondContact O-N 3.33Å; Q679-R682 PolarHBondContact O-N 3.45Å; Q679-T683 PolarHBondContact O-N 3.07Å
680	R	89.7	Confident	87.6	Confident	42 Å²	42	43.8 Å²	43.8	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-44.3	174.7	-166.7	177.9	70.2	-177.6	2.3	111.5	W417 W676 R677 L678 R682 T683 I684	W417-R680 HydrophobicContact CE3-CG 4.23Å; W417-R680 HydrophobicContact CZ3-CG 4.21Å; W676-R680 WeakPolarHBondContact O-CB 3.04Å; W676-R680 PolarHBondContact O-N 3.24Å; R677-R680 PolarHBondContact O-N 3.38Å; L678-R680 VanDerWaalsContact C-N 3.3Å; L678-R680 PolarHBondContact O-N 3.43Å; R680-R682 VanDerWaalsContact C-N 3.32Å; R680-R682 PolarHBondContact O-N 3.39Å; R680-T683 PolarHBondContact O-N 2.9Å; R680-T683 PolarHBondContact O-OG1 3.49Å; R680-I684 HydrophobicContact CG-CD1 4.27Å; R680-I684 WeakPolarHBondContact O-CG1 3.3Å; R680-I684 PolarHBondContact O-N 3.33Å
681	A	90.5	Very high	87.6	Confident	2 Å²	2	38.4 Å²	38.4	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-57.2	-44.5	175.7	0	0	0	0	0	112	V392 L404 L413 R677 L678 I684 L685	V392-A681 HydrophobicContact CG1-CB 4.38Å; V392-A681 HydrophobicContact CG2-CB 3.96Å; L404-A681 HydrophobicContact CD1-CB 4.16Å; L413-A681 HydrophobicContact CD1-CB 3.68Å; L413-A681 HydrophobicContact CD2-CB 4.03Å; R677-A681 WeakPolarHBondContact O-CB 3.45Å; R677-A681 PolarHBondContact O-N 3.33Å; L678-A681 WeakPolarHBondContact O-CB 3.02Å; L678-A681 PolarHBondContact O-N 2.88Å; L678-A681 VanDerWaalsContact O-N 3.15Å; A681-I684 WeakPolarHBondContact O-CB 3.49Å; A681-I684 PolarHBondContact O-N 2.96Å; A681-L685 PolarHBondContact O-N 2.89Å; A681-L685 VanDerWaalsContact O-N 3.1Å
682	R	88.7	Confident	87.8	Confident	39 Å²	39	38.1 Å²	38.1	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-48.1	174.8	179.9	170	170	161.4	-5.7	112.5	V392 Y393 H507 L678 Q679 R680 I684 L685 E686	V392-R682 HydrophobicContact CG1-CB 3.79Å; Y393-R682 HydrophobicContact CE1-CG 4.32Å; H507-R682 PolarHBondContact NE2-NH2 3.05Å; H507-R682 VanDerWaalsContact NE2-NH2 3.13Å; L678-R682 PolarHBondContact O-N 3.36Å; Q679-R682 PolarHBondContact O-N 3.45Å; R680-R682 VanDerWaalsContact C-N 3.32Å; R680-R682 PolarHBondContact O-N 3.39Å; R682-I684 VanDerWaalsContact C-N 3.28Å; R682-I684 PolarHBondContact O-N 3.41Å; R682-L685 PolarHBondContact O-N 2.99Å; R682-L685 VanDerWaalsContact O-N 3.14Å; R682-E686 HydrophobicContact CG-CG 4.41Å; R682-E686 VanDerWaalsContact CG-OE1 3.29Å; R682-E686 WeakPolarHBondContact CG-OE1 3.5Å; R682-E686 IonicContact CZ-OE1 3.99Å; R682-E686 IonicContact NE-OE1 2.72Å; R682-E686 PolarHBondContact NE-OE1 3.28Å; R682-E686 IonicContact NH2-OE1 3.04Å; R682-E686 WeakPolarHBondContact O-CG 3.26Å; R682-E686 PolarHBondContact O-N 3.49Å
683	T	88.9	Confident	87.8	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-34.5	177.1	62	0	0	0	0	113.1	Q679 R680 E686 F687	Q679-T683 PolarHBondContact O-N 3.07Å; R680-T683 PolarHBondContact O-N 2.9Å; R680-T683 PolarHBondContact O-OG1 3.49Å; T683-E686 PolarHBondContact O-N 3.2Å; T683-F687 WeakPolarHBondContact O-CD2 3.38Å; T683-F687 WeakPolarHBondContact O-CG 3.29Å; T683-F687 PolarHBondContact O-N 3.47Å
684	I	92.4	Very high	87.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-46.7	175	-68.3	161.3	0	0	0	110.3	L413 K416 W417 F420 A421 R680 A681 R682 F687 E688	L413-I684 HydrophobicContact CD2-CB 4.46Å; L413-I684 HydrophobicContact CD2-CD1 4.2Å; L413-I684 HydrophobicContact CD2-CG2 4.26Å; K416-I684 HydrophobicContact CB-CG2 3.79Å; K416-I684 HydrophobicContact CD-CG2 4.27Å; W417-I684 HydrophobicContact CB-CD1 4.01Å; W417-I684 HydrophobicContact CE3-CD1 4.03Å; W417-I684 HydrophobicContact CE3-CG1 3.79Å; W417-I684 HydrophobicContact CZ3-CG1 4.48Å; F420-I684 HydrophobicContact CZ-CG2 4.44Å; A421-I684 HydrophobicContact CB-CB 4.48Å; A421-I684 HydrophobicContact CB-CG1 3.95Å; A421-I684 HydrophobicContact CB-CG2 4.44Å; R680-I684 HydrophobicContact CG-CD1 4.27Å; R680-I684 WeakPolarHBondContact O-CG1 3.3Å; R680-I684 PolarHBondContact O-N 3.33Å; A681-I684 WeakPolarHBondContact O-CB 3.49Å; A681-I684 PolarHBondContact O-N 2.96Å; R682-I684 VanDerWaalsContact C-N 3.28Å; R682-I684 PolarHBondContact O-N 3.41Å; I684-F687 PolarHBondContact O-N 3.15Å; I684-E688 WeakPolarHBondContact O-CB 3.12Å; I684-E688 PolarHBondContact O-N 2.86Å
685	L	90.2	Very high	87.9	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-36.6	178.2	-65.1	-174.2	0	0	0	112.8	T381 L388 V392 Y393 A681 R682 E688 K689	T381-L685 HydrophobicContact CG2-CD2 3.65Å; L388-L685 HydrophobicContact CD2-CD2 3.96Å; L388-L685 HydrophobicContact CG-CD1 4.49Å; L388-L685 HydrophobicContact CG-CD2 4.15Å; V392-L685 HydrophobicContact CB-CD1 3.61Å; V392-L685 HydrophobicContact CG1-CD1 3.76Å; V392-L685 HydrophobicContact CG2-CD1 3.87Å; Y393-L685 HydrophobicContact CD2-CD1 4.25Å; Y393-L685 HydrophobicContact CE2-CB 4.01Å; Y393-L685 HydrophobicContact CE2-CD1 3.76Å; A681-L685 PolarHBondContact O-N 2.89Å; A681-L685 VanDerWaalsContact O-N 3.1Å; R682-L685 PolarHBondContact O-N 2.99Å; R682-L685 VanDerWaalsContact O-N 3.14Å; L685-E688 PolarHBondContact O-N 2.83Å; L685-K689 WeakPolarHBondContact O-CB 3.35Å; L685-K689 WeakPolarHBondContact O-CG 3.42Å; L685-K689 PolarHBondContact O-N 3.45Å
686	E	87.9	Confident	87.9	Confident	38 Å²	38	49.5 Å²	49.5	18%	0.178	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-46.5	174.7	-73.3	176	-166.2	0	0	111.1	H507 R682 T683 E688 K689 M690	H507-E686 IonicContact NE2-OE1 3.09Å; R682-E686 HydrophobicContact CG-CG 4.41Å; R682-E686 VanDerWaalsContact CG-OE1 3.29Å; R682-E686 WeakPolarHBondContact CG-OE1 3.5Å; R682-E686 IonicContact CZ-OE1 3.99Å; R682-E686 IonicContact NE-OE1 2.72Å; R682-E686 PolarHBondContact NE-OE1 3.28Å; R682-E686 IonicContact NH2-OE1 3.04Å; R682-E686 WeakPolarHBondContact O-CG 3.26Å; R682-E686 PolarHBondContact O-N 3.49Å; T683-E686 PolarHBondContact O-N 3.2Å; E686-E688 VanDerWaalsContact C-N 3.31Å; E686-E688 PolarHBondContact O-N 3.12Å; E686-K689 PolarHBondContact O-N 2.96Å; E686-M690 WeakPolarHBondContact O-CG 3.33Å; E686-M690 PolarHBondContact O-N 2.92Å
687	F	90.1	Very high	87.5	Confident	20 Å²	20	52.3 Å²	52.3	9%	0.088	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-37.2	173.5	-68.8	-48.1	0	0	0	112.7	F420 A421 M424 F425 T683 I684 M690 L691	F420-F687 HydrophobicContact CE2-CB 4.33Å; A421-F687 HydrophobicContact CB-CD2 4.24Å; M424-F687 HydrophobicContact CB-CD1 4.15Å; M424-F687 HydrophobicContact CB-CD2 4.47Å; M424-F687 HydrophobicContact CB-CE1 4.49Å; M424-F687 HydrophobicContact CB-CG 4.15Å; M424-F687 HydrophobicContact CE-CB 3.91Å; M424-F687 HydrophobicContact CE-CD1 4.02Å; M424-F687 HydrophobicContact CE-CG 4.28Å; M424-F687 HydrophobicContact SD-CB 4.09Å; F425-F687 HydrophobicContact CB-CE2 3.78Å; F425-F687 HydrophobicContact CB-CZ 4.08Å; F425-F687 AromaticContact CD2-CE2 3.84Å; F425-F687 HydrophobicContact CD2-CE2 3.84Å; F425-F687 AromaticContact CD2-CZ 3.96Å; F425-F687 HydrophobicContact CD2-CZ 3.96Å; F425-F687 HydrophobicContact CG-CE2 4.33Å; T683-F687 WeakPolarHBondContact O-CD2 3.38Å; T683-F687 WeakPolarHBondContact O-CG 3.29Å; T683-F687 PolarHBondContact O-N 3.47Å; I684-F687 PolarHBondContact O-N 3.15Å; F687-M690 HydrophobicContact CD1-SD 4.39Å; F687-M690 WeakPolarHBondContact O-CB 3.49Å; F687-M690 PolarHBondContact O-N 3.46Å; F687-M690 VanDerWaalsContact O-N 3.15Å; F687-L691 PolarHBondContact O-N 3Å
688	E	90.6	Very high	87.3	Confident	21 Å²	21	57.9 Å²	57.9	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-40	176.1	-169.6	166.3	-176.5	0	0	112.2	T381 K416 F420 I684 L685 E686 M690 L691 R696	T381-E688 PolarHBondContact OG1-OE1 3.46Å; T381-E688 PolarHBondContact OG1-OE2 3.09Å; K416-E688 WeakPolarHBondContact CD-OE2 3.4Å; K416-E688 WeakPolarHBondContact CE-OE2 3.34Å; K416-E688 VanDerWaalsContact NZ-CD 3.29Å; K416-E688 IonicContact NZ-OE1 2.89Å; K416-E688 PolarHBondContact NZ-OE1 2.8Å; K416-E688 IonicContact NZ-OE2 3.25Å; K416-E688 PolarHBondContact NZ-OE2 3.31Å; F420-E688 HydrophobicContact CE2-CB 4.3Å; F420-E688 HydrophobicContact CZ-CB 4Å; F420-E688 HydrophobicContact CZ-CG 4.28Å; I684-E688 WeakPolarHBondContact O-CB 3.12Å; I684-E688 PolarHBondContact O-N 2.86Å; L685-E688 PolarHBondContact O-N 2.83Å; E686-E688 VanDerWaalsContact C-N 3.31Å; E686-E688 PolarHBondContact O-N 3.12Å; E688-M690 VanDerWaalsContact C-N 3.26Å; E688-M690 PolarHBondContact O-N 3.34Å; E688-L691 WeakPolarHBondContact O-CB 3.37Å; E688-L691 PolarHBondContact O-N 3.15Å; E688-L691 VanDerWaalsContact O-N 3.08Å; E688-R696 PolarHBondContact O-NE 3.25Å; E688-R696 PolarHBondContact O-NH2 2.78Å
689	K	87.8	Confident	86.9	Confident	102 Å²	102	59.6 Å²	59.6	44%	0.443	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-32	171.4	-75.3	178.2	177.1	-175.3	0	112.2	E389 Y393 L685 E686 L691 R696	E389-K689 WeakPolarHBondContact OE1-CE 3.48Å; E389-K689 IonicContact OE1-NZ 3.5Å; E389-K689 PolarHBondContact OE1-NZ 3.38Å; Y393-K689 VanDerWaalsContact CE2-NZ 3.34Å; L685-K689 WeakPolarHBondContact O-CB 3.35Å; L685-K689 WeakPolarHBondContact O-CG 3.42Å; L685-K689 PolarHBondContact O-N 3.45Å; E686-K689 PolarHBondContact O-N 2.96Å; K689-L691 VanDerWaalsContact C-N 3.33Å; K689-L691 PolarHBondContact O-N 2.94Å; K689-R696 PolarHBondContact O-NH2 3.36Å
690	M	86.4	Confident	86.5	Confident	113 Å²	113	65.8 Å²	65.8	56%	0.557	29%	0.292	S	S	*	.	H	α-helix	trans	-74.3	-15.1	173.5	-64.9	-180	78.3	0	0	114.4	K484 E686 F687 E688	K484-M690 HydrophobicContact CD-CE 4Å; K484-M690 HydrophobicContact CD-SD 4.44Å; E686-M690 WeakPolarHBondContact O-CG 3.33Å; E686-M690 PolarHBondContact O-N 2.92Å; F687-M690 HydrophobicContact CD1-SD 4.39Å; F687-M690 WeakPolarHBondContact O-CB 3.49Å; F687-M690 PolarHBondContact O-N 3.46Å; F687-M690 VanDerWaalsContact O-N 3.15Å; E688-M690 VanDerWaalsContact C-N 3.26Å; E688-M690 PolarHBondContact O-N 3.34Å
691	L	87.1	Confident	86	Confident	12 Å²	12	64.4 Å²	64.4	6%	0.063	29%	0.287	C	S	.	.	S	Bend	trans	-75.3	135	177.3	-68.8	174	0	0	0	111.7	F420 M424 F687 E688 K689 L695 R696 F699	F420-L691 HydrophobicContact CD2-CD1 3.93Å; F420-L691 HydrophobicContact CE2-CD1 3.9Å; F420-L691 HydrophobicContact CG-CD1 4.36Å; F420-L691 HydrophobicContact CZ-CD1 4.29Å; M424-L691 HydrophobicContact CE-CD2 4.09Å; M424-L691 HydrophobicContact CE-CG 4.48Å; M424-L691 HydrophobicContact SD-CD2 3.67Å; M424-L691 HydrophobicContact SD-CG 4.18Å; F687-L691 PolarHBondContact O-N 3Å; E688-L691 WeakPolarHBondContact O-CB 3.37Å; E688-L691 PolarHBondContact O-N 3.15Å; E688-L691 VanDerWaalsContact O-N 3.08Å; K689-L691 VanDerWaalsContact C-N 3.33Å; K689-L691 PolarHBondContact O-N 2.94Å; L691-L695 HydrophobicContact CD2-CD2 3.68Å; L691-L695 HydrophobicContact CD2-CG 4.03Å; L691-R696 HydrophobicContact CB-CG 3.75Å; L691-R696 HydrophobicContact CD1-CG 4.5Å; L691-R696 PolarHBondContact O-NE 2.88Å; L691-R696 PolarHBondContact O-NH2 3.37Å; L691-R696 VanDerWaalsContact O-NH2 3.15Å; L691-F699 HydrophobicContact CD1-CD2 4.07Å
692	P	87.8	Confident	85.4	Confident	60 Å²	60	66 Å²	66	39%	0.39	30%	0.303	S	S	.	.			trans	-62.8	154.2	167.2	-23.3	34.5	0	0	0	113.1	W694 L695 R696	P692-W694 VanDerWaalsContact C-N 3.35Å; P692-W694 HydrophobicContact CB-CG 4.37Å; P692-W694 VanDerWaalsContact CB-NE1 3.31Å; P692-W694 HydrophobicContact CG-CZ2 4.45Å; P692-W694 PolarHBondContact O-N 2.97Å; P692-L695 WeakPolarHBondContact O-CA 3.45Å; P692-L695 WeakPolarHBondContact O-CB 3.45Å; P692-L695 PolarHBondContact O-N 2.87Å; P692-R696 PolarHBondContact O-N 2.89Å
693	E	84.5	Confident	85.1	Confident	165 Å²	165	68.7 Å²	68.7	77%	0.771	32%	0.318	S	S	*	.	H	α-helix	trans	-55.9	-42.3	-176.8	-63.7	175.6	-178.6	0	0	113.9	L695 R696 S697	E693-L695 PolarHBondContact O-N 3.35Å; E693-R696 PolarHBondContact O-N 3.35Å; E693-S697 PolarHBondContact O-N 3.11Å
694	W	85.9	Confident	84.8	Confident	172 Å²	172	73.7 Å²	73.7	65%	0.652	34%	0.344	S	S	*	.	H	α-helix	trans	-63.8	-24.4	177.3	64.8	-99	0	0	0	113.4	P692 S697	P692-W694 VanDerWaalsContact C-N 3.35Å; P692-W694 HydrophobicContact CB-CG 4.37Å; P692-W694 VanDerWaalsContact CB-NE1 3.31Å; P692-W694 HydrophobicContact CG-CZ2 4.45Å; P692-W694 PolarHBondContact O-N 2.97Å; W694-S697 PolarHBondContact O-OG 2.93Å
695	L	85.6	Confident	84.2	Confident	36 Å²	36	74.1 Å²	74.1	19%	0.188	35%	0.347	C	S	.	.	H	α-helix	trans	-91.4	-35.7	178.4	-168.2	49.8	0	0	0	110.6	L691 P692 E693 R698 F699	L691-L695 HydrophobicContact CD2-CD2 3.68Å; L691-L695 HydrophobicContact CD2-CG 4.03Å; P692-L695 WeakPolarHBondContact O-CA 3.45Å; P692-L695 WeakPolarHBondContact O-CB 3.45Å; P692-L695 PolarHBondContact O-N 2.87Å; E693-L695 PolarHBondContact O-N 3.35Å; L695-R698 PolarHBondContact O-N 2.64Å; L695-F699 HydrophobicContact CD1-CD2 3.79Å; L695-F699 HydrophobicContact CD1-CE2 3.33Å; L695-F699 HydrophobicContact CD1-CZ 3.98Å; L695-F699 HydrophobicContact CD2-CE2 4.15Å; L695-F699 HydrophobicContact CG-CD2 3.77Å; L695-F699 HydrophobicContact CG-CE2 3.52Å; L695-F699 VanDerWaalsContact O-CD2 3.25Å; L695-F699 WeakPolarHBondContact O-CD2 3.37Å; L695-F699 PolarHBondContact O-N 2.86Å
696	R	83.1	Confident	83.7	Confident	89 Å²	89	78.4 Å²	78.4	34%	0.336	37%	0.365	S	S	.	.	H	α-helix	trans	-59.3	-45.3	168.9	-65.3	-171.2	-161.3	169.5	9.7	111.7	E688 K689 L691 P692 E693 R698 F699 R700	E688-R696 PolarHBondContact O-NE 3.25Å; E688-R696 PolarHBondContact O-NH2 2.78Å; K689-R696 PolarHBondContact O-NH2 3.36Å; L691-R696 HydrophobicContact CB-CG 3.75Å; L691-R696 HydrophobicContact CD1-CG 4.5Å; L691-R696 PolarHBondContact O-NE 2.88Å; L691-R696 PolarHBondContact O-NH2 3.37Å; L691-R696 VanDerWaalsContact O-NH2 3.15Å; P692-R696 PolarHBondContact O-N 2.89Å; E693-R696 PolarHBondContact O-N 3.35Å; R696-R698 VanDerWaalsContact C-N 3.29Å; R696-R698 PolarHBondContact O-N 2.97Å; R696-F699 CarbonylContact O-C 3.5Å; R696-F699 PolarHBondContact O-N 3.46Å; R696-R700 WeakPolarHBondContact O-CG 3.44Å; R696-R700 PolarHBondContact O-N 3.16Å
697	S	79.8	Confident	82.9	Confident	66 Å²	66	77.2 Å²	77.2	46%	0.462	36%	0.361	S	S	.	.	H	α-helix	trans	-58.9	-39.3	179	67	0	0	0	0	112.5	E693 W694	E693-S697 PolarHBondContact O-N 3.11Å; W694-S697 PolarHBondContact O-OG 2.93Å
698	R	82.1	Confident	82	Confident	198 Å²	198	78.3 Å²	78.3	75%	0.747	37%	0.373	S	S	*	.	H	α-helix	trans	-71.5	-29.1	174.4	-168.8	176.6	-175.8	-178.4	1.7	113.5	L695 R696	L695-R698 PolarHBondContact O-N 2.64Å; R696-R698 VanDerWaalsContact C-N 3.29Å; R696-R698 PolarHBondContact O-N 2.97Å
699	F	80	Confident	81	Confident	53 Å²	53	85 Å²	85	23%	0.232	41%	0.405	C	S	.	.	H	α-helix	trans	-90.7	-7.9	178.9	-73.4	-48.1	0	0	0	115.2	K419 F420 L691 L695 R696	K419-F699 HydrophobicContact CD-CD1 4.08Å; K419-F699 HydrophobicContact CG-CD1 4Å; K419-F699 HydrophobicContact CG-CE1 4.32Å; K419-F699 PolarHBondContact NZ-O 2.96Å; F420-F699 HydrophobicContact CB-CD2 4.34Å; F420-F699 HydrophobicContact CB-CE1 4.39Å; F420-F699 HydrophobicContact CB-CE2 4.09Å; F420-F699 HydrophobicContact CB-CZ 4.15Å; F420-F699 HydrophobicContact CD1-CG 4.48Å; L691-F699 HydrophobicContact CD1-CD2 4.07Å; L695-F699 HydrophobicContact CD1-CD2 3.79Å; L695-F699 HydrophobicContact CD1-CE2 3.33Å; L695-F699 HydrophobicContact CD1-CZ 3.98Å; L695-F699 HydrophobicContact CD2-CE2 4.15Å; L695-F699 HydrophobicContact CG-CD2 3.77Å; L695-F699 HydrophobicContact CG-CE2 3.52Å; L695-F699 VanDerWaalsContact O-CD2 3.25Å; L695-F699 WeakPolarHBondContact O-CD2 3.37Å; L695-F699 PolarHBondContact O-N 2.86Å; R696-F699 CarbonylContact O-C 3.5Å; R696-F699 PolarHBondContact O-N 3.46Å
700	R	77.7	Confident	80.2	Confident	144 Å²	144	87.1 Å²	87.1	54%	0.543	42%	0.421	S	S	.	.			trans	-41.8	142.5	172.3	-74.9	-176.5	-174.9	-172.9	1.9	111.9	T382 K419 R696	T382-R700 HydrophobicContact CG2-CG 4.27Å; K419-R700 PolarHBondContact NZ-O 2.98Å; R696-R700 WeakPolarHBondContact O-CG 3.44Å; R696-R700 PolarHBondContact O-N 3.16Å
701	M	79.1	Confident	79.8	Confident	12 Å²	12	84.1 Å²	84.1	6%	0.059	41%	0.407	C	S	.	.			trans	-108.9	159.9	180	-58.5	-64.3	-161.8	0	0	109.8	L412 M415 K416 K419	L412-M701 HydrophobicContact CD1-CB 3.97Å; L412-M701 HydrophobicContact CD1-CG 4.09Å; M415-M701 HydrophobicContact CB-CE 3.7Å; M415-M701 HydrophobicContact CB-SD 4.34Å; M415-M701 HydrophobicContact CE-SD 4.1Å; M415-M701 WeakPolarHBondContact O-CE 3.45Å; K416-M701 HydrophobicContact CG-CE 4.07Å; K419-M701 HydrophobicContact CB-CE 3.81Å; K419-M701 HydrophobicContact CD-CE 3.34Å; K419-M701 HydrophobicContact CD-SD 3.63Å; K419-M701 HydrophobicContact CG-CE 4.24Å; K419-M701 PolarHBondContact NZ-SD 3.17Å; K419-M701 VanDerWaalsContact NZ-SD 3.44Å
702	G	77.6	Confident	79.6	Confident	35 Å²	35	89 Å²	89	36%	0.361	43%	0.428	S	S	.	.			trans	96.9	161.1	-179.9	0	0	0	0	0	114.1	C715	G702-C715 CarbonylContact C-O 3.56Å; G702-C715 WeakPolarHBondContact CA-O 3.25Å
703	E	82.2	Confident	79.4	Confident	97 Å²	97	87.1 Å²	87.1	45%	0.453	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.2	179.5	-62.9	176.5	162.6	0	0	108.3	C705 C715 R717	E703-C705 PolarHBondContact O-N 3.43Å; E703-C705 PolarHBondContact O-SG 3.17Å; E703-C715 PolarHBondContact N-O 3.34Å; E703-C715 PolarHBondContact O-N 3.49Å; E703-R717 IonicContact OE2-CZ 2.74Å; E703-R717 IonicContact OE2-NE 2.68Å; E703-R717 PolarHBondContact OE2-NE 3.15Å; E703-R717 IonicContact OE2-NH2 2.68Å; E703-R717 PolarHBondContact OE2-NH2 3.19Å
704	L	82.9	Confident	79.6	Confident	110 Å²	110	82.6 Å²	82.6	58%	0.576	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	110.1	176.1	-168.5	75.2	0	0	0	109.4	F712 L714	L704-F712 HydrophobicContact CD1-CB 4.08Å; L704-F712 HydrophobicContact CD2-CB 4.37Å; L704-F712 HydrophobicContact CD2-CD1 4.06Å; L704-F712 HydrophobicContact CG-CB 4.23Å; L704-F712 HydrophobicContact CG-CD1 4.26Å; L704-L714 HydrophobicContact CD1-CD2 4.45Å
705	C	79.9	Confident	79.8	Confident	11 Å²	11	74.4 Å²	74.4	7%	0.074	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	133	-176.8	-64.5	0	0	0	0	110.3	E703 F712 R713 C715	E703-C705 PolarHBondContact O-N 3.43Å; E703-C705 PolarHBondContact O-SG 3.17Å; C705-F712 WeakPolarHBondContact O-CA 3.44Å; C705-R713 PolarHBondContact N-O 3.04Å; C705-R713 PolarHBondContact O-N 3.48Å; C705-C715 HydrophobicContact CB-CB 4.06Å
706	K	79.6	Confident	80	Confident	92 Å²	92	72.9 Å²	72.9	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.6	172.8	-174.1	171.7	-175.7	165.3	0	108.3	A708 E709 F712	K706-A708 WeakPolarHBondContact CE-O 3.29Å; K706-A708 WeakPolarHBondContact CG-O 3.31Å; K706-E709 WeakPolarHBondContact CE-O 3Å; K706-E709 PolarHBondContact NZ-O 3.04Å; K706-F712 HydrophobicContact CB-CD1 4.01Å; K706-F712 HydrophobicContact CB-CE1 3.73Å; K706-F712 HydrophobicContact CB-CZ 4.44Å; K706-F712 HydrophobicContact CD-CE1 3.93Å; K706-F712 HydrophobicContact CD-CZ 3.8Å; K706-F712 HydrophobicContact CG-CD1 4.33Å; K706-F712 HydrophobicContact CG-CE1 3.86Å; K706-F712 HydrophobicContact CG-CZ 4.07Å
707	V	71.3	Confident	80.2	Confident	13 Å²	13	72 Å²	72	8%	0.079	35%	0.351	C	S	.	.			trans	-97.6	-42.7	-174.8	170	0	0	0	0	111.6	R355 F361 D711	R355-V707 HydrophobicContact CG-CG1 4.38Å; F361-V707 HydrophobicContact CD1-CG1 4.3Å; F361-V707 HydrophobicContact CD2-CG2 4.33Å; F361-V707 HydrophobicContact CE1-CB 4.31Å; F361-V707 HydrophobicContact CE1-CG1 3.34Å; F361-V707 HydrophobicContact CE1-CG2 4.04Å; F361-V707 HydrophobicContact CE2-CG1 4.42Å; F361-V707 HydrophobicContact CE2-CG2 3.75Å; F361-V707 HydrophobicContact CZ-CB 4.17Å; F361-V707 HydrophobicContact CZ-CG1 3.43Å; F361-V707 VanDerWaalsContact CZ-CG1 3.43Å; F361-V707 HydrophobicContact CZ-CG2 3.58Å; V707-D711 HydrophobicContact CB-CB 4.12Å; V707-D711 PolarHBondContact N-O 2.95Å
708	A	71.1	Confident	80.7	Confident	43 Å²	43	69.6 Å²	69.6	36%	0.355	33%	0.333	S	S	.	.	S	Bend	trans	-132.2	-170.9	173.6	0	0	0	0	0	109.4	K706 D710 D711	K706-A708 WeakPolarHBondContact CE-O 3.29Å; K706-A708 WeakPolarHBondContact CG-O 3.31Å; A708-D710 VanDerWaalsContact C-N 3.31Å; A708-D710 PolarHBondContact O-N 3Å; A708-D711 HydrophobicContact CB-CB 3.92Å
709	E	68.8	Low	80.9	Confident	162 Å²	162	65.4 Å²	65.4	76%	0.757	33%	0.326	S	S	*	.	S	Bend	trans	-62.6	-36.6	-176	-64.3	-168.6	158.9	0	0	113	K706	K706-E709 WeakPolarHBondContact CE-O 3Å; K706-E709 PolarHBondContact NZ-O 3.04Å
710	D	71.8	Confident	81	Confident	146 Å²	146	63.8 Å²	63.8	78%	0.781	32%	0.319	S	S	*	.	S	Bend	trans	-114.1	-12.2	177.7	-61.2	-47.4	0	0	0	114.3	A708 F712	A708-D710 VanDerWaalsContact C-N 3.31Å; A708-D710 PolarHBondContact O-N 3Å; D710-F712 PolarHBondContact O-N 3.03Å
711	D	77.2	Confident	81.4	Confident	51 Å²	51	60.9 Å²	60.9	27%	0.273	32%	0.317	S	S	.	.			trans	-80.9	107	-179.3	-87	33.7	0	0	0	112.2	V707 A708 R713	V707-D711 HydrophobicContact CB-CB 4.12Å; V707-D711 PolarHBondContact N-O 2.95Å; A708-D711 HydrophobicContact CB-CB 3.92Å; D711-R713 IonicContact OD2-CZ 3.51Å; D711-R713 IonicContact OD2-NE 3.77Å; D711-R713 IonicContact OD2-NH2 2.96Å; D711-R713 PolarHBondContact OD2-NH2 3.34Å
712	F	82.9	Confident	81.4	Confident	113 Å²	113	63.5 Å²	63.5	50%	0.496	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.9	167.9	-66.5	-89.5	0	0	0	111	L704 C705 K706 D710	L704-F712 HydrophobicContact CD1-CB 4.08Å; L704-F712 HydrophobicContact CD2-CB 4.37Å; L704-F712 HydrophobicContact CD2-CD1 4.06Å; L704-F712 HydrophobicContact CG-CB 4.23Å; L704-F712 HydrophobicContact CG-CD1 4.26Å; C705-F712 WeakPolarHBondContact O-CA 3.44Å; K706-F712 HydrophobicContact CB-CD1 4.01Å; K706-F712 HydrophobicContact CB-CE1 3.73Å; K706-F712 HydrophobicContact CB-CZ 4.44Å; K706-F712 HydrophobicContact CD-CE1 3.93Å; K706-F712 HydrophobicContact CD-CZ 3.8Å; K706-F712 HydrophobicContact CG-CD1 4.33Å; K706-F712 HydrophobicContact CG-CE1 3.86Å; K706-F712 HydrophobicContact CG-CZ 4.07Å; D710-F712 PolarHBondContact O-N 3.03Å
713	R	85.3	Confident	81.3	Confident	22 Å²	22	70.7 Å²	70.7	8%	0.083	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.7	-178.8	-54.5	-168.9	-168.6	-179.1	4	111.6	W315 S356 D375 C705 D711 C715	W315-R713 VanDerWaalsContact CZ3-NH1 3.32Å; S356-R713 PolarHBondContact O-NH1 3.32Å; S356-R713 PolarHBondContact O-NH2 3.24Å; D375-R713 WeakPolarHBondContact OD2-CD 3.39Å; D375-R713 IonicContact OD2-CZ 2.89Å; D375-R713 IonicContact OD2-NE 2.73Å; D375-R713 IonicContact OD2-NH1 3.11Å; D375-R713 PolarHBondContact OD2-NH1 3.21Å; C705-R713 PolarHBondContact N-O 3.04Å; C705-R713 PolarHBondContact O-N 3.48Å; D711-R713 IonicContact OD2-CZ 3.51Å; D711-R713 IonicContact OD2-NE 3.77Å; D711-R713 IonicContact OD2-NH2 2.96Å; D711-R713 PolarHBondContact OD2-NH2 3.34Å; R713-C715 PolarHBondContact O-N 3.1Å
714	L	88.1	Confident	80.7	Confident	70 Å²	70	72.1 Å²	72.1	37%	0.366	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	112.8	168.7	-72.1	171.6	0	0	0	108	L376 L704	L376-L714 WeakPolarHBondContact CB-O 3.49Å; L376-L714 PolarHBondContact N-O 3.47Å; L704-L714 HydrophobicContact CD1-CD2 4.45Å
715	C	88.9	Confident	79.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.5	179.6	-58.7	0	0	0	0	111.9	L373 Y374 G702 E703 C705 R713	L373-C715 HydrophobicContact CB-CB 4.07Å; L373-C715 HydrophobicContact CD2-CB 4.49Å; Y374-C715 CarbonylContact O-C 3.59Å; Y374-C715 WeakPolarHBondContact O-CA 3.46Å; Y374-C715 WeakPolarHBondContact O-CB 3.42Å; G702-C715 CarbonylContact C-O 3.56Å; G702-C715 WeakPolarHBondContact CA-O 3.25Å; E703-C715 PolarHBondContact N-O 3.34Å; E703-C715 PolarHBondContact O-N 3.49Å; C705-C715 HydrophobicContact CB-CB 4.06Å; R713-C715 PolarHBondContact O-N 3.1Å
716	L	90.3	Very high	79.2	Confident	3 Å²	3	79.5 Å²	79.5	2%	0.016	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.6	173.4	-169.2	62.2	0	0	0	110.2	L373 Y374 L376 T411 L412 M415 I718	L373-L716 WeakPolarHBondContact CA-O 3.27Å; Y374-L716 PolarHBondContact N-O 3.42Å; Y374-L716 PolarHBondContact O-N 2.68Å; L376-L716 HydrophobicContact CD1-CB 4.1Å; L376-L716 HydrophobicContact CD2-CB 3.98Å; L376-L716 HydrophobicContact CD2-CD2 4.49Å; L376-L716 HydrophobicContact CG-CB 4.1Å; T411-L716 WeakPolarHBondContact OG1-CD2 3.44Å; L412-L716 HydrophobicContact CB-CD2 4.18Å; M415-L716 HydrophobicContact CE-CD1 4.32Å; M415-L716 HydrophobicContact SD-CD1 3.78Å; L716-I718 HydrophobicContact CD2-CD1 4.31Å; L716-I718 HydrophobicContact CD2-CG1 4.38Å; L716-I718 HydrophobicContact CG-CG1 4.23Å
717	R	88.8	Confident	78.2	Confident	70 Å²	70	81.4 Å²	81.4	26%	0.264	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.4	172.1	-174.9	178.3	-68.2	-81.8	-1.9	110.3	D363 S371 S372 L373 E703	D363-R717 IonicContact OD2-CZ 2.64Å; D363-R717 VanDerWaalsContact OD2-CZ 3.23Å; D363-R717 IonicContact OD2-NH1 3.65Å; D363-R717 PolarHBondContact OD2-NH1 3.02Å; D363-R717 IonicContact OD2-NH2 3.23Å; D363-R717 PolarHBondContact OD2-NH2 2.97Å; S371-R717 PolarHBondContact OG-NH1 3.45Å; S372-R717 CarbonylContact O-C 3.52Å; S372-R717 WeakPolarHBondContact O-CA 3.36Å; L373-R717 HydrophobicContact CD2-CB 3.75Å; L373-R717 HydrophobicContact CD2-CG 4.17Å; E703-R717 IonicContact OE2-CZ 2.74Å; E703-R717 IonicContact OE2-NE 2.68Å; E703-R717 PolarHBondContact OE2-NE 3.15Å; E703-R717 IonicContact OE2-NH2 2.68Å; E703-R717 PolarHBondContact OE2-NH2 3.19Å
718	I	88.8	Confident	77.6	Confident	17 Å²	17	86.7 Å²	86.7	9%	0.087	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.6	176.8	-56.6	-177.1	0	0	0	107.9	S372 Y374 T411 L716 E720	S372-I718 PolarHBondContact N-O 3.47Å; S372-I718 PolarHBondContact O-N 2.93Å; Y374-I718 HydrophobicContact CD2-CB 4.39Å; Y374-I718 HydrophobicContact CD2-CD1 3.51Å; Y374-I718 HydrophobicContact CD2-CG1 4.05Å; Y374-I718 HydrophobicContact CE2-CB 4.41Å; Y374-I718 HydrophobicContact CE2-CD1 3.73Å; Y374-I718 HydrophobicContact CE2-CG1 4.42Å; Y374-I718 HydrophobicContact CG-CD1 4.43Å; T411-I718 HydrophobicContact CG2-CD1 3.96Å; T411-I718 HydrophobicContact CG2-CG1 4.34Å; T411-I718 HydrophobicContact CG2-CG2 4.25Å; T411-I718 WeakPolarHBondContact OG1-CD1 3.31Å; L716-I718 HydrophobicContact CD2-CD1 4.31Å; L716-I718 HydrophobicContact CD2-CG1 4.38Å; L716-I718 HydrophobicContact CG-CG1 4.23Å; I718-E720 HydrophobicContact CG2-CG 4.35Å
719	N	86.2	Confident	76.7	Confident	110 Å²	110	92.6 Å²	92.6	59%	0.588	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	119	172.3	-60.8	-24.3	0	0	0	108.5	S370	S370-N719 CarbonylContact O-C 3.54Å; S370-N719 WeakPolarHBondContact O-CA 2.91Å
720	E	83.3	Confident	76.2	Confident	19 Å²	19	85.8 Å²	85.8	9%	0.089	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142	175.7	-64.7	168.6	-126.5	0	0	109.2	K360 S370 S372 I718 K722	K360-E720 WeakPolarHBondContact CE-OE1 3.2Å; K360-E720 IonicContact NZ-OE1 2.86Å; K360-E720 PolarHBondContact NZ-OE1 3.39Å; K360-E720 IonicContact NZ-OE2 2.65Å; S370-E720 PolarHBondContact N-O 3.24Å; S370-E720 PolarHBondContact O-N 3.03Å; S372-E720 VanDerWaalsContact CB-OE1 3.27Å; S372-E720 WeakPolarHBondContact CB-OE1 3.26Å; S372-E720 PolarHBondContact OG-OE1 3.16Å; I718-E720 HydrophobicContact CG2-CG 4.35Å; E720-K722 WeakPolarHBondContact OE2-CE 3.42Å; E720-K722 IonicContact OE2-NZ 3.75Å; E720-K722 PolarHBondContact OE2-NZ 2.98Å
721	V	84.5	Confident	75.4	Confident	82 Å²	82	81 Å²	81	50%	0.497	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	109.8	169.2	-175.1	0	0	0	0	108.2	P368 V369	P368-V721 CarbonylContact O-C 3.54Å; P368-V721 WeakPolarHBondContact O-CA 3.44Å; V369-V721 HydrophobicContact CG1-CG2 4.35Å; V369-V721 HydrophobicContact CG2-CG1 4.4Å; V369-V721 HydrophobicContact CG2-CG2 4.24Å
722	K	79.4	Confident	74.9	Confident	68 Å²	68	82.9 Å²	82.9	30%	0.296	40%	0.397	S	S	.	.			trans	-126	89.1	-174.2	-74.2	174.7	175.9	164.2	0	109.8	P368 E407 E720 T724 E725	P368-K722 PolarHBondContact O-N 2.55Å; E407-K722 IonicContact OE1-NZ 2.75Å; E407-K722 PolarHBondContact OE1-NZ 3.31Å; E720-K722 WeakPolarHBondContact OE2-CE 3.42Å; E720-K722 IonicContact OE2-NZ 3.75Å; E720-K722 PolarHBondContact OE2-NZ 2.98Å; K722-T724 PolarHBondContact O-N 3.41Å; K722-E725 PolarHBondContact O-N 3.25Å
723	W	75.1	Confident	73.8	Confident	185 Å²	185	79.8 Å²	79.8	70%	0.701	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.5	178.6	-66.3	100	0	0	0	114.4	P368 W726	P368-W723 HydrophobicContact CB-CD2 4.15Å; P368-W723 HydrophobicContact CB-CE3 4.05Å; P368-W723 HydrophobicContact CG-CD2 4.23Å; P368-W723 HydrophobicContact CG-CE3 3.84Å; P368-W723 HydrophobicContact CG-CH2 4.15Å; P368-W723 HydrophobicContact CG-CZ3 3.8Å; W723-W726 PolarHBondContact O-NE1 2.78Å
724	T	71.6	Confident	72.7	Confident	127 Å²	127	81 Å²	81	78%	0.779	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-20.9	-176.5	51.7	0	0	0	0	114.3	K722	K722-T724 PolarHBondContact O-N 3.41Å
725	E	63.9	Low	71.3	Confident	100 Å²	100	86.6 Å²	86.6	47%	0.467	42%	0.417	S	S	.	.			trans	-121	97.7	-174.9	-77	-175.9	-147.4	0	0	111.3	K722 K727	K722-E725 PolarHBondContact O-N 3.25Å; E725-K727 PolarHBondContact O-N 3.43Å; E725-K727 WeakPolarHBondContact OE2-CE 3.38Å; E725-K727 IonicContact OE2-NZ 3.67Å; E725-K727 PolarHBondContact OE2-NZ 3.16Å
726	W	65.6	Low	69.9	Low	176 Å²	176	92.4 Å²	92.4	67%	0.667	45%	0.449	S	S	*	.			trans	-88.6	100	175.6	-72.9	72.1	0	0	0	110.8	W723	W723-W726 PolarHBondContact O-NE1 2.78Å
727	K	60	Low	68.4	Low	133 Å²	133	96.5 Å²	96.5	58%	0.578	48%	0.476	S	S	*	.			trans	-92.9	107.1	177.6	-70.2	176.7	-176.9	158.4	0	110.7	E725 V730	E725-K727 PolarHBondContact O-N 3.43Å; E725-K727 WeakPolarHBondContact OE2-CE 3.38Å; E725-K727 IonicContact OE2-NZ 3.67Å; E725-K727 PolarHBondContact OE2-NZ 3.16Å; K727-V730 HydrophobicContact CB-CG2 3.82Å
728	T	58.6	Low	66.9	Low	123 Å²	123	94.3 Å²	94.3	76%	0.755	47%	0.474	S	S	*	.	S	Bend	trans	-75.7	-22.3	177.8	51.9	0	0	0	0	113.8
729	H	51.2	Low	65.3	Low	168 Å²	168	99 Å²	99	78%	0.778	51%	0.506	S	S	*	.			trans	-124	105.6	-179.3	-61.7	-71.4	0	0	0	110.4
730	V	57.9	Low	63.5	Low	19 Å²	19	97.5 Å²	97.5	12%	0.115	50%	0.501	C	S	.	.			trans	-128.5	128.7	175.7	-179.8	0	0	0	0	108.1	T362 A365 K727 F732	T362-V730 VanDerWaalsContact CB-CG1 3.46Å; T362-V730 HydrophobicContact CG2-CG1 3.87Å; T362-V730 WeakPolarHBondContact OG1-CG1 2.97Å; A365-V730 HydrophobicContact CB-CG1 4.46Å; A365-V730 HydrophobicContact CB-CG2 4.42Å; K727-V730 HydrophobicContact CB-CG2 3.82Å; V730-F732 VanDerWaalsContact C-N 3.31Å; V730-F732 HydrophobicContact CB-CD1 4.09Å; V730-F732 HydrophobicContact CB-CE1 3.54Å; V730-F732 HydrophobicContact CB-CZ 3.97Å; V730-F732 HydrophobicContact CG1-CD1 3.82Å; V730-F732 HydrophobicContact CG1-CE1 3.69Å; V730-F732 WeakPolarHBondContact O-CD2 3.22Å; V730-F732 WeakPolarHBondContact O-CE2 3.01Å; V730-F732 PolarHBondContact O-N 3.48Å
731	S	56.6	Low	61.3	Low	45 Å²	45	107.8 Å²	107.8	32%	0.315	54%	0.539	S	S	.	.			trans	-85.6	72.5	-173.9	-50.2	0	0	0	0	110.3	R355	R355-S731 PolarHBondContact NH2-O 3.42Å
732	F	65.3	Low	59.1	Low	90 Å²	90	112.2 Å²	112.2	40%	0.395	55%	0.547	S	S	.	.			trans	-49.2	153.6	-171.7	-52.1	-58.5	0	0	0	114.8	A365 V730	A365-F732 HydrophobicContact CB-CE1 3.94Å; A365-F732 VanDerWaalsContact N-CE1 3.31Å; V730-F732 VanDerWaalsContact C-N 3.31Å; V730-F732 HydrophobicContact CB-CD1 4.09Å; V730-F732 HydrophobicContact CB-CE1 3.54Å; V730-F732 HydrophobicContact CB-CZ 3.97Å; V730-F732 HydrophobicContact CG1-CD1 3.82Å; V730-F732 HydrophobicContact CG1-CE1 3.69Å; V730-F732 WeakPolarHBondContact O-CD2 3.22Å; V730-F732 WeakPolarHBondContact O-CE2 3.01Å; V730-F732 PolarHBondContact O-N 3.48Å
733	L	60.4	Low	56.8	Low	49 Å²	49	114.3 Å²	114.3	26%	0.257	57%	0.565	S	S	.	*	S	Bend	trans	-95.2	-36	169.7	-158.7	84.6	0	0	0	111	T362 D363 L373	T362-L733 PolarHBondContact O-N 3.39Å; D363-L733 PolarHBondContact O-N 3.19Å; L373-L733 HydrophobicContact CD1-CD2 4.14Å
734	N	62.3	Low	54.8	Low	46 Å²	46	110.3 Å²	110.3	25%	0.246	57%	0.572	C	S	.	*			trans	-125.7	139.4	169.6	-68.6	-66.3	0	0	0	109.5	D363	D363-N734 PolarHBondContact O-N 2.74Å; D363-N734 VanDerWaalsContact O-N 3.12Å; D363-N734 PolarHBondContact OD1-ND2 3.48Å
735	E	58.7	Low	52.9	Low	188 Å²	188	110.9 Å²	110.9	88%	0.879	57%	0.57	S	S	*	*	S	Bend	trans	-80.6	-25.2	-179.3	-62.4	-179.5	166.2	0	0	112.4
736	D	58.7	Low	51.2	Low	123 Å²	123	115.9 Å²	115.9	66%	0.658	59%	0.591	S	S	*	*	S	Bend	trans	-85.8	125.6	178.5	-69.6	-42.9	0	0	0	112.5	G738	D736-G738 PolarHBondContact O-N 3.5Å
737	P	58.9	Low	49.5	Very low	89 Å²	89	114.4 Å²	114.4	58%	0.578	60%	0.596	S	S	*	*	S	Bend	trans	-77	105.1	175.5	30.2	-33.3	0	0	0	111.6	W364	W364-P737 HydrophobicContact CD2-CB 4.24Å; W364-P737 HydrophobicContact CE3-CB 4.12Å
738	G	57.4	Low	48	Very low	23 Å²	23	117.5 Å²	117.5	24%	0.237	61%	0.609	C	S	.	*	S	Bend	trans	154.8	170.6	170.9	0	0	0	0	0	113.8	D736 V740	D736-G738 PolarHBondContact O-N 3.5Å; G738-V740 PolarHBondContact O-N 3.27Å
739	P	55.6	Low	46.4	Very low	117 Å²	117	120.1 Å²	120.1	76%	0.76	62%	0.617	S	S	*	*			trans	-71.6	100.9	172.9	29.5	-32.7	0	0	0	109.7	R741	P739-R741 PolarHBondContact O-N 3.42Å
740	V	47.7	Very low	45.3	Very low	78 Å²	78	119.8 Å²	119.8	47%	0.473	62%	0.615	S	S	.	*			trans	-60.4	103.2	172	-177.2	0	0	0	0	108.7	G738 R742	G738-V740 PolarHBondContact O-N 3.27Å; V740-R742 HydrophobicContact CG1-CG 3.91Å; V740-R742 PolarHBondContact O-N 3.39Å
741	R	38.9	Very low	43.8	Very low	234 Å²	234	125 Å²	125	88%	0.883	64%	0.643	S	S	*	*			trans	-65.4	85.4	163.5	-80	-174.3	175.3	174.8	1.1	107.8	P739 T743	P739-R741 PolarHBondContact O-N 3.42Å; R741-T743 PolarHBondContact O-N 3.26Å
742	R	37.3	Very low	42.4	Very low	176 Å²	176	128.3 Å²	128.3	66%	0.664	67%	0.666	S	S	*	*			trans	-61.8	99.4	170	-71.8	-175	176.3	167.9	-0.1	108.2	V740 A744	V740-R742 HydrophobicContact CG1-CG 3.91Å; V740-R742 PolarHBondContact O-N 3.39Å; R742-A744 PolarHBondContact O-N 2.67Å
743	T	30.8	Very low	40.5	Very low	111 Å²	111	129.8 Å²	129.8	68%	0.681	69%	0.687	S	S	*	*			trans	-56.4	128	159.4	40.9	0	0	0	0	107.4	R741 D745	R741-T743 PolarHBondContact O-N 3.26Å; T743-D745 PolarHBondContact O-N 3.41Å
744	A	32.6	Very low	39.2	Very low	102 Å²	102	139 Å²	139	84%	0.843	72%	0.718	S	S	*	*			trans	-78.2	71.1	-177.1	0	0	0	0	0	110.5	R742 F746	R742-A744 PolarHBondContact O-N 2.67Å; A744-F746 VanDerWaalsContact C-N 3.32Å; A744-F746 PolarHBondContact O-N 3.49Å; A744-F746 VanDerWaalsContact O-N 3.16Å
745	D	31.5	Very low	37.9	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	74%	0.743	S	S	*	*			trans	-87	73.2	173	-75.8	-50.9	0	0	0	111.1	T743	T743-D745 PolarHBondContact O-N 3.41Å
746	F	29.8	Very low	36.6	Very low	205 Å²	205	142.3 Å²	142.3	90%	0.899	74%	0.742	S	S	*	*	S	Bend	trans	-123.3	82.9	154.8	-94	-84	0	0	0	109	A744	A744-F746 VanDerWaalsContact C-N 3.32Å; A744-F746 PolarHBondContact O-N 3.49Å; A744-F746 VanDerWaalsContact O-N 3.16Å
747	N	29	Very low	35.2	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	75%	0.751	S	S	*	*			trans	29.1	109.5	160.6	-74.1	-42.7	0	0	0	119.8
748	K	28.8	Very low	33.9	Very low	197 Å²	197	147.4 Å²	147.4	86%	0.857	77%	0.765	S	S	*	*			trans	51.7	106.2	145.3	-65.7	-179.9	176.4	177.6	0	118.2
749	I	26	Very low	32.7	Very low	179 Å²	179	152.7 Å²	152.7	92%	0.918	79%	0.793	S	S	*	*				-136.9	146.7	113.8	-96.4	154.8	0	0	0	107.6
750	Q	27.3	Very low	31.6	Very low	160 Å²	160	153.7 Å²	153.7	75%	0.748	80%	0.797	S	S	*	*			trans	-94.6	151.7	-170.2	-153.2	179.9	-57.5	0	0	111.6
751	D	27	Very low	30.8	Very low	130 Å²	130	157.6 Å²	157.6	70%	0.695	81%	0.814	S	S	*	*			trans	76.1	143.1	162	-63.3	-46.3	0	0	0	121.4
752	S	26.2	Very low	30.3	Very low	113 Å²	113	154.3 Å²	154.3	79%	0.79	81%	0.814	S	S	*	*			trans	73.3	88.8	170	73.2	0	0	0	0	119.5
753	S	26.1	Very low	30	Very low	121 Å²	121	150.2 Å²	150.2	85%	0.846	82%	0.818	S	S	*	*				-179.8	103.7	106.5	42.2	0	0	0	0	112.5	N755	S753-N755 PolarHBondContact O-N 3.08Å
754	R	33.4	Very low	30	Very low	242 Å²	242	154.8 Å²	154.8	91%	0.913	83%	0.829	S	S	*	*			trans	-84.3	101.2	169.4	-168.6	177.9	-175.3	169.7	-0.4	107.4
755	N	33.7	Very low	30	Very low	143 Å²	143	158.8 Å²	158.8	77%	0.765	83%	0.83	S	S	*	*			trans	165.2	117.9	150.6	-85	-17.4	0	0	0	112	S753	S753-N755 PolarHBondContact O-N 3.08Å
756	N	32.2	Very low	30	Very low	162 Å²	162	161.5 Å²	161.5	87%	0.866	84%	0.838	S	S	*	*			trans	152.6	65.4	143.5	-77.7	-18.3	0	0	0	111.9
757	S	29.8	Very low	30.1	Very low	120 Å²	120	158.3 Å²	158.3	84%	0.839	84%	0.835	S	S	*	*			trans	-116.1	58.8	177.6	50	0	0	0	0	112.4
758	K	30.9	Very low	30.4	Very low	199 Å²	199	160.4 Å²	160.4	87%	0.865	84%	0.84	S	S	*	*			trans	-146.4	72.6	170.2	-74.8	-165.5	176.4	-175.5	0	112
759	T	32.8	Very low	30.3	Very low	134 Å²	134	160.2 Å²	160.2	82%	0.822	84%	0.843	S	S	*	*	S	Bend	trans	-160.3	11.2	169.8	-11.5	0	0	0	0	116.3
760	T	31.8	Very low	30.6	Very low	137 Å²	137	160.9 Å²	160.9	84%	0.84	84%	0.839	S	S	*	*	S	Bend	trans	-130.9	32.4	-171.6	46.5	0	0	0	0	114.2
761	L	30	Very low	30.8	Very low	161 Å²	161	158.6 Å²	158.6	84%	0.843	84%	0.838	S	S	*	*	S	Bend	trans	-118.8	3.5	-179.8	-112.4	163.4	0	0	0	115
762	N	29.2	Very low	31	Very low	164 Å²	164	161.8 Å²	161.8	88%	0.877	85%	0.849	S	S	*	*			trans	-114.6	50.5	-177.8	-65.3	48.2	0	0	0	111.5
763	A	31.4	Very low	31.3	Very low	91 Å²	91	163 Å²	163	75%	0.752	85%	0.852	S	S	*	*	S	Bend	trans	-129.2	16.6	179.1	0	0	0	0	0	113.2
764	F	30.5	Very low	31.7	Very low	206 Å²	206	162.8 Å²	162.8	90%	0.904	85%	0.85	S	S	*	*	S	Bend	trans	-134.1	3.9	-176.3	-107.5	-78.5	0	0	0	114.9
765	E	33.1	Very low	31.8	Very low	186 Å²	186	161.6 Å²	161.6	87%	0.869	87%	0.869	S	S	*	*	S	Bend	trans	-124.5	104	170.2	-73.3	-180	149.9	0	0	108.4
766	E	30.7	Very low	31.7	Very low	197 Å²	197	162.5 Å²	162.5	92%	0.921	87%	0.874	S	S	*	*			trans	158	68.8	158.3	-91.1	173.9	-166.4	0	0	107.6
767	V	33.2	Very low	31.7	Very low	137 Å²	137	162.5 Å²	162.5	83%	0.83	88%	0.875	S	S	*	*			trans	-114.8	77.3	162	-178.3	0	0	0	0	106.4
768	E	33.3	Very low	31.8	Very low	190 Å²	190	164.9 Å²	164.9	89%	0.888	88%	0.877	S	S	*	*			trans	-157	150.4	168.9	-118.3	165.3	-150.1	0	0	110
769	E	28.1	Very low	31.9	Very low	193 Å²	193	162.9 Å²	162.9	90%	0.902	88%	0.878	S	S	*	*			trans	88.5	67.7	-169.7	-58.5	-164.3	157.5	0	0	116.8
770	F	31	Very low	31.8	Very low	192 Å²	192	164.7 Å²	164.7	84%	0.842	88%	0.881	S	S	*	*	P	Polyproline II helix	trans	-77.7	136.8	143	-79	-91.6	0	0	0	109	E772	F770-E772 PolarHBondContact O-N 2.04Å
771	P	32.3	Very low	31.8	Very low	113 Å²	113	166.5 Å²	166.5	73%	0.734	88%	0.884	S	S	*	*	P	Polyproline II helix	trans	-69.5	129.9	164.5	30	-32.2	0	0	0	109.2	T773	P771-T773 PolarHBondContact O-N 2.93Å
772	E	30.3	Very low	31.9	Very low	196 Å²	196	166.9 Å²	166.9	92%	0.916	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-60.3	117.1	176.9	-64	179.5	136.7	0	0	110.5	F770	F770-E772 PolarHBondContact O-N 2.04Å
773	T	34.4	Very low	32.2	Very low	140 Å²	140	167.2 Å²	167.2	86%	0.859	89%	0.887	S	S	*	*			trans	-87.2	109.4	161.3	46.9	0	0	0	0	108.1	P771	P771-T773 PolarHBondContact O-N 2.93Å
774	S	34.1	Very low	32.2	Very low	116 Å²	116	173.5 Å²	173.5	81%	0.811	90%	0.899	S	S	*	*			trans	-70.7	134.7	167.5	41	0	0	0	0	110.4
775	V	35.6	Very low	32.4	Very low	216 Å²	216	170.5 Å²	170.5	100%	1.309	90%	0.898	S	S	*	*			trans	-7.4	0	170.2	-172.9	0	0	0	0	117

Retrieved 775 of 775 residues in 1213.5 ms (Link to these results)

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