MICU2_RAT Loading...

Calcium uptake protein 2, mitochondrial

Calcium sensor of the mitochondrial calcium uniporter (MCU) channel, which senses calcium level via its EF-hand domains. MICU1 and MICU2 form a disulfide-linked heterodimer that stimulates and inhibits MCU activity, depending on the concentration of calcium. At low calcium levels, MICU1 occludes the pore of the MCU channel, preventing mitochondrial calcium uptake. At higher calcium levels, calcium-binding to MICU1 and MICU2 induces a conformational change that weakens MCU-MICU1 interactions and moves the MICU1-MICU2 heterodimer away from the pore, allowing calcium permeation through the MCU channel.

AlphaFold DB , UniProt , Accession Q99P63, Species RAT (Rattus norvegicus, Rat), Gene Micu2, Length 432 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	31.3	Very low	34.2	Very low	235 Å²	235	118.3 Å²	118.3	100%	1.158	71%	0.705	S	S	*	*				0	-20.4	0	-74.2	-66.6	-159.2	0	0	114.7
2	A	30.6	Very low	34.7	Very low	98 Å²	98	113.9 Å²	113.9	81%	0.81	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-3	-179.8	0	0	0	0	0	116.4
3	A	35.2	Very low	34.9	Very low	87 Å²	87	109.2 Å²	109.2	72%	0.719	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-4.2	-176.9	0	0	0	0	0	115
4	A	36.3	Very low	35.3	Very low	75 Å²	75	111.9 Å²	111.9	62%	0.62	66%	0.664	S	S	*	*	S	Bend	trans	-88.9	-25.6	-179.8	0	0	0	0	0	113.3	G6 R7	A4-G6 VanDerWaalsContact C-N 3.33Å; A4-G6 PolarHBondContact O-N 3.07Å; A4-R7 PolarHBondContact O-N 3.17Å
5	A	34.7	Very low	35.2	Very low	74 Å²	74	108 Å²	108	61%	0.612	66%	0.657	S	S	*	*	H	α-helix	trans	-73.4	-21.6	-176.4	0	0	0	0	0	113.9	S8	A5-S8 PolarHBondContact O-OG 3.15Å
6	G	31.2	Very low	35	Very low	50 Å²	50	103.4 Å²	103.4	52%	0.515	64%	0.637	S	S	.	*	H	α-helix	trans	-76	-19.4	178.3	0	0	0	0	0	114.7	A4	A4-G6 VanDerWaalsContact C-N 3.33Å; A4-G6 PolarHBondContact O-N 3.07Å
7	R	34.6	Very low	35.2	Very low	197 Å²	197	108 Å²	108	74%	0.743	64%	0.64	S	S	*	*	H	α-helix	trans	-89	-24.1	-174.4	-65.5	-173.2	-173.8	-152.2	1	113.7	A4	A4-R7 PolarHBondContact O-N 3.17Å
8	S	34.6	Very low	35.4	Very low	82 Å²	82	109.7 Å²	109.7	57%	0.573	65%	0.645	S	S	*	*	H	α-helix	trans	-80.6	-32.4	-179.5	52.7	0	0	0	0	113.3	A5	A5-S8 PolarHBondContact O-OG 3.15Å
9	A	34.2	Very low	35.6	Very low	66 Å²	66	115.3 Å²	115.3	55%	0.545	65%	0.654	S	S	.	*	H	α-helix	trans	-72.2	-30.5	179.8	0	0	0	0	0	113.4
10	W	36.4	Very low	35.7	Very low	208 Å²	208	120.6 Å²	120.6	79%	0.788	66%	0.663	S	S	*	*	H	α-helix	trans	-76.7	-37.4	-178.8	-88.3	68.8	0	0	0	113.3	A12 A13	W10-A12 VanDerWaalsContact C-N 3.3Å; W10-A12 PolarHBondContact O-N 3.43Å; W10-A13 PolarHBondContact O-N 3.11Å
11	L	37.4	Very low	35.5	Very low	129 Å²	129	117.7 Å²	117.7	68%	0.675	66%	0.66	S	S	*	*	H	α-helix	trans	-70.6	-25.2	177.8	-71.8	166.6	0	0	0	112.8
12	A	40.1	Very low	35.8	Very low	66 Å²	66	113.5 Å²	113.5	55%	0.545	64%	0.642	S	S	.	*	H	α-helix	trans	-76.2	-25.2	177.1	0	0	0	0	0	113.6	W10 W14 G15 G16	W10-A12 VanDerWaalsContact C-N 3.3Å; W10-A12 PolarHBondContact O-N 3.43Å; A12-W14 VanDerWaalsContact C-N 3.29Å; A12-W14 PolarHBondContact O-N 3.32Å; A12-G15 PolarHBondContact O-N 3.04Å; A12-G16 PolarHBondContact O-N 3.37Å
13	A	37.6	Very low	35.8	Very low	52 Å²	52	113.1 Å²	113.1	43%	0.43	64%	0.639	S	S	.	*	H	α-helix	trans	-69.4	-23.4	-173.9	0	0	0	0	0	113.7	W10	W10-A13 PolarHBondContact O-N 3.11Å
14	W	40.3	Very low	35.7	Very low	147 Å²	147	113.6 Å²	113.6	56%	0.557	64%	0.643	S	S	*	*	H	α-helix	trans	-83.6	-38.1	174.3	-110.8	-7.6	0	0	0	113.1	A12 G16 R17	A12-W14 VanDerWaalsContact C-N 3.29Å; A12-W14 PolarHBondContact O-N 3.32Å; W14-G16 PolarHBondContact O-N 3.03Å; W14-R17 PolarHBondContact O-N 3.49Å
15	G	33.4	Very low	35.3	Very low	54 Å²	54	113.3 Å²	113.3	56%	0.557	65%	0.647	S	S	*	*	H	α-helix	trans	-60.4	-27.4	170.7	0	0	0	0	0	113.3	A12	A12-G15 PolarHBondContact O-N 3.04Å
16	G	32.4	Very low	34.9	Very low	34 Å²	34	121.9 Å²	121.9	35%	0.351	66%	0.664	S	S	.	*	H	α-helix	trans	-74.5	-26.1	178.4	0	0	0	0	0	115.5	A12 W14 R19 R20	A12-G16 PolarHBondContact O-N 3.37Å; W14-G16 PolarHBondContact O-N 3.03Å; G16-R19 PolarHBondContact O-N 3.19Å; G16-R20 PolarHBondContact O-N 3.18Å
17	R	37.4	Very low	34.9	Very low	182 Å²	182	131.1 Å²	131.1	69%	0.687	68%	0.683	S	S	*	*	H	α-helix	trans	-79.9	-32.1	-174	-110.5	-179.1	-77.2	-121.2	3.2	113.3	W14 R19	W14-R17 PolarHBondContact O-N 3.49Å; R17-R19 VanDerWaalsContact C-N 3.32Å
18	L	38.9	Very low	34.5	Very low	139 Å²	139	126.7 Å²	126.7	73%	0.728	69%	0.688	S	S	*	*	H	α-helix	trans	-70.2	-26.7	167.6	-93.4	115.1	0	0	0	112.8
19	R	40	Very low	34.4	Very low	216 Å²	216	129.1 Å²	129.1	82%	0.815	70%	0.7	S	S	*	*	H	α-helix	trans	-73.4	-24.7	176.1	-103.6	-175.9	176.4	-133.3	1.1	114.3	G16 R17	G16-R19 PolarHBondContact O-N 3.19Å; R17-R19 VanDerWaalsContact C-N 3.32Å
20	R	38.1	Very low	34.3	Very low	221 Å²	221	131.6 Å²	131.6	83%	0.834	71%	0.71	S	S	*	*	H	α-helix	trans	-86.1	-19.4	177.7	-78.1	-173.5	-174.2	175.5	2.7	114.3	G16 L22	G16-R20 PolarHBondContact O-N 3.18Å; R20-L22 VanDerWaalsContact C-N 3.32Å
21	G	31.9	Very low	33.6	Very low	59 Å²	59	128.6 Å²	128.6	61%	0.608	72%	0.715	S	S	*	*	H	α-helix	trans	-73.1	-21	174.8	0	0	0	0	0	114.3
22	L	35.8	Very low	33.3	Very low	148 Å²	148	134.3 Å²	134.3	78%	0.775	73%	0.728	S	S	*	*	S	Bend	trans	-106.4	3.2	-171.3	-71.4	167.4	0	0	0	114.9	R20	R20-L22 VanDerWaalsContact C-N 3.32Å
23	A	31.7	Very low	32.6	Very low	90 Å²	90	134.6 Å²	134.6	74%	0.744	74%	0.737	S	S	*	*	S	Bend	trans	-89.1	-9.9	172.6	0	0	0	0	0	113.5
24	A	32.8	Very low	32.7	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	75%	0.753	S	S	*	*	S	Bend	trans	-105	69.1	179.8	0	0	0	0	0	110.6
25	G	28.6	Very low	32.1	Very low	69 Å²	69	139 Å²	139	71%	0.711	77%	0.77	S	S	*	*			trans	-172.2	21.1	-178.9	0	0	0	0	0	115.5
26	R	25.7	Very low	31.8	Very low	255 Å²	255	140.7 Å²	140.7	96%	0.962	78%	0.778	S	S	*	*			trans	-95.6	81.8	164.9	-76.3	-173.2	177.8	-167.7	-0.6	108.6
27	R	31.1	Very low	31.5	Very low	243 Å²	243	143.5 Å²	143.5	92%	0.917	80%	0.798	S	S	*	*			trans	-132	103.5	159	-133.6	174.1	-173.1	175.9	1	108.3
28	A	26.7	Very low	30.9	Very low	104 Å²	104	139.2 Å²	139.2	86%	0.86	80%	0.802	S	S	*	*			trans	-58.7	137.5	177.4	0	0	0	0	0	111.1
29	V	32.6	Very low	30.2	Very low	134 Å²	134	139.2 Å²	139.2	81%	0.812	81%	0.807	S	S	*	*			trans	-135.4	134.1	160.9	178.8	0	0	0	0	107.1
30	P	31.6	Very low	29.6	Very low	118 Å²	118	133.3 Å²	133.3	77%	0.766	80%	0.804	S	S	*	*			trans	-92.7	156.1	-154.8	35.8	-34.3	0	0	0	114.7
31	T	22.2	Very low	28.9	Very low	145 Å²	145	126 Å²	126	89%	0.89	80%	0.799	S	S	*	*			trans	-59.5	134.6	168.4	36.1	0	0	0	0	114.2
32	R	31	Very low	28.7	Very low	249 Å²	249	130.1 Å²	130.1	94%	0.94	81%	0.811	S	S	*	*			trans	-154.1	114.2	158.9	-139.8	173.6	165.1	160.9	-4	104.1
33	G	24.9	Very low	28.4	Very low	71 Å²	71	127 Å²	127	73%	0.732	81%	0.807	S	S	*	*				105.5	119.3	52	0	0	0	0	0	107.3
34	P	39.2	Very low	28.5	Very low	121 Å²	121	131 Å²	131	79%	0.786	82%	0.815	S	S	*	*			trans	-93.5	155.9	-167.9	36.6	-32.5	0	0	0	112.3
35	L	28.4	Very low	28.5	Very low	171 Å²	171	131.8 Å²	131.8	90%	0.895	82%	0.821	S	S	*	*			trans	163.8	145	135.5	-90.1	162	0	0	0	113.3
36	A	26.3	Very low	28.7	Very low	89 Å²	89	131.8 Å²	131.8	74%	0.736	82%	0.822	S	S	*	*			trans	66	106	147.5	0	0	0	0	0	117.9
37	A	25.8	Very low	29.1	Very low	94 Å²	94	123.3 Å²	123.3	78%	0.777	81%	0.806	S	S	*	*				89.6	118.8	76.7	0	0	0	0	0	113.4
38	A	24.6	Very low	29.1	Very low	92 Å²	92	114.4 Å²	114.4	76%	0.76	79%	0.79	S	S	*	*			trans	92.5	126.3	134.7	0	0	0	0	0	120.8
39	V	25.6	Very low	29.7	Very low	139 Å²	139	113.2 Å²	113.2	84%	0.842	78%	0.78	S	S	*	*			trans	93.8	121.6	138.5	-168.3	0	0	0	0	120.3
40	A	27	Very low	30.2	Very low	91 Å²	91	110.4 Å²	110.4	75%	0.752	77%	0.771	S	S	*	*			trans	69.1	109.1	148.6	0	0	0	0	0	120.2
41	G	22.2	Very low	30.5	Very low	69 Å²	69	113.1 Å²	113.1	71%	0.711	77%	0.766	S	S	*	*				82.7	121.6	92.2	0	0	0	0	0	118.1
42	V	28.2	Very low	31.1	Very low	145 Å²	145	112.5 Å²	112.5	88%	0.879	75%	0.753	S	S	*	*			trans	87.2	95.6	150.9	-166.9	0	0	0	0	117.8
43	A	30.3	Very low	31.3	Very low	82 Å²	82	106.8 Å²	106.8	68%	0.678	74%	0.736	S	S	*	*			trans	49.1	104.4	130.6	0	0	0	0	0	120
44	L	33.9	Very low	31.8	Very low	174 Å²	174	105.5 Å²	105.5	91%	0.911	72%	0.723	S	S	*	*			trans	-142.3	81.5	137.5	-77.2	-177.8	0	0	0	110.4	G46	L44-G46 PolarHBondContact O-N 3.34Å; L44-G46 VanDerWaalsContact O-N 3.15Å
45	A	31.5	Very low	31.6	Very low	112 Å²	112	107.5 Å²	107.5	93%	0.926	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	103.5	156.1	0	0	0	0	0	107.9
46	G	32.7	Very low	32.1	Very low	70 Å²	70	103.9 Å²	103.9	72%	0.722	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.1	-21.7	177.6	0	0	0	0	0	116.7	L44	L44-G46 PolarHBondContact O-N 3.34Å; L44-G46 VanDerWaalsContact O-N 3.15Å
47	A	34.7	Very low	32.4	Very low	77 Å²	77	107.1 Å²	107.1	64%	0.636	70%	0.697	S	S	*	*	S	Bend	trans	-94.7	-10.5	-176.2	0	0	0	0	0	115.4
48	G	31.7	Very low	32.7	Very low	56 Å²	56	105.9 Å²	105.9	58%	0.577	69%	0.686	S	S	*	*	H	α-helix	trans	-72.6	-33.4	-175.1	0	0	0	0	0	115.2	W51 H52	G48-W51 PolarHBondContact O-N 3.17Å; G48-H52 PolarHBondContact O-N 3.25Å
49	A	38.3	Very low	33.1	Very low	79 Å²	79	105.6 Å²	105.6	65%	0.653	68%	0.684	S	S	*	*	H	α-helix	trans	-72.5	-33.2	-177.5	0	0	0	0	0	112.6	H53	A49-H53 PolarHBondContact O-N 3.32Å
50	A	42.8	Very low	33.6	Very low	75 Å²	75	103 Å²	103	62%	0.62	68%	0.678	S	S	*	*	H	α-helix	trans	-72.8	-34.6	176.7	0	0	0	0	0	112.4	H52 G54	A50-H52 PolarHBondContact O-N 3.05Å; A50-G54 PolarHBondContact O-N 2.9Å; A50-G54 VanDerWaalsContact O-N 3.11Å
51	W	39.6	Very low	34	Very low	174 Å²	174	109.8 Å²	109.8	66%	0.659	68%	0.684	S	S	*	*	H	α-helix	trans	-67.8	-35.1	178.4	-166.3	76.9	0	0	0	112.5	G48 R55	G48-W51 PolarHBondContact O-N 3.17Å; W51-R55 VanDerWaalsContact CZ2-NH1 3.26Å
52	H	35.1	Very low	34.4	Very low	133 Å²	133	115.4 Å²	115.4	62%	0.616	69%	0.692	S	S	*	*	H	α-helix	trans	-78.3	-35.4	177.9	-154.6	-85.4	0	0	0	112.8	G48 A50	G48-H52 PolarHBondContact O-N 3.25Å; A50-H52 PolarHBondContact O-N 3.05Å
53	H	35.3	Very low	34.5	Very low	129 Å²	129	111.8 Å²	111.8	60%	0.597	68%	0.684	S	S	*	*	H	α-helix	trans	-75.4	-26.7	179.1	-125.7	-65.4	0	0	0	113.4	A49	A49-H53 PolarHBondContact O-N 3.32Å
54	G	34.2	Very low	34.2	Very low	43 Å²	43	113 Å²	113	44%	0.443	69%	0.687	S	S	.	*	H	α-helix	trans	-68.5	-36.2	176	0	0	0	0	0	113.6	A50 A58	A50-G54 PolarHBondContact O-N 2.9Å; A50-G54 VanDerWaalsContact O-N 3.11Å; G54-A58 WeakPolarHBondContact O-CB 3.44Å; G54-A58 PolarHBondContact O-N 2.88Å; G54-A58 VanDerWaalsContact O-N 3.08Å
55	R	34.3	Very low	34	Very low	164 Å²	164	116.1 Å²	116.1	62%	0.619	69%	0.687	S	S	*	*	H	α-helix	trans	-77	-29.8	-179.3	-91.6	-172.8	151.3	151.1	-4.4	114.4	W51 K57 A59	W51-R55 VanDerWaalsContact CZ2-NH1 3.26Å; R55-K57 VanDerWaalsContact C-N 3.32Å; R55-K57 PolarHBondContact O-N 3.3Å; R55-A59 VanDerWaalsContact O-CB 3.32Å; R55-A59 WeakPolarHBondContact O-CB 3.46Å; R55-A59 PolarHBondContact O-N 3.06Å; R55-A59 VanDerWaalsContact O-N 3.07Å
56	V	39.4	Very low	33.8	Very low	94 Å²	94	116.9 Å²	116.9	57%	0.57	68%	0.68	S	S	*	*	H	α-helix	trans	-71	-28.7	177.5	179.1	0	0	0	0	111.8
57	K	32.6	Very low	33.6	Very low	157 Å²	157	119.8 Å²	119.8	68%	0.683	68%	0.683	S	S	*	*	H	α-helix	trans	-89.5	-30.6	175	-73.6	-174.2	176.8	180	0	113.7	R55 A60	R55-K57 VanDerWaalsContact C-N 3.32Å; R55-K57 PolarHBondContact O-N 3.3Å; K57-A60 PolarHBondContact O-N 2.6Å
58	A	33.2	Very low	33.3	Very low	68 Å²	68	121.8 Å²	121.8	56%	0.562	69%	0.693	S	S	*	*	H	α-helix	trans	-71.4	-34.7	175.4	0	0	0	0	0	112.6	G54 A60 R61	G54-A58 WeakPolarHBondContact O-CB 3.44Å; G54-A58 PolarHBondContact O-N 2.88Å; G54-A58 VanDerWaalsContact O-N 3.08Å; A58-A60 PolarHBondContact O-N 2.87Å; A58-R61 PolarHBondContact O-N 2.7Å
59	A	33.1	Very low	33.4	Very low	86 Å²	86	123 Å²	123	71%	0.711	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-12.3	175.6	0	0	0	0	0	113.9	R55	R55-A59 VanDerWaalsContact O-CB 3.32Å; R55-A59 WeakPolarHBondContact O-CB 3.46Å; R55-A59 PolarHBondContact O-N 3.06Å; R55-A59 VanDerWaalsContact O-N 3.07Å
60	A	35.5	Very low	32.8	Very low	86 Å²	86	128.5 Å²	128.5	71%	0.711	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-2.2	178	0	0	0	0	0	114	K57 A58	K57-A60 PolarHBondContact O-N 2.6Å; A58-A60 PolarHBondContact O-N 2.87Å
61	R	34.9	Very low	32.1	Very low	232 Å²	232	134 Å²	134	88%	0.875	72%	0.72	S	S	*	*	S	Bend	trans	-128.8	28.8	-173.3	-144.1	173.8	89.9	130.5	-1.8	116.4	A58	A58-R61 PolarHBondContact O-N 2.7Å
62	E	31.3	Very low	31.8	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	72%	0.724	S	S	*	*	S	Bend	trans	-122.5	89.3	169.9	-148.9	155.7	-151.4	0	0	111.7
63	G	29.6	Very low	31.5	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	74%	0.739	S	S	*	*				71.5	86.2	127	0	0	0	0	0	118.5
64	S	25.4	Very low	31.7	Very low	108 Å²	108	137 Å²	137	76%	0.755	74%	0.741	S	S	*	*				13.8	111	126.2	-169.7	0	0	0	0	117.6
65	R	29.2	Very low	31.7	Very low	239 Å²	239	137.8 Å²	137.8	90%	0.902	75%	0.749	S	S	*	*			trans	-145.4	83	138.8	-105.4	-179.6	-178.3	170.8	1.1	108.2	V67	R65-V67 PolarHBondContact O-N 3.33Å; R65-V67 VanDerWaalsContact O-N 3.08Å
66	T	27.2	Very low	32	Very low	127 Å²	127	136.4 Å²	136.4	78%	0.779	76%	0.761	S	S	*	*			trans	-67.5	99.4	169	46.4	0	0	0	0	109
67	V	29.2	Very low	32.2	Very low	131 Å²	131	138 Å²	138	79%	0.794	77%	0.765	S	S	*	*			trans	-91	111.2	161.4	179.5	0	0	0	0	106.5	R65 A69	R65-V67 PolarHBondContact O-N 3.33Å; R65-V67 VanDerWaalsContact O-N 3.08Å; V67-A69 PolarHBondContact O-N 3.3Å
68	S	27.3	Very low	33.1	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	76%	0.762	S	S	*	*			trans	-63.5	90.3	177.6	-61.9	0	0	0	0	110.7
69	A	33.1	Very low	34.7	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	77%	0.771	S	S	*	*			trans	-81.3	116.6	158.5	0	0	0	0	0	107.4	V67 K71	V67-A69 PolarHBondContact O-N 3.3Å; A69-K71 PolarHBondContact O-N 3.4Å
70	Q	25.6	Very low	36.9	Very low	193 Å²	193	140.5 Å²	140.5	90%	0.902	75%	0.752	S	S	*	*			trans	-49.8	100.2	169.8	-88.7	172.4	-56.9	0	0	109.3	N72	Q70-N72 PolarHBondContact O-N 2.99Å
71	K	29	Very low	39.4	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.826	72%	0.724	S	S	*	*			trans	-77.2	108.4	166.6	-95.2	-179.8	173.8	176.9	0	106.9	A69 Y73	A69-K71 PolarHBondContact O-N 3.4Å; K71-Y73 PolarHBondContact O-N 2.91Å
72	N	34.1	Very low	41.9	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	71%	0.705	S	S	*	*			trans	-59.5	130.3	161.7	-72.7	-13.3	0	0	0	108.1	Q70 L74	Q70-N72 PolarHBondContact O-N 2.99Å; N72-L74 PolarHBondContact O-N 3.17Å
73	Y	28.4	Very low	44.8	Very low	236 Å²	236	122.5 Å²	122.5	93%	0.925	67%	0.667	S	S	*	*			trans	-59.6	90.3	180	-68.4	-95.9	0	0	0	111.1	K71	K71-Y73 PolarHBondContact O-N 2.91Å
74	L	39.8	Very low	47.8	Very low	124 Å²	124	121.2 Å²	121.2	65%	0.649	64%	0.641	S	S	*	*			trans	-91.1	130.3	143.6	-91	112.1	0	0	0	106.3	N72	N72-L74 PolarHBondContact O-N 3.17Å
75	G	33.4	Very low	50.9	Low	58 Å²	58	120.7 Å²	120.7	60%	0.598	63%	0.627	S	S	*	*			trans	-57.8	-169.6	178.9	0	0	0	0	0	113.6	I77	G75-I77 PolarHBondContact O-N 3.47Å
76	P	41.5	Very low	53.9	Low	136 Å²	136	110.8 Å²	110.8	88%	0.883	59%	0.59	S	S	*	*	S	Bend	trans	-49.6	115.2	-174.5	-19.6	29.2	0	0	0	109.4	E78	P76-E78 PolarHBondContact O-N 3.41Å
77	I	43.9	Very low	57.1	Low	127 Å²	127	104.8 Å²	104.8	65%	0.651	55%	0.553	S	S	*	*			trans	-70.7	80.9	-176.8	-55	170.1	0	0	0	106.4	G75 K79	G75-I77 PolarHBondContact O-N 3.47Å; I77-K79 PolarHBondContact O-N 3.42Å; I77-K79 VanDerWaalsContact O-N 3.14Å
78	E	51.7	Low	60.1	Low	132 Å²	132	100.7 Å²	100.7	62%	0.617	53%	0.525	S	S	*	.			trans	-43.9	121.3	144.8	-173.3	175.3	-167.3	0	0	105	P76 L80 T209	P76-E78 PolarHBondContact O-N 3.41Å; E78-L80 WeakPolarHBondContact O-CG 3.13Å; E78-L80 PolarHBondContact O-N 2.96Å; E78-T209 HydrophobicContact CG-CG2 4.01Å
79	K	66.2	Low	63.2	Low	174 Å²	174	98.7 Å²	98.7	76%	0.757	50%	0.503	S	S	*	.			trans	-60.5	88.9	-171.6	-74.4	-178.9	-179.6	176.3	0	108.8	I77 S81 T209	I77-K79 PolarHBondContact O-N 3.42Å; I77-K79 VanDerWaalsContact O-N 3.14Å; K79-S81 PolarHBondContact O-N 2.99Å; K79-T209 PolarHBondContact O-OG1 3.13Å
80	L	79.5	Confident	66.1	Low	57 Å²	57	95.5 Å²	95.5	30%	0.298	47%	0.473	S	S	.	.			trans	-59.1	138.3	179.6	-64.6	179.6	0	0	0	107.6	E78 K84 Q85	E78-L80 WeakPolarHBondContact O-CG 3.13Å; E78-L80 PolarHBondContact O-N 2.96Å; L80-K84 HydrophobicContact CB-CB 4.3Å; L80-K84 HydrophobicContact CB-CG 4.34Å; L80-K84 HydrophobicContact CD1-CG 4.47Å; L80-K84 HydrophobicContact CD2-CG 3.97Å; L80-K84 HydrophobicContact CG-CG 4.49Å; L80-Q85 HydrophobicContact CB-CG 3.62Å; L80-Q85 HydrophobicContact CD1-CG 4.39Å; L80-Q85 PolarHBondContact O-NE2 3.49Å
81	S	87	Confident	69.4	Low	19 Å²	19	86.6 Å²	86.6	13%	0.133	43%	0.433	C	S	.	.			trans	-56.9	153.1	171.6	72.3	0	0	0	0	109.9	K79 R83 K84 Q85 Y157 D205	K79-S81 PolarHBondContact O-N 2.99Å; S81-R83 PolarHBondContact O-N 3.16Å; S81-K84 PolarHBondContact O-N 3.14Å; S81-K84 VanDerWaalsContact OG-CB 3.27Å; S81-K84 WeakPolarHBondContact OG-CB 3.4Å; S81-K84 PolarHBondContact OG-N 2.78Å; S81-Q85 WeakPolarHBondContact O-CG 3.45Å; S81-Q85 PolarHBondContact O-N 3.08Å; S81-Y157 PolarHBondContact OG-OH 3.07Å; S81-D205 WeakPolarHBondContact CB-OD2 3.24Å; S81-D205 VanDerWaalsContact OG-CG 3.27Å; S81-D205 PolarHBondContact OG-OD1 2.8Å; S81-D205 PolarHBondContact OG-OD2 3Å
82	L	88.3	Confident	72.6	Confident	89 Å²	89	78 Å²	78	47%	0.466	40%	0.397	S	S	.	.	H	α-helix	trans	-56.6	-37.1	178.3	-177.7	64.2	0	0	0	111.8	Q85 R86 G395 L396	L82-Q85 PolarHBondContact O-N 3.5Å; L82-R86 WeakPolarHBondContact O-CB 3.41Å; L82-R86 PolarHBondContact O-N 3.21Å; L82-G395 WeakPolarHBondContact CD2-O 3.42Å; L82-L396 HydrophobicContact CD2-CD2 4.06Å; L82-L396 HydrophobicContact CG-CD2 3.81Å
83	R	91.7	Very high	75.5	Confident	21 Å²	21	72 Å²	72	8%	0.079	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-40.8	175.2	-69.6	-175	-70.2	-177	-7.8	111.8	S81 R86 F87 Y160 L161 L164 D205 L396	S81-R83 PolarHBondContact O-N 3.16Å; R83-R86 PolarHBondContact O-N 2.85Å; R83-F87 WeakPolarHBondContact O-CB 3.3Å; R83-F87 PolarHBondContact O-N 3.44Å; R83-Y160 HydrophobicContact CB-CE1 4.32Å; R83-Y160 WeakPolarHBondContact O-CE1 3.23Å; R83-L161 HydrophobicContact CB-CD2 3.85Å; R83-L161 HydrophobicContact CG-CD2 4.36Å; R83-L164 HydrophobicContact CG-CD1 4.02Å; R83-D205 IonicContact CZ-OD1 3.94Å; R83-D205 IonicContact NE-OD1 3.69Å; R83-D205 PolarHBondContact NE-OD1 2.94Å; R83-D205 IonicContact NH2-OD1 2.79Å; R83-D205 PolarHBondContact NH2-OD1 2.94Å; R83-L396 HydrophobicContact CG-CB 4.08Å; R83-L396 HydrophobicContact CG-CD1 4.41Å; R83-L396 HydrophobicContact CG-CD2 4.26Å
84	K	92.4	Very high	78.7	Confident	42 Å²	42	62.1 Å²	62.1	18%	0.183	33%	0.327	C	S	.	.	H	α-helix	trans	-66.8	-42.3	175	-173.1	61.7	174.6	-175.9	0	111.6	L80 S81 R86 F87 M88 Y157	L80-K84 HydrophobicContact CB-CB 4.3Å; L80-K84 HydrophobicContact CB-CG 4.34Å; L80-K84 HydrophobicContact CD1-CG 4.47Å; L80-K84 HydrophobicContact CD2-CG 3.97Å; L80-K84 HydrophobicContact CG-CG 4.49Å; S81-K84 PolarHBondContact O-N 3.14Å; S81-K84 VanDerWaalsContact OG-CB 3.27Å; S81-K84 WeakPolarHBondContact OG-CB 3.4Å; S81-K84 PolarHBondContact OG-N 2.78Å; K84-R86 VanDerWaalsContact C-N 3.34Å; K84-R86 PolarHBondContact O-N 3.2Å; K84-F87 HydrophobicContact CD-CD1 4.42Å; K84-F87 WeakPolarHBondContact O-CB 3.12Å; K84-F87 PolarHBondContact O-N 3.4Å; K84-M88 HydrophobicContact CD-CG 4.3Å; K84-M88 HydrophobicContact CG-CG 4.37Å; K84-M88 WeakPolarHBondContact O-CB 3.43Å; K84-M88 WeakPolarHBondContact O-CG 3.31Å; K84-M88 PolarHBondContact O-N 3.35Å; K84-Y157 WeakPolarHBondContact CA-OH 3.42Å; K84-Y157 HydrophobicContact CB-CE2 4.15Å; K84-Y157 WeakPolarHBondContact CB-OH 3.25Å; K84-Y157 HydrophobicContact CD-CD1 4Å; K84-Y157 HydrophobicContact CD-CD2 3.87Å; K84-Y157 HydrophobicContact CD-CE1 3.78Å; K84-Y157 HydrophobicContact CD-CE2 3.65Å; K84-Y157 HydrophobicContact CD-CG 4.04Å; K84-Y157 PolarHBondContact N-OH 3.07Å; K84-Y157 VanDerWaalsContact N-OH 3.14Å
85	Q	91	Very high	81.3	Confident	97 Å²	97	56.8 Å²	56.8	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-58.7	-47.8	175	-68	178.9	23.3	0	0	111	L80 S81 L82 F87 M88 Q89	L80-Q85 HydrophobicContact CB-CG 3.62Å; L80-Q85 HydrophobicContact CD1-CG 4.39Å; L80-Q85 PolarHBondContact O-NE2 3.49Å; S81-Q85 WeakPolarHBondContact O-CG 3.45Å; S81-Q85 PolarHBondContact O-N 3.08Å; L82-Q85 PolarHBondContact O-N 3.5Å; Q85-F87 VanDerWaalsContact C-N 3.34Å; Q85-F87 PolarHBondContact O-N 3.01Å; Q85-M88 PolarHBondContact O-N 2.75Å; Q85-Q89 WeakPolarHBondContact O-CB 3.37Å; Q85-Q89 PolarHBondContact O-N 3.36Å
86	R	91.7	Very high	84.1	Confident	31 Å²	31	60.9 Å²	60.9	12%	0.117	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-41	177.3	-174.2	149.9	-138.1	87.1	26.8	112.3	L82 R83 K84 Q89 F90 S109 F112 E113 L396	L82-R86 WeakPolarHBondContact O-CB 3.41Å; L82-R86 PolarHBondContact O-N 3.21Å; R83-R86 PolarHBondContact O-N 2.85Å; K84-R86 VanDerWaalsContact C-N 3.34Å; K84-R86 PolarHBondContact O-N 3.2Å; R86-Q89 PolarHBondContact O-N 2.91Å; R86-F90 HydrophobicContact CG-CD2 4.21Å; R86-F90 HydrophobicContact CG-CE2 4.38Å; R86-F90 VanDerWaalsContact NH2-CZ 3.29Å; R86-F90 WeakPolarHBondContact O-CD2 3.49Å; R86-F90 PolarHBondContact O-N 3.25Å; R86-S109 WeakPolarHBondContact CD-O 3.37Å; R86-S109 PolarHBondContact NE-O 3Å; R86-F112 PolarHBondContact NH2-O 3.06Å; R86-E113 PolarHBondContact NH1-O 2.74Å; R86-E113 VanDerWaalsContact NH2-CA 3.26Å; R86-E113 PolarHBondContact NH2-O 2.89Å; R86-L396 HydrophobicContact CB-CD2 4.21Å
87	F	94.3	Very high	86.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-56.7	173.4	177.3	-98.5	0	0	0	110.9	R83 K84 Q85 Q89 F90 S91 Y99 M101 Y157 Y160	R83-F87 WeakPolarHBondContact O-CB 3.3Å; R83-F87 PolarHBondContact O-N 3.44Å; K84-F87 HydrophobicContact CD-CD1 4.42Å; K84-F87 WeakPolarHBondContact O-CB 3.12Å; K84-F87 PolarHBondContact O-N 3.4Å; Q85-F87 VanDerWaalsContact C-N 3.34Å; Q85-F87 PolarHBondContact O-N 3.01Å; F87-Q89 PolarHBondContact O-N 3.43Å; F87-F90 PolarHBondContact O-N 3.2Å; F87-F90 VanDerWaalsContact O-N 3.11Å; F87-S91 WeakPolarHBondContact CE1-OG 3.24Å; F87-S91 WeakPolarHBondContact CZ-OG 3.35Å; F87-S91 PolarHBondContact O-N 3.35Å; F87-S91 PolarHBondContact O-OG 3.01Å; F87-Y99 WeakPolarHBondContact CE1-O 3.47Å; F87-Y99 VanDerWaalsContact CZ-O 3.24Å; F87-Y99 WeakPolarHBondContact CZ-O 3.34Å; F87-M101 HydrophobicContact CB-CE 4.31Å; F87-M101 HydrophobicContact CD2-CE 3.67Å; F87-M101 HydrophobicContact CD2-CG 3.95Å; F87-M101 HydrophobicContact CD2-SD 3.64Å; F87-M101 HydrophobicContact CE2-CB 4.34Å; F87-M101 HydrophobicContact CE2-CE 4.35Å; F87-M101 HydrophobicContact CE2-CG 3.7Å; F87-M101 HydrophobicContact CE2-SD 3.9Å; F87-M101 HydrophobicContact CG-CE 4.2Å; F87-M101 HydrophobicContact CZ-CG 4.49Å; F87-M101 VanDerWaalsContact O-CE 3.24Å; F87-M101 WeakPolarHBondContact O-CE 3.48Å; F87-Y157 HydrophobicContact CB-CD2 3.72Å; F87-Y157 HydrophobicContact CB-CE2 3.76Å; F87-Y157 AromaticContact CD1-CD2 3.64Å; F87-Y157 HydrophobicContact CD1-CD2 3.64Å; F87-Y157 HydrophobicContact CD1-CE2 4.41Å; F87-Y157 HydrophobicContact CD1-CG 4.29Å; F87-Y157 AromaticContact CD2-CD2 3.78Å; F87-Y157 HydrophobicContact CD2-CD2 3.78Å; F87-Y157 HydrophobicContact CE1-CD2 4.14Å; F87-Y157 HydrophobicContact CE1-CG 4.43Å; F87-Y157 HydrophobicContact CE2-CD2 4.27Å; F87-Y157 AromaticContact CG-CD2 3.43Å; F87-Y157 HydrophobicContact CG-CD2 3.43Å; F87-Y157 VanDerWaalsContact CG-CD2 3.43Å; F87-Y157 HydrophobicContact CG-CE2 4.02Å; F87-Y157 HydrophobicContact CG-CG 4.44Å; F87-Y157 HydrophobicContact CZ-CD2 4.42Å; F87-Y160 HydrophobicContact CB-CD1 3.98Å; F87-Y160 HydrophobicContact CB-CE1 3.97Å; F87-Y160 AromaticContact CD2-CD1 3.88Å; F87-Y160 HydrophobicContact CD2-CD1 3.88Å; F87-Y160 HydrophobicContact CD2-CD2 4.15Å; F87-Y160 AromaticContact CD2-CG 3.64Å; F87-Y160 HydrophobicContact CD2-CG 3.64Å; F87-Y160 HydrophobicContact CE2-CG 4.36Å; F87-Y160 HydrophobicContact CG-CD1 4.33Å
88	M	92.9	Very high	88.8	Confident	45 Å²	45	56 Å²	56	22%	0.222	28%	0.282	C	S	.	.	H	α-helix	trans	-59.4	-33.7	-179.4	-65.6	-59.1	-60.7	0	0	113	K84 Q85 F90 Y99	K84-M88 HydrophobicContact CD-CG 4.3Å; K84-M88 HydrophobicContact CG-CG 4.37Å; K84-M88 WeakPolarHBondContact O-CB 3.43Å; K84-M88 WeakPolarHBondContact O-CG 3.31Å; K84-M88 PolarHBondContact O-N 3.35Å; Q85-M88 PolarHBondContact O-N 2.75Å; M88-F90 VanDerWaalsContact C-N 3.35Å; M88-Y99 HydrophobicContact CE-CD1 3.99Å; M88-Y99 HydrophobicContact CE-CD2 3.41Å; M88-Y99 VanDerWaalsContact CE-CD2 3.41Å; M88-Y99 HydrophobicContact CE-CE1 4.15Å; M88-Y99 HydrophobicContact CE-CE2 3.61Å; M88-Y99 HydrophobicContact CE-CG 3.6Å; M88-Y99 HydrophobicContact SD-CD2 4.15Å; M88-Y99 HydrophobicContact SD-CG 4.09Å
89	Q	91.7	Very high	90.8	Very high	77 Å²	77	53.6 Å²	53.6	36%	0.36	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-37.6	179	-172.1	-174.6	-4.7	0	0	112.2	Q85 R86 F87 V115	Q85-Q89 WeakPolarHBondContact O-CB 3.37Å; Q85-Q89 PolarHBondContact O-N 3.36Å; R86-Q89 PolarHBondContact O-N 2.91Å; F87-Q89 PolarHBondContact O-N 3.43Å; Q89-V115 HydrophobicContact CG-CG2 3.78Å; Q89-V115 WeakPolarHBondContact O-CG2 3.45Å
90	F	94.3	Very high	92.3	Very high	16 Å²	16	46.5 Å²	46.5	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-100.5	-16.9	-174.2	-78.6	-103.3	0	0	0	114	R86 F87 M88 S92 M101 D105 F108 F112 V115	R86-F90 HydrophobicContact CG-CD2 4.21Å; R86-F90 HydrophobicContact CG-CE2 4.38Å; R86-F90 VanDerWaalsContact NH2-CZ 3.29Å; R86-F90 WeakPolarHBondContact O-CD2 3.49Å; R86-F90 PolarHBondContact O-N 3.25Å; F87-F90 PolarHBondContact O-N 3.2Å; F87-F90 VanDerWaalsContact O-N 3.11Å; M88-F90 VanDerWaalsContact C-N 3.35Å; F90-S92 PolarHBondContact O-N 2.83Å; F90-M101 HydrophobicContact CB-CE 3.49Å; F90-M101 VanDerWaalsContact CB-CE 3.49Å; F90-D105 WeakPolarHBondContact O-CB 3.25Å; F90-F108 HydrophobicContact CD1-CB 3.91Å; F90-F108 HydrophobicContact CE1-CB 3.9Å; F90-F108 VanDerWaalsContact CE1-O 3.28Å; F90-F108 WeakPolarHBondContact CE1-O 3.14Å; F90-F112 HydrophobicContact CE1-CB 4.5Å; F90-F112 HydrophobicContact CZ-CB 4.41Å; F90-V115 HydrophobicContact CB-CG2 4.45Å; F90-V115 HydrophobicContact CD1-CG2 3.61Å; F90-V115 HydrophobicContact CD2-CG2 3.51Å; F90-V115 HydrophobicContact CE1-CG2 3.52Å; F90-V115 HydrophobicContact CE2-CG2 3.4Å; F90-V115 HydrophobicContact CG-CG2 3.6Å; F90-V115 HydrophobicContact CZ-CB 4.42Å; F90-V115 HydrophobicContact CZ-CG2 3.42Å; F90-V115 VanDerWaalsContact CZ-CG2 3.42Å
91	S	95.1	Very high	93.1	Very high	7 Å²	7	43.8 Å²	43.8	5%	0.049	22%	0.222	C	C	.	.			trans	-58.9	119.3	178.5	-69	0	0	0	0	111.9	F87 Y100	F87-S91 WeakPolarHBondContact CE1-OG 3.24Å; F87-S91 WeakPolarHBondContact CZ-OG 3.35Å; F87-S91 PolarHBondContact O-N 3.35Å; F87-S91 PolarHBondContact O-OG 3.01Å; S91-Y100 WeakPolarHBondContact CA-O 3.22Å; S91-Y100 VanDerWaalsContact CB-O 3.31Å; S91-Y100 WeakPolarHBondContact CB-O 3.35Å
92	S	95	Very high	93.5	Very high	9 Å²	9	43 Å²	43	6%	0.063	22%	0.217	C	C	.	.			trans	-102.5	-0.5	177.8	69.1	0	0	0	0	114.1	F90 Y100 D105 V121 K122	F90-S92 PolarHBondContact O-N 2.83Å; S92-Y100 PolarHBondContact N-O 2.91Å; S92-D105 VanDerWaalsContact CB-OD2 3.28Å; S92-D105 WeakPolarHBondContact CB-OD2 3.39Å; S92-D105 PolarHBondContact N-OD2 2.94Å; S92-D105 VanDerWaalsContact N-OD2 3.12Å; S92-D105 PolarHBondContact OG-OD1 3.23Å; S92-D105 PolarHBondContact OG-OD2 3.27Å; S92-V121 CarbonylContact O-C 3.56Å; S92-V121 WeakPolarHBondContact O-CA 3.41Å; S92-K122 PolarHBondContact O-N 3.25Å
93	L	95.7	Very high	93.9	Very high	14 Å²	14	38.8 Å²	38.8	7%	0.073	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.3	-176.6	-55.2	178.7	0	0	0	111.5	Y99 Y100 T102 K122 L124 V154	L93-Y99 WeakPolarHBondContact O-CA 3.28Å; L93-Y100 PolarHBondContact N-O 3.16Å; L93-Y100 VanDerWaalsContact N-O 3.14Å; L93-Y100 PolarHBondContact O-N 3.42Å; L93-T102 HydrophobicContact CD1-CG2 3.78Å; L93-T102 HydrophobicContact CD2-CG2 4.28Å; L93-T102 HydrophobicContact CG-CG2 4Å; L93-K122 WeakPolarHBondContact CA-O 3.28Å; L93-K122 HydrophobicContact CD2-CB 4.11Å; L93-L124 HydrophobicContact CB-CD1 4.22Å; L93-L124 HydrophobicContact CD1-CD1 3.99Å; L93-L124 HydrophobicContact CD2-CD1 4Å; L93-L124 HydrophobicContact CD2-CG 4.39Å; L93-L124 HydrophobicContact CG-CD1 4.29Å; L93-V154 HydrophobicContact CD1-CG2 4.19Å
94	E	95.1	Very high	94.1	Very high	29 Å²	29	41.7 Å²	41.7	14%	0.136	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.5	173.6	-177.3	-164.5	149	0	0	110	E98 V121 K122 K123 L124	E94-E98 CarbonylContact C-O 3.49Å; E94-E98 VanDerWaalsContact CA-O 3.29Å; E94-E98 WeakPolarHBondContact CA-O 3.42Å; E94-V121 HydrophobicContact CB-CG1 3.57Å; E94-K122 PolarHBondContact N-O 3.28Å; E94-K123 HydrophobicContact CB-CG 4.41Å; E94-K123 VanDerWaalsContact CD-NZ 3.33Å; E94-K123 CarbonylContact O-C 3.53Å; E94-K123 WeakPolarHBondContact O-CA 3.38Å; E94-K123 IonicContact OE1-NZ 2.76Å; E94-K123 PolarHBondContact OE1-NZ 3.37Å; E94-K123 WeakPolarHBondContact OE2-CE 3.4Å; E94-K123 IonicContact OE2-NZ 3.13Å; E94-K123 PolarHBondContact OE2-NZ 3.34Å; E94-K123 VanDerWaalsContact OE2-NZ 3.13Å; E94-L124 PolarHBondContact O-N 3.46Å
95	H	94.6	Very high	94.3	Very high	13 Å²	13	40.2 Å²	40.2	6%	0.06	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	126.9	171.8	175.3	59.9	0	0	0	109.7	G97 E98 Y100 L124 I129 V227	H95-G97 PolarHBondContact O-N 3.21Å; H95-G97 VanDerWaalsContact O-N 3.16Å; H95-E98 PolarHBondContact N-O 3.47Å; H95-E98 WeakPolarHBondContact O-CB 3.42Å; H95-E98 PolarHBondContact O-N 3.32Å; H95-Y100 HydrophobicContact CB-CD2 4.33Å; H95-Y100 HydrophobicContact CB-CE2 3.85Å; H95-L124 PolarHBondContact ND1-O 2.69Å; H95-I129 HydrophobicContact CB-CD1 3.75Å; H95-I129 VanDerWaalsContact CG-CD1 3.42Å; H95-V227 VanDerWaalsContact NE2-CG1 3.28Å; H95-V227 WeakPolarHBondContact NE2-CG1 3.31Å
96	D	92	Very high	94.6	Very high	144 Å²	144	35.6 Å²	35.6	77%	0.77	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	37.5	-177.3	-64.5	-8.3	0	0	0	113.7	E98	D96-E98 PolarHBondContact O-N 3.31Å
97	G	90.9	Very high	94.7	Very high	47 Å²	47	34.3 Å²	34.3	49%	0.485	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-6.6	-178.7	0	0	0	0	0	115.2	H95	H95-G97 PolarHBondContact O-N 3.21Å; H95-G97 VanDerWaalsContact O-N 3.16Å
98	E	93.1	Very high	94.7	Very high	114 Å²	114	36.7 Å²	36.7	53%	0.533	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.6	175.4	-70.7	-67.3	160.1	0	0	111.3	E94 H95 D96 Y100	E94-E98 CarbonylContact C-O 3.49Å; E94-E98 VanDerWaalsContact CA-O 3.29Å; E94-E98 WeakPolarHBondContact CA-O 3.42Å; H95-E98 PolarHBondContact N-O 3.47Å; H95-E98 WeakPolarHBondContact O-CB 3.42Å; H95-E98 PolarHBondContact O-N 3.32Å; D96-E98 PolarHBondContact O-N 3.31Å; E98-Y100 HydrophobicContact CB-CE2 3.77Å; E98-Y100 WeakPolarHBondContact O-CD2 3.49Å; E98-Y100 VanDerWaalsContact O-CE2 3.3Å; E98-Y100 WeakPolarHBondContact O-CE2 3.21Å
99	Y	94.7	Very high	94.7	Very high	80 Å²	80	34.7 Å²	34.7	31%	0.314	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.5	-178.5	-72.2	-101.3	0	0	0	111.6	F87 M88 L93 V121	F87-Y99 WeakPolarHBondContact CE1-O 3.47Å; F87-Y99 VanDerWaalsContact CZ-O 3.24Å; F87-Y99 WeakPolarHBondContact CZ-O 3.34Å; M88-Y99 HydrophobicContact CE-CD1 3.99Å; M88-Y99 HydrophobicContact CE-CD2 3.41Å; M88-Y99 VanDerWaalsContact CE-CD2 3.41Å; M88-Y99 HydrophobicContact CE-CE1 4.15Å; M88-Y99 HydrophobicContact CE-CE2 3.61Å; M88-Y99 HydrophobicContact CE-CG 3.6Å; M88-Y99 HydrophobicContact SD-CD2 4.15Å; M88-Y99 HydrophobicContact SD-CG 4.09Å; L93-Y99 WeakPolarHBondContact O-CA 3.28Å; Y99-V121 HydrophobicContact CD1-CG1 4.31Å; Y99-V121 HydrophobicContact CE1-CG1 4.05Å; Y99-V121 HydrophobicContact CE1-CG2 4.19Å
100	Y	96.6	Very high	94.8	Very high	26 Å²	26	31.2 Å²	31.2	10%	0.102	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	157.3	179.2	-58.4	-96.9	0	0	0	111.3	S91 S92 L93 H95 E98 V154 I155 V227	S91-Y100 WeakPolarHBondContact CA-O 3.22Å; S91-Y100 VanDerWaalsContact CB-O 3.31Å; S91-Y100 WeakPolarHBondContact CB-O 3.35Å; S92-Y100 PolarHBondContact N-O 2.91Å; L93-Y100 PolarHBondContact N-O 3.16Å; L93-Y100 VanDerWaalsContact N-O 3.14Å; L93-Y100 PolarHBondContact O-N 3.42Å; H95-Y100 HydrophobicContact CB-CD2 4.33Å; H95-Y100 HydrophobicContact CB-CE2 3.85Å; E98-Y100 HydrophobicContact CB-CE2 3.77Å; E98-Y100 WeakPolarHBondContact O-CD2 3.49Å; E98-Y100 VanDerWaalsContact O-CE2 3.3Å; E98-Y100 WeakPolarHBondContact O-CE2 3.21Å; Y100-V154 HydrophobicContact CD1-CG1 3.34Å; Y100-V154 HydrophobicContact CE1-CG1 4.05Å; Y100-V154 HydrophobicContact CG-CG1 3.62Å; Y100-I155 WeakPolarHBondContact CA-O 3.4Å; Y100-V227 HydrophobicContact CE1-CG2 4.42Å
101	M	96.7	Very high	94.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-104	146.3	173.6	-79.8	-176.7	166.1	0	0	111.1	F87 F90 D105 F106 V154 I155 Y160	F87-M101 HydrophobicContact CB-CE 4.31Å; F87-M101 HydrophobicContact CD2-CE 3.67Å; F87-M101 HydrophobicContact CD2-CG 3.95Å; F87-M101 HydrophobicContact CD2-SD 3.64Å; F87-M101 HydrophobicContact CE2-CB 4.34Å; F87-M101 HydrophobicContact CE2-CE 4.35Å; F87-M101 HydrophobicContact CE2-CG 3.7Å; F87-M101 HydrophobicContact CE2-SD 3.9Å; F87-M101 HydrophobicContact CG-CE 4.2Å; F87-M101 HydrophobicContact CZ-CG 4.49Å; F87-M101 VanDerWaalsContact O-CE 3.24Å; F87-M101 WeakPolarHBondContact O-CE 3.48Å; F90-M101 HydrophobicContact CB-CE 3.49Å; F90-M101 VanDerWaalsContact CB-CE 3.49Å; M101-D105 HydrophobicContact CB-CB 3.85Å; M101-D105 HydrophobicContact CG-CB 3.82Å; M101-D105 HydrophobicContact SD-CB 4.45Å; M101-F106 HydrophobicContact SD-CB 4.43Å; M101-V154 CarbonylContact O-C 3.54Å; M101-I155 HydrophobicContact CB-CB 4.01Å; M101-I155 HydrophobicContact CB-CG2 4.46Å; M101-I155 PolarHBondContact N-O 2.91Å; M101-I155 WeakPolarHBondContact O-CB 3.39Å; M101-I155 PolarHBondContact O-N 2.82Å; M101-Y160 HydrophobicContact CE-CD2 4.34Å; M101-Y160 HydrophobicContact CE-CE2 4.27Å; M101-Y160 HydrophobicContact SD-CD2 3.64Å; M101-Y160 HydrophobicContact SD-CE2 4.05Å; M101-Y160 HydrophobicContact SD-CG 4.37Å
102	T	96.3	Very high	94.1	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.018	17%	0.165	C	C	.	.			trans	-76.8	163.1	156.6	65.2	0	0	0	0	110.6	L93 R104 D105 F106 D151	L93-T102 HydrophobicContact CD1-CG2 3.78Å; L93-T102 HydrophobicContact CD2-CG2 4.28Å; L93-T102 HydrophobicContact CG-CG2 4Å; T102-R104 PolarHBondContact O-N 2.88Å; T102-R104 PolarHBondContact OG1-N 3.49Å; T102-D105 PolarHBondContact N-OD2 3.37Å; T102-D105 WeakPolarHBondContact O-CB 3.14Å; T102-D105 PolarHBondContact O-N 2.92Å; T102-D105 VanDerWaalsContact O-N 3.09Å; T102-D105 PolarHBondContact OG1-N 2.86Å; T102-D105 PolarHBondContact OG1-OD1 3.4Å; T102-D105 PolarHBondContact OG1-OD2 3.23Å; T102-D105 VanDerWaalsContact OG1-OD2 3.14Å; T102-F106 PolarHBondContact O-N 3.47Å; T102-D151 HydrophobicContact CG2-CB 4.35Å
103	P	96.8	Very high	93.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-52.4	-37.1	167.6	-29.8	37.2	0	0	0	113.3	F106 L107 F146 L149 G150 I155	P103-F106 PolarHBondContact O-N 3.24Å; P103-L107 WeakPolarHBondContact O-CG 3.18Å; P103-L107 PolarHBondContact O-N 2.96Å; P103-F146 HydrophobicContact CB-CB 4.1Å; P103-F146 HydrophobicContact CB-CD1 3.74Å; P103-F146 HydrophobicContact CB-CE1 4.48Å; P103-F146 HydrophobicContact CB-CG 4.1Å; P103-L149 HydrophobicContact CB-CB 4.03Å; P103-L149 HydrophobicContact CB-CD1 4.48Å; P103-L149 HydrophobicContact CG-CB 3.81Å; P103-L149 HydrophobicContact CG-CD1 3.85Å; P103-G150 WeakPolarHBondContact CB-O 3.33Å; P103-G150 WeakPolarHBondContact CD-O 3.05Å; P103-I155 HydrophobicContact CG-CD1 4.34Å
104	R	95.1	Very high	92.3	Very high	81 Å²	81	42.6 Å²	42.6	31%	0.306	21%	0.209	S	C	.	.	H	α-helix	trans	-63.3	-47.3	172.7	-174.9	-172.2	-52.9	-68.2	0.4	112.2	T102 F106 L107 F108 G150 D151	T102-R104 PolarHBondContact O-N 2.88Å; T102-R104 PolarHBondContact OG1-N 3.49Å; R104-F106 VanDerWaalsContact C-N 3.26Å; R104-F106 PolarHBondContact O-N 3.21Å; R104-L107 PolarHBondContact O-N 3.22Å; R104-F108 HydrophobicContact CG-CD1 4.26Å; R104-F108 HydrophobicContact CG-CD2 4.41Å; R104-F108 HydrophobicContact CG-CE1 4.14Å; R104-F108 HydrophobicContact CG-CE2 4.3Å; R104-F108 HydrophobicContact CG-CG 4.41Å; R104-F108 HydrophobicContact CG-CZ 4.17Å; R104-F108 WeakPolarHBondContact O-CB 3.43Å; R104-F108 PolarHBondContact O-N 3.22Å; R104-G150 WeakPolarHBondContact CB-O 3.37Å; R104-G150 PolarHBondContact N-O 2.94Å; R104-D151 WeakPolarHBondContact CD-OD1 3.36Å; R104-D151 IonicContact CZ-OD1 2.88Å; R104-D151 IonicContact CZ-OD2 3.57Å; R104-D151 IonicContact NE-OD1 2.89Å; R104-D151 PolarHBondContact NE-OD1 2.96Å; R104-D151 IonicContact NE-OD2 2.68Å; R104-D151 PolarHBondContact NE-OD2 2.86Å; R104-D151 VanDerWaalsContact NE-OD2 3.16Å; R104-D151 IonicContact NH2-OD1 3.16Å; R104-D151 IonicContact NH2-OD2 2.92Å; R104-D151 PolarHBondContact NH2-OD2 3.32Å
105	D	96	Very high	91.1	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.059	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-43	178.5	-62.7	-21.5	0	0	0	110.5	F90 S92 M101 T102 F108 S109	F90-D105 WeakPolarHBondContact O-CB 3.25Å; S92-D105 VanDerWaalsContact CB-OD2 3.28Å; S92-D105 WeakPolarHBondContact CB-OD2 3.39Å; S92-D105 PolarHBondContact N-OD2 2.94Å; S92-D105 VanDerWaalsContact N-OD2 3.12Å; S92-D105 PolarHBondContact OG-OD1 3.23Å; S92-D105 PolarHBondContact OG-OD2 3.27Å; M101-D105 HydrophobicContact CB-CB 3.85Å; M101-D105 HydrophobicContact CG-CB 3.82Å; M101-D105 HydrophobicContact SD-CB 4.45Å; T102-D105 PolarHBondContact N-OD2 3.37Å; T102-D105 WeakPolarHBondContact O-CB 3.14Å; T102-D105 PolarHBondContact O-N 2.92Å; T102-D105 VanDerWaalsContact O-N 3.09Å; T102-D105 PolarHBondContact OG1-N 2.86Å; T102-D105 PolarHBondContact OG1-OD1 3.4Å; T102-D105 PolarHBondContact OG1-OD2 3.23Å; T102-D105 VanDerWaalsContact OG1-OD2 3.14Å; D105-F108 PolarHBondContact O-N 3.48Å; D105-S109 VanDerWaalsContact O-CB 3.29Å; D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 2.88Å
106	F	96.9	Very high	89.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.5	-55.3	174.6	169.7	-101.8	0	0	0	111.3	M101 T102 P103 R104 F108 S109 V110 F146 I155 Y160 L163 L164 L167 L256	M101-F106 HydrophobicContact SD-CB 4.43Å; T102-F106 PolarHBondContact O-N 3.47Å; P103-F106 PolarHBondContact O-N 3.24Å; R104-F106 VanDerWaalsContact C-N 3.26Å; R104-F106 PolarHBondContact O-N 3.21Å; F106-F108 VanDerWaalsContact C-N 3.27Å; F106-F108 PolarHBondContact O-N 2.98Å; F106-S109 PolarHBondContact O-N 3.12Å; F106-S109 VanDerWaalsContact O-N 3.12Å; F106-S109 PolarHBondContact O-OG 3.47Å; F106-V110 HydrophobicContact CD2-CG2 4.3Å; F106-V110 HydrophobicContact CE1-CG2 4.34Å; F106-V110 HydrophobicContact CE2-CG2 3.82Å; F106-V110 HydrophobicContact CZ-CG2 3.84Å; F106-V110 WeakPolarHBondContact O-CG2 3.32Å; F106-V110 PolarHBondContact O-N 3.2Å; F106-V110 VanDerWaalsContact O-N 3.15Å; F106-F146 HydrophobicContact CB-CD1 4.48Å; F106-F146 HydrophobicContact CB-CE1 4.42Å; F106-F146 AromaticContact CD1-CD1 3.51Å; F106-F146 HydrophobicContact CD1-CD1 3.51Å; F106-F146 AromaticContact CD1-CE1 3.48Å; F106-F146 HydrophobicContact CD1-CE1 3.48Å; F106-F146 VanDerWaalsContact CD1-CE1 3.48Å; F106-F146 HydrophobicContact CE1-CD1 4.2Å; F106-F146 HydrophobicContact CE1-CE1 4.02Å; F106-F146 HydrophobicContact CG-CD1 4.32Å; F106-F146 HydrophobicContact CG-CE1 4.08Å; F106-I155 HydrophobicContact CB-CD1 3.88Å; F106-I155 HydrophobicContact CG-CD1 4.47Å; F106-Y160 AromaticContact CD2-CD2 3.83Å; F106-Y160 HydrophobicContact CD2-CD2 3.83Å; F106-Y160 HydrophobicContact CD2-CE2 4.13Å; F106-Y160 HydrophobicContact CE2-CD2 4.26Å; F106-Y160 HydrophobicContact CE2-CE2 4.42Å; F106-L163 HydrophobicContact CD1-CD1 4.38Å; F106-L163 HydrophobicContact CD2-CB 4.21Å; F106-L163 HydrophobicContact CD2-CD1 3.9Å; F106-L163 HydrophobicContact CE1-CB 4.4Å; F106-L163 HydrophobicContact CE1-CD1 4.41Å; F106-L163 HydrophobicContact CE2-CB 3.41Å; F106-L163 VanDerWaalsContact CE2-CB 3.41Å; F106-L163 HydrophobicContact CE2-CD1 3.93Å; F106-L163 HydrophobicContact CE2-CG 4.3Å; F106-L163 HydrophobicContact CG-CD1 4.12Å; F106-L163 HydrophobicContact CZ-CB 3.52Å; F106-L163 HydrophobicContact CZ-CD1 4.19Å; F106-L163 HydrophobicContact CZ-CG 4.36Å; F106-L164 HydrophobicContact CE2-CD2 4.44Å; F106-L167 HydrophobicContact CZ-CD1 3.79Å; F106-L256 HydrophobicContact CE1-CD1 4.13Å; F106-L256 HydrophobicContact CE1-CD2 4.33Å; F106-L256 HydrophobicContact CZ-CD2 4.44Å
107	L	95.3	Very high	88.2	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-44.1	179.5	-70.2	175.8	0	0	0	111.1	P103 R104 S109 V110 M111 F146 R147 V260 M263	P103-L107 WeakPolarHBondContact O-CG 3.18Å; P103-L107 PolarHBondContact O-N 2.96Å; R104-L107 PolarHBondContact O-N 3.22Å; L107-S109 PolarHBondContact O-N 3.28Å; L107-V110 PolarHBondContact O-N 3.15Å; L107-M111 VanDerWaalsContact O-CB 3.29Å; L107-M111 WeakPolarHBondContact O-CB 3.34Å; L107-M111 WeakPolarHBondContact O-CG 3.04Å; L107-M111 PolarHBondContact O-N 2.63Å; L107-F146 HydrophobicContact CD1-CB 3.68Å; L107-F146 HydrophobicContact CD2-CB 4.05Å; L107-F146 HydrophobicContact CG-CB 3.88Å; L107-R147 HydrophobicContact CD1-CG 3.72Å; L107-V260 HydrophobicContact CD2-CG2 4.16Å; L107-M263 HydrophobicContact CB-CE 4.22Å; L107-M263 HydrophobicContact CB-SD 4.29Å; L107-M263 HydrophobicContact CD1-CE 4.38Å; L107-M263 HydrophobicContact CD1-SD 3.86Å; L107-M263 HydrophobicContact CD2-SD 3.91Å; L107-M263 HydrophobicContact CG-SD 4.24Å
108	F	93.4	Very high	86.8	Confident	49 Å²	49	57.4 Å²	57.4	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-35.9	-180	-79.8	18.4	0	0	0	112.3	F90 R104 D105 F106 V110 M111 F112	F90-F108 HydrophobicContact CD1-CB 3.91Å; F90-F108 HydrophobicContact CE1-CB 3.9Å; F90-F108 VanDerWaalsContact CE1-O 3.28Å; F90-F108 WeakPolarHBondContact CE1-O 3.14Å; R104-F108 HydrophobicContact CG-CD1 4.26Å; R104-F108 HydrophobicContact CG-CD2 4.41Å; R104-F108 HydrophobicContact CG-CE1 4.14Å; R104-F108 HydrophobicContact CG-CE2 4.3Å; R104-F108 HydrophobicContact CG-CG 4.41Å; R104-F108 HydrophobicContact CG-CZ 4.17Å; R104-F108 WeakPolarHBondContact O-CB 3.43Å; R104-F108 PolarHBondContact O-N 3.22Å; D105-F108 PolarHBondContact O-N 3.48Å; F106-F108 VanDerWaalsContact C-N 3.27Å; F106-F108 PolarHBondContact O-N 2.98Å; F108-V110 PolarHBondContact O-N 3.21Å; F108-M111 PolarHBondContact O-N 3.05Å; F108-F112 HydrophobicContact CB-CD2 3.89Å; F108-F112 HydrophobicContact CB-CE2 4.28Å; F108-F112 HydrophobicContact CD1-CD2 4.15Å; F108-F112 AromaticContact CD1-CE2 3.65Å; F108-F112 HydrophobicContact CD1-CE2 3.65Å; F108-F112 HydrophobicContact CD2-CD2 4.25Å; F108-F112 HydrophobicContact CD2-CE2 4.12Å; F108-F112 AromaticContact CE1-CE2 3.89Å; F108-F112 HydrophobicContact CE1-CE2 3.89Å; F108-F112 HydrophobicContact CE2-CE2 4.33Å; F108-F112 AromaticContact CG-CD2 3.86Å; F108-F112 HydrophobicContact CG-CD2 3.86Å; F108-F112 AromaticContact CG-CE2 3.76Å; F108-F112 HydrophobicContact CG-CE2 3.76Å; F108-F112 HydrophobicContact CZ-CE2 4.22Å; F108-F112 PolarHBondContact O-N 3.28Å
109	S	93.7	Very high	85.5	Confident	3 Å²	3	56 Å²	56	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-29.5	176.7	79	0	0	0	0	112.6	R86 D105 F106 L107 Y160	R86-S109 WeakPolarHBondContact CD-O 3.37Å; R86-S109 PolarHBondContact NE-O 3Å; D105-S109 VanDerWaalsContact O-CB 3.29Å; D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 2.88Å; F106-S109 PolarHBondContact O-N 3.12Å; F106-S109 VanDerWaalsContact O-N 3.12Å; F106-S109 PolarHBondContact O-OG 3.47Å; L107-S109 PolarHBondContact O-N 3.28Å; S109-Y160 WeakPolarHBondContact OG-CE2 3.28Å
110	V	92.5	Very high	85	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-82.5	-36.6	177	173.9	0	0	0	0	110.5	F106 L107 F108 L164 L167 V260 R394	F106-V110 HydrophobicContact CD2-CG2 4.3Å; F106-V110 HydrophobicContact CE1-CG2 4.34Å; F106-V110 HydrophobicContact CE2-CG2 3.82Å; F106-V110 HydrophobicContact CZ-CG2 3.84Å; F106-V110 WeakPolarHBondContact O-CG2 3.32Å; F106-V110 PolarHBondContact O-N 3.2Å; F106-V110 VanDerWaalsContact O-N 3.15Å; L107-V110 PolarHBondContact O-N 3.15Å; F108-V110 PolarHBondContact O-N 3.21Å; V110-L164 HydrophobicContact CG2-CD2 4.05Å; V110-L167 HydrophobicContact CG1-CD1 3.91Å; V110-L167 HydrophobicContact CG2-CD1 3.98Å; V110-V260 HydrophobicContact CG1-CG1 3.69Å; V110-V260 HydrophobicContact CG1-CG2 4.42Å; V110-R394 VanDerWaalsContact CG1-NE 3.33Å; V110-R394 WeakPolarHBondContact O-CD 3.24Å
111	M	89.1	Confident	84.7	Confident	16 Å²	16	61.3 Å²	61.3	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-85.3	-35.4	-173.3	-72.5	-64.4	-52.8	0	0	114.8	L107 F108 M263 E264 Q267	L107-M111 VanDerWaalsContact O-CB 3.29Å; L107-M111 WeakPolarHBondContact O-CB 3.34Å; L107-M111 WeakPolarHBondContact O-CG 3.04Å; L107-M111 PolarHBondContact O-N 2.63Å; F108-M111 PolarHBondContact O-N 3.05Å; M111-M263 HydrophobicContact CE-CB 3.93Å; M111-M263 WeakPolarHBondContact CE-O 3.26Å; M111-M263 HydrophobicContact CG-CB 4.41Å; M111-M263 HydrophobicContact CG-CE 3.97Å; M111-M263 HydrophobicContact SD-CB 3.62Å; M111-E264 HydrophobicContact CE-CG 4.08Å; M111-E264 HydrophobicContact SD-CB 4.45Å; M111-E264 HydrophobicContact SD-CG 3.53Å; M111-E264 VanDerWaalsContact SD-CG 3.53Å; M111-Q267 HydrophobicContact CE-CB 3.85Å; M111-Q267 HydrophobicContact CE-CG 4.24Å
112	F	85.8	Confident	84.6	Confident	42 Å²	42	67.2 Å²	67.2	18%	0.184	32%	0.316	C	S	.	.			trans	-118.6	141.4	-170.3	-57.5	-63.2	0	0	0	110.9	R86 F90 F108	R86-F112 PolarHBondContact NH2-O 3.06Å; F90-F112 HydrophobicContact CE1-CB 4.5Å; F90-F112 HydrophobicContact CZ-CB 4.41Å; F108-F112 HydrophobicContact CB-CD2 3.89Å; F108-F112 HydrophobicContact CB-CE2 4.28Å; F108-F112 HydrophobicContact CD1-CD2 4.15Å; F108-F112 AromaticContact CD1-CE2 3.65Å; F108-F112 HydrophobicContact CD1-CE2 3.65Å; F108-F112 HydrophobicContact CD2-CD2 4.25Å; F108-F112 HydrophobicContact CD2-CE2 4.12Å; F108-F112 AromaticContact CE1-CE2 3.89Å; F108-F112 HydrophobicContact CE1-CE2 3.89Å; F108-F112 HydrophobicContact CE2-CE2 4.33Å; F108-F112 AromaticContact CG-CD2 3.86Å; F108-F112 HydrophobicContact CG-CD2 3.86Å; F108-F112 AromaticContact CG-CE2 3.76Å; F108-F112 HydrophobicContact CG-CE2 3.76Å; F108-F112 HydrophobicContact CZ-CE2 4.22Å; F108-F112 PolarHBondContact O-N 3.28Å
113	E	78.7	Confident	84.5	Confident	109 Å²	109	73.9 Å²	73.9	51%	0.509	35%	0.345	S	S	.	.	S	Bend	trans	-77.2	-27.4	176.3	-171.3	-174.2	-179.6	0	0	112.9	R86 F286	R86-E113 PolarHBondContact NH1-O 2.74Å; R86-E113 VanDerWaalsContact NH2-CA 3.26Å; R86-E113 PolarHBondContact NH2-O 2.89Å; E113-F286 HydrophobicContact CB-CE1 4.36Å; E113-F286 HydrophobicContact CB-CZ 4.5Å
114	Q	73.9	Confident	84.3	Confident	119 Å²	119	74.5 Å²	74.5	56%	0.556	35%	0.348	S	S	*	.	S	Bend	trans	-133	149	177.3	-63.3	-63.6	-20.3	0	0	110	E116	Q114-E116 PolarHBondContact O-N 3.06Å
115	V	70.7	Confident	84.3	Confident	46 Å²	46	73.2 Å²	73.2	28%	0.279	36%	0.355	S	S	.	.			trans	-73.7	110.4	171.6	173	0	0	0	0	108.7	Q89 F90 R117	Q89-V115 HydrophobicContact CG-CG2 3.78Å; Q89-V115 WeakPolarHBondContact O-CG2 3.45Å; F90-V115 HydrophobicContact CB-CG2 4.45Å; F90-V115 HydrophobicContact CD1-CG2 3.61Å; F90-V115 HydrophobicContact CD2-CG2 3.51Å; F90-V115 HydrophobicContact CE1-CG2 3.52Å; F90-V115 HydrophobicContact CE2-CG2 3.4Å; F90-V115 HydrophobicContact CG-CG2 3.6Å; F90-V115 HydrophobicContact CZ-CB 4.42Å; F90-V115 HydrophobicContact CZ-CG2 3.42Å; F90-V115 VanDerWaalsContact CZ-CG2 3.42Å; V115-R117 VanDerWaalsContact C-N 3.28Å; V115-R117 VanDerWaalsContact CG1-C 3.49Å; V115-R117 WeakPolarHBondContact CG1-O 3.05Å
116	E	65.7	Low	84.1	Confident	131 Å²	131	78.2 Å²	78.2	61%	0.612	38%	0.376	S	S	*	.	S	Bend	trans	-74.3	-24.1	173.9	-62.3	-171.8	161.7	0	0	112.2	Q114	Q114-E116 PolarHBondContact O-N 3.06Å
117	R	61.1	Low	83.9	Confident	154 Å²	154	86.1 Å²	86.1	58%	0.581	41%	0.41	S	S	*	.	S	Bend	trans	-110.8	108	-176.3	-63.8	-178.8	-176.5	158.1	2.7	109.9	V115 T119	V115-R117 VanDerWaalsContact C-N 3.28Å; V115-R117 VanDerWaalsContact CG1-C 3.49Å; V115-R117 WeakPolarHBondContact CG1-O 3.05Å; R117-T119 PolarHBondContact O-N 2.91Å; R117-T119 PolarHBondContact O-OG1 2.72Å
118	K	60.6	Low	83.8	Confident	212 Å²	212	88.9 Å²	88.9	92%	0.922	43%	0.425	S	S	*	.			trans	-66	78.1	165.7	-69.8	-176.9	179.6	179.1	0	109	L120	K118-L120 PolarHBondContact O-N 3.17Å
119	T	66	Low	83.7	Confident	84 Å²	84	86.7 Å²	86.7	52%	0.515	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-69	124.6	174	-46	0	0	0	0	106.9	R117 V121	R117-T119 PolarHBondContact O-N 2.91Å; R117-T119 PolarHBondContact O-OG1 2.72Å; T119-V121 PolarHBondContact O-N 2.75Å
120	L	83.1	Confident	83.6	Confident	160 Å²	160	90.3 Å²	90.3	84%	0.838	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-60.6	132.1	169.7	-73.4	166	0	0	0	108	K118 K122	K118-L120 PolarHBondContact O-N 3.17Å; L120-K122 PolarHBondContact O-N 2.94Å
121	V	91.3	Very high	83.6	Confident	58 Å²	58	95.3 Å²	95.3	35%	0.352	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-66.6	116.5	176.1	179.6	0	0	0	0	108.3	S92 E94 Y99 T119	S92-V121 CarbonylContact O-C 3.56Å; S92-V121 WeakPolarHBondContact O-CA 3.41Å; E94-V121 HydrophobicContact CB-CG1 3.57Å; Y99-V121 HydrophobicContact CD1-CG1 4.31Å; Y99-V121 HydrophobicContact CE1-CG1 4.05Å; Y99-V121 HydrophobicContact CE1-CG2 4.19Å; T119-V121 PolarHBondContact O-N 2.75Å
122	K	93.8	Very high	83.7	Confident	124 Å²	124	96.5 Å²	96.5	54%	0.539	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.2	178.2	-175.3	-179.3	177.7	-173.8	0	109.2	S92 L93 E94 L120 L124	S92-K122 PolarHBondContact O-N 3.25Å; L93-K122 WeakPolarHBondContact CA-O 3.28Å; L93-K122 HydrophobicContact CD2-CB 4.11Å; E94-K122 PolarHBondContact N-O 3.28Å; L120-K122 PolarHBondContact O-N 2.94Å; K122-L124 HydrophobicContact CD-CD2 3.82Å; K122-L124 HydrophobicContact CG-CD2 3.95Å
123	K	94.7	Very high	84	Confident	143 Å²	143	95 Å²	95	62%	0.622	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	130.5	170.2	-61.8	-168.4	-177.5	-116.2	0	109.8	E94	E94-K123 HydrophobicContact CB-CG 4.41Å; E94-K123 VanDerWaalsContact CD-NZ 3.33Å; E94-K123 CarbonylContact O-C 3.53Å; E94-K123 WeakPolarHBondContact O-CA 3.38Å; E94-K123 IonicContact OE1-NZ 2.76Å; E94-K123 PolarHBondContact OE1-NZ 3.37Å; E94-K123 WeakPolarHBondContact OE2-CE 3.4Å; E94-K123 IonicContact OE2-NZ 3.13Å; E94-K123 PolarHBondContact OE2-NZ 3.34Å; E94-K123 VanDerWaalsContact OE2-NZ 3.13Å
124	L	93.4	Very high	84.5	Confident	13 Å²	13	94 Å²	94	7%	0.068	47%	0.465	C	S	.	.			trans	-114.3	133.8	179.3	-60	-178.3	0	0	0	109.6	L93 E94 H95 K122 D128 I129	L93-L124 HydrophobicContact CB-CD1 4.22Å; L93-L124 HydrophobicContact CD1-CD1 3.99Å; L93-L124 HydrophobicContact CD2-CD1 4Å; L93-L124 HydrophobicContact CD2-CG 4.39Å; L93-L124 HydrophobicContact CG-CD1 4.29Å; E94-L124 PolarHBondContact O-N 3.46Å; H95-L124 PolarHBondContact ND1-O 2.69Å; K122-L124 HydrophobicContact CD-CD2 3.82Å; K122-L124 HydrophobicContact CG-CD2 3.95Å; L124-D128 HydrophobicContact CB-CB 4.19Å; L124-D128 HydrophobicContact CD2-CB 3.92Å; L124-I129 HydrophobicContact CB-CD1 4.4Å; L124-I129 HydrophobicContact CB-CG1 4Å; L124-I129 HydrophobicContact CD1-CG1 3.94Å
125	A	93.8	Very high	85	Confident	54 Å²	54	90.1 Å²	90.1	45%	0.446	46%	0.458	S	S	.	.			trans	-79.3	164.4	160.3	0	0	0	0	0	109.9	K127 D128 I129	A125-K127 PolarHBondContact O-N 3.26Å; A125-D128 WeakPolarHBondContact CB-OD2 3.45Å; A125-D128 PolarHBondContact N-OD2 3.35Å; A125-D128 WeakPolarHBondContact O-CB 3.38Å; A125-D128 PolarHBondContact O-N 3.1Å; A125-I129 PolarHBondContact O-N 2.96Å
126	K	92.1	Very high	85.8	Confident	117 Å²	117	88 Å²	88	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-55.3	-37.1	177.5	-175.4	172.3	179.7	171.7	0	112.9	I129 E130 V227	K126-I129 PolarHBondContact O-N 3.01Å; K126-E130 PolarHBondContact O-N 2.83Å; K126-E130 VanDerWaalsContact O-N 3.08Å; K126-V227 HydrophobicContact CG-CG1 4.4Å
127	K	92.8	Very high	86.3	Confident	165 Å²	165	85.7 Å²	85.7	72%	0.717	43%	0.434	S	S	*	.	H	α-helix	trans	-63.9	-43.5	176.6	-67.1	-177.3	179.8	178.4	0	112.1	A125 I129 E130 D131	A125-K127 PolarHBondContact O-N 3.26Å; K127-I129 PolarHBondContact O-N 3.41Å; K127-E130 PolarHBondContact O-N 3.29Å; K127-E130 VanDerWaalsContact O-N 3.09Å; K127-D131 PolarHBondContact O-N 3.23Å
128	D	93.3	Very high	87.1	Confident	63 Å²	63	84.4 Å²	84.4	34%	0.337	44%	0.443	S	S	.	.	H	α-helix	trans	-60	-38.4	177.5	-56.8	-57.4	0	0	0	111.4	L124 A125 D131 V132	L124-D128 HydrophobicContact CB-CB 4.19Å; L124-D128 HydrophobicContact CD2-CB 3.92Å; A125-D128 WeakPolarHBondContact CB-OD2 3.45Å; A125-D128 PolarHBondContact N-OD2 3.35Å; A125-D128 WeakPolarHBondContact O-CB 3.38Å; A125-D128 PolarHBondContact O-N 3.1Å; D128-D131 PolarHBondContact O-N 3.39Å; D128-V132 WeakPolarHBondContact O-CB 3.17Å; D128-V132 VanDerWaalsContact O-CG2 3.23Å; D128-V132 WeakPolarHBondContact O-CG2 3.43Å; D128-V132 PolarHBondContact O-N 3.12Å
129	I	92.5	Very high	88.1	Confident	3 Å²	3	75.7 Å²	75.7	2%	0.015	41%	0.411	C	S	.	.	H	α-helix	trans	-64.5	-47	175.6	-65.7	171	0	0	0	110.3	H95 L124 A125 K126 K127 D131 V132 L133 V154 V227	H95-I129 HydrophobicContact CB-CD1 3.75Å; H95-I129 VanDerWaalsContact CG-CD1 3.42Å; L124-I129 HydrophobicContact CB-CD1 4.4Å; L124-I129 HydrophobicContact CB-CG1 4Å; L124-I129 HydrophobicContact CD1-CG1 3.94Å; A125-I129 PolarHBondContact O-N 2.96Å; K126-I129 PolarHBondContact O-N 3.01Å; K127-I129 PolarHBondContact O-N 3.41Å; I129-D131 VanDerWaalsContact C-N 3.29Å; I129-D131 PolarHBondContact O-N 3.12Å; I129-V132 PolarHBondContact O-N 3.31Å; I129-L133 HydrophobicContact CG2-CD1 3.63Å; I129-L133 HydrophobicContact CG2-CG 4.2Å; I129-L133 WeakPolarHBondContact O-CB 3.5Å; I129-L133 WeakPolarHBondContact O-CG 3.36Å; I129-L133 PolarHBondContact O-N 2.96Å; I129-V154 HydrophobicContact CG2-CG2 4.26Å; I129-V227 HydrophobicContact CD1-CB 4.21Å; I129-V227 HydrophobicContact CD1-CG1 3.94Å; I129-V227 HydrophobicContact CD1-CG2 4.14Å; I129-V227 HydrophobicContact CG2-CB 4.35Å
130	E	91.8	Very high	88.8	Confident	79 Å²	79	82.3 Å²	82.3	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-39.6	177.8	-70.3	-169	-145.2	0	0	112.5	K126 K127 L133 S134 K238	K126-E130 PolarHBondContact O-N 2.83Å; K126-E130 VanDerWaalsContact O-N 3.08Å; K127-E130 PolarHBondContact O-N 3.29Å; K127-E130 VanDerWaalsContact O-N 3.09Å; E130-L133 PolarHBondContact O-N 3.44Å; E130-S134 PolarHBondContact O-N 3.1Å; E130-K238 IonicContact OE2-NZ 3.99Å; E130-K238 PolarHBondContact OE2-NZ 3.13Å
131	D	91.8	Very high	88.6	Confident	110 Å²	110	76.3 Å²	76.3	59%	0.588	40%	0.398	S	S	*	.	H	α-helix	trans	-66.7	-45.5	177.6	-68.9	-21.4	0	0	0	111.5	K127 D128 I129 L133 S134	K127-D131 PolarHBondContact O-N 3.23Å; D128-D131 PolarHBondContact O-N 3.39Å; I129-D131 VanDerWaalsContact C-N 3.29Å; I129-D131 PolarHBondContact O-N 3.12Å; D131-L133 VanDerWaalsContact C-N 3.29Å; D131-L133 PolarHBondContact O-N 2.94Å; D131-S134 WeakPolarHBondContact O-CB 3.18Å; D131-S134 PolarHBondContact O-N 2.66Å; D131-S134 PolarHBondContact O-OG 3.05Å
132	V	91.7	Very high	88.5	Confident	41 Å²	41	74.7 Å²	74.7	25%	0.248	39%	0.393	C	S	.	.	H	α-helix	trans	-59.5	-40.4	175.4	167.7	0	0	0	0	111.4	D128 I129 V154	D128-V132 WeakPolarHBondContact O-CB 3.17Å; D128-V132 VanDerWaalsContact O-CG2 3.23Å; D128-V132 WeakPolarHBondContact O-CG2 3.43Å; D128-V132 PolarHBondContact O-N 3.12Å; I129-V132 PolarHBondContact O-N 3.31Å; V132-V154 HydrophobicContact CG1-CG2 4.39Å
133	L	91.8	Very high	88.4	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.052	38%	0.38	C	S	.	.	H	α-helix	trans	-80.4	-15.2	-177.1	-61.4	174.1	0	0	0	113.7	I129 E130 D131 G135 I136 V154 N228 V233	I129-L133 HydrophobicContact CG2-CD1 3.63Å; I129-L133 HydrophobicContact CG2-CG 4.2Å; I129-L133 WeakPolarHBondContact O-CB 3.5Å; I129-L133 WeakPolarHBondContact O-CG 3.36Å; I129-L133 PolarHBondContact O-N 2.96Å; E130-L133 PolarHBondContact O-N 3.44Å; D131-L133 VanDerWaalsContact C-N 3.29Å; D131-L133 PolarHBondContact O-N 2.94Å; L133-G135 VanDerWaalsContact C-N 3.28Å; L133-G135 PolarHBondContact O-N 3.14Å; L133-I136 HydrophobicContact CB-CD1 4.12Å; L133-I136 HydrophobicContact CD2-CD1 3.28Å; L133-I136 HydrophobicContact CG-CD1 4.25Å; L133-I136 WeakPolarHBondContact O-CB 3.46Å; L133-I136 PolarHBondContact O-N 3.15Å; L133-I136 VanDerWaalsContact O-N 3.17Å; L133-V154 HydrophobicContact CD2-CB 4.4Å; L133-V154 HydrophobicContact CD2-CG2 4.46Å; L133-N228 HydrophobicContact CD1-CB 3.79Å; L133-N228 VanDerWaalsContact CD1-O 3.29Å; L133-N228 WeakPolarHBondContact CD1-O 3.05Å; L133-V233 HydrophobicContact CB-CG2 4.38Å; L133-V233 HydrophobicContact CD1-CG2 4.11Å
134	S	88.9	Confident	88.4	Confident	87 Å²	87	66.1 Å²	66.1	61%	0.608	37%	0.365	S	S	*	.	H	α-helix	trans	-58	-36.3	-176	68.4	0	0	0	0	113.5	E130 D131	E130-S134 PolarHBondContact O-N 3.1Å; D131-S134 WeakPolarHBondContact O-CB 3.18Å; D131-S134 PolarHBondContact O-N 2.66Å; D131-S134 PolarHBondContact O-OG 3.05Å
135	G	84.2	Confident	88.5	Confident	38 Å²	38	65.8 Å²	65.8	39%	0.392	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-6	-179.2	0	0	0	0	0	115.5	L133 Q137 T138 A139	L133-G135 VanDerWaalsContact C-N 3.28Å; L133-G135 PolarHBondContact O-N 3.14Å; G135-Q137 PolarHBondContact O-N 3.21Å; G135-T138 PolarHBondContact O-OG1 3.32Å; G135-A139 PolarHBondContact O-N 2.9Å
136	I	86.5	Confident	88.7	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.7	-172.3	-66.8	173	0	0	0	112	L133 T138 A139 L149 T230 V233 R234	L133-I136 HydrophobicContact CB-CD1 4.12Å; L133-I136 HydrophobicContact CD2-CD1 3.28Å; L133-I136 HydrophobicContact CG-CD1 4.25Å; L133-I136 WeakPolarHBondContact O-CB 3.46Å; L133-I136 PolarHBondContact O-N 3.15Å; L133-I136 VanDerWaalsContact O-N 3.17Å; I136-T138 VanDerWaalsContact C-N 3.29Å; I136-T138 PolarHBondContact O-N 3.48Å; I136-A139 PolarHBondContact O-N 3.39Å; I136-L149 HydrophobicContact CG1-CD2 4.31Å; I136-T230 HydrophobicContact CD1-CG2 4.03Å; I136-V233 HydrophobicContact CB-CG1 4.39Å; I136-V233 HydrophobicContact CG2-CG1 4.44Å; I136-R234 HydrophobicContact CG2-CB 4.06Å
137	Q	77.1	Confident	88.8	Confident	84 Å²	84	61.2 Å²	61.2	39%	0.393	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-28	-177.2	-64.9	-172.8	43.7	0	0	113	G135 V233	G135-Q137 PolarHBondContact O-N 3.21Å; Q137-V233 HydrophobicContact CG-CG1 3.73Å
138	T	77.6	Confident	88.9	Confident	126 Å²	126	58.5 Å²	58.5	77%	0.773	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.2	179.3	54.8	0	0	0	0	112.7	G135 I136	G135-T138 PolarHBondContact O-OG1 3.32Å; I136-T138 VanDerWaalsContact C-N 3.29Å; I136-T138 PolarHBondContact O-N 3.48Å
139	A	81.5	Confident	89	Confident	30 Å²	30	56.1 Å²	56.1	25%	0.248	31%	0.311	C	S	.	.	S	Bend	trans	-65.8	136.4	178.9	0	0	0	0	0	111.3	G135 I136 C141 F145 L149	G135-A139 PolarHBondContact O-N 2.9Å; I136-A139 PolarHBondContact O-N 3.39Å; A139-C141 PolarHBondContact O-N 3.3Å; A139-F145 HydrophobicContact CB-CE2 4.1Å; A139-L149 HydrophobicContact CB-CD2 4.18Å
140	R	81.3	Confident	89	Confident	222 Å²	222	56.1 Å²	56.1	84%	0.838	31%	0.312	S	S	*	.			trans	-63.6	134.7	173.9	-68.7	-176.7	178.7	-177.4	-0.3	109.4	F145	R140-F145 WeakPolarHBondContact O-CD2 3.46Å
141	C	79.4	Confident	89.1	Confident	34 Å²	34	56.6 Å²	56.6	23%	0.23	32%	0.317	C	S	.	.			trans	-106.5	96.2	179.6	-169.4	0	0	0	0	109.2	A139	A139-C141 PolarHBondContact O-N 3.3Å
142	G	89.5	Confident	89.1	Confident	24 Å²	24	58.2 Å²	58.2	25%	0.247	32%	0.319	C	S	.	.	S	Bend	trans	-135.2	-165.4	177	0	0	0	0	0	111.5	T144 F145	G142-T144 PolarHBondContact O-N 3.23Å; G142-T144 VanDerWaalsContact O-N 3.15Å; G142-F145 WeakPolarHBondContact O-CB 3.26Å; G142-F145 PolarHBondContact O-N 3.25Å
143	S	91.3	Very high	89.3	Confident	40 Å²	40	56.3 Å²	56.3	28%	0.28	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	6.1	178	56.5	0	0	0	0	114.6	R147 E259	S143-R147 PolarHBondContact O-NH2 3.41Å; S143-R147 VanDerWaalsContact O-NH2 3.12Å; S143-E259 WeakPolarHBondContact O-CA 3.3Å; S143-E259 WeakPolarHBondContact O-CB 3.43Å; S143-E259 WeakPolarHBondContact O-CG 3.45Å
144	T	94.6	Very high	89.5	Confident	48 Å²	48	55.9 Å²	55.9	29%	0.294	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	11.1	175.5	53.1	0	0	0	0	111.9	G142 F146 R147 D148 E259	G142-T144 PolarHBondContact O-N 3.23Å; G142-T144 VanDerWaalsContact O-N 3.15Å; T144-F146 PolarHBondContact O-N 3.46Å; T144-R147 PolarHBondContact O-N 2.96Å; T144-R147 VanDerWaalsContact O-N 3.15Å; T144-D148 WeakPolarHBondContact CB-OD2 3.36Å; T144-D148 WeakPolarHBondContact O-CB 2.96Å; T144-D148 PolarHBondContact O-N 3.35Å; T144-D148 PolarHBondContact OG1-OD2 3.12Å; T144-E259 WeakPolarHBondContact CA-OE1 3.44Å
145	F	95.5	Very high	89.9	Confident	5 Å²	5	51.7 Å²	51.7	2%	0.022	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-45.4	-168	176.2	-119.4	0	0	0	113.1	A139 R140 G142 L149 R234 F252 E259	A139-F145 HydrophobicContact CB-CE2 4.1Å; R140-F145 WeakPolarHBondContact O-CD2 3.46Å; G142-F145 WeakPolarHBondContact O-CB 3.26Å; G142-F145 PolarHBondContact O-N 3.25Å; F145-L149 HydrophobicContact CD1-CD1 4.43Å; F145-L149 HydrophobicContact CD2-CD1 4.35Å; F145-L149 HydrophobicContact CD2-CG 4.35Å; F145-L149 HydrophobicContact CE1-CD1 3.86Å; F145-L149 HydrophobicContact CE2-CD1 3.79Å; F145-L149 HydrophobicContact CE2-CD2 4.33Å; F145-L149 HydrophobicContact CE2-CG 4.03Å; F145-L149 HydrophobicContact CZ-CD1 3.51Å; F145-L149 HydrophobicContact CZ-CG 4.28Å; F145-L149 WeakPolarHBondContact O-CG 3.44Å; F145-L149 PolarHBondContact O-N 3.21Å; F145-R234 HydrophobicContact CE1-CG 4.45Å; F145-R234 HydrophobicContact CZ-CG 4.07Å; F145-F252 HydrophobicContact CD1-CE2 4.27Å; F145-F252 HydrophobicContact CE1-CE2 4.34Å; F145-E259 PolarHBondContact N-OE1 3.08Å; F145-E259 PolarHBondContact N-OE2 3.46Å
146	F	96.7	Very high	90.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-72.9	-37.1	-179.6	-82.4	-123.3	0	0	0	111.8	P103 F106 L107 T144 D148 G150 I155 L163 L231 F252 L256 E259	P103-F146 HydrophobicContact CB-CB 4.1Å; P103-F146 HydrophobicContact CB-CD1 3.74Å; P103-F146 HydrophobicContact CB-CE1 4.48Å; P103-F146 HydrophobicContact CB-CG 4.1Å; F106-F146 HydrophobicContact CB-CD1 4.48Å; F106-F146 HydrophobicContact CB-CE1 4.42Å; F106-F146 AromaticContact CD1-CD1 3.51Å; F106-F146 HydrophobicContact CD1-CD1 3.51Å; F106-F146 AromaticContact CD1-CE1 3.48Å; F106-F146 HydrophobicContact CD1-CE1 3.48Å; F106-F146 VanDerWaalsContact CD1-CE1 3.48Å; F106-F146 HydrophobicContact CE1-CD1 4.2Å; F106-F146 HydrophobicContact CE1-CE1 4.02Å; F106-F146 HydrophobicContact CG-CD1 4.32Å; F106-F146 HydrophobicContact CG-CE1 4.08Å; L107-F146 HydrophobicContact CD1-CB 3.68Å; L107-F146 HydrophobicContact CD2-CB 4.05Å; L107-F146 HydrophobicContact CG-CB 3.88Å; T144-F146 PolarHBondContact O-N 3.46Å; F146-D148 VanDerWaalsContact C-N 3.35Å; F146-G150 PolarHBondContact O-N 3.39Å; F146-I155 HydrophobicContact CD1-CD1 4.33Å; F146-I155 HydrophobicContact CE1-CD1 3.64Å; F146-I155 HydrophobicContact CZ-CD1 4.45Å; F146-L163 HydrophobicContact CE1-CD1 3.88Å; F146-L163 HydrophobicContact CE1-CD2 4.45Å; F146-L163 HydrophobicContact CZ-CD1 3.96Å; F146-L163 HydrophobicContact CZ-CD2 3.8Å; F146-L231 HydrophobicContact CZ-CD2 4.31Å; F146-F252 HydrophobicContact CE2-CE2 4.02Å; F146-F252 AromaticContact CE2-CZ 3.99Å; F146-F252 HydrophobicContact CE2-CZ 3.99Å; F146-F252 HydrophobicContact CZ-CZ 4.31Å; F146-L256 HydrophobicContact CD1-CD1 4.44Å; F146-L256 HydrophobicContact CD2-CD1 3.69Å; F146-L256 HydrophobicContact CE1-CD1 4.45Å; F146-L256 HydrophobicContact CE2-CD1 3.74Å; F146-L256 HydrophobicContact CG-CD1 4.08Å; F146-L256 HydrophobicContact CZ-CD1 4.14Å; F146-E259 PolarHBondContact N-OE1 3.39Å; F146-E259 PolarHBondContact N-OE2 3.19Å; F146-E259 VanDerWaalsContact N-OE2 3.1Å
147	R	94.6	Very high	90.8	Very high	75 Å²	75	52.6 Å²	52.6	28%	0.283	27%	0.271	S	S	.	.	H	α-helix	trans	-62	-42.8	174.4	-72.2	-173.6	-64.5	-118.5	12.6	111.6	L107 S143 T144 G150 E259 E262 M263	L107-R147 HydrophobicContact CD1-CG 3.72Å; S143-R147 PolarHBondContact O-NH2 3.41Å; S143-R147 VanDerWaalsContact O-NH2 3.12Å; T144-R147 PolarHBondContact O-N 2.96Å; T144-R147 VanDerWaalsContact O-N 3.15Å; R147-G150 PolarHBondContact O-N 3.21Å; R147-E259 WeakPolarHBondContact CB-OE1 3.35Å; R147-E259 HydrophobicContact CG-CG 4.44Å; R147-E259 VanDerWaalsContact CG-OE1 3.28Å; R147-E259 WeakPolarHBondContact CG-OE1 3.46Å; R147-E259 PolarHBondContact N-OE1 2.92Å; R147-E259 IonicContact NE-OE1 3.47Å; R147-E259 PolarHBondContact NH1-O 2.86Å; R147-E262 IonicContact NH2-OE2 2.66Å; R147-E262 PolarHBondContact NH2-OE2 3.45Å; R147-M263 HydrophobicContact CG-SD 4.01Å; R147-M263 VanDerWaalsContact NH1-CG 3.3Å
148	D	95	Very high	91.5	Very high	108 Å²	108	50.9 Å²	50.9	58%	0.578	27%	0.266	S	S	*	.	H	α-helix	trans	-70.3	-38.2	-178.7	-66.6	-20	0	0	0	111.6	T144 F146	T144-D148 WeakPolarHBondContact CB-OD2 3.36Å; T144-D148 WeakPolarHBondContact O-CB 2.96Å; T144-D148 PolarHBondContact O-N 3.35Å; T144-D148 PolarHBondContact OG1-OD2 3.12Å; F146-D148 VanDerWaalsContact C-N 3.35Å
149	L	94.7	Very high	92.3	Very high	13 Å²	13	44.9 Å²	44.9	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-42.3	171.3	-71.9	-178.9	0	0	0	111.4	P103 I136 A139 F145 D151 K152 T230	P103-L149 HydrophobicContact CB-CB 4.03Å; P103-L149 HydrophobicContact CB-CD1 4.48Å; P103-L149 HydrophobicContact CG-CB 3.81Å; P103-L149 HydrophobicContact CG-CD1 3.85Å; I136-L149 HydrophobicContact CG1-CD2 4.31Å; A139-L149 HydrophobicContact CB-CD2 4.18Å; F145-L149 HydrophobicContact CD1-CD1 4.43Å; F145-L149 HydrophobicContact CD2-CD1 4.35Å; F145-L149 HydrophobicContact CD2-CG 4.35Å; F145-L149 HydrophobicContact CE1-CD1 3.86Å; F145-L149 HydrophobicContact CE2-CD1 3.79Å; F145-L149 HydrophobicContact CE2-CD2 4.33Å; F145-L149 HydrophobicContact CE2-CG 4.03Å; F145-L149 HydrophobicContact CZ-CD1 3.51Å; F145-L149 HydrophobicContact CZ-CG 4.28Å; F145-L149 WeakPolarHBondContact O-CG 3.44Å; F145-L149 PolarHBondContact O-N 3.21Å; L149-D151 PolarHBondContact O-N 3.39Å; L149-K152 VanDerWaalsContact O-CB 3.27Å; L149-K152 WeakPolarHBondContact O-CB 3.41Å; L149-K152 PolarHBondContact O-N 3.05Å; L149-T230 HydrophobicContact CD1-CG2 3.91Å
150	G	93.4	Very high	93	Very high	4 Å²	4	43.4 Å²	43.4	4%	0.041	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	-111	-177.6	0	0	0	0	0	111.2	P103 R104 F146 R147 K152	P103-G150 WeakPolarHBondContact CB-O 3.33Å; P103-G150 WeakPolarHBondContact CD-O 3.05Å; R104-G150 WeakPolarHBondContact CB-O 3.37Å; R104-G150 PolarHBondContact N-O 2.94Å; F146-G150 PolarHBondContact O-N 3.39Å; R147-G150 PolarHBondContact O-N 3.21Å; G150-K152 VanDerWaalsContact C-N 3.34Å
151	D	93.3	Very high	93.6	Very high	89 Å²	89	32.9 Å²	32.9	48%	0.476	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-1.3	-179.1	-48.7	-65.5	0	0	0	112.7	T102 R104 L149 G153	T102-D151 HydrophobicContact CG2-CB 4.35Å; R104-D151 WeakPolarHBondContact CD-OD1 3.36Å; R104-D151 IonicContact CZ-OD1 2.88Å; R104-D151 IonicContact CZ-OD2 3.57Å; R104-D151 IonicContact NE-OD1 2.89Å; R104-D151 PolarHBondContact NE-OD1 2.96Å; R104-D151 IonicContact NE-OD2 2.68Å; R104-D151 PolarHBondContact NE-OD2 2.86Å; R104-D151 VanDerWaalsContact NE-OD2 3.16Å; R104-D151 IonicContact NH2-OD1 3.16Å; R104-D151 IonicContact NH2-OD2 2.92Å; R104-D151 PolarHBondContact NH2-OD2 3.32Å; L149-D151 PolarHBondContact O-N 3.39Å; D151-G153 PolarHBondContact O-N 3.33Å
152	K	92.6	Very high	94.2	Very high	144 Å²	144	31.2 Å²	31.2	63%	0.626	17%	0.166	S	C	*	.	S	Bend	trans	-90.8	72.5	-179.3	-59.2	179.2	-178.3	177.1	0	111.3	L149 G150	L149-K152 VanDerWaalsContact O-CB 3.27Å; L149-K152 WeakPolarHBondContact O-CB 3.41Å; L149-K152 PolarHBondContact O-N 3.05Å; G150-K152 VanDerWaalsContact C-N 3.34Å
153	G	94.9	Very high	94.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.			trans	177.8	162.6	171.7	0	0	0	0	0	112.2	D151 T230	D151-G153 PolarHBondContact O-N 3.33Å; G153-T230 VanDerWaalsContact CA-OG1 3.32Å; G153-T230 WeakPolarHBondContact CA-OG1 3.46Å
154	V	96.6	Very high	94.6	Very high	1 Å²	1	29 Å²	29	1%	0.006	15%	0.146	C	C	.	.			trans	-124.7	123.2	176.2	-178	0	0	0	0	108.5	L93 Y100 M101 I129 V132 L133 T230	L93-V154 HydrophobicContact CD1-CG2 4.19Å; Y100-V154 HydrophobicContact CD1-CG1 3.34Å; Y100-V154 HydrophobicContact CE1-CG1 4.05Å; Y100-V154 HydrophobicContact CG-CG1 3.62Å; M101-V154 CarbonylContact O-C 3.54Å; I129-V154 HydrophobicContact CG2-CG2 4.26Å; V132-V154 HydrophobicContact CG1-CG2 4.39Å; L133-V154 HydrophobicContact CD2-CB 4.4Å; L133-V154 HydrophobicContact CD2-CG2 4.46Å; V154-T230 PolarHBondContact N-OG1 3.4Å; V154-T230 WeakPolarHBondContact O-CB 3.19Å; V154-T230 PolarHBondContact O-N 3.45Å; V154-T230 PolarHBondContact O-OG1 2.75Å
155	I	97.1	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-123.5	116.2	179.4	-62.9	172.5	0	0	0	107.3	Y100 M101 P103 F106 F146 E159 L163	Y100-I155 WeakPolarHBondContact CA-O 3.4Å; M101-I155 HydrophobicContact CB-CB 4.01Å; M101-I155 HydrophobicContact CB-CG2 4.46Å; M101-I155 PolarHBondContact N-O 2.91Å; M101-I155 WeakPolarHBondContact O-CB 3.39Å; M101-I155 PolarHBondContact O-N 2.82Å; P103-I155 HydrophobicContact CG-CD1 4.34Å; F106-I155 HydrophobicContact CB-CD1 3.88Å; F106-I155 HydrophobicContact CG-CD1 4.47Å; F146-I155 HydrophobicContact CD1-CD1 4.33Å; F146-I155 HydrophobicContact CE1-CD1 3.64Å; F146-I155 HydrophobicContact CZ-CD1 4.45Å; I155-E159 WeakPolarHBondContact CA-OE2 3.24Å; I155-E159 HydrophobicContact CG2-CB 3.79Å; I155-L163 HydrophobicContact CD1-CD1 4.08Å; I155-L163 HydrophobicContact CG2-CD1 3.96Å
156	S	95.5	Very high	94	Very high	17 Å²	17	27.7 Å²	27.7	12%	0.119	14%	0.138	C	C	.	.			trans	-75.1	168.6	176.2	62.2	0	0	0	0	112.3	T158 E159 Y160	S156-T158 VanDerWaalsContact C-N 3.32Å; S156-T158 PolarHBondContact O-N 2.94Å; S156-T158 PolarHBondContact OG-OG1 3.45Å; S156-E159 PolarHBondContact N-OE2 2.93Å; S156-E159 PolarHBondContact O-N 2.93Å; S156-E159 VanDerWaalsContact OG-CG 3.32Å; S156-E159 WeakPolarHBondContact OG-CG 3.45Å; S156-E159 PolarHBondContact OG-N 3.23Å; S156-E159 PolarHBondContact OG-OE2 3.24Å; S156-Y160 PolarHBondContact O-N 3.46Å
157	Y	94.8	Very high	93.7	Very high	41 Å²	41	28.2 Å²	28.2	16%	0.161	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-37.8	177.4	-176.1	-123.3	0	0	0	113.6	S81 K84 F87 Y160 L161 D205	S81-Y157 PolarHBondContact OG-OH 3.07Å; K84-Y157 WeakPolarHBondContact CA-OH 3.42Å; K84-Y157 HydrophobicContact CB-CE2 4.15Å; K84-Y157 WeakPolarHBondContact CB-OH 3.25Å; K84-Y157 HydrophobicContact CD-CD1 4Å; K84-Y157 HydrophobicContact CD-CD2 3.87Å; K84-Y157 HydrophobicContact CD-CE1 3.78Å; K84-Y157 HydrophobicContact CD-CE2 3.65Å; K84-Y157 HydrophobicContact CD-CG 4.04Å; K84-Y157 PolarHBondContact N-OH 3.07Å; K84-Y157 VanDerWaalsContact N-OH 3.14Å; F87-Y157 HydrophobicContact CB-CD2 3.72Å; F87-Y157 HydrophobicContact CB-CE2 3.76Å; F87-Y157 AromaticContact CD1-CD2 3.64Å; F87-Y157 HydrophobicContact CD1-CD2 3.64Å; F87-Y157 HydrophobicContact CD1-CE2 4.41Å; F87-Y157 HydrophobicContact CD1-CG 4.29Å; F87-Y157 AromaticContact CD2-CD2 3.78Å; F87-Y157 HydrophobicContact CD2-CD2 3.78Å; F87-Y157 HydrophobicContact CE1-CD2 4.14Å; F87-Y157 HydrophobicContact CE1-CG 4.43Å; F87-Y157 HydrophobicContact CE2-CD2 4.27Å; F87-Y157 AromaticContact CG-CD2 3.43Å; F87-Y157 HydrophobicContact CG-CD2 3.43Å; F87-Y157 VanDerWaalsContact CG-CD2 3.43Å; F87-Y157 HydrophobicContact CG-CE2 4.02Å; F87-Y157 HydrophobicContact CG-CG 4.44Å; F87-Y157 HydrophobicContact CZ-CD2 4.42Å; Y157-Y160 HydrophobicContact CD2-CD1 4.07Å; Y157-Y160 AromaticContact CE2-CD1 3.9Å; Y157-Y160 HydrophobicContact CE2-CD1 3.9Å; Y157-Y160 HydrophobicContact CE2-CE1 4.45Å; Y157-Y160 WeakPolarHBondContact O-CB 3.33Å; Y157-Y160 PolarHBondContact O-N 3.08Å; Y157-L161 HydrophobicContact CD1-CD1 4.33Å; Y157-L161 HydrophobicContact CE1-CD1 3.72Å; Y157-L161 HydrophobicContact CE1-CG 4.25Å; Y157-L161 HydrophobicContact CE2-CD1 4.46Å; Y157-L161 HydrophobicContact CE2-CD2 4.15Å; Y157-L161 HydrophobicContact CE2-CG 4.12Å; Y157-L161 WeakPolarHBondContact O-CG 3.41Å; Y157-L161 PolarHBondContact O-N 3.37Å; Y157-D205 PolarHBondContact OH-OD2 2.74Å
158	T	92.4	Very high	93.2	Very high	47 Å²	47	25.2 Å²	25.2	29%	0.288	13%	0.13	S	C	.	.	H	α-helix	trans	-70.3	-35.3	178.9	59	0	0	0	0	111.5	S156 L161 F162 S202	S156-T158 VanDerWaalsContact C-N 3.32Å; S156-T158 PolarHBondContact O-N 2.94Å; S156-T158 PolarHBondContact OG-OG1 3.45Å; T158-L161 PolarHBondContact O-N 3.49Å; T158-F162 WeakPolarHBondContact O-CB 3.35Å; T158-F162 PolarHBondContact O-N 2.8Å; T158-S202 WeakPolarHBondContact CG2-OG 3.48Å
159	E	94.6	Very high	92.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.7	-40.9	170.8	-73.8	173.4	135.4	0	0	111.8	I155 S156 L161 F162 L163 T229 L231	I155-E159 WeakPolarHBondContact CA-OE2 3.24Å; I155-E159 HydrophobicContact CG2-CB 3.79Å; S156-E159 PolarHBondContact N-OE2 2.93Å; S156-E159 PolarHBondContact O-N 2.93Å; S156-E159 VanDerWaalsContact OG-CG 3.32Å; S156-E159 WeakPolarHBondContact OG-CG 3.45Å; S156-E159 PolarHBondContact OG-N 3.23Å; S156-E159 PolarHBondContact OG-OE2 3.24Å; E159-L161 VanDerWaalsContact C-N 3.34Å; E159-L161 PolarHBondContact O-N 2.89Å; E159-F162 WeakPolarHBondContact O-CB 3.42Å; E159-F162 PolarHBondContact O-N 3.26Å; E159-L163 WeakPolarHBondContact O-CB 3.28Å; E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 3.44Å; E159-T229 VanDerWaalsContact CD-CB 3.47Å; E159-T229 WeakPolarHBondContact OE1-CB 3.19Å; E159-T229 PolarHBondContact OE1-OG1 3.27Å; E159-T229 WeakPolarHBondContact OE2-CB 3.31Å; E159-T229 WeakPolarHBondContact OE2-CG2 3.38Å; E159-T229 PolarHBondContact OE2-OG1 3.07Å; E159-L231 HydrophobicContact CB-CD1 4Å; E159-L231 HydrophobicContact CG-CD1 3.93Å; E159-L231 HydrophobicContact CG-CG 4.36Å; E159-L231 VanDerWaalsContact OE1-CB 3.24Å; E159-L231 WeakPolarHBondContact OE1-CB 3.32Å; E159-L231 PolarHBondContact OE1-N 2.95Å
160	Y	96	Very high	92.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.1	-49.3	173.8	171.9	-105.7	0	0	0	111.6	R83 F87 M101 F106 S109 S156 Y157 F162 L163 L164	R83-Y160 HydrophobicContact CB-CE1 4.32Å; R83-Y160 WeakPolarHBondContact O-CE1 3.23Å; F87-Y160 HydrophobicContact CB-CD1 3.98Å; F87-Y160 HydrophobicContact CB-CE1 3.97Å; F87-Y160 AromaticContact CD2-CD1 3.88Å; F87-Y160 HydrophobicContact CD2-CD1 3.88Å; F87-Y160 HydrophobicContact CD2-CD2 4.15Å; F87-Y160 AromaticContact CD2-CG 3.64Å; F87-Y160 HydrophobicContact CD2-CG 3.64Å; F87-Y160 HydrophobicContact CE2-CG 4.36Å; F87-Y160 HydrophobicContact CG-CD1 4.33Å; M101-Y160 HydrophobicContact CE-CD2 4.34Å; M101-Y160 HydrophobicContact CE-CE2 4.27Å; M101-Y160 HydrophobicContact SD-CD2 3.64Å; M101-Y160 HydrophobicContact SD-CE2 4.05Å; M101-Y160 HydrophobicContact SD-CG 4.37Å; F106-Y160 AromaticContact CD2-CD2 3.83Å; F106-Y160 HydrophobicContact CD2-CD2 3.83Å; F106-Y160 HydrophobicContact CD2-CE2 4.13Å; F106-Y160 HydrophobicContact CE2-CD2 4.26Å; F106-Y160 HydrophobicContact CE2-CE2 4.42Å; S109-Y160 WeakPolarHBondContact OG-CE2 3.28Å; S156-Y160 PolarHBondContact O-N 3.46Å; Y157-Y160 HydrophobicContact CD2-CD1 4.07Å; Y157-Y160 AromaticContact CE2-CD1 3.9Å; Y157-Y160 HydrophobicContact CE2-CD1 3.9Å; Y157-Y160 HydrophobicContact CE2-CE1 4.45Å; Y157-Y160 WeakPolarHBondContact O-CB 3.33Å; Y157-Y160 PolarHBondContact O-N 3.08Å; Y160-F162 VanDerWaalsContact C-N 3.34Å; Y160-F162 PolarHBondContact O-N 3.47Å; Y160-L163 PolarHBondContact O-N 3.34Å; Y160-L164 HydrophobicContact CD1-CD1 4.1Å; Y160-L164 HydrophobicContact CE1-CD1 3.45Å; Y160-L164 VanDerWaalsContact CE1-CD1 3.45Å; Y160-L164 HydrophobicContact CE1-CG 4.19Å; Y160-L164 HydrophobicContact CE2-CD1 4.17Å; Y160-L164 HydrophobicContact CE2-CD2 4.2Å; Y160-L164 HydrophobicContact CE2-CG 4.1Å; Y160-L164 WeakPolarHBondContact O-CG 3.48Å; Y160-L164 PolarHBondContact O-N 2.85Å
161	L	93.4	Very high	91.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-39.4	177.1	-66.5	-179.3	0	0	0	112.7	R83 Y157 T158 E159 T165 I201 D205	R83-L161 HydrophobicContact CB-CD2 3.85Å; R83-L161 HydrophobicContact CG-CD2 4.36Å; Y157-L161 HydrophobicContact CD1-CD1 4.33Å; Y157-L161 HydrophobicContact CE1-CD1 3.72Å; Y157-L161 HydrophobicContact CE1-CG 4.25Å; Y157-L161 HydrophobicContact CE2-CD1 4.46Å; Y157-L161 HydrophobicContact CE2-CD2 4.15Å; Y157-L161 HydrophobicContact CE2-CG 4.12Å; Y157-L161 WeakPolarHBondContact O-CG 3.41Å; Y157-L161 PolarHBondContact O-N 3.37Å; T158-L161 PolarHBondContact O-N 3.49Å; E159-L161 VanDerWaalsContact C-N 3.34Å; E159-L161 PolarHBondContact O-N 2.89Å; L161-T165 WeakPolarHBondContact O-CB 3.44Å; L161-T165 PolarHBondContact O-N 2.73Å; L161-T165 PolarHBondContact O-OG1 3.17Å; L161-I201 HydrophobicContact CB-CG2 4.06Å; L161-D205 HydrophobicContact CD1-CB 3.72Å; L161-D205 HydrophobicContact CD2-CB 4.29Å
162	F	92.3	Very high	90.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-48	173.2	166.9	-95.4	0	0	0	111.2	T158 E159 Y160 L164 T165 I166 F194 L197 Q198 I201 L231 F249 F252	T158-F162 WeakPolarHBondContact O-CB 3.35Å; T158-F162 PolarHBondContact O-N 2.8Å; E159-F162 WeakPolarHBondContact O-CB 3.42Å; E159-F162 PolarHBondContact O-N 3.26Å; Y160-F162 VanDerWaalsContact C-N 3.34Å; Y160-F162 PolarHBondContact O-N 3.47Å; F162-L164 PolarHBondContact O-N 3.39Å; F162-T165 WeakPolarHBondContact O-CB 3.18Å; F162-T165 PolarHBondContact O-N 2.99Å; F162-T165 VanDerWaalsContact O-N 3.08Å; F162-I166 HydrophobicContact CD2-CG2 4.35Å; F162-I166 HydrophobicContact CE1-CD1 4.12Å; F162-I166 HydrophobicContact CE1-CG2 4.07Å; F162-I166 HydrophobicContact CE2-CG2 3.75Å; F162-I166 HydrophobicContact CZ-CD1 4.41Å; F162-I166 HydrophobicContact CZ-CG2 3.55Å; F162-I166 WeakPolarHBondContact O-CG2 3.43Å; F162-I166 PolarHBondContact O-N 3.43Å; F162-F194 HydrophobicContact CD1-CZ 4.21Å; F162-F194 HydrophobicContact CD2-CE2 4.39Å; F162-F194 HydrophobicContact CE1-CE2 4.17Å; F162-F194 HydrophobicContact CE1-CZ 4.09Å; F162-F194 AromaticContact CE2-CE2 3.97Å; F162-F194 HydrophobicContact CE2-CE2 3.97Å; F162-F194 AromaticContact CZ-CE2 3.88Å; F162-F194 HydrophobicContact CZ-CE2 3.88Å; F162-F194 HydrophobicContact CZ-CZ 4.28Å; F162-L197 HydrophobicContact CE2-CD2 4.21Å; F162-Q198 HydrophobicContact CB-CG 4.27Å; F162-I201 HydrophobicContact CB-CD1 4.41Å; F162-I201 HydrophobicContact CD2-CD1 3.83Å; F162-L231 HydrophobicContact CD1-CD1 3.81Å; F162-L231 HydrophobicContact CE1-CD1 4.06Å; F162-F249 AromaticContact CE2-CE2 3.93Å; F162-F249 HydrophobicContact CE2-CE2 3.93Å; F162-F249 HydrophobicContact CE2-CZ 4.01Å; F162-F249 AromaticContact CZ-CE2 3.5Å; F162-F249 HydrophobicContact CZ-CE2 3.5Å; F162-F249 VanDerWaalsContact CZ-CE2 3.5Å; F162-F249 AromaticContact CZ-CZ 3.83Å; F162-F249 HydrophobicContact CZ-CZ 3.83Å; F162-F252 HydrophobicContact CE1-CE1 4.43Å
163	L	95	Very high	90	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-43.2	179	-68.6	169.2	0	0	0	112	F106 F146 I155 E159 Y160 T165 I166 L167 L231 F252 L256	F106-L163 HydrophobicContact CD1-CD1 4.38Å; F106-L163 HydrophobicContact CD2-CB 4.21Å; F106-L163 HydrophobicContact CD2-CD1 3.9Å; F106-L163 HydrophobicContact CE1-CB 4.4Å; F106-L163 HydrophobicContact CE1-CD1 4.41Å; F106-L163 HydrophobicContact CE2-CB 3.41Å; F106-L163 VanDerWaalsContact CE2-CB 3.41Å; F106-L163 HydrophobicContact CE2-CD1 3.93Å; F106-L163 HydrophobicContact CE2-CG 4.3Å; F106-L163 HydrophobicContact CG-CD1 4.12Å; F106-L163 HydrophobicContact CZ-CB 3.52Å; F106-L163 HydrophobicContact CZ-CD1 4.19Å; F106-L163 HydrophobicContact CZ-CG 4.36Å; F146-L163 HydrophobicContact CE1-CD1 3.88Å; F146-L163 HydrophobicContact CE1-CD2 4.45Å; F146-L163 HydrophobicContact CZ-CD1 3.96Å; F146-L163 HydrophobicContact CZ-CD2 3.8Å; I155-L163 HydrophobicContact CD1-CD1 4.08Å; I155-L163 HydrophobicContact CG2-CD1 3.96Å; E159-L163 WeakPolarHBondContact O-CB 3.28Å; E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 3.44Å; Y160-L163 PolarHBondContact O-N 3.34Å; L163-T165 PolarHBondContact O-N 2.86Å; L163-I166 HydrophobicContact CD2-CD1 4.04Å; L163-I166 WeakPolarHBondContact O-CG1 3.47Å; L163-I166 PolarHBondContact O-N 3.42Å; L163-L167 WeakPolarHBondContact O-CG 3.35Å; L163-L167 PolarHBondContact O-N 2.77Å; L163-L167 VanDerWaalsContact O-N 3.12Å; L163-L231 HydrophobicContact CD1-CD1 4.33Å; L163-L231 HydrophobicContact CD2-CD1 3.87Å; L163-L231 HydrophobicContact CD2-CD2 4.34Å; L163-L231 HydrophobicContact CG-CD1 4.02Å; L163-F252 HydrophobicContact CD2-CE1 4.16Å; L163-F252 HydrophobicContact CD2-CZ 3.99Å; L163-L256 HydrophobicContact CD2-CD2 3.65Å
164	L	93.4	Very high	89.3	Confident	18 Å²	18	18.1 Å²	18.1	9%	0.094	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-36.9	173.1	-71.3	-176.7	0	0	0	112.6	R83 F106 V110 Y160 F162 L167 T168 L396	R83-L164 HydrophobicContact CG-CD1 4.02Å; F106-L164 HydrophobicContact CE2-CD2 4.44Å; V110-L164 HydrophobicContact CG2-CD2 4.05Å; Y160-L164 HydrophobicContact CD1-CD1 4.1Å; Y160-L164 HydrophobicContact CE1-CD1 3.45Å; Y160-L164 VanDerWaalsContact CE1-CD1 3.45Å; Y160-L164 HydrophobicContact CE1-CG 4.19Å; Y160-L164 HydrophobicContact CE2-CD1 4.17Å; Y160-L164 HydrophobicContact CE2-CD2 4.2Å; Y160-L164 HydrophobicContact CE2-CG 4.1Å; Y160-L164 WeakPolarHBondContact O-CG 3.48Å; Y160-L164 PolarHBondContact O-N 2.85Å; F162-L164 PolarHBondContact O-N 3.39Å; L164-L167 PolarHBondContact O-N 3.2Å; L164-T168 PolarHBondContact O-OG1 2.89Å; L164-L396 HydrophobicContact CD1-CD1 3.73Å; L164-L396 HydrophobicContact CD2-CD1 3.99Å
165	T	88.5	Confident	88.5	Confident	25 Å²	25	21 Å²	21	15%	0.153	12%	0.121	C	C	.	.	H	α-helix	trans	-67.4	-45.6	179.5	-56.8	0	0	0	0	110.6	L161 F162 L163 L167 T168 K169 F174 I201	L161-T165 WeakPolarHBondContact O-CB 3.44Å; L161-T165 PolarHBondContact O-N 2.73Å; L161-T165 PolarHBondContact O-OG1 3.17Å; F162-T165 WeakPolarHBondContact O-CB 3.18Å; F162-T165 PolarHBondContact O-N 2.99Å; F162-T165 VanDerWaalsContact O-N 3.08Å; L163-T165 PolarHBondContact O-N 2.86Å; T165-L167 VanDerWaalsContact C-N 3.27Å; T165-L167 PolarHBondContact O-N 3.35Å; T165-T168 PolarHBondContact O-N 2.86Å; T165-T168 VanDerWaalsContact O-N 3.12Å; T165-T168 PolarHBondContact O-OG1 3.34Å; T165-K169 HydrophobicContact CG2-CG 4.14Å; T165-K169 PolarHBondContact O-N 2.89Å; T165-F174 HydrophobicContact CG2-CZ 4.32Å; T165-I201 HydrophobicContact CG2-CD1 4.42Å; T165-I201 WeakPolarHBondContact OG1-CG2 3.09Å
166	I	88.9	Confident	87.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.4	-27.1	178.1	71.9	174.3	0	0	0	113.5	F162 L163 T168 F174 F249 F252 V253 L256 Q257	F162-I166 HydrophobicContact CD2-CG2 4.35Å; F162-I166 HydrophobicContact CE1-CD1 4.12Å; F162-I166 HydrophobicContact CE1-CG2 4.07Å; F162-I166 HydrophobicContact CE2-CG2 3.75Å; F162-I166 HydrophobicContact CZ-CD1 4.41Å; F162-I166 HydrophobicContact CZ-CG2 3.55Å; F162-I166 WeakPolarHBondContact O-CG2 3.43Å; F162-I166 PolarHBondContact O-N 3.43Å; L163-I166 HydrophobicContact CD2-CD1 4.04Å; L163-I166 WeakPolarHBondContact O-CG1 3.47Å; L163-I166 PolarHBondContact O-N 3.42Å; I166-T168 PolarHBondContact O-N 3.29Å; I166-F174 VanDerWaalsContact CA-CZ 3.4Å; I166-F174 HydrophobicContact CB-CE1 4.47Å; I166-F174 HydrophobicContact CB-CE2 4.12Å; I166-F174 HydrophobicContact CB-CZ 3.84Å; I166-F174 HydrophobicContact CG2-CD1 4.47Å; I166-F174 HydrophobicContact CG2-CE1 3.66Å; I166-F174 HydrophobicContact CG2-CE2 4.17Å; I166-F174 HydrophobicContact CG2-CZ 3.52Å; I166-F249 HydrophobicContact CG2-CZ 4.45Å; I166-F252 HydrophobicContact CD1-CD1 4.01Å; I166-F252 HydrophobicContact CD1-CE1 3.5Å; I166-F252 VanDerWaalsContact CD1-CE1 3.5Å; I166-V253 HydrophobicContact CB-CG1 4.25Å; I166-V253 HydrophobicContact CB-CG2 4.08Å; I166-V253 HydrophobicContact CD1-CG2 4.21Å; I166-V253 HydrophobicContact CG2-CG2 4.19Å; I166-L256 HydrophobicContact CD1-CD2 3.47Å; I166-L256 VanDerWaalsContact CD1-CD2 3.47Å; I166-L256 HydrophobicContact CG1-CD2 3.9Å; I166-Q257 PolarHBondContact O-NE2 3.44Å
167	L	90.9	Very high	86.6	Confident	10 Å²	10	23.3 Å²	23.3	5%	0.052	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.3	174	-72.9	-179.7	0	0	0	114.3	F106 V110 L163 L164 T165 L256 Q257 V260	F106-L167 HydrophobicContact CZ-CD1 3.79Å; V110-L167 HydrophobicContact CG1-CD1 3.91Å; V110-L167 HydrophobicContact CG2-CD1 3.98Å; L163-L167 WeakPolarHBondContact O-CG 3.35Å; L163-L167 PolarHBondContact O-N 2.77Å; L163-L167 VanDerWaalsContact O-N 3.12Å; L164-L167 PolarHBondContact O-N 3.2Å; T165-L167 VanDerWaalsContact C-N 3.27Å; T165-L167 PolarHBondContact O-N 3.35Å; L167-L256 HydrophobicContact CD2-CD2 4.14Å; L167-L256 HydrophobicContact CD2-CG 3.97Å; L167-L256 HydrophobicContact CG-CD2 4.43Å; L167-Q257 HydrophobicContact CD2-CG 4.43Å; L167-V260 HydrophobicContact CD1-CG2 4.21Å; L167-V260 HydrophobicContact CD2-CB 4.09Å; L167-V260 HydrophobicContact CD2-CG2 3.73Å
168	T	85.2	Confident	85.9	Confident	12 Å²	12	21.7 Å²	21.7	7%	0.074	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-2.3	-169.4	59.1	0	0	0	0	114.8	L164 T165 I166 M392	L164-T168 PolarHBondContact O-OG1 2.89Å; T165-T168 PolarHBondContact O-N 2.86Å; T165-T168 VanDerWaalsContact O-N 3.12Å; T165-T168 PolarHBondContact O-OG1 3.34Å; I166-T168 PolarHBondContact O-N 3.29Å; T168-M392 HydrophobicContact CG2-CG 4.03Å; T168-M392 VanDerWaalsContact CG2-O 3.28Å; T168-M392 WeakPolarHBondContact CG2-O 3.08Å
169	K	83.9	Confident	85.4	Confident	37 Å²	37	25.4 Å²	25.4	16%	0.161	14%	0.141	C	C	.	.	S	Bend	trans	-112.6	141.4	-179	-71	-67.7	179.6	-178	0	111	T165 F174 Q257 E326	T165-K169 HydrophobicContact CG2-CG 4.14Å; T165-K169 PolarHBondContact O-N 2.89Å; K169-F174 HydrophobicContact CB-CD2 4.4Å; K169-F174 HydrophobicContact CB-CE2 3.49Å; K169-F174 VanDerWaalsContact CB-CE2 3.49Å; K169-F174 HydrophobicContact CB-CZ 3.62Å; K169-F174 HydrophobicContact CG-CZ 4.39Å; K169-Q257 PolarHBondContact O-NE2 3.24Å; K169-E326 IonicContact NZ-OE1 3.61Å; K169-E326 PolarHBondContact NZ-OE1 2.58Å
170	P	81.9	Confident	84.5	Confident	20 Å²	20	28.5 Å²	28.5	13%	0.13	16%	0.157	C	C	.	.			trans	-70.2	158.9	176.9	30.3	-34.5	0	0	0	110.8	S172 G173 T323	P170-S172 PolarHBondContact O-N 3.26Å; P170-G173 PolarHBondContact O-N 3.28Å; P170-G173 VanDerWaalsContact O-N 3.12Å; P170-T323 WeakPolarHBondContact CD-O 3.49Å
171	H	78.9	Confident	83.7	Confident	39 Å²	39	29.1 Å²	29.1	18%	0.181	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-31.1	-178.8	-56.9	-59.4	0	0	0	113.2	G173 F174 H175 E254	H171-G173 VanDerWaalsContact C-N 3.34Å; H171-G173 PolarHBondContact O-N 3.41Å; H171-F174 PolarHBondContact O-N 2.67Å; H171-H175 PolarHBondContact O-N 3.36Å; H171-E254 WeakPolarHBondContact CE1-CG 3.49Å
172	S	80.2	Confident	83.2	Confident	69 Å²	69	29.7 Å²	29.7	48%	0.483	16%	0.163	S	C	.	.	H	α-helix	trans	-57.9	-44.2	175.4	53.6	0	0	0	0	111.9	P170 F174 H175 V176	P170-S172 PolarHBondContact O-N 3.26Å; S172-F174 VanDerWaalsContact C-N 3.33Å; S172-F174 PolarHBondContact O-N 3.42Å; S172-H175 WeakPolarHBondContact O-CB 3.45Å; S172-H175 PolarHBondContact O-N 2.89Å; S172-V176 WeakPolarHBondContact O-CG2 3.2Å; S172-V176 PolarHBondContact O-N 3.4Å
173	G	76.6	Confident	82.5	Confident	30 Å²	30	32.7 Å²	32.7	31%	0.309	18%	0.181	S	C	.	.	H	α-helix	trans	-62.7	-38.2	177.5	0	0	0	0	0	112.9	P170 H171 V176 A177	P170-G173 PolarHBondContact O-N 3.28Å; P170-G173 VanDerWaalsContact O-N 3.12Å; H171-G173 VanDerWaalsContact C-N 3.34Å; H171-G173 PolarHBondContact O-N 3.41Å; G173-V176 PolarHBondContact O-N 3Å; G173-A177 PolarHBondContact O-N 3.47Å; G173-A177 VanDerWaalsContact O-N 3.12Å
174	F	78.3	Confident	81.9	Confident	15 Å²	15	38.1 Å²	38.1	7%	0.066	21%	0.21	C	C	.	.	H	α-helix	trans	-70.6	-36.8	175.4	-73.2	-63.1	0	0	0	113.3	T165 I166 K169 H171 S172 V176 A177 F178 F249 V253	T165-F174 HydrophobicContact CG2-CZ 4.32Å; I166-F174 VanDerWaalsContact CA-CZ 3.4Å; I166-F174 HydrophobicContact CB-CE1 4.47Å; I166-F174 HydrophobicContact CB-CE2 4.12Å; I166-F174 HydrophobicContact CB-CZ 3.84Å; I166-F174 HydrophobicContact CG2-CD1 4.47Å; I166-F174 HydrophobicContact CG2-CE1 3.66Å; I166-F174 HydrophobicContact CG2-CE2 4.17Å; I166-F174 HydrophobicContact CG2-CZ 3.52Å; K169-F174 HydrophobicContact CB-CD2 4.4Å; K169-F174 HydrophobicContact CB-CE2 3.49Å; K169-F174 VanDerWaalsContact CB-CE2 3.49Å; K169-F174 HydrophobicContact CB-CZ 3.62Å; K169-F174 HydrophobicContact CG-CZ 4.39Å; H171-F174 PolarHBondContact O-N 2.67Å; S172-F174 VanDerWaalsContact C-N 3.33Å; S172-F174 PolarHBondContact O-N 3.42Å; F174-V176 PolarHBondContact O-N 3.3Å; F174-A177 PolarHBondContact O-N 2.94Å; F174-F178 VanDerWaalsContact O-CB 3.23Å; F174-F178 WeakPolarHBondContact O-CB 3.3Å; F174-F178 PolarHBondContact O-N 2.99Å; F174-F249 HydrophobicContact CB-CE1 3.89Å; F174-F249 AromaticContact CD1-CE1 3.89Å; F174-F249 HydrophobicContact CD1-CE1 3.89Å; F174-F249 AromaticContact CD1-CZ 3.97Å; F174-F249 HydrophobicContact CD1-CZ 3.97Å; F174-F249 AromaticContact CG-CE1 3.92Å; F174-F249 HydrophobicContact CG-CE1 3.92Å; F174-F249 HydrophobicContact CG-CZ 4.43Å; F174-V253 HydrophobicContact CD2-CG1 4.47Å; F174-V253 HydrophobicContact CE2-CG1 4.47Å
175	H	80.6	Confident	81.4	Confident	60 Å²	60	39.9 Å²	39.9	28%	0.278	23%	0.232	S	C	.	.	H	α-helix	trans	-56.2	-44.6	174.5	-167.7	48.6	0	0	0	111.4	H171 S172 F178 K179 Y246	H171-H175 PolarHBondContact O-N 3.36Å; S172-H175 WeakPolarHBondContact O-CB 3.45Å; S172-H175 PolarHBondContact O-N 2.89Å; H175-F178 PolarHBondContact O-N 3.33Å; H175-K179 VanDerWaalsContact CE1-CE 3.42Å; H175-K179 WeakPolarHBondContact CE1-CE 3.44Å; H175-K179 WeakPolarHBondContact NE2-CE 3.4Å; H175-K179 PolarHBondContact NE2-NZ 3.45Å; H175-K179 WeakPolarHBondContact O-CB 3.01Å; H175-K179 WeakPolarHBondContact O-CG 3.33Å; H175-K179 PolarHBondContact O-N 2.89Å; H175-Y246 HydrophobicContact CB-CE2 4.19Å; H175-Y246 WeakPolarHBondContact CB-OH 3.34Å; H175-Y246 AromaticContact CG-CZ 3.97Å; H175-Y246 AromaticContact ND1-CE1 3.51Å; H175-Y246 AromaticContact ND1-CE2 3.72Å; H175-Y246 AromaticContact ND1-CZ 3.35Å
176	V	78.7	Confident	81.4	Confident	62 Å²	62	41.5 Å²	41.5	38%	0.376	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-46.7	178	-177.8	0	0	0	0	111	S172 G173 F174 F178 K179 M180 W408	S172-V176 WeakPolarHBondContact O-CG2 3.2Å; S172-V176 PolarHBondContact O-N 3.4Å; G173-V176 PolarHBondContact O-N 3Å; F174-V176 PolarHBondContact O-N 3.3Å; V176-F178 VanDerWaalsContact C-N 3.3Å; V176-F178 PolarHBondContact O-N 2.88Å; V176-K179 PolarHBondContact O-N 2.98Å; V176-M180 HydrophobicContact CG1-CE 3.82Å; V176-M180 WeakPolarHBondContact O-CG 3.41Å; V176-M180 PolarHBondContact O-N 3.44Å; V176-W408 HydrophobicContact CB-CH2 3.99Å; V176-W408 HydrophobicContact CG1-CH2 3.35Å; V176-W408 HydrophobicContact CG1-CZ2 4.4Å; V176-W408 HydrophobicContact CG1-CZ3 3.69Å
177	A	74.5	Confident	81.4	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-38.3	178.1	0	0	0	0	0	112.5	G173 F174 M180 L181 Y407	G173-A177 PolarHBondContact O-N 3.47Å; G173-A177 VanDerWaalsContact O-N 3.12Å; F174-A177 PolarHBondContact O-N 2.94Å; A177-M180 PolarHBondContact O-N 3.37Å; A177-L181 WeakPolarHBondContact O-CG 3.48Å; A177-L181 PolarHBondContact O-N 2.97Å; A177-Y407 WeakPolarHBondContact CB-OH 3.38Å
178	F	80.9	Confident	81.4	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-49.1	178.5	-157.5	-75.8	0	0	0	110.8	F174 H175 V176 M180 L181 D182 E187 I189 L244 Y246 F249	F174-F178 VanDerWaalsContact O-CB 3.23Å; F174-F178 WeakPolarHBondContact O-CB 3.3Å; F174-F178 PolarHBondContact O-N 2.99Å; H175-F178 PolarHBondContact O-N 3.33Å; V176-F178 VanDerWaalsContact C-N 3.3Å; V176-F178 PolarHBondContact O-N 2.88Å; F178-M180 PolarHBondContact O-N 3.48Å; F178-L181 PolarHBondContact O-N 2.82Å; F178-D182 HydrophobicContact CD1-CB 4.43Å; F178-D182 WeakPolarHBondContact O-CB 3.25Å; F178-D182 PolarHBondContact O-N 2.75Å; F178-E187 VanDerWaalsContact CE1-O 3.3Å; F178-E187 WeakPolarHBondContact CE1-O 3.21Å; F178-I189 HydrophobicContact CB-CD1 4.4Å; F178-I189 HydrophobicContact CD1-CD1 3.86Å; F178-I189 HydrophobicContact CD1-CG1 3.97Å; F178-I189 HydrophobicContact CD2-CD1 3.25Å; F178-I189 HydrophobicContact CD2-CG1 4.07Å; F178-I189 HydrophobicContact CE1-CB 4.38Å; F178-I189 HydrophobicContact CE1-CD1 3.86Å; F178-I189 HydrophobicContact CE1-CG1 3.56Å; F178-I189 HydrophobicContact CE2-CB 4.15Å; F178-I189 HydrophobicContact CE2-CD1 3.26Å; F178-I189 HydrophobicContact CE2-CG1 3.69Å; F178-I189 HydrophobicContact CG-CD1 3.57Å; F178-I189 HydrophobicContact CG-CG1 4.2Å; F178-I189 HydrophobicContact CZ-CB 3.84Å; F178-I189 HydrophobicContact CZ-CD1 3.57Å; F178-I189 HydrophobicContact CZ-CG1 3.41Å; F178-I189 VanDerWaalsContact CZ-CG1 3.41Å; F178-L244 WeakPolarHBondContact CZ-O 3.47Å; F178-Y246 HydrophobicContact CB-CD2 3.96Å; F178-Y246 HydrophobicContact CB-CE2 4.35Å; F178-Y246 HydrophobicContact CD1-CD2 4.1Å; F178-Y246 HydrophobicContact CD1-CG 4.5Å; F178-Y246 AromaticContact CD2-CD2 3.79Å; F178-Y246 HydrophobicContact CD2-CD2 3.79Å; F178-Y246 HydrophobicContact CE2-CD2 4.28Å; F178-Y246 AromaticContact CG-CD2 3.69Å; F178-Y246 HydrophobicContact CG-CD2 3.69Å; F178-Y246 HydrophobicContact CG-CG 4.5Å; F178-F249 HydrophobicContact CD2-CB 4.45Å; F178-F249 HydrophobicContact CD2-CD1 4.19Å; F178-F249 HydrophobicContact CD2-CG 4.22Å; F178-F249 HydrophobicContact CE2-CB 3.9Å; F178-F249 HydrophobicContact CE2-CD1 4.47Å; F178-F249 HydrophobicContact CE2-CG 4.07Å
179	K	80.9	Confident	81.6	Confident	125 Å²	125	47.8 Å²	47.8	54%	0.543	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-26.4	174.5	-78.2	-177	166.4	-176	0	114.3	H175 V176	H175-K179 VanDerWaalsContact CE1-CE 3.42Å; H175-K179 WeakPolarHBondContact CE1-CE 3.44Å; H175-K179 WeakPolarHBondContact NE2-CE 3.4Å; H175-K179 PolarHBondContact NE2-NZ 3.45Å; H175-K179 WeakPolarHBondContact O-CB 3.01Å; H175-K179 WeakPolarHBondContact O-CG 3.33Å; H175-K179 PolarHBondContact O-N 2.89Å; V176-K179 PolarHBondContact O-N 2.98Å
180	M	75.9	Confident	81.9	Confident	65 Å²	65	49.9 Å²	49.9	32%	0.32	28%	0.28	S	S	.	.	H	α-helix	trans	-77.2	-26.4	175.1	-73.7	-167.3	-175.1	0	0	112.9	V176 A177 F178 W408 V411 S415	V176-M180 HydrophobicContact CG1-CE 3.82Å; V176-M180 WeakPolarHBondContact O-CG 3.41Å; V176-M180 PolarHBondContact O-N 3.44Å; A177-M180 PolarHBondContact O-N 3.37Å; F178-M180 PolarHBondContact O-N 3.48Å; M180-W408 HydrophobicContact CE-CE3 3.5Å; M180-W408 HydrophobicContact CE-CH2 4.24Å; M180-W408 HydrophobicContact CE-CZ3 3.25Å; M180-W408 HydrophobicContact SD-CE3 3.61Å; M180-W408 HydrophobicContact SD-CZ3 3.38Å; M180-W408 WeakPolarHBondContact SD-CZ3 3.39Å; M180-V411 HydrophobicContact CB-CG1 3.59Å; M180-V411 HydrophobicContact CG-CG1 4.06Å; M180-V411 HydrophobicContact SD-CB 4.16Å; M180-V411 HydrophobicContact SD-CG1 3.28Å; M180-V411 WeakPolarHBondContact SD-CG1 3.15Å; M180-S415 PolarHBondContact O-OG 3.38Å; M180-S415 VanDerWaalsContact O-OG 3.07Å
181	L	77.9	Confident	82.3	Confident	12 Å²	12	50.8 Å²	50.8	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-86.4	-39.3	177.7	-67.1	165.1	0	0	0	112.1	A177 F178 V183 I189 E193 L197	A177-L181 WeakPolarHBondContact O-CG 3.48Å; A177-L181 PolarHBondContact O-N 2.97Å; F178-L181 PolarHBondContact O-N 2.82Å; L181-V183 VanDerWaalsContact C-N 3.3Å; L181-V183 PolarHBondContact O-N 3.24Å; L181-I189 HydrophobicContact CB-CD1 4.12Å; L181-I189 HydrophobicContact CB-CG1 4.37Å; L181-I189 HydrophobicContact CD1-CD1 3.84Å; L181-E193 HydrophobicContact CB-CB 4.49Å; L181-L197 HydrophobicContact CD1-CB 3.67Å; L181-L197 HydrophobicContact CD1-CD1 4.09Å; L181-L197 HydrophobicContact CD1-CD2 3.87Å; L181-L197 HydrophobicContact CD1-CG 4.05Å
182	D	83.1	Confident	82.7	Confident	12 Å²	12	55 Å²	55	6%	0.064	30%	0.298	C	S	.	.			trans	-73	80.7	175	174.3	21.1	0	0	0	110.1	F178 D184 G185 N186 E187	F178-D182 HydrophobicContact CD1-CB 4.43Å; F178-D182 WeakPolarHBondContact O-CB 3.25Å; F178-D182 PolarHBondContact O-N 2.75Å; D182-D184 VanDerWaalsContact C-N 3.34Å; D182-G185 PolarHBondContact O-N 3.22Å; D182-G185 WeakPolarHBondContact OD1-CA 3.47Å; D182-G185 PolarHBondContact OD1-N 3.21Å; D182-G185 WeakPolarHBondContact OD2-CA 3.25Å; D182-N186 PolarHBondContact OD1-N 2.86Å; D182-N186 PolarHBondContact OD1-OD1 3.04Å; D182-N186 PolarHBondContact OD2-N 3.35Å; D182-E187 WeakPolarHBondContact OD2-CA 3.48Å; D182-E187 PolarHBondContact OD2-N 3.26Å
183	V	78.4	Confident	83	Confident	64 Å²	64	52.8 Å²	52.8	39%	0.388	28%	0.28	S	S	.	.	S	Bend	trans	-69.5	-31.3	-175.4	173.9	0	0	0	0	112.2	L181 V419	L181-V183 VanDerWaalsContact C-N 3.3Å; L181-V183 PolarHBondContact O-N 3.24Å; V183-V419 HydrophobicContact CG1-CB 4.46Å; V183-V419 HydrophobicContact CG1-CG2 3.54Å; V183-V419 HydrophobicContact CG2-CG2 4.16Å
184	D	83.3	Confident	83.6	Confident	113 Å²	113	51.4 Å²	51.4	60%	0.604	27%	0.266	S	S	*	.	S	Bend	trans	-88.6	-9.2	180	66.9	-22.3	0	0	0	113.3	D182 N186	D182-D184 VanDerWaalsContact C-N 3.34Å; D184-N186 VanDerWaalsContact OD1-CG 3.25Å; D184-N186 PolarHBondContact OD1-ND2 3.44Å; D184-N186 PolarHBondContact OD2-ND2 3.43Å
185	G	82.4	Confident	84	Confident	55 Å²	55	51.2 Å²	51.2	57%	0.567	27%	0.266	S	S	*	.			trans	76.1	24.4	171.5	0	0	0	0	0	113.6	D182 E187	D182-G185 PolarHBondContact O-N 3.22Å; D182-G185 WeakPolarHBondContact OD1-CA 3.47Å; D182-G185 PolarHBondContact OD1-N 3.21Å; D182-G185 WeakPolarHBondContact OD2-CA 3.25Å; G185-E187 VanDerWaalsContact C-N 3.27Å
186	N	88.5	Confident	84.2	Confident	60 Å²	60	50.5 Å²	50.5	32%	0.321	26%	0.261	S	S	.	.	S	Bend	trans	-87.1	4.7	-177.6	68.2	20.8	0	0	0	113.2	D182 D184 M188	D182-N186 PolarHBondContact OD1-N 2.86Å; D182-N186 PolarHBondContact OD1-OD1 3.04Å; D182-N186 PolarHBondContact OD2-N 3.35Å; D184-N186 VanDerWaalsContact OD1-CG 3.25Å; D184-N186 PolarHBondContact OD1-ND2 3.44Å; D184-N186 PolarHBondContact OD2-ND2 3.43Å; N186-M188 PolarHBondContact O-N 3.11Å; N186-M188 VanDerWaalsContact OD1-CA 3.29Å; N186-M188 WeakPolarHBondContact OD1-CA 3.37Å; N186-M188 WeakPolarHBondContact OD1-CB 3.43Å; N186-M188 PolarHBondContact OD1-N 3.31Å; N186-M188 PolarHBondContact OD1-O 3.22Å
187	E	88.4	Confident	84.4	Confident	92 Å²	92	47.9 Å²	47.9	43%	0.43	25%	0.245	S	C	.	.	S	Bend	trans	61	19.5	-174.4	-56	-165.8	158.2	0	0	115	F178 D182 G185 H245 Y246	F178-E187 VanDerWaalsContact CE1-O 3.3Å; F178-E187 WeakPolarHBondContact CE1-O 3.21Å; D182-E187 WeakPolarHBondContact OD2-CA 3.48Å; D182-E187 PolarHBondContact OD2-N 3.26Å; G185-E187 VanDerWaalsContact C-N 3.27Å; E187-H245 WeakPolarHBondContact O-CA 3.46Å; E187-H245 IonicContact OE2-CE1 2.73Å; E187-H245 PolarHBondContact OE2-CE1 3.02Å; E187-H245 IonicContact OE2-NE2 3.31Å; E187-Y246 PolarHBondContact O-N 2.98Å
188	M	90.9	Very high	84.9	Confident	59 Å²	59	47.9 Å²	47.9	29%	0.291	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.6	179.8	-57.2	-73.9	-148.8	0	0	111.3	N186 K243 L244 H245	N186-M188 PolarHBondContact O-N 3.11Å; N186-M188 VanDerWaalsContact OD1-CA 3.29Å; N186-M188 WeakPolarHBondContact OD1-CA 3.37Å; N186-M188 WeakPolarHBondContact OD1-CB 3.43Å; N186-M188 PolarHBondContact OD1-N 3.31Å; N186-M188 PolarHBondContact OD1-O 3.22Å; M188-K243 HydrophobicContact CB-CB 3.92Å; M188-K243 HydrophobicContact CB-CD 4.09Å; M188-K243 HydrophobicContact CG-CB 4.33Å; M188-K243 HydrophobicContact SD-CB 4.22Å; M188-L244 WeakPolarHBondContact CA-O 3.42Å; M188-H245 HydrophobicContact CE-CB 4.32Å; M188-H245 WeakPolarHBondContact SD-CA 3.45Å; M188-H245 HydrophobicContact SD-CB 3.53Å; M188-H245 VanDerWaalsContact SD-CB 3.53Å
189	I	89.6	Confident	85.1	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.5	169.8	-78.4	180	0	0	0	109.3	F178 L181 E193 F194 F236 L244	F178-I189 HydrophobicContact CB-CD1 4.4Å; F178-I189 HydrophobicContact CD1-CD1 3.86Å; F178-I189 HydrophobicContact CD1-CG1 3.97Å; F178-I189 HydrophobicContact CD2-CD1 3.25Å; F178-I189 HydrophobicContact CD2-CG1 4.07Å; F178-I189 HydrophobicContact CE1-CB 4.38Å; F178-I189 HydrophobicContact CE1-CD1 3.86Å; F178-I189 HydrophobicContact CE1-CG1 3.56Å; F178-I189 HydrophobicContact CE2-CB 4.15Å; F178-I189 HydrophobicContact CE2-CD1 3.26Å; F178-I189 HydrophobicContact CE2-CG1 3.69Å; F178-I189 HydrophobicContact CG-CD1 3.57Å; F178-I189 HydrophobicContact CG-CG1 4.2Å; F178-I189 HydrophobicContact CZ-CB 3.84Å; F178-I189 HydrophobicContact CZ-CD1 3.57Å; F178-I189 HydrophobicContact CZ-CG1 3.41Å; F178-I189 VanDerWaalsContact CZ-CG1 3.41Å; L181-I189 HydrophobicContact CB-CD1 4.12Å; L181-I189 HydrophobicContact CB-CG1 4.37Å; L181-I189 HydrophobicContact CD1-CD1 3.84Å; I189-E193 HydrophobicContact CG2-CB 4.02Å; I189-F194 HydrophobicContact CG2-CB 3.89Å; I189-F236 HydrophobicContact CG2-CE1 4.36Å; I189-F236 HydrophobicContact CG2-CZ 4.32Å; I189-F236 WeakPolarHBondContact O-CE1 3.33Å; I189-L244 PolarHBondContact N-O 3.36Å; I189-L244 PolarHBondContact O-N 3.47Å
190	E	90.3	Very high	85	Confident	82 Å²	82	44.8 Å²	44.8	38%	0.383	23%	0.231	S	C	.	.			trans	-86.7	159.6	169.8	-61.8	-171.3	170.9	0	0	111.8	K192 E193 F194 K243	E190-K192 PolarHBondContact O-N 3.07Å; E190-K192 VanDerWaalsContact O-N 3.15Å; E190-E193 PolarHBondContact N-OE2 3.33Å; E190-E193 PolarHBondContact O-N 3.4Å; E190-F194 PolarHBondContact O-N 3.06Å; E190-K243 HydrophobicContact CG-CD 4.18Å; E190-K243 HydrophobicContact CG-CG 4.35Å; E190-K243 WeakPolarHBondContact OE1-CE 3.44Å; E190-K243 IonicContact OE1-NZ 3.86Å; E190-K243 PolarHBondContact OE1-NZ 2.79Å
191	R	90.2	Very high	85.3	Confident	39 Å²	39	41.9 Å²	41.9	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-51.6	-41.9	178.6	-175.8	-176.8	178.2	-150.5	1.6	112.6	E193 F194 V195 E224 N228 F236	R191-E193 PolarHBondContact O-N 3.12Å; R191-F194 PolarHBondContact O-N 3.04Å; R191-V195 WeakPolarHBondContact O-CG2 3.24Å; R191-V195 PolarHBondContact O-N 3.41Å; R191-E224 IonicContact NH1-OE2 3.68Å; R191-N228 PolarHBondContact NH2-OD1 2.93Å; R191-F236 HydrophobicContact CB-CB 4.12Å; R191-F236 HydrophobicContact CB-CD1 4.18Å; R191-F236 HydrophobicContact CB-CD2 4.05Å; R191-F236 HydrophobicContact CB-CG 3.83Å; R191-F236 HydrophobicContact CG-CB 4.46Å; R191-F236 HydrophobicContact CG-CD2 4.07Å; R191-F236 HydrophobicContact CG-CG 4.27Å
192	K	87.3	Confident	85.5	Confident	126 Å²	126	42.5 Å²	42.5	55%	0.548	22%	0.221	S	C	.	.	H	α-helix	trans	-64	-40.9	-179.1	-69	-179.7	-179	175.1	0	111.9	E190 V195 R196	E190-K192 PolarHBondContact O-N 3.07Å; E190-K192 VanDerWaalsContact O-N 3.15Å; K192-V195 PolarHBondContact O-N 3.14Å; K192-R196 WeakPolarHBondContact O-CG 3.39Å; K192-R196 PolarHBondContact O-N 3.07Å
193	E	86.6	Confident	85.3	Confident	23 Å²	23	46.3 Å²	46.3	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-69.9	-39.6	178.6	-67.7	166	153	0	0	111.6	L181 I189 E190 R191 V195 R196 L197	L181-E193 HydrophobicContact CB-CB 4.49Å; I189-E193 HydrophobicContact CG2-CB 4.02Å; E190-E193 PolarHBondContact N-OE2 3.33Å; E190-E193 PolarHBondContact O-N 3.4Å; R191-E193 PolarHBondContact O-N 3.12Å; E193-V195 VanDerWaalsContact C-N 3.34Å; E193-V195 PolarHBondContact O-N 3.23Å; E193-R196 WeakPolarHBondContact O-CA 3.33Å; E193-R196 WeakPolarHBondContact O-CB 3.4Å; E193-R196 PolarHBondContact O-N 2.94Å; E193-R196 VanDerWaalsContact O-N 3.11Å; E193-L197 PolarHBondContact O-N 3.15Å
194	F	88.5	Confident	84.9	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-43.1	172.6	-177.2	-104.7	0	0	0	112.1	F162 I189 E190 R191 R196 L197 Q198 F235 F236	F162-F194 HydrophobicContact CD1-CZ 4.21Å; F162-F194 HydrophobicContact CD2-CE2 4.39Å; F162-F194 HydrophobicContact CE1-CE2 4.17Å; F162-F194 HydrophobicContact CE1-CZ 4.09Å; F162-F194 AromaticContact CE2-CE2 3.97Å; F162-F194 HydrophobicContact CE2-CE2 3.97Å; F162-F194 AromaticContact CZ-CE2 3.88Å; F162-F194 HydrophobicContact CZ-CE2 3.88Å; F162-F194 HydrophobicContact CZ-CZ 4.28Å; I189-F194 HydrophobicContact CG2-CB 3.89Å; E190-F194 PolarHBondContact O-N 3.06Å; R191-F194 PolarHBondContact O-N 3.04Å; F194-R196 VanDerWaalsContact C-N 3.28Å; F194-R196 PolarHBondContact O-N 3.37Å; F194-L197 WeakPolarHBondContact O-CB 3.42Å; F194-L197 PolarHBondContact O-N 3.44Å; F194-L197 VanDerWaalsContact O-N 3.16Å; F194-Q198 HydrophobicContact CD1-CG 4.33Å; F194-Q198 HydrophobicContact CE1-CG 4.03Å; F194-Q198 HydrophobicContact CZ-CG 4.21Å; F194-Q198 WeakPolarHBondContact O-CG 3.31Å; F194-Q198 PolarHBondContact O-N 2.92Å; F194-F235 HydrophobicContact CE1-CD2 4.42Å; F194-F235 HydrophobicContact CE2-CD2 4.11Å; F194-F235 HydrophobicContact CE2-CE2 4Å; F194-F235 AromaticContact CZ-CD2 3.98Å; F194-F235 HydrophobicContact CZ-CD2 3.98Å; F194-F235 AromaticContact CZ-CE2 3.89Å; F194-F235 HydrophobicContact CZ-CE2 3.89Å; F194-F236 HydrophobicContact CB-CE1 4.43Å; F194-F236 HydrophobicContact CB-CE2 3.65Å; F194-F236 HydrophobicContact CB-CZ 3.39Å; F194-F236 AromaticContact CD1-CE2 3.54Å; F194-F236 HydrophobicContact CD1-CE2 3.54Å; F194-F236 HydrophobicContact CD1-CZ 4.1Å; F194-F236 HydrophobicContact CD2-CE2 4.34Å; F194-F236 HydrophobicContact CD2-CZ 4.15Å; F194-F236 HydrophobicContact CE1-CE2 4.24Å; F194-F236 AromaticContact CG-CE2 3.58Å; F194-F236 HydrophobicContact CG-CE2 3.58Å; F194-F236 AromaticContact CG-CZ 3.63Å; F194-F236 HydrophobicContact CG-CZ 3.63Å
195	V	87.2	Confident	84.2	Confident	11 Å²	11	40 Å²	40	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-36.2	174.4	172	0	0	0	0	111.4	R191 K192 E193 Q198 K199 V222	R191-V195 WeakPolarHBondContact O-CG2 3.24Å; R191-V195 PolarHBondContact O-N 3.41Å; K192-V195 PolarHBondContact O-N 3.14Å; E193-V195 VanDerWaalsContact C-N 3.34Å; E193-V195 PolarHBondContact O-N 3.23Å; V195-Q198 PolarHBondContact O-N 3.1Å; V195-K199 HydrophobicContact CG1-CD 4.4Å; V195-K199 WeakPolarHBondContact O-CG 3.28Å; V195-K199 PolarHBondContact O-N 2.92Å; V195-V222 HydrophobicContact CG1-CG1 3.72Å
196	R	84	Confident	83.1	Confident	45 Å²	45	39.3 Å²	39.3	17%	0.17	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-46	172.3	-68.5	175.5	-173	144.1	-1.6	111.2	K192 E193 F194 Q198 K199 I200 E421	K192-R196 WeakPolarHBondContact O-CG 3.39Å; K192-R196 PolarHBondContact O-N 3.07Å; E193-R196 WeakPolarHBondContact O-CA 3.33Å; E193-R196 WeakPolarHBondContact O-CB 3.4Å; E193-R196 PolarHBondContact O-N 2.94Å; E193-R196 VanDerWaalsContact O-N 3.11Å; F194-R196 VanDerWaalsContact C-N 3.28Å; F194-R196 PolarHBondContact O-N 3.37Å; R196-Q198 VanDerWaalsContact C-N 3.35Å; R196-Q198 PolarHBondContact O-N 3.14Å; R196-K199 PolarHBondContact O-N 3.36Å; R196-I200 WeakPolarHBondContact O-CG1 3.15Å; R196-I200 PolarHBondContact O-N 3.24Å; R196-E421 IonicContact CZ-OE2 3.4Å; R196-E421 IonicContact NH2-OE2 2.87Å; R196-E421 PolarHBondContact NH2-OE2 3.07Å
197	L	83.6	Confident	81.4	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-56.2	-48.3	176.5	-178.5	55.8	0	0	0	112	F162 L181 E193 F194 K199 I200 I201	F162-L197 HydrophobicContact CE2-CD2 4.21Å; L181-L197 HydrophobicContact CD1-CB 3.67Å; L181-L197 HydrophobicContact CD1-CD1 4.09Å; L181-L197 HydrophobicContact CD1-CD2 3.87Å; L181-L197 HydrophobicContact CD1-CG 4.05Å; E193-L197 PolarHBondContact O-N 3.15Å; F194-L197 WeakPolarHBondContact O-CB 3.42Å; F194-L197 PolarHBondContact O-N 3.44Å; F194-L197 VanDerWaalsContact O-N 3.16Å; L197-K199 VanDerWaalsContact C-N 3.3Å; L197-K199 PolarHBondContact O-N 3.27Å; L197-I200 PolarHBondContact O-N 2.63Å; L197-I201 HydrophobicContact CD1-CD1 4.13Å; L197-I201 HydrophobicContact CD1-CG1 4.47Å; L197-I201 HydrophobicContact CG-CD1 4.08Å; L197-I201 WeakPolarHBondContact O-CG1 3.44Å; L197-I201 PolarHBondContact O-N 2.91Å
198	Q	85.9	Confident	79.4	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.019	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-39.9	178.3	-68.3	-178.6	-46.4	0	0	112.1	F162 F194 V195 R196 I201 S202	F162-Q198 HydrophobicContact CB-CG 4.27Å; F194-Q198 HydrophobicContact CD1-CG 4.33Å; F194-Q198 HydrophobicContact CE1-CG 4.03Å; F194-Q198 HydrophobicContact CZ-CG 4.21Å; F194-Q198 WeakPolarHBondContact O-CG 3.31Å; F194-Q198 PolarHBondContact O-N 2.92Å; V195-Q198 PolarHBondContact O-N 3.1Å; R196-Q198 VanDerWaalsContact C-N 3.35Å; R196-Q198 PolarHBondContact O-N 3.14Å; Q198-I201 PolarHBondContact O-N 3.19Å; Q198-S202 VanDerWaalsContact O-CB 3.31Å; Q198-S202 WeakPolarHBondContact O-CB 3.23Å; Q198-S202 PolarHBondContact O-N 3.43Å; Q198-S202 PolarHBondContact O-OG 2.85Å
199	K	83.3	Confident	77	Confident	65 Å²	65	44.8 Å²	44.8	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-40.8	175.9	-75	180	179.5	-172.6	0	112.2	V195 R196 L197 I201 S202 K203	V195-K199 HydrophobicContact CG1-CD 4.4Å; V195-K199 WeakPolarHBondContact O-CG 3.28Å; V195-K199 PolarHBondContact O-N 2.92Å; R196-K199 PolarHBondContact O-N 3.36Å; L197-K199 VanDerWaalsContact C-N 3.3Å; L197-K199 PolarHBondContact O-N 3.27Å; K199-I201 VanDerWaalsContact C-N 3.35Å; K199-S202 PolarHBondContact O-N 2.76Å; K199-K203 WeakPolarHBondContact O-CG 3.26Å; K199-K203 PolarHBondContact O-N 3.48Å
200	I	79.9	Confident	74.5	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-45.6	175.9	-65.3	163.7	0	0	0	110.4	R196 L197 S202 K203 Y407 C410 V411 E414	R196-I200 WeakPolarHBondContact O-CG1 3.15Å; R196-I200 PolarHBondContact O-N 3.24Å; L197-I200 PolarHBondContact O-N 2.63Å; I200-S202 VanDerWaalsContact C-N 3.31Å; I200-S202 PolarHBondContact O-N 3.39Å; I200-K203 PolarHBondContact O-N 2.91Å; I200-Y407 HydrophobicContact CG2-CD2 3.61Å; I200-Y407 HydrophobicContact CG2-CE2 3.64Å; I200-C410 HydrophobicContact CG1-CB 4.46Å; I200-C410 HydrophobicContact CG2-CB 3.91Å; I200-V411 HydrophobicContact CD1-CG2 4.11Å; I200-V411 HydrophobicContact CG2-CG2 3.92Å; I200-E414 HydrophobicContact CD1-CB 4.03Å; I200-E414 HydrophobicContact CD1-CG 3.9Å; I200-E414 HydrophobicContact CG1-CG 4.03Å
201	I	81	Confident	71.9	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-40.9	176.5	-66.8	168.1	0	0	0	110.6	L161 F162 T165 L197 Q198 K199 Q204	L161-I201 HydrophobicContact CB-CG2 4.06Å; F162-I201 HydrophobicContact CB-CD1 4.41Å; F162-I201 HydrophobicContact CD2-CD1 3.83Å; T165-I201 HydrophobicContact CG2-CD1 4.42Å; T165-I201 WeakPolarHBondContact OG1-CG2 3.09Å; L197-I201 HydrophobicContact CD1-CD1 4.13Å; L197-I201 HydrophobicContact CD1-CG1 4.47Å; L197-I201 HydrophobicContact CG-CD1 4.08Å; L197-I201 WeakPolarHBondContact O-CG1 3.44Å; L197-I201 PolarHBondContact O-N 2.91Å; Q198-I201 PolarHBondContact O-N 3.19Å; K199-I201 VanDerWaalsContact C-N 3.35Å; I201-Q204 WeakPolarHBondContact O-CB 3.4Å; I201-Q204 PolarHBondContact O-N 2.87Å
202	S	83.3	Confident	69.3	Low	25 Å²	25	58.4 Å²	58.4	18%	0.175	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-36.9	-178.8	-58.3	0	0	0	0	112.7	T158 Q198 K199 I200 Q204 D205	T158-S202 WeakPolarHBondContact CG2-OG 3.48Å; Q198-S202 VanDerWaalsContact O-CB 3.31Å; Q198-S202 WeakPolarHBondContact O-CB 3.23Å; Q198-S202 PolarHBondContact O-N 3.43Å; Q198-S202 PolarHBondContact O-OG 2.85Å; K199-S202 PolarHBondContact O-N 2.76Å; I200-S202 VanDerWaalsContact C-N 3.31Å; I200-S202 PolarHBondContact O-N 3.39Å; S202-Q204 PolarHBondContact O-N 2.81Å; S202-D205 WeakPolarHBondContact O-CB 3.38Å; S202-D205 PolarHBondContact O-N 3.21Å
203	K	79	Confident	66.7	Low	93 Å²	93	58.6 Å²	58.6	40%	0.404	30%	0.297	S	S	.	.	H	α-helix	trans	-55.5	-40.1	174.9	-77	174.8	-179.6	176.6	0	111.4	K199 I200 D205 G206 F207 E414	K199-K203 WeakPolarHBondContact O-CG 3.26Å; K199-K203 PolarHBondContact O-N 3.48Å; I200-K203 PolarHBondContact O-N 2.91Å; K203-D205 PolarHBondContact O-N 3.28Å; K203-D205 VanDerWaalsContact O-N 3.16Å; K203-G206 PolarHBondContact O-N 3.35Å; K203-F207 HydrophobicContact CB-CE2 4.22Å; K203-F207 WeakPolarHBondContact O-CD2 3.45Å; K203-F207 VanDerWaalsContact O-CE2 3.25Å; K203-F207 WeakPolarHBondContact O-CE2 3.2Å; K203-E414 IonicContact NZ-OE1 3.76Å
204	Q	69.2	Low	64.4	Low	32 Å²	32	67.2 Å²	67.2	15%	0.15	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-24.9	177.9	-66.2	-172.9	-8.7	0	0	114.4	I201 S202	I201-Q204 WeakPolarHBondContact O-CB 3.4Å; I201-Q204 PolarHBondContact O-N 2.87Å; S202-Q204 PolarHBondContact O-N 2.81Å
205	D	70.1	Confident	61.7	Low	12 Å²	12	72.7 Å²	72.7	6%	0.064	37%	0.371	C	S	.	.	H	α-helix	trans	-80.1	-32	-179.9	-170.3	62.2	0	0	0	113.5	S81 R83 Y157 L161 S202 K203 F207	S81-D205 WeakPolarHBondContact CB-OD2 3.24Å; S81-D205 VanDerWaalsContact OG-CG 3.27Å; S81-D205 PolarHBondContact OG-OD1 2.8Å; S81-D205 PolarHBondContact OG-OD2 3Å; R83-D205 IonicContact CZ-OD1 3.94Å; R83-D205 IonicContact NE-OD1 3.69Å; R83-D205 PolarHBondContact NE-OD1 2.94Å; R83-D205 IonicContact NH2-OD1 2.79Å; R83-D205 PolarHBondContact NH2-OD1 2.94Å; Y157-D205 PolarHBondContact OH-OD2 2.74Å; L161-D205 HydrophobicContact CD1-CB 3.72Å; L161-D205 HydrophobicContact CD2-CB 4.29Å; S202-D205 WeakPolarHBondContact O-CB 3.38Å; S202-D205 PolarHBondContact O-N 3.21Å; K203-D205 PolarHBondContact O-N 3.28Å; K203-D205 VanDerWaalsContact O-N 3.16Å; D205-F207 PolarHBondContact O-N 2.72Å
206	G	58	Low	58.9	Low	40 Å²	40	79.7 Å²	79.7	41%	0.412	40%	0.403	S	S	.	.	H	α-helix	trans	-74.2	-20	-177.5	0	0	0	0	0	115	K203 K208 T209	K203-G206 PolarHBondContact O-N 3.35Å; G206-K208 PolarHBondContact O-N 2.7Å; G206-T209 PolarHBondContact O-N 3.4Å; G206-T209 VanDerWaalsContact O-O 3.11Å
207	F	52.5	Low	56.8	Low	125 Å²	125	87.4 Å²	87.4	55%	0.548	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-5	-167.3	-83.6	-76	0	0	0	116.7	K203 D205 T209	K203-F207 HydrophobicContact CB-CE2 4.22Å; K203-F207 WeakPolarHBondContact O-CD2 3.45Å; K203-F207 VanDerWaalsContact O-CE2 3.25Å; K203-F207 WeakPolarHBondContact O-CE2 3.2Å; D205-F207 PolarHBondContact O-N 2.72Å; F207-T209 VanDerWaalsContact C-N 3.34Å
208	K	46.3	Very low	54.3	Low	160 Å²	160	94.1 Å²	94.1	70%	0.696	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.6	169.2	-73.1	-168.1	176.7	-177.7	0	113.7	G206	G206-K208 PolarHBondContact O-N 2.7Å
209	T	40.5	Very low	52.1	Low	42 Å²	42	98.8 Å²	98.8	26%	0.258	49%	0.489	S	S	.	.	S	Bend	trans	-116.3	120.4	177.6	-36.5	0	0	0	0	106.2	E78 K79 G206 F207	E78-T209 HydrophobicContact CG-CG2 4.01Å; K79-T209 PolarHBondContact O-OG1 3.13Å; G206-T209 PolarHBondContact O-N 3.4Å; G206-T209 VanDerWaalsContact O-O 3.11Å; F207-T209 VanDerWaalsContact C-N 3.34Å
210	V	38.5	Very low	50.3	Low	96 Å²	96	98.6 Å²	98.6	58%	0.582	50%	0.495	S	S	*	.			trans	83.9	73.9	171	-160.7	0	0	0	0	115.1	T212	V210-T212 VanDerWaalsContact CG1-OG1 3.28Å; V210-T212 WeakPolarHBondContact CG1-OG1 3.31Å; V210-T212 PolarHBondContact O-N 3.41Å; V210-T212 VanDerWaalsContact O-N 3.1Å
211	K	34.1	Very low	48.6	Very low	220 Å²	220	103.4 Å²	103.4	96%	0.957	52%	0.524	S	S	*	.			trans	-71	71.7	135.2	-74.8	-172.4	179.4	-177.5	0	107.5
212	T	35.6	Very low	47.2	Very low	93 Å²	93	106 Å²	106	57%	0.571	54%	0.54	S	S	*	.			trans	-127.6	105.5	166.7	-48.8	0	0	0	0	106.4	V210	V210-T212 VanDerWaalsContact CG1-OG1 3.28Å; V210-T212 WeakPolarHBondContact CG1-OG1 3.31Å; V210-T212 PolarHBondContact O-N 3.41Å; V210-T212 VanDerWaalsContact O-N 3.1Å
213	N	33.7	Very low	45.6	Very low	129 Å²	129	113.6 Å²	113.6	69%	0.69	57%	0.57	S	S	*	*			trans	46.1	114.7	151.3	-55.4	-7.9	0	0	0	116.8	T215	N213-T215 VanDerWaalsContact C-N 3.3Å; N213-T215 PolarHBondContact O-N 2.83Å; N213-T215 PolarHBondContact O-OG1 3.34Å
214	E	39.2	Very low	44.7	Very low	204 Å²	204	114.5 Å²	114.5	95%	0.953	58%	0.576	S	S	*	*			trans	-42.5	93.3	157.1	-58	178.7	154.3	0	0	110
215	T	29.8	Very low	44.4	Very low	116 Å²	116	115.3 Å²	115.3	71%	0.712	58%	0.584	S	S	*	*			trans	-140.5	114.8	173.7	12.5	0	0	0	0	108.4	N213	N213-T215 VanDerWaalsContact C-N 3.3Å; N213-T215 PolarHBondContact O-N 2.83Å; N213-T215 PolarHBondContact O-OG1 3.34Å
216	E	29.8	Very low	44.6	Very low	158 Å²	158	118 Å²	118	74%	0.738	61%	0.614	S	S	*	*			trans	58.3	98.7	166.9	-69.1	-173.8	146.2	0	0	117.8	Q218	E216-Q218 HydrophobicContact CB-CG 4.3Å; E216-Q218 PolarHBondContact O-N 2.82Å
217	Y	39	Very low	45.9	Very low	208 Å²	208	116.5 Å²	116.5	82%	0.816	60%	0.597	S	S	*	*			trans	-60.7	73.5	149.4	-67.1	-81.8	0	0	0	110	D219	Y217-D219 PolarHBondContact O-N 3.23Å
218	Q	31.4	Very low	47.7	Very low	149 Å²	149	112.2 Å²	112.2	70%	0.696	58%	0.58	S	S	*	*			trans	-62.6	124.9	160.6	-68.5	-171.4	2.6	0	0	106.6	E216 P220	E216-Q218 HydrophobicContact CB-CG 4.3Å; E216-Q218 PolarHBondContact O-N 2.82Å; Q218-P220 WeakPolarHBondContact O-CD 3.28Å
219	D	40	Very low	50	Low	101 Å²	101	104.7 Å²	104.7	54%	0.54	55%	0.547	S	S	.	.			trans	-43.9	114.8	170.8	178	36.2	0	0	0	107.6	Y217 T221 K417	Y217-D219 PolarHBondContact O-N 3.23Å; D219-T221 PolarHBondContact O-N 3.49Å; D219-T221 PolarHBondContact O-OG1 3.11Å; D219-K417 IonicContact OD1-NZ 3.22Å; D219-K417 PolarHBondContact OD1-NZ 3.45Å
220	P	44.6	Very low	52.6	Low	62 Å²	62	102.7 Å²	102.7	40%	0.403	54%	0.535	S	S	.	.			trans	-73.7	76.6	171.9	30.9	-30.5	0	0	0	104.8	Q218 V222	Q218-P220 WeakPolarHBondContact O-CD 3.28Å; P220-V222 VanDerWaalsContact C-N 3.33Å; P220-V222 PolarHBondContact O-N 2.87Å
221	T	45.1	Very low	55.3	Low	103 Å²	103	98.1 Å²	98.1	63%	0.632	51%	0.507	S	S	*	.			trans	-40.5	115.3	149.6	14.8	0	0	0	0	103.4	D219 K223	D219-T221 PolarHBondContact O-N 3.49Å; D219-T221 PolarHBondContact O-OG1 3.11Å; T221-K223 PolarHBondContact O-N 3.38Å
222	V	51.1	Low	58.1	Low	57 Å²	57	87.8 Å²	87.8	35%	0.345	46%	0.463	S	S	.	.			trans	-63.6	92.6	178.8	177.1	0	0	0	0	103.6	V195 P220 E224	V195-V222 HydrophobicContact CG1-CG1 3.72Å; P220-V222 VanDerWaalsContact C-N 3.33Å; P220-V222 PolarHBondContact O-N 2.87Å; V222-E224 PolarHBondContact O-N 2.87Å
223	K	51.1	Low	60.9	Low	186 Å²	186	83.6 Å²	83.6	81%	0.809	44%	0.437	S	S	*	.			trans	-56.7	102.3	162.1	-78.3	-169.1	178.3	-177.2	0	103	T221	T221-K223 PolarHBondContact O-N 3.38Å
224	E	58.6	Low	63.7	Low	111 Å²	111	80 Å²	80	52%	0.519	41%	0.414	S	S	.	.			trans	-56.5	136.9	172.8	-74.7	-165.2	160.3	0	0	105.9	R191 V222 G226	R191-E224 IonicContact NH1-OE2 3.68Å; V222-E224 PolarHBondContact O-N 2.87Å; E224-G226 PolarHBondContact O-N 2.95Å
225	P	64.1	Low	66.3	Low	49 Å²	49	71 Å²	71	32%	0.318	37%	0.371	S	S	.	.			trans	-53.5	130.3	174.1	14.7	-20.7	0	0	0	108.3	V227	P225-V227 PolarHBondContact O-N 2.87Å
226	G	74	Confident	69.3	Low	68 Å²	68	65.4 Å²	65.4	70%	0.701	34%	0.337	S	S	*	.	S	Bend	trans	-60.8	-17.1	-173.5	0	0	0	0	0	113.6	E224	E224-G226 PolarHBondContact O-N 2.95Å
227	V	85.2	Confident	72.3	Confident	10 Å²	10	58 Å²	58	6%	0.061	30%	0.303	C	S	.	.	S	Bend	trans	-132.5	151.5	175.1	-65.9	0	0	0	0	111.2	H95 Y100 K126 I129 P225	H95-V227 VanDerWaalsContact NE2-CG1 3.28Å; H95-V227 WeakPolarHBondContact NE2-CG1 3.31Å; Y100-V227 HydrophobicContact CE1-CG2 4.42Å; K126-V227 HydrophobicContact CG-CG1 4.4Å; I129-V227 HydrophobicContact CD1-CB 4.21Å; I129-V227 HydrophobicContact CD1-CG1 3.94Å; I129-V227 HydrophobicContact CD1-CG2 4.14Å; I129-V227 HydrophobicContact CG2-CB 4.35Å; P225-V227 PolarHBondContact O-N 2.87Å
228	N	90.7	Very high	74.7	Confident	35 Å²	35	52.9 Å²	52.9	19%	0.187	29%	0.285	C	S	.	.			trans	-69.3	157.7	169.2	-78.5	-23.2	0	0	0	110.8	L133 R191 V233 K238	L133-N228 HydrophobicContact CD1-CB 3.79Å; L133-N228 VanDerWaalsContact CD1-O 3.29Å; L133-N228 WeakPolarHBondContact CD1-O 3.05Å; R191-N228 PolarHBondContact NH2-OD1 2.93Å; N228-V233 HydrophobicContact CB-CG2 3.83Å; N228-K238 PolarHBondContact ND2-O 2.94Å
229	T	94.8	Very high	77.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.292	C	S	.	.			trans	-129.3	170.7	178.4	57.7	0	0	0	0	110.9	E159 L231 Q232 V233	E159-T229 VanDerWaalsContact CD-CB 3.47Å; E159-T229 WeakPolarHBondContact OE1-CB 3.19Å; E159-T229 PolarHBondContact OE1-OG1 3.27Å; E159-T229 WeakPolarHBondContact OE2-CB 3.31Å; E159-T229 WeakPolarHBondContact OE2-CG2 3.38Å; E159-T229 PolarHBondContact OE2-OG1 3.07Å; T229-L231 PolarHBondContact O-N 2.88Å; T229-Q232 PolarHBondContact O-N 3.16Å; T229-Q232 VanDerWaalsContact OG1-CG 3.26Å; T229-Q232 WeakPolarHBondContact OG1-CG 3.41Å; T229-V233 WeakPolarHBondContact O-CG2 3.42Å; T229-V233 PolarHBondContact O-N 3.29Å
230	T	95.4	Very high	79.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-55.4	-50.9	-177.1	-56.5	0	0	0	0	112.2	I136 L149 G153 V154 R234	I136-T230 HydrophobicContact CD1-CG2 4.03Å; L149-T230 HydrophobicContact CD1-CG2 3.91Å; G153-T230 VanDerWaalsContact CA-OG1 3.32Å; G153-T230 WeakPolarHBondContact CA-OG1 3.46Å; V154-T230 PolarHBondContact N-OG1 3.4Å; V154-T230 WeakPolarHBondContact O-CB 3.19Å; V154-T230 PolarHBondContact O-N 3.45Å; V154-T230 PolarHBondContact O-OG1 2.75Å; T230-R234 WeakPolarHBondContact O-CB 3.26Å; T230-R234 PolarHBondContact O-N 3.29Å
231	L	94.3	Very high	81.8	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.7	-36.4	-176.3	-53.5	-178.3	0	0	0	111.1	F146 E159 F162 L163 T229 R234 F235 F252	F146-L231 HydrophobicContact CZ-CD2 4.31Å; E159-L231 HydrophobicContact CB-CD1 4Å; E159-L231 HydrophobicContact CG-CD1 3.93Å; E159-L231 HydrophobicContact CG-CG 4.36Å; E159-L231 VanDerWaalsContact OE1-CB 3.24Å; E159-L231 WeakPolarHBondContact OE1-CB 3.32Å; E159-L231 PolarHBondContact OE1-N 2.95Å; F162-L231 HydrophobicContact CD1-CD1 3.81Å; F162-L231 HydrophobicContact CE1-CD1 4.06Å; L163-L231 HydrophobicContact CD1-CD1 4.33Å; L163-L231 HydrophobicContact CD2-CD1 3.87Å; L163-L231 HydrophobicContact CD2-CD2 4.34Å; L163-L231 HydrophobicContact CG-CD1 4.02Å; T229-L231 PolarHBondContact O-N 2.88Å; L231-R234 PolarHBondContact O-N 2.97Å; L231-F235 HydrophobicContact CB-CD2 4.25Å; L231-F235 HydrophobicContact CB-CE2 4.08Å; L231-F235 WeakPolarHBondContact O-CB 3.4Å; L231-F235 WeakPolarHBondContact O-CD2 3.13Å; L231-F235 WeakPolarHBondContact O-CG 3.44Å; L231-F235 PolarHBondContact O-N 3Å; L231-F252 HydrophobicContact CD2-CE2 4.17Å; L231-F252 HydrophobicContact CD2-CZ 3.67Å
232	Q	93.1	Very high	84.1	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.019	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-49.4	176.8	-70.7	-178.4	21.1	0	0	112	T229 R234 F236	T229-Q232 PolarHBondContact O-N 3.16Å; T229-Q232 VanDerWaalsContact OG1-CG 3.26Å; T229-Q232 WeakPolarHBondContact OG1-CG 3.41Å; Q232-R234 VanDerWaalsContact C-N 3.31Å; Q232-R234 PolarHBondContact O-N 2.94Å; Q232-F236 WeakPolarHBondContact O-CA 3.41Å; Q232-F236 WeakPolarHBondContact O-CB 3.43Å; Q232-F236 PolarHBondContact O-N 2.77Å
233	V	93.7	Very high	86.1	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-38.8	177.5	175.7	0	0	0	0	110.7	L133 I136 Q137 N228 T229 G237	L133-V233 HydrophobicContact CB-CG2 4.38Å; L133-V233 HydrophobicContact CD1-CG2 4.11Å; I136-V233 HydrophobicContact CB-CG1 4.39Å; I136-V233 HydrophobicContact CG2-CG1 4.44Å; Q137-V233 HydrophobicContact CG-CG1 3.73Å; N228-V233 HydrophobicContact CB-CG2 3.83Å; T229-V233 WeakPolarHBondContact O-CG2 3.42Å; T229-V233 PolarHBondContact O-N 3.29Å; V233-G237 VanDerWaalsContact O-CA 3.23Å; V233-G237 WeakPolarHBondContact O-CA 3.46Å; V233-G237 PolarHBondContact O-N 3.17Å
234	R	93.1	Very high	88	Confident	54 Å²	54	47.4 Å²	47.4	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-43.4	-178.6	-179.7	62	-165.1	98.7	-4.2	112.7	I136 F145 T230 L231 Q232	I136-R234 HydrophobicContact CG2-CB 4.06Å; F145-R234 HydrophobicContact CE1-CG 4.45Å; F145-R234 HydrophobicContact CZ-CG 4.07Å; T230-R234 WeakPolarHBondContact O-CB 3.26Å; T230-R234 PolarHBondContact O-N 3.29Å; L231-R234 PolarHBondContact O-N 2.97Å; Q232-R234 VanDerWaalsContact C-N 3.31Å; Q232-R234 PolarHBondContact O-N 2.94Å
235	F	93.2	Very high	89.6	Confident	13 Å²	13	44.8 Å²	44.8	6%	0.057	23%	0.225	C	C	.	.	H	α-helix	trans	-86.6	-40	-176.2	-64.5	-26.1	0	0	0	113	F194 L231 L244 F252	F194-F235 HydrophobicContact CE1-CD2 4.42Å; F194-F235 HydrophobicContact CE2-CD2 4.11Å; F194-F235 HydrophobicContact CE2-CE2 4Å; F194-F235 AromaticContact CZ-CD2 3.98Å; F194-F235 HydrophobicContact CZ-CD2 3.98Å; F194-F235 AromaticContact CZ-CE2 3.89Å; F194-F235 HydrophobicContact CZ-CE2 3.89Å; L231-F235 HydrophobicContact CB-CD2 4.25Å; L231-F235 HydrophobicContact CB-CE2 4.08Å; L231-F235 WeakPolarHBondContact O-CB 3.4Å; L231-F235 WeakPolarHBondContact O-CD2 3.13Å; L231-F235 WeakPolarHBondContact O-CG 3.44Å; L231-F235 PolarHBondContact O-N 3Å; F235-L244 HydrophobicContact CB-CB 4.4Å; F235-L244 HydrophobicContact CB-CD1 4.18Å; F235-L244 HydrophobicContact CB-CD2 4.03Å; F235-L244 HydrophobicContact CB-CG 4.45Å; F235-L244 HydrophobicContact CD1-CD1 3.79Å; F235-L244 HydrophobicContact CD1-CD2 4.07Å; F235-L244 HydrophobicContact CD2-CD2 3.79Å; F235-L244 HydrophobicContact CE1-CD1 4.43Å; F235-L244 HydrophobicContact CE1-CD2 4.49Å; F235-L244 HydrophobicContact CE2-CD2 4.23Å; F235-L244 HydrophobicContact CG-CD1 4.07Å; F235-L244 HydrophobicContact CG-CD2 3.71Å; F235-L244 HydrophobicContact CG-CG 4.44Å; F235-F252 HydrophobicContact CE1-CB 4.2Å; F235-F252 HydrophobicContact CE1-CD1 4.2Å; F235-F252 AromaticContact CE1-CD2 3.84Å; F235-F252 HydrophobicContact CE1-CD2 3.84Å; F235-F252 HydrophobicContact CE1-CE2 4.25Å; F235-F252 AromaticContact CE1-CG 3.81Å; F235-F252 HydrophobicContact CE1-CG 3.81Å; F235-F252 HydrophobicContact CZ-CB 4.39Å; F235-F252 AromaticContact CZ-CD1 3.59Å; F235-F252 HydrophobicContact CZ-CD1 3.59Å; F235-F252 AromaticContact CZ-CD2 3.93Å; F235-F252 HydrophobicContact CZ-CD2 3.93Å; F235-F252 AromaticContact CZ-CE1 3.72Å; F235-F252 HydrophobicContact CZ-CE1 3.72Å; F235-F252 HydrophobicContact CZ-CE2 4.05Å; F235-F252 AromaticContact CZ-CG 3.69Å; F235-F252 HydrophobicContact CZ-CG 3.69Å; F235-F252 AromaticContact CZ-CZ 3.96Å; F235-F252 HydrophobicContact CZ-CZ 3.96Å
236	F	93.7	Very high	90.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-116.3	-3.3	-169.2	-48.4	-70.7	0	0	0	113.5	I189 R191 F194 Q232 G240 E241 K242 L244	I189-F236 HydrophobicContact CG2-CE1 4.36Å; I189-F236 HydrophobicContact CG2-CZ 4.32Å; I189-F236 WeakPolarHBondContact O-CE1 3.33Å; R191-F236 HydrophobicContact CB-CB 4.12Å; R191-F236 HydrophobicContact CB-CD1 4.18Å; R191-F236 HydrophobicContact CB-CD2 4.05Å; R191-F236 HydrophobicContact CB-CG 3.83Å; R191-F236 HydrophobicContact CG-CB 4.46Å; R191-F236 HydrophobicContact CG-CD2 4.07Å; R191-F236 HydrophobicContact CG-CG 4.27Å; F194-F236 HydrophobicContact CB-CE1 4.43Å; F194-F236 HydrophobicContact CB-CE2 3.65Å; F194-F236 HydrophobicContact CB-CZ 3.39Å; F194-F236 AromaticContact CD1-CE2 3.54Å; F194-F236 HydrophobicContact CD1-CE2 3.54Å; F194-F236 HydrophobicContact CD1-CZ 4.1Å; F194-F236 HydrophobicContact CD2-CE2 4.34Å; F194-F236 HydrophobicContact CD2-CZ 4.15Å; F194-F236 HydrophobicContact CE1-CE2 4.24Å; F194-F236 AromaticContact CG-CE2 3.58Å; F194-F236 HydrophobicContact CG-CE2 3.58Å; F194-F236 AromaticContact CG-CZ 3.63Å; F194-F236 HydrophobicContact CG-CZ 3.63Å; Q232-F236 WeakPolarHBondContact O-CA 3.41Å; Q232-F236 WeakPolarHBondContact O-CB 3.43Å; Q232-F236 PolarHBondContact O-N 2.77Å; F236-G240 CarbonylContact O-C 3.52Å; F236-G240 WeakPolarHBondContact O-CA 3.32Å; F236-G240 PolarHBondContact O-N 3.36Å; F236-E241 PolarHBondContact O-N 3.38Å; F236-K242 WeakPolarHBondContact CD1-O 3.37Å; F236-K242 PolarHBondContact O-N 3.29Å; F236-L244 HydrophobicContact CD1-CB 4.43Å; F236-L244 HydrophobicContact CE1-CB 3.67Å; F236-L244 HydrophobicContact CZ-CB 4.16Å; F236-L244 HydrophobicContact CZ-CD2 4.35Å
237	G	91.9	Very high	91.6	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.021	22%	0.215	C	C	.	.			trans	79.2	179.7	-176	0	0	0	0	0	113.5	V233 R239 G240 E241	V233-G237 VanDerWaalsContact O-CA 3.23Å; V233-G237 WeakPolarHBondContact O-CA 3.46Å; V233-G237 PolarHBondContact O-N 3.17Å; G237-R239 VanDerWaalsContact C-N 3.29Å; G237-R239 PolarHBondContact O-N 3.15Å; G237-G240 PolarHBondContact O-N 2.81Å; G237-E241 WeakPolarHBondContact CA-OE1 3.2Å
238	K	89.1	Confident	92	Very high	101 Å²	101	52 Å²	52	44%	0.439	23%	0.231	S	C	.	.	S	Bend	trans	-66.5	-31	-173.2	-174.2	173.2	-179.1	174.2	0	112	E130 N228	E130-K238 IonicContact OE2-NZ 3.99Å; E130-K238 PolarHBondContact OE2-NZ 3.13Å; N228-K238 PolarHBondContact ND2-O 2.94Å
239	R	88.2	Confident	92	Very high	222 Å²	222	50.5 Å²	50.5	84%	0.838	22%	0.223	S	C	*	.	S	Bend	trans	-108.8	3.4	-177.2	-60.5	-176.7	-176.1	-93.2	2.8	112.7	G237 E241	G237-R239 VanDerWaalsContact C-N 3.29Å; G237-R239 PolarHBondContact O-N 3.15Å; R239-E241 VanDerWaalsContact C-N 3.3Å; R239-E241 VanDerWaalsContact CA-OE2 3.31Å; R239-E241 WeakPolarHBondContact CA-OE2 3.46Å; R239-E241 WeakPolarHBondContact CB-OE2 3.41Å; R239-E241 PolarHBondContact N-OE2 2.94Å
240	G	88.2	Confident	91.8	Very high	24 Å²	24	55.8 Å²	55.8	25%	0.247	24%	0.243	C	C	.	.	S	Bend	trans	74.5	23.1	-175	0	0	0	0	0	113.2	F236 G237	F236-G240 CarbonylContact O-C 3.52Å; F236-G240 WeakPolarHBondContact O-CA 3.32Å; F236-G240 PolarHBondContact O-N 3.36Å; G237-G240 PolarHBondContact O-N 2.81Å
241	E	90	Very high	91.7	Very high	109 Å²	109	61.3 Å²	61.3	51%	0.509	26%	0.264	S	S	.	.			trans	-77.3	-20.5	-175.3	71.7	-73.9	173.8	0	0	114.1	F236 G237 R239	F236-E241 PolarHBondContact O-N 3.38Å; G237-E241 WeakPolarHBondContact CA-OE1 3.2Å; R239-E241 VanDerWaalsContact C-N 3.3Å; R239-E241 VanDerWaalsContact CA-OE2 3.31Å; R239-E241 WeakPolarHBondContact CA-OE2 3.46Å; R239-E241 WeakPolarHBondContact CB-OE2 3.41Å; R239-E241 PolarHBondContact N-OE2 2.94Å
242	K	92.5	Very high	91.6	Very high	98 Å²	98	61.7 Å²	61.7	43%	0.426	27%	0.266	S	S	.	.	S	Bend	trans	-91	151	178.1	-56.3	179.2	-175.3	175.9	0	110.1	F236	F236-K242 WeakPolarHBondContact CD1-O 3.37Å; F236-K242 PolarHBondContact O-N 3.29Å
243	K	92.7	Very high	91.5	Very high	86 Å²	86	61.5 Å²	61.5	37%	0.374	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-103.7	147	166	-54.1	-170	172	-158.8	0	109.2	M188 E190	M188-K243 HydrophobicContact CB-CB 3.92Å; M188-K243 HydrophobicContact CB-CD 4.09Å; M188-K243 HydrophobicContact CG-CB 4.33Å; M188-K243 HydrophobicContact SD-CB 4.22Å; E190-K243 HydrophobicContact CG-CD 4.18Å; E190-K243 HydrophobicContact CG-CG 4.35Å; E190-K243 WeakPolarHBondContact OE1-CE 3.44Å; E190-K243 IonicContact OE1-NZ 3.86Å; E190-K243 PolarHBondContact OE1-NZ 2.79Å
244	L	92.4	Very high	91.4	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.9	-179.4	179.2	63.8	0	0	0	109.5	F178 M188 I189 F235 F236 E248 F249	F178-L244 WeakPolarHBondContact CZ-O 3.47Å; M188-L244 WeakPolarHBondContact CA-O 3.42Å; I189-L244 PolarHBondContact N-O 3.36Å; I189-L244 PolarHBondContact O-N 3.47Å; F235-L244 HydrophobicContact CB-CB 4.4Å; F235-L244 HydrophobicContact CB-CD1 4.18Å; F235-L244 HydrophobicContact CB-CD2 4.03Å; F235-L244 HydrophobicContact CB-CG 4.45Å; F235-L244 HydrophobicContact CD1-CD1 3.79Å; F235-L244 HydrophobicContact CD1-CD2 4.07Å; F235-L244 HydrophobicContact CD2-CD2 3.79Å; F235-L244 HydrophobicContact CE1-CD1 4.43Å; F235-L244 HydrophobicContact CE1-CD2 4.49Å; F235-L244 HydrophobicContact CE2-CD2 4.23Å; F235-L244 HydrophobicContact CG-CD1 4.07Å; F235-L244 HydrophobicContact CG-CD2 3.71Å; F235-L244 HydrophobicContact CG-CG 4.44Å; F236-L244 HydrophobicContact CD1-CB 4.43Å; F236-L244 HydrophobicContact CE1-CB 3.67Å; F236-L244 HydrophobicContact CZ-CB 4.16Å; F236-L244 HydrophobicContact CZ-CD2 4.35Å; L244-E248 HydrophobicContact CD1-CB 3.91Å; L244-F249 HydrophobicContact CD2-CB 4.02Å; L244-F249 HydrophobicContact CD2-CD2 3.75Å; L244-F249 HydrophobicContact CD2-CG 4.37Å; L244-F249 HydrophobicContact CG-CB 4.19Å
245	H	92.5	Very high	91.5	Very high	56 Å²	56	63 Å²	63	26%	0.259	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	146.1	176.8	-165.9	-70.2	0	0	0	111.2	E187 M188 K247 E248 F249	E187-H245 WeakPolarHBondContact O-CA 3.46Å; E187-H245 IonicContact OE2-CE1 2.73Å; E187-H245 PolarHBondContact OE2-CE1 3.02Å; E187-H245 IonicContact OE2-NE2 3.31Å; M188-H245 HydrophobicContact CE-CB 4.32Å; M188-H245 WeakPolarHBondContact SD-CA 3.45Å; M188-H245 HydrophobicContact SD-CB 3.53Å; M188-H245 VanDerWaalsContact SD-CB 3.53Å; H245-K247 PolarHBondContact ND1-N 2.92Å; H245-K247 VanDerWaalsContact ND1-N 3.17Å; H245-K247 PolarHBondContact O-N 3.31Å; H245-E248 HydrophobicContact CB-CG 4.2Å; H245-E248 PolarHBondContact N-OE2 2.89Å; H245-E248 WeakPolarHBondContact O-CB 3.4Å; H245-E248 PolarHBondContact O-N 2.99Å; H245-F249 PolarHBondContact O-N 3.29Å
246	Y	89.3	Confident	91.5	Very high	30 Å²	30	62.5 Å²	62.5	12%	0.118	27%	0.273	C	S	.	.	H	α-helix	trans	-52.9	-47.8	178.5	176.2	-108.8	0	0	0	113.2	H175 F178 E187 E248 F249 R250	H175-Y246 HydrophobicContact CB-CE2 4.19Å; H175-Y246 WeakPolarHBondContact CB-OH 3.34Å; H175-Y246 AromaticContact CG-CZ 3.97Å; H175-Y246 AromaticContact ND1-CE1 3.51Å; H175-Y246 AromaticContact ND1-CE2 3.72Å; H175-Y246 AromaticContact ND1-CZ 3.35Å; F178-Y246 HydrophobicContact CB-CD2 3.96Å; F178-Y246 HydrophobicContact CB-CE2 4.35Å; F178-Y246 HydrophobicContact CD1-CD2 4.1Å; F178-Y246 HydrophobicContact CD1-CG 4.5Å; F178-Y246 AromaticContact CD2-CD2 3.79Å; F178-Y246 HydrophobicContact CD2-CD2 3.79Å; F178-Y246 HydrophobicContact CE2-CD2 4.28Å; F178-Y246 AromaticContact CG-CD2 3.69Å; F178-Y246 HydrophobicContact CG-CD2 3.69Å; F178-Y246 HydrophobicContact CG-CG 4.5Å; E187-Y246 PolarHBondContact O-N 2.98Å; Y246-E248 VanDerWaalsContact C-N 3.27Å; Y246-E248 PolarHBondContact O-N 3.48Å; Y246-F249 CarbonylContact O-C 3.16Å; Y246-F249 WeakPolarHBondContact O-CB 3.46Å; Y246-F249 PolarHBondContact O-N 2.87Å; Y246-F249 VanDerWaalsContact O-N 3.15Å; Y246-R250 WeakPolarHBondContact O-CB 3.3Å; Y246-R250 PolarHBondContact O-N 2.73Å
247	K	90.9	Very high	91.5	Very high	163 Å²	163	63.2 Å²	63.2	71%	0.709	28%	0.276	S	S	*	.	H	α-helix	trans	-51.9	-40	172.9	-172.3	177.2	-179.6	177.8	0	114	H245 R251	H245-K247 PolarHBondContact ND1-N 2.92Å; H245-K247 VanDerWaalsContact ND1-N 3.17Å; H245-K247 PolarHBondContact O-N 3.31Å; K247-R251 WeakPolarHBondContact O-CB 3.4Å; K247-R251 PolarHBondContact O-N 3.25Å; K247-R251 VanDerWaalsContact O-N 3.07Å
248	E	92	Very high	91.6	Very high	84 Å²	84	65 Å²	65	39%	0.393	29%	0.287	S	S	.	.	H	α-helix	trans	-71.7	-42.1	177.6	-64.6	-174.9	118.4	0	0	111.6	L244 H245 Y246 R251 F252	L244-E248 HydrophobicContact CD1-CB 3.91Å; H245-E248 HydrophobicContact CB-CG 4.2Å; H245-E248 PolarHBondContact N-OE2 2.89Å; H245-E248 WeakPolarHBondContact O-CB 3.4Å; H245-E248 PolarHBondContact O-N 2.99Å; Y246-E248 VanDerWaalsContact C-N 3.27Å; Y246-E248 PolarHBondContact O-N 3.48Å; E248-R251 PolarHBondContact O-N 3.29Å; E248-F252 PolarHBondContact O-N 3.43Å
249	F	91.2	Very high	91.9	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-47.6	173.4	179.4	-93.4	0	0	0	111.6	F162 I166 F174 F178 L244 H245 Y246 R251 F252 V253	F162-F249 AromaticContact CE2-CE2 3.93Å; F162-F249 HydrophobicContact CE2-CE2 3.93Å; F162-F249 HydrophobicContact CE2-CZ 4.01Å; F162-F249 AromaticContact CZ-CE2 3.5Å; F162-F249 HydrophobicContact CZ-CE2 3.5Å; F162-F249 VanDerWaalsContact CZ-CE2 3.5Å; F162-F249 AromaticContact CZ-CZ 3.83Å; F162-F249 HydrophobicContact CZ-CZ 3.83Å; I166-F249 HydrophobicContact CG2-CZ 4.45Å; F174-F249 HydrophobicContact CB-CE1 3.89Å; F174-F249 AromaticContact CD1-CE1 3.89Å; F174-F249 HydrophobicContact CD1-CE1 3.89Å; F174-F249 AromaticContact CD1-CZ 3.97Å; F174-F249 HydrophobicContact CD1-CZ 3.97Å; F174-F249 AromaticContact CG-CE1 3.92Å; F174-F249 HydrophobicContact CG-CE1 3.92Å; F174-F249 HydrophobicContact CG-CZ 4.43Å; F178-F249 HydrophobicContact CD2-CB 4.45Å; F178-F249 HydrophobicContact CD2-CD1 4.19Å; F178-F249 HydrophobicContact CD2-CG 4.22Å; F178-F249 HydrophobicContact CE2-CB 3.9Å; F178-F249 HydrophobicContact CE2-CD1 4.47Å; F178-F249 HydrophobicContact CE2-CG 4.07Å; L244-F249 HydrophobicContact CD2-CB 4.02Å; L244-F249 HydrophobicContact CD2-CD2 3.75Å; L244-F249 HydrophobicContact CD2-CG 4.37Å; L244-F249 HydrophobicContact CG-CB 4.19Å; H245-F249 PolarHBondContact O-N 3.29Å; Y246-F249 CarbonylContact O-C 3.16Å; Y246-F249 WeakPolarHBondContact O-CB 3.46Å; Y246-F249 PolarHBondContact O-N 2.87Å; Y246-F249 VanDerWaalsContact O-N 3.15Å; F249-R251 PolarHBondContact O-N 3.12Å; F249-F252 WeakPolarHBondContact O-CB 3.44Å; F249-F252 PolarHBondContact O-N 2.89Å; F249-F252 VanDerWaalsContact O-N 3.12Å; F249-V253 HydrophobicContact CD1-CG2 4.16Å; F249-V253 HydrophobicContact CE1-CG2 3.72Å; F249-V253 HydrophobicContact CZ-CG2 4.02Å; F249-V253 WeakPolarHBondContact O-CG2 3.39Å; F249-V253 PolarHBondContact O-N 3.36Å
250	R	90.4	Very high	92.2	Very high	113 Å²	113	49.7 Å²	49.7	43%	0.426	23%	0.226	S	C	.	.	H	α-helix	trans	-57.1	-49.2	176.9	179.3	-179.3	170.4	178.6	0.5	111.2	Y246 F252 V253 E254	Y246-R250 WeakPolarHBondContact O-CB 3.3Å; Y246-R250 PolarHBondContact O-N 2.73Å; R250-F252 VanDerWaalsContact C-N 3.28Å; R250-F252 PolarHBondContact O-N 3.02Å; R250-V253 PolarHBondContact O-N 3.28Å; R250-V253 VanDerWaalsContact O-N 3.13Å; R250-E254 HydrophobicContact CG-CG 4.49Å; R250-E254 IonicContact CZ-OE1 2.75Å; R250-E254 IonicContact NE-OE1 3.25Å; R250-E254 PolarHBondContact NE-OE1 2.77Å; R250-E254 IonicContact NH2-OE1 3.4Å; R250-E254 PolarHBondContact NH2-OE1 3.35Å; R250-E254 WeakPolarHBondContact O-CG 3.47Å; R250-E254 PolarHBondContact O-N 3.34Å
251	R	92.6	Very high	92.5	Very high	116 Å²	116	49.8 Å²	49.8	44%	0.438	22%	0.22	S	C	.	.	H	α-helix	trans	-59.5	-39	176.4	-177.4	176.8	63	-176.8	-4.6	112	K247 E248 F249 N255	K247-R251 WeakPolarHBondContact O-CB 3.4Å; K247-R251 PolarHBondContact O-N 3.25Å; K247-R251 VanDerWaalsContact O-N 3.07Å; E248-R251 PolarHBondContact O-N 3.29Å; F249-R251 PolarHBondContact O-N 3.12Å; R251-N255 VanDerWaalsContact O-CB 3.26Å; R251-N255 WeakPolarHBondContact O-CB 3.39Å; R251-N255 PolarHBondContact O-N 3.47Å; R251-N255 PolarHBondContact O-ND2 2.83Å
252	F	93	Very high	92.7	Very high	7 Å²	7	47 Å²	47	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-44.3	175	173.4	-93.7	0	0	0	112	F145 F146 F162 L163 I166 L231 F235 E248 F249 R250 N255 L256	F145-F252 HydrophobicContact CD1-CE2 4.27Å; F145-F252 HydrophobicContact CE1-CE2 4.34Å; F146-F252 HydrophobicContact CE2-CE2 4.02Å; F146-F252 AromaticContact CE2-CZ 3.99Å; F146-F252 HydrophobicContact CE2-CZ 3.99Å; F146-F252 HydrophobicContact CZ-CZ 4.31Å; F162-F252 HydrophobicContact CE1-CE1 4.43Å; L163-F252 HydrophobicContact CD2-CE1 4.16Å; L163-F252 HydrophobicContact CD2-CZ 3.99Å; I166-F252 HydrophobicContact CD1-CD1 4.01Å; I166-F252 HydrophobicContact CD1-CE1 3.5Å; I166-F252 VanDerWaalsContact CD1-CE1 3.5Å; L231-F252 HydrophobicContact CD2-CE2 4.17Å; L231-F252 HydrophobicContact CD2-CZ 3.67Å; F235-F252 HydrophobicContact CE1-CB 4.2Å; F235-F252 HydrophobicContact CE1-CD1 4.2Å; F235-F252 AromaticContact CE1-CD2 3.84Å; F235-F252 HydrophobicContact CE1-CD2 3.84Å; F235-F252 HydrophobicContact CE1-CE2 4.25Å; F235-F252 AromaticContact CE1-CG 3.81Å; F235-F252 HydrophobicContact CE1-CG 3.81Å; F235-F252 HydrophobicContact CZ-CB 4.39Å; F235-F252 AromaticContact CZ-CD1 3.59Å; F235-F252 HydrophobicContact CZ-CD1 3.59Å; F235-F252 AromaticContact CZ-CD2 3.93Å; F235-F252 HydrophobicContact CZ-CD2 3.93Å; F235-F252 AromaticContact CZ-CE1 3.72Å; F235-F252 HydrophobicContact CZ-CE1 3.72Å; F235-F252 HydrophobicContact CZ-CE2 4.05Å; F235-F252 AromaticContact CZ-CG 3.69Å; F235-F252 HydrophobicContact CZ-CG 3.69Å; F235-F252 AromaticContact CZ-CZ 3.96Å; F235-F252 HydrophobicContact CZ-CZ 3.96Å; E248-F252 PolarHBondContact O-N 3.43Å; F249-F252 WeakPolarHBondContact O-CB 3.44Å; F249-F252 PolarHBondContact O-N 2.89Å; F249-F252 VanDerWaalsContact O-N 3.12Å; R250-F252 VanDerWaalsContact C-N 3.28Å; R250-F252 PolarHBondContact O-N 3.02Å; F252-N255 PolarHBondContact O-N 3.39Å; F252-L256 WeakPolarHBondContact O-CB 3.32Å; F252-L256 PolarHBondContact O-N 3.12Å
253	V	91.2	Very high	92.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-49.1	176.8	175.1	0	0	0	0	111.1	I166 F174 F249 R250 N255 L256 Q257	I166-V253 HydrophobicContact CB-CG1 4.25Å; I166-V253 HydrophobicContact CB-CG2 4.08Å; I166-V253 HydrophobicContact CD1-CG2 4.21Å; I166-V253 HydrophobicContact CG2-CG2 4.19Å; F174-V253 HydrophobicContact CD2-CG1 4.47Å; F174-V253 HydrophobicContact CE2-CG1 4.47Å; F249-V253 HydrophobicContact CD1-CG2 4.16Å; F249-V253 HydrophobicContact CE1-CG2 3.72Å; F249-V253 HydrophobicContact CZ-CG2 4.02Å; F249-V253 WeakPolarHBondContact O-CG2 3.39Å; F249-V253 PolarHBondContact O-N 3.36Å; R250-V253 PolarHBondContact O-N 3.28Å; R250-V253 VanDerWaalsContact O-N 3.13Å; V253-N255 VanDerWaalsContact C-N 3.34Å; V253-N255 PolarHBondContact O-N 3.04Å; V253-L256 PolarHBondContact O-N 3.35Å; V253-Q257 HydrophobicContact CG1-CG 4.38Å; V253-Q257 WeakPolarHBondContact O-CB 3.49Å; V253-Q257 WeakPolarHBondContact O-CG 3.49Å; V253-Q257 PolarHBondContact O-N 3.47Å
254	E	91.9	Very high	92.8	Very high	59 Å²	59	40 Å²	40	28%	0.276	18%	0.178	S	C	.	.	H	α-helix	trans	-58.5	-45.2	178.2	-71.9	169.8	174.8	0	0	111.5	H171 R250 T258	H171-E254 WeakPolarHBondContact CE1-CG 3.49Å; R250-E254 HydrophobicContact CG-CG 4.49Å; R250-E254 IonicContact CZ-OE1 2.75Å; R250-E254 IonicContact NE-OE1 3.25Å; R250-E254 PolarHBondContact NE-OE1 2.77Å; R250-E254 IonicContact NH2-OE1 3.4Å; R250-E254 PolarHBondContact NH2-OE1 3.35Å; R250-E254 WeakPolarHBondContact O-CG 3.47Å; R250-E254 PolarHBondContact O-N 3.34Å; E254-T258 VanDerWaalsContact O-CB 3.32Å; E254-T258 WeakPolarHBondContact O-CB 3.4Å; E254-T258 PolarHBondContact O-N 3.01Å; E254-T258 PolarHBondContact O-OG1 3.28Å
255	N	94.5	Very high	93	Very high	32 Å²	32	40.3 Å²	40.3	17%	0.171	18%	0.179	C	C	.	.	H	α-helix	trans	-63	-45.5	177.7	-77.3	-14	0	0	0	112	R251 F252 V253 T258 E259	R251-N255 VanDerWaalsContact O-CB 3.26Å; R251-N255 WeakPolarHBondContact O-CB 3.39Å; R251-N255 PolarHBondContact O-N 3.47Å; R251-N255 PolarHBondContact O-ND2 2.83Å; F252-N255 PolarHBondContact O-N 3.39Å; V253-N255 VanDerWaalsContact C-N 3.34Å; V253-N255 PolarHBondContact O-N 3.04Å; N255-T258 PolarHBondContact O-N 3.25Å; N255-E259 VanDerWaalsContact O-CB 3.28Å; N255-E259 WeakPolarHBondContact O-CB 3.46Å; N255-E259 PolarHBondContact O-N 3.41Å
256	L	94.3	Very high	93.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-41.5	-179.2	-173.5	68.2	0	0	0	112.1	F106 F146 L163 I166 L167 F252 V253 T258 E259 V260	F106-L256 HydrophobicContact CE1-CD1 4.13Å; F106-L256 HydrophobicContact CE1-CD2 4.33Å; F106-L256 HydrophobicContact CZ-CD2 4.44Å; F146-L256 HydrophobicContact CD1-CD1 4.44Å; F146-L256 HydrophobicContact CD2-CD1 3.69Å; F146-L256 HydrophobicContact CE1-CD1 4.45Å; F146-L256 HydrophobicContact CE2-CD1 3.74Å; F146-L256 HydrophobicContact CG-CD1 4.08Å; F146-L256 HydrophobicContact CZ-CD1 4.14Å; L163-L256 HydrophobicContact CD2-CD2 3.65Å; I166-L256 HydrophobicContact CD1-CD2 3.47Å; I166-L256 VanDerWaalsContact CD1-CD2 3.47Å; I166-L256 HydrophobicContact CG1-CD2 3.9Å; L167-L256 HydrophobicContact CD2-CD2 4.14Å; L167-L256 HydrophobicContact CD2-CG 3.97Å; L167-L256 HydrophobicContact CG-CD2 4.43Å; F252-L256 WeakPolarHBondContact O-CB 3.32Å; F252-L256 PolarHBondContact O-N 3.12Å; V253-L256 PolarHBondContact O-N 3.35Å; L256-T258 VanDerWaalsContact C-N 3.34Å; L256-E259 WeakPolarHBondContact O-CB 3.39Å; L256-E259 PolarHBondContact O-N 2.99Å; L256-V260 WeakPolarHBondContact O-CG2 3.41Å; L256-V260 PolarHBondContact O-N 2.91Å
257	Q	92.9	Very high	93.3	Very high	15 Å²	15	44.9 Å²	44.9	7%	0.07	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-46.6	174.8	-73.9	177.1	-14.9	0	0	110.6	I166 L167 K169 V253 E259 V260 Q261	I166-Q257 PolarHBondContact O-NE2 3.44Å; L167-Q257 HydrophobicContact CD2-CG 4.43Å; K169-Q257 PolarHBondContact O-NE2 3.24Å; V253-Q257 HydrophobicContact CG1-CG 4.38Å; V253-Q257 WeakPolarHBondContact O-CB 3.49Å; V253-Q257 WeakPolarHBondContact O-CG 3.49Å; V253-Q257 PolarHBondContact O-N 3.47Å; Q257-E259 VanDerWaalsContact C-N 3.34Å; Q257-E259 PolarHBondContact O-N 2.97Å; Q257-V260 PolarHBondContact O-N 3.47Å; Q257-Q261 WeakPolarHBondContact O-CB 3.14Å; Q257-Q261 WeakPolarHBondContact O-CG 3.44Å; Q257-Q261 PolarHBondContact O-N 2.9Å
258	T	93.7	Very high	93.4	Very high	39 Å²	39	38.3 Å²	38.3	24%	0.239	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-45.1	175.5	-58	0	0	0	0	111.4	E254 N255 L256 V260 Q261 E262	E254-T258 VanDerWaalsContact O-CB 3.32Å; E254-T258 WeakPolarHBondContact O-CB 3.4Å; E254-T258 PolarHBondContact O-N 3.01Å; E254-T258 PolarHBondContact O-OG1 3.28Å; N255-T258 PolarHBondContact O-N 3.25Å; L256-T258 VanDerWaalsContact C-N 3.34Å; T258-V260 PolarHBondContact O-N 3.26Å; T258-Q261 PolarHBondContact O-N 2.75Å; T258-E262 HydrophobicContact CG2-CG 4.33Å; T258-E262 WeakPolarHBondContact CG2-OE1 3.47Å; T258-E262 WeakPolarHBondContact O-CB 3.43Å; T258-E262 WeakPolarHBondContact O-CG 3.49Å; T258-E262 PolarHBondContact O-N 3.3Å
259	E	95.4	Very high	93.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-56.9	-49.1	-179.7	-173.1	160.7	-164.5	0	0	111.4	S143 T144 F145 F146 R147 N255 L256 Q257 M263	S143-E259 WeakPolarHBondContact O-CA 3.3Å; S143-E259 WeakPolarHBondContact O-CB 3.43Å; S143-E259 WeakPolarHBondContact O-CG 3.45Å; T144-E259 WeakPolarHBondContact CA-OE1 3.44Å; F145-E259 PolarHBondContact N-OE1 3.08Å; F145-E259 PolarHBondContact N-OE2 3.46Å; F146-E259 PolarHBondContact N-OE1 3.39Å; F146-E259 PolarHBondContact N-OE2 3.19Å; F146-E259 VanDerWaalsContact N-OE2 3.1Å; R147-E259 WeakPolarHBondContact CB-OE1 3.35Å; R147-E259 HydrophobicContact CG-CG 4.44Å; R147-E259 VanDerWaalsContact CG-OE1 3.28Å; R147-E259 WeakPolarHBondContact CG-OE1 3.46Å; R147-E259 PolarHBondContact N-OE1 2.92Å; R147-E259 IonicContact NE-OE1 3.47Å; R147-E259 PolarHBondContact NH1-O 2.86Å; N255-E259 VanDerWaalsContact O-CB 3.28Å; N255-E259 WeakPolarHBondContact O-CB 3.46Å; N255-E259 PolarHBondContact O-N 3.41Å; L256-E259 WeakPolarHBondContact O-CB 3.39Å; L256-E259 PolarHBondContact O-N 2.99Å; Q257-E259 VanDerWaalsContact C-N 3.34Å; Q257-E259 PolarHBondContact O-N 2.97Å; E259-M263 WeakPolarHBondContact O-CG 3.41Å; E259-M263 PolarHBondContact O-N 3.08Å
260	V	94.4	Very high	93.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.7	-42.8	179.2	174.2	0	0	0	0	111.5	L107 V110 L167 L256 Q257 T258 E262 M263 E264	L107-V260 HydrophobicContact CD2-CG2 4.16Å; V110-V260 HydrophobicContact CG1-CG1 3.69Å; V110-V260 HydrophobicContact CG1-CG2 4.42Å; L167-V260 HydrophobicContact CD1-CG2 4.21Å; L167-V260 HydrophobicContact CD2-CB 4.09Å; L167-V260 HydrophobicContact CD2-CG2 3.73Å; L256-V260 WeakPolarHBondContact O-CG2 3.41Å; L256-V260 PolarHBondContact O-N 2.91Å; Q257-V260 PolarHBondContact O-N 3.47Å; T258-V260 PolarHBondContact O-N 3.26Å; V260-E262 VanDerWaalsContact C-N 3.33Å; V260-E262 PolarHBondContact O-N 3.42Å; V260-M263 PolarHBondContact O-N 3.33Å; V260-E264 HydrophobicContact CG1-CG 4.32Å; V260-E264 WeakPolarHBondContact O-CG 3.29Å; V260-E264 PolarHBondContact O-N 2.86Å
261	Q	93.6	Very high	93.9	Very high	26 Å²	26	36.4 Å²	36.4	12%	0.121	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-43.1	178.1	-73.2	165.1	5	0	0	111.9	Q257 T258 M263 E264 F265 F315 C319	Q257-Q261 WeakPolarHBondContact O-CB 3.14Å; Q257-Q261 WeakPolarHBondContact O-CG 3.44Å; Q257-Q261 PolarHBondContact O-N 2.9Å; T258-Q261 PolarHBondContact O-N 2.75Å; Q261-M263 VanDerWaalsContact C-N 3.33Å; Q261-M263 PolarHBondContact O-N 2.93Å; Q261-E264 PolarHBondContact O-N 2.95Å; Q261-F265 WeakPolarHBondContact O-CB 3.39Å; Q261-F265 PolarHBondContact O-N 3.2Å; Q261-F315 HydrophobicContact CB-CE1 4.32Å; Q261-F315 WeakPolarHBondContact O-CE1 3.39Å; Q261-C319 HydrophobicContact CG-CB 3.96Å
262	E	94.5	Very high	94	Very high	51 Å²	51	34 Å²	34	24%	0.238	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-37.5	177.1	-73.6	174.8	173.3	0	0	112.2	R147 T258 V260 F265 L266 K316	R147-E262 IonicContact NH2-OE2 2.66Å; R147-E262 PolarHBondContact NH2-OE2 3.45Å; T258-E262 HydrophobicContact CG2-CG 4.33Å; T258-E262 WeakPolarHBondContact CG2-OE1 3.47Å; T258-E262 WeakPolarHBondContact O-CB 3.43Å; T258-E262 WeakPolarHBondContact O-CG 3.49Å; T258-E262 PolarHBondContact O-N 3.3Å; V260-E262 VanDerWaalsContact C-N 3.33Å; V260-E262 PolarHBondContact O-N 3.42Å; E262-F265 PolarHBondContact O-N 2.86Å; E262-L266 WeakPolarHBondContact O-CB 3.43Å; E262-L266 PolarHBondContact O-N 3.02Å; E262-K316 IonicContact OE1-NZ 2.94Å; E262-K316 PolarHBondContact OE1-NZ 3.06Å
263	M	94.3	Very high	94.1	Very high	32 Å²	32	40 Å²	40	16%	0.158	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-44.2	174.1	-70.3	-177.4	67.7	0	0	111.8	L107 M111 R147 E259 V260 Q261 F265 L266 Q267	L107-M263 HydrophobicContact CB-CE 4.22Å; L107-M263 HydrophobicContact CB-SD 4.29Å; L107-M263 HydrophobicContact CD1-CE 4.38Å; L107-M263 HydrophobicContact CD1-SD 3.86Å; L107-M263 HydrophobicContact CD2-SD 3.91Å; L107-M263 HydrophobicContact CG-SD 4.24Å; M111-M263 HydrophobicContact CE-CB 3.93Å; M111-M263 WeakPolarHBondContact CE-O 3.26Å; M111-M263 HydrophobicContact CG-CB 4.41Å; M111-M263 HydrophobicContact CG-CE 3.97Å; M111-M263 HydrophobicContact SD-CB 3.62Å; R147-M263 HydrophobicContact CG-SD 4.01Å; R147-M263 VanDerWaalsContact NH1-CG 3.3Å; E259-M263 WeakPolarHBondContact O-CG 3.41Å; E259-M263 PolarHBondContact O-N 3.08Å; V260-M263 PolarHBondContact O-N 3.33Å; Q261-M263 VanDerWaalsContact C-N 3.33Å; Q261-M263 PolarHBondContact O-N 2.93Å; M263-F265 VanDerWaalsContact C-N 3.32Å; M263-L266 PolarHBondContact O-N 2.8Å; M263-Q267 VanDerWaalsContact O-CB 3.3Å; M263-Q267 WeakPolarHBondContact O-CB 3.23Å; M263-Q267 PolarHBondContact O-N 3.48Å
264	E	93.7	Very high	94.3	Very high	5 Å²	5	43.8 Å²	43.8	2%	0.023	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-45.7	175.4	-71.7	-179.5	132.5	0	0	110.4	M111 V260 Q261 L266 Q267 F268 F315 R391 R394	M111-E264 HydrophobicContact CE-CG 4.08Å; M111-E264 HydrophobicContact SD-CB 4.45Å; M111-E264 HydrophobicContact SD-CG 3.53Å; M111-E264 VanDerWaalsContact SD-CG 3.53Å; V260-E264 HydrophobicContact CG1-CG 4.32Å; V260-E264 WeakPolarHBondContact O-CG 3.29Å; V260-E264 PolarHBondContact O-N 2.86Å; Q261-E264 PolarHBondContact O-N 2.95Å; E264-L266 PolarHBondContact O-N 3.28Å; E264-Q267 PolarHBondContact O-N 3.26Å; E264-F268 WeakPolarHBondContact O-CD2 3.09Å; E264-F268 PolarHBondContact O-N 2.92Å; E264-F268 VanDerWaalsContact O-N 3.15Å; E264-F315 HydrophobicContact CB-CZ 4.31Å; E264-R391 VanDerWaalsContact CD-NH2 3.3Å; E264-R391 IonicContact OE1-CZ 3.94Å; E264-R391 VanDerWaalsContact OE1-CZ 3.31Å; E264-R391 IonicContact OE1-NH1 3.82Å; E264-R391 PolarHBondContact OE1-NH1 3.02Å; E264-R391 IonicContact OE1-NH2 2.82Å; E264-R391 PolarHBondContact OE1-NH2 2.93Å; E264-R391 IonicContact OE2-NH2 3.95Å; E264-R394 IonicContact OE1-CZ 3.91Å; E264-R394 IonicContact OE1-NE 2.97Å; E264-R394 PolarHBondContact OE1-NE 3.49Å; E264-R394 IonicContact OE1-NH2 3.83Å; E264-R394 PolarHBondContact OE1-NH2 2.9Å; E264-R394 IonicContact OE2-CZ 2.68Å; E264-R394 IonicContact OE2-NE 2.78Å; E264-R394 IonicContact OE2-NH2 3.86Å; E264-R394 PolarHBondContact OE2-NH2 3.13Å
265	F	96.1	Very high	94.5	Very high	10 Å²	10	41 Å²	41	4%	0.044	22%	0.215	C	C	.	.	H	α-helix	trans	-58.6	-51.6	176	-175.7	-88.5	0	0	0	111.9	Q261 E262 M263 Q267 F268 S269 M275 L312 F315	Q261-F265 WeakPolarHBondContact O-CB 3.39Å; Q261-F265 PolarHBondContact O-N 3.2Å; E262-F265 PolarHBondContact O-N 2.86Å; M263-F265 VanDerWaalsContact C-N 3.32Å; F265-Q267 VanDerWaalsContact C-N 3.31Å; F265-Q267 PolarHBondContact O-N 3.46Å; F265-F268 PolarHBondContact O-N 3.1Å; F265-S269 WeakPolarHBondContact O-CB 3.43Å; F265-S269 PolarHBondContact O-N 3.47Å; F265-S269 PolarHBondContact O-OG 3.22Å; F265-M275 HydrophobicContact CB-CE 4.34Å; F265-M275 HydrophobicContact CD2-CB 4.42Å; F265-M275 HydrophobicContact CD2-CE 3.68Å; F265-M275 HydrophobicContact CE2-CB 3.82Å; F265-M275 HydrophobicContact CE2-CE 4.22Å; F265-M275 HydrophobicContact CG-CE 4.11Å; F265-M275 HydrophobicContact CZ-CB 4.23Å; F265-M275 WeakPolarHBondContact O-CE 3.48Å; F265-L312 HydrophobicContact CB-CD1 3.96Å; F265-L312 HydrophobicContact CD1-CD1 3.85Å; F265-L312 HydrophobicContact CD2-CD1 3.77Å; F265-L312 HydrophobicContact CE1-CB 4.35Å; F265-L312 HydrophobicContact CE1-CD1 4.26Å; F265-L312 HydrophobicContact CE2-CB 4.19Å; F265-L312 HydrophobicContact CE2-CD1 4.18Å; F265-L312 HydrophobicContact CG-CD1 3.57Å; F265-L312 HydrophobicContact CZ-CB 4.03Å; F265-L312 HydrophobicContact CZ-CD1 4.39Å; F265-F315 HydrophobicContact CB-CD1 4.04Å; F265-F315 HydrophobicContact CB-CE1 3.93Å; F265-F315 HydrophobicContact CB-CZ 4.4Å; F265-F315 HydrophobicContact CD2-CB 3.8Å; F265-F315 AromaticContact CD2-CD1 3.81Å; F265-F315 HydrophobicContact CD2-CD1 3.81Å; F265-F315 HydrophobicContact CD2-CD2 4.13Å; F265-F315 HydrophobicContact CD2-CE1 4.41Å; F265-F315 AromaticContact CD2-CG 3.64Å; F265-F315 HydrophobicContact CD2-CG 3.64Å; F265-F315 HydrophobicContact CE2-CB 4.06Å; F265-F315 HydrophobicContact CE2-CG 4.37Å; F265-F315 HydrophobicContact CG-CD1 4.39Å
266	L	95	Very high	94.7	Very high	101 Å²	101	44.1 Å²	44.1	53%	0.529	22%	0.224	S	C	.	.	H	α-helix	trans	-63	-38.4	-176.7	-171.2	69	0	0	0	112.4	E262 M263 E264 S269 K270 G271	E262-L266 WeakPolarHBondContact O-CB 3.43Å; E262-L266 PolarHBondContact O-N 3.02Å; M263-L266 PolarHBondContact O-N 2.8Å; E264-L266 PolarHBondContact O-N 3.28Å; L266-S269 WeakPolarHBondContact CA-OG 3.28Å; L266-S269 PolarHBondContact O-OG 3.23Å; L266-K270 PolarHBondContact O-N 3.44Å; L266-G271 PolarHBondContact O-N 2.66Å
267	Q	92.7	Very high	94.8	Very high	82 Å²	82	44 Å²	44	38%	0.383	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-50.5	179.2	179.4	65.7	8	0	0	111.4	M111 M263 E264 F265 K270	M111-Q267 HydrophobicContact CE-CB 3.85Å; M111-Q267 HydrophobicContact CE-CG 4.24Å; M263-Q267 VanDerWaalsContact O-CB 3.3Å; M263-Q267 WeakPolarHBondContact O-CB 3.23Å; M263-Q267 PolarHBondContact O-N 3.48Å; E264-Q267 PolarHBondContact O-N 3.26Å; F265-Q267 VanDerWaalsContact C-N 3.31Å; F265-Q267 PolarHBondContact O-N 3.46Å; Q267-K270 PolarHBondContact O-N 3.19Å
268	F	94.5	Very high	94.9	Very high	24 Å²	24	45.8 Å²	45.8	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-79.5	-32	-175.7	-77	-92.3	0	0	0	112.8	E264 F265 K270 M275 D279 E282 W283 F286	E264-F268 WeakPolarHBondContact O-CD2 3.09Å; E264-F268 PolarHBondContact O-N 2.92Å; E264-F268 VanDerWaalsContact O-N 3.15Å; F265-F268 PolarHBondContact O-N 3.1Å; F268-K270 PolarHBondContact O-N 3.07Å; F268-M275 HydrophobicContact CB-CE 3.73Å; F268-M275 HydrophobicContact CB-SD 4.24Å; F268-D279 WeakPolarHBondContact O-CB 3.47Å; F268-E282 HydrophobicContact CD1-CB 4.38Å; F268-E282 HydrophobicContact CD1-CG 4.33Å; F268-E282 HydrophobicContact CE1-CG 4.14Å; F268-W283 HydrophobicContact CB-CB 4.06Å; F268-W283 VanDerWaalsContact CD1-CA 3.49Å; F268-W283 HydrophobicContact CD1-CB 3.62Å; F268-W283 HydrophobicContact CD2-CB 4.05Å; F268-W283 AromaticContact CD2-CD1 3.5Å; F268-W283 HydrophobicContact CD2-CG 4.18Å; F268-W283 HydrophobicContact CE1-CB 4Å; F268-W283 HydrophobicContact CE2-CB 4.37Å; F268-W283 AromaticContact CE2-CD1 3.71Å; F268-W283 HydrophobicContact CE2-CG 4.41Å; F268-W283 HydrophobicContact CG-CB 3.63Å; F268-W283 AromaticContact CG-CD1 3.97Å; F268-W283 HydrophobicContact CG-CG 4.23Å; F268-W283 HydrophobicContact CZ-CB 4.34Å; F268-F286 AromaticContact CE1-CD2 3.99Å; F268-F286 HydrophobicContact CE1-CD2 3.99Å; F268-F286 HydrophobicContact CE1-CG 4.48Å; F268-F286 HydrophobicContact CZ-CB 4.19Å; F268-F286 AromaticContact CZ-CD2 3.78Å; F268-F286 HydrophobicContact CZ-CD2 3.78Å; F268-F286 HydrophobicContact CZ-CE2 4.37Å; F268-F286 AromaticContact CZ-CG 3.99Å; F268-F286 HydrophobicContact CZ-CG 3.99Å
269	S	95.5	Very high	95	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.1	170.8	62.8	0	0	0	0	113.7	F265 L266 G271 L272 F274	F265-S269 WeakPolarHBondContact O-CB 3.43Å; F265-S269 PolarHBondContact O-N 3.47Å; F265-S269 PolarHBondContact O-OG 3.22Å; L266-S269 WeakPolarHBondContact CA-OG 3.28Å; L266-S269 PolarHBondContact O-OG 3.23Å; S269-G271 PolarHBondContact O-N 3.08Å; S269-L272 WeakPolarHBondContact O-CB 3.21Å; S269-L272 WeakPolarHBondContact O-CG 3.43Å; S269-L272 PolarHBondContact O-N 3.49Å; S269-L272 PolarHBondContact OG-O 3.2Å; S269-F274 WeakPolarHBondContact CB-O 3.41Å
270	K	94.6	Very high	95.1	Very high	110 Å²	110	44.2 Å²	44.2	48%	0.478	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	35.9	-177.6	-61.5	152.6	-179.5	152.8	0	112.1	L266 Q267 F268 D279	L266-K270 PolarHBondContact O-N 3.44Å; Q267-K270 PolarHBondContact O-N 3.19Å; F268-K270 PolarHBondContact O-N 3.07Å; K270-D279 IonicContact NZ-OD1 3.05Å; K270-D279 PolarHBondContact NZ-OD1 2.93Å
271	G	93.1	Very high	95.1	Very high	52 Å²	52	44.2 Å²	44.2	54%	0.536	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	1.4	178.6	0	0	0	0	0	115.6	L266 S269	L266-G271 PolarHBondContact O-N 2.66Å; S269-G271 PolarHBondContact O-N 3.08Å
272	L	94.9	Very high	95.1	Very high	65 Å²	65	46.6 Å²	46.6	34%	0.34	23%	0.234	S	C	.	.			trans	-77.8	158.8	177.1	-61.6	173.6	0	0	0	111.2	S269 F274	S269-L272 WeakPolarHBondContact O-CB 3.21Å; S269-L272 WeakPolarHBondContact O-CG 3.43Å; S269-L272 PolarHBondContact O-N 3.49Å; S269-L272 PolarHBondContact OG-O 3.2Å; L272-F274 VanDerWaalsContact CB-O 3.29Å; L272-F274 WeakPolarHBondContact CB-O 3.2Å; L272-F274 HydrophobicContact CD1-CE2 3.91Å; L272-F274 HydrophobicContact CD1-CZ 3.99Å; L272-F274 PolarHBondContact O-N 3.28Å
273	N	94.9	Very high	95.1	Very high	133 Å²	133	44.4 Å²	44.4	71%	0.711	22%	0.223	S	C	*	.	S	Bend	trans	-80.7	-3.9	173.6	62.1	-26.4	0	0	0	113.3
274	F	96	Very high	95.1	Very high	80 Å²	80	42.9 Å²	42.9	35%	0.351	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154.3	172.1	59.8	-95.4	0	0	0	109	S269 L272 R276	S269-F274 WeakPolarHBondContact CB-O 3.41Å; L272-F274 VanDerWaalsContact CB-O 3.29Å; L272-F274 WeakPolarHBondContact CB-O 3.2Å; L272-F274 HydrophobicContact CD1-CE2 3.91Å; L272-F274 HydrophobicContact CD1-CZ 3.99Å; L272-F274 PolarHBondContact O-N 3.28Å; F274-R276 HydrophobicContact CE2-CG 4.28Å
275	M	96.7	Very high	95	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.5	174.2	-172.9	177.5	-65.9	0	0	108.5	F265 F268 D279 F280 W283 S309 I310 F315	F265-M275 HydrophobicContact CB-CE 4.34Å; F265-M275 HydrophobicContact CD2-CB 4.42Å; F265-M275 HydrophobicContact CD2-CE 3.68Å; F265-M275 HydrophobicContact CE2-CB 3.82Å; F265-M275 HydrophobicContact CE2-CE 4.22Å; F265-M275 HydrophobicContact CG-CE 4.11Å; F265-M275 HydrophobicContact CZ-CB 4.23Å; F265-M275 WeakPolarHBondContact O-CE 3.48Å; F268-M275 HydrophobicContact CB-CE 3.73Å; F268-M275 HydrophobicContact CB-SD 4.24Å; M275-D279 HydrophobicContact CG-CB 3.68Å; M275-F280 HydrophobicContact CG-CB 4.14Å; M275-F280 WeakPolarHBondContact SD-CA 3.38Å; M275-F280 HydrophobicContact SD-CB 3.74Å; M275-F280 HydrophobicContact SD-CD2 4.18Å; M275-F280 HydrophobicContact SD-CG 4.48Å; M275-W283 HydrophobicContact SD-CB 4.39Å; M275-S309 CarbonylContact O-C 3.59Å; M275-S309 VanDerWaalsContact O-CA 3.25Å; M275-S309 WeakPolarHBondContact O-CA 3.17Å; M275-S309 WeakPolarHBondContact O-CB 3.35Å; M275-I310 PolarHBondContact N-O 3.16Å; M275-I310 PolarHBondContact O-N 3.01Å; M275-F315 HydrophobicContact CE-CD2 4.16Å; M275-F315 HydrophobicContact CE-CE2 4.01Å; M275-F315 HydrophobicContact SD-CD2 4.38Å; M275-F315 HydrophobicContact SD-CE2 4.44Å
276	R	96.7	Very high	94.6	Very high	98 Å²	98	45.4 Å²	45.4	37%	0.37	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	150.7	173.8	-68.9	175.5	-85	-142.2	-14.1	110.1	F274 E278 D279 F280	F274-R276 HydrophobicContact CE2-CG 4.28Å; R276-E278 WeakPolarHBondContact CB-OE2 3.35Å; R276-E278 PolarHBondContact O-N 2.92Å; R276-E278 VanDerWaalsContact O-N 3.16Å; R276-D279 HydrophobicContact CB-CB 4.33Å; R276-D279 IonicContact CZ-OD2 3.42Å; R276-D279 IonicContact NE-OD2 3.2Å; R276-D279 PolarHBondContact NE-OD2 3.4Å; R276-D279 IonicContact NH2-OD2 2.77Å; R276-D279 WeakPolarHBondContact O-CA 3.25Å; R276-D279 WeakPolarHBondContact O-CB 3.36Å; R276-D279 PolarHBondContact O-N 2.82Å; R276-F280 PolarHBondContact O-N 3.42Å
277	K	97.4	Very high	94.1	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-32.4	180	-72.5	-171.8	177.1	176.7	0	112.3	F280 A281 L304 E308 I310 N362 D365 T366	K277-F280 PolarHBondContact O-N 2.94Å; K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.47Å; K277-L304 HydrophobicContact CB-CD1 4.12Å; K277-L304 HydrophobicContact CD-CD2 4.32Å; K277-E308 HydrophobicContact CD-CB 3.59Å; K277-E308 HydrophobicContact CD-CG 4.49Å; K277-E308 WeakPolarHBondContact CD-OE2 3.4Å; K277-E308 WeakPolarHBondContact CE-OE2 3.45Å; K277-E308 HydrophobicContact CG-CB 3.96Å; K277-E308 PolarHBondContact N-O 3.15Å; K277-E308 VanDerWaalsContact N-O 3.17Å; K277-E308 IonicContact NZ-OE1 2.6Å; K277-E308 PolarHBondContact NZ-OE1 3.44Å; K277-E308 IonicContact NZ-OE2 3.79Å; K277-E308 PolarHBondContact NZ-OE2 3.4Å; K277-I310 HydrophobicContact CG-CD1 4.41Å; K277-I310 HydrophobicContact CG-CG1 4.34Å; K277-N362 WeakPolarHBondContact CE-OD1 3.21Å; K277-N362 PolarHBondContact NZ-OD1 3.14Å; K277-D365 IonicContact NZ-OD2 2.97Å; K277-D365 PolarHBondContact NZ-OD2 2.95Å; K277-T366 HydrophobicContact CB-CG2 4.21Å; K277-T366 HydrophobicContact CD-CG2 4.15Å; K277-T366 WeakPolarHBondContact CD-OG1 3.44Å; K277-T366 WeakPolarHBondContact CE-OG1 3.41Å; K277-T366 HydrophobicContact CG-CG2 4.16Å
278	E	95.2	Very high	93.6	Very high	52 Å²	52	38.7 Å²	38.7	24%	0.243	19%	0.192	C	C	.	.	H	α-helix	trans	-69.3	-39.4	174.6	-54.1	89.1	157.7	0	0	112.4	R276 F280 A281 E282 V300	R276-E278 WeakPolarHBondContact CB-OE2 3.35Å; R276-E278 PolarHBondContact O-N 2.92Å; R276-E278 VanDerWaalsContact O-N 3.16Å; E278-F280 VanDerWaalsContact C-N 3.32Å; E278-A281 PolarHBondContact O-N 2.94Å; E278-E282 WeakPolarHBondContact O-CB 3.45Å; E278-E282 PolarHBondContact O-N 3.47Å; E278-V300 HydrophobicContact CB-CG1 4.46Å; E278-V300 HydrophobicContact CG-CG1 4.37Å
279	D	95.7	Very high	92.5	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.032	23%	0.226	C	C	.	.	H	α-helix	trans	-67.8	-35.5	175.4	-66.7	-36.4	0	0	0	110.3	F268 K270 M275 R276 E282 W283	F268-D279 WeakPolarHBondContact O-CB 3.47Å; K270-D279 IonicContact NZ-OD1 3.05Å; K270-D279 PolarHBondContact NZ-OD1 2.93Å; M275-D279 HydrophobicContact CG-CB 3.68Å; R276-D279 HydrophobicContact CB-CB 4.33Å; R276-D279 IonicContact CZ-OD2 3.42Å; R276-D279 IonicContact NE-OD2 3.2Å; R276-D279 PolarHBondContact NE-OD2 3.4Å; R276-D279 IonicContact NH2-OD2 2.77Å; R276-D279 WeakPolarHBondContact O-CA 3.25Å; R276-D279 WeakPolarHBondContact O-CB 3.36Å; R276-D279 PolarHBondContact O-N 2.82Å; D279-E282 PolarHBondContact O-N 3.32Å; D279-W283 WeakPolarHBondContact O-CB 3.33Å; D279-W283 PolarHBondContact O-N 3.47Å
280	F	96.8	Very high	91.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-43.1	172.3	175.5	-97.3	0	0	0	112.1	M275 R276 K277 E278 E282 W283 L284 I310 F315 F318 L363 T366	M275-F280 HydrophobicContact CG-CB 4.14Å; M275-F280 WeakPolarHBondContact SD-CA 3.38Å; M275-F280 HydrophobicContact SD-CB 3.74Å; M275-F280 HydrophobicContact SD-CD2 4.18Å; M275-F280 HydrophobicContact SD-CG 4.48Å; R276-F280 PolarHBondContact O-N 3.42Å; K277-F280 PolarHBondContact O-N 2.94Å; E278-F280 VanDerWaalsContact C-N 3.32Å; F280-E282 VanDerWaalsContact C-N 3.33Å; F280-W283 AromaticContact CD2-CE3 3.9Å; F280-W283 HydrophobicContact CD2-CE3 3.9Å; F280-W283 HydrophobicContact CD2-CZ3 4.2Å; F280-W283 AromaticContact CE2-CE3 3.74Å; F280-W283 HydrophobicContact CE2-CE3 3.74Å; F280-W283 AromaticContact CE2-CZ3 3.56Å; F280-W283 HydrophobicContact CE2-CZ3 3.56Å; F280-W283 HydrophobicContact CZ-CE3 4.38Å; F280-W283 HydrophobicContact CZ-CZ3 4.06Å; F280-W283 WeakPolarHBondContact O-CB 3.36Å; F280-W283 PolarHBondContact O-N 2.84Å; F280-L284 HydrophobicContact CE1-CD2 4.06Å; F280-L284 HydrophobicContact CZ-CD2 4.37Å; F280-L284 WeakPolarHBondContact O-CB 3.16Å; F280-L284 PolarHBondContact O-N 3.32Å; F280-I310 HydrophobicContact CB-CG1 4.13Å; F280-I310 HydrophobicContact CD2-CG1 4.39Å; F280-I310 HydrophobicContact CD2-CG2 4.43Å; F280-I310 HydrophobicContact CG-CG1 4.09Å; F280-F315 HydrophobicContact CD2-CD2 4.16Å; F280-F315 HydrophobicContact CE2-CD2 4.25Å; F280-F318 HydrophobicContact CE2-CD1 4.11Å; F280-F318 HydrophobicContact CE2-CG 4.44Å; F280-F318 AromaticContact CZ-CD1 3.91Å; F280-F318 HydrophobicContact CZ-CD1 3.91Å; F280-F318 HydrophobicContact CZ-CD2 4.48Å; F280-F318 AromaticContact CZ-CE1 3.97Å; F280-F318 HydrophobicContact CZ-CE1 3.97Å; F280-F318 HydrophobicContact CZ-CG 4.16Å; F280-F318 HydrophobicContact CZ-CZ 4.27Å; F280-L363 HydrophobicContact CE1-CD1 4.13Å; F280-L363 HydrophobicContact CE2-CD1 4.04Å; F280-L363 HydrophobicContact CZ-CD1 3.63Å; F280-T366 HydrophobicContact CD1-CG2 3.9Å; F280-T366 HydrophobicContact CE1-CG2 4.24Å
281	A	95.2	Very high	90.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-41.7	174	0	0	0	0	0	111.4	K277 E278 L284 L285 V300 L304 I370	K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.47Å; E278-A281 PolarHBondContact O-N 2.94Å; A281-L284 PolarHBondContact O-N 2.9Å; A281-L285 VanDerWaalsContact O-CB 3.26Å; A281-L285 WeakPolarHBondContact O-CB 3.32Å; A281-L285 VanDerWaalsContact O-CG 3.23Å; A281-L285 WeakPolarHBondContact O-CG 3.41Å; A281-L285 PolarHBondContact O-N 3.2Å; A281-V300 HydrophobicContact CB-CG1 4.17Å; A281-V300 HydrophobicContact CB-CG2 3.48Å; A281-V300 VanDerWaalsContact CB-CG2 3.48Å; A281-L304 HydrophobicContact CB-CD1 4.43Å; A281-I370 HydrophobicContact CB-CD1 3.69Å; A281-I370 HydrophobicContact CB-CG1 4.41Å
282	E	93.5	Very high	90.3	Very high	77 Å²	77	49.6 Å²	49.6	36%	0.36	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-47.3	173.8	-168.5	175.7	-174	0	0	111.5	F268 E278 D279 F280 L284 L285 F286 W297	F268-E282 HydrophobicContact CD1-CB 4.38Å; F268-E282 HydrophobicContact CD1-CG 4.33Å; F268-E282 HydrophobicContact CE1-CG 4.14Å; E278-E282 WeakPolarHBondContact O-CB 3.45Å; E278-E282 PolarHBondContact O-N 3.47Å; D279-E282 PolarHBondContact O-N 3.32Å; F280-E282 VanDerWaalsContact C-N 3.33Å; E282-L284 PolarHBondContact O-N 3.48Å; E282-L285 PolarHBondContact O-N 3.3Å; E282-F286 WeakPolarHBondContact O-CA 3.33Å; E282-F286 WeakPolarHBondContact O-CB 3.45Å; E282-F286 PolarHBondContact O-N 3.42Å; E282-W297 HydrophobicContact CB-CH2 3.76Å; E282-W297 HydrophobicContact CG-CH2 3.95Å; E282-W297 HydrophobicContact CG-CZ2 4.44Å
283	W	94.2	Very high	89.9	Confident	5 Å²	5	50 Å²	50	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-57.4	-46.9	174.7	169.2	91.1	0	0	0	112.4	F268 M275 D279 F280 F315 F318 R391	F268-W283 HydrophobicContact CB-CB 4.06Å; F268-W283 VanDerWaalsContact CD1-CA 3.49Å; F268-W283 HydrophobicContact CD1-CB 3.62Å; F268-W283 HydrophobicContact CD2-CB 4.05Å; F268-W283 AromaticContact CD2-CD1 3.5Å; F268-W283 HydrophobicContact CD2-CG 4.18Å; F268-W283 HydrophobicContact CE1-CB 4Å; F268-W283 HydrophobicContact CE2-CB 4.37Å; F268-W283 AromaticContact CE2-CD1 3.71Å; F268-W283 HydrophobicContact CE2-CG 4.41Å; F268-W283 HydrophobicContact CG-CB 3.63Å; F268-W283 AromaticContact CG-CD1 3.97Å; F268-W283 HydrophobicContact CG-CG 4.23Å; F268-W283 HydrophobicContact CZ-CB 4.34Å; M275-W283 HydrophobicContact SD-CB 4.39Å; D279-W283 WeakPolarHBondContact O-CB 3.33Å; D279-W283 PolarHBondContact O-N 3.47Å; F280-W283 AromaticContact CD2-CE3 3.9Å; F280-W283 HydrophobicContact CD2-CE3 3.9Å; F280-W283 HydrophobicContact CD2-CZ3 4.2Å; F280-W283 AromaticContact CE2-CE3 3.74Å; F280-W283 HydrophobicContact CE2-CE3 3.74Å; F280-W283 AromaticContact CE2-CZ3 3.56Å; F280-W283 HydrophobicContact CE2-CZ3 3.56Å; F280-W283 HydrophobicContact CZ-CE3 4.38Å; F280-W283 HydrophobicContact CZ-CZ3 4.06Å; F280-W283 WeakPolarHBondContact O-CB 3.36Å; F280-W283 PolarHBondContact O-N 2.84Å; W283-F315 AromaticContact CD2-CE2 3.58Å; W283-F315 HydrophobicContact CD2-CE2 3.58Å; W283-F315 HydrophobicContact CD2-CZ 4.18Å; W283-F315 AromaticContact CE2-CE2 3.32Å; W283-F315 AromaticContact CE2-CZ 3.45Å; W283-F315 VanDerWaalsContact CE2-CZ 3.45Å; W283-F315 AromaticContact CE3-CE2 3.9Å; W283-F315 HydrophobicContact CE3-CE2 3.9Å; W283-F315 HydrophobicContact CG-CE2 4.14Å; W283-F315 AromaticContact CH2-CE2 3.88Å; W283-F315 HydrophobicContact CH2-CE2 3.88Å; W283-F315 HydrophobicContact CH2-CZ 4.26Å; W283-F315 AromaticContact CZ2-CE2 3.52Å; W283-F315 HydrophobicContact CZ2-CE2 3.52Å; W283-F315 AromaticContact CZ2-CZ 3.54Å; W283-F315 HydrophobicContact CZ2-CZ 3.54Å; W283-F315 HydrophobicContact CZ3-CE2 4.03Å; W283-F315 AromaticContact NE1-CE2 3.58Å; W283-F315 AromaticContact NE1-CZ 3.41Å; W283-F318 AromaticContact CH2-CD1 3.84Å; W283-F318 HydrophobicContact CH2-CD1 3.84Å; W283-F318 HydrophobicContact CH2-CE1 4.1Å; W283-F318 AromaticContact CZ3-CD1 3.75Å; W283-F318 HydrophobicContact CZ3-CD1 3.75Å; W283-F318 AromaticContact CZ3-CE1 3.81Å; W283-F318 HydrophobicContact CZ3-CE1 3.81Å; W283-R391 WeakPolarHBondContact O-CD 3.34Å; W283-R391 PolarHBondContact O-NE 2.72Å
284	L	94	Very high	89.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-41	-176.4	-172.7	54.2	0	0	0	111.7	F280 A281 E282 F318 F371 L388 R391	F280-L284 HydrophobicContact CE1-CD2 4.06Å; F280-L284 HydrophobicContact CZ-CD2 4.37Å; F280-L284 WeakPolarHBondContact O-CB 3.16Å; F280-L284 PolarHBondContact O-N 3.32Å; A281-L284 PolarHBondContact O-N 2.9Å; E282-L284 PolarHBondContact O-N 3.48Å; L284-F318 HydrophobicContact CD1-CE1 3.88Å; L284-F318 HydrophobicContact CD1-CZ 4.28Å; L284-F318 HydrophobicContact CD2-CZ 4.42Å; L284-F371 HydrophobicContact CD2-CE2 3.61Å; L284-F371 HydrophobicContact CD2-CZ 3.87Å; L284-F371 HydrophobicContact CG-CE2 4.46Å; L284-F371 HydrophobicContact CG-CZ 4.25Å; L284-L388 HydrophobicContact CD1-CD2 3.56Å; L284-R391 HydrophobicContact CD1-CG 4.3Å
285	L	92	Very high	89.4	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-88.9	-3.1	-175.3	-61	174.6	0	0	0	113.6	A281 E282 F287 T288 Y296 W297 I370 F371 V387	A281-L285 VanDerWaalsContact O-CB 3.26Å; A281-L285 WeakPolarHBondContact O-CB 3.32Å; A281-L285 VanDerWaalsContact O-CG 3.23Å; A281-L285 WeakPolarHBondContact O-CG 3.41Å; A281-L285 PolarHBondContact O-N 3.2Å; E282-L285 PolarHBondContact O-N 3.3Å; L285-F287 VanDerWaalsContact C-N 3.35Å; L285-F287 PolarHBondContact O-N 3.19Å; L285-T288 HydrophobicContact CD2-CG2 4.49Å; L285-T288 WeakPolarHBondContact O-CB 3.4Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 PolarHBondContact O-OG1 2.87Å; L285-Y296 HydrophobicContact CD2-CD2 3.78Å; L285-Y296 HydrophobicContact CD2-CE2 4.47Å; L285-Y296 HydrophobicContact CD2-CG 4.26Å; L285-W297 HydrophobicContact CB-CZ2 4.49Å; L285-W297 HydrophobicContact CD1-CZ2 4.49Å; L285-I370 HydrophobicContact CD1-CG2 4.36Å; L285-F371 HydrophobicContact CD2-CE1 4.1Å; L285-F371 HydrophobicContact CD2-CZ 4.03Å; L285-V387 HydrophobicContact CD2-CG1 4.2Å
286	F	88.5	Confident	89.2	Confident	67 Å²	67	47.9 Å²	47.9	29%	0.294	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-47.5	-172.5	-169.5	-97.5	0	0	0	113.5	E113 F268 E282 T288	E113-F286 HydrophobicContact CB-CE1 4.36Å; E113-F286 HydrophobicContact CB-CZ 4.5Å; F268-F286 AromaticContact CE1-CD2 3.99Å; F268-F286 HydrophobicContact CE1-CD2 3.99Å; F268-F286 HydrophobicContact CE1-CG 4.48Å; F268-F286 HydrophobicContact CZ-CB 4.19Å; F268-F286 AromaticContact CZ-CD2 3.78Å; F268-F286 HydrophobicContact CZ-CD2 3.78Å; F268-F286 HydrophobicContact CZ-CE2 4.37Å; F268-F286 AromaticContact CZ-CG 3.99Å; F268-F286 HydrophobicContact CZ-CG 3.99Å; E282-F286 WeakPolarHBondContact O-CA 3.33Å; E282-F286 WeakPolarHBondContact O-CB 3.45Å; E282-F286 PolarHBondContact O-N 3.42Å; F286-T288 VanDerWaalsContact C-N 3.34Å
287	F	84.1	Confident	89	Confident	39 Å²	39	46.2 Å²	46.2	17%	0.171	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	12.8	178.6	-61	-72.4	0	0	0	113.8	L285 R394	L285-F287 VanDerWaalsContact C-N 3.35Å; L285-F287 PolarHBondContact O-N 3.19Å; F287-R394 HydrophobicContact CD2-CB 4.31Å; F287-R394 HydrophobicContact CE1-CB 4.47Å; F287-R394 WeakPolarHBondContact CE1-O 3.41Å; F287-R394 VanDerWaalsContact CE2-CA 3.46Å; F287-R394 HydrophobicContact CE2-CB 3.7Å; F287-R394 HydrophobicContact CE2-CG 3.94Å; F287-R394 HydrophobicContact CZ-CB 3.78Å; F287-R394 HydrophobicContact CZ-CG 4.4Å
288	T	81.6	Confident	88.9	Confident	3 Å²	3	52 Å²	52	2%	0.018	25%	0.247	C	C	.	.			trans	-82.9	123.3	-178.5	-62	0	0	0	0	110.5	L285 F286 T290 K293 Y296 V387	L285-T288 HydrophobicContact CD2-CG2 4.49Å; L285-T288 WeakPolarHBondContact O-CB 3.4Å; L285-T288 PolarHBondContact O-N 2.93Å; L285-T288 PolarHBondContact O-OG1 2.87Å; F286-T288 VanDerWaalsContact C-N 3.34Å; T288-T290 HydrophobicContact CG2-CG2 3.75Å; T288-T290 WeakPolarHBondContact CG2-OG1 3.29Å; T288-K293 PolarHBondContact O-NZ 3.41Å; T288-K293 VanDerWaalsContact O-NZ 3.08Å; T288-Y296 HydrophobicContact CG2-CE2 4.3Å; T288-V387 HydrophobicContact CG2-CG2 3.77Å; T288-V387 WeakPolarHBondContact OG1-CG1 3.47Å
289	N	71.3	Confident	88.8	Confident	153 Å²	153	50 Å²	50	82%	0.818	24%	0.237	S	C	*	.			trans	-125.3	56.9	174.1	-169.9	28.8	0	0	0	110.1
290	T	74.9	Confident	88.7	Confident	40 Å²	40	50 Å²	50	25%	0.245	24%	0.237	C	C	.	.			trans	-101.7	153.3	177.8	55.6	0	0	0	0	110.1	T288 N292 K293 Y296 V387	T288-T290 HydrophobicContact CG2-CG2 3.75Å; T288-T290 WeakPolarHBondContact CG2-OG1 3.29Å; T290-N292 PolarHBondContact O-N 3.15Å; T290-K293 VanDerWaalsContact O-CB 3.26Å; T290-K293 WeakPolarHBondContact O-CB 3.34Å; T290-K293 PolarHBondContact O-N 3.44Å; T290-Y296 WeakPolarHBondContact OG1-CE2 3.47Å; T290-V387 HydrophobicContact CG2-CG2 4.25Å
291	E	79.9	Confident	88.5	Confident	191 Å²	191	59 Å²	59	89%	0.893	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.6	172.9	-61.6	179.6	-176.1	0	0	111.6	K293	E291-K293 PolarHBondContact O-N 3.2Å
292	N	83.7	Confident	88.5	Confident	31 Å²	31	65.8 Å²	65.8	17%	0.166	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	5.1	179	-60.9	-23.3	0	0	0	114.6	T290 D294 I295 Y296 L373 E383	T290-N292 PolarHBondContact O-N 3.15Å; N292-D294 VanDerWaalsContact C-N 3.26Å; N292-D294 PolarHBondContact O-N 3.5Å; N292-I295 HydrophobicContact CB-CD1 4.31Å; N292-I295 WeakPolarHBondContact O-CA 3.38Å; N292-I295 WeakPolarHBondContact O-CB 3.26Å; N292-I295 PolarHBondContact O-N 3.36Å; N292-Y296 HydrophobicContact CB-CE1 4.18Å; N292-Y296 HydrophobicContact CB-CE2 4.13Å; N292-Y296 PolarHBondContact O-N 3.12Å; N292-L373 HydrophobicContact CB-CD1 4.44Å; N292-L373 HydrophobicContact CB-CD2 4.48Å; N292-L373 WeakPolarHBondContact ND2-CD1 3.39Å; N292-E383 PolarHBondContact ND2-OE1 3.37Å; N292-E383 PolarHBondContact ND2-OE2 3Å
293	K	85.8	Confident	88.5	Confident	73 Å²	73	65.3 Å²	65.3	32%	0.317	30%	0.3	S	S	.	.	H	α-helix	trans	-55.3	-42.5	-176.8	-178	174.5	-171.6	160	0	112.3	T288 T290 E291 I295 Y296 W297	T288-K293 PolarHBondContact O-NZ 3.41Å; T288-K293 VanDerWaalsContact O-NZ 3.08Å; T290-K293 VanDerWaalsContact O-CB 3.26Å; T290-K293 WeakPolarHBondContact O-CB 3.34Å; T290-K293 PolarHBondContact O-N 3.44Å; E291-K293 PolarHBondContact O-N 3.2Å; K293-I295 VanDerWaalsContact C-N 3.27Å; K293-I295 PolarHBondContact O-N 2.68Å; K293-Y296 PolarHBondContact O-N 2.96Å; K293-W297 PolarHBondContact O-N 3.05Å; K293-W297 VanDerWaalsContact O-N 3.11Å
294	D	89.8	Confident	88.4	Confident	123 Å²	123	65.6 Å²	65.6	66%	0.658	30%	0.302	S	S	*	.	H	α-helix	trans	-66.9	-30.7	178.2	-68.6	-29.9	0	0	0	112.3	N292 R298	N292-D294 VanDerWaalsContact C-N 3.26Å; N292-D294 PolarHBondContact O-N 3.5Å; D294-R298 PolarHBondContact O-N 3.42Å
295	I	90.5	Very high	88.3	Confident	45 Å²	45	68.6 Å²	68.6	23%	0.231	32%	0.323	C	S	.	.	H	α-helix	trans	-72	-44.6	176.4	-51.2	174.8	0	0	0	110.2	N292 K293 W297 R298 N299 L373	N292-I295 HydrophobicContact CB-CD1 4.31Å; N292-I295 WeakPolarHBondContact O-CA 3.38Å; N292-I295 WeakPolarHBondContact O-CB 3.26Å; N292-I295 PolarHBondContact O-N 3.36Å; K293-I295 VanDerWaalsContact C-N 3.27Å; K293-I295 PolarHBondContact O-N 2.68Å; I295-W297 VanDerWaalsContact C-N 3.28Å; I295-W297 PolarHBondContact O-N 3.4Å; I295-R298 WeakPolarHBondContact O-CB 3.28Å; I295-R298 PolarHBondContact O-N 2.97Å; I295-N299 PolarHBondContact O-N 2.99Å; I295-L373 HydrophobicContact CB-CD2 4.04Å; I295-L373 HydrophobicContact CG2-CD2 3.55Å
296	Y	92.5	Very high	88.1	Confident	1 Å²	1	75.1 Å²	75.1	0%	0.004	36%	0.362	C	S	.	.	H	α-helix	trans	-57.4	-43.1	174.5	-57.8	-36.2	0	0	0	111.5	L285 T288 T290 N292 K293 R298 N299 V300 I370 F371 L373 V387	L285-Y296 HydrophobicContact CD2-CD2 3.78Å; L285-Y296 HydrophobicContact CD2-CE2 4.47Å; L285-Y296 HydrophobicContact CD2-CG 4.26Å; T288-Y296 HydrophobicContact CG2-CE2 4.3Å; T290-Y296 WeakPolarHBondContact OG1-CE2 3.47Å; N292-Y296 HydrophobicContact CB-CE1 4.18Å; N292-Y296 HydrophobicContact CB-CE2 4.13Å; N292-Y296 PolarHBondContact O-N 3.12Å; K293-Y296 PolarHBondContact O-N 2.96Å; Y296-R298 VanDerWaalsContact C-N 3.32Å; Y296-R298 PolarHBondContact O-N 2.96Å; Y296-N299 WeakPolarHBondContact O-CB 3.36Å; Y296-N299 PolarHBondContact O-N 2.97Å; Y296-V300 VanDerWaalsContact O-CG2 3.24Å; Y296-V300 WeakPolarHBondContact O-CG2 3.37Å; Y296-V300 PolarHBondContact O-N 2.73Å; Y296-I370 WeakPolarHBondContact CD1-O 3.38Å; Y296-F371 HydrophobicContact CD1-CD1 4.06Å; Y296-F371 HydrophobicContact CD1-CE1 4.43Å; Y296-F371 HydrophobicContact CD2-CE1 4.47Å; Y296-F371 AromaticContact CE1-CD1 3.57Å; Y296-F371 HydrophobicContact CE1-CD1 3.57Å; Y296-F371 HydrophobicContact CE1-CE1 4.13Å; Y296-F371 HydrophobicContact CE2-CD1 4.4Å; Y296-F371 HydrophobicContact CE2-CE1 4.17Å; Y296-F371 AromaticContact CZ-CD1 3.78Å; Y296-L373 HydrophobicContact CD1-CD2 3.89Å; Y296-L373 HydrophobicContact CE1-CD2 3.64Å; Y296-L373 HydrophobicContact CE1-CG 4.42Å; Y296-V387 HydrophobicContact CE2-CG2 4.15Å
297	W	92.7	Very high	88	Confident	63 Å²	63	75 Å²	75	24%	0.239	38%	0.38	C	S	.	.	H	α-helix	trans	-70	-26.1	177	-78.7	114.5	0	0	0	114.1	E282 L285 K293 I295 V300 R301	E282-W297 HydrophobicContact CB-CH2 3.76Å; E282-W297 HydrophobicContact CG-CH2 3.95Å; E282-W297 HydrophobicContact CG-CZ2 4.44Å; L285-W297 HydrophobicContact CB-CZ2 4.49Å; L285-W297 HydrophobicContact CD1-CZ2 4.49Å; K293-W297 PolarHBondContact O-N 3.05Å; K293-W297 VanDerWaalsContact O-N 3.11Å; I295-W297 VanDerWaalsContact C-N 3.28Å; I295-W297 PolarHBondContact O-N 3.4Å; W297-V300 HydrophobicContact CE3-CB 4.16Å; W297-V300 HydrophobicContact CE3-CG1 3.96Å; W297-V300 HydrophobicContact CE3-CG2 4.38Å; W297-V300 HydrophobicContact CZ3-CG1 4.01Å; W297-R301 VanDerWaalsContact O-CG 3.28Å; W297-R301 WeakPolarHBondContact O-CG 3.44Å; W297-R301 PolarHBondContact O-N 2.9Å; W297-R301 PolarHBondContact O-NE 2.95Å
298	R	93.9	Very high	88.5	Confident	123 Å²	123	76.2 Å²	76.2	46%	0.464	39%	0.386	S	S	.	.	H	α-helix	trans	-68.1	-49.8	169.5	-170.8	-170.8	-52.9	138.6	5.6	110.1	D294 I295 Y296 V300 R301 E302	D294-R298 PolarHBondContact O-N 3.42Å; I295-R298 WeakPolarHBondContact O-CB 3.28Å; I295-R298 PolarHBondContact O-N 2.97Å; Y296-R298 VanDerWaalsContact C-N 3.32Å; Y296-R298 PolarHBondContact O-N 2.96Å; R298-V300 VanDerWaalsContact C-N 3.3Å; R298-V300 PolarHBondContact O-N 2.94Å; R298-R301 PolarHBondContact O-N 3.34Å; R298-E302 VanDerWaalsContact CG-CD 3.49Å; R298-E302 HydrophobicContact CG-CG 4.35Å; R298-E302 VanDerWaalsContact CG-OE1 3.28Å; R298-E302 WeakPolarHBondContact CG-OE1 3.35Å; R298-E302 PolarHBondContact O-N 2.82Å
299	N	93.8	Very high	89.2	Confident	8 Å²	8	78 Å²	78	4%	0.043	40%	0.399	C	S	.	.	H	α-helix	trans	-55.2	-44	175.5	-79.1	-3.9	0	0	0	112.2	I295 Y296 R301 E302 K303 K369 I370 D372	I295-N299 PolarHBondContact O-N 2.99Å; Y296-N299 WeakPolarHBondContact O-CB 3.36Å; Y296-N299 PolarHBondContact O-N 2.97Å; N299-R301 VanDerWaalsContact C-N 3.27Å; N299-R301 PolarHBondContact O-N 2.86Å; N299-E302 PolarHBondContact O-N 3.4Å; N299-K303 HydrophobicContact CB-CD 4.18Å; N299-K303 WeakPolarHBondContact O-CA 3.33Å; N299-K303 VanDerWaalsContact O-CB 3.25Å; N299-K303 WeakPolarHBondContact O-CB 3.48Å; N299-K303 PolarHBondContact O-N 3.01Å; N299-K303 VanDerWaalsContact OD1-CE 3.28Å; N299-K303 WeakPolarHBondContact OD1-CE 3.47Å; N299-K369 WeakPolarHBondContact CB-O 3.35Å; N299-K369 PolarHBondContact ND2-O 3.47Å; N299-I370 PolarHBondContact ND2-O 2.96Å; N299-D372 PolarHBondContact ND2-O 3.32Å
300	V	94	Very high	90.5	Very high	6 Å²	6	70.7 Å²	70.7	4%	0.036	36%	0.36	C	S	.	.	H	α-helix	trans	-57.4	-38.7	175.1	166.2	0	0	0	0	112.2	E278 A281 Y296 W297 R298 L304 I370	E278-V300 HydrophobicContact CB-CG1 4.46Å; E278-V300 HydrophobicContact CG-CG1 4.37Å; A281-V300 HydrophobicContact CB-CG1 4.17Å; A281-V300 HydrophobicContact CB-CG2 3.48Å; A281-V300 VanDerWaalsContact CB-CG2 3.48Å; Y296-V300 VanDerWaalsContact O-CG2 3.24Å; Y296-V300 WeakPolarHBondContact O-CG2 3.37Å; Y296-V300 PolarHBondContact O-N 2.73Å; W297-V300 HydrophobicContact CE3-CB 4.16Å; W297-V300 HydrophobicContact CE3-CG1 3.96Å; W297-V300 HydrophobicContact CE3-CG2 4.38Å; W297-V300 HydrophobicContact CZ3-CG1 4.01Å; R298-V300 VanDerWaalsContact C-N 3.3Å; R298-V300 PolarHBondContact O-N 2.94Å; V300-L304 HydrophobicContact CB-CD1 4.17Å; V300-L304 HydrophobicContact CG1-CD1 4.01Å; V300-L304 HydrophobicContact CG2-CD1 4.08Å; V300-L304 WeakPolarHBondContact O-CB 3.49Å; V300-I370 HydrophobicContact CG2-CG1 3.97Å
301	R	93.6	Very high	91.5	Very high	190 Å²	190	70.8 Å²	70.8	72%	0.717	36%	0.362	S	S	*	.	H	α-helix	trans	-81.6	-32.8	-178	-67.2	173.3	-154.3	-149.8	5.1	113.5	W297 R298 N299	W297-R301 VanDerWaalsContact O-CG 3.28Å; W297-R301 WeakPolarHBondContact O-CG 3.44Å; W297-R301 PolarHBondContact O-N 2.9Å; W297-R301 PolarHBondContact O-NE 2.95Å; R298-R301 PolarHBondContact O-N 3.34Å; N299-R301 VanDerWaalsContact C-N 3.27Å; N299-R301 PolarHBondContact O-N 2.86Å
302	E	93.9	Very high	92.3	Very high	143 Å²	143	64.2 Å²	64.2	67%	0.668	33%	0.333	S	S	*	.	H	α-helix	trans	-97.6	-31.7	-171.8	-68.8	175.6	-173.9	0	0	113	R298 N299	R298-E302 VanDerWaalsContact CG-CD 3.49Å; R298-E302 HydrophobicContact CG-CG 4.35Å; R298-E302 VanDerWaalsContact CG-OE1 3.28Å; R298-E302 WeakPolarHBondContact CG-OE1 3.35Å; R298-E302 PolarHBondContact O-N 2.82Å; N299-E302 PolarHBondContact O-N 3.4Å
303	K	93.5	Very high	92.9	Very high	66 Å²	66	68.6 Å²	68.6	29%	0.287	36%	0.356	S	S	.	.	H	α-helix	trans	-105.5	-26.3	-172	-56.6	-178.7	178.3	-176.1	0	113.9	N299 K369 D372	N299-K303 HydrophobicContact CB-CD 4.18Å; N299-K303 WeakPolarHBondContact O-CA 3.33Å; N299-K303 VanDerWaalsContact O-CB 3.25Å; N299-K303 WeakPolarHBondContact O-CB 3.48Å; N299-K303 PolarHBondContact O-N 3.01Å; N299-K303 VanDerWaalsContact OD1-CE 3.28Å; N299-K303 WeakPolarHBondContact OD1-CE 3.47Å; K303-K369 HydrophobicContact CB-CB 4.07Å; K303-K369 HydrophobicContact CB-CG 4.16Å; K303-K369 WeakPolarHBondContact CD-O 3.37Å; K303-K369 WeakPolarHBondContact O-CD 3.43Å; K303-D372 PolarHBondContact NZ-O 3.42Å
304	L	93.3	Very high	93.4	Very high	11 Å²	11	66.8 Å²	66.8	6%	0.058	35%	0.349	C	S	.	.	S	Bend	trans	-83.7	134.4	177.2	-57.7	179.2	0	0	0	110.4	K277 A281 V300 T366 K369 I370	K277-L304 HydrophobicContact CB-CD1 4.12Å; K277-L304 HydrophobicContact CD-CD2 4.32Å; A281-L304 HydrophobicContact CB-CD1 4.43Å; V300-L304 HydrophobicContact CB-CD1 4.17Å; V300-L304 HydrophobicContact CG1-CD1 4.01Å; V300-L304 HydrophobicContact CG2-CD1 4.08Å; V300-L304 WeakPolarHBondContact O-CB 3.49Å; L304-T366 HydrophobicContact CD2-CG2 4.07Å; L304-K369 HydrophobicContact CD2-CB 3.86Å; L304-K369 HydrophobicContact CD2-CD 3.97Å; L304-I370 HydrophobicContact CD1-CG1 4.35Å
305	S	90.6	Very high	93.7	Very high	63 Å²	63	61 Å²	61	44%	0.441	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-85.8	137.9	-179.3	-63.3	0	0	0	0	111.2	G307 E308	S305-G307 PolarHBondContact O-N 3.06Å; S305-E308 PolarHBondContact O-N 3.5Å
306	V	88	Confident	93.9	Very high	139 Å²	139	61.5 Å²	61.5	84%	0.842	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	130.4	179.9	-177.8	0	0	0	0	110.2
307	G	87.1	Confident	94.1	Very high	65 Å²	65	62.6 Å²	62.6	67%	0.67	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.9	-8.9	176.5	0	0	0	0	0	114.4	S305	S305-G307 PolarHBondContact O-N 3.06Å
308	E	93.7	Very high	94.2	Very high	63 Å²	63	59.6 Å²	59.6	29%	0.294	32%	0.315	S	S	.	.			trans	-72.2	149.7	170	-62	-171.1	121.5	0	0	111.3	K277 S305	K277-E308 HydrophobicContact CD-CB 3.59Å; K277-E308 HydrophobicContact CD-CG 4.49Å; K277-E308 WeakPolarHBondContact CD-OE2 3.4Å; K277-E308 WeakPolarHBondContact CE-OE2 3.45Å; K277-E308 HydrophobicContact CG-CB 3.96Å; K277-E308 PolarHBondContact N-O 3.15Å; K277-E308 VanDerWaalsContact N-O 3.17Å; K277-E308 IonicContact NZ-OE1 2.6Å; K277-E308 PolarHBondContact NZ-OE1 3.44Å; K277-E308 IonicContact NZ-OE2 3.79Å; K277-E308 PolarHBondContact NZ-OE2 3.4Å; S305-E308 PolarHBondContact O-N 3.5Å
309	S	97	Very high	94.2	Very high	41 Å²	41	54 Å²	54	29%	0.287	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	162.8	-176.2	65.3	0	0	0	0	113	M275 N362	M275-S309 CarbonylContact O-C 3.59Å; M275-S309 VanDerWaalsContact O-CA 3.25Å; M275-S309 WeakPolarHBondContact O-CA 3.17Å; M275-S309 WeakPolarHBondContact O-CB 3.35Å; S309-N362 PolarHBondContact O-ND2 2.63Å
310	I	97.7	Very high	94.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.1	173.3	-57.5	-61.9	0	0	0	106.7	M275 K277 F280 E314 F315 L363	M275-I310 PolarHBondContact N-O 3.16Å; M275-I310 PolarHBondContact O-N 3.01Å; K277-I310 HydrophobicContact CG-CD1 4.41Å; K277-I310 HydrophobicContact CG-CG1 4.34Å; F280-I310 HydrophobicContact CB-CG1 4.13Å; F280-I310 HydrophobicContact CD2-CG1 4.39Å; F280-I310 HydrophobicContact CD2-CG2 4.43Å; F280-I310 HydrophobicContact CG-CG1 4.09Å; I310-E314 HydrophobicContact CG2-CB 3.77Å; I310-F315 HydrophobicContact CG2-CB 4.25Å; I310-L363 HydrophobicContact CD1-CB 4.49Å; I310-L363 HydrophobicContact CD1-CD1 4.08Å; I310-L363 HydrophobicContact CG2-CD1 4.36Å
311	S	96.7	Very high	94.1	Very high	42 Å²	42	56.5 Å²	56.5	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	165.2	175.1	63	0	0	0	0	112	D313 E314 F315	S311-D313 VanDerWaalsContact C-N 3.26Å; S311-D313 PolarHBondContact O-N 3.19Å; S311-E314 WeakPolarHBondContact CB-OE2 3.49Å; S311-E314 PolarHBondContact N-OE2 3.25Å; S311-E314 PolarHBondContact O-N 3.05Å; S311-E314 WeakPolarHBondContact OG-CB 3.17Å; S311-E314 VanDerWaalsContact OG-CG 3.25Å; S311-E314 WeakPolarHBondContact OG-CG 3.44Å; S311-E314 PolarHBondContact OG-N 3.39Å; S311-E314 PolarHBondContact OG-OE2 3.08Å; S311-F315 WeakPolarHBondContact O-CB 3.37Å; S311-F315 PolarHBondContact O-N 2.79Å
312	L	95.7	Very high	94	Very high	52 Å²	52	48.2 Å²	48.2	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-59.9	-37.4	174.3	179.9	61.2	0	0	0	112.2	F265 F315 K316	F265-L312 HydrophobicContact CB-CD1 3.96Å; F265-L312 HydrophobicContact CD1-CD1 3.85Å; F265-L312 HydrophobicContact CD2-CD1 3.77Å; F265-L312 HydrophobicContact CE1-CB 4.35Å; F265-L312 HydrophobicContact CE1-CD1 4.26Å; F265-L312 HydrophobicContact CE2-CB 4.19Å; F265-L312 HydrophobicContact CE2-CD1 4.18Å; F265-L312 HydrophobicContact CG-CD1 3.57Å; F265-L312 HydrophobicContact CZ-CB 4.03Å; F265-L312 HydrophobicContact CZ-CD1 4.39Å; L312-F315 PolarHBondContact O-N 3.11Å; L312-K316 HydrophobicContact CD1-CD 4.43Å; L312-K316 HydrophobicContact CD1-CG 4.33Å; L312-K316 HydrophobicContact CG-CD 4.26Å; L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 WeakPolarHBondContact O-CG 3.44Å; L312-K316 PolarHBondContact O-N 3.48Å
313	D	96	Very high	93.7	Very high	123 Å²	123	42.1 Å²	42.1	66%	0.658	25%	0.249	S	C	*	.	H	α-helix	trans	-71.1	-41.3	-178.7	-66.2	-32	0	0	0	111.7	S311 F315 K316 S317	S311-D313 VanDerWaalsContact C-N 3.26Å; S311-D313 PolarHBondContact O-N 3.19Å; D313-F315 VanDerWaalsContact C-N 3.32Å; D313-F315 PolarHBondContact O-N 2.99Å; D313-K316 PolarHBondContact O-N 3.02Å; D313-S317 WeakPolarHBondContact O-CB 3.4Å; D313-S317 PolarHBondContact O-N 3.45Å
314	E	97.5	Very high	93.6	Very high	36 Å²	36	40.3 Å²	40.3	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-42.3	172.1	-71.9	170.4	118.6	0	0	111.2	I310 S311 S317 F318 S360 N362	I310-E314 HydrophobicContact CG2-CB 3.77Å; S311-E314 WeakPolarHBondContact CB-OE2 3.49Å; S311-E314 PolarHBondContact N-OE2 3.25Å; S311-E314 PolarHBondContact O-N 3.05Å; S311-E314 WeakPolarHBondContact OG-CB 3.17Å; S311-E314 VanDerWaalsContact OG-CG 3.25Å; S311-E314 WeakPolarHBondContact OG-CG 3.44Å; S311-E314 PolarHBondContact OG-N 3.39Å; S311-E314 PolarHBondContact OG-OE2 3.08Å; E314-S317 PolarHBondContact O-N 3.45Å; E314-F318 PolarHBondContact O-N 3.39Å; E314-S360 WeakPolarHBondContact OE1-CB 3.43Å; E314-S360 PolarHBondContact OE1-OG 3Å; E314-N362 PolarHBondContact OE1-ND2 2.92Å
315	F	96.8	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-44.5	175.9	178.2	-92.7	0	0	0	112.5	Q261 E264 F265 M275 F280 W283 I310 S311 L312 D313 F318 C319	Q261-F315 HydrophobicContact CB-CE1 4.32Å; Q261-F315 WeakPolarHBondContact O-CE1 3.39Å; E264-F315 HydrophobicContact CB-CZ 4.31Å; F265-F315 HydrophobicContact CB-CD1 4.04Å; F265-F315 HydrophobicContact CB-CE1 3.93Å; F265-F315 HydrophobicContact CB-CZ 4.4Å; F265-F315 HydrophobicContact CD2-CB 3.8Å; F265-F315 AromaticContact CD2-CD1 3.81Å; F265-F315 HydrophobicContact CD2-CD1 3.81Å; F265-F315 HydrophobicContact CD2-CD2 4.13Å; F265-F315 HydrophobicContact CD2-CE1 4.41Å; F265-F315 AromaticContact CD2-CG 3.64Å; F265-F315 HydrophobicContact CD2-CG 3.64Å; F265-F315 HydrophobicContact CE2-CB 4.06Å; F265-F315 HydrophobicContact CE2-CG 4.37Å; F265-F315 HydrophobicContact CG-CD1 4.39Å; M275-F315 HydrophobicContact CE-CD2 4.16Å; M275-F315 HydrophobicContact CE-CE2 4.01Å; M275-F315 HydrophobicContact SD-CD2 4.38Å; M275-F315 HydrophobicContact SD-CE2 4.44Å; F280-F315 HydrophobicContact CD2-CD2 4.16Å; F280-F315 HydrophobicContact CE2-CD2 4.25Å; W283-F315 AromaticContact CD2-CE2 3.58Å; W283-F315 HydrophobicContact CD2-CE2 3.58Å; W283-F315 HydrophobicContact CD2-CZ 4.18Å; W283-F315 AromaticContact CE2-CE2 3.32Å; W283-F315 AromaticContact CE2-CZ 3.45Å; W283-F315 VanDerWaalsContact CE2-CZ 3.45Å; W283-F315 AromaticContact CE3-CE2 3.9Å; W283-F315 HydrophobicContact CE3-CE2 3.9Å; W283-F315 HydrophobicContact CG-CE2 4.14Å; W283-F315 AromaticContact CH2-CE2 3.88Å; W283-F315 HydrophobicContact CH2-CE2 3.88Å; W283-F315 HydrophobicContact CH2-CZ 4.26Å; W283-F315 AromaticContact CZ2-CE2 3.52Å; W283-F315 HydrophobicContact CZ2-CE2 3.52Å; W283-F315 AromaticContact CZ2-CZ 3.54Å; W283-F315 HydrophobicContact CZ2-CZ 3.54Å; W283-F315 HydrophobicContact CZ3-CE2 4.03Å; W283-F315 AromaticContact NE1-CE2 3.58Å; W283-F315 AromaticContact NE1-CZ 3.41Å; I310-F315 HydrophobicContact CG2-CB 4.25Å; S311-F315 WeakPolarHBondContact O-CB 3.37Å; S311-F315 PolarHBondContact O-N 2.79Å; L312-F315 PolarHBondContact O-N 3.11Å; D313-F315 VanDerWaalsContact C-N 3.32Å; D313-F315 PolarHBondContact O-N 2.99Å; F315-F318 PolarHBondContact O-N 3.17Å; F315-C319 WeakPolarHBondContact CE1-SG 3.37Å; F315-C319 PolarHBondContact O-N 3.05Å; F315-C319 PolarHBondContact O-SG 3.46Å
316	K	94.6	Very high	93.3	Very high	56 Å²	56	42 Å²	42	24%	0.243	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-41.4	175.9	-78	-179.6	174.6	-176.3	0	111.2	E262 L312 D313 C319 H320	E262-K316 IonicContact OE1-NZ 2.94Å; E262-K316 PolarHBondContact OE1-NZ 3.06Å; L312-K316 HydrophobicContact CD1-CD 4.43Å; L312-K316 HydrophobicContact CD1-CG 4.33Å; L312-K316 HydrophobicContact CG-CD 4.26Å; L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 WeakPolarHBondContact O-CG 3.44Å; L312-K316 PolarHBondContact O-N 3.48Å; D313-K316 PolarHBondContact O-N 3.02Å; K316-C319 PolarHBondContact O-N 2.66Å; K316-H320 PolarHBondContact O-N 3.11Å
317	S	95.6	Very high	93.4	Very high	25 Å²	25	38.9 Å²	38.9	18%	0.175	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-42.2	175.4	-172.7	0	0	0	0	111.7	D313 E314 H320 F321 Q357 L359	D313-S317 WeakPolarHBondContact O-CB 3.4Å; D313-S317 PolarHBondContact O-N 3.45Å; E314-S317 PolarHBondContact O-N 3.45Å; S317-H320 PolarHBondContact O-N 3.4Å; S317-F321 PolarHBondContact O-N 2.94Å; S317-Q357 PolarHBondContact O-NE2 2.96Å; S317-Q357 VanDerWaalsContact O-NE2 3.1Å; S317-Q357 PolarHBondContact OG-NE2 3.48Å; S317-Q357 PolarHBondContact OG-OE1 3.48Å; S317-L359 WeakPolarHBondContact OG-CD2 3.38Å
318	F	96	Very high	93.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-46.6	173	-166.6	-104	0	0	0	112	F280 W283 L284 E314 F315 H320 F321 T322 L359 L363 V367 L388	F280-F318 HydrophobicContact CE2-CD1 4.11Å; F280-F318 HydrophobicContact CE2-CG 4.44Å; F280-F318 AromaticContact CZ-CD1 3.91Å; F280-F318 HydrophobicContact CZ-CD1 3.91Å; F280-F318 HydrophobicContact CZ-CD2 4.48Å; F280-F318 AromaticContact CZ-CE1 3.97Å; F280-F318 HydrophobicContact CZ-CE1 3.97Å; F280-F318 HydrophobicContact CZ-CG 4.16Å; F280-F318 HydrophobicContact CZ-CZ 4.27Å; W283-F318 AromaticContact CH2-CD1 3.84Å; W283-F318 HydrophobicContact CH2-CD1 3.84Å; W283-F318 HydrophobicContact CH2-CE1 4.1Å; W283-F318 AromaticContact CZ3-CD1 3.75Å; W283-F318 HydrophobicContact CZ3-CD1 3.75Å; W283-F318 AromaticContact CZ3-CE1 3.81Å; W283-F318 HydrophobicContact CZ3-CE1 3.81Å; L284-F318 HydrophobicContact CD1-CE1 3.88Å; L284-F318 HydrophobicContact CD1-CZ 4.28Å; L284-F318 HydrophobicContact CD2-CZ 4.42Å; E314-F318 PolarHBondContact O-N 3.39Å; F315-F318 PolarHBondContact O-N 3.17Å; F318-H320 VanDerWaalsContact C-N 3.32Å; F318-H320 PolarHBondContact O-N 3.46Å; F318-F321 HydrophobicContact CD2-CD1 4Å; F318-F321 AromaticContact CE2-CD1 3.93Å; F318-F321 HydrophobicContact CE2-CD1 3.93Å; F318-F321 HydrophobicContact CE2-CE1 4.05Å; F318-F321 HydrophobicContact CZ-CD1 4.49Å; F318-F321 HydrophobicContact CZ-CE1 4.46Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 2.87Å; F318-F321 VanDerWaalsContact O-N 3.14Å; F318-T322 HydrophobicContact CD1-CG2 4.1Å; F318-T322 HydrophobicContact CE1-CG2 3.86Å; F318-T322 HydrophobicContact CZ-CG2 4.4Å; F318-T322 WeakPolarHBondContact O-CG2 3.34Å; F318-T322 PolarHBondContact O-N 2.78Å; F318-L359 HydrophobicContact CD2-CD1 4.16Å; F318-L363 HydrophobicContact CB-CD1 4.22Å; F318-L363 HydrophobicContact CB-CD2 3.73Å; F318-L363 HydrophobicContact CD2-CD1 4.07Å; F318-L363 HydrophobicContact CD2-CD2 3.81Å; F318-L363 HydrophobicContact CD2-CG 4.04Å; F318-L363 HydrophobicContact CG-CD1 4.23Å; F318-L363 HydrophobicContact CG-CD2 4.17Å; F318-V367 HydrophobicContact CE2-CG2 3.81Å; F318-V367 HydrophobicContact CZ-CG2 4.25Å; F318-L388 HydrophobicContact CE1-CD2 4.17Å; F318-L388 HydrophobicContact CZ-CD2 3.91Å
319	C	93.6	Very high	93.5	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.034	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-44.5	176.3	-71.6	0	0	0	0	111.5	Q261 F315 K316 F321 T322 T323	Q261-C319 HydrophobicContact CG-CB 3.96Å; F315-C319 WeakPolarHBondContact CE1-SG 3.37Å; F315-C319 PolarHBondContact O-N 3.05Å; F315-C319 PolarHBondContact O-SG 3.46Å; K316-C319 PolarHBondContact O-N 2.66Å; C319-F321 VanDerWaalsContact C-N 3.33Å; C319-F321 PolarHBondContact O-N 3.25Å; C319-T322 PolarHBondContact O-N 2.68Å; C319-T322 VanDerWaalsContact O-N 3.12Å; C319-T322 PolarHBondContact O-OG1 3.41Å; C319-T323 PolarHBondContact O-N 2.93Å
320	H	91.5	Very high	93.2	Very high	66 Å²	66	36.1 Å²	36.1	31%	0.306	19%	0.189	S	C	.	.	H	α-helix	trans	-58.6	-44.5	174.6	-177.1	82.6	0	0	0	111.8	K316 S317 F318 T322 T323 H324 Q357	K316-H320 PolarHBondContact O-N 3.11Å; S317-H320 PolarHBondContact O-N 3.4Å; F318-H320 VanDerWaalsContact C-N 3.32Å; F318-H320 PolarHBondContact O-N 3.46Å; H320-T322 VanDerWaalsContact C-N 3.32Å; H320-T322 PolarHBondContact O-N 3.21Å; H320-T323 PolarHBondContact O-N 3.21Å; H320-T323 VanDerWaalsContact O-N 3.1Å; H320-T323 PolarHBondContact O-OG1 2.97Å; H320-H324 AromaticContact CE1-CE1 3.68Å; H320-H324 AromaticContact NE2-CE1 3.52Å; H320-H324 AromaticContact NE2-ND1 3.91Å; H320-H324 PolarHBondContact O-ND1 3.23Å; H320-Q357 PolarHBondContact CD2-NE2 2.69Å; H320-Q357 VanDerWaalsContact CD2-NE2 3.28Å
321	F	93.5	Very high	92.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-55.5	-45.6	172.8	155.5	-111.9	0	0	0	112.1	S317 F318 C319 T323 H324 L325 F328 F347 V351 T355 L359 L388	S317-F321 PolarHBondContact O-N 2.94Å; F318-F321 HydrophobicContact CD2-CD1 4Å; F318-F321 AromaticContact CE2-CD1 3.93Å; F318-F321 HydrophobicContact CE2-CD1 3.93Å; F318-F321 HydrophobicContact CE2-CE1 4.05Å; F318-F321 HydrophobicContact CZ-CD1 4.49Å; F318-F321 HydrophobicContact CZ-CE1 4.46Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 2.87Å; F318-F321 VanDerWaalsContact O-N 3.14Å; C319-F321 VanDerWaalsContact C-N 3.33Å; C319-F321 PolarHBondContact O-N 3.25Å; F321-T323 PolarHBondContact O-N 3.47Å; F321-T323 VanDerWaalsContact O-N 3.12Å; F321-H324 PolarHBondContact O-N 3.29Å; F321-L325 HydrophobicContact CZ-CD2 4.17Å; F321-F328 HydrophobicContact CE2-CB 4.02Å; F321-F328 AromaticContact CE2-CD1 3.98Å; F321-F328 HydrophobicContact CE2-CD1 3.98Å; F321-F328 AromaticContact CE2-CD2 3.6Å; F321-F328 HydrophobicContact CE2-CD2 3.6Å; F321-F328 HydrophobicContact CE2-CE1 4.37Å; F321-F328 AromaticContact CE2-CE2 3.99Å; F321-F328 HydrophobicContact CE2-CE2 3.99Å; F321-F328 AromaticContact CE2-CG 3.59Å; F321-F328 HydrophobicContact CE2-CG 3.59Å; F321-F328 HydrophobicContact CE2-CZ 4.38Å; F321-F328 AromaticContact CZ-CD1 3.96Å; F321-F328 HydrophobicContact CZ-CD1 3.96Å; F321-F328 HydrophobicContact CZ-CD2 4.17Å; F321-F328 HydrophobicContact CZ-CE1 4.01Å; F321-F328 HydrophobicContact CZ-CE2 4.18Å; F321-F328 HydrophobicContact CZ-CG 4.05Å; F321-F328 HydrophobicContact CZ-CZ 4.13Å; F321-F347 HydrophobicContact CE1-CZ 4.49Å; F321-F347 HydrophobicContact CZ-CZ 4.22Å; F321-V351 HydrophobicContact CD2-CB 4.42Å; F321-V351 HydrophobicContact CD2-CG1 3.89Å; F321-V351 HydrophobicContact CD2-CG2 3.95Å; F321-V351 HydrophobicContact CE2-CG1 4.47Å; F321-V351 HydrophobicContact CE2-CG2 3.72Å; F321-V351 HydrophobicContact CG-CG1 4.4Å; F321-V351 HydrophobicContact CZ-CG2 4.23Å; F321-T355 HydrophobicContact CB-CG2 4.29Å; F321-T355 HydrophobicContact CD2-CG2 4.08Å; F321-L359 HydrophobicContact CB-CD1 4.32Å; F321-L359 HydrophobicContact CB-CD2 4.19Å; F321-L359 HydrophobicContact CD1-CD1 4.01Å; F321-L359 HydrophobicContact CG-CD1 4.11Å; F321-L388 HydrophobicContact CE1-CD1 3.82Å; F321-L388 HydrophobicContact CZ-CD1 4.19Å
322	T	91.6	Very high	92.4	Very high	16 Å²	16	34.7 Å²	34.7	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-20.5	179.4	65.1	0	0	0	0	114	F318 C319 H320 H324 L325 L388	F318-T322 HydrophobicContact CD1-CG2 4.1Å; F318-T322 HydrophobicContact CE1-CG2 3.86Å; F318-T322 HydrophobicContact CZ-CG2 4.4Å; F318-T322 WeakPolarHBondContact O-CG2 3.34Å; F318-T322 PolarHBondContact O-N 2.78Å; C319-T322 PolarHBondContact O-N 2.68Å; C319-T322 VanDerWaalsContact O-N 3.12Å; C319-T322 PolarHBondContact O-OG1 3.41Å; H320-T322 VanDerWaalsContact C-N 3.32Å; H320-T322 PolarHBondContact O-N 3.21Å; T322-H324 PolarHBondContact O-N 3.02Å; T322-L325 WeakPolarHBondContact O-CD1 3.36Å; T322-L325 WeakPolarHBondContact O-CG 3.35Å; T322-L388 HydrophobicContact CG2-CD1 4.5Å; T322-L388 HydrophobicContact CG2-CD2 4.34Å
323	T	88.1	Confident	91.9	Very high	15 Å²	15	37.4 Å²	37.4	9%	0.092	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.5	174	67.3	0	0	0	0	113.7	P170 C319 H320 F321	P170-T323 WeakPolarHBondContact CD-O 3.49Å; C319-T323 PolarHBondContact O-N 2.93Å; H320-T323 PolarHBondContact O-N 3.21Å; H320-T323 VanDerWaalsContact O-N 3.1Å; H320-T323 PolarHBondContact O-OG1 2.97Å; F321-T323 PolarHBondContact O-N 3.47Å; F321-T323 VanDerWaalsContact O-N 3.12Å
324	H	90.3	Very high	91.5	Very high	28 Å²	28	35.7 Å²	35.7	13%	0.13	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	26.6	179.3	-62.8	81.4	0	0	0	112.2	H320 F321 T322 E326 D327 F328 A354 T355	H320-H324 AromaticContact CE1-CE1 3.68Å; H320-H324 AromaticContact NE2-CE1 3.52Å; H320-H324 AromaticContact NE2-ND1 3.91Å; H320-H324 PolarHBondContact O-ND1 3.23Å; F321-H324 PolarHBondContact O-N 3.29Å; T322-H324 PolarHBondContact O-N 3.02Å; H324-E326 PolarHBondContact O-N 2.51Å; H324-D327 IonicContact CD2-OD2 2.74Å; H324-D327 PolarHBondContact O-N 3.48Å; H324-F328 WeakPolarHBondContact O-CB 3.41Å; H324-F328 PolarHBondContact O-N 3.27Å; H324-A354 PolarHBondContact CD2-O 3.21Å; H324-T355 HydrophobicContact CB-CG2 3.89Å
325	L	90.2	Very high	90.9	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-26.9	-176.5	-75.7	167.3	0	0	0	114.3	F321 T322 F328 A329 L385 L388 M392	F321-L325 HydrophobicContact CZ-CD2 4.17Å; T322-L325 WeakPolarHBondContact O-CD1 3.36Å; T322-L325 WeakPolarHBondContact O-CG 3.35Å; L325-F328 HydrophobicContact CD2-CD1 4.41Å; L325-A329 WeakPolarHBondContact O-CB 3.35Å; L325-A329 PolarHBondContact O-N 2.92Å; L325-L385 HydrophobicContact CD2-CD2 4.17Å; L325-L388 HydrophobicContact CD1-CB 3.67Å; L325-L388 HydrophobicContact CD2-CB 3.93Å; L325-L388 HydrophobicContact CD2-CD1 3.42Å; L325-L388 VanDerWaalsContact CD2-CD1 3.42Å; L325-L388 HydrophobicContact CD2-CG 4.34Å; L325-L388 HydrophobicContact CG-CB 4.47Å; L325-M392 HydrophobicContact CD1-CE 4.47Å; L325-M392 HydrophobicContact CD1-SD 4.16Å
326	E	88.3	Confident	90.1	Very high	107 Å²	107	37.4 Å²	37.4	50%	0.5	20%	0.198	S	C	.	.	H	α-helix	trans	-68.6	-48.4	176.9	-66.7	178.7	-160.4	0	0	110.4	K169 H324 A329 I330	K169-E326 IonicContact NZ-OE1 3.61Å; K169-E326 PolarHBondContact NZ-OE1 2.58Å; H324-E326 PolarHBondContact O-N 2.51Å; E326-A329 WeakPolarHBondContact O-CB 3.31Å; E326-A329 PolarHBondContact O-N 3.27Å; E326-I330 WeakPolarHBondContact O-CG1 3.16Å; E326-I330 PolarHBondContact O-N 2.77Å; E326-I330 VanDerWaalsContact O-N 3.12Å
327	D	90.9	Very high	89.7	Confident	73 Å²	73	41.5 Å²	41.5	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-65.6	-41.3	177.1	-60.6	-32.3	0	0	0	111.4	H324 A329 I330 A331 A354	H324-D327 IonicContact CD2-OD2 2.74Å; H324-D327 PolarHBondContact O-N 3.48Å; D327-A329 VanDerWaalsContact C-N 3.35Å; D327-A329 PolarHBondContact O-N 3.25Å; D327-I330 PolarHBondContact O-N 3.16Å; D327-A331 PolarHBondContact O-N 3.4Å; D327-A354 HydrophobicContact CB-CB 4Å
328	F	92.1	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-41.7	173.4	176.3	-102.9	0	0	0	111.9	F321 H324 L325 I330 A331 M332 F347 A350 V351 A354 F384 L385	F321-F328 HydrophobicContact CE2-CB 4.02Å; F321-F328 AromaticContact CE2-CD1 3.98Å; F321-F328 HydrophobicContact CE2-CD1 3.98Å; F321-F328 AromaticContact CE2-CD2 3.6Å; F321-F328 HydrophobicContact CE2-CD2 3.6Å; F321-F328 HydrophobicContact CE2-CE1 4.37Å; F321-F328 AromaticContact CE2-CE2 3.99Å; F321-F328 HydrophobicContact CE2-CE2 3.99Å; F321-F328 AromaticContact CE2-CG 3.59Å; F321-F328 HydrophobicContact CE2-CG 3.59Å; F321-F328 HydrophobicContact CE2-CZ 4.38Å; F321-F328 AromaticContact CZ-CD1 3.96Å; F321-F328 HydrophobicContact CZ-CD1 3.96Å; F321-F328 HydrophobicContact CZ-CD2 4.17Å; F321-F328 HydrophobicContact CZ-CE1 4.01Å; F321-F328 HydrophobicContact CZ-CE2 4.18Å; F321-F328 HydrophobicContact CZ-CG 4.05Å; F321-F328 HydrophobicContact CZ-CZ 4.13Å; H324-F328 WeakPolarHBondContact O-CB 3.41Å; H324-F328 PolarHBondContact O-N 3.27Å; L325-F328 HydrophobicContact CD2-CD1 4.41Å; F328-I330 VanDerWaalsContact C-N 3.3Å; F328-I330 PolarHBondContact O-N 2.97Å; F328-A331 WeakPolarHBondContact O-CB 3.39Å; F328-A331 PolarHBondContact O-N 3.25Å; F328-M332 HydrophobicContact CD1-CG 3.97Å; F328-M332 HydrophobicContact CD2-CG 4.29Å; F328-M332 HydrophobicContact CE1-CG 3.54Å; F328-M332 HydrophobicContact CE1-SD 4.15Å; F328-M332 HydrophobicContact CE2-CG 3.93Å; F328-M332 HydrophobicContact CE2-SD 3.94Å; F328-M332 HydrophobicContact CG-CG 4.32Å; F328-M332 HydrophobicContact CZ-CE 4.32Å; F328-M332 HydrophobicContact CZ-CG 3.51Å; F328-M332 HydrophobicContact CZ-SD 3.54Å; F328-M332 VanDerWaalsContact CZ-SD 3.54Å; F328-M332 WeakPolarHBondContact O-CB 3.34Å; F328-M332 WeakPolarHBondContact O-CG 2.93Å; F328-M332 PolarHBondContact O-N 2.67Å; F328-F347 HydrophobicContact CE1-CE2 4.32Å; F328-F347 HydrophobicContact CE2-CD2 4.42Å; F328-F347 HydrophobicContact CE2-CE2 4.28Å; F328-F347 HydrophobicContact CE2-CZ 4.37Å; F328-F347 AromaticContact CZ-CD2 3.85Å; F328-F347 HydrophobicContact CZ-CD2 3.85Å; F328-F347 AromaticContact CZ-CE2 3.51Å; F328-F347 HydrophobicContact CZ-CE2 3.51Å; F328-F347 AromaticContact CZ-CZ 3.89Å; F328-F347 HydrophobicContact CZ-CZ 3.89Å; F328-A350 HydrophobicContact CD2-CB 3.73Å; F328-A350 HydrophobicContact CE2-CB 3.46Å; F328-A350 VanDerWaalsContact CE2-CB 3.46Å; F328-A350 HydrophobicContact CZ-CB 4.45Å; F328-V351 HydrophobicContact CD2-CG2 4.14Å; F328-V351 HydrophobicContact CE2-CG2 3.79Å; F328-A354 HydrophobicContact CB-CB 3.83Å; F328-F384 HydrophobicContact CE1-CD1 4.46Å; F328-F384 HydrophobicContact CE1-CE1 4.11Å; F328-F384 HydrophobicContact CZ-CE1 4.47Å; F328-L385 HydrophobicContact CD1-CD2 3.81Å; F328-L385 HydrophobicContact CE1-CD2 4.06Å
329	A	90.5	Very high	88.6	Confident	10 Å²	10	51.3 Å²	51.3	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-37.9	177	0	0	0	0	0	112.2	L325 E326 D327 M332 Q333 L385	L325-A329 WeakPolarHBondContact O-CB 3.35Å; L325-A329 PolarHBondContact O-N 2.92Å; E326-A329 WeakPolarHBondContact O-CB 3.31Å; E326-A329 PolarHBondContact O-N 3.27Å; D327-A329 VanDerWaalsContact C-N 3.35Å; D327-A329 PolarHBondContact O-N 3.25Å; A329-M332 PolarHBondContact O-N 3.05Å; A329-Q333 WeakPolarHBondContact O-CB 3.45Å; A329-Q333 VanDerWaalsContact O-CG 3.25Å; A329-Q333 WeakPolarHBondContact O-CG 3.17Å; A329-Q333 PolarHBondContact O-N 2.8Å; A329-L385 HydrophobicContact CB-CD1 3.8Å; A329-L385 HydrophobicContact CB-CD2 4.19Å
330	I	89.4	Confident	88.1	Confident	100 Å²	100	58.2 Å²	58.2	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-44.9	174.5	-64.6	165	0	0	0	110.5	E326 D327 F328 M332 Q333 T334	E326-I330 WeakPolarHBondContact O-CG1 3.16Å; E326-I330 PolarHBondContact O-N 2.77Å; E326-I330 VanDerWaalsContact O-N 3.12Å; D327-I330 PolarHBondContact O-N 3.16Å; F328-I330 VanDerWaalsContact C-N 3.3Å; F328-I330 PolarHBondContact O-N 2.97Å; I330-M332 VanDerWaalsContact C-N 3.33Å; I330-M332 PolarHBondContact O-N 3.46Å; I330-Q333 PolarHBondContact O-N 2.85Å; I330-T334 PolarHBondContact O-N 3.15Å; I330-T334 PolarHBondContact O-OG1 3.1Å
331	A	89.7	Confident	87.7	Confident	12 Å²	12	58.7 Å²	58.7	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-44.2	176.2	0	0	0	0	0	111.5	D327 F328 T334 F335 A350	D327-A331 PolarHBondContact O-N 3.4Å; F328-A331 WeakPolarHBondContact O-CB 3.39Å; F328-A331 PolarHBondContact O-N 3.25Å; A331-T334 WeakPolarHBondContact O-CB 3.47Å; A331-T334 PolarHBondContact O-N 3.37Å; A331-F335 WeakPolarHBondContact O-CD2 3.22Å; A331-F335 PolarHBondContact O-N 3.44Å; A331-A350 HydrophobicContact CB-CB 4.02Å
332	M	88	Confident	87.4	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-44.2	177.5	-69.4	-66.4	-67.6	0	0	112.6	F328 A329 I330 T334 F335 S336 V342 A350 H381	F328-M332 HydrophobicContact CD1-CG 3.97Å; F328-M332 HydrophobicContact CD2-CG 4.29Å; F328-M332 HydrophobicContact CE1-CG 3.54Å; F328-M332 HydrophobicContact CE1-SD 4.15Å; F328-M332 HydrophobicContact CE2-CG 3.93Å; F328-M332 HydrophobicContact CE2-SD 3.94Å; F328-M332 HydrophobicContact CG-CG 4.32Å; F328-M332 HydrophobicContact CZ-CE 4.32Å; F328-M332 HydrophobicContact CZ-CG 3.51Å; F328-M332 HydrophobicContact CZ-SD 3.54Å; F328-M332 VanDerWaalsContact CZ-SD 3.54Å; F328-M332 WeakPolarHBondContact O-CB 3.34Å; F328-M332 WeakPolarHBondContact O-CG 2.93Å; F328-M332 PolarHBondContact O-N 2.67Å; A329-M332 PolarHBondContact O-N 3.05Å; I330-M332 VanDerWaalsContact C-N 3.33Å; I330-M332 PolarHBondContact O-N 3.46Å; M332-T334 PolarHBondContact O-N 3.32Å; M332-F335 PolarHBondContact O-N 2.78Å; M332-F335 VanDerWaalsContact O-N 3.17Å; M332-S336 PolarHBondContact O-N 3.04Å; M332-S336 PolarHBondContact O-OG 3.27Å; M332-V342 HydrophobicContact CE-CB 3.91Å; M332-V342 HydrophobicContact CE-CG1 3.38Å; M332-V342 HydrophobicContact CE-CG2 3.69Å; M332-V342 HydrophobicContact SD-CG1 3.77Å; M332-V342 HydrophobicContact SD-CG2 4.4Å; M332-A350 HydrophobicContact CG-CB 4.43Å; M332-A350 HydrophobicContact SD-CB 3.96Å; M332-H381 HydrophobicContact CB-CB 4.4Å; M332-H381 HydrophobicContact CE-CB 3.4Å; M332-H381 VanDerWaalsContact CE-CB 3.4Å
333	Q	86.4	Confident	87.4	Confident	108 Å²	108	64 Å²	64	51%	0.505	33%	0.327	S	S	.	.	H	α-helix	trans	-58.6	-37.2	174.5	-75.9	171.9	-5.8	0	0	111.8	A329 I330 S336 L337	A329-Q333 WeakPolarHBondContact O-CB 3.45Å; A329-Q333 VanDerWaalsContact O-CG 3.25Å; A329-Q333 WeakPolarHBondContact O-CG 3.17Å; A329-Q333 PolarHBondContact O-N 2.8Å; I330-Q333 PolarHBondContact O-N 2.85Å; Q333-S336 PolarHBondContact O-N 3.12Å; Q333-L337 WeakPolarHBondContact O-CB 3.28Å; Q333-L337 VanDerWaalsContact O-CG 3.3Å; Q333-L337 WeakPolarHBondContact O-CG 3.25Å; Q333-L337 PolarHBondContact O-N 2.95Å
334	T	86.5	Confident	87.5	Confident	87 Å²	87	66.4 Å²	66.4	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-63.1	-41.5	177.2	-54.3	0	0	0	0	111.8	I330 A331 M332 A338	I330-T334 PolarHBondContact O-N 3.15Å; I330-T334 PolarHBondContact O-OG1 3.1Å; A331-T334 WeakPolarHBondContact O-CB 3.47Å; A331-T334 PolarHBondContact O-N 3.37Å; M332-T334 PolarHBondContact O-N 3.32Å; T334-A338 PolarHBondContact O-N 3.37Å; T334-A338 VanDerWaalsContact O-N 3.11Å
335	F	84.9	Confident	87.6	Confident	31 Å²	31	68 Å²	68	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-65	-42.5	174.1	-69	-66.2	0	0	0	112.4	A331 M332 A338 H339 R340 V342 E346 R349 A350	A331-F335 WeakPolarHBondContact O-CD2 3.22Å; A331-F335 PolarHBondContact O-N 3.44Å; M332-F335 PolarHBondContact O-N 2.78Å; M332-F335 VanDerWaalsContact O-N 3.17Å; F335-A338 CarbonylContact O-C 3.52Å; F335-A338 PolarHBondContact O-N 2.89Å; F335-A338 VanDerWaalsContact O-N 3.17Å; F335-H339 PolarHBondContact O-N 3.21Å; F335-R340 PolarHBondContact O-N 2.97Å; F335-V342 HydrophobicContact CB-CG2 4.29Å; F335-E346 HydrophobicContact CD1-CB 4.41Å; F335-E346 HydrophobicContact CD1-CG 4Å; F335-E346 HydrophobicContact CE1-CB 4.43Å; F335-E346 HydrophobicContact CE1-CG 4.1Å; F335-E346 HydrophobicContact CG-CG 4.48Å; F335-R349 HydrophobicContact CZ-CB 4.4Å; F335-R349 HydrophobicContact CZ-CG 4.31Å; F335-A350 HydrophobicContact CE2-CB 3.94Å
336	S	81.7	Confident	87.7	Confident	42 Å²	42	69.7 Å²	69.7	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-40.6	177.4	-57.6	0	0	0	0	112.5	M332 Q333 A338 H339	M332-S336 PolarHBondContact O-N 3.04Å; M332-S336 PolarHBondContact O-OG 3.27Å; Q333-S336 PolarHBondContact O-N 3.12Å; S336-A338 VanDerWaalsContact C-N 3.26Å; S336-A338 PolarHBondContact O-N 3.18Å; S336-H339 PolarHBondContact O-N 3.37Å
337	L	84.8	Confident	87.9	Confident	141 Å²	141	64.6 Å²	64.6	74%	0.738	34%	0.341	S	S	*	.	H	α-helix	trans	-64.5	-31	174	-73.8	172.9	0	0	0	112.5	Q333 H339	Q333-L337 WeakPolarHBondContact O-CB 3.28Å; Q333-L337 VanDerWaalsContact O-CG 3.3Å; Q333-L337 WeakPolarHBondContact O-CG 3.25Å; Q333-L337 PolarHBondContact O-N 2.95Å; L337-H339 PolarHBondContact O-N 3.28Å
338	A	86.7	Confident	88	Confident	56 Å²	56	64.6 Å²	64.6	46%	0.463	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	7	173.3	0	0	0	0	0	113.4	T334 F335 S336 R340	T334-A338 PolarHBondContact O-N 3.37Å; T334-A338 VanDerWaalsContact O-N 3.11Å; F335-A338 CarbonylContact O-C 3.52Å; F335-A338 PolarHBondContact O-N 2.89Å; F335-A338 VanDerWaalsContact O-N 3.17Å; S336-A338 VanDerWaalsContact C-N 3.26Å; S336-A338 PolarHBondContact O-N 3.18Å; A338-R340 HydrophobicContact CB-CG 4.2Å; A338-R340 PolarHBondContact O-N 2.87Å; A338-R340 VanDerWaalsContact O-N 3.15Å
339	H	82.6	Confident	88.1	Confident	175 Å²	175	72.4 Å²	72.4	81%	0.81	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	30.9	-175.1	-56.4	-64.9	0	0	0	113.6	F335 S336 L337	F335-H339 PolarHBondContact O-N 3.21Å; S336-H339 PolarHBondContact O-N 3.37Å; L337-H339 PolarHBondContact O-N 3.28Å
340	R	82.5	Confident	88.2	Confident	151 Å²	151	71.9 Å²	71.9	57%	0.57	36%	0.363	S	S	*	.			trans	-94.4	129	176.6	-66.9	-170.8	177.7	-162.7	-0.3	110.1	F335 A338	F335-R340 PolarHBondContact O-N 2.97Å; A338-R340 HydrophobicContact CB-CG 4.2Å; A338-R340 PolarHBondContact O-N 2.87Å; A338-R340 VanDerWaalsContact O-N 3.15Å
341	P	84.3	Confident	88.5	Confident	76 Å²	76	67.2 Å²	67.2	49%	0.494	34%	0.34	S	S	.	.			trans	-63.7	141.9	171.1	28.2	-33.4	0	0	0	109.5	R343	P341-R343 PolarHBondContact O-N 2.67Å
342	V	86.2	Confident	88.7	Confident	9 Å²	9	71.8 Å²	71.8	6%	0.055	36%	0.357	C	S	.	.			trans	-90.1	85.9	-179.8	-175.1	0	0	0	0	109.4	M332 F335 E346 F347 C378 L379	M332-V342 HydrophobicContact CE-CB 3.91Å; M332-V342 HydrophobicContact CE-CG1 3.38Å; M332-V342 HydrophobicContact CE-CG2 3.69Å; M332-V342 HydrophobicContact SD-CG1 3.77Å; M332-V342 HydrophobicContact SD-CG2 4.4Å; F335-V342 HydrophobicContact CB-CG2 4.29Å; V342-E346 HydrophobicContact CG1-CB 4.11Å; V342-F347 HydrophobicContact CG1-CB 4.31Å; V342-C378 WeakPolarHBondContact O-CA 3.32Å; V342-L379 PolarHBondContact O-N 3.34Å; V342-L379 VanDerWaalsContact O-N 3.14Å
343	R	90.7	Very high	89	Confident	117 Å²	117	77 Å²	77	44%	0.442	39%	0.389	S	S	.	.			trans	-82.6	177.6	170.4	-62	175.8	175.3	-95.2	-5.4	110.3	P341 A345 E346 F347 E377	P341-R343 PolarHBondContact O-N 2.67Å; R343-A345 PolarHBondContact O-N 3.3Å; R343-E346 WeakPolarHBondContact CB-OE2 3.4Å; R343-E346 PolarHBondContact O-N 3.26Å; R343-F347 PolarHBondContact O-N 2.93Å; R343-E377 IonicContact NH1-OE2 3.92Å
344	L	91.7	Very high	89.2	Confident	67 Å²	67	72.3 Å²	72.3	35%	0.351	37%	0.369	S	S	.	.	H	α-helix	trans	-52.1	-38.5	178.4	-178	60.7	0	0	0	113.5	F347 K348 L364 F368	L344-F347 PolarHBondContact O-N 3.12Å; L344-K348 HydrophobicContact CD1-CG 4.45Å; L344-K348 HydrophobicContact CG-CD 4.46Å; L344-K348 WeakPolarHBondContact O-CB 3.28Å; L344-K348 WeakPolarHBondContact O-CG 3.45Å; L344-K348 PolarHBondContact O-N 3.25Å; L344-L364 HydrophobicContact CD1-CB 3.66Å; L344-L364 HydrophobicContact CD1-CD1 3.99Å; L344-L364 HydrophobicContact CD1-CG 4.3Å; L344-F368 VanDerWaalsContact CA-CZ 3.5Å; L344-F368 HydrophobicContact CB-CE1 4.37Å; L344-F368 HydrophobicContact CB-CZ 4.18Å; L344-F368 HydrophobicContact CD1-CD2 4.05Å; L344-F368 HydrophobicContact CD1-CE2 3.78Å; L344-F368 HydrophobicContact CD1-CZ 4.29Å
345	A	91.9	Very high	89.4	Confident	62 Å²	62	69.2 Å²	69.2	51%	0.512	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-45.2	-179.7	0	0	0	0	0	112.5	R343 F347 K348 R349	R343-A345 PolarHBondContact O-N 3.3Å; A345-F347 VanDerWaalsContact C-N 3.35Å; A345-K348 PolarHBondContact O-N 3.15Å; A345-R349 WeakPolarHBondContact O-CB 3.4Å; A345-R349 PolarHBondContact O-N 2.86Å
346	E	91.1	Very high	89.8	Confident	38 Å²	38	71 Å²	71	18%	0.178	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-42	174.5	-74.8	64.5	-143.6	0	0	110.9	F335 V342 R343 R349 A350	F335-E346 HydrophobicContact CD1-CB 4.41Å; F335-E346 HydrophobicContact CD1-CG 4Å; F335-E346 HydrophobicContact CE1-CB 4.43Å; F335-E346 HydrophobicContact CE1-CG 4.1Å; F335-E346 HydrophobicContact CG-CG 4.48Å; V342-E346 HydrophobicContact CG1-CB 4.11Å; R343-E346 WeakPolarHBondContact CB-OE2 3.4Å; R343-E346 PolarHBondContact O-N 3.26Å; E346-R349 PolarHBondContact O-N 3.35Å; E346-A350 WeakPolarHBondContact O-CB 3.48Å; E346-A350 PolarHBondContact O-N 3.4Å
347	F	92.6	Very high	90.4	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-50	176.4	-169.5	-79.6	0	0	0	111.6	F321 F328 V342 R343 L344 A345 R349 A350 V351 L364 F368 L379 F384	F321-F347 HydrophobicContact CE1-CZ 4.49Å; F321-F347 HydrophobicContact CZ-CZ 4.22Å; F328-F347 HydrophobicContact CE1-CE2 4.32Å; F328-F347 HydrophobicContact CE2-CD2 4.42Å; F328-F347 HydrophobicContact CE2-CE2 4.28Å; F328-F347 HydrophobicContact CE2-CZ 4.37Å; F328-F347 AromaticContact CZ-CD2 3.85Å; F328-F347 HydrophobicContact CZ-CD2 3.85Å; F328-F347 AromaticContact CZ-CE2 3.51Å; F328-F347 HydrophobicContact CZ-CE2 3.51Å; F328-F347 AromaticContact CZ-CZ 3.89Å; F328-F347 HydrophobicContact CZ-CZ 3.89Å; V342-F347 HydrophobicContact CG1-CB 4.31Å; R343-F347 PolarHBondContact O-N 2.93Å; L344-F347 PolarHBondContact O-N 3.12Å; A345-F347 VanDerWaalsContact C-N 3.35Å; F347-R349 VanDerWaalsContact C-N 3.28Å; F347-R349 PolarHBondContact O-N 3.03Å; F347-A350 WeakPolarHBondContact O-CB 3.18Å; F347-A350 PolarHBondContact O-N 3.27Å; F347-A350 VanDerWaalsContact O-N 3.16Å; F347-V351 HydrophobicContact CD1-CG2 3.81Å; F347-V351 HydrophobicContact CE1-CG2 3.53Å; F347-V351 HydrophobicContact CZ-CG2 4.31Å; F347-V351 WeakPolarHBondContact O-CG2 3.35Å; F347-V351 PolarHBondContact O-N 3.34Å; F347-L364 HydrophobicContact CD1-CD2 3.5Å; F347-L364 HydrophobicContact CE1-CD2 3.41Å; F347-L364 VanDerWaalsContact CE1-CD2 3.41Å; F347-F368 HydrophobicContact CB-CE2 3.92Å; F347-F368 HydrophobicContact CB-CZ 3.8Å; F347-F368 HydrophobicContact CD1-CE2 4.25Å; F347-F368 HydrophobicContact CD2-CE2 4.08Å; F347-F368 HydrophobicContact CD2-CZ 4.28Å; F347-F368 AromaticContact CG-CE2 3.83Å; F347-F368 HydrophobicContact CG-CE2 3.83Å; F347-F368 HydrophobicContact CG-CZ 4.12Å; F347-L379 HydrophobicContact CD2-CD1 3.77Å; F347-L379 HydrophobicContact CE2-CD1 3.75Å; F347-F384 HydrophobicContact CE2-CD1 4.21Å; F347-F384 AromaticContact CE2-CE1 3.51Å; F347-F384 HydrophobicContact CE2-CE1 3.51Å; F347-F384 AromaticContact CE2-CZ 3.93Å; F347-F384 HydrophobicContact CE2-CZ 3.93Å; F347-F384 AromaticContact CZ-CE1 3.73Å; F347-F384 HydrophobicContact CZ-CE1 3.73Å; F347-F384 AromaticContact CZ-CZ 3.8Å; F347-F384 HydrophobicContact CZ-CZ 3.8Å
348	K	94.6	Very high	90.8	Very high	73 Å²	73	71 Å²	71	32%	0.317	37%	0.368	S	S	.	.	H	α-helix	trans	-54.3	-45.8	175	-80.1	179.3	173.8	-174.4	0	111.6	L344 A345 V351 K352 D361 L364	L344-K348 HydrophobicContact CD1-CG 4.45Å; L344-K348 HydrophobicContact CG-CD 4.46Å; L344-K348 WeakPolarHBondContact O-CB 3.28Å; L344-K348 WeakPolarHBondContact O-CG 3.45Å; L344-K348 PolarHBondContact O-N 3.25Å; A345-K348 PolarHBondContact O-N 3.15Å; K348-V351 PolarHBondContact O-N 3.47Å; K348-K352 WeakPolarHBondContact O-CB 3.41Å; K348-K352 PolarHBondContact O-N 3.23Å; K348-D361 WeakPolarHBondContact CE-OD1 3.09Å; K348-D361 IonicContact NZ-OD1 2.7Å; K348-D361 PolarHBondContact NZ-OD1 3.37Å; K348-D361 IonicContact NZ-OD2 3.9Å; K348-L364 HydrophobicContact CD-CD1 4.03Å; K348-L364 HydrophobicContact CG-CD1 3.44Å; K348-L364 VanDerWaalsContact CG-CD1 3.44Å
349	R	93.5	Very high	91.3	Very high	164 Å²	164	68.9 Å²	68.9	62%	0.619	35%	0.349	S	S	*	.	H	α-helix	trans	-63	-44.6	178.2	-171.1	-178.5	-61.3	-120.3	2	111.6	F335 A345 E346 F347 V351 K352 V353	F335-R349 HydrophobicContact CZ-CB 4.4Å; F335-R349 HydrophobicContact CZ-CG 4.31Å; A345-R349 WeakPolarHBondContact O-CB 3.4Å; A345-R349 PolarHBondContact O-N 2.86Å; E346-R349 PolarHBondContact O-N 3.35Å; F347-R349 VanDerWaalsContact C-N 3.28Å; F347-R349 PolarHBondContact O-N 3.03Å; R349-V351 PolarHBondContact O-N 3.43Å; R349-K352 PolarHBondContact O-N 3.5Å; R349-V353 VanDerWaalsContact O-CG2 3.31Å; R349-V353 WeakPolarHBondContact O-CG2 3.29Å; R349-V353 PolarHBondContact O-N 3.32Å
350	A	92.9	Very high	92	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-43.7	177.6	0	0	0	0	0	111.8	F328 A331 M332 F335 E346 F347 V353 A354	F328-A350 HydrophobicContact CD2-CB 3.73Å; F328-A350 HydrophobicContact CE2-CB 3.46Å; F328-A350 VanDerWaalsContact CE2-CB 3.46Å; F328-A350 HydrophobicContact CZ-CB 4.45Å; A331-A350 HydrophobicContact CB-CB 4.02Å; M332-A350 HydrophobicContact CG-CB 4.43Å; M332-A350 HydrophobicContact SD-CB 3.96Å; F335-A350 HydrophobicContact CE2-CB 3.94Å; E346-A350 WeakPolarHBondContact O-CB 3.48Å; E346-A350 PolarHBondContact O-N 3.4Å; F347-A350 WeakPolarHBondContact O-CB 3.18Å; F347-A350 PolarHBondContact O-N 3.27Å; F347-A350 VanDerWaalsContact O-N 3.16Å; A350-V353 PolarHBondContact O-N 2.84Å; A350-A354 WeakPolarHBondContact O-CB 3.44Å; A350-A354 PolarHBondContact O-N 3.07Å
351	V	94.6	Very high	92.6	Very high	2 Å²	2	60 Å²	60	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-46.3	175.9	176.6	0	0	0	0	111.2	F321 F328 F347 K348 R349 V353 A354 T355 L359	F321-V351 HydrophobicContact CD2-CB 4.42Å; F321-V351 HydrophobicContact CD2-CG1 3.89Å; F321-V351 HydrophobicContact CD2-CG2 3.95Å; F321-V351 HydrophobicContact CE2-CG1 4.47Å; F321-V351 HydrophobicContact CE2-CG2 3.72Å; F321-V351 HydrophobicContact CG-CG1 4.4Å; F321-V351 HydrophobicContact CZ-CG2 4.23Å; F328-V351 HydrophobicContact CD2-CG2 4.14Å; F328-V351 HydrophobicContact CE2-CG2 3.79Å; F347-V351 HydrophobicContact CD1-CG2 3.81Å; F347-V351 HydrophobicContact CE1-CG2 3.53Å; F347-V351 HydrophobicContact CZ-CG2 4.31Å; F347-V351 WeakPolarHBondContact O-CG2 3.35Å; F347-V351 PolarHBondContact O-N 3.34Å; K348-V351 PolarHBondContact O-N 3.47Å; R349-V351 PolarHBondContact O-N 3.43Å; V351-V353 VanDerWaalsContact C-N 3.33Å; V351-V353 PolarHBondContact O-N 2.66Å; V351-A354 PolarHBondContact O-N 2.61Å; V351-T355 HydrophobicContact CG1-CG2 4.38Å; V351-T355 WeakPolarHBondContact O-CB 3.4Å; V351-T355 PolarHBondContact O-N 3.31Å; V351-T355 PolarHBondContact O-OG1 2.85Å; V351-L359 HydrophobicContact CG1-CD1 4.11Å; V351-L359 HydrophobicContact CG1-CG 3.97Å; V351-L359 HydrophobicContact CG2-CD1 4.2Å
352	K	95.1	Very high	93.2	Very high	107 Å²	107	58.7 Å²	58.7	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-40.4	179.1	-170.8	173.2	-170.4	162.2	0	112.5	K348 R349 G356 Q357 E358	K348-K352 WeakPolarHBondContact O-CB 3.41Å; K348-K352 PolarHBondContact O-N 3.23Å; R349-K352 PolarHBondContact O-N 3.5Å; K352-G356 VanDerWaalsContact O-CA 3.24Å; K352-G356 WeakPolarHBondContact O-CA 3.1Å; K352-G356 PolarHBondContact O-N 2.87Å; K352-Q357 WeakPolarHBondContact CA-O 3.3Å; K352-E358 HydrophobicContact CD-CG 4.13Å; K352-E358 WeakPolarHBondContact CD-OE1 3.48Å; K352-E358 WeakPolarHBondContact CE-OE1 3.35Å; K352-E358 HydrophobicContact CG-CG 4.44Å; K352-E358 IonicContact NZ-OE1 2.99Å; K352-E358 PolarHBondContact NZ-OE1 2.89Å
353	V	93.2	Very high	93.7	Very high	110 Å²	110	58.3 Å²	58.3	67%	0.667	31%	0.308	S	S	*	.	H	α-helix	trans	-66.1	-42.8	175.9	170.2	0	0	0	0	111.5	R349 A350 V351	R349-V353 VanDerWaalsContact O-CG2 3.31Å; R349-V353 WeakPolarHBondContact O-CG2 3.29Å; R349-V353 PolarHBondContact O-N 3.32Å; A350-V353 PolarHBondContact O-N 2.84Å; V351-V353 VanDerWaalsContact C-N 3.33Å; V351-V353 PolarHBondContact O-N 2.66Å
354	A	91.5	Very high	93.9	Very high	11 Å²	11	52.8 Å²	52.8	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-75.2	-29.8	-176.4	0	0	0	0	0	114	H324 D327 F328 A350 V351	H324-A354 PolarHBondContact CD2-O 3.21Å; D327-A354 HydrophobicContact CB-CB 4Å; F328-A354 HydrophobicContact CB-CB 3.83Å; A350-A354 WeakPolarHBondContact O-CB 3.44Å; A350-A354 PolarHBondContact O-N 3.07Å; V351-A354 PolarHBondContact O-N 2.61Å
355	T	91.2	Very high	94	Very high	22 Å²	22	52.2 Å²	52.2	14%	0.135	29%	0.285	C	S	.	.	H	α-helix	trans	-122.3	-18.5	-168.9	65.8	0	0	0	0	114.4	F321 H324 V351 Q357	F321-T355 HydrophobicContact CB-CG2 4.29Å; F321-T355 HydrophobicContact CD2-CG2 4.08Å; H324-T355 HydrophobicContact CB-CG2 3.89Å; V351-T355 HydrophobicContact CG1-CG2 4.38Å; V351-T355 WeakPolarHBondContact O-CB 3.4Å; V351-T355 PolarHBondContact O-N 3.31Å; V351-T355 PolarHBondContact O-OG1 2.85Å; T355-Q357 PolarHBondContact O-N 3.28Å; T355-Q357 WeakPolarHBondContact OG1-CG 3.48Å; T355-Q357 PolarHBondContact OG1-N 3.48Å; T355-Q357 PolarHBondContact OG1-O 3.44Å
356	G	92.2	Very high	94.2	Very high	67 Å²	67	49.2 Å²	49.2	69%	0.691	26%	0.26	S	S	*	.	S	Bend	trans	74.5	-0.5	-170.4	0	0	0	0	0	115	K352	K352-G356 VanDerWaalsContact O-CA 3.24Å; K352-G356 WeakPolarHBondContact O-CA 3.1Å; K352-G356 PolarHBondContact O-N 2.87Å
357	Q	93.6	Very high	94.4	Very high	55 Å²	55	47.5 Å²	47.5	26%	0.257	25%	0.252	S	S	.	.	S	Bend	trans	-120	166.9	178.8	59.9	164.5	12.1	0	0	112	S317 H320 K352 T355	S317-Q357 PolarHBondContact O-NE2 2.96Å; S317-Q357 VanDerWaalsContact O-NE2 3.1Å; S317-Q357 PolarHBondContact OG-NE2 3.48Å; S317-Q357 PolarHBondContact OG-OE1 3.48Å; H320-Q357 PolarHBondContact CD2-NE2 2.69Å; H320-Q357 VanDerWaalsContact CD2-NE2 3.28Å; K352-Q357 WeakPolarHBondContact CA-O 3.3Å; T355-Q357 PolarHBondContact O-N 3.28Å; T355-Q357 WeakPolarHBondContact OG1-CG 3.48Å; T355-Q357 PolarHBondContact OG1-N 3.48Å; T355-Q357 PolarHBondContact OG1-O 3.44Å
358	E	95	Very high	94.4	Very high	128 Å²	128	48.5 Å²	48.5	60%	0.598	26%	0.256	S	S	*	.			trans	-111.2	142.1	173.9	-66.8	178.2	178.9	0	0	109.6	K352	K352-E358 HydrophobicContact CD-CG 4.13Å; K352-E358 WeakPolarHBondContact CD-OE1 3.48Å; K352-E358 WeakPolarHBondContact CE-OE1 3.35Å; K352-E358 HydrophobicContact CG-CG 4.44Å; K352-E358 IonicContact NZ-OE1 2.99Å; K352-E358 PolarHBondContact NZ-OE1 2.89Å
359	L	96.6	Very high	94.4	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	25%	0.252	C	S	.	.			trans	-87.5	150.4	170.9	-64.7	176.4	0	0	0	109.5	S317 F318 F321 V351 L363 L364	S317-L359 WeakPolarHBondContact OG-CD2 3.38Å; F318-L359 HydrophobicContact CD2-CD1 4.16Å; F321-L359 HydrophobicContact CB-CD1 4.32Å; F321-L359 HydrophobicContact CB-CD2 4.19Å; F321-L359 HydrophobicContact CD1-CD1 4.01Å; F321-L359 HydrophobicContact CG-CD1 4.11Å; V351-L359 HydrophobicContact CG1-CD1 4.11Å; V351-L359 HydrophobicContact CG1-CG 3.97Å; V351-L359 HydrophobicContact CG2-CD1 4.2Å; L359-L363 HydrophobicContact CB-CD2 4.09Å; L359-L363 HydrophobicContact CD1-CD2 4.32Å; L359-L363 HydrophobicContact CD2-CD2 3.83Å; L359-L363 HydrophobicContact CG-CD2 4.27Å; L359-L364 HydrophobicContact CB-CD1 4.26Å; L359-L364 HydrophobicContact CB-CD2 4.05Å; L359-L364 HydrophobicContact CB-CG 3.97Å; L359-L364 HydrophobicContact CD1-CD2 4.05Å
360	S	96.9	Very high	94.4	Very high	38 Å²	38	39.7 Å²	39.7	27%	0.266	22%	0.223	S	C	.	.			trans	-64.7	150.9	178.2	72.3	0	0	0	0	111.8	E314 N362 L363 L364	E314-S360 WeakPolarHBondContact OE1-CB 3.43Å; E314-S360 PolarHBondContact OE1-OG 3Å; S360-N362 PolarHBondContact O-N 3.14Å; S360-L363 PolarHBondContact O-N 3.37Å; S360-L363 VanDerWaalsContact OG-CB 3.26Å; S360-L363 WeakPolarHBondContact OG-CB 3.24Å; S360-L363 PolarHBondContact OG-N 3.36Å; S360-L364 WeakPolarHBondContact O-CG 3.35Å; S360-L364 PolarHBondContact O-N 2.85Å
361	D	96	Very high	94.4	Very high	103 Å²	103	39.9 Å²	39.9	55%	0.551	22%	0.223	S	C	*	.	H	α-helix	trans	-61.2	-36.4	176.3	-72.6	-11.2	0	0	0	112	K348 L363 L364 D365	K348-D361 WeakPolarHBondContact CE-OD1 3.09Å; K348-D361 IonicContact NZ-OD1 2.7Å; K348-D361 PolarHBondContact NZ-OD1 3.37Å; K348-D361 IonicContact NZ-OD2 3.9Å; D361-L363 PolarHBondContact O-N 3.01Å; D361-L364 PolarHBondContact O-N 3.45Å; D361-D365 WeakPolarHBondContact O-CB 3.36Å; D361-D365 PolarHBondContact O-N 2.87Å
362	N	96.7	Very high	94.2	Very high	48 Å²	48	40.4 Å²	40.4	26%	0.257	23%	0.226	S	C	.	.	H	α-helix	trans	-59.6	-43.4	175.5	177	47.6	0	0	0	112.5	K277 S309 E314 S360 T366	K277-N362 WeakPolarHBondContact CE-OD1 3.21Å; K277-N362 PolarHBondContact NZ-OD1 3.14Å; S309-N362 PolarHBondContact O-ND2 2.63Å; E314-N362 PolarHBondContact OE1-ND2 2.92Å; S360-N362 PolarHBondContact O-N 3.14Å; N362-T366 PolarHBondContact O-N 3.44Å; N362-T366 PolarHBondContact O-OG1 2.7Å
363	L	96	Very high	93.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-42.6	178.2	-179.7	67.4	0	0	0	111.6	F280 I310 F318 L359 S360 D361 T366 V367	F280-L363 HydrophobicContact CE1-CD1 4.13Å; F280-L363 HydrophobicContact CE2-CD1 4.04Å; F280-L363 HydrophobicContact CZ-CD1 3.63Å; I310-L363 HydrophobicContact CD1-CB 4.49Å; I310-L363 HydrophobicContact CD1-CD1 4.08Å; I310-L363 HydrophobicContact CG2-CD1 4.36Å; F318-L363 HydrophobicContact CB-CD1 4.22Å; F318-L363 HydrophobicContact CB-CD2 3.73Å; F318-L363 HydrophobicContact CD2-CD1 4.07Å; F318-L363 HydrophobicContact CD2-CD2 3.81Å; F318-L363 HydrophobicContact CD2-CG 4.04Å; F318-L363 HydrophobicContact CG-CD1 4.23Å; F318-L363 HydrophobicContact CG-CD2 4.17Å; L359-L363 HydrophobicContact CB-CD2 4.09Å; L359-L363 HydrophobicContact CD1-CD2 4.32Å; L359-L363 HydrophobicContact CD2-CD2 3.83Å; L359-L363 HydrophobicContact CG-CD2 4.27Å; S360-L363 PolarHBondContact O-N 3.37Å; S360-L363 VanDerWaalsContact OG-CB 3.26Å; S360-L363 WeakPolarHBondContact OG-CB 3.24Å; S360-L363 PolarHBondContact OG-N 3.36Å; D361-L363 PolarHBondContact O-N 3.01Å; L363-T366 WeakPolarHBondContact O-CB 3.43Å; L363-T366 PolarHBondContact O-N 3.41Å; L363-V367 WeakPolarHBondContact O-CG2 3.4Å; L363-V367 PolarHBondContact O-N 2.81Å
364	L	95.1	Very high	93.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-43.5	178.7	-68.1	170.1	0	0	0	112.2	L344 F347 K348 L359 S360 D361 T366 V367 F368	L344-L364 HydrophobicContact CD1-CB 3.66Å; L344-L364 HydrophobicContact CD1-CD1 3.99Å; L344-L364 HydrophobicContact CD1-CG 4.3Å; F347-L364 HydrophobicContact CD1-CD2 3.5Å; F347-L364 HydrophobicContact CE1-CD2 3.41Å; F347-L364 VanDerWaalsContact CE1-CD2 3.41Å; K348-L364 HydrophobicContact CD-CD1 4.03Å; K348-L364 HydrophobicContact CG-CD1 3.44Å; K348-L364 VanDerWaalsContact CG-CD1 3.44Å; L359-L364 HydrophobicContact CB-CD1 4.26Å; L359-L364 HydrophobicContact CB-CD2 4.05Å; L359-L364 HydrophobicContact CB-CG 3.97Å; L359-L364 HydrophobicContact CD1-CD2 4.05Å; S360-L364 WeakPolarHBondContact O-CG 3.35Å; S360-L364 PolarHBondContact O-N 2.85Å; D361-L364 PolarHBondContact O-N 3.45Å; L364-T366 VanDerWaalsContact C-N 3.26Å; L364-T366 PolarHBondContact O-N 3.33Å; L364-V367 PolarHBondContact O-N 3.15Å; L364-V367 VanDerWaalsContact O-N 3.16Å; L364-F368 WeakPolarHBondContact O-CD2 3.28Å; L364-F368 PolarHBondContact O-N 3.06Å
365	D	94.6	Very high	93.1	Very high	55 Å²	55	40.3 Å²	40.3	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-54.1	-45.3	171.8	168.6	74.3	0	0	0	111.1	K277 D361 V367 F368 K369	K277-D365 IonicContact NZ-OD2 2.97Å; K277-D365 PolarHBondContact NZ-OD2 2.95Å; D361-D365 WeakPolarHBondContact O-CB 3.36Å; D361-D365 PolarHBondContact O-N 2.87Å; D365-V367 PolarHBondContact O-N 3.27Å; D365-F368 PolarHBondContact O-N 3.44Å; D365-K369 WeakPolarHBondContact O-CB 3.32Å; D365-K369 WeakPolarHBondContact O-CG 3.37Å; D365-K369 PolarHBondContact O-N 3.02Å; D365-K369 WeakPolarHBondContact OD1-CE 3.38Å; D365-K369 IonicContact OD1-NZ 3.28Å; D365-K369 PolarHBondContact OD1-NZ 2.94Å; D365-K369 WeakPolarHBondContact OD2-CE 3.42Å; D365-K369 IonicContact OD2-NZ 2.86Å; D365-K369 PolarHBondContact OD2-NZ 3.32Å
366	T	95.7	Very high	92.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-46.4	176.9	-54.8	0	0	0	0	111.6	K277 F280 L304 N362 L363 L364 I370	K277-T366 HydrophobicContact CB-CG2 4.21Å; K277-T366 HydrophobicContact CD-CG2 4.15Å; K277-T366 WeakPolarHBondContact CD-OG1 3.44Å; K277-T366 WeakPolarHBondContact CE-OG1 3.41Å; K277-T366 HydrophobicContact CG-CG2 4.16Å; F280-T366 HydrophobicContact CD1-CG2 3.9Å; F280-T366 HydrophobicContact CE1-CG2 4.24Å; L304-T366 HydrophobicContact CD2-CG2 4.07Å; N362-T366 PolarHBondContact O-N 3.44Å; N362-T366 PolarHBondContact O-OG1 2.7Å; L363-T366 WeakPolarHBondContact O-CB 3.43Å; L363-T366 PolarHBondContact O-N 3.41Å; L364-T366 VanDerWaalsContact C-N 3.26Å; L364-T366 PolarHBondContact O-N 3.33Å; T366-I370 HydrophobicContact CG2-CD1 3.97Å; T366-I370 WeakPolarHBondContact O-CD1 3.38Å; T366-I370 VanDerWaalsContact O-CG1 3.23Å; T366-I370 WeakPolarHBondContact O-CG1 3.27Å; T366-I370 PolarHBondContact O-N 3.4Å; T366-I370 VanDerWaalsContact O-N 3.15Å
367	V	94.6	Very high	92.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-48.3	178.9	169.9	0	0	0	0	111	F318 L363 L364 D365 K369 I370 F371 L379 F384	F318-V367 HydrophobicContact CE2-CG2 3.81Å; F318-V367 HydrophobicContact CZ-CG2 4.25Å; L363-V367 WeakPolarHBondContact O-CG2 3.4Å; L363-V367 PolarHBondContact O-N 2.81Å; L364-V367 PolarHBondContact O-N 3.15Å; L364-V367 VanDerWaalsContact O-N 3.16Å; D365-V367 PolarHBondContact O-N 3.27Å; V367-K369 PolarHBondContact O-N 3.35Å; V367-I370 PolarHBondContact O-N 2.85Å; V367-F371 HydrophobicContact CG1-CD2 3.97Å; V367-F371 HydrophobicContact CG1-CE2 4.44Å; V367-F371 VanDerWaalsContact O-CD2 3.28Å; V367-F371 WeakPolarHBondContact O-CD2 3.47Å; V367-F371 PolarHBondContact O-N 3.32Å; V367-L379 HydrophobicContact CG1-CD1 4.21Å; V367-F384 HydrophobicContact CG1-CD2 4.43Å; V367-F384 HydrophobicContact CG1-CE2 3.55Å; V367-F384 HydrophobicContact CG1-CZ 3.82Å
368	F	93.9	Very high	92.4	Very high	21 Å²	21	43.8 Å²	43.8	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-45.2	179.2	-88	-106.9	0	0	0	111.3	L344 F347 L364 D365 I370 F371 D372 E377 L379	L344-F368 VanDerWaalsContact CA-CZ 3.5Å; L344-F368 HydrophobicContact CB-CE1 4.37Å; L344-F368 HydrophobicContact CB-CZ 4.18Å; L344-F368 HydrophobicContact CD1-CD2 4.05Å; L344-F368 HydrophobicContact CD1-CE2 3.78Å; L344-F368 HydrophobicContact CD1-CZ 4.29Å; F347-F368 HydrophobicContact CB-CE2 3.92Å; F347-F368 HydrophobicContact CB-CZ 3.8Å; F347-F368 HydrophobicContact CD1-CE2 4.25Å; F347-F368 HydrophobicContact CD2-CE2 4.08Å; F347-F368 HydrophobicContact CD2-CZ 4.28Å; F347-F368 AromaticContact CG-CE2 3.83Å; F347-F368 HydrophobicContact CG-CE2 3.83Å; F347-F368 HydrophobicContact CG-CZ 4.12Å; L364-F368 WeakPolarHBondContact O-CD2 3.28Å; L364-F368 PolarHBondContact O-N 3.06Å; D365-F368 PolarHBondContact O-N 3.44Å; F368-I370 PolarHBondContact O-N 2.99Å; F368-F371 PolarHBondContact O-N 3.41Å; F368-D372 WeakPolarHBondContact O-CB 3.42Å; F368-D372 PolarHBondContact O-N 3.46Å; F368-E377 WeakPolarHBondContact CE1-O 3.39Å; F368-L379 HydrophobicContact CD1-CD1 4.27Å; F368-L379 HydrophobicContact CD1-CD2 4.35Å; F368-L379 HydrophobicContact CD1-CG 3.9Å; F368-L379 HydrophobicContact CD2-CD1 3.75Å; F368-L379 HydrophobicContact CD2-CG 4.28Å; F368-L379 HydrophobicContact CE1-CD1 4.01Å; F368-L379 HydrophobicContact CE1-CG 3.69Å; F368-L379 HydrophobicContact CE2-CD1 3.46Å; F368-L379 VanDerWaalsContact CE2-CD1 3.46Å; F368-L379 HydrophobicContact CE2-CG 4.1Å; F368-L379 HydrophobicContact CG-CD1 4.15Å; F368-L379 HydrophobicContact CG-CD2 4.47Å; F368-L379 HydrophobicContact CG-CG 4.2Å; F368-L379 HydrophobicContact CZ-CD1 3.6Å; F368-L379 HydrophobicContact CZ-CG 3.78Å
369	K	94	Very high	91.8	Very high	53 Å²	53	38.2 Å²	38.2	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-36.5	175.8	-77.6	169.9	173.2	161.6	0	113	N299 K303 L304 D365 V367	N299-K369 WeakPolarHBondContact CB-O 3.35Å; N299-K369 PolarHBondContact ND2-O 3.47Å; K303-K369 HydrophobicContact CB-CB 4.07Å; K303-K369 HydrophobicContact CB-CG 4.16Å; K303-K369 WeakPolarHBondContact CD-O 3.37Å; K303-K369 WeakPolarHBondContact O-CD 3.43Å; L304-K369 HydrophobicContact CD2-CB 3.86Å; L304-K369 HydrophobicContact CD2-CD 3.97Å; D365-K369 WeakPolarHBondContact O-CB 3.32Å; D365-K369 WeakPolarHBondContact O-CG 3.37Å; D365-K369 PolarHBondContact O-N 3.02Å; D365-K369 WeakPolarHBondContact OD1-CE 3.38Å; D365-K369 IonicContact OD1-NZ 3.28Å; D365-K369 PolarHBondContact OD1-NZ 2.94Å; D365-K369 WeakPolarHBondContact OD2-CE 3.42Å; D365-K369 IonicContact OD2-NZ 2.86Å; D365-K369 PolarHBondContact OD2-NZ 3.32Å; V367-K369 PolarHBondContact O-N 3.35Å
370	I	93.5	Very high	91	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.1	-48.6	179.7	-66.3	164.6	0	0	0	111.3	A281 L285 Y296 N299 V300 L304 T366 V367 F368	A281-I370 HydrophobicContact CB-CD1 3.69Å; A281-I370 HydrophobicContact CB-CG1 4.41Å; L285-I370 HydrophobicContact CD1-CG2 4.36Å; Y296-I370 WeakPolarHBondContact CD1-O 3.38Å; N299-I370 PolarHBondContact ND2-O 2.96Å; V300-I370 HydrophobicContact CG2-CG1 3.97Å; L304-I370 HydrophobicContact CD1-CG1 4.35Å; T366-I370 HydrophobicContact CG2-CD1 3.97Å; T366-I370 WeakPolarHBondContact O-CD1 3.38Å; T366-I370 VanDerWaalsContact O-CG1 3.23Å; T366-I370 WeakPolarHBondContact O-CG1 3.27Å; T366-I370 PolarHBondContact O-N 3.4Å; T366-I370 VanDerWaalsContact O-N 3.15Å; V367-I370 PolarHBondContact O-N 2.85Å; F368-I370 PolarHBondContact O-N 2.99Å
371	F	92.4	Very high	90	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-99.6	-10.4	-166.7	-66.1	-74.6	0	0	0	115.3	L284 L285 Y296 V367 F368 L373 L379 F384 V387	L284-F371 HydrophobicContact CD2-CE2 3.61Å; L284-F371 HydrophobicContact CD2-CZ 3.87Å; L284-F371 HydrophobicContact CG-CE2 4.46Å; L284-F371 HydrophobicContact CG-CZ 4.25Å; L285-F371 HydrophobicContact CD2-CE1 4.1Å; L285-F371 HydrophobicContact CD2-CZ 4.03Å; Y296-F371 HydrophobicContact CD1-CD1 4.06Å; Y296-F371 HydrophobicContact CD1-CE1 4.43Å; Y296-F371 HydrophobicContact CD2-CE1 4.47Å; Y296-F371 AromaticContact CE1-CD1 3.57Å; Y296-F371 HydrophobicContact CE1-CD1 3.57Å; Y296-F371 HydrophobicContact CE1-CE1 4.13Å; Y296-F371 HydrophobicContact CE2-CD1 4.4Å; Y296-F371 HydrophobicContact CE2-CE1 4.17Å; Y296-F371 AromaticContact CZ-CD1 3.78Å; V367-F371 HydrophobicContact CG1-CD2 3.97Å; V367-F371 HydrophobicContact CG1-CE2 4.44Å; V367-F371 VanDerWaalsContact O-CD2 3.28Å; V367-F371 WeakPolarHBondContact O-CD2 3.47Å; V367-F371 PolarHBondContact O-N 3.32Å; F368-F371 PolarHBondContact O-N 3.41Å; F371-L373 PolarHBondContact O-N 3.42Å; F371-L379 HydrophobicContact CB-CD2 3.51Å; F371-F384 HydrophobicContact CB-CD2 4.46Å; F371-F384 HydrophobicContact CD1-CD2 4.16Å; F371-F384 AromaticContact CD2-CD2 3.56Å; F371-F384 HydrophobicContact CD2-CD2 3.56Å; F371-F384 AromaticContact CD2-CE2 3.77Å; F371-F384 HydrophobicContact CD2-CE2 3.77Å; F371-F384 HydrophobicContact CE1-CD2 4.33Å; F371-F384 AromaticContact CE2-CD2 3.75Å; F371-F384 HydrophobicContact CE2-CD2 3.75Å; F371-F384 AromaticContact CE2-CE2 3.75Å; F371-F384 HydrophobicContact CE2-CE2 3.75Å; F371-F384 AromaticContact CG-CD2 3.8Å; F371-F384 HydrophobicContact CG-CD2 3.8Å; F371-F384 HydrophobicContact CG-CE2 4.45Å; F371-F384 HydrophobicContact CZ-CD2 4.13Å; F371-F384 HydrophobicContact CZ-CE2 4.42Å; F371-V387 HydrophobicContact CE1-CB 4.06Å; F371-V387 HydrophobicContact CE1-CG1 3.86Å; F371-V387 HydrophobicContact CE1-CG2 3.97Å; F371-V387 HydrophobicContact CZ-CB 4.33Å; F371-V387 HydrophobicContact CZ-CG1 3.73Å
372	D	90.1	Very high	89.2	Confident	14 Å²	14	38.5 Å²	38.5	8%	0.075	22%	0.223	C	C	.	.			trans	-74.3	103.2	169.6	-178.9	1.1	0	0	0	109.5	N299 K303 F368 G375 D376 E377	N299-D372 PolarHBondContact ND2-O 3.32Å; K303-D372 PolarHBondContact NZ-O 3.42Å; F368-D372 WeakPolarHBondContact O-CB 3.42Å; F368-D372 PolarHBondContact O-N 3.46Å; D372-G375 VanDerWaalsContact OD1-CA 3.22Å; D372-G375 WeakPolarHBondContact OD1-CA 3.35Å; D372-G375 PolarHBondContact OD1-N 2.82Å; D372-G375 VanDerWaalsContact OD2-CA 3.28Å; D372-G375 WeakPolarHBondContact OD2-CA 3.5Å; D372-D376 PolarHBondContact OD1-N 2.79Å; D372-E377 WeakPolarHBondContact OD2-CA 3.33Å; D372-E377 PolarHBondContact OD2-N 3.09Å; D372-E377 VanDerWaalsContact OD2-N 3.08Å
373	L	86.4	Confident	88.4	Confident	59 Å²	59	40 Å²	40	31%	0.309	23%	0.228	S	C	.	.	S	Bend	trans	-84.5	-35	-171.7	-65.1	179.7	0	0	0	112.9	N292 I295 Y296 F371 E383	N292-L373 HydrophobicContact CB-CD1 4.44Å; N292-L373 HydrophobicContact CB-CD2 4.48Å; N292-L373 WeakPolarHBondContact ND2-CD1 3.39Å; I295-L373 HydrophobicContact CB-CD2 4.04Å; I295-L373 HydrophobicContact CG2-CD2 3.55Å; Y296-L373 HydrophobicContact CD1-CD2 3.89Å; Y296-L373 HydrophobicContact CE1-CD2 3.64Å; Y296-L373 HydrophobicContact CE1-CG 4.42Å; F371-L373 PolarHBondContact O-N 3.42Å; L373-E383 WeakPolarHBondContact CD1-OE2 3.41Å
374	D	86.4	Confident	87.9	Confident	121 Å²	121	40.1 Å²	40.1	65%	0.647	23%	0.228	S	C	*	.	S	Bend	trans	-105.8	-9.3	-175.8	57.9	-1.6	0	0	0	113.4	D376	D374-D376 PolarHBondContact OD1-N 2.76Å
375	G	83.7	Confident	87.6	Confident	45 Å²	45	40.7 Å²	40.7	46%	0.464	23%	0.232	S	C	.	.	S	Bend	trans	82.2	19.6	176.4	0	0	0	0	0	113.4	D372 E377	D372-G375 VanDerWaalsContact OD1-CA 3.22Å; D372-G375 WeakPolarHBondContact OD1-CA 3.35Å; D372-G375 PolarHBondContact OD1-N 2.82Å; D372-G375 VanDerWaalsContact OD2-CA 3.28Å; D372-G375 WeakPolarHBondContact OD2-CA 3.5Å; G375-E377 VanDerWaalsContact C-N 3.25Å; G375-E377 PolarHBondContact O-N 3.27Å
376	D	88.5	Confident	87.2	Confident	75 Å²	75	39.3 Å²	39.3	40%	0.401	23%	0.23	S	C	.	.	S	Bend	trans	-85.8	4.8	-178.9	83.4	-18.9	0	0	0	113.6	D372 D374 C378	D372-D376 PolarHBondContact OD1-N 2.79Å; D374-D376 PolarHBondContact OD1-N 2.76Å; D376-C378 PolarHBondContact O-N 3Å; D376-C378 WeakPolarHBondContact OD1-CA 3.23Å; D376-C378 WeakPolarHBondContact OD1-CB 3.17Å; D376-C378 PolarHBondContact OD1-N 3.22Å
377	E	86.4	Confident	86.9	Confident	129 Å²	129	39.3 Å²	39.3	60%	0.603	23%	0.23	S	C	*	.	S	Bend	trans	62.1	20.6	-174.6	-53	-178.3	154.3	0	0	114.3	R343 F368 D372 G375	R343-E377 IonicContact NH1-OE2 3.92Å; F368-E377 WeakPolarHBondContact CE1-O 3.39Å; D372-E377 WeakPolarHBondContact OD2-CA 3.33Å; D372-E377 PolarHBondContact OD2-N 3.09Å; D372-E377 VanDerWaalsContact OD2-N 3.08Å; G375-E377 VanDerWaalsContact C-N 3.25Å; G375-E377 PolarHBondContact O-N 3.27Å
378	C	86.9	Confident	86.7	Confident	14 Å²	14	39.3 Å²	39.3	10%	0.095	23%	0.23	C	C	.	.			trans	-113.9	149.9	175.8	-55.8	0	0	0	0	111.2	V342 D376	V342-C378 WeakPolarHBondContact O-CA 3.32Å; D376-C378 PolarHBondContact O-N 3Å; D376-C378 WeakPolarHBondContact OD1-CA 3.23Å; D376-C378 WeakPolarHBondContact OD1-CB 3.17Å; D376-C378 PolarHBondContact OD1-N 3.22Å
379	L	84.4	Confident	86.5	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.052	24%	0.242	C	C	.	.			trans	-103.8	129.2	176.7	-72.7	-178.3	0	0	0	112.3	V342 F347 V367 F368 F371 H381	V342-L379 PolarHBondContact O-N 3.34Å; V342-L379 VanDerWaalsContact O-N 3.14Å; F347-L379 HydrophobicContact CD2-CD1 3.77Å; F347-L379 HydrophobicContact CE2-CD1 3.75Å; V367-L379 HydrophobicContact CG1-CD1 4.21Å; F368-L379 HydrophobicContact CD1-CD1 4.27Å; F368-L379 HydrophobicContact CD1-CD2 4.35Å; F368-L379 HydrophobicContact CD1-CG 3.9Å; F368-L379 HydrophobicContact CD2-CD1 3.75Å; F368-L379 HydrophobicContact CD2-CG 4.28Å; F368-L379 HydrophobicContact CE1-CD1 4.01Å; F368-L379 HydrophobicContact CE1-CG 3.69Å; F368-L379 HydrophobicContact CE2-CD1 3.46Å; F368-L379 VanDerWaalsContact CE2-CD1 3.46Å; F368-L379 HydrophobicContact CE2-CG 4.1Å; F368-L379 HydrophobicContact CG-CD1 4.15Å; F368-L379 HydrophobicContact CG-CD2 4.47Å; F368-L379 HydrophobicContact CG-CG 4.2Å; F368-L379 HydrophobicContact CZ-CD1 3.6Å; F368-L379 HydrophobicContact CZ-CG 3.78Å; F371-L379 HydrophobicContact CB-CD2 3.51Å; L379-H381 PolarHBondContact O-N 3.05Å
380	S	78.1	Confident	86.2	Confident	50 Å²	50	41.7 Å²	41.7	35%	0.35	24%	0.243	S	C	.	.			trans	-69.1	98.8	166.6	72.8	0	0	0	0	109.5	G382 E383 F384	S380-G382 VanDerWaalsContact C-N 3.28Å; S380-G382 PolarHBondContact O-N 2.81Å; S380-E383 PolarHBondContact O-N 3.36Å; S380-E383 PolarHBondContact OG-OE2 2.87Å; S380-F384 WeakPolarHBondContact O-CB 3.31Å; S380-F384 PolarHBondContact O-N 3.38Å
381	H	76.3	Confident	86	Confident	62 Å²	62	42.1 Å²	42.1	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-35.2	-173.5	72.9	-41.1	0	0	0	114	M332 L379 L385	M332-H381 HydrophobicContact CB-CB 4.4Å; M332-H381 HydrophobicContact CE-CB 3.4Å; M332-H381 VanDerWaalsContact CE-CB 3.4Å; L379-H381 PolarHBondContact O-N 3.05Å; H381-L385 WeakPolarHBondContact O-CB 3.5Å; H381-L385 WeakPolarHBondContact O-CD1 3.32Å; H381-L385 WeakPolarHBondContact O-CG 3.41Å; H381-L385 PolarHBondContact O-N 3.46Å
382	G	78.7	Confident	85.8	Confident	48 Å²	48	43 Å²	43	50%	0.495	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-46.1	-176.5	0	0	0	0	0	113.5	S380 G386	S380-G382 VanDerWaalsContact C-N 3.28Å; S380-G382 PolarHBondContact O-N 2.81Å; G382-G386 PolarHBondContact O-N 2.96Å
383	E	79.8	Confident	85.6	Confident	80 Å²	80	43.6 Å²	43.6	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-73	-44.6	-179.3	-61.1	-175	148.9	0	0	111.1	N292 L373 S380 L385 G386 V387	N292-E383 PolarHBondContact ND2-OE1 3.37Å; N292-E383 PolarHBondContact ND2-OE2 3Å; L373-E383 WeakPolarHBondContact CD1-OE2 3.41Å; S380-E383 PolarHBondContact O-N 3.36Å; S380-E383 PolarHBondContact OG-OE2 2.87Å; E383-L385 PolarHBondContact O-N 3.26Å; E383-G386 WeakPolarHBondContact O-CA 3.33Å; E383-G386 PolarHBondContact O-N 2.73Å; E383-V387 PolarHBondContact O-N 2.85Å
384	F	87	Confident	85.8	Confident	1 Å²	1	42.2 Å²	42.2	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-48.1	174.8	175.7	-112.1	0	0	0	111.9	F328 F347 V367 F371 S380 G386 V387 L388	F328-F384 HydrophobicContact CE1-CD1 4.46Å; F328-F384 HydrophobicContact CE1-CE1 4.11Å; F328-F384 HydrophobicContact CZ-CE1 4.47Å; F347-F384 HydrophobicContact CE2-CD1 4.21Å; F347-F384 AromaticContact CE2-CE1 3.51Å; F347-F384 HydrophobicContact CE2-CE1 3.51Å; F347-F384 AromaticContact CE2-CZ 3.93Å; F347-F384 HydrophobicContact CE2-CZ 3.93Å; F347-F384 AromaticContact CZ-CE1 3.73Å; F347-F384 HydrophobicContact CZ-CE1 3.73Å; F347-F384 AromaticContact CZ-CZ 3.8Å; F347-F384 HydrophobicContact CZ-CZ 3.8Å; V367-F384 HydrophobicContact CG1-CD2 4.43Å; V367-F384 HydrophobicContact CG1-CE2 3.55Å; V367-F384 HydrophobicContact CG1-CZ 3.82Å; F371-F384 HydrophobicContact CB-CD2 4.46Å; F371-F384 HydrophobicContact CD1-CD2 4.16Å; F371-F384 AromaticContact CD2-CD2 3.56Å; F371-F384 HydrophobicContact CD2-CD2 3.56Å; F371-F384 AromaticContact CD2-CE2 3.77Å; F371-F384 HydrophobicContact CD2-CE2 3.77Å; F371-F384 HydrophobicContact CE1-CD2 4.33Å; F371-F384 AromaticContact CE2-CD2 3.75Å; F371-F384 HydrophobicContact CE2-CD2 3.75Å; F371-F384 AromaticContact CE2-CE2 3.75Å; F371-F384 HydrophobicContact CE2-CE2 3.75Å; F371-F384 AromaticContact CG-CD2 3.8Å; F371-F384 HydrophobicContact CG-CD2 3.8Å; F371-F384 HydrophobicContact CG-CE2 4.45Å; F371-F384 HydrophobicContact CZ-CD2 4.13Å; F371-F384 HydrophobicContact CZ-CE2 4.42Å; S380-F384 WeakPolarHBondContact O-CB 3.31Å; S380-F384 PolarHBondContact O-N 3.38Å; F384-G386 VanDerWaalsContact C-N 3.27Å; F384-G386 PolarHBondContact O-N 3.46Å; F384-V387 PolarHBondContact O-N 3.25Å; F384-L388 HydrophobicContact CD1-CD1 4.15Å; F384-L388 HydrophobicContact CD2-CG 4.36Å; F384-L388 HydrophobicContact CE1-CD1 3.44Å; F384-L388 VanDerWaalsContact CE1-CD1 3.44Å; F384-L388 HydrophobicContact CE1-CG 4.21Å; F384-L388 HydrophobicContact CE2-CD1 3.91Å; F384-L388 HydrophobicContact CE2-CD2 4.17Å; F384-L388 HydrophobicContact CE2-CG 3.97Å; F384-L388 HydrophobicContact CZ-CD1 3.33Å; F384-L388 HydrophobicContact CZ-CD2 4.32Å; F384-L388 HydrophobicContact CZ-CG 3.93Å; F384-L388 WeakPolarHBondContact O-CG 3.29Å; F384-L388 PolarHBondContact O-N 2.53Å
385	L	87.4	Confident	85.5	Confident	14 Å²	14	37.9 Å²	37.9	7%	0.073	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-35.9	175.3	-74	171.9	0	0	0	112	L325 F328 A329 H381 E383 K389	L325-L385 HydrophobicContact CD2-CD2 4.17Å; F328-L385 HydrophobicContact CD1-CD2 3.81Å; F328-L385 HydrophobicContact CE1-CD2 4.06Å; A329-L385 HydrophobicContact CB-CD1 3.8Å; A329-L385 HydrophobicContact CB-CD2 4.19Å; H381-L385 WeakPolarHBondContact O-CB 3.5Å; H381-L385 WeakPolarHBondContact O-CD1 3.32Å; H381-L385 WeakPolarHBondContact O-CG 3.41Å; H381-L385 PolarHBondContact O-N 3.46Å; E383-L385 PolarHBondContact O-N 3.26Å; L385-K389 VanDerWaalsContact O-CB 3.3Å; L385-K389 WeakPolarHBondContact O-CB 3.15Å; L385-K389 WeakPolarHBondContact O-CG 3.42Å; L385-K389 PolarHBondContact O-N 2.83Å
386	G	86.4	Confident	85.4	Confident	26 Å²	26	36.4 Å²	36.4	27%	0.268	21%	0.207	S	C	.	.	H	α-helix	trans	-62.1	-44.8	174.8	0	0	0	0	0	112.4	G382 E383 F384 N390	G382-G386 PolarHBondContact O-N 2.96Å; E383-G386 WeakPolarHBondContact O-CA 3.33Å; E383-G386 PolarHBondContact O-N 2.73Å; F384-G386 VanDerWaalsContact C-N 3.27Å; F384-G386 PolarHBondContact O-N 3.46Å; G386-N390 PolarHBondContact O-N 3.34Å; G386-N390 PolarHBondContact O-ND2 3.38Å; G386-N390 VanDerWaalsContact O-ND2 3.14Å
387	V	89.2	Confident	84.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-49.9	175.6	169.6	0	0	0	0	110.9	L285 T288 T290 Y296 F371 E383 F384 K389 N390 R391	L285-V387 HydrophobicContact CD2-CG1 4.2Å; T288-V387 HydrophobicContact CG2-CG2 3.77Å; T288-V387 WeakPolarHBondContact OG1-CG1 3.47Å; T290-V387 HydrophobicContact CG2-CG2 4.25Å; Y296-V387 HydrophobicContact CE2-CG2 4.15Å; F371-V387 HydrophobicContact CE1-CB 4.06Å; F371-V387 HydrophobicContact CE1-CG1 3.86Å; F371-V387 HydrophobicContact CE1-CG2 3.97Å; F371-V387 HydrophobicContact CZ-CB 4.33Å; F371-V387 HydrophobicContact CZ-CG1 3.73Å; E383-V387 PolarHBondContact O-N 2.85Å; F384-V387 PolarHBondContact O-N 3.25Å; V387-K389 PolarHBondContact O-N 2.89Å; V387-N390 PolarHBondContact O-N 2.89Å; V387-R391 WeakPolarHBondContact O-CB 3.26Å; V387-R391 PolarHBondContact O-N 3.26Å
388	L	91.2	Very high	83.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-40.4	179.8	-67.2	-167.3	0	0	0	113	L284 F318 F321 T322 L325 F384 R391 M392	L284-L388 HydrophobicContact CD1-CD2 3.56Å; F318-L388 HydrophobicContact CE1-CD2 4.17Å; F318-L388 HydrophobicContact CZ-CD2 3.91Å; F321-L388 HydrophobicContact CE1-CD1 3.82Å; F321-L388 HydrophobicContact CZ-CD1 4.19Å; T322-L388 HydrophobicContact CG2-CD1 4.5Å; T322-L388 HydrophobicContact CG2-CD2 4.34Å; L325-L388 HydrophobicContact CD1-CB 3.67Å; L325-L388 HydrophobicContact CD2-CB 3.93Å; L325-L388 HydrophobicContact CD2-CD1 3.42Å; L325-L388 VanDerWaalsContact CD2-CD1 3.42Å; L325-L388 HydrophobicContact CD2-CG 4.34Å; L325-L388 HydrophobicContact CG-CB 4.47Å; F384-L388 HydrophobicContact CD1-CD1 4.15Å; F384-L388 HydrophobicContact CD2-CG 4.36Å; F384-L388 HydrophobicContact CE1-CD1 3.44Å; F384-L388 VanDerWaalsContact CE1-CD1 3.44Å; F384-L388 HydrophobicContact CE1-CG 4.21Å; F384-L388 HydrophobicContact CE2-CD1 3.91Å; F384-L388 HydrophobicContact CE2-CD2 4.17Å; F384-L388 HydrophobicContact CE2-CG 3.97Å; F384-L388 HydrophobicContact CZ-CD1 3.33Å; F384-L388 HydrophobicContact CZ-CD2 4.32Å; F384-L388 HydrophobicContact CZ-CG 3.93Å; F384-L388 WeakPolarHBondContact O-CG 3.29Å; F384-L388 PolarHBondContact O-N 2.53Å; L388-R391 PolarHBondContact O-N 3.11Å; L388-M392 VanDerWaalsContact O-CB 3.31Å; L388-M392 WeakPolarHBondContact O-CB 3.19Å; L388-M392 PolarHBondContact O-N 2.92Å
389	K	88.9	Confident	82.7	Confident	75 Å²	75	35.5 Å²	35.5	33%	0.326	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-49.6	175.5	-77.1	172.2	-178.8	176.3	0	111.2	L385 V387 R391 M392 H393	L385-K389 VanDerWaalsContact O-CB 3.3Å; L385-K389 WeakPolarHBondContact O-CB 3.15Å; L385-K389 WeakPolarHBondContact O-CG 3.42Å; L385-K389 PolarHBondContact O-N 2.83Å; V387-K389 PolarHBondContact O-N 2.89Å; K389-R391 VanDerWaalsContact C-N 3.29Å; K389-R391 PolarHBondContact O-N 3.33Å; K389-M392 PolarHBondContact O-N 3.48Å; K389-H393 WeakPolarHBondContact O-CB 3.38Å; K389-H393 PolarHBondContact O-CD2 3.21Å; K389-H393 PolarHBondContact O-N 3.2Å
390	N	88.1	Confident	81.3	Confident	49 Å²	49	36.9 Å²	36.9	26%	0.262	21%	0.21	S	C	.	.	H	α-helix	trans	-60.8	-39.7	177.8	-77.9	-42.7	0	0	0	112	G386 V387 R394 G395	G386-N390 PolarHBondContact O-N 3.34Å; G386-N390 PolarHBondContact O-ND2 3.38Å; G386-N390 VanDerWaalsContact O-ND2 3.14Å; V387-N390 PolarHBondContact O-N 2.89Å; N390-R394 PolarHBondContact O-N 3.5Å; N390-G395 PolarHBondContact O-N 3.26Å
391	R	90.4	Very high	80	Confident	9 Å²	9	43.1 Å²	43.1	3%	0.034	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-48	177.3	178.8	59.1	-171.5	99.9	-19.6	112.9	E264 W283 L284 V387 L388 K389 H393 R394	E264-R391 VanDerWaalsContact CD-NH2 3.3Å; E264-R391 IonicContact OE1-CZ 3.94Å; E264-R391 VanDerWaalsContact OE1-CZ 3.31Å; E264-R391 IonicContact OE1-NH1 3.82Å; E264-R391 PolarHBondContact OE1-NH1 3.02Å; E264-R391 IonicContact OE1-NH2 2.82Å; E264-R391 PolarHBondContact OE1-NH2 2.93Å; E264-R391 IonicContact OE2-NH2 3.95Å; W283-R391 WeakPolarHBondContact O-CD 3.34Å; W283-R391 PolarHBondContact O-NE 2.72Å; L284-R391 HydrophobicContact CD1-CG 4.3Å; V387-R391 WeakPolarHBondContact O-CB 3.26Å; V387-R391 PolarHBondContact O-N 3.26Å; L388-R391 PolarHBondContact O-N 3.11Å; K389-R391 VanDerWaalsContact C-N 3.29Å; K389-R391 PolarHBondContact O-N 3.33Å; R391-H393 VanDerWaalsContact C-N 3.28Å; R391-H393 PolarHBondContact O-N 2.78Å; R391-R394 PolarHBondContact O-N 2.66Å
392	M	87.4	Confident	78.6	Confident	22 Å²	22	47.7 Å²	47.7	11%	0.108	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-41.9	179.4	-179.4	-176.7	68	0	0	110.9	T168 L325 L388 K389 R394	T168-M392 HydrophobicContact CG2-CG 4.03Å; T168-M392 VanDerWaalsContact CG2-O 3.28Å; T168-M392 WeakPolarHBondContact CG2-O 3.08Å; L325-M392 HydrophobicContact CD1-CE 4.47Å; L325-M392 HydrophobicContact CD1-SD 4.16Å; L388-M392 VanDerWaalsContact O-CB 3.31Å; L388-M392 WeakPolarHBondContact O-CB 3.19Å; L388-M392 PolarHBondContact O-N 2.92Å; K389-M392 PolarHBondContact O-N 3.48Å; M392-R394 VanDerWaalsContact C-N 3.29Å; M392-R394 PolarHBondContact O-N 3.38Å; M392-R394 PolarHBondContact O-NH1 3.41Å
393	H	86.9	Confident	77.4	Confident	26 Å²	26	46.1 Å²	46.1	12%	0.12	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.3	177.1	-71	-75.8	0	0	0	114.2	K389 R391 G395 L396 W397	K389-H393 WeakPolarHBondContact O-CB 3.38Å; K389-H393 PolarHBondContact O-CD2 3.21Å; K389-H393 PolarHBondContact O-N 3.2Å; R391-H393 VanDerWaalsContact C-N 3.28Å; R391-H393 PolarHBondContact O-N 2.78Å; H393-G395 VanDerWaalsContact C-N 3.25Å; H393-G395 PolarHBondContact O-N 2.89Å; H393-L396 WeakPolarHBondContact O-CA 3.41Å; H393-L396 VanDerWaalsContact O-CB 3.27Å; H393-L396 WeakPolarHBondContact O-CB 3.41Å; H393-L396 PolarHBondContact O-N 3.37Å; H393-W397 HydrophobicContact CB-CB 3.69Å; H393-W397 HydrophobicContact CB-CG 4.4Å; H393-W397 AromaticContact CD2-CD1 3.15Å; H393-W397 AromaticContact CD2-CG 3.95Å; H393-W397 AromaticContact CD2-NE1 3.99Å; H393-W397 AromaticContact CE1-CD1 3.93Å; H393-W397 AromaticContact CG-CD1 3.6Å; H393-W397 AromaticContact NE2-CD1 3.36Å; H393-W397 AromaticContact NE2-NE1 3.89Å
394	R	89.2	Confident	76.1	Confident	29 Å²	29	44.8 Å²	44.8	11%	0.109	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	41.2	177.3	-60.4	167.8	178.8	93.2	1.1	112.9	V110 E264 F287 N390 R391 M392 L396	V110-R394 VanDerWaalsContact CG1-NE 3.33Å; V110-R394 WeakPolarHBondContact O-CD 3.24Å; E264-R394 IonicContact OE1-CZ 3.91Å; E264-R394 IonicContact OE1-NE 2.97Å; E264-R394 PolarHBondContact OE1-NE 3.49Å; E264-R394 IonicContact OE1-NH2 3.83Å; E264-R394 PolarHBondContact OE1-NH2 2.9Å; E264-R394 IonicContact OE2-CZ 2.68Å; E264-R394 IonicContact OE2-NE 2.78Å; E264-R394 IonicContact OE2-NH2 3.86Å; E264-R394 PolarHBondContact OE2-NH2 3.13Å; F287-R394 HydrophobicContact CD2-CB 4.31Å; F287-R394 HydrophobicContact CE1-CB 4.47Å; F287-R394 WeakPolarHBondContact CE1-O 3.41Å; F287-R394 VanDerWaalsContact CE2-CA 3.46Å; F287-R394 HydrophobicContact CE2-CB 3.7Å; F287-R394 HydrophobicContact CE2-CG 3.94Å; F287-R394 HydrophobicContact CZ-CB 3.78Å; F287-R394 HydrophobicContact CZ-CG 4.4Å; N390-R394 PolarHBondContact O-N 3.5Å; R391-R394 PolarHBondContact O-N 2.66Å; M392-R394 VanDerWaalsContact C-N 3.29Å; M392-R394 PolarHBondContact O-N 3.38Å; M392-R394 PolarHBondContact O-NH1 3.41Å; R394-L396 PolarHBondContact O-N 3.17Å; R394-L396 VanDerWaalsContact O-N 3.11Å
395	G	81.6	Confident	74.5	Confident	30 Å²	30	51 Å²	51	31%	0.309	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-4.5	-174.4	0	0	0	0	0	115.1	L82 N390 H393 W397	L82-G395 WeakPolarHBondContact CD2-O 3.42Å; N390-G395 PolarHBondContact O-N 3.26Å; H393-G395 VanDerWaalsContact C-N 3.25Å; H393-G395 PolarHBondContact O-N 2.89Å; G395-W397 PolarHBondContact O-N 3.03Å
396	L	80.7	Confident	73.2	Confident	15 Å²	15	53.9 Å²	53.9	8%	0.079	28%	0.276	C	S	.	.			trans	-88.3	21.5	177.5	-59.9	177.4	0	0	0	113.2	L82 R83 R86 L164 H393 R394 V398	L82-L396 HydrophobicContact CD2-CD2 4.06Å; L82-L396 HydrophobicContact CG-CD2 3.81Å; R83-L396 HydrophobicContact CG-CB 4.08Å; R83-L396 HydrophobicContact CG-CD1 4.41Å; R83-L396 HydrophobicContact CG-CD2 4.26Å; R86-L396 HydrophobicContact CB-CD2 4.21Å; L164-L396 HydrophobicContact CD1-CD1 3.73Å; L164-L396 HydrophobicContact CD2-CD1 3.99Å; H393-L396 WeakPolarHBondContact O-CA 3.41Å; H393-L396 VanDerWaalsContact O-CB 3.27Å; H393-L396 WeakPolarHBondContact O-CB 3.41Å; H393-L396 PolarHBondContact O-N 3.37Å; R394-L396 PolarHBondContact O-N 3.17Å; R394-L396 VanDerWaalsContact O-N 3.11Å; L396-V398 PolarHBondContact O-N 2.91Å
397	W	75.4	Confident	72	Confident	104 Å²	104	54.3 Å²	54.3	39%	0.394	27%	0.269	S	S	.	.			trans	-67.5	133.7	-177.3	-174.6	63.2	0	0	0	111.6	H393 G395	H393-W397 HydrophobicContact CB-CB 3.69Å; H393-W397 HydrophobicContact CB-CG 4.4Å; H393-W397 AromaticContact CD2-CD1 3.15Å; H393-W397 AromaticContact CD2-CG 3.95Å; H393-W397 AromaticContact CD2-NE1 3.99Å; H393-W397 AromaticContact CE1-CD1 3.93Å; H393-W397 AromaticContact CG-CD1 3.6Å; H393-W397 AromaticContact NE2-CD1 3.36Å; H393-W397 AromaticContact NE2-NE1 3.89Å; G395-W397 PolarHBondContact O-N 3.03Å
398	V	67.9	Low	70.9	Confident	36 Å²	36	58.6 Å²	58.6	22%	0.218	29%	0.286	C	S	.	.			trans	-120.3	128.8	170.1	-176.9	0	0	0	0	107.2	L396 Q400	L396-V398 PolarHBondContact O-N 2.91Å; V398-Q400 WeakPolarHBondContact O-CG 3.24Å; V398-Q400 PolarHBondContact O-N 2.84Å; V398-Q400 VanDerWaalsContact O-N 3.1Å
399	S	62.1	Low	69.9	Low	59 Å²	59	65 Å²	65	41%	0.413	31%	0.313	S	S	.	.			trans	-54.6	115.6	179.5	55.9	0	0	0	0	111.3
400	Q	55.7	Low	69.1	Low	38 Å²	38	62.7 Å²	62.7	18%	0.178	31%	0.307	C	S	.	.			trans	-90.9	-7.6	-175	-60.1	-171.1	-8.3	0	0	114.9	V398 Q402 S403 V404	V398-Q400 WeakPolarHBondContact O-CG 3.24Å; V398-Q400 PolarHBondContact O-N 2.84Å; V398-Q400 VanDerWaalsContact O-N 3.1Å; Q400-Q402 CarbonylContact O-C 3.45Å; Q400-Q402 PolarHBondContact O-N 2.88Å; Q400-Q402 VanDerWaalsContact O-N 3.08Å; Q400-S403 WeakPolarHBondContact CA-OG 3.38Å; Q400-S403 WeakPolarHBondContact CB-OG 3.4Å; Q400-S403 CarbonylContact O-C 3.6Å; Q400-S403 WeakPolarHBondContact O-CA 3.39Å; Q400-S403 PolarHBondContact O-N 3.16Å; Q400-S403 PolarHBondContact O-OG 2.83Å; Q400-V404 HydrophobicContact CB-CG2 3.69Å; Q400-V404 WeakPolarHBondContact O-CG2 3.47Å; Q400-V404 PolarHBondContact O-N 3.23Å
401	Q	49.4	Very low	68.3	Low	181 Å²	181	60.5 Å²	60.5	85%	0.846	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.5	-173	-86.2	171.1	-42	0	0	113.9
402	Q	48.4	Very low	67.5	Low	159 Å²	159	66.8 Å²	66.8	74%	0.743	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-30.9	169	-71.1	176.8	-23.5	0	0	112.3	Q400 E406	Q400-Q402 CarbonylContact O-C 3.45Å; Q400-Q402 PolarHBondContact O-N 2.88Å; Q400-Q402 VanDerWaalsContact O-N 3.08Å; Q402-E406 WeakPolarHBondContact O-CG 3.47Å; Q402-E406 PolarHBondContact O-N 3.25Å
403	S	51.8	Low	66.8	Low	14 Å²	14	70.8 Å²	70.8	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-77.7	-26.9	-174.8	88	0	0	0	0	115.6	Q400 Y407	Q400-S403 WeakPolarHBondContact CA-OG 3.38Å; Q400-S403 WeakPolarHBondContact CB-OG 3.4Å; Q400-S403 CarbonylContact O-C 3.6Å; Q400-S403 WeakPolarHBondContact O-CA 3.39Å; Q400-S403 PolarHBondContact O-N 3.16Å; Q400-S403 PolarHBondContact O-OG 2.83Å; S403-Y407 WeakPolarHBondContact O-CA 3.5Å; S403-Y407 WeakPolarHBondContact O-CB 3.27Å; S403-Y407 PolarHBondContact O-N 3.45Å
404	V	52.8	Low	66	Low	52 Å²	52	70.9 Å²	70.9	32%	0.315	34%	0.34	S	S	.	.	H	α-helix	trans	-72.5	-42.6	179.2	179.5	0	0	0	0	111	Q400 E406 Y407 W408	Q400-V404 HydrophobicContact CB-CG2 3.69Å; Q400-V404 WeakPolarHBondContact O-CG2 3.47Å; Q400-V404 PolarHBondContact O-N 3.23Å; V404-E406 VanDerWaalsContact C-N 3.29Å; V404-E406 PolarHBondContact O-N 2.88Å; V404-Y407 VanDerWaalsContact O-CB 3.31Å; V404-Y407 WeakPolarHBondContact O-CB 3.33Å; V404-Y407 PolarHBondContact O-N 3.24Å; V404-W408 VanDerWaalsContact CG1-CD1 3.49Å; V404-W408 PolarHBondContact O-N 3.37Å
405	Q	54.4	Low	65.3	Low	132 Å²	132	70.6 Å²	70.6	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-62.5	-42.2	174.5	-70.1	-173.1	-6.6	0	0	110.4	K409	Q405-K409 WeakPolarHBondContact O-CB 3.34Å; Q405-K409 WeakPolarHBondContact O-CG 3.22Å; Q405-K409 PolarHBondContact O-N 3.14Å
406	E	59	Low	65	Low	75 Å²	75	73 Å²	73	35%	0.35	35%	0.347	S	S	.	.	H	α-helix	trans	-69.4	-32.7	175.3	-70.5	175.1	173.3	0	0	113	Q402 V404 K409 C410	Q402-E406 WeakPolarHBondContact O-CG 3.47Å; Q402-E406 PolarHBondContact O-N 3.25Å; V404-E406 VanDerWaalsContact C-N 3.29Å; V404-E406 PolarHBondContact O-N 2.88Å; E406-K409 CarbonylContact O-C 3.58Å; E406-K409 PolarHBondContact O-N 2.56Å; E406-C410 WeakPolarHBondContact O-CB 3.49Å; E406-C410 PolarHBondContact O-N 3.21Å; E406-C410 PolarHBondContact O-SG 3.14Å
407	Y	61.1	Low	64.6	Low	34 Å²	34	75.1 Å²	75.1	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-57.4	171.8	179.3	-107.8	0	0	0	109.9	A177 I200 S403 V404 K409 C410 V411	A177-Y407 WeakPolarHBondContact CB-OH 3.38Å; I200-Y407 HydrophobicContact CG2-CD2 3.61Å; I200-Y407 HydrophobicContact CG2-CE2 3.64Å; S403-Y407 WeakPolarHBondContact O-CA 3.5Å; S403-Y407 WeakPolarHBondContact O-CB 3.27Å; S403-Y407 PolarHBondContact O-N 3.45Å; V404-Y407 VanDerWaalsContact O-CB 3.31Å; V404-Y407 WeakPolarHBondContact O-CB 3.33Å; V404-Y407 PolarHBondContact O-N 3.24Å; Y407-K409 VanDerWaalsContact C-N 3.25Å; Y407-K409 PolarHBondContact O-N 3.12Å; Y407-C410 CarbonylContact O-C 3.54Å; Y407-C410 WeakPolarHBondContact O-CA 3.18Å; Y407-C410 WeakPolarHBondContact O-CB 3.49Å; Y407-C410 PolarHBondContact O-N 2.93Å; Y407-V411 HydrophobicContact CD1-CG2 4Å; Y407-V411 HydrophobicContact CD2-CG2 4.04Å; Y407-V411 HydrophobicContact CE1-CG2 3.64Å; Y407-V411 HydrophobicContact CE2-CG2 3.7Å; Y407-V411 HydrophobicContact CG-CG2 4.19Å; Y407-V411 VanDerWaalsContact CZ-CG2 3.48Å; Y407-V411 VanDerWaalsContact O-CG2 3.31Å; Y407-V411 WeakPolarHBondContact O-CG2 3.46Å; Y407-V411 PolarHBondContact O-N 3.01Å
408	W	66.7	Low	64.3	Low	91 Å²	91	70.5 Å²	70.5	35%	0.345	34%	0.34	S	S	.	.	H	α-helix	trans	-65.5	-32.6	-179.7	-68.6	118.4	0	0	0	111.3	V176 M180 V404 V411 K412	V176-W408 HydrophobicContact CB-CH2 3.99Å; V176-W408 HydrophobicContact CG1-CH2 3.35Å; V176-W408 HydrophobicContact CG1-CZ2 4.4Å; V176-W408 HydrophobicContact CG1-CZ3 3.69Å; M180-W408 HydrophobicContact CE-CE3 3.5Å; M180-W408 HydrophobicContact CE-CH2 4.24Å; M180-W408 HydrophobicContact CE-CZ3 3.25Å; M180-W408 HydrophobicContact SD-CE3 3.61Å; M180-W408 HydrophobicContact SD-CZ3 3.38Å; M180-W408 WeakPolarHBondContact SD-CZ3 3.39Å; V404-W408 VanDerWaalsContact CG1-CD1 3.49Å; V404-W408 PolarHBondContact O-N 3.37Å; W408-V411 HydrophobicContact CE3-CB 4.49Å; W408-K412 WeakPolarHBondContact O-CB 3.28Å; W408-K412 PolarHBondContact O-N 2.85Å
409	K	70.8	Confident	64.6	Low	134 Å²	134	71.1 Å²	71.1	58%	0.583	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-45	168.2	-75.4	170.5	-177.3	178.6	0	111.7	Q405 E406 Y407 K413	Q405-K409 WeakPolarHBondContact O-CB 3.34Å; Q405-K409 WeakPolarHBondContact O-CG 3.22Å; Q405-K409 PolarHBondContact O-N 3.14Å; E406-K409 CarbonylContact O-C 3.58Å; E406-K409 PolarHBondContact O-N 2.56Å; Y407-K409 VanDerWaalsContact C-N 3.25Å; Y407-K409 PolarHBondContact O-N 3.12Å; K409-K413 WeakPolarHBondContact O-CB 3.29Å; K409-K413 PolarHBondContact O-N 3.35Å
410	C	70.6	Confident	65.1	Low	28 Å²	28	74.8 Å²	74.8	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-65.8	-50.4	177.7	-72.4	0	0	0	0	111.2	I200 E406 Y407 K412 K413 E414	I200-C410 HydrophobicContact CG1-CB 4.46Å; I200-C410 HydrophobicContact CG2-CB 3.91Å; E406-C410 WeakPolarHBondContact O-CB 3.49Å; E406-C410 PolarHBondContact O-N 3.21Å; E406-C410 PolarHBondContact O-SG 3.14Å; Y407-C410 CarbonylContact O-C 3.54Å; Y407-C410 WeakPolarHBondContact O-CA 3.18Å; Y407-C410 WeakPolarHBondContact O-CB 3.49Å; Y407-C410 PolarHBondContact O-N 2.93Å; C410-K412 PolarHBondContact O-N 2.87Å; C410-K413 PolarHBondContact O-N 2.88Å; C410-E414 WeakPolarHBondContact O-CB 3.45Å; C410-E414 VanDerWaalsContact O-CG 3.26Å; C410-E414 WeakPolarHBondContact O-CG 3.31Å; C410-E414 PolarHBondContact O-N 2.72Å
411	V	71.4	Confident	66.1	Low	2 Å²	2	75.8 Å²	75.8	1%	0.012	36%	0.357	C	S	.	.	H	α-helix	trans	-58.6	-49.4	177.2	-178.6	0	0	0	0	109.6	M180 I200 Y407 W408 K413 E414 S415	M180-V411 HydrophobicContact CB-CG1 3.59Å; M180-V411 HydrophobicContact CG-CG1 4.06Å; M180-V411 HydrophobicContact SD-CB 4.16Å; M180-V411 HydrophobicContact SD-CG1 3.28Å; M180-V411 WeakPolarHBondContact SD-CG1 3.15Å; I200-V411 HydrophobicContact CD1-CG2 4.11Å; I200-V411 HydrophobicContact CG2-CG2 3.92Å; Y407-V411 HydrophobicContact CD1-CG2 4Å; Y407-V411 HydrophobicContact CD2-CG2 4.04Å; Y407-V411 HydrophobicContact CE1-CG2 3.64Å; Y407-V411 HydrophobicContact CE2-CG2 3.7Å; Y407-V411 HydrophobicContact CG-CG2 4.19Å; Y407-V411 VanDerWaalsContact CZ-CG2 3.48Å; Y407-V411 VanDerWaalsContact O-CG2 3.31Å; Y407-V411 WeakPolarHBondContact O-CG2 3.46Å; Y407-V411 PolarHBondContact O-N 3.01Å; W408-V411 HydrophobicContact CE3-CB 4.49Å; V411-K413 VanDerWaalsContact C-N 3.34Å; V411-K413 PolarHBondContact O-N 2.9Å; V411-E414 PolarHBondContact O-N 3.18Å; V411-S415 VanDerWaalsContact O-CB 3.31Å; V411-S415 WeakPolarHBondContact O-CB 3.3Å; V411-S415 PolarHBondContact O-N 3.08Å; V411-S415 PolarHBondContact O-OG 2.89Å
412	K	73.5	Confident	66.9	Low	141 Å²	141	69 Å²	69	61%	0.613	33%	0.332	S	S	*	.	H	α-helix	trans	-59	-44	176.5	-173.3	177	-176.4	176.8	0	111.7	W408 C410 S415 I416	W408-K412 WeakPolarHBondContact O-CB 3.28Å; W408-K412 PolarHBondContact O-N 2.85Å; C410-K412 PolarHBondContact O-N 2.87Å; K412-S415 PolarHBondContact O-N 2.67Å; K412-I416 HydrophobicContact CG-CD1 3.92Å; K412-I416 WeakPolarHBondContact O-CB 3.32Å; K412-I416 WeakPolarHBondContact O-CD1 3.23Å; K412-I416 WeakPolarHBondContact O-CG1 3.42Å; K412-I416 PolarHBondContact O-N 3.4Å
413	K	74	Confident	67.8	Low	106 Å²	106	69.9 Å²	69.9	46%	0.461	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-45	177.7	-177.8	174.1	178.8	171.7	0	112	K409 C410 V411 K417	K409-K413 WeakPolarHBondContact O-CB 3.29Å; K409-K413 PolarHBondContact O-N 3.35Å; C410-K413 PolarHBondContact O-N 2.88Å; V411-K413 VanDerWaalsContact C-N 3.34Å; V411-K413 PolarHBondContact O-N 2.9Å; K413-K417 WeakPolarHBondContact O-CB 2.79Å; K413-K417 PolarHBondContact O-N 2.97Å
414	E	70	Confident	68.8	Low	29 Å²	29	78.8 Å²	78.8	14%	0.136	36%	0.36	C	S	.	.	H	α-helix	trans	-71.4	-33.7	178.2	-65.2	-66.8	162.2	0	0	111.8	I200 K203 C410 V411 K417 G418	I200-E414 HydrophobicContact CD1-CB 4.03Å; I200-E414 HydrophobicContact CD1-CG 3.9Å; I200-E414 HydrophobicContact CG1-CG 4.03Å; K203-E414 IonicContact NZ-OE1 3.76Å; C410-E414 WeakPolarHBondContact O-CB 3.45Å; C410-E414 VanDerWaalsContact O-CG 3.26Å; C410-E414 WeakPolarHBondContact O-CG 3.31Å; C410-E414 PolarHBondContact O-N 2.72Å; V411-E414 PolarHBondContact O-N 3.18Å; E414-K417 WeakPolarHBondContact O-CB 3.44Å; E414-K417 PolarHBondContact O-N 3.38Å; E414-G418 PolarHBondContact O-N 3.09Å
415	S	73.8	Confident	69.4	Low	22 Å²	22	82.9 Å²	82.9	15%	0.154	38%	0.376	C	S	.	.	H	α-helix	trans	-65.1	-47.4	173.3	-50.9	0	0	0	0	110.1	M180 V411 K412 K417 G418 V419	M180-S415 PolarHBondContact O-OG 3.38Å; M180-S415 VanDerWaalsContact O-OG 3.07Å; V411-S415 VanDerWaalsContact O-CB 3.31Å; V411-S415 WeakPolarHBondContact O-CB 3.3Å; V411-S415 PolarHBondContact O-N 3.08Å; V411-S415 PolarHBondContact O-OG 2.89Å; K412-S415 PolarHBondContact O-N 2.67Å; S415-K417 VanDerWaalsContact C-N 3.27Å; S415-K417 PolarHBondContact O-N 2.92Å; S415-G418 PolarHBondContact O-N 3.28Å; S415-V419 VanDerWaalsContact O-CG2 3.24Å; S415-V419 WeakPolarHBondContact O-CG2 3.41Å; S415-V419 PolarHBondContact O-N 3.06Å
416	I	74.9	Confident	69.7	Low	80 Å²	80	83.4 Å²	83.4	41%	0.41	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-36.9	173.9	-68.2	165.8	0	0	0	110.9	K412 K420	K412-I416 HydrophobicContact CG-CD1 3.92Å; K412-I416 WeakPolarHBondContact O-CB 3.32Å; K412-I416 WeakPolarHBondContact O-CD1 3.23Å; K412-I416 WeakPolarHBondContact O-CG1 3.42Å; K412-I416 PolarHBondContact O-N 3.4Å; I416-K420 HydrophobicContact CG2-CD 4.31Å; I416-K420 WeakPolarHBondContact O-CB 3.41Å; I416-K420 VanDerWaalsContact O-CG 3.32Å; I416-K420 WeakPolarHBondContact O-CG 3.29Å; I416-K420 PolarHBondContact O-N 3.43Å
417	K	72.1	Confident	69.9	Low	60 Å²	60	83.7 Å²	83.7	26%	0.261	39%	0.394	S	S	.	.	H	α-helix	trans	-64.2	-48	174.3	-166.7	-173.1	-175.2	-171.8	0	110.8	D219 K413 E414 S415 V419 K420 E421	D219-K417 IonicContact OD1-NZ 3.22Å; D219-K417 PolarHBondContact OD1-NZ 3.45Å; K413-K417 WeakPolarHBondContact O-CB 2.79Å; K413-K417 PolarHBondContact O-N 2.97Å; E414-K417 WeakPolarHBondContact O-CB 3.44Å; E414-K417 PolarHBondContact O-N 3.38Å; S415-K417 VanDerWaalsContact C-N 3.27Å; S415-K417 PolarHBondContact O-N 2.92Å; K417-V419 PolarHBondContact O-N 2.95Å; K417-K420 PolarHBondContact O-N 3.35Å; K417-K420 VanDerWaalsContact O-N 3.14Å; K417-E421 WeakPolarHBondContact CE-OE1 3.35Å; K417-E421 IonicContact NZ-OE1 2.84Å; K417-E421 WeakPolarHBondContact O-CG 3.43Å; K417-E421 PolarHBondContact O-N 3.22Å
418	G	70.8	Confident	69.6	Low	7 Å²	7	85.3 Å²	85.3	7%	0.072	42%	0.421	C	S	.	.	H	α-helix	trans	-58.4	-44.7	177	0	0	0	0	0	112.4	E414 S415 E421 A422	E414-G418 PolarHBondContact O-N 3.09Å; S415-G418 PolarHBondContact O-N 3.28Å; G418-E421 PolarHBondContact O-N 3.08Å; G418-A422 WeakPolarHBondContact O-CB 3.35Å; G418-A422 PolarHBondContact O-N 3.33Å
419	V	72.7	Confident	68.8	Low	50 Å²	50	89.4 Å²	89.4	30%	0.303	44%	0.441	S	S	.	.	H	α-helix	trans	-57.3	-54	171.1	175.1	0	0	0	0	109.8	V183 S415 K417 E421 A422 W423	V183-V419 HydrophobicContact CG1-CB 4.46Å; V183-V419 HydrophobicContact CG1-CG2 3.54Å; V183-V419 HydrophobicContact CG2-CG2 4.16Å; S415-V419 VanDerWaalsContact O-CG2 3.24Å; S415-V419 WeakPolarHBondContact O-CG2 3.41Å; S415-V419 PolarHBondContact O-N 3.06Å; K417-V419 PolarHBondContact O-N 2.95Å; V419-E421 VanDerWaalsContact C-N 3.26Å; V419-E421 PolarHBondContact O-N 2.94Å; V419-A422 PolarHBondContact O-N 3.18Å; V419-A422 VanDerWaalsContact O-N 3.13Å; V419-W423 HydrophobicContact CG1-CG 4.44Å; V419-W423 VanDerWaalsContact CG1-NE1 3.26Å; V419-W423 PolarHBondContact O-N 3.38Å
420	K	72.8	Confident	67.5	Low	136 Å²	136	85 Å²	85	59%	0.591	43%	0.434	S	S	*	.	H	α-helix	trans	-57.4	-37.2	179	-76.1	178.4	178.7	-174.3	0	113.4	I416 K417 R424	I416-K420 HydrophobicContact CG2-CD 4.31Å; I416-K420 WeakPolarHBondContact O-CB 3.41Å; I416-K420 VanDerWaalsContact O-CG 3.32Å; I416-K420 WeakPolarHBondContact O-CG 3.29Å; I416-K420 PolarHBondContact O-N 3.43Å; K417-K420 PolarHBondContact O-N 3.35Å; K417-K420 VanDerWaalsContact O-N 3.14Å; K420-R424 WeakPolarHBondContact O-CB 3.36Å; K420-R424 VanDerWaalsContact O-CG 3.32Å; K420-R424 WeakPolarHBondContact O-CG 3.28Å; K420-R424 PolarHBondContact O-N 3.16Å
421	E	76.2	Confident	66.7	Low	58 Å²	58	89.9 Å²	89.9	27%	0.271	47%	0.465	S	S	.	.	H	α-helix	trans	-68.6	-44.2	176.2	-73.3	174	-167.6	0	0	111.9	R196 K417 G418 V419 W423 R424 Q425	R196-E421 IonicContact CZ-OE2 3.4Å; R196-E421 IonicContact NH2-OE2 2.87Å; R196-E421 PolarHBondContact NH2-OE2 3.07Å; K417-E421 WeakPolarHBondContact CE-OE1 3.35Å; K417-E421 IonicContact NZ-OE1 2.84Å; K417-E421 WeakPolarHBondContact O-CG 3.43Å; K417-E421 PolarHBondContact O-N 3.22Å; G418-E421 PolarHBondContact O-N 3.08Å; V419-E421 VanDerWaalsContact C-N 3.26Å; V419-E421 PolarHBondContact O-N 2.94Å; E421-W423 VanDerWaalsContact C-N 3.35Å; E421-W423 PolarHBondContact O-N 2.82Å; E421-R424 PolarHBondContact O-N 2.93Å; E421-Q425 WeakPolarHBondContact O-CG 3.47Å; E421-Q425 PolarHBondContact O-N 2.79Å
422	A	68	Low	65.4	Low	39 Å²	39	102.6 Å²	102.6	32%	0.322	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.3	0	0	0	0	0	111.6	G418 V419 R424 Q425 Q426	G418-A422 WeakPolarHBondContact O-CB 3.35Å; G418-A422 PolarHBondContact O-N 3.33Å; V419-A422 PolarHBondContact O-N 3.18Å; V419-A422 VanDerWaalsContact O-N 3.13Å; A422-R424 PolarHBondContact O-N 2.8Å; A422-Q425 PolarHBondContact O-N 3.4Å; A422-Q426 PolarHBondContact O-N 2.76Å
423	W	67.6	Low	65	Low	178 Å²	178	100.7 Å²	100.7	67%	0.674	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-38.2	176.6	-74.1	55.3	0	0	0	111.9	V419 E421 Q426 A427	V419-W423 HydrophobicContact CG1-CG 4.44Å; V419-W423 VanDerWaalsContact CG1-NE1 3.26Å; V419-W423 PolarHBondContact O-N 3.38Å; E421-W423 VanDerWaalsContact C-N 3.35Å; E421-W423 PolarHBondContact O-N 2.82Å; W423-Q426 PolarHBondContact O-N 3.35Å; W423-A427 VanDerWaalsContact O-CB 3.25Å; W423-A427 WeakPolarHBondContact O-CB 3.44Å; W423-A427 PolarHBondContact O-N 3.3Å
424	R	72.3	Confident	64.5	Low	200 Å²	200	100.4 Å²	100.4	76%	0.755	52%	0.519	S	S	*	.	H	α-helix	trans	-65.2	-38.3	172.7	-79	175.9	-179.9	-98.2	0.9	112.4	K420 E421 A422 G428	K420-R424 WeakPolarHBondContact O-CB 3.36Å; K420-R424 VanDerWaalsContact O-CG 3.32Å; K420-R424 WeakPolarHBondContact O-CG 3.28Å; K420-R424 PolarHBondContact O-N 3.16Å; E421-R424 PolarHBondContact O-N 2.93Å; A422-R424 PolarHBondContact O-N 2.8Å; R424-G428 PolarHBondContact O-N 3.19Å
425	Q	65.4	Low	64.2	Low	138 Å²	138	104.3 Å²	104.3	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-70.3	-34.5	177.3	-71.5	177.1	27.6	0	0	112.6	E421 A422 K429	E421-Q425 WeakPolarHBondContact O-CG 3.47Å; E421-Q425 PolarHBondContact O-N 2.79Å; A422-Q425 PolarHBondContact O-N 3.4Å; Q425-K429 PolarHBondContact O-N 3.13Å
426	Q	59.5	Low	63.7	Low	143 Å²	143	109.2 Å²	109.2	67%	0.668	56%	0.563	S	S	*	*	H	α-helix	trans	-71.9	-44.1	171.8	-85.3	176	-34.3	0	0	112.1	A422 W423 G428 K429	A422-Q426 PolarHBondContact O-N 2.76Å; W423-Q426 PolarHBondContact O-N 3.35Å; Q426-G428 VanDerWaalsContact C-N 3.29Å; Q426-G428 PolarHBondContact O-N 3.39Å; Q426-K429 CarbonylContact O-C 3.55Å; Q426-K429 PolarHBondContact O-N 2.82Å; Q426-K429 VanDerWaalsContact O-N 3.08Å
427	A	64.4	Low	63	Low	82 Å²	82	111 Å²	111	68%	0.678	57%	0.573	S	S	*	*	H	α-helix	trans	-65.7	-30.9	177.5	0	0	0	0	0	112.9	W423 K429	W423-A427 VanDerWaalsContact O-CB 3.25Å; W423-A427 WeakPolarHBondContact O-CB 3.44Å; W423-A427 PolarHBondContact O-N 3.3Å; A427-K429 VanDerWaalsContact C-N 3.26Å; A427-K429 PolarHBondContact O-N 3.06Å
428	G	55.3	Low	62.4	Low	67 Å²	67	114.4 Å²	114.4	69%	0.691	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-12.2	173.3	0	0	0	0	0	114.4	R424 Q426	R424-G428 PolarHBondContact O-N 3.19Å; Q426-G428 VanDerWaalsContact C-N 3.29Å; Q426-G428 PolarHBondContact O-N 3.39Å
429	K	49.9	Very low	61.8	Low	177 Å²	177	122.1 Å²	122.1	77%	0.77	63%	0.631	S	S	*	*	S	Bend	trans	-104.1	57.9	169.5	-68.6	-178	179.2	-177.9	0	109.1	Q425 Q426 A427	Q425-K429 PolarHBondContact O-N 3.13Å; Q426-K429 CarbonylContact O-C 3.55Å; Q426-K429 PolarHBondContact O-N 2.82Å; Q426-K429 VanDerWaalsContact O-N 3.08Å; A427-K429 VanDerWaalsContact C-N 3.26Å; A427-K429 PolarHBondContact O-N 3.06Å
430	G	42.3	Very low	60.9	Low	43 Å²	43	127.6 Å²	127.6	44%	0.443	66%	0.656	S	S	.	*			trans	-64.1	148.3	167.8	0	0	0	0	0	110.3	F432	G430-F432 PolarHBondContact O-N 2.78Å
431	P	54.2	Low	59.9	Low	129 Å²	129	126.9 Å²	126.9	84%	0.838	66%	0.661	S	S	*	*			trans	-82.7	41.5	-175	35.5	-35.4	0	0	0	112.9
432	F	44.4	Very low	58.4	Low	269 Å²	269	133.2 Å²	133.2	100%	1.18	70%	0.697	S	S	*	*			trans	-110.8	0	175.1	-66.3	-70.6	0	0	0	111.2	G430	G430-F432 PolarHBondContact O-N 2.78Å

Retrieved 432 of 432 residues in 1142.7 ms (Link to these results)

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