A0A087Y0V5_POEFO Loading...

AarF domain containing kinase 2

AlphaFold DB , UniProt , Accession A0A087Y0V5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 585 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	Very low	32.1	Very low	244 Å²	244	133.4 Å²	133.4	100%	1.202	74%	0.744	S	S	*	*				0	68.8	0	-80.2	-173.7	160.6	0	0	111.4
2	L	30	Very low	32.1	Very low	179 Å²	179	131.7 Å²	131.7	94%	0.937	73%	0.732	S	S	*	*			trans	-116.2	26.4	172.6	-83.8	167.5	0	0	0	111.7
3	A	27.9	Very low	32.3	Very low	78 Å²	78	130.2 Å²	130.2	65%	0.645	72%	0.721	S	S	*	*			trans	-99.7	-11.6	-173.9	0	0	0	0	0	114.9
4	F	28.8	Very low	32.4	Very low	206 Å²	206	136.6 Å²	136.6	90%	0.904	73%	0.729	S	S	*	*	S	Bend	trans	-92.4	-11.6	-171.8	-93.9	-85.7	0	0	0	115.7
5	G	30.7	Very low	32.4	Very low	59 Å²	59	132.3 Å²	132.3	61%	0.608	71%	0.714	S	S	*	*	S	Bend	trans	-87.4	-20.9	179.5	0	0	0	0	0	115.4
6	A	32.4	Very low	32.6	Very low	64 Å²	64	130.7 Å²	130.7	53%	0.529	71%	0.71	S	S	.	*	H	α-helix	trans	-81.3	-22.7	-169.2	0	0	0	0	0	114.2
7	R	32.8	Very low	32.7	Very low	220 Å²	220	131.7 Å²	131.7	83%	0.83	71%	0.714	S	S	*	*	H	α-helix	trans	-74.1	-28.9	180	-87.5	-176.4	171.1	-178.5	-2.3	113.7
8	G	29.4	Very low	32.7	Very low	51 Å²	51	134.2 Å²	134.2	53%	0.526	72%	0.72	S	S	.	*	H	α-helix	trans	-74.9	-26.5	179.6	0	0	0	0	0	114.3
9	L	34.8	Very low	32.7	Very low	123 Å²	123	139.6 Å²	139.6	64%	0.644	73%	0.729	S	S	*	*	H	α-helix	trans	-81.9	-28.1	-173.8	-118.7	128.1	0	0	0	113.5
10	L	37	Very low	32.7	Very low	138 Å²	138	137.8 Å²	137.8	72%	0.723	74%	0.735	S	S	*	*	H	α-helix	trans	-77.4	-20.3	-179.9	-81.5	162	0	0	0	113.7
11	V	38.2	Very low	32.6	Very low	105 Å²	105	134.4 Å²	134.4	64%	0.636	73%	0.734	S	S	*	*	H	α-helix	trans	-80.4	-35.7	-179.7	-179.8	0	0	0	0	111.7
12	N	31.8	Very low	32.4	Very low	113 Å²	113	128 Å²	128	60%	0.604	71%	0.712	S	S	*	*	H	α-helix	trans	-77.2	-21.4	-178.1	-82	-22.4	0	0	0	114.8	S15 T16	N12-S15 PolarHBondContact O-OG 3.21Å; N12-T16 PolarHBondContact O-OG1 3.14Å; N12-T16 VanDerWaalsContact O-OG1 3.04Å
13	L	35.4	Very low	32.3	Very low	113 Å²	113	129 Å²	129	59%	0.592	71%	0.709	S	S	*	*	H	α-helix	trans	-77.3	-22.4	176.7	-101.6	130.4	0	0	0	113.1
14	R	32.7	Very low	32.3	Very low	220 Å²	220	129.7 Å²	129.7	83%	0.83	71%	0.714	S	S	*	*	H	α-helix	trans	-78.9	-29.5	178.7	-119.3	179.9	-179.1	-176	-0	113.4
15	S	33	Very low	32.1	Very low	71 Å²	71	131.3 Å²	131.3	50%	0.497	72%	0.715	S	S	.	*	H	α-helix	trans	-79.5	-20.5	-178.6	57.2	0	0	0	0	114.1	N12	N12-S15 PolarHBondContact O-OG 3.21Å
16	T	35.4	Very low	31.8	Very low	107 Å²	107	134.6 Å²	134.6	66%	0.656	73%	0.727	S	S	*	*	H	α-helix	trans	-88.6	-19.9	-171.7	-43.5	0	0	0	0	112.7	N12	N12-T16 PolarHBondContact O-OG1 3.14Å; N12-T16 VanDerWaalsContact O-OG1 3.04Å
17	L	34.4	Very low	31.3	Very low	148 Å²	148	142.8 Å²	142.8	78%	0.775	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-4.5	-178.7	-84.4	157.3	0	0	0	114.8
18	Q	32.7	Very low	31	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-2.2	179.9	-88.4	-175.9	-29.3	0	0	115.2
19	R	33.2	Very low	30.7	Very low	236 Å²	236	144.5 Å²	144.5	89%	0.891	76%	0.762	S	S	*	*	S	Bend	trans	-108.8	-0.2	-174.4	-87	-174.4	-176.8	171.8	2.1	116.8
20	A	32	Very low	30.3	Very low	103 Å²	103	146 Å²	146	85%	0.851	77%	0.766	S	S	*	*			trans	-108.6	70.6	-177.6	0	0	0	0	0	111.8
21	G	30	Very low	29.7	Very low	68 Å²	68	147.1 Å²	147.1	70%	0.701	77%	0.772	S	S	*	*			trans	-161	88.7	171.2	0	0	0	0	0	111.4
22	C	26.6	Very low	29.1	Very low	110 Å²	110	148.3 Å²	148.3	74%	0.743	77%	0.771	S	S	*	*			trans	179.8	126.7	156	-103	0	0	0	0	113.4
23	F	28.4	Very low	28.8	Very low	200 Å²	200	152.5 Å²	152.5	88%	0.877	78%	0.778	S	S	*	*			trans	66.6	145.9	148	-74.4	-80.8	0	0	0	120.4
24	A	28.4	Very low	28.4	Very low	92 Å²	92	153.5 Å²	153.5	76%	0.76	79%	0.789	S	S	*	*			cis	-159.8	162.7	7.3	0	0	0	0	0	112.6
25	R	25.3	Very low	28	Very low	240 Å²	240	148 Å²	148	91%	0.906	78%	0.783	S	S	*	*			trans	-76.9	151.5	167.4	-73.6	170.1	167.4	170.5	-4	112.1
26	C	23.9	Very low	27.6	Very low	128 Å²	128	151.5 Å²	151.5	87%	0.865	80%	0.796	S	S	*	*				174.3	138.2	117.8	-99.2	0	0	0	0	117.5
27	R	22.4	Very low	27.3	Very low	235 Å²	235	153.6 Å²	153.6	89%	0.887	80%	0.801	S	S	*	*			trans	-6.3	136.3	160.9	-74.2	175	177.1	-176.7	-1.4	125.5
28	L	25.3	Very low	27	Very low	156 Å²	156	156.6 Å²	156.6	82%	0.817	81%	0.808	S	S	*	*			trans	-3.1	133.3	131.6	-85.8	133.6	0	0	0	121
29	V	24	Very low	26.8	Very low	151 Å²	151	160.4 Å²	160.4	92%	0.915	82%	0.815	S	S	*	*			trans	-141.4	147.1	135.2	175.7	0	0	0	0	109.7
30	Q	26.2	Very low	26.4	Very low	156 Å²	156	152.2 Å²	152.2	73%	0.729	80%	0.804	S	S	*	*			trans	-109.9	135.2	-163.2	-176	179.5	8.8	0	0	109.4
31	N	23.4	Very low	26.3	Very low	161 Å²	161	156.4 Å²	156.4	86%	0.861	81%	0.806	S	S	*	*			trans	-160.6	143	139.6	-123.9	-14.9	0	0	0	114.8
32	Q	25.7	Very low	26.1	Very low	129 Å²	129	160 Å²	160	60%	0.603	81%	0.807	S	S	*	*			trans	-70.7	166.3	-177.7	-69.3	-179.9	-8.9	0	0	111.9
33	R	25.9	Very low	26.1	Very low	201 Å²	201	162.9 Å²	162.9	76%	0.758	82%	0.815	S	S	*	*			cis	-174.1	163.9	20.4	-129.2	163.3	-163.9	-168.5	5.7	108.7
34	T	26.8	Very low	26	Very low	135 Å²	135	158.6 Å²	158.6	83%	0.828	81%	0.805	S	S	*	*			trans	78.3	135.3	161.3	59.6	0	0	0	0	118.9
35	C	24.6	Very low	25.9	Very low	103 Å²	103	162.3 Å²	162.3	70%	0.696	81%	0.806	S	S	*	*			cis	-169.2	136.2	-15.8	-155.3	0	0	0	0	107.8
36	L	25.7	Very low	26.1	Very low	146 Å²	146	158.5 Å²	158.5	76%	0.764	80%	0.802	S	S	*	*			trans	75.9	105.3	152.2	-68.9	157.7	0	0	0	122.7
37	I	27.8	Very low	26.5	Very low	150 Å²	150	158 Å²	158	77%	0.769	80%	0.797	S	S	*	*			trans	82.7	80.9	136.7	-47.3	177.8	0	0	0	119.1
38	K	30	Very low	26.8	Very low	212 Å²	212	156.1 Å²	156.1	92%	0.922	80%	0.795	S	S	*	*			trans	24.7	111.2	140	-76.1	-178.7	174.1	178.1	0	119.6
39	R	26.6	Very low	27.1	Very low	256 Å²	256	155.6 Å²	155.6	97%	0.966	80%	0.798	S	S	*	*			trans	-138.3	144.8	156.4	-129.3	-175.6	-175.7	-168.4	1.8	110.6
40	G	26.6	Very low	27.4	Very low	64 Å²	64	154.4 Å²	154.4	66%	0.66	79%	0.792	S	S	*	*			trans	98.4	115.8	161.6	0	0	0	0	0	115.3
41	Q	28.2	Very low	27.6	Very low	192 Å²	192	154.3 Å²	154.3	90%	0.897	80%	0.795	S	S	*	*				57.9	124.9	87.1	-70	-178.4	-25.7	0	0	110.9
42	I	26.3	Very low	27.9	Very low	143 Å²	143	158.9 Å²	158.9	73%	0.733	80%	0.801	S	S	*	*			cis	-163.2	129.1	49.4	-65.1	168.5	0	0	0	107.2
43	L	26.2	Very low	27.9	Very low	171 Å²	171	158.1 Å²	158.1	90%	0.895	81%	0.808	S	S	*	*				-173.3	110.1	122.5	-123.3	98.7	0	0	0	109.5
44	T	27.2	Very low	28	Very low	110 Å²	110	160.8 Å²	160.8	68%	0.675	82%	0.818	S	S	*	*			trans	-85.6	160	176.5	40.4	0	0	0	0	111
45	H	26.6	Very low	28.1	Very low	170 Å²	170	158 Å²	158	79%	0.787	82%	0.817	S	S	*	*			trans	92.1	74.6	164.4	-61.3	-73.3	0	0	0	119.4
46	I	29.3	Very low	28.2	Very low	160 Å²	160	157.8 Å²	157.8	82%	0.821	82%	0.822	S	S	*	*			trans	-141.7	113.8	136.3	-56.4	179.9	0	0	0	107.2
47	P	31	Very low	28.4	Very low	116 Å²	116	157.6 Å²	157.6	75%	0.753	83%	0.827	S	S	*	*			trans	-87.4	125.7	174.9	31.3	-25.7	0	0	0	110.8
48	K	29.5	Very low	28.5	Very low	196 Å²	196	155.9 Å²	155.9	85%	0.852	83%	0.828	S	S	*	*			trans	-70.6	125.4	172.3	-66.4	169.1	177.1	174.2	0	109.3
49	V	31.3	Very low	28.5	Very low	145 Å²	145	150.6 Å²	150.6	88%	0.879	82%	0.824	S	S	*	*			trans	-98.3	104.8	168.7	-179	0	0	0	0	108.4
50	T	30.9	Very low	28.5	Very low	127 Å²	127	144.1 Å²	144.1	78%	0.779	82%	0.818	S	S	*	*			trans	-130.5	121.1	159.2	38.4	0	0	0	0	107.8
51	L	30.1	Very low	28.5	Very low	154 Å²	154	146.3 Å²	146.3	81%	0.806	82%	0.824	S	S	*	*			trans	26.9	122.5	142.2	-120.2	79.4	0	0	0	116.8
52	W	28.7	Very low	28.4	Very low	257 Å²	257	147 Å²	147	97%	0.973	82%	0.824	S	S	*	*				-165.6	143.6	126.8	-101.2	37.6	0	0	0	108.5
53	C	27.1	Very low	28.6	Very low	112 Å²	112	144.9 Å²	144.9	76%	0.757	83%	0.828	S	S	*	*			trans	-84.4	157.6	-168.1	-59.3	0	0	0	0	113.3
54	W	28.3	Very low	28.6	Very low	257 Å²	257	141 Å²	141	97%	0.973	82%	0.82	S	S	*	*			trans	-163.1	136.7	138.2	-89.8	-7.7	0	0	0	108.1
55	G	27.7	Very low	28.9	Very low	77 Å²	77	145.9 Å²	145.9	79%	0.794	83%	0.832	S	S	*	*			cis	85	54.3	12.4	0	0	0	0	0	112.6
56	A	28.1	Very low	28.9	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	84%	0.835	S	S	*	*			trans	-116.9	101.9	171.6	0	0	0	0	0	109.8
57	V	28.9	Very low	28.9	Very low	142 Å²	142	145 Å²	145	86%	0.861	84%	0.837	S	S	*	*			trans	-124.3	124.4	147.4	173.5	0	0	0	0	105.9
58	S	30.2	Very low	29	Very low	114 Å²	114	148.9 Å²	148.9	80%	0.797	85%	0.846	S	S	*	*			trans	-49.8	130.7	177.9	50	0	0	0	0	113.9
59	A	29.3	Very low	29	Very low	102 Å²	102	143.5 Å²	143.5	84%	0.843	84%	0.837	S	S	*	*			trans	-136.7	115.3	150.7	0	0	0	0	0	107.9
60	S	27.9	Very low	29.3	Very low	119 Å²	119	144 Å²	144	83%	0.832	84%	0.841	S	S	*	*			trans	-61.9	149.4	179.4	42.4	0	0	0	0	112.8
61	S	26.1	Very low	29.4	Very low	111 Å²	111	145.1 Å²	145.1	78%	0.776	84%	0.841	S	S	*	*			trans	-52.7	132.8	175.3	53.5	0	0	0	0	115
62	F	25.8	Very low	29.6	Very low	205 Å²	205	143 Å²	143	90%	0.899	84%	0.839	S	S	*	*			trans	-141.9	115.3	136.6	-141.3	-95.3	0	0	0	108.8
63	A	29.7	Very low	30.3	Very low	99 Å²	99	135.5 Å²	135.5	82%	0.818	82%	0.824	S	S	*	*			trans	-79.8	120.4	174.6	0	0	0	0	0	108.9
64	A	27.3	Very low	31	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	82%	0.824	S	S	*	*			trans	-126.4	114.1	161.9	0	0	0	0	0	108.3	C66	A64-C66 PolarHBondContact O-N 3.44Å
65	K	32.1	Very low	31.8	Very low	213 Å²	213	129.8 Å²	129.8	93%	0.926	81%	0.807	S	S	*	*			trans	-59.7	123.1	166.9	-82.7	173.1	171.4	174.8	0	108.6
66	C	27.1	Very low	32.4	Very low	124 Å²	124	130.2 Å²	130.2	84%	0.838	80%	0.803	S	S	*	*			trans	-137.7	136.1	157.1	-87.4	0	0	0	0	109.9	A64	A64-C66 PolarHBondContact O-N 3.44Å
67	Q	29.7	Very low	33.5	Very low	187 Å²	187	131 Å²	131	87%	0.874	79%	0.794	S	S	*	*			trans	-50.3	149.8	-171.4	-82.4	142.9	-68.8	0	0	115.6	A69	Q67-A69 PolarHBondContact O-N 3.14Å
68	E	33.1	Very low	34.5	Very low	198 Å²	198	133.9 Å²	133.9	93%	0.925	79%	0.789	S	S	*	*			trans	-50	104.8	161	-77.1	171.6	139.3	0	0	110.7
69	A	29.8	Very low	35.6	Very low	82 Å²	82	136 Å²	136	68%	0.678	78%	0.784	S	S	*	*			trans	-101.8	111.2	154.5	0	0	0	0	0	107.3	Q67 L71	Q67-A69 PolarHBondContact O-N 3.14Å; A69-L71 PolarHBondContact O-N 3.14Å
70	T	37.4	Very low	37	Very low	155 Å²	155	134.3 Å²	134.3	95%	0.951	77%	0.766	S	S	*	*			trans	-60.4	92.2	172.2	5.7	0	0	0	0	109.8
71	L	33.2	Very low	38.5	Very low	151 Å²	151	133.9 Å²	133.9	79%	0.791	75%	0.753	S	S	*	*			trans	-113.1	115.7	166.1	-92	156.1	0	0	0	108.8	A69 P73	A69-L71 PolarHBondContact O-N 3.14Å; L71-P73 VanDerWaalsContact O-CD 3.26Å; L71-P73 WeakPolarHBondContact O-CD 3.46Å
72	S	35.2	Very low	40.4	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	74%	0.736	S	S	*	*			trans	-53.8	119.9	177.5	173.3	0	0	0	0	112.5
73	P	42.5	Very low	42.3	Very low	99 Å²	99	128 Å²	128	64%	0.643	72%	0.723	S	S	*	*			trans	-112.3	82.8	172.5	34.9	-19.5	0	0	0	109.6	L71	L71-P73 VanDerWaalsContact O-CD 3.26Å; L71-P73 WeakPolarHBondContact O-CD 3.46Å
74	K	42.2	Very low	44.2	Very low	176 Å²	176	126.7 Å²	126.7	77%	0.765	71%	0.705	S	S	*	*	S	Bend	trans	-133	-1.4	179	-78.2	-169.4	177.7	172.9	0	118.3
75	A	44.6	Very low	46.7	Very low	74 Å²	74	128.4 Å²	128.4	61%	0.612	70%	0.697	S	S	*	*	S	Bend	trans	-116.9	-34.8	179.3	0	0	0	0	0	115.2
76	A	40.8	Very low	49.1	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	68%	0.677	S	S	*	*	H	α-helix	trans	-76.5	-38.9	-177.4	0	0	0	0	0	112.9	K79 S80	A76-K79 PolarHBondContact O-N 3.16Å; A76-S80 PolarHBondContact O-N 3.32Å
77	D	50.8	Low	51.8	Low	115 Å²	115	122.6 Å²	122.6	62%	0.615	67%	0.666	S	S	*	*	H	α-helix	trans	-71.2	-36.5	-176.4	-104.4	-22	0	0	0	114.1	K79 S80 L81	D77-K79 VanDerWaalsContact C-N 3.33Å; D77-K79 PolarHBondContact O-N 3.14Å; D77-S80 WeakPolarHBondContact O-CB 3.49Å; D77-S80 PolarHBondContact O-N 3.22Å; D77-L81 WeakPolarHBondContact O-CB 3.41Å; D77-L81 PolarHBondContact O-N 3.36Å
78	R	50.1	Low	54.5	Low	202 Å²	202	119.8 Å²	119.8	76%	0.762	65%	0.651	S	S	*	*	H	α-helix	trans	-64	-37.2	176.7	-91.1	-178.5	173.1	-177.4	-2.5	112.6	A82	R78-A82 WeakPolarHBondContact O-CB 3.14Å; R78-A82 PolarHBondContact O-N 3.43Å
79	K	52.4	Low	57.2	Low	157 Å²	157	115 Å²	115	68%	0.683	64%	0.635	S	S	*	*	H	α-helix	trans	-69.2	-35.2	176.4	-70.6	-176.5	-178.8	179.4	0	111.6	A76 D77 K83	A76-K79 PolarHBondContact O-N 3.16Å; D77-K79 VanDerWaalsContact C-N 3.33Å; D77-K79 PolarHBondContact O-N 3.14Å; K79-K83 WeakPolarHBondContact O-CB 3.18Å; K79-K83 VanDerWaalsContact O-CG 3.32Å; K79-K83 WeakPolarHBondContact O-CG 3.45Å; K79-K83 PolarHBondContact O-N 2.68Å; K79-K83 VanDerWaalsContact O-N 3.16Å
80	S	59.4	Low	60	Low	67 Å²	67	114.6 Å²	114.6	47%	0.469	62%	0.621	S	S	.	*	H	α-helix	trans	-67.4	-46.3	174.5	-170.5	0	0	0	0	111.5	A76 D77 A82 K83 V84	A76-S80 PolarHBondContact O-N 3.32Å; D77-S80 WeakPolarHBondContact O-CB 3.49Å; D77-S80 PolarHBondContact O-N 3.22Å; S80-A82 PolarHBondContact O-N 2.83Å; S80-K83 PolarHBondContact O-N 3.43Å; S80-V84 WeakPolarHBondContact O-CG2 3.29Å; S80-V84 PolarHBondContact O-N 3.08Å
81	L	59.4	Low	62.5	Low	110 Å²	110	111.1 Å²	111.1	58%	0.576	59%	0.593	S	S	*	*	H	α-helix	trans	-63.9	-43.4	179.2	-156.9	82.2	0	0	0	112.6	D77 V84 Q85	D77-L81 WeakPolarHBondContact O-CB 3.41Å; D77-L81 PolarHBondContact O-N 3.36Å; L81-V84 PolarHBondContact O-N 3.47Å; L81-Q85 WeakPolarHBondContact O-CG 3.27Å; L81-Q85 PolarHBondContact O-N 3.29Å
82	A	65.1	Low	65.3	Low	49 Å²	49	109.9 Å²	109.9	41%	0.405	58%	0.581	S	S	.	*	H	α-helix	trans	-64.2	-41.2	176.5	0	0	0	0	0	111.9	R78 S80 V84 Q85 V86	R78-A82 WeakPolarHBondContact O-CB 3.14Å; R78-A82 PolarHBondContact O-N 3.43Å; S80-A82 PolarHBondContact O-N 2.83Å; A82-V84 VanDerWaalsContact C-N 3.33Å; A82-V84 PolarHBondContact O-N 3.29Å; A82-Q85 PolarHBondContact O-N 3.1Å; A82-V86 WeakPolarHBondContact O-CG2 3.22Å; A82-V86 PolarHBondContact O-N 3.25Å
83	K	66	Low	68.1	Low	145 Å²	145	110.5 Å²	110.5	63%	0.63	58%	0.575	S	S	*	*	H	α-helix	trans	-60.7	-41.5	173.8	-80.1	178.7	179.9	-178.4	0	111.8	K79 S80 V86 H87	K79-K83 WeakPolarHBondContact O-CB 3.18Å; K79-K83 VanDerWaalsContact O-CG 3.32Å; K79-K83 WeakPolarHBondContact O-CG 3.45Å; K79-K83 PolarHBondContact O-N 2.68Å; K79-K83 VanDerWaalsContact O-N 3.16Å; S80-K83 PolarHBondContact O-N 3.43Å; K83-V86 PolarHBondContact O-N 3.08Å; K83-H87 PolarHBondContact O-N 3.21Å; K83-H87 PolarHBondContact O-ND1 3.27Å
84	V	70.3	Confident	70.4	Confident	71 Å²	71	112 Å²	112	43%	0.43	57%	0.568	S	S	.	*	H	α-helix	trans	-64.4	-41.2	177.7	174.6	0	0	0	0	111.1	S80 L81 A82 H87 K88	S80-V84 WeakPolarHBondContact O-CG2 3.29Å; S80-V84 PolarHBondContact O-N 3.08Å; L81-V84 PolarHBondContact O-N 3.47Å; A82-V84 VanDerWaalsContact C-N 3.33Å; A82-V84 PolarHBondContact O-N 3.29Å; V84-H87 PolarHBondContact O-N 2.86Å; V84-K88 WeakPolarHBondContact O-CG 3.31Å; V84-K88 PolarHBondContact O-N 3.17Å; V84-K88 VanDerWaalsContact O-N 3.13Å
85	Q	78.9	Confident	72.9	Confident	125 Å²	125	104.6 Å²	104.6	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-42.6	176.6	-72.9	-175.3	-12	0	0	112.3	L81 A82 H87 K88 V89	L81-Q85 WeakPolarHBondContact O-CG 3.27Å; L81-Q85 PolarHBondContact O-N 3.29Å; A82-Q85 PolarHBondContact O-N 3.1Å; Q85-H87 PolarHBondContact O-N 2.89Å; Q85-K88 PolarHBondContact O-N 3.3Å; Q85-V89 WeakPolarHBondContact O-CG2 3.27Å; Q85-V89 PolarHBondContact O-N 2.86Å
86	V	83	Confident	75.3	Confident	83 Å²	83	104.7 Å²	104.7	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-42.9	176.6	172.7	0	0	0	0	111.5	A82 K83 K88 V89 I90	A82-V86 WeakPolarHBondContact O-CG2 3.22Å; A82-V86 PolarHBondContact O-N 3.25Å; K83-V86 PolarHBondContact O-N 3.08Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.01Å; V86-V89 PolarHBondContact O-N 3.01Å; V86-I90 HydrophobicContact CG1-CD1 3.74Å; V86-I90 HydrophobicContact CG1-CG1 4.37Å; V86-I90 WeakPolarHBondContact O-CG1 3.39Å; V86-I90 PolarHBondContact O-N 3.1Å
87	H	83.9	Confident	77.9	Confident	133 Å²	133	105.7 Å²	105.7	62%	0.616	53%	0.526	S	S	*	.	H	α-helix	trans	-61.5	-39.9	176.4	-78.5	79	0	0	0	112.3	K83 V84 Q85 F91	K83-H87 PolarHBondContact O-N 3.21Å; K83-H87 PolarHBondContact O-ND1 3.27Å; V84-H87 PolarHBondContact O-N 2.86Å; Q85-H87 PolarHBondContact O-N 2.89Å; H87-F91 WeakPolarHBondContact O-CB 3.39Å; H87-F91 PolarHBondContact O-N 3.37Å
88	K	85.8	Confident	80.1	Confident	127 Å²	127	102.1 Å²	102.1	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-62.6	-47.4	175.3	-73	179	178.7	-176.1	0	111.4	V84 Q85 V86 I90 F91 F92	V84-K88 WeakPolarHBondContact O-CG 3.31Å; V84-K88 PolarHBondContact O-N 3.17Å; V84-K88 VanDerWaalsContact O-N 3.13Å; Q85-K88 PolarHBondContact O-N 3.3Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.01Å; K88-I90 PolarHBondContact O-N 3.3Å; K88-F91 WeakPolarHBondContact O-CB 3.46Å; K88-F91 PolarHBondContact O-N 3.17Å; K88-F92 WeakPolarHBondContact O-CD2 3.37Å; K88-F92 PolarHBondContact O-N 3.46Å
89	V	90.8	Very high	82.2	Confident	99 Å²	99	94.2 Å²	94.2	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-46.2	178.7	173.7	0	0	0	0	111.2	Q85 V86 F91 F92 L93	Q85-V89 WeakPolarHBondContact O-CG2 3.27Å; Q85-V89 PolarHBondContact O-N 2.86Å; V86-V89 PolarHBondContact O-N 3.01Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 2.85Å; V89-F92 PolarHBondContact O-N 3.28Å; V89-L93 WeakPolarHBondContact O-CB 3.3Å; V89-L93 PolarHBondContact O-N 3.03Å
90	I	89.5	Confident	84.4	Confident	73 Å²	73	91.4 Å²	91.4	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-61.3	-41.4	177	-67.5	169.2	0	0	0	111	V86 K88 L93 R94	V86-I90 HydrophobicContact CG1-CD1 3.74Å; V86-I90 HydrophobicContact CG1-CG1 4.37Å; V86-I90 WeakPolarHBondContact O-CG1 3.39Å; V86-I90 PolarHBondContact O-N 3.1Å; K88-I90 PolarHBondContact O-N 3.3Å; I90-L93 PolarHBondContact O-N 3.48Å; I90-R94 WeakPolarHBondContact O-CB 3.45Å; I90-R94 VanDerWaalsContact O-CG 3.31Å; I90-R94 WeakPolarHBondContact O-CG 3.01Å; I90-R94 PolarHBondContact O-N 2.88Å
91	F	89.3	Confident	86.1	Confident	81 Å²	81	91 Å²	91	36%	0.355	47%	0.468	S	S	.	.	H	α-helix	trans	-61.8	-50.4	177.1	177.2	-95.3	0	0	0	111.8	H87 K88 V89 L93 R94 L95 I284 L287	H87-F91 WeakPolarHBondContact O-CB 3.39Å; H87-F91 PolarHBondContact O-N 3.37Å; K88-F91 WeakPolarHBondContact O-CB 3.46Å; K88-F91 PolarHBondContact O-N 3.17Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 2.85Å; F91-L93 VanDerWaalsContact C-N 3.34Å; F91-L93 PolarHBondContact O-N 3.37Å; F91-R94 PolarHBondContact O-N 3.27Å; F91-L95 HydrophobicContact CE1-CD2 4.33Å; F91-L95 WeakPolarHBondContact O-CB 3.38Å; F91-L95 PolarHBondContact O-N 3.37Å; F91-I284 HydrophobicContact CE2-CG1 4.1Å; F91-L287 HydrophobicContact CZ-CD1 4.47Å
92	F	91.4	Very high	87.8	Confident	126 Å²	126	86.4 Å²	86.4	55%	0.553	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-40.6	177.8	-79.1	-67.8	0	0	0	112.3	K88 V89 R94 L95 S96	K88-F92 WeakPolarHBondContact O-CD2 3.37Å; K88-F92 PolarHBondContact O-N 3.46Å; V89-F92 PolarHBondContact O-N 3.28Å; F92-R94 PolarHBondContact O-N 2.88Å; F92-L95 HydrophobicContact CD1-CD2 4.47Å; F92-L95 PolarHBondContact O-N 3.26Å; F92-S96 WeakPolarHBondContact O-CB 3.27Å; F92-S96 PolarHBondContact O-N 3.49Å; F92-S96 PolarHBondContact O-OG 3.4Å; F92-S96 VanDerWaalsContact O-OG 3.09Å
93	L	93.4	Very high	89.2	Confident	122 Å²	122	89.6 Å²	89.6	64%	0.639	45%	0.453	S	S	*	.	H	α-helix	trans	-60.7	-45.4	175.8	-177.7	66.3	0	0	0	111.5	V89 I90 F91 S96 L97	V89-L93 WeakPolarHBondContact O-CB 3.3Å; V89-L93 PolarHBondContact O-N 3.03Å; I90-L93 PolarHBondContact O-N 3.48Å; F91-L93 VanDerWaalsContact C-N 3.34Å; F91-L93 PolarHBondContact O-N 3.37Å; L93-S96 PolarHBondContact O-N 3.41Å; L93-L97 VanDerWaalsContact O-CB 3.3Å; L93-L97 WeakPolarHBondContact O-CB 2.95Å; L93-L97 PolarHBondContact O-N 3.11Å
94	R	92.4	Very high	90.7	Very high	130 Å²	130	86.6 Å²	86.6	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-63.8	-42.6	176.6	-74.7	177.3	178.9	-179.8	1.6	112.1	I90 F91 F92 R98 I284	I90-R94 WeakPolarHBondContact O-CB 3.45Å; I90-R94 VanDerWaalsContact O-CG 3.31Å; I90-R94 WeakPolarHBondContact O-CG 3.01Å; I90-R94 PolarHBondContact O-N 2.88Å; F91-R94 PolarHBondContact O-N 3.27Å; F92-R94 PolarHBondContact O-N 2.88Å; R94-R98 WeakPolarHBondContact O-CB 3.44Å; R94-R98 PolarHBondContact O-N 2.99Å; R94-I284 HydrophobicContact CB-CD1 4.15Å
95	L	93.8	Very high	91.9	Very high	22 Å²	22	85.9 Å²	85.9	12%	0.115	44%	0.441	C	S	.	.	H	α-helix	trans	-60	-49.9	176.8	179	64.9	0	0	0	111	F91 F92 R98 A99 I284 L287 L288	F91-L95 HydrophobicContact CE1-CD2 4.33Å; F91-L95 WeakPolarHBondContact O-CB 3.38Å; F91-L95 PolarHBondContact O-N 3.37Å; F92-L95 HydrophobicContact CD1-CD2 4.47Å; F92-L95 PolarHBondContact O-N 3.26Å; L95-R98 PolarHBondContact O-N 2.97Å; L95-A99 WeakPolarHBondContact O-CB 3.41Å; L95-A99 PolarHBondContact O-N 3.03Å; L95-I284 HydrophobicContact CD1-CG2 3.78Å; L95-L287 HydrophobicContact CD1-CD2 3.66Å; L95-L287 HydrophobicContact CD2-CD2 3.69Å; L95-L287 HydrophobicContact CG-CD2 4.33Å; L95-L288 HydrophobicContact CD1-CD1 4.19Å; L95-L288 HydrophobicContact CD1-CD2 3.48Å; L95-L288 VanDerWaalsContact CD1-CD2 3.48Å; L95-L288 HydrophobicContact CD1-CG 3.62Å; L95-L288 HydrophobicContact CG-CD2 4.22Å
96	S	94.6	Very high	92.6	Very high	76 Å²	76	81.9 Å²	81.9	53%	0.531	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-43.7	179.1	-62.2	0	0	0	0	112.4	F92 L93 R98 A99 L100	F92-S96 WeakPolarHBondContact O-CB 3.27Å; F92-S96 PolarHBondContact O-N 3.49Å; F92-S96 PolarHBondContact O-OG 3.4Å; F92-S96 VanDerWaalsContact O-OG 3.09Å; L93-S96 PolarHBondContact O-N 3.41Å; S96-R98 VanDerWaalsContact C-N 3.32Å; S96-R98 PolarHBondContact O-N 3.39Å; S96-A99 PolarHBondContact O-N 3.47Å; S96-L100 WeakPolarHBondContact O-CB 3.37Å; S96-L100 PolarHBondContact O-N 2.88Å
97	L	96.3	Very high	93.1	Very high	107 Å²	107	78.6 Å²	78.6	56%	0.56	41%	0.405	S	S	*	.	H	α-helix	trans	-61.5	-43.4	175.5	-179.9	63.5	0	0	0	110.9	L93 L100 V101	L93-L97 VanDerWaalsContact O-CB 3.3Å; L93-L97 WeakPolarHBondContact O-CB 2.95Å; L93-L97 PolarHBondContact O-N 3.11Å; L97-L100 PolarHBondContact O-N 3.45Å; L97-V101 WeakPolarHBondContact O-CG2 3.34Å; L97-V101 PolarHBondContact O-N 3.17Å
98	R	95.8	Very high	93.7	Very high	40 Å²	40	75.3 Å²	75.3	15%	0.151	40%	0.395	C	S	.	.	H	α-helix	trans	-64	-43.8	177.9	-176.7	57.6	169.5	171.2	2.6	111.7	R94 L95 S96 L100 V101 L102 S137 I284 D285 L288	R94-R98 WeakPolarHBondContact O-CB 3.44Å; R94-R98 PolarHBondContact O-N 2.99Å; L95-R98 PolarHBondContact O-N 2.97Å; S96-R98 VanDerWaalsContact C-N 3.32Å; S96-R98 PolarHBondContact O-N 3.39Å; R98-L100 VanDerWaalsContact C-N 3.33Å; R98-L100 PolarHBondContact O-N 3.35Å; R98-V101 PolarHBondContact O-N 3.43Å; R98-L102 HydrophobicContact CG-CD1 4.18Å; R98-L102 WeakPolarHBondContact O-CG 3.32Å; R98-L102 PolarHBondContact O-N 3.19Å; R98-S137 PolarHBondContact NH1-O 2.93Å; R98-S137 PolarHBondContact NH2-O 3.46Å; R98-I284 HydrophobicContact CB-CG2 3.9Å; R98-I284 HydrophobicContact CG-CG2 3.74Å; R98-D285 IonicContact CZ-OD1 3.27Å; R98-D285 VanDerWaalsContact CZ-OD1 3.27Å; R98-D285 IonicContact CZ-OD2 3.83Å; R98-D285 IonicContact NE-OD1 2.73Å; R98-D285 PolarHBondContact NE-OD1 2.98Å; R98-D285 IonicContact NE-OD2 3.69Å; R98-D285 VanDerWaalsContact NH2-CG 3.26Å; R98-D285 IonicContact NH2-OD1 2.92Å; R98-D285 PolarHBondContact NH2-OD1 3.42Å; R98-D285 IonicContact NH2-OD2 3.03Å; R98-D285 PolarHBondContact NH2-OD2 2.86Å; R98-L288 HydrophobicContact CB-CD1 4.24Å; R98-L288 HydrophobicContact CG-CD1 3.86Å
99	A	95.8	Very high	94	Very high	36 Å²	36	70 Å²	70	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-44.8	174.4	0	0	0	0	0	111.6	L95 S96 L102 L103 L288	L95-A99 WeakPolarHBondContact O-CB 3.41Å; L95-A99 PolarHBondContact O-N 3.03Å; S96-A99 PolarHBondContact O-N 3.47Å; A99-L102 PolarHBondContact O-N 2.86Å; A99-L103 VanDerWaalsContact O-CB 3.26Å; A99-L103 WeakPolarHBondContact O-CB 3.33Å; A99-L103 PolarHBondContact O-N 2.78Å; A99-L288 HydrophobicContact CB-CD1 4.13Å; A99-L288 HydrophobicContact CB-CD2 3.76Å
100	L	96.7	Very high	94	Very high	98 Å²	98	71.2 Å²	71.2	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176.7	-179.5	63.7	0	0	0	111.7	S96 L97 R98 L102 L103 C104	S96-L100 WeakPolarHBondContact O-CB 3.37Å; S96-L100 PolarHBondContact O-N 2.88Å; L97-L100 PolarHBondContact O-N 3.45Å; R98-L100 VanDerWaalsContact C-N 3.33Å; R98-L100 PolarHBondContact O-N 3.35Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.31Å; L100-L103 PolarHBondContact O-N 3.4Å; L100-C104 WeakPolarHBondContact O-CB 3.46Å; L100-C104 PolarHBondContact O-N 3.26Å; L100-C104 PolarHBondContact O-SG 3.41Å
101	V	96.2	Very high	94.1	Very high	57 Å²	57	74.7 Å²	74.7	35%	0.345	39%	0.394	S	S	.	.	H	α-helix	trans	-58.5	-47	177.2	168.7	0	0	0	0	111.1	L97 R98 C104 K105	L97-V101 WeakPolarHBondContact O-CG2 3.34Å; L97-V101 PolarHBondContact O-N 3.17Å; R98-V101 PolarHBondContact O-N 3.43Å; V101-C104 PolarHBondContact O-N 3.26Å; V101-K105 WeakPolarHBondContact O-CG 3.35Å; V101-K105 PolarHBondContact O-N 2.93Å; V101-K105 VanDerWaalsContact O-N 3.07Å
102	L	95.9	Very high	94.2	Very high	15 Å²	15	75 Å²	75	8%	0.079	40%	0.399	C	S	.	.	H	α-helix	trans	-66	-40.1	178.8	-67.2	172.8	0	0	0	111.6	R98 A99 L100 K105 F106 F141 L288	R98-L102 HydrophobicContact CG-CD1 4.18Å; R98-L102 WeakPolarHBondContact O-CG 3.32Å; R98-L102 PolarHBondContact O-N 3.19Å; A99-L102 PolarHBondContact O-N 2.86Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.31Å; L102-K105 PolarHBondContact O-N 2.98Å; L102-F106 HydrophobicContact CD2-CD2 4.42Å; L102-F106 HydrophobicContact CD2-CE2 4.13Å; L102-F106 WeakPolarHBondContact O-CB 3.5Å; L102-F106 WeakPolarHBondContact O-CD2 3.32Å; L102-F106 PolarHBondContact O-N 3.19Å; L102-F141 HydrophobicContact CD1-CE2 3.73Å; L102-F141 HydrophobicContact CD1-CZ 3.66Å; L102-F141 HydrophobicContact CD2-CD2 4.1Å; L102-F141 HydrophobicContact CD2-CE2 3.43Å; L102-F141 VanDerWaalsContact CD2-CE2 3.43Å; L102-F141 HydrophobicContact CD2-CZ 3.67Å; L102-F141 HydrophobicContact CG-CE2 4.23Å; L102-F141 HydrophobicContact CG-CZ 4.27Å; L102-L288 HydrophobicContact CD1-CD1 3.87Å
103	L	94.5	Very high	94	Very high	115 Å²	115	74.3 Å²	74.3	60%	0.602	39%	0.393	S	S	*	.	H	α-helix	trans	-63.2	-41.9	175.6	-176.9	64.5	0	0	0	111.7	A99 L100 K105 G107	A99-L103 VanDerWaalsContact O-CB 3.26Å; A99-L103 WeakPolarHBondContact O-CB 3.33Å; A99-L103 PolarHBondContact O-N 2.78Å; L100-L103 PolarHBondContact O-N 3.4Å; L103-K105 VanDerWaalsContact C-N 3.28Å; L103-K105 PolarHBondContact O-N 3.13Å; L103-G107 WeakPolarHBondContact O-CA 3.5Å; L103-G107 PolarHBondContact O-N 3.24Å
104	C	96.2	Very high	94	Very high	82 Å²	82	72.1 Å²	72.1	55%	0.554	39%	0.386	S	S	*	.	H	α-helix	trans	-65.3	-31.3	175.6	-70.3	0	0	0	0	112.5	L100 V101 P108	L100-C104 WeakPolarHBondContact O-CB 3.46Å; L100-C104 PolarHBondContact O-N 3.26Å; L100-C104 PolarHBondContact O-SG 3.41Å; V101-C104 PolarHBondContact O-N 3.26Å; C104-P108 WeakPolarHBondContact O-CD 3.46Å; C104-P108 WeakPolarHBondContact O-CG 3.41Å
105	K	95.1	Very high	93.8	Very high	57 Å²	57	70.1 Å²	70.1	25%	0.248	39%	0.385	C	S	.	.	H	α-helix	trans	-79.6	-53.1	177.8	-73.9	-171	175.6	-153.4	0	113.1	V101 L102 L103 V133 T136	V101-K105 WeakPolarHBondContact O-CG 3.35Å; V101-K105 PolarHBondContact O-N 2.93Å; V101-K105 VanDerWaalsContact O-N 3.07Å; L102-K105 PolarHBondContact O-N 2.98Å; L103-K105 VanDerWaalsContact C-N 3.28Å; L103-K105 PolarHBondContact O-N 3.13Å; K105-V133 HydrophobicContact CB-CG1 3.87Å; K105-T136 VanDerWaalsContact NZ-C 3.27Å; K105-T136 VanDerWaalsContact NZ-CB 3.29Å; K105-T136 PolarHBondContact NZ-O 3.42Å; K105-T136 PolarHBondContact NZ-OG1 2.97Å
106	F	94.8	Very high	93.6	Very high	40 Å²	40	69.7 Å²	69.7	18%	0.175	39%	0.385	C	S	.	.	H	α-helix	trans	-85.8	-25.1	-175.2	-74	-83.9	0	0	0	113.2	L102 L109 L110 L130 V133 S137 F141	L102-F106 HydrophobicContact CD2-CD2 4.42Å; L102-F106 HydrophobicContact CD2-CE2 4.13Å; L102-F106 WeakPolarHBondContact O-CB 3.5Å; L102-F106 WeakPolarHBondContact O-CD2 3.32Å; L102-F106 PolarHBondContact O-N 3.19Å; F106-L109 WeakPolarHBondContact O-CB 3.26Å; F106-L109 PolarHBondContact O-N 3.17Å; F106-L110 WeakPolarHBondContact O-CG 3.45Å; F106-L110 PolarHBondContact O-N 3.2Å; F106-L130 HydrophobicContact CD1-CD1 4.25Å; F106-L130 HydrophobicContact CE1-CD1 4.05Å; F106-V133 HydrophobicContact CD1-CG1 3.78Å; F106-V133 HydrophobicContact CD2-CG1 3.89Å; F106-V133 HydrophobicContact CE1-CG1 3.61Å; F106-V133 HydrophobicContact CE2-CG1 3.72Å; F106-V133 HydrophobicContact CG-CG1 3.93Å; F106-V133 HydrophobicContact CZ-CG1 3.58Å; F106-S137 WeakPolarHBondContact CE2-OG 3.49Å; F106-F141 AromaticContact CE2-CD1 3.87Å; F106-F141 HydrophobicContact CE2-CD1 3.87Å; F106-F141 AromaticContact CE2-CE1 3.84Å; F106-F141 HydrophobicContact CE2-CE1 3.84Å; F106-F141 HydrophobicContact CE2-CG 4.46Å; F106-F141 HydrophobicContact CE2-CZ 4.41Å; F106-F141 AromaticContact CZ-CD1 3.67Å; F106-F141 HydrophobicContact CZ-CD1 3.67Å; F106-F141 AromaticContact CZ-CE1 3.99Å; F106-F141 HydrophobicContact CZ-CE1 3.99Å; F106-F141 HydrophobicContact CZ-CG 4.37Å
107	G	93.6	Very high	93.2	Very high	14 Å²	14	72 Å²	72	14%	0.144	39%	0.39	C	S	.	.	H	α-helix	trans	-56.4	-50.7	-179.3	0	0	0	0	0	113.7	L103 L109 L110 L111	L103-G107 WeakPolarHBondContact O-CA 3.5Å; L103-G107 PolarHBondContact O-N 3.24Å; G107-L109 VanDerWaalsContact C-N 3.3Å; G107-L109 PolarHBondContact O-N 3.14Å; G107-L110 PolarHBondContact O-N 3.23Å; G107-L111 WeakPolarHBondContact O-CG 3.5Å; G107-L111 PolarHBondContact O-N 2.86Å
108	P	95.2	Very high	93	Very high	65 Å²	65	74.1 Å²	74.1	42%	0.422	40%	0.399	S	S	.	.	H	α-helix	trans	-58.6	-40.1	175.1	-25.6	35.1	0	0	0	112.8	C104 L111 L112	C104-P108 WeakPolarHBondContact O-CD 3.46Å; C104-P108 WeakPolarHBondContact O-CG 3.41Å; P108-L111 PolarHBondContact O-N 3.03Å; P108-L112 WeakPolarHBondContact O-CB 3.43Å; P108-L112 WeakPolarHBondContact O-CG 3.14Å; P108-L112 PolarHBondContact O-N 3.2Å
109	L	93.4	Very high	92.8	Very high	14 Å²	14	74.4 Å²	74.4	7%	0.073	41%	0.407	C	S	.	.	H	α-helix	trans	-64.1	-42.2	177.2	-68.4	177	0	0	0	112.1	F106 G107 L111 L112 Y113 W126 A129 L130 V133	F106-L109 WeakPolarHBondContact O-CB 3.26Å; F106-L109 PolarHBondContact O-N 3.17Å; G107-L109 VanDerWaalsContact C-N 3.3Å; G107-L109 PolarHBondContact O-N 3.14Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.37Å; L109-L112 PolarHBondContact O-N 3.42Å; L109-Y113 PolarHBondContact O-N 3.04Å; L109-W126 PolarHBondContact O-NE1 3.03Å; L109-A129 HydrophobicContact CD2-CB 3.64Å; L109-L130 HydrophobicContact CD1-CB 4.27Å; L109-L130 HydrophobicContact CD1-CD1 3.83Å; L109-V133 HydrophobicContact CD1-CB 3.73Å; L109-V133 HydrophobicContact CD1-CG1 4.08Å; L109-V133 HydrophobicContact CD1-CG2 3.56Å; L109-V133 HydrophobicContact CG-CG2 4.36Å
110	L	89.7	Confident	92.4	Very high	125 Å²	125	78.2 Å²	78.2	65%	0.654	43%	0.427	S	S	*	.	H	α-helix	trans	-62.6	-41.5	176.4	-71.3	168.7	0	0	0	111.5	F106 G107 Y113	F106-L110 WeakPolarHBondContact O-CG 3.45Å; F106-L110 PolarHBondContact O-N 3.2Å; G107-L110 PolarHBondContact O-N 3.23Å; L110-Y113 WeakPolarHBondContact O-CB 3.49Å; L110-Y113 PolarHBondContact O-N 3.46Å
111	L	91.6	Very high	92	Very high	146 Å²	146	79.9 Å²	79.9	76%	0.764	43%	0.432	S	S	*	.	H	α-helix	trans	-67.8	-34.1	177.4	-69.3	173.1	0	0	0	112.8	G107 P108 L109 P114	G107-L111 WeakPolarHBondContact O-CG 3.5Å; G107-L111 PolarHBondContact O-N 2.86Å; P108-L111 PolarHBondContact O-N 3.03Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.37Å; L111-P114 VanDerWaalsContact O-CD 3.31Å; L111-P114 WeakPolarHBondContact O-CD 3.38Å
112	L	91.2	Very high	91.7	Very high	89 Å²	89	79.7 Å²	79.7	47%	0.466	43%	0.433	S	S	.	.	H	α-helix	trans	-86	-7.5	-180	-65.1	171.3	0	0	0	113.5	P108 L109 P114 L115	P108-L112 WeakPolarHBondContact O-CB 3.43Å; P108-L112 WeakPolarHBondContact O-CG 3.14Å; P108-L112 PolarHBondContact O-N 3.2Å; L109-L112 PolarHBondContact O-N 3.42Å; L112-P114 VanDerWaalsContact C-CD 3.43Å; L112-L115 HydrophobicContact CD2-CD1 3.73Å; L112-L115 WeakPolarHBondContact O-CB 3.41Å; L112-L115 PolarHBondContact O-N 2.93Å
113	Y	89.1	Confident	91.4	Very high	110 Å²	110	80.8 Å²	80.8	43%	0.431	44%	0.444	S	S	.	.	H	α-helix	trans	-53.9	-39.9	179.6	175.9	-104.5	0	0	0	114.3	L109 L110 L115 A116 L117 W126	L109-Y113 PolarHBondContact O-N 3.04Å; L110-Y113 WeakPolarHBondContact O-CB 3.49Å; L110-Y113 PolarHBondContact O-N 3.46Å; Y113-L115 PolarHBondContact O-N 2.69Å; Y113-L115 VanDerWaalsContact O-N 3.16Å; Y113-A116 WeakPolarHBondContact O-CB 3.43Å; Y113-A116 PolarHBondContact O-N 3.43Å; Y113-L117 HydrophobicContact CE1-CD1 4.12Å; Y113-L117 HydrophobicContact CE1-CD2 4.44Å; Y113-L117 HydrophobicContact CE1-CG 4.36Å; Y113-W126 HydrophobicContact CD2-CH2 4.17Å; Y113-W126 AromaticContact CD2-CZ2 3.85Å; Y113-W126 HydrophobicContact CD2-CZ2 3.85Å
114	P	92.2	Very high	91.1	Very high	76 Å²	76	77.9 Å²	77.9	49%	0.494	43%	0.433	S	S	.	.	H	α-helix	trans	-57.8	-29.9	176.4	-26.2	36.5	0	0	0	114.1	L111 L112 A116 L117	L111-P114 VanDerWaalsContact O-CD 3.31Å; L111-P114 WeakPolarHBondContact O-CD 3.38Å; L112-P114 VanDerWaalsContact C-CD 3.43Å; P114-A116 VanDerWaalsContact C-N 3.3Å; P114-A116 PolarHBondContact O-N 3.13Å; P114-L117 WeakPolarHBondContact O-CB 3.35Å; P114-L117 PolarHBondContact O-N 2.85Å
115	L	89	Confident	90.9	Very high	88 Å²	88	81.8 Å²	81.8	46%	0.461	44%	0.438	S	S	.	.	H	α-helix	trans	-69.2	-30.6	175.9	-60.4	175.7	0	0	0	111.9	L112 Y113 L117 M118 C122	L112-L115 HydrophobicContact CD2-CD1 3.73Å; L112-L115 WeakPolarHBondContact O-CB 3.41Å; L112-L115 PolarHBondContact O-N 2.93Å; Y113-L115 PolarHBondContact O-N 2.69Å; Y113-L115 VanDerWaalsContact O-N 3.16Å; L115-L117 PolarHBondContact O-N 3.46Å; L115-M118 HydrophobicContact CD2-SD 3.81Å; L115-M118 WeakPolarHBondContact O-CB 3.34Å; L115-M118 PolarHBondContact O-N 2.89Å; L115-M118 VanDerWaalsContact O-N 3.1Å; L115-C122 VanDerWaalsContact O-CB 3.23Å; L115-C122 WeakPolarHBondContact O-CB 3.3Å
116	A	88.5	Confident	90.9	Very high	14 Å²	14	81.7 Å²	81.7	12%	0.116	44%	0.435	C	S	.	.	H	α-helix	trans	-62.7	-26.3	173.8	0	0	0	0	0	111.9	Y113 P114 M118 A123 W126	Y113-A116 WeakPolarHBondContact O-CB 3.43Å; Y113-A116 PolarHBondContact O-N 3.43Å; P114-A116 VanDerWaalsContact C-N 3.3Å; P114-A116 PolarHBondContact O-N 3.13Å; A116-M118 VanDerWaalsContact C-N 3.31Å; A116-A123 HydrophobicContact CB-CB 4.35Å; A116-W126 HydrophobicContact CB-CB 3.99Å; A116-W126 HydrophobicContact CB-CG 4.08Å
117	L	87.5	Confident	90.8	Very high	123 Å²	123	81 Å²	81	64%	0.644	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.4	177	-57.9	176.7	0	0	0	113.3	Y113 P114 L115	Y113-L117 HydrophobicContact CE1-CD1 4.12Å; Y113-L117 HydrophobicContact CE1-CD2 4.44Å; Y113-L117 HydrophobicContact CE1-CG 4.36Å; P114-L117 WeakPolarHBondContact O-CB 3.35Å; P114-L117 PolarHBondContact O-N 2.85Å; L115-L117 PolarHBondContact O-N 3.46Å
118	M	91.1	Very high	90.7	Very high	152 Å²	152	85.9 Å²	85.9	75%	0.749	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-29.3	-175.8	-63.3	-176.2	65.8	0	0	113.5	L115 A116	L115-M118 HydrophobicContact CD2-SD 3.81Å; L115-M118 WeakPolarHBondContact O-CB 3.34Å; L115-M118 PolarHBondContact O-N 2.89Å; L115-M118 VanDerWaalsContact O-N 3.1Å; A116-M118 VanDerWaalsContact C-N 3.31Å
119	S	91.3	Very high	90.7	Very high	46 Å²	46	84.5 Å²	84.5	32%	0.322	45%	0.445	S	S	.	.			trans	-155.4	144.9	-176.3	175.9	0	0	0	0	111.7	H121 C122 A123	S119-H121 PolarHBondContact O-N 2.77Å; S119-H121 PolarHBondContact OG-N 2.89Å; S119-C122 PolarHBondContact O-N 3.44Å; S119-A123 PolarHBondContact O-N 2.99Å
120	T	87.4	Confident	90.7	Very high	116 Å²	116	85 Å²	85	71%	0.712	45%	0.447	S	S	*	.	H	α-helix	trans	-59.9	-33.8	175	52.6	0	0	0	0	112.2	A123 S124	T120-A123 PolarHBondContact O-N 3.3Å; T120-S124 PolarHBondContact O-N 2.87Å
121	H	89.4	Confident	90.9	Very high	134 Å²	134	79.2 Å²	79.2	62%	0.62	42%	0.418	S	S	*	.	H	α-helix	trans	-65.6	-46.7	175.1	-67.1	-72.8	0	0	0	111.4	S119 A123 S124 Y125	S119-H121 PolarHBondContact O-N 2.77Å; S119-H121 PolarHBondContact OG-N 2.89Å; H121-A123 VanDerWaalsContact C-N 3.3Å; H121-A123 PolarHBondContact O-N 3.4Å; H121-S124 PolarHBondContact O-N 3.01Å; H121-Y125 WeakPolarHBondContact O-CD2 3.47Å; H121-Y125 PolarHBondContact O-N 3.35Å
122	C	90.1	Very high	90.9	Very high	53 Å²	53	79.8 Å²	79.8	36%	0.358	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-39.2	176.9	-64.8	0	0	0	0	111.6	L115 S119 Y125 W126	L115-C122 VanDerWaalsContact O-CB 3.23Å; L115-C122 WeakPolarHBondContact O-CB 3.3Å; S119-C122 PolarHBondContact O-N 3.44Å; C122-Y125 PolarHBondContact O-N 3.38Å; C122-W126 VanDerWaalsContact O-CB 3.3Å; C122-W126 WeakPolarHBondContact O-CB 3.3Å; C122-W126 PolarHBondContact O-N 3.38Å
123	A	88	Confident	91	Very high	38 Å²	38	75.9 Å²	75.9	31%	0.314	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-44.5	173.6	0	0	0	0	0	112.3	A116 S119 T120 H121 W126 L127	A116-A123 HydrophobicContact CB-CB 4.35Å; S119-A123 PolarHBondContact O-N 2.99Å; T120-A123 PolarHBondContact O-N 3.3Å; H121-A123 VanDerWaalsContact C-N 3.3Å; H121-A123 PolarHBondContact O-N 3.4Å; A123-W126 PolarHBondContact O-N 2.97Å; A123-L127 WeakPolarHBondContact O-CB 3.45Å; A123-L127 PolarHBondContact O-N 3.15Å
124	S	89.9	Confident	91.2	Very high	54 Å²	54	71.1 Å²	71.1	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-44	177.7	-172.1	0	0	0	0	112.5	T120 H121 L127 K128	T120-S124 PolarHBondContact O-N 2.87Å; H121-S124 PolarHBondContact O-N 3.01Å; S124-L127 PolarHBondContact O-N 3.05Å; S124-K128 WeakPolarHBondContact O-CG 3.44Å; S124-K128 PolarHBondContact O-N 3.21Å
125	Y	91.7	Very high	91.1	Very high	164 Å²	164	71 Å²	71	64%	0.643	36%	0.364	S	S	*	.	H	α-helix	trans	-65.2	-42.1	176.1	-77.9	-69.7	0	0	0	112.3	H121 C122 L127 K128 A129	H121-Y125 WeakPolarHBondContact O-CD2 3.47Å; H121-Y125 PolarHBondContact O-N 3.35Å; C122-Y125 PolarHBondContact O-N 3.38Å; Y125-L127 VanDerWaalsContact C-N 3.32Å; Y125-L127 PolarHBondContact O-N 3.02Å; Y125-K128 PolarHBondContact O-N 3.3Å; Y125-A129 WeakPolarHBondContact O-CB 3.36Å; Y125-A129 PolarHBondContact O-N 3.03Å
126	W	94.2	Very high	91.1	Very high	54 Å²	54	69.5 Å²	69.5	21%	0.205	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-43	176.1	-174.9	93.7	0	0	0	111.3	L109 Y113 A116 C122 A123 A129 L130	L109-W126 PolarHBondContact O-NE1 3.03Å; Y113-W126 HydrophobicContact CD2-CH2 4.17Å; Y113-W126 AromaticContact CD2-CZ2 3.85Å; Y113-W126 HydrophobicContact CD2-CZ2 3.85Å; A116-W126 HydrophobicContact CB-CB 3.99Å; A116-W126 HydrophobicContact CB-CG 4.08Å; C122-W126 VanDerWaalsContact O-CB 3.3Å; C122-W126 WeakPolarHBondContact O-CB 3.3Å; C122-W126 PolarHBondContact O-N 3.38Å; A123-W126 PolarHBondContact O-N 2.97Å; W126-A129 PolarHBondContact O-N 2.84Å; W126-L130 HydrophobicContact CE3-CB 4.47Å; W126-L130 HydrophobicContact CH2-CD1 4.28Å; W126-L130 HydrophobicContact CH2-CD2 3.74Å; W126-L130 HydrophobicContact CH2-CG 4.38Å; W126-L130 HydrophobicContact CZ3-CB 4.29Å; W126-L130 HydrophobicContact CZ3-CD2 3.68Å; W126-L130 HydrophobicContact CZ3-CG 4.45Å; W126-L130 WeakPolarHBondContact O-CB 3.43Å; W126-L130 PolarHBondContact O-N 3.25Å
127	L	92.6	Very high	91.3	Very high	25 Å²	25	68.9 Å²	68.9	13%	0.131	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-42	178.4	-174.3	64.7	0	0	0	112.2	A123 S124 Y125 A129 L130 L131 F159 C162 F163	A123-L127 WeakPolarHBondContact O-CB 3.45Å; A123-L127 PolarHBondContact O-N 3.15Å; S124-L127 PolarHBondContact O-N 3.05Å; Y125-L127 VanDerWaalsContact C-N 3.32Å; Y125-L127 PolarHBondContact O-N 3.02Å; L127-A129 VanDerWaalsContact C-N 3.34Å; L127-L130 PolarHBondContact O-N 3.31Å; L127-L131 PolarHBondContact O-N 3.42Å; L127-F159 HydrophobicContact CD1-CB 4.27Å; L127-F159 HydrophobicContact CD1-CD2 3.54Å; L127-F159 HydrophobicContact CD1-CE2 4.29Å; L127-F159 HydrophobicContact CD1-CG 4.28Å; L127-C162 HydrophobicContact CD2-CB 3.71Å; L127-C162 HydrophobicContact CG-CB 4.04Å; L127-F163 HydrophobicContact CD1-CD2 4.32Å; L127-F163 HydrophobicContact CD1-CE2 3.87Å
128	K	91.8	Very high	91.4	Very high	117 Å²	117	63.8 Å²	63.8	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-40.5	173.5	-71.6	173.4	-175.7	176.5	0	112.1	S124 Y125 L131 W132	S124-K128 WeakPolarHBondContact O-CG 3.44Å; S124-K128 PolarHBondContact O-N 3.21Å; Y125-K128 PolarHBondContact O-N 3.3Å; K128-L131 PolarHBondContact O-N 3.45Å; K128-W132 PolarHBondContact O-N 3.17Å; K128-W132 VanDerWaalsContact O-N 3.08Å
129	A	94.3	Very high	91.3	Very high	37 Å²	37	57.1 Å²	57.1	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-67.7	-38.2	176.7	0	0	0	0	0	111.6	L109 Y125 W126 L127 W132 V133	L109-A129 HydrophobicContact CD2-CB 3.64Å; Y125-A129 WeakPolarHBondContact O-CB 3.36Å; Y125-A129 PolarHBondContact O-N 3.03Å; W126-A129 PolarHBondContact O-N 2.84Å; L127-A129 VanDerWaalsContact C-N 3.34Å; A129-W132 PolarHBondContact O-N 3.34Å; A129-V133 WeakPolarHBondContact O-CG2 3.27Å; A129-V133 PolarHBondContact O-N 2.91Å
130	L	94.4	Very high	91.3	Very high	23 Å²	23	55 Å²	55	12%	0.12	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-42.7	173.2	-174.1	72.9	0	0	0	111.7	F106 L109 W126 L127 V133 T134 F159 F163	F106-L130 HydrophobicContact CD1-CD1 4.25Å; F106-L130 HydrophobicContact CE1-CD1 4.05Å; L109-L130 HydrophobicContact CD1-CB 4.27Å; L109-L130 HydrophobicContact CD1-CD1 3.83Å; W126-L130 HydrophobicContact CE3-CB 4.47Å; W126-L130 HydrophobicContact CH2-CD1 4.28Å; W126-L130 HydrophobicContact CH2-CD2 3.74Å; W126-L130 HydrophobicContact CH2-CG 4.38Å; W126-L130 HydrophobicContact CZ3-CB 4.29Å; W126-L130 HydrophobicContact CZ3-CD2 3.68Å; W126-L130 HydrophobicContact CZ3-CG 4.45Å; W126-L130 WeakPolarHBondContact O-CB 3.43Å; W126-L130 PolarHBondContact O-N 3.25Å; L127-L130 PolarHBondContact O-N 3.31Å; L130-V133 PolarHBondContact O-N 2.93Å; L130-T134 WeakPolarHBondContact O-CB 3.39Å; L130-T134 PolarHBondContact O-N 3.31Å; L130-T134 PolarHBondContact O-OG1 3.34Å; L130-F159 HydrophobicContact CD2-CE2 3.94Å; L130-F163 HydrophobicContact CB-CZ 4.37Å; L130-F163 HydrophobicContact CD2-CE2 4.12Å; L130-F163 HydrophobicContact CD2-CZ 3.72Å; L130-F163 HydrophobicContact CG-CE2 4.45Å; L130-F163 HydrophobicContact CG-CZ 3.82Å
131	L	92.6	Very high	91.6	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-57.1	-52.1	174.6	177.2	64.6	0	0	0	110.6	L127 K128 V133 T134 E135 F163 L166	L127-L131 PolarHBondContact O-N 3.42Å; K128-L131 PolarHBondContact O-N 3.45Å; L131-V133 PolarHBondContact O-N 2.91Å; L131-T134 WeakPolarHBondContact O-CA 3.4Å; L131-T134 WeakPolarHBondContact O-CB 3.49Å; L131-T134 PolarHBondContact O-N 2.85Å; L131-T134 VanDerWaalsContact O-N 3.07Å; L131-E135 HydrophobicContact CD1-CG 4.41Å; L131-E135 WeakPolarHBondContact O-CG 3.46Å; L131-E135 PolarHBondContact O-N 3.07Å; L131-F163 HydrophobicContact CB-CE2 4.14Å; L131-F163 HydrophobicContact CB-CZ 4.38Å; L131-F163 HydrophobicContact CD1-CD1 4.45Å; L131-F163 HydrophobicContact CD1-CD2 4.33Å; L131-F163 HydrophobicContact CD1-CE2 4.44Å; L131-F163 HydrophobicContact CD1-CG 4.31Å; L131-L166 HydrophobicContact CD1-CD1 4.19Å; L131-L166 HydrophobicContact CD1-CD2 3.63Å; L131-L166 HydrophobicContact CD1-CG 3.65Å
132	W	92.1	Very high	91.5	Very high	158 Å²	158	44.9 Å²	44.9	60%	0.598	23%	0.229	S	C	*	.	H	α-helix	trans	-60.7	-41.8	179.2	178.7	82.7	0	0	0	113.1	K128 A129 T134 E135 T136	K128-W132 PolarHBondContact O-N 3.17Å; K128-W132 VanDerWaalsContact O-N 3.08Å; A129-W132 PolarHBondContact O-N 3.34Å; W132-T134 VanDerWaalsContact C-N 3.3Å; W132-T134 PolarHBondContact O-N 3.23Å; W132-E135 PolarHBondContact O-N 3.49Å; W132-T136 HydrophobicContact CD2-CG2 4.38Å; W132-T136 HydrophobicContact CZ2-CG2 4.19Å; W132-T136 WeakPolarHBondContact O-CG2 3.26Å; W132-T136 PolarHBondContact O-N 3.24Å; W132-T136 PolarHBondContact O-OG1 3.29Å; W132-T136 VanDerWaalsContact O-OG1 3.08Å
133	V	94.3	Very high	91.4	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-40.5	174.6	164.9	0	0	0	0	110.7	K105 F106 L109 A129 L130 L131 T136 S137	K105-V133 HydrophobicContact CB-CG1 3.87Å; F106-V133 HydrophobicContact CD1-CG1 3.78Å; F106-V133 HydrophobicContact CD2-CG1 3.89Å; F106-V133 HydrophobicContact CE1-CG1 3.61Å; F106-V133 HydrophobicContact CE2-CG1 3.72Å; F106-V133 HydrophobicContact CG-CG1 3.93Å; F106-V133 HydrophobicContact CZ-CG1 3.58Å; L109-V133 HydrophobicContact CD1-CB 3.73Å; L109-V133 HydrophobicContact CD1-CG1 4.08Å; L109-V133 HydrophobicContact CD1-CG2 3.56Å; L109-V133 HydrophobicContact CG-CG2 4.36Å; A129-V133 WeakPolarHBondContact O-CG2 3.27Å; A129-V133 PolarHBondContact O-N 2.91Å; L130-V133 PolarHBondContact O-N 2.93Å; L131-V133 PolarHBondContact O-N 2.91Å; V133-T136 PolarHBondContact O-N 3.49Å; V133-T136 PolarHBondContact O-OG1 3.4Å; V133-S137 VanDerWaalsContact O-CB 3.22Å; V133-S137 WeakPolarHBondContact O-CB 3.23Å; V133-S137 PolarHBondContact O-N 3.2Å; V133-S137 PolarHBondContact O-OG 3.08Å
134	T	92.8	Very high	91.4	Very high	9 Å²	9	43.4 Å²	43.4	6%	0.055	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-48.7	178	-56.9	0	0	0	0	111.2	L130 L131 W132 T136 S137 F141 F163 L166	L130-T134 WeakPolarHBondContact O-CB 3.39Å; L130-T134 PolarHBondContact O-N 3.31Å; L130-T134 PolarHBondContact O-OG1 3.34Å; L131-T134 WeakPolarHBondContact O-CA 3.4Å; L131-T134 WeakPolarHBondContact O-CB 3.49Å; L131-T134 PolarHBondContact O-N 2.85Å; L131-T134 VanDerWaalsContact O-N 3.07Å; W132-T134 VanDerWaalsContact C-N 3.3Å; W132-T134 PolarHBondContact O-N 3.23Å; T134-T136 VanDerWaalsContact C-N 3.31Å; T134-T136 PolarHBondContact O-N 3.28Å; T134-S137 PolarHBondContact O-N 3.36Å; T134-S137 VanDerWaalsContact O-N 3.11Å; T134-F141 HydrophobicContact CG2-CB 4.16Å; T134-F141 WeakPolarHBondContact CG2-O 3.24Å; T134-F163 HydrophobicContact CG2-CE1 4.01Å; T134-L166 HydrophobicContact CG2-CD1 4.02Å
135	E	89.8	Confident	91.3	Very high	74 Å²	74	41 Å²	41	35%	0.346	20%	0.195	S	C	.	.	H	α-helix	trans	-54.5	-45.8	176.4	-74.5	173.4	170.6	0	0	111.8	L131 W132 S137 L166	L131-E135 HydrophobicContact CD1-CG 4.41Å; L131-E135 WeakPolarHBondContact O-CG 3.46Å; L131-E135 PolarHBondContact O-N 3.07Å; W132-E135 PolarHBondContact O-N 3.49Å; E135-S137 VanDerWaalsContact C-N 3.3Å; E135-S137 PolarHBondContact O-N 3.47Å; E135-L166 HydrophobicContact CB-CD2 4.37Å; E135-L166 HydrophobicContact CG-CD2 3.23Å
136	T	90.1	Very high	90.9	Very high	57 Å²	57	34 Å²	34	35%	0.35	17%	0.168	S	C	.	.	H	α-helix	trans	-83.5	-6	-177.1	65.8	0	0	0	0	113.4	K105 W132 V133 T134 G138	K105-T136 VanDerWaalsContact NZ-C 3.27Å; K105-T136 VanDerWaalsContact NZ-CB 3.29Å; K105-T136 PolarHBondContact NZ-O 3.42Å; K105-T136 PolarHBondContact NZ-OG1 2.97Å; W132-T136 HydrophobicContact CD2-CG2 4.38Å; W132-T136 HydrophobicContact CZ2-CG2 4.19Å; W132-T136 WeakPolarHBondContact O-CG2 3.26Å; W132-T136 PolarHBondContact O-N 3.24Å; W132-T136 PolarHBondContact O-OG1 3.29Å; W132-T136 VanDerWaalsContact O-OG1 3.08Å; V133-T136 PolarHBondContact O-N 3.49Å; V133-T136 PolarHBondContact O-OG1 3.4Å; T134-T136 VanDerWaalsContact C-N 3.31Å; T134-T136 PolarHBondContact O-N 3.28Å; T136-G138 VanDerWaalsContact C-N 3.35Å
137	S	92.2	Very high	90.2	Very high	1 Å²	1	33 Å²	33	1%	0.007	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-8.4	-177.3	-70.2	0	0	0	0	113.2	R98 F106 V133 T134 E135	R98-S137 PolarHBondContact NH1-O 2.93Å; R98-S137 PolarHBondContact NH2-O 3.46Å; F106-S137 WeakPolarHBondContact CE2-OG 3.49Å; V133-S137 VanDerWaalsContact O-CB 3.22Å; V133-S137 WeakPolarHBondContact O-CB 3.23Å; V133-S137 PolarHBondContact O-N 3.2Å; V133-S137 PolarHBondContact O-OG 3.08Å; T134-S137 PolarHBondContact O-N 3.36Å; T134-S137 VanDerWaalsContact O-N 3.11Å; E135-S137 VanDerWaalsContact C-N 3.3Å; E135-S137 PolarHBondContact O-N 3.47Å
138	G	89.4	Confident	89.6	Confident	15 Å²	15	32 Å²	32	16%	0.155	16%	0.16	C	C	.	.			trans	100.8	-178.3	173.2	0	0	0	0	0	113.9	T136 T140 F141 I142	T136-G138 VanDerWaalsContact C-N 3.35Å; G138-T140 VanDerWaalsContact C-N 3.34Å; G138-T140 PolarHBondContact O-N 3.16Å; G138-F141 PolarHBondContact O-N 2.73Å; G138-F141 VanDerWaalsContact O-N 3.09Å; G138-I142 WeakPolarHBondContact O-CG1 3.42Å; G138-I142 PolarHBondContact O-N 3.01Å
139	P	89.3	Confident	89	Confident	13 Å²	13	27 Å²	27	8%	0.084	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-39.1	-162.9	23	-35.7	0	0	0	113.8	F141 I142 K143 C206 V278 V282	P139-F141 PolarHBondContact O-N 3.31Å; P139-I142 PolarHBondContact O-N 2.99Å; P139-K143 PolarHBondContact O-N 3.24Å; P139-C206 WeakPolarHBondContact CB-O 3.37Å; P139-V278 HydrophobicContact CB-CG1 4.27Å; P139-V278 HydrophobicContact CG-CG1 4.03Å; P139-V278 HydrophobicContact CG-CG2 4.18Å; P139-V282 HydrophobicContact CG-CG2 4.22Å
140	T	91.7	Very high	87.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-46.2	178.1	-39.9	0	0	0	0	111.6	G138 L144 V282 D285 L286 M289 F314	G138-T140 VanDerWaalsContact C-N 3.34Å; G138-T140 PolarHBondContact O-N 3.16Å; T140-L144 VanDerWaalsContact O-CB 3.28Å; T140-L144 WeakPolarHBondContact O-CB 3.03Å; T140-L144 PolarHBondContact O-N 3.32Å; T140-V282 WeakPolarHBondContact OG1-CA 3.31Å; T140-V282 WeakPolarHBondContact OG1-CG2 3.35Å; T140-D285 VanDerWaalsContact CB-OD2 3.31Å; T140-D285 WeakPolarHBondContact CB-OD2 3.48Å; T140-D285 HydrophobicContact CG2-CB 3.68Å; T140-D285 WeakPolarHBondContact OG1-CB 3.42Å; T140-D285 PolarHBondContact OG1-OD2 2.97Å; T140-L286 HydrophobicContact CG2-CD2 4.42Å; T140-M289 HydrophobicContact CG2-SD 4.09Å; T140-F314 HydrophobicContact CG2-CE1 3.73Å; T140-F314 HydrophobicContact CG2-CZ 4.23Å; T140-F314 VanDerWaalsContact O-CZ 3.31Å; T140-F314 WeakPolarHBondContact O-CZ 3.24Å
141	F	92.1	Very high	86.6	Confident	24 Å²	24	26.6 Å²	26.6	11%	0.105	13%	0.131	C	C	.	.	H	α-helix	trans	-75.7	-35.8	-178.2	-68.9	-86.3	0	0	0	111.7	L102 F106 T134 G138 P139 L144 G145 D285	L102-F141 HydrophobicContact CD1-CE2 3.73Å; L102-F141 HydrophobicContact CD1-CZ 3.66Å; L102-F141 HydrophobicContact CD2-CD2 4.1Å; L102-F141 HydrophobicContact CD2-CE2 3.43Å; L102-F141 VanDerWaalsContact CD2-CE2 3.43Å; L102-F141 HydrophobicContact CD2-CZ 3.67Å; L102-F141 HydrophobicContact CG-CE2 4.23Å; L102-F141 HydrophobicContact CG-CZ 4.27Å; F106-F141 AromaticContact CE2-CD1 3.87Å; F106-F141 HydrophobicContact CE2-CD1 3.87Å; F106-F141 AromaticContact CE2-CE1 3.84Å; F106-F141 HydrophobicContact CE2-CE1 3.84Å; F106-F141 HydrophobicContact CE2-CG 4.46Å; F106-F141 HydrophobicContact CE2-CZ 4.41Å; F106-F141 AromaticContact CZ-CD1 3.67Å; F106-F141 HydrophobicContact CZ-CD1 3.67Å; F106-F141 AromaticContact CZ-CE1 3.99Å; F106-F141 HydrophobicContact CZ-CE1 3.99Å; F106-F141 HydrophobicContact CZ-CG 4.37Å; T134-F141 HydrophobicContact CG2-CB 4.16Å; T134-F141 WeakPolarHBondContact CG2-O 3.24Å; G138-F141 PolarHBondContact O-N 2.73Å; G138-F141 VanDerWaalsContact O-N 3.09Å; P139-F141 PolarHBondContact O-N 3.31Å; F141-L144 PolarHBondContact O-N 3.06Å; F141-G145 PolarHBondContact O-N 3.38Å; F141-D285 HydrophobicContact CE2-CB 4.33Å
142	I	89.2	Confident	85.4	Confident	15 Å²	15	31.5 Å²	31.5	8%	0.077	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-51.4	172.1	-65.6	168.1	0	0	0	110	G138 P139 L144 G145 Q146 V170 C206	G138-I142 WeakPolarHBondContact O-CG1 3.42Å; G138-I142 PolarHBondContact O-N 3.01Å; P139-I142 PolarHBondContact O-N 2.99Å; I142-L144 VanDerWaalsContact C-N 3.35Å; I142-L144 PolarHBondContact O-N 3Å; I142-G145 PolarHBondContact O-N 3.09Å; I142-Q146 WeakPolarHBondContact O-CG 3.48Å; I142-Q146 PolarHBondContact O-N 3.43Å; I142-V170 HydrophobicContact CD1-CG2 4.43Å; I142-C206 HydrophobicContact CB-CB 4.41Å; I142-C206 HydrophobicContact CG2-CB 3.95Å
143	K	86.8	Confident	83.9	Confident	19 Å²	19	25.4 Å²	25.4	8%	0.083	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-36	177.2	-84.9	-47.9	-162.8	-179.3	0	112.7	P139 G145 Q146 W147 C206 F314 M318 Q321 D406	P139-K143 PolarHBondContact O-N 3.24Å; K143-G145 VanDerWaalsContact C-N 3.3Å; K143-G145 PolarHBondContact O-N 3.01Å; K143-Q146 PolarHBondContact O-N 3.35Å; K143-W147 VanDerWaalsContact O-CB 3.31Å; K143-W147 WeakPolarHBondContact O-CB 3.23Å; K143-W147 PolarHBondContact O-N 3.41Å; K143-C206 VanDerWaalsContact CD-SG 3.51Å; K143-C206 WeakPolarHBondContact CE-SG 3.31Å; K143-C206 VanDerWaalsContact CG-SG 3.51Å; K143-F314 HydrophobicContact CB-CE2 4.39Å; K143-F314 HydrophobicContact CB-CZ 4.36Å; K143-M318 HydrophobicContact CB-CE 4.08Å; K143-M318 HydrophobicContact CB-SD 3.29Å; K143-M318 WeakPolarHBondContact CB-SD 3.33Å; K143-M318 HydrophobicContact CG-CE 4.15Å; K143-M318 HydrophobicContact CG-SD 3.67Å; K143-Q321 VanDerWaalsContact CE-OE1 3.25Å; K143-D406 IonicContact NZ-OD2 2.88Å
144	L	88.3	Confident	82.7	Confident	41 Å²	41	28.9 Å²	28.9	22%	0.215	15%	0.146	C	C	.	.	H	α-helix	trans	-61.6	-41.7	173	-176.9	64.9	0	0	0	111.1	T140 F141 I142 W147 A148 M289 F314	T140-L144 VanDerWaalsContact O-CB 3.28Å; T140-L144 WeakPolarHBondContact O-CB 3.03Å; T140-L144 PolarHBondContact O-N 3.32Å; F141-L144 PolarHBondContact O-N 3.06Å; I142-L144 VanDerWaalsContact C-N 3.35Å; I142-L144 PolarHBondContact O-N 3Å; L144-W147 HydrophobicContact CD1-CE3 3.99Å; L144-W147 HydrophobicContact CD1-CZ3 4.37Å; L144-W147 PolarHBondContact O-N 2.84Å; L144-A148 WeakPolarHBondContact O-CB 3.31Å; L144-A148 PolarHBondContact O-N 3Å; L144-M289 HydrophobicContact CD1-CE 4.16Å; L144-M289 HydrophobicContact CD2-CE 3.75Å; L144-F314 VanDerWaalsContact CA-CE2 3.45Å; L144-F314 HydrophobicContact CB-CE1 4.13Å; L144-F314 HydrophobicContact CB-CE2 3.87Å; L144-F314 HydrophobicContact CB-CZ 3.6Å; L144-F314 HydrophobicContact CD1-CD1 4.09Å; L144-F314 HydrophobicContact CD1-CD2 3.79Å; L144-F314 HydrophobicContact CD1-CE1 4.19Å; L144-F314 HydrophobicContact CD1-CE2 3.93Å; L144-F314 HydrophobicContact CD1-CG 3.88Å; L144-F314 HydrophobicContact CD1-CZ 4.12Å; L144-F314 HydrophobicContact CG-CZ 4.45Å
145	G	87.4	Confident	82	Confident	4 Å²	4	31.6 Å²	31.6	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-42.3	176.3	0	0	0	0	0	112.8	F141 I142 K143 A148 S149	F141-G145 PolarHBondContact O-N 3.38Å; I142-G145 PolarHBondContact O-N 3.09Å; K143-G145 VanDerWaalsContact C-N 3.3Å; K143-G145 PolarHBondContact O-N 3.01Å; G145-A148 PolarHBondContact O-N 2.84Å; G145-S149 WeakPolarHBondContact O-CB 3.48Å; G145-S149 PolarHBondContact O-N 3.3Å
146	Q	82.7	Confident	81.5	Confident	16 Å²	16	31.1 Å²	31.1	8%	0.075	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-50.4	172.7	-70.6	178.6	0.8	0	0	110.3	I142 K143 A148 S149 T150 L166	I142-Q146 WeakPolarHBondContact O-CG 3.48Å; I142-Q146 PolarHBondContact O-N 3.43Å; K143-Q146 PolarHBondContact O-N 3.35Å; Q146-A148 PolarHBondContact O-N 2.92Å; Q146-S149 WeakPolarHBondContact O-CB 3.35Å; Q146-S149 PolarHBondContact O-N 3.31Å; Q146-S149 VanDerWaalsContact O-N 3.15Å; Q146-S149 PolarHBondContact O-OG 3.4Å; Q146-T150 WeakPolarHBondContact O-CG2 3.4Å; Q146-T150 PolarHBondContact O-N 2.9Å; Q146-L166 HydrophobicContact CG-CB 3.78Å; Q146-L166 PolarHBondContact NE2-O 3.44Å
147	W	80.4	Confident	81	Confident	33 Å²	33	36.6 Å²	36.6	13%	0.125	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-39.4	175.7	179	80	0	0	0	113	K143 L144 S149 T150 R151 V310	K143-W147 VanDerWaalsContact O-CB 3.31Å; K143-W147 WeakPolarHBondContact O-CB 3.23Å; K143-W147 PolarHBondContact O-N 3.41Å; L144-W147 HydrophobicContact CD1-CE3 3.99Å; L144-W147 HydrophobicContact CD1-CZ3 4.37Å; L144-W147 PolarHBondContact O-N 2.84Å; W147-S149 VanDerWaalsContact C-N 3.33Å; W147-S149 PolarHBondContact O-N 3.07Å; W147-T150 PolarHBondContact O-N 3.28Å; W147-T150 PolarHBondContact O-OG1 3.1Å; W147-R151 HydrophobicContact CD2-CG 4.43Å; W147-R151 HydrophobicContact CH2-CG 4.45Å; W147-R151 HydrophobicContact CZ2-CG 4.23Å; W147-R151 WeakPolarHBondContact O-CG 3.07Å; W147-V310 HydrophobicContact CH2-CG1 3.7Å; W147-V310 HydrophobicContact CZ3-CG1 3.86Å
148	A	80.3	Confident	80.6	Confident	5 Å²	5	43.3 Å²	43.3	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-67.7	-34.8	176.2	0	0	0	0	0	111.8	L144 G145 Q146 T150 R151 F155 F159	L144-A148 WeakPolarHBondContact O-CB 3.31Å; L144-A148 PolarHBondContact O-N 3Å; G145-A148 PolarHBondContact O-N 2.84Å; Q146-A148 PolarHBondContact O-N 2.92Å; A148-T150 PolarHBondContact O-N 2.78Å; A148-R151 PolarHBondContact O-N 3.38Å; A148-F155 HydrophobicContact CB-CD2 4Å; A148-F155 HydrophobicContact CB-CE2 3.52Å; A148-F155 HydrophobicContact CB-CZ 3.82Å; A148-F155 WeakPolarHBondContact O-CD2 3.35Å; A148-F159 HydrophobicContact CB-CE1 3.74Å; A148-F159 HydrophobicContact CB-CZ 3.99Å
149	S	78.8	Confident	80.5	Confident	10 Å²	10	43.7 Å²	43.7	7%	0.07	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-20.5	178.4	81.6	0	0	0	0	113.3	G145 Q146 W147 C160	G145-S149 WeakPolarHBondContact O-CB 3.48Å; G145-S149 PolarHBondContact O-N 3.3Å; Q146-S149 WeakPolarHBondContact O-CB 3.35Å; Q146-S149 PolarHBondContact O-N 3.31Å; Q146-S149 VanDerWaalsContact O-N 3.15Å; Q146-S149 PolarHBondContact O-OG 3.4Å; W147-S149 VanDerWaalsContact C-N 3.33Å; W147-S149 PolarHBondContact O-N 3.07Å; S149-C160 WeakPolarHBondContact O-CB 3.17Å; S149-C160 PolarHBondContact O-SG 2.93Å; S149-C160 VanDerWaalsContact O-SG 3.38Å
150	T	69.6	Low	80.2	Confident	27 Å²	27	43.3 Å²	43.3	17%	0.166	20%	0.203	C	C	.	.	H	α-helix	trans	-89.7	-16.8	175.7	68.3	0	0	0	0	112.9	Q146 W147 A148 R152 F551	Q146-T150 WeakPolarHBondContact O-CG2 3.4Å; Q146-T150 PolarHBondContact O-N 2.9Å; W147-T150 PolarHBondContact O-N 3.28Å; W147-T150 PolarHBondContact O-OG1 3.1Å; A148-T150 PolarHBondContact O-N 2.78Å; T150-R152 PolarHBondContact O-N 2.64Å; T150-R152 VanDerWaalsContact O-N 3.15Å; T150-F551 HydrophobicContact CG2-CD1 3.89Å; T150-F551 HydrophobicContact CG2-CE1 3.19Å; T150-F551 HydrophobicContact CG2-CE2 4.06Å; T150-F551 HydrophobicContact CG2-CZ 3.29Å; T150-F551 WeakPolarHBondContact O-CD2 3.14Å; T150-F551 VanDerWaalsContact O-CE2 3.28Å; T150-F551 WeakPolarHBondContact O-CE2 3.15Å
151	R	69.9	Low	79.8	Confident	26 Å²	26	47.6 Å²	47.6	10%	0.098	22%	0.223	C	C	.	.			trans	-90.8	68.1	-175.1	-69.2	-65.5	-59.3	-96	8	113.2	W147 A148 D153 I154 F155	W147-R151 HydrophobicContact CD2-CG 4.43Å; W147-R151 HydrophobicContact CH2-CG 4.45Å; W147-R151 HydrophobicContact CZ2-CG 4.23Å; W147-R151 WeakPolarHBondContact O-CG 3.07Å; A148-R151 PolarHBondContact O-N 3.38Å; R151-D153 WeakPolarHBondContact CA-OD1 3.39Å; R151-D153 IonicContact CZ-OD1 2.83Å; R151-D153 IonicContact CZ-OD2 2.61Å; R151-D153 IonicContact NE-OD1 3.72Å; R151-D153 PolarHBondContact NE-OD1 2.7Å; R151-D153 IonicContact NE-OD2 3.47Å; R151-D153 PolarHBondContact NE-OD2 3.18Å; R151-D153 IonicContact NH2-OD1 3.7Å; R151-D153 IonicContact NH2-OD2 3.18Å; R151-D153 PolarHBondContact NH2-OD2 3.35Å; R151-D153 PolarHBondContact O-N 3.48Å; R151-I154 HydrophobicContact CB-CB 4.42Å; R151-I154 VanDerWaalsContact NH2-CD1 3.3Å; R151-I154 PolarHBondContact O-N 2.95Å; R151-F155 HydrophobicContact CB-CD2 3.94Å; R151-F155 HydrophobicContact CB-CE2 4.24Å; R151-F155 WeakPolarHBondContact O-CD2 3.32Å; R151-F155 PolarHBondContact O-N 3.39Å
152	R	66.1	Low	79.4	Confident	107 Å²	107	47.6 Å²	47.6	40%	0.404	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.4	176.4	-68.4	-175	178.2	-167.5	1.1	114.5	T150 I154 C160	T150-R152 PolarHBondContact O-N 2.64Å; T150-R152 VanDerWaalsContact O-N 3.15Å; R152-I154 VanDerWaalsContact C-N 3.27Å; R152-C160 HydrophobicContact CG-CB 4.39Å
153	D	61.6	Low	79.4	Confident	30 Å²	30	47 Å²	47	16%	0.16	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-20.4	172.5	65.7	-51.9	0	0	0	112.7	R151 F532 I536	R151-D153 WeakPolarHBondContact CA-OD1 3.39Å; R151-D153 IonicContact CZ-OD1 2.83Å; R151-D153 IonicContact CZ-OD2 2.61Å; R151-D153 IonicContact NE-OD1 3.72Å; R151-D153 PolarHBondContact NE-OD1 2.7Å; R151-D153 IonicContact NE-OD2 3.47Å; R151-D153 PolarHBondContact NE-OD2 3.18Å; R151-D153 IonicContact NH2-OD1 3.7Å; R151-D153 IonicContact NH2-OD2 3.18Å; R151-D153 PolarHBondContact NH2-OD2 3.35Å; R151-D153 PolarHBondContact O-N 3.48Å; D153-F532 HydrophobicContact CB-CB 4.27Å; D153-F532 HydrophobicContact CB-CD1 3.54Å; D153-F532 HydrophobicContact CB-CE1 4.01Å; D153-F532 HydrophobicContact CB-CG 4.02Å; D153-I536 WeakPolarHBondContact O-CD1 3.46Å; D153-I536 WeakPolarHBondContact O-CG1 3.38Å
154	I	68.8	Low	78.9	Confident	80 Å²	80	49 Å²	49	41%	0.41	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-39.9	178.6	-60.9	178.4	0	0	0	110.7	R151 R152	R151-I154 HydrophobicContact CB-CB 4.42Å; R151-I154 VanDerWaalsContact NH2-CD1 3.3Å; R151-I154 PolarHBondContact O-N 2.95Å; R152-I154 VanDerWaalsContact C-N 3.27Å
155	F	77.2	Confident	78.5	Confident	67 Å²	67	54.5 Å²	54.5	29%	0.294	26%	0.256	S	S	.	.	S	Bend	trans	-111.1	150.2	-170.4	-60.3	-80.2	0	0	0	112.6	A148 R151 F159	A148-F155 HydrophobicContact CB-CD2 4Å; A148-F155 HydrophobicContact CB-CE2 3.52Å; A148-F155 HydrophobicContact CB-CZ 3.82Å; A148-F155 WeakPolarHBondContact O-CD2 3.35Å; R151-F155 HydrophobicContact CB-CD2 3.94Å; R151-F155 HydrophobicContact CB-CE2 4.24Å; R151-F155 WeakPolarHBondContact O-CD2 3.32Å; R151-F155 PolarHBondContact O-N 3.39Å; F155-F159 HydrophobicContact CB-CB 4.3Å; F155-F159 HydrophobicContact CB-CD1 3.46Å; F155-F159 VanDerWaalsContact CB-CD1 3.46Å; F155-F159 HydrophobicContact CB-CE1 4.02Å; F155-F159 HydrophobicContact CB-CG 4.02Å; F155-F159 AromaticContact CD1-CD1 3.84Å; F155-F159 HydrophobicContact CD1-CD1 3.84Å; F155-F159 HydrophobicContact CD1-CD2 4.34Å; F155-F159 AromaticContact CD1-CE1 3.74Å; F155-F159 HydrophobicContact CD1-CE1 3.74Å; F155-F159 HydrophobicContact CD1-CE2 4.25Å; F155-F159 HydrophobicContact CD1-CG 4.16Å; F155-F159 AromaticContact CD1-CZ 3.96Å; F155-F159 HydrophobicContact CD1-CZ 3.96Å; F155-F159 HydrophobicContact CD2-CE1 4.24Å; F155-F159 HydrophobicContact CE1-CE1 4.27Å; F155-F159 HydrophobicContact CE1-CZ 4.16Å; F155-F159 AromaticContact CG-CD1 3.7Å; F155-F159 HydrophobicContact CG-CD1 3.7Å; F155-F159 AromaticContact CG-CE1 3.73Å; F155-F159 HydrophobicContact CG-CE1 3.73Å; F155-F159 HydrophobicContact CG-CG 4.36Å; F155-F159 HydrophobicContact CG-CZ 4.41Å
156	S	80.1	Confident	78.1	Confident	64 Å²	64	54.7 Å²	54.7	45%	0.448	26%	0.256	S	S	.	.			trans	-65.6	158.2	178.2	71.6	0	0	0	0	111.9	E158 F159 C160	S156-E158 VanDerWaalsContact C-N 3.29Å; S156-E158 PolarHBondContact O-N 3.41Å; S156-F159 WeakPolarHBondContact O-CB 3.3Å; S156-F159 PolarHBondContact O-N 3.16Å; S156-F159 PolarHBondContact OG-N 2.69Å; S156-C160 PolarHBondContact O-N 2.99Å; S156-C160 PolarHBondContact O-SG 3.35Å
157	R	78.5	Confident	77.3	Confident	171 Å²	171	56.8 Å²	56.8	65%	0.645	27%	0.266	S	S	*	.	H	α-helix	trans	-55.5	-45	175.1	-178.4	176.4	174.8	170.5	0.5	112.1	F159 C160 E161	R157-F159 VanDerWaalsContact C-N 3.32Å; R157-F159 PolarHBondContact O-N 2.65Å; R157-C160 PolarHBondContact O-N 3.36Å; R157-E161 HydrophobicContact CG-CG 4.41Å; R157-E161 WeakPolarHBondContact CG-OE1 3.42Å; R157-E161 IonicContact CZ-OE1 2.64Å; R157-E161 IonicContact NE-OE1 2.65Å; R157-E161 PolarHBondContact NE-OE1 3.25Å; R157-E161 IonicContact NH2-OE1 3.68Å; R157-E161 PolarHBondContact NH2-OE1 3.38Å; R157-E161 WeakPolarHBondContact O-CG 3.38Å; R157-E161 PolarHBondContact O-N 3.33Å
158	E	84.9	Confident	76.4	Confident	143 Å²	143	60.7 Å²	60.7	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-60.3	-40.8	178.7	-63.4	151.1	174.2	0	0	111.9	S156 C162	S156-E158 VanDerWaalsContact C-N 3.29Å; S156-E158 PolarHBondContact O-N 3.41Å; E158-C162 VanDerWaalsContact O-CB 3.3Å; E158-C162 WeakPolarHBondContact O-CB 3.27Å; E158-C162 PolarHBondContact O-N 2.69Å
159	F	88	Confident	75.6	Confident	22 Å²	22	67.8 Å²	67.8	10%	0.096	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-50.4	174.5	175.7	-82.2	0	0	0	111	L127 L130 A148 F155 S156 R157 E161 C162 F163	L127-F159 HydrophobicContact CD1-CB 4.27Å; L127-F159 HydrophobicContact CD1-CD2 3.54Å; L127-F159 HydrophobicContact CD1-CE2 4.29Å; L127-F159 HydrophobicContact CD1-CG 4.28Å; L130-F159 HydrophobicContact CD2-CE2 3.94Å; A148-F159 HydrophobicContact CB-CE1 3.74Å; A148-F159 HydrophobicContact CB-CZ 3.99Å; F155-F159 HydrophobicContact CB-CB 4.3Å; F155-F159 HydrophobicContact CB-CD1 3.46Å; F155-F159 VanDerWaalsContact CB-CD1 3.46Å; F155-F159 HydrophobicContact CB-CE1 4.02Å; F155-F159 HydrophobicContact CB-CG 4.02Å; F155-F159 AromaticContact CD1-CD1 3.84Å; F155-F159 HydrophobicContact CD1-CD1 3.84Å; F155-F159 HydrophobicContact CD1-CD2 4.34Å; F155-F159 AromaticContact CD1-CE1 3.74Å; F155-F159 HydrophobicContact CD1-CE1 3.74Å; F155-F159 HydrophobicContact CD1-CE2 4.25Å; F155-F159 HydrophobicContact CD1-CG 4.16Å; F155-F159 AromaticContact CD1-CZ 3.96Å; F155-F159 HydrophobicContact CD1-CZ 3.96Å; F155-F159 HydrophobicContact CD2-CE1 4.24Å; F155-F159 HydrophobicContact CE1-CE1 4.27Å; F155-F159 HydrophobicContact CE1-CZ 4.16Å; F155-F159 AromaticContact CG-CD1 3.7Å; F155-F159 HydrophobicContact CG-CD1 3.7Å; F155-F159 AromaticContact CG-CE1 3.73Å; F155-F159 HydrophobicContact CG-CE1 3.73Å; F155-F159 HydrophobicContact CG-CG 4.36Å; F155-F159 HydrophobicContact CG-CZ 4.41Å; S156-F159 WeakPolarHBondContact O-CB 3.3Å; S156-F159 PolarHBondContact O-N 3.16Å; S156-F159 PolarHBondContact OG-N 2.69Å; R157-F159 VanDerWaalsContact C-N 3.32Å; R157-F159 PolarHBondContact O-N 2.65Å; F159-E161 PolarHBondContact O-N 2.68Å; F159-C162 PolarHBondContact O-N 2.77Å; F159-F163 HydrophobicContact CD1-CD2 4.46Å; F159-F163 HydrophobicContact CD2-CD2 4.04Å; F159-F163 HydrophobicContact CD2-CE2 4.01Å; F159-F163 HydrophobicContact CE1-CB 4.3Å; F159-F163 HydrophobicContact CE1-CD1 4.28Å; F159-F163 HydrophobicContact CE1-CD2 4.22Å; F159-F163 AromaticContact CE1-CG 4Å; F159-F163 HydrophobicContact CE1-CG 4Å; F159-F163 HydrophobicContact CE2-CD1 4.37Å; F159-F163 AromaticContact CE2-CD2 3.78Å; F159-F163 HydrophobicContact CE2-CD2 3.78Å; F159-F163 HydrophobicContact CE2-CE1 4.17Å; F159-F163 AromaticContact CE2-CE2 3.57Å; F159-F163 HydrophobicContact CE2-CE2 3.57Å; F159-F163 HydrophobicContact CE2-CG 4.21Å; F159-F163 AromaticContact CE2-CZ 3.79Å; F159-F163 HydrophobicContact CE2-CZ 3.79Å; F159-F163 HydrophobicContact CG-CD2 4.36Å; F159-F163 AromaticContact CZ-CD1 3.81Å; F159-F163 HydrophobicContact CZ-CD1 3.81Å; F159-F163 AromaticContact CZ-CD2 3.87Å; F159-F163 HydrophobicContact CZ-CD2 3.87Å; F159-F163 AromaticContact CZ-CE1 3.91Å; F159-F163 HydrophobicContact CZ-CE1 3.91Å; F159-F163 AromaticContact CZ-CE2 3.99Å; F159-F163 HydrophobicContact CZ-CE2 3.99Å; F159-F163 AromaticContact CZ-CG 3.81Å; F159-F163 HydrophobicContact CZ-CG 3.81Å; F159-F163 HydrophobicContact CZ-CZ 4.01Å; F159-F163 WeakPolarHBondContact O-CB 3.42Å; F159-F163 PolarHBondContact O-N 3.01Å
160	C	82.7	Confident	75.1	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-44.5	-177.6	-63.7	0	0	0	0	111.8	S149 R152 S156 R157 F163 S164	S149-C160 WeakPolarHBondContact O-CB 3.17Å; S149-C160 PolarHBondContact O-SG 2.93Å; S149-C160 VanDerWaalsContact O-SG 3.38Å; R152-C160 HydrophobicContact CG-CB 4.39Å; S156-C160 PolarHBondContact O-N 2.99Å; S156-C160 PolarHBondContact O-SG 3.35Å; R157-C160 PolarHBondContact O-N 3.36Å; C160-F163 PolarHBondContact O-N 3.39Å; C160-S164 PolarHBondContact O-N 2.91Å
161	E	81.6	Confident	75.7	Confident	90 Å²	90	73.1 Å²	73.1	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-62.4	-43.7	175.9	-72.8	173.4	-177.8	0	0	111.5	R157 F159 S164	R157-E161 HydrophobicContact CG-CG 4.41Å; R157-E161 WeakPolarHBondContact CG-OE1 3.42Å; R157-E161 IonicContact CZ-OE1 2.64Å; R157-E161 IonicContact NE-OE1 2.65Å; R157-E161 PolarHBondContact NE-OE1 3.25Å; R157-E161 IonicContact NH2-OE1 3.68Å; R157-E161 PolarHBondContact NH2-OE1 3.38Å; R157-E161 WeakPolarHBondContact O-CG 3.38Å; R157-E161 PolarHBondContact O-N 3.33Å; F159-E161 PolarHBondContact O-N 2.68Å; E161-S164 PolarHBondContact O-OG 2.81Å
162	C	85.6	Confident	76.6	Confident	24 Å²	24	75.7 Å²	75.7	16%	0.162	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-44.8	178.5	-171.7	0	0	0	0	112.4	L127 E158 F159	L127-C162 HydrophobicContact CD2-CB 3.71Å; L127-C162 HydrophobicContact CG-CB 4.04Å; E158-C162 VanDerWaalsContact O-CB 3.3Å; E158-C162 WeakPolarHBondContact O-CB 3.27Å; E158-C162 PolarHBondContact O-N 2.69Å; F159-C162 PolarHBondContact O-N 2.77Å
163	F	87.3	Confident	77.9	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-78.8	-16.6	-176.4	-85.7	-115.8	0	0	0	114	L127 L130 L131 T134 F159 C160 R165 L166	L127-F163 HydrophobicContact CD1-CD2 4.32Å; L127-F163 HydrophobicContact CD1-CE2 3.87Å; L130-F163 HydrophobicContact CB-CZ 4.37Å; L130-F163 HydrophobicContact CD2-CE2 4.12Å; L130-F163 HydrophobicContact CD2-CZ 3.72Å; L130-F163 HydrophobicContact CG-CE2 4.45Å; L130-F163 HydrophobicContact CG-CZ 3.82Å; L131-F163 HydrophobicContact CB-CE2 4.14Å; L131-F163 HydrophobicContact CB-CZ 4.38Å; L131-F163 HydrophobicContact CD1-CD1 4.45Å; L131-F163 HydrophobicContact CD1-CD2 4.33Å; L131-F163 HydrophobicContact CD1-CE2 4.44Å; L131-F163 HydrophobicContact CD1-CG 4.31Å; T134-F163 HydrophobicContact CG2-CE1 4.01Å; F159-F163 HydrophobicContact CD1-CD2 4.46Å; F159-F163 HydrophobicContact CD2-CD2 4.04Å; F159-F163 HydrophobicContact CD2-CE2 4.01Å; F159-F163 HydrophobicContact CE1-CB 4.3Å; F159-F163 HydrophobicContact CE1-CD1 4.28Å; F159-F163 HydrophobicContact CE1-CD2 4.22Å; F159-F163 AromaticContact CE1-CG 4Å; F159-F163 HydrophobicContact CE1-CG 4Å; F159-F163 HydrophobicContact CE2-CD1 4.37Å; F159-F163 AromaticContact CE2-CD2 3.78Å; F159-F163 HydrophobicContact CE2-CD2 3.78Å; F159-F163 HydrophobicContact CE2-CE1 4.17Å; F159-F163 AromaticContact CE2-CE2 3.57Å; F159-F163 HydrophobicContact CE2-CE2 3.57Å; F159-F163 HydrophobicContact CE2-CG 4.21Å; F159-F163 AromaticContact CE2-CZ 3.79Å; F159-F163 HydrophobicContact CE2-CZ 3.79Å; F159-F163 HydrophobicContact CG-CD2 4.36Å; F159-F163 AromaticContact CZ-CD1 3.81Å; F159-F163 HydrophobicContact CZ-CD1 3.81Å; F159-F163 AromaticContact CZ-CD2 3.87Å; F159-F163 HydrophobicContact CZ-CD2 3.87Å; F159-F163 AromaticContact CZ-CE1 3.91Å; F159-F163 HydrophobicContact CZ-CE1 3.91Å; F159-F163 AromaticContact CZ-CE2 3.99Å; F159-F163 HydrophobicContact CZ-CE2 3.99Å; F159-F163 AromaticContact CZ-CG 3.81Å; F159-F163 HydrophobicContact CZ-CG 3.81Å; F159-F163 HydrophobicContact CZ-CZ 4.01Å; F159-F163 WeakPolarHBondContact O-CB 3.42Å; F159-F163 PolarHBondContact O-N 3.01Å; C160-F163 PolarHBondContact O-N 3.39Å; F163-R165 PolarHBondContact O-N 3.43Å; F163-L166 HydrophobicContact CB-CD1 4.38Å; F163-L166 HydrophobicContact CD1-CD1 3.51Å; F163-L166 HydrophobicContact CE1-CD1 4.1Å; F163-L166 HydrophobicContact CG-CD1 4.28Å; F163-L166 VanDerWaalsContact O-CB 3.28Å; F163-L166 WeakPolarHBondContact O-CB 3.47Å; F163-L166 WeakPolarHBondContact O-CG 3.48Å; F163-L166 PolarHBondContact O-N 2.88Å
164	S	77.4	Confident	79.5	Confident	60 Å²	60	73.8 Å²	73.8	42%	0.42	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-56.2	-22.1	171.7	73	0	0	0	0	113.3	C160 E161 L166 H167	C160-S164 PolarHBondContact O-N 2.91Å; E161-S164 PolarHBondContact O-OG 2.81Å; S164-L166 PolarHBondContact O-N 2.98Å; S164-H167 PolarHBondContact O-CD2 3.03Å; S164-H167 VanDerWaalsContact O-CD2 3.24Å; S164-H167 PolarHBondContact O-N 2.79Å
165	R	79.6	Confident	80.8	Confident	156 Å²	156	72.3 Å²	72.3	59%	0.589	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-65.3	-22.6	175.2	-64.6	177.6	63.2	-162.8	-3.2	113.8	F163 H167 V168	F163-R165 PolarHBondContact O-N 3.43Å; R165-H167 PolarHBondContact O-N 3.15Å; R165-H167 VanDerWaalsContact O-N 3.07Å; R165-V168 PolarHBondContact O-N 2.87Å; R165-V168 VanDerWaalsContact O-N 3.08Å
166	L	78.6	Confident	81.6	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.042	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-63.1	-12.6	178.1	-69	176.4	0	0	0	113.4	L131 T134 E135 Q146 F163 S164 V168	L131-L166 HydrophobicContact CD1-CD1 4.19Å; L131-L166 HydrophobicContact CD1-CD2 3.63Å; L131-L166 HydrophobicContact CD1-CG 3.65Å; T134-L166 HydrophobicContact CG2-CD1 4.02Å; E135-L166 HydrophobicContact CB-CD2 4.37Å; E135-L166 HydrophobicContact CG-CD2 3.23Å; Q146-L166 HydrophobicContact CG-CB 3.78Å; Q146-L166 PolarHBondContact NE2-O 3.44Å; F163-L166 HydrophobicContact CB-CD1 4.38Å; F163-L166 HydrophobicContact CD1-CD1 3.51Å; F163-L166 HydrophobicContact CE1-CD1 4.1Å; F163-L166 HydrophobicContact CG-CD1 4.28Å; F163-L166 VanDerWaalsContact O-CB 3.28Å; F163-L166 WeakPolarHBondContact O-CB 3.47Å; F163-L166 WeakPolarHBondContact O-CG 3.48Å; F163-L166 PolarHBondContact O-N 2.88Å; S164-L166 PolarHBondContact O-N 2.98Å; L166-V168 PolarHBondContact O-N 3.31Å
167	H	67	Low	82.3	Confident	60 Å²	60	70.9 Å²	70.9	28%	0.278	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-75.2	-6.1	174.8	-69	-97	0	0	0	113	S164 R165 D406 H408	S164-H167 PolarHBondContact O-CD2 3.03Å; S164-H167 VanDerWaalsContact O-CD2 3.24Å; S164-H167 PolarHBondContact O-N 2.79Å; R165-H167 PolarHBondContact O-N 3.15Å; R165-H167 VanDerWaalsContact O-N 3.07Å; H167-D406 IonicContact CE1-OD1 3.33Å; H167-H408 AromaticContact ND1-NE2 3.74Å
168	V	61.4	Low	83.1	Confident	115 Å²	115	62.7 Å²	62.7	70%	0.697	34%	0.339	S	S	*	.	S	Bend	trans	-93.1	129.7	-177.4	-175.1	0	0	0	0	111.6	R165 L166	R165-V168 PolarHBondContact O-N 2.87Å; R165-V168 VanDerWaalsContact O-N 3.08Å; L166-V168 PolarHBondContact O-N 3.31Å
169	K	62.2	Low	83.5	Confident	154 Å²	154	59.5 Å²	59.5	67%	0.67	32%	0.323	S	S	*	.			trans	-14.8	134.2	-173.4	-67.2	-174.4	179.3	-171.1	0	118.1	V202	K169-V202 PolarHBondContact NZ-O 2.98Å
170	V	70.1	Confident	83.8	Confident	45 Å²	45	64.6 Å²	64.6	27%	0.273	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-97	150.4	174.9	-178.5	0	0	0	0	110.8	I142 S204 C206	I142-V170 HydrophobicContact CD1-CG2 4.43Å; V170-S204 PolarHBondContact N-O 3.48Å; V170-S204 WeakPolarHBondContact O-CB 3.41Å; V170-S204 PolarHBondContact O-OG 2.98Å; V170-C206 HydrophobicContact CG2-CB 4.16Å
171	S	80.8	Confident	84.3	Confident	104 Å²	104	65 Å²	65	73%	0.727	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-52.3	130.1	176	-57.1	0	0	0	0	112.4
172	P	90.2	Very high	84.8	Confident	80 Å²	80	60.8 Å²	60.8	52%	0.519	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-74.2	151.9	-178	30.4	-35.2	0	0	0	112.3	P201	P172-P201 HydrophobicContact CB-CG 3.73Å
173	H	92.9	Very high	85.1	Confident	21 Å²	21	66 Å²	66	10%	0.097	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-81.5	163.3	168.2	67.4	-112.8	0	0	0	112	H177 T178 Q209 H275 P276	H173-H177 AromaticContact CD2-CD2 3.51Å; H173-H177 AromaticContact CE1-CD2 3.8Å; H173-H177 AromaticContact CG-CD2 3.76Å; H173-H177 AromaticContact ND1-CD2 3.94Å; H173-H177 AromaticContact NE2-CD2 3.53Å; H173-T178 PolarHBondContact CD2-OG1 2.88Å; H173-T178 PolarHBondContact NE2-OG1 3.15Å; H173-Q209 VanDerWaalsContact CE1-CG 3.44Å; H173-Q209 WeakPolarHBondContact CE1-CG 2.97Å; H173-Q209 PolarHBondContact CE1-OE1 3.35Å; H173-Q209 VanDerWaalsContact CG-OE1 3.24Å; H173-Q209 VanDerWaalsContact ND1-CD 3.35Å; H173-Q209 PolarHBondContact ND1-OE1 3.47Å; H173-Q209 PolarHBondContact O-NE2 3.07Å; H173-H275 AromaticContact CE1-ND1 3.96Å; H173-H275 AromaticContact CG-ND1 3.66Å; H173-H275 AromaticContact ND1-CE1 3.64Å; H173-H275 AromaticContact ND1-CG 3.79Å; H173-H275 AromaticContact ND1-ND1 2.88Å; H173-H275 PolarHBondContact ND1-ND1 2.84Å; H173-P276 HydrophobicContact CB-CG 4.1Å
174	S	94.8	Very high	85.2	Confident	76 Å²	76	71 Å²	71	53%	0.531	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-70.6	142.8	-177.7	69.6	0	0	0	0	112.9	A176 H177 T178	S174-A176 PolarHBondContact O-N 2.94Å; S174-H177 WeakPolarHBondContact O-CB 3.4Å; S174-H177 PolarHBondContact O-N 3.33Å; S174-T178 PolarHBondContact O-N 3.21Å
175	W	95.2	Very high	85.8	Confident	49 Å²	49	70 Å²	70	19%	0.186	37%	0.371	C	S	.	.	H	α-helix	trans	-52.1	-27.6	174.4	178.7	-119.2	0	0	0	114.2	H177 T178 K179 F196 K199 Y211	W175-H177 VanDerWaalsContact C-N 3.31Å; W175-H177 PolarHBondContact O-N 2.98Å; W175-T178 HydrophobicContact CE3-CG2 3.85Å; W175-T178 HydrophobicContact CH2-CG2 4.28Å; W175-T178 HydrophobicContact CZ3-CG2 3.54Å; W175-T178 WeakPolarHBondContact O-CB 3.48Å; W175-T178 PolarHBondContact O-N 2.92Å; W175-K179 HydrophobicContact CD2-CG 4.35Å; W175-K179 HydrophobicContact CZ2-CD 4.47Å; W175-K179 HydrophobicContact CZ2-CG 3.98Å; W175-K179 PolarHBondContact O-N 2.88Å; W175-F196 HydrophobicContact CH2-CB 4.25Å; W175-F196 AromaticContact CH2-CD1 3.54Å; W175-F196 HydrophobicContact CH2-CD1 3.54Å; W175-F196 AromaticContact CH2-CD2 3.86Å; W175-F196 HydrophobicContact CH2-CD2 3.86Å; W175-F196 AromaticContact CH2-CE1 3.74Å; W175-F196 HydrophobicContact CH2-CE1 3.74Å; W175-F196 HydrophobicContact CH2-CE2 4.05Å; W175-F196 AromaticContact CH2-CG 3.61Å; W175-F196 HydrophobicContact CH2-CG 3.61Å; W175-F196 AromaticContact CH2-CZ 3.99Å; W175-F196 HydrophobicContact CH2-CZ 3.99Å; W175-F196 AromaticContact CZ3-CD1 3.69Å; W175-F196 HydrophobicContact CZ3-CD1 3.69Å; W175-F196 AromaticContact CZ3-CE1 3.75Å; W175-F196 HydrophobicContact CZ3-CE1 3.75Å; W175-F196 HydrophobicContact CZ3-CG 4.23Å; W175-F196 HydrophobicContact CZ3-CZ 4.34Å; W175-K199 HydrophobicContact CB-CB 4.47Å; W175-K199 HydrophobicContact CD2-CB 4.16Å; W175-K199 HydrophobicContact CD2-CG 4.07Å; W175-K199 HydrophobicContact CE3-CB 4.43Å; W175-K199 HydrophobicContact CG-CB 4.15Å; W175-K199 HydrophobicContact CG-CD 4.35Å; W175-K199 HydrophobicContact CG-CG 4.12Å; W175-Y211 AromaticContact CE3-CE1 3.81Å; W175-Y211 HydrophobicContact CE3-CE1 3.81Å; W175-Y211 AromaticContact CE3-CZ 3.87Å; W175-Y211 HydrophobicContact CZ3-CD1 4.13Å; W175-Y211 AromaticContact CZ3-CE1 3.73Å; W175-Y211 HydrophobicContact CZ3-CE1 3.73Å; W175-Y211 HydrophobicContact CZ3-CE2 4.5Å; W175-Y211 AromaticContact CZ3-CZ 3.9Å
176	A	95.3	Very high	86.1	Confident	63 Å²	63	64.5 Å²	64.5	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-38	175	0	0	0	0	0	112.6	S174 K180	S174-A176 PolarHBondContact O-N 2.94Å; A176-K180 WeakPolarHBondContact O-CB 3.39Å; A176-K180 PolarHBondContact O-N 3.25Å; A176-K180 VanDerWaalsContact O-N 3.12Å
177	H	94.7	Very high	86.5	Confident	38 Å²	38	65.8 Å²	65.8	18%	0.176	37%	0.367	C	S	.	.	H	α-helix	trans	-65.9	-45.7	173.8	177.7	69.9	0	0	0	110.9	H173 S174 W175 K179 K180 C181 V274 P276	H173-H177 AromaticContact CD2-CD2 3.51Å; H173-H177 AromaticContact CE1-CD2 3.8Å; H173-H177 AromaticContact CG-CD2 3.76Å; H173-H177 AromaticContact ND1-CD2 3.94Å; H173-H177 AromaticContact NE2-CD2 3.53Å; S174-H177 WeakPolarHBondContact O-CB 3.4Å; S174-H177 PolarHBondContact O-N 3.33Å; W175-H177 VanDerWaalsContact C-N 3.31Å; W175-H177 PolarHBondContact O-N 2.98Å; H177-K179 PolarHBondContact O-N 3.45Å; H177-K180 WeakPolarHBondContact O-CA 3.33Å; H177-K180 WeakPolarHBondContact O-CB 3.08Å; H177-K180 PolarHBondContact O-N 3.48Å; H177-C181 PolarHBondContact CE1-SG 3Å; H177-C181 PolarHBondContact NE2-SG 3.42Å; H177-C181 VanDerWaalsContact NE2-SG 3.38Å; H177-C181 PolarHBondContact O-N 3.02Å; H177-V274 PolarHBondContact NE2-O 2.87Å; H177-P276 VanDerWaalsContact CE1-CA 3.45Å; H177-P276 WeakPolarHBondContact CE1-CA 3.27Å
178	T	95.2	Very high	87.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-52.4	-53.1	175.5	-48	0	0	0	0	112.1	H173 S174 W175 K180 C181 L182 Y211 V273	H173-T178 PolarHBondContact CD2-OG1 2.88Å; H173-T178 PolarHBondContact NE2-OG1 3.15Å; S174-T178 PolarHBondContact O-N 3.21Å; W175-T178 HydrophobicContact CE3-CG2 3.85Å; W175-T178 HydrophobicContact CH2-CG2 4.28Å; W175-T178 HydrophobicContact CZ3-CG2 3.54Å; W175-T178 WeakPolarHBondContact O-CB 3.48Å; W175-T178 PolarHBondContact O-N 2.92Å; T178-K180 VanDerWaalsContact C-N 3.27Å; T178-K180 PolarHBondContact O-N 2.9Å; T178-C181 WeakPolarHBondContact O-CB 3.44Å; T178-C181 PolarHBondContact O-N 3.45Å; T178-C181 VanDerWaalsContact O-N 3.13Å; T178-L182 HydrophobicContact CG2-CD1 4.04Å; T178-L182 WeakPolarHBondContact O-CG 3.18Å; T178-L182 PolarHBondContact O-N 3.47Å; T178-Y211 HydrophobicContact CG2-CD2 4.3Å; T178-Y211 HydrophobicContact CG2-CE2 3.59Å; T178-Y211 PolarHBondContact OG1-OH 3.08Å; T178-V273 HydrophobicContact CG2-CG1 4.42Å; T178-V273 HydrophobicContact CG2-CG2 4.07Å
179	K	94.1	Very high	88.3	Confident	76 Å²	76	64 Å²	64	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-39.1	176.7	-73.4	-172.7	-67.6	178.2	0	112.5	W175 H177 R183 W190	W175-K179 HydrophobicContact CD2-CG 4.35Å; W175-K179 HydrophobicContact CZ2-CD 4.47Å; W175-K179 HydrophobicContact CZ2-CG 3.98Å; W175-K179 PolarHBondContact O-N 2.88Å; H177-K179 PolarHBondContact O-N 3.45Å; K179-R183 VanDerWaalsContact O-CB 3.28Å; K179-R183 WeakPolarHBondContact O-CB 3.33Å; K179-R183 PolarHBondContact O-N 3.26Å; K179-W190 HydrophobicContact CG-CH2 4.47Å; K179-W190 HydrophobicContact CG-CZ2 4.31Å
180	K	93.8	Very high	89.5	Confident	128 Å²	128	57.1 Å²	57.1	56%	0.557	33%	0.328	S	S	*	.	H	α-helix	trans	-65.6	-42.6	177.8	-176.8	-177.8	177.1	-179.2	0	111.2	A176 H177 T178 T184	A176-K180 WeakPolarHBondContact O-CB 3.39Å; A176-K180 PolarHBondContact O-N 3.25Å; A176-K180 VanDerWaalsContact O-N 3.12Å; H177-K180 WeakPolarHBondContact O-CA 3.33Å; H177-K180 WeakPolarHBondContact O-CB 3.08Å; H177-K180 PolarHBondContact O-N 3.48Å; T178-K180 VanDerWaalsContact C-N 3.27Å; T178-K180 PolarHBondContact O-N 2.9Å; K180-T184 WeakPolarHBondContact O-CB 3.39Å; K180-T184 PolarHBondContact O-N 3.46Å; K180-T184 PolarHBondContact O-OG1 3.07Å
181	C	92.5	Very high	90.3	Very high	15 Å²	15	61 Å²	61	10%	0.101	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-50.5	175.5	-72.8	0	0	0	0	111	H177 T178 R183 T184 A185 V273 I358	H177-C181 PolarHBondContact CE1-SG 3Å; H177-C181 PolarHBondContact NE2-SG 3.42Å; H177-C181 VanDerWaalsContact NE2-SG 3.38Å; H177-C181 PolarHBondContact O-N 3.02Å; T178-C181 WeakPolarHBondContact O-CB 3.44Å; T178-C181 PolarHBondContact O-N 3.45Å; T178-C181 VanDerWaalsContact O-N 3.13Å; C181-R183 VanDerWaalsContact C-N 3.34Å; C181-R183 PolarHBondContact O-N 3.05Å; C181-T184 PolarHBondContact O-N 3.3Å; C181-T184 VanDerWaalsContact O-N 3.14Å; C181-A185 WeakPolarHBondContact O-CB 3.45Å; C181-A185 PolarHBondContact O-N 3.42Å; C181-V273 HydrophobicContact CB-CG1 3.9Å; C181-I358 VanDerWaalsContact C-CD1 3.48Å; C181-I358 HydrophobicContact CB-CD1 4.01Å; C181-I358 HydrophobicContact CB-CG1 4.35Å
182	L	91.9	Very high	90.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-45.2	179.1	-69	163	0	0	0	111.5	T178 T184 A185 F186 W190 L194 F196 I358	T178-L182 HydrophobicContact CG2-CD1 4.04Å; T178-L182 WeakPolarHBondContact O-CG 3.18Å; T178-L182 PolarHBondContact O-N 3.47Å; L182-T184 VanDerWaalsContact C-N 3.32Å; L182-T184 PolarHBondContact O-N 2.95Å; L182-A185 PolarHBondContact O-N 2.95Å; L182-F186 HydrophobicContact CD2-CD2 4.13Å; L182-F186 HydrophobicContact CD2-CE2 4.08Å; L182-F186 PolarHBondContact O-N 2.97Å; L182-W190 HydrophobicContact CB-CD2 3.84Å; L182-W190 HydrophobicContact CB-CE3 4.5Å; L182-W190 HydrophobicContact CB-CG 3.95Å; L182-W190 HydrophobicContact CB-CZ2 4.22Å; L182-W190 HydrophobicContact CD1-CD2 4.12Å; L182-W190 HydrophobicContact CD1-CE3 3.96Å; L182-W190 HydrophobicContact CD1-CH2 3.86Å; L182-W190 HydrophobicContact CD1-CZ2 4.03Å; L182-W190 HydrophobicContact CD1-CZ3 3.83Å; L182-W190 HydrophobicContact CG-CD2 4.45Å; L182-L194 HydrophobicContact CD2-CD1 4.29Å; L182-F196 HydrophobicContact CD1-CE2 3.87Å; L182-F196 HydrophobicContact CD1-CZ 3.64Å; L182-I358 HydrophobicContact CB-CD1 4.41Å; L182-I358 HydrophobicContact CD2-CD1 3.76Å; L182-I358 HydrophobicContact CD2-CG2 4.38Å; L182-I358 HydrophobicContact CG-CD1 4.09Å
183	R	92.4	Very high	90.3	Very high	133 Å²	133	60.4 Å²	60.4	50%	0.502	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-38.3	176.7	-174.4	176.6	66.1	177.7	0.7	113.3	K179 C181 G187 E188	K179-R183 VanDerWaalsContact O-CB 3.28Å; K179-R183 WeakPolarHBondContact O-CB 3.33Å; K179-R183 PolarHBondContact O-N 3.26Å; C181-R183 VanDerWaalsContact C-N 3.34Å; C181-R183 PolarHBondContact O-N 3.05Å; R183-G187 WeakPolarHBondContact CA-O 3.43Å; R183-G187 VanDerWaalsContact O-CA 3.28Å; R183-G187 WeakPolarHBondContact O-CA 3.34Å; R183-G187 PolarHBondContact O-N 3.47Å; R183-E188 WeakPolarHBondContact CD-OE1 3.28Å; R183-E188 IonicContact NH1-OE1 3.93Å
184	T	90.1	Very high	90.2	Very high	110 Å²	110	59.6 Å²	59.6	68%	0.675	31%	0.307	S	S	*	.	H	α-helix	trans	-71.2	-35.1	179.1	-54.4	0	0	0	0	111.4	K180 C181 L182	K180-T184 WeakPolarHBondContact O-CB 3.39Å; K180-T184 PolarHBondContact O-N 3.46Å; K180-T184 PolarHBondContact O-OG1 3.07Å; C181-T184 PolarHBondContact O-N 3.3Å; C181-T184 VanDerWaalsContact O-N 3.14Å; L182-T184 VanDerWaalsContact C-N 3.32Å; L182-T184 PolarHBondContact O-N 2.95Å
185	A	88.1	Confident	90	Very high	39 Å²	39	58.6 Å²	58.6	32%	0.322	30%	0.298	S	S	.	.	H	α-helix	trans	-79.3	-41.5	-178.9	0	0	0	0	0	113	C181 L182 T355 I358	C181-A185 WeakPolarHBondContact O-CB 3.45Å; C181-A185 PolarHBondContact O-N 3.42Å; L182-A185 PolarHBondContact O-N 2.95Å; A185-T355 HydrophobicContact CB-CG2 3.92Å; A185-I358 HydrophobicContact CB-CD1 3.66Å
186	F	86.6	Confident	89.9	Confident	40 Å²	40	57.9 Å²	57.9	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-129.7	9.2	-164.4	-50.5	-51.8	0	0	0	113.9	L182 W190 F353 T355 I358	L182-F186 HydrophobicContact CD2-CD2 4.13Å; L182-F186 HydrophobicContact CD2-CE2 4.08Å; L182-F186 PolarHBondContact O-N 2.97Å; F186-W190 HydrophobicContact CB-CB 3.94Å; F186-W190 HydrophobicContact CD2-CB 4.24Å; F186-F353 HydrophobicContact CD1-CD1 4.22Å; F186-F353 HydrophobicContact CD2-CD1 4.28Å; F186-F353 HydrophobicContact CE1-CB 4.45Å; F186-F353 HydrophobicContact CE1-CD1 4.09Å; F186-F353 HydrophobicContact CE2-CD1 4.13Å; F186-F353 HydrophobicContact CG-CD1 4.33Å; F186-F353 HydrophobicContact CZ-CB 4.04Å; F186-F353 HydrophobicContact CZ-CD1 4.05Å; F186-T355 HydrophobicContact CE1-CG2 3.64Å; F186-T355 HydrophobicContact CZ-CG2 3.95Å; F186-I358 HydrophobicContact CD2-CD1 4.45Å; F186-I358 HydrophobicContact CE2-CB 4.29Å; F186-I358 HydrophobicContact CE2-CD1 3.9Å; F186-I358 HydrophobicContact CE2-CG2 3.85Å; F186-I358 HydrophobicContact CZ-CB 4.32Å; F186-I358 HydrophobicContact CZ-CG2 4.07Å
187	G	88.3	Confident	89.7	Confident	36 Å²	36	58.4 Å²	58.4	37%	0.371	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	-156.9	-176.3	0	0	0	0	0	112.9	R183 A189	R183-G187 WeakPolarHBondContact CA-O 3.43Å; R183-G187 VanDerWaalsContact O-CA 3.28Å; R183-G187 WeakPolarHBondContact O-CA 3.34Å; R183-G187 PolarHBondContact O-N 3.47Å; G187-A189 VanDerWaalsContact C-N 3.33Å
188	E	86.7	Confident	89.6	Confident	96 Å²	96	59.4 Å²	59.4	45%	0.449	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.5	174.2	-71.7	-68.3	163.7	0	0	112.9	R183 W190 R191	R183-E188 WeakPolarHBondContact CD-OE1 3.28Å; R183-E188 IonicContact NH1-OE1 3.93Å; E188-W190 VanDerWaalsContact C-N 3.29Å; E188-W190 PolarHBondContact O-N 2.99Å; E188-R191 IonicContact OE2-CZ 3.44Å; E188-R191 IonicContact OE2-NE 2.67Å; E188-R191 PolarHBondContact OE2-NE 2.9Å; E188-R191 IonicContact OE2-NH2 3.38Å
189	A	79.4	Confident	89.5	Confident	41 Å²	41	66.3 Å²	66.3	34%	0.339	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.4	-174.9	0	0	0	0	0	113.8	G187 R191 R192	G187-A189 VanDerWaalsContact C-N 3.33Å; A189-R191 PolarHBondContact O-N 3.26Å; A189-R192 PolarHBondContact O-N 3.43Å
190	W	86.6	Confident	89.4	Confident	10 Å²	10	70 Å²	70	4%	0.038	35%	0.349	C	S	.	.	H	α-helix	trans	-55.6	-27.7	179.9	70.9	-98.6	0	0	0	113.2	K179 L182 F186 E188 R192 V193 L194 F196	K179-W190 HydrophobicContact CG-CH2 4.47Å; K179-W190 HydrophobicContact CG-CZ2 4.31Å; L182-W190 HydrophobicContact CB-CD2 3.84Å; L182-W190 HydrophobicContact CB-CE3 4.5Å; L182-W190 HydrophobicContact CB-CG 3.95Å; L182-W190 HydrophobicContact CB-CZ2 4.22Å; L182-W190 HydrophobicContact CD1-CD2 4.12Å; L182-W190 HydrophobicContact CD1-CE3 3.96Å; L182-W190 HydrophobicContact CD1-CH2 3.86Å; L182-W190 HydrophobicContact CD1-CZ2 4.03Å; L182-W190 HydrophobicContact CD1-CZ3 3.83Å; L182-W190 HydrophobicContact CG-CD2 4.45Å; F186-W190 HydrophobicContact CB-CB 3.94Å; F186-W190 HydrophobicContact CD2-CB 4.24Å; E188-W190 VanDerWaalsContact C-N 3.29Å; E188-W190 PolarHBondContact O-N 2.99Å; W190-R192 PolarHBondContact O-N 2.82Å; W190-V193 PolarHBondContact O-N 2.87Å; W190-V193 VanDerWaalsContact O-N 3.12Å; W190-L194 HydrophobicContact CE3-CB 4.38Å; W190-L194 PolarHBondContact O-N 3.02Å; W190-F196 HydrophobicContact CE3-CE2 4.26Å; W190-F196 HydrophobicContact CZ3-CD2 4.12Å; W190-F196 AromaticContact CZ3-CE2 3.71Å; W190-F196 HydrophobicContact CZ3-CE2 3.71Å
191	R	86.6	Confident	89.4	Confident	126 Å²	126	65.6 Å²	65.6	48%	0.475	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-25	179.8	-62.7	176	-176.8	-79.1	1.7	113.3	E188 A189	E188-R191 IonicContact OE2-CZ 3.44Å; E188-R191 IonicContact OE2-NE 2.67Å; E188-R191 PolarHBondContact OE2-NE 2.9Å; E188-R191 IonicContact OE2-NH2 3.38Å; A189-R191 PolarHBondContact O-N 3.26Å
192	R	84.6	Confident	89.2	Confident	160 Å²	160	68.9 Å²	68.9	60%	0.604	35%	0.353	S	S	*	.	H	α-helix	trans	-83	-24.3	177	-60.6	-171.4	-71.9	-131	1.9	111.7	A189 W190 R216 Q219	A189-R192 PolarHBondContact O-N 3.43Å; W190-R192 PolarHBondContact O-N 2.82Å; R192-R216 WeakPolarHBondContact O-CD 3.29Å; R192-Q219 VanDerWaalsContact CB-OE1 3.24Å
193	V	86.1	Confident	89	Confident	12 Å²	12	69.9 Å²	69.9	7%	0.073	36%	0.363	C	S	.	.	H	α-helix	trans	-99.2	-43.9	-176.5	-171.6	0	0	0	0	112.2	W190 A215 R216 Q219 V220 F353	W190-V193 PolarHBondContact O-N 2.87Å; W190-V193 VanDerWaalsContact O-N 3.12Å; V193-A215 CarbonylContact O-C 3.45Å; V193-A215 VanDerWaalsContact O-CA 3.29Å; V193-A215 WeakPolarHBondContact O-CA 3.42Å; V193-R216 PolarHBondContact O-N 3.34Å; V193-Q219 HydrophobicContact CG2-CB 4.18Å; V193-V220 HydrophobicContact CG1-CG2 3.72Å; V193-F353 HydrophobicContact CB-CE1 4.4Å; V193-F353 HydrophobicContact CB-CZ 3.99Å; V193-F353 HydrophobicContact CG1-CE1 4.25Å; V193-F353 HydrophobicContact CG1-CE2 3.85Å; V193-F353 HydrophobicContact CG1-CZ 3.47Å; V193-F353 VanDerWaalsContact CG1-CZ 3.47Å; V193-F353 HydrophobicContact CG2-CZ 4.2Å
194	L	90.8	Very high	88.8	Confident	3 Å²	3	64 Å²	64	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.4	-174.7	-58.2	175.8	0	0	0	111.1	L182 W190 F196 W214 A215 I271 F353 V360	L182-L194 HydrophobicContact CD2-CD1 4.29Å; W190-L194 HydrophobicContact CE3-CB 4.38Å; W190-L194 PolarHBondContact O-N 3.02Å; L194-F196 HydrophobicContact CB-CE2 4.32Å; L194-W214 WeakPolarHBondContact CA-O 3.4Å; L194-A215 HydrophobicContact CD2-CB 3.97Å; L194-I271 HydrophobicContact CB-CD1 4.34Å; L194-I271 HydrophobicContact CD1-CD1 4.41Å; L194-I271 HydrophobicContact CD2-CD1 4.5Å; L194-F353 HydrophobicContact CD1-CD1 4.32Å; L194-V360 HydrophobicContact CD1-CG2 4.07Å; L194-V360 HydrophobicContact CD2-CG1 4.17Å
195	V	91.5	Very high	88.5	Confident	56 Å²	56	60.5 Å²	60.5	34%	0.339	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.6	176.6	-176.3	0	0	0	0	108.4	G213 W214	V195-G213 CarbonylContact O-C 3.55Å; V195-G213 WeakPolarHBondContact O-CA 3.39Å; V195-W214 HydrophobicContact CB-CB 4.42Å; V195-W214 PolarHBondContact N-O 3.47Å; V195-W214 PolarHBondContact O-N 3.46Å
196	F	93.3	Very high	88.3	Confident	33 Å²	33	59.2 Å²	59.2	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136	179.7	-73.4	-111.4	0	0	0	109.9	W175 L182 W190 L194 Y211 I271	W175-F196 HydrophobicContact CH2-CB 4.25Å; W175-F196 AromaticContact CH2-CD1 3.54Å; W175-F196 HydrophobicContact CH2-CD1 3.54Å; W175-F196 AromaticContact CH2-CD2 3.86Å; W175-F196 HydrophobicContact CH2-CD2 3.86Å; W175-F196 AromaticContact CH2-CE1 3.74Å; W175-F196 HydrophobicContact CH2-CE1 3.74Å; W175-F196 HydrophobicContact CH2-CE2 4.05Å; W175-F196 AromaticContact CH2-CG 3.61Å; W175-F196 HydrophobicContact CH2-CG 3.61Å; W175-F196 AromaticContact CH2-CZ 3.99Å; W175-F196 HydrophobicContact CH2-CZ 3.99Å; W175-F196 AromaticContact CZ3-CD1 3.69Å; W175-F196 HydrophobicContact CZ3-CD1 3.69Å; W175-F196 AromaticContact CZ3-CE1 3.75Å; W175-F196 HydrophobicContact CZ3-CE1 3.75Å; W175-F196 HydrophobicContact CZ3-CG 4.23Å; W175-F196 HydrophobicContact CZ3-CZ 4.34Å; L182-F196 HydrophobicContact CD1-CE2 3.87Å; L182-F196 HydrophobicContact CD1-CZ 3.64Å; W190-F196 HydrophobicContact CE3-CE2 4.26Å; W190-F196 HydrophobicContact CZ3-CD2 4.12Å; W190-F196 AromaticContact CZ3-CE2 3.71Å; W190-F196 HydrophobicContact CZ3-CE2 3.71Å; L194-F196 HydrophobicContact CB-CE2 4.32Å; F196-Y211 AromaticContact CD1-CD1 3.93Å; F196-Y211 HydrophobicContact CD1-CD1 3.93Å; F196-Y211 AromaticContact CD1-CG 3.79Å; F196-Y211 HydrophobicContact CD1-CG 3.79Å; F196-Y211 HydrophobicContact CE1-CD1 4.12Å; F196-Y211 AromaticContact CE1-CD2 3.92Å; F196-Y211 HydrophobicContact CE1-CD2 3.92Å; F196-Y211 AromaticContact CE1-CG 3.59Å; F196-Y211 HydrophobicContact CE1-CG 3.59Å; F196-I271 HydrophobicContact CD1-CD1 4.2Å; F196-I271 HydrophobicContact CD2-CD1 4.19Å; F196-I271 HydrophobicContact CE1-CB 4.18Å; F196-I271 HydrophobicContact CE1-CD1 3.69Å; F196-I271 HydrophobicContact CE1-CG2 4.17Å; F196-I271 HydrophobicContact CE2-CD1 3.67Å; F196-I271 HydrophobicContact CG-CD1 4.43Å; F196-I271 HydrophobicContact CZ-CB 4.23Å; F196-I271 HydrophobicContact CZ-CD1 3.39Å; F196-I271 HydrophobicContact CZ-CG1 4.38Å; F196-I271 HydrophobicContact CZ-CG2 3.87Å
197	D	91.1	Very high	88.4	Confident	75 Å²	75	57.7 Å²	57.7	40%	0.401	31%	0.311	S	S	.	.	S	Bend	trans	-67.2	-40.9	175.7	-64	-32.4	0	0	0	111.4	R212 W214	D197-R212 PolarHBondContact N-O 3.08Å; D197-R212 VanDerWaalsContact N-O 3.14Å; D197-R212 IonicContact OD1-NH1 2.8Å; D197-R212 WeakPolarHBondContact OD2-CB 3.32Å; D197-R212 VanDerWaalsContact OD2-CD 3.31Å; D197-R212 WeakPolarHBondContact OD2-CD 3.49Å; D197-R212 WeakPolarHBondContact OD2-CG 3.4Å; D197-R212 IonicContact OD2-CZ 2.61Å; D197-R212 IonicContact OD2-NE 3.79Å; D197-R212 IonicContact OD2-NH1 3.81Å; D197-R212 PolarHBondContact OD2-NH1 2.91Å; D197-W214 VanDerWaalsContact OD1-CD1 3.25Å; D197-W214 PolarHBondContact OD1-NE1 3.45Å
198	S	92.9	Very high	88.6	Confident	58 Å²	58	56.7 Å²	56.7	41%	0.406	30%	0.3	S	S	.	.			trans	-145.2	157.1	-178.7	-178.4	0	0	0	0	111.4	E200	S198-E200 PolarHBondContact OG-N 2.67Å; S198-E200 VanDerWaalsContact OG-N 3.09Å
199	K	92.5	Very high	89	Confident	146 Å²	146	52.1 Å²	52.1	64%	0.635	28%	0.278	S	S	*	.	S	Bend	trans	-79.5	-11.2	170.1	-63.1	173.7	-172.7	160.1	0	112.1	W175 Y211	W175-K199 HydrophobicContact CB-CB 4.47Å; W175-K199 HydrophobicContact CD2-CB 4.16Å; W175-K199 HydrophobicContact CD2-CG 4.07Å; W175-K199 HydrophobicContact CE3-CB 4.43Å; W175-K199 HydrophobicContact CG-CB 4.15Å; W175-K199 HydrophobicContact CG-CD 4.35Å; W175-K199 HydrophobicContact CG-CG 4.12Å; K199-Y211 WeakPolarHBondContact O-CE1 3.43Å
200	E	92.3	Very high	89.7	Confident	153 Å²	153	52.1 Å²	52.1	72%	0.715	27%	0.274	S	S	*	.	S	Bend	trans	-88.4	131.7	174.6	-62.6	-171.4	167.5	0	0	109.7	S198	S198-E200 PolarHBondContact OG-N 2.67Å; S198-E200 VanDerWaalsContact OG-N 3.09Å
201	P	93.1	Very high	90.1	Very high	35 Å²	35	51.7 Å²	51.7	23%	0.227	27%	0.272	C	S	.	.			trans	-72.9	144.6	178	31.2	-34.6	0	0	0	110.9	P172 G203 Q209 V210 Y211	P172-P201 HydrophobicContact CB-CG 3.73Å; P201-G203 VanDerWaalsContact C-N 3.32Å; P201-Q209 HydrophobicContact CB-CB 4.12Å; P201-Q209 HydrophobicContact CB-CG 4.06Å; P201-Q209 HydrophobicContact CG-CG 4.47Å; P201-V210 CarbonylContact C-O 3.6Å; P201-V210 VanDerWaalsContact CA-O 3.27Å; P201-V210 WeakPolarHBondContact CA-O 3.43Å; P201-V210 VanDerWaalsContact CB-O 3.26Å; P201-V210 WeakPolarHBondContact CB-O 3.29Å; P201-Y211 HydrophobicContact CB-CD1 4.29Å; P201-Y211 HydrophobicContact CB-CE1 4.08Å
202	V	88.9	Confident	90.5	Very high	84 Å²	84	48.7 Å²	48.7	51%	0.509	26%	0.261	S	S	.	.	S	Bend	trans	-67	-38.6	174.2	-178.9	0	0	0	0	110.6	K169 V210 R212	K169-V202 PolarHBondContact NZ-O 2.98Å; V202-V210 PolarHBondContact N-O 2.96Å; V202-R212 HydrophobicContact CG2-CB 3.73Å
203	G	87.3	Confident	90.9	Very high	21 Å²	21	41 Å²	41	22%	0.216	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.9	178.7	0	0	0	0	0	111.5	P201 Q209 V210	P201-G203 VanDerWaalsContact C-N 3.32Å; G203-Q209 CarbonylContact O-C 3.46Å; G203-Q209 WeakPolarHBondContact O-CA 3.26Å; G203-Q209 WeakPolarHBondContact O-CB 3.23Å; G203-V210 PolarHBondContact N-O 3.39Å; G203-V210 PolarHBondContact O-N 3.49Å
204	S	87.4	Confident	91.2	Very high	11 Å²	11	44.3 Å²	44.3	8%	0.077	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	108.9	175.7	177.2	0	0	0	0	108.9	V170 H275	V170-S204 PolarHBondContact N-O 3.48Å; V170-S204 WeakPolarHBondContact O-CB 3.41Å; V170-S204 PolarHBondContact O-OG 2.98Å; S204-H275 PolarHBondContact OG-CE1 3.44Å
205	G	85.6	Confident	91.1	Very high	36 Å²	36	44.2 Å²	44.2	37%	0.371	24%	0.242	S	C	.	.			trans	-89.2	-177.6	173.2	0	0	0	0	0	111.4	A208 H275	G205-A208 CarbonylContact C-O 3.46Å; G205-A208 WeakPolarHBondContact CA-O 3.21Å; G205-A208 PolarHBondContact N-O 3.49Å; G205-H275 PolarHBondContact O-CD2 2.73Å; G205-H275 PolarHBondContact O-NE2 2.94Å
206	C	83.9	Confident	90.8	Very high	12 Å²	12	44.5 Å²	44.5	8%	0.081	24%	0.237	C	C	.	.	S	Bend	trans	-73.5	-29.9	-176.8	61.6	0	0	0	0	113.9	P139 I142 K143 V170	P139-C206 WeakPolarHBondContact CB-O 3.37Å; I142-C206 HydrophobicContact CB-CB 4.41Å; I142-C206 HydrophobicContact CG2-CB 3.95Å; K143-C206 VanDerWaalsContact CD-SG 3.51Å; K143-C206 WeakPolarHBondContact CE-SG 3.31Å; K143-C206 VanDerWaalsContact CG-SG 3.51Å; V170-C206 HydrophobicContact CG2-CB 4.16Å
207	V	88.6	Confident	89.7	Confident	7 Å²	7	43 Å²	43	4%	0.042	23%	0.231	C	C	.	.	S	Bend	trans	-99.9	-38.4	-179.4	176.2	0	0	0	0	112.1	V274 H275 V278 Q321 I322	V207-V274 HydrophobicContact CG1-CG1 4.38Å; V207-H275 VanDerWaalsContact C-CD2 3.42Å; V207-H275 WeakPolarHBondContact O-CB 3.35Å; V207-H275 PolarHBondContact O-CD2 3.37Å; V207-H275 PolarHBondContact O-N 3.5Å; V207-V278 HydrophobicContact CG1-CG1 4.28Å; V207-Q321 WeakPolarHBondContact CG1-O 2.86Å; V207-I322 HydrophobicContact CG1-CG2 4.17Å; V207-I322 HydrophobicContact CG2-CG2 4.44Å
208	A	92	Very high	88.5	Confident	16 Å²	16	43.4 Å²	43.4	13%	0.132	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	164.8	-175.1	0	0	0	0	0	111.2	G205 V273 V274	G205-A208 CarbonylContact C-O 3.46Å; G205-A208 WeakPolarHBondContact CA-O 3.21Å; G205-A208 PolarHBondContact N-O 3.49Å; A208-V273 CarbonylContact C-O 3.59Å; A208-V273 VanDerWaalsContact CA-O 3.22Å; A208-V273 WeakPolarHBondContact CA-O 3.3Å; A208-V273 WeakPolarHBondContact CB-O 3.27Å; A208-V274 HydrophobicContact CB-CG2 4.4Å
209	Q	93.6	Very high	87.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.4	168.5	73.9	-167.6	47.7	0	0	110.7	H173 P201 G203 Y211 K272 V273 H275	H173-Q209 VanDerWaalsContact CE1-CG 3.44Å; H173-Q209 WeakPolarHBondContact CE1-CG 2.97Å; H173-Q209 PolarHBondContact CE1-OE1 3.35Å; H173-Q209 VanDerWaalsContact CG-OE1 3.24Å; H173-Q209 VanDerWaalsContact ND1-CD 3.35Å; H173-Q209 PolarHBondContact ND1-OE1 3.47Å; H173-Q209 PolarHBondContact O-NE2 3.07Å; P201-Q209 HydrophobicContact CB-CB 4.12Å; P201-Q209 HydrophobicContact CB-CG 4.06Å; P201-Q209 HydrophobicContact CG-CG 4.47Å; G203-Q209 CarbonylContact O-C 3.46Å; G203-Q209 WeakPolarHBondContact O-CA 3.26Å; G203-Q209 WeakPolarHBondContact O-CB 3.23Å; Q209-Y211 HydrophobicContact CG-CE2 3.88Å; Q209-Y211 PolarHBondContact NE2-OH 2.93Å; Q209-K272 CarbonylContact O-C 3.57Å; Q209-K272 WeakPolarHBondContact O-CA 3.35Å; Q209-V273 PolarHBondContact N-O 2.91Å; Q209-V273 PolarHBondContact O-N 3.42Å; Q209-H275 PolarHBondContact OE1-CE1 2.91Å
210	V	94.3	Very high	85.7	Confident	40 Å²	40	38.6 Å²	38.6	24%	0.242	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.5	-169.7	-165.7	0	0	0	0	109.7	P201 V202 G203 A270 I271 K272	P201-V210 CarbonylContact C-O 3.6Å; P201-V210 VanDerWaalsContact CA-O 3.27Å; P201-V210 WeakPolarHBondContact CA-O 3.43Å; P201-V210 VanDerWaalsContact CB-O 3.26Å; P201-V210 WeakPolarHBondContact CB-O 3.29Å; V202-V210 PolarHBondContact N-O 2.96Å; G203-V210 PolarHBondContact N-O 3.39Å; G203-V210 PolarHBondContact O-N 3.49Å; V210-A270 HydrophobicContact CG1-CB 4.05Å; V210-I271 WeakPolarHBondContact CA-O 3.22Å; V210-K272 HydrophobicContact CB-CG 4.37Å; V210-K272 HydrophobicContact CG1-CG 3.95Å; V210-K272 HydrophobicContact CG2-CG 3.84Å
211	Y	95.8	Very high	84.1	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149.7	173	-63.7	-90.8	0	0	0	110.3	W175 T178 F196 K199 P201 Q209 A270 I271 V273	W175-Y211 AromaticContact CE3-CE1 3.81Å; W175-Y211 HydrophobicContact CE3-CE1 3.81Å; W175-Y211 AromaticContact CE3-CZ 3.87Å; W175-Y211 HydrophobicContact CZ3-CD1 4.13Å; W175-Y211 AromaticContact CZ3-CE1 3.73Å; W175-Y211 HydrophobicContact CZ3-CE1 3.73Å; W175-Y211 HydrophobicContact CZ3-CE2 4.5Å; W175-Y211 AromaticContact CZ3-CZ 3.9Å; T178-Y211 HydrophobicContact CG2-CD2 4.3Å; T178-Y211 HydrophobicContact CG2-CE2 3.59Å; T178-Y211 PolarHBondContact OG1-OH 3.08Å; F196-Y211 AromaticContact CD1-CD1 3.93Å; F196-Y211 HydrophobicContact CD1-CD1 3.93Å; F196-Y211 AromaticContact CD1-CG 3.79Å; F196-Y211 HydrophobicContact CD1-CG 3.79Å; F196-Y211 HydrophobicContact CE1-CD1 4.12Å; F196-Y211 AromaticContact CE1-CD2 3.92Å; F196-Y211 HydrophobicContact CE1-CD2 3.92Å; F196-Y211 AromaticContact CE1-CG 3.59Å; F196-Y211 HydrophobicContact CE1-CG 3.59Å; K199-Y211 WeakPolarHBondContact O-CE1 3.43Å; P201-Y211 HydrophobicContact CB-CD1 4.29Å; P201-Y211 HydrophobicContact CB-CE1 4.08Å; Q209-Y211 HydrophobicContact CG-CE2 3.88Å; Q209-Y211 PolarHBondContact NE2-OH 2.93Å; Y211-A270 CarbonylContact O-C 3.58Å; Y211-A270 WeakPolarHBondContact O-CA 3.46Å; Y211-I271 PolarHBondContact N-O 3.41Å; Y211-I271 PolarHBondContact O-N 3.41Å; Y211-V273 HydrophobicContact CD2-CG2 4.31Å; Y211-V273 HydrophobicContact CE2-CG2 4.32Å
212	R	94.8	Very high	82.5	Confident	63 Å²	63	41 Å²	41	24%	0.238	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.2	166.2	-168.7	-176.9	178.6	-86.6	2.2	109.5	D197 V202 F363 E365	D197-R212 PolarHBondContact N-O 3.08Å; D197-R212 VanDerWaalsContact N-O 3.14Å; D197-R212 IonicContact OD1-NH1 2.8Å; D197-R212 WeakPolarHBondContact OD2-CB 3.32Å; D197-R212 VanDerWaalsContact OD2-CD 3.31Å; D197-R212 WeakPolarHBondContact OD2-CD 3.49Å; D197-R212 WeakPolarHBondContact OD2-CG 3.4Å; D197-R212 IonicContact OD2-CZ 2.61Å; D197-R212 IonicContact OD2-NE 3.79Å; D197-R212 IonicContact OD2-NH1 3.81Å; D197-R212 PolarHBondContact OD2-NH1 2.91Å; V202-R212 HydrophobicContact CG2-CB 3.73Å; R212-F363 HydrophobicContact CB-CD2 4.49Å; R212-F363 HydrophobicContact CB-CE2 4.37Å; R212-F363 HydrophobicContact CG-CD1 4.39Å; R212-F363 HydrophobicContact CG-CD2 3.92Å; R212-F363 HydrophobicContact CG-CE1 4.43Å; R212-F363 HydrophobicContact CG-CE2 3.98Å; R212-F363 HydrophobicContact CG-CG 4.14Å; R212-F363 HydrophobicContact CG-CZ 4.24Å; R212-E365 IonicContact CZ-OE1 3.65Å; R212-E365 IonicContact NE-OE1 2.98Å; R212-E365 PolarHBondContact NE-OE1 2.88Å; R212-E365 IonicContact NH2-OE1 2.63Å; R212-E365 PolarHBondContact NH2-OE1 2.67Å
213	G	93.6	Very high	81	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	-161.1	177.7	0	0	0	0	0	112	V195 V269	V195-G213 CarbonylContact O-C 3.55Å; V195-G213 WeakPolarHBondContact O-CA 3.39Å; G213-V269 PolarHBondContact N-O 2.65Å; G213-V269 PolarHBondContact O-N 3.47Å
214	W	91.8	Very high	79.6	Confident	81 Å²	81	43.3 Å²	43.3	31%	0.307	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.8	-178.1	-56.6	83.5	0	0	0	110.2	L194 V195 D197 L266 I267 P268	L194-W214 WeakPolarHBondContact CA-O 3.4Å; V195-W214 HydrophobicContact CB-CB 4.42Å; V195-W214 PolarHBondContact N-O 3.47Å; V195-W214 PolarHBondContact O-N 3.46Å; D197-W214 VanDerWaalsContact OD1-CD1 3.25Å; D197-W214 PolarHBondContact OD1-NE1 3.45Å; W214-L266 HydrophobicContact CB-CB 4.46Å; W214-L266 HydrophobicContact CB-CD2 4.38Å; W214-L266 HydrophobicContact CE3-CB 3.9Å; W214-I267 CarbonylContact C-O 3.51Å; W214-I267 WeakPolarHBondContact CA-O 3.24Å; W214-P268 HydrophobicContact CE3-CB 4Å; W214-P268 HydrophobicContact CH2-CB 4.15Å; W214-P268 HydrophobicContact CZ3-CB 3.78Å; W214-P268 HydrophobicContact CZ3-CG 4.21Å
215	A	89.1	Confident	78.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.8	172.4	0	0	0	0	0	110.8	V193 L194 F225 L266 I267 V269 L350	V193-A215 CarbonylContact O-C 3.45Å; V193-A215 VanDerWaalsContact O-CA 3.29Å; V193-A215 WeakPolarHBondContact O-CA 3.42Å; L194-A215 HydrophobicContact CD2-CB 3.97Å; A215-F225 HydrophobicContact CB-CZ 3.9Å; A215-L266 WeakPolarHBondContact O-CA 3.46Å; A215-I267 PolarHBondContact N-O 3.21Å; A215-I267 PolarHBondContact O-N 3.38Å; A215-V269 HydrophobicContact CB-CG1 3.68Å; A215-V269 HydrophobicContact CB-CG2 4.31Å; A215-L350 HydrophobicContact CB-CD2 4.05Å
216	R	85.6	Confident	77	Confident	63 Å²	63	44.6 Å²	44.6	24%	0.238	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	115	177.7	-52.6	-158.4	176.2	-149	-26.7	110.6	R192 V193 E264 L266	R192-R216 WeakPolarHBondContact O-CD 3.29Å; V193-R216 PolarHBondContact O-N 3.34Å; R216-E264 IonicContact CZ-OE1 3.69Å; R216-E264 IonicContact CZ-OE2 2.69Å; R216-E264 IonicContact NE-OE2 2.82Å; R216-E264 IonicContact NH1-OE1 2.6Å; R216-E264 PolarHBondContact NH1-OE1 2.87Å; R216-E264 IonicContact NH1-OE2 3.83Å; R216-E264 PolarHBondContact NH1-OE2 3.31Å; R216-E264 IonicContact NH2-OE1 3.61Å; R216-E264 IonicContact NH2-OE2 2.86Å; R216-E264 PolarHBondContact NH2-OE2 3.35Å; R216-L266 HydrophobicContact CB-CD2 4.39Å; R216-L266 HydrophobicContact CG-CD2 3.7Å
217	V	69.6	Low	75.9	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-66.2	-43.6	-176.2	176.4	0	0	0	0	112.1	Q219 V220 F225 V229 R265 I267	V217-Q219 PolarHBondContact O-N 2.8Å; V217-V220 PolarHBondContact O-N 3.5Å; V217-F225 HydrophobicContact CB-CD1 4.26Å; V217-F225 HydrophobicContact CB-CE1 4.01Å; V217-F225 HydrophobicContact CG1-CD1 4.05Å; V217-F225 HydrophobicContact CG1-CE1 4.31Å; V217-F225 HydrophobicContact CG2-CD1 4.27Å; V217-F225 HydrophobicContact CG2-CE1 3.74Å; V217-V229 HydrophobicContact CB-CG2 4.1Å; V217-V229 HydrophobicContact CG1-CB 4.31Å; V217-V229 HydrophobicContact CG1-CG1 4.36Å; V217-V229 HydrophobicContact CG1-CG2 3.63Å; V217-V229 HydrophobicContact CG2-CB 4.45Å; V217-V229 HydrophobicContact CG2-CG1 4.37Å; V217-V229 HydrophobicContact CG2-CG2 3.3Å; V217-R265 HydrophobicContact CB-CB 3.68Å; V217-R265 HydrophobicContact CG1-CB 4.34Å; V217-R265 HydrophobicContact CG2-CB 3.79Å; V217-R265 VanDerWaalsContact CG2-O 3.31Å; V217-R265 WeakPolarHBondContact CG2-O 3.48Å; V217-R265 PolarHBondContact N-O 3.47Å; V217-I267 HydrophobicContact CG2-CD1 3.84Å; V217-I267 HydrophobicContact CG2-CG1 3.61Å
218	D	66.1	Low	74.6	Confident	83 Å²	83	47.5 Å²	47.5	44%	0.444	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-68	-4.5	-170.1	-47.5	-49.3	0	0	0	113.1	R265	D218-R265 PolarHBondContact OD2-N 3.45Å
219	Q	64.7	Low	73.1	Confident	97 Å²	97	47.2 Å²	47.2	45%	0.453	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-112.8	9.7	178.8	-58.1	-154.2	10.7	0	0	113.9	R192 V193 V217	R192-Q219 VanDerWaalsContact CB-OE1 3.24Å; V193-Q219 HydrophobicContact CG2-CB 4.18Å; V217-Q219 PolarHBondContact O-N 2.8Å
220	V	62.2	Low	71.5	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.042	27%	0.272	C	S	.	.			trans	-118.5	107	179.6	-173.8	0	0	0	0	109.4	V193 V217 D222 F225 H226 F353	V193-V220 HydrophobicContact CG1-CG2 3.72Å; V217-V220 PolarHBondContact O-N 3.5Å; V220-D222 HydrophobicContact CG1-CB 3.91Å; V220-D222 PolarHBondContact O-N 3.43Å; V220-F225 HydrophobicContact CB-CB 4.43Å; V220-F225 HydrophobicContact CB-CD1 3.98Å; V220-F225 HydrophobicContact CB-CD2 4.32Å; V220-F225 HydrophobicContact CB-CE1 4.34Å; V220-F225 HydrophobicContact CB-CG 4Å; V220-F225 HydrophobicContact CG1-CB 3.98Å; V220-F225 HydrophobicContact CG1-CD1 4.3Å; V220-F225 HydrophobicContact CG1-CD2 3.84Å; V220-F225 HydrophobicContact CG1-CE2 4.36Å; V220-F225 HydrophobicContact CG1-CG 3.78Å; V220-F225 HydrophobicContact CG2-CD1 4.32Å; V220-F225 HydrophobicContact CG2-CD2 4.5Å; V220-F225 HydrophobicContact CG2-CE1 4.17Å; V220-F225 HydrophobicContact CG2-CE2 4.28Å; V220-F225 HydrophobicContact CG2-CG 4.5Å; V220-F225 HydrophobicContact CG2-CZ 4.14Å; V220-H226 PolarHBondContact O-NE2 3.48Å; V220-F353 HydrophobicContact CG1-CE2 4.31Å; V220-F353 HydrophobicContact CG2-CE2 3.76Å; V220-F353 HydrophobicContact CG2-CZ 4.16Å
221	E	57.3	Low	69.9	Low	195 Å²	195	57.5 Å²	57.5	91%	0.911	29%	0.287	S	S	*	.			trans	-75	21.3	-179.5	-62.3	178.5	177	0	0	114.1
222	D	59.8	Low	68.1	Low	44 Å²	44	60.3 Å²	60.3	24%	0.235	30%	0.301	C	S	.	.			trans	-93.9	119.2	-177.3	-168.6	-31.8	0	0	0	110.4	V220 S224 F225 H226	V220-D222 HydrophobicContact CG1-CB 3.91Å; V220-D222 PolarHBondContact O-N 3.43Å; D222-S224 PolarHBondContact O-N 3.23Å; D222-S224 WeakPolarHBondContact OD1-CB 3.49Å; D222-S224 PolarHBondContact OD1-N 2.77Å; D222-S224 PolarHBondContact OD1-OG 3.25Å; D222-S224 PolarHBondContact OD2-OG 2.75Å; D222-F225 HydrophobicContact CB-CB 4.15Å; D222-F225 WeakPolarHBondContact O-CA 3.36Å; D222-F225 WeakPolarHBondContact O-CB 3.36Å; D222-F225 PolarHBondContact O-N 3.19Å; D222-H226 PolarHBondContact O-N 2.87Å
223	P	58.8	Low	66.3	Low	102 Å²	102	60.5 Å²	60.5	66%	0.662	30%	0.304	S	S	*	.	H	α-helix	trans	-56.8	-31.5	179.4	-24.7	33.7	0	0	0	113.8	F225 H226 S227	P223-F225 PolarHBondContact O-N 2.83Å; P223-H226 PolarHBondContact O-N 2.61Å; P223-S227 PolarHBondContact O-N 3.09Å; P223-S227 VanDerWaalsContact O-N 3.1Å
224	S	58.1	Low	64.5	Low	51 Å²	51	68.3 Å²	68.3	36%	0.357	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-27	176.1	64.7	0	0	0	0	112.4	D222 S227 I228	D222-S224 PolarHBondContact O-N 3.23Å; D222-S224 WeakPolarHBondContact OD1-CB 3.49Å; D222-S224 PolarHBondContact OD1-N 2.77Å; D222-S224 PolarHBondContact OD1-OG 3.25Å; D222-S224 PolarHBondContact OD2-OG 2.75Å; S224-S227 WeakPolarHBondContact CA-OG 3.47Å; S224-S227 PolarHBondContact O-OG 3.27Å; S224-I228 VanDerWaalsContact O-CD1 3.29Å; S224-I228 WeakPolarHBondContact O-CD1 3.47Å; S224-I228 VanDerWaalsContact O-CG1 3.23Å; S224-I228 WeakPolarHBondContact O-CG1 3.26Å; S224-I228 PolarHBondContact O-N 2.67Å
225	F	59.1	Low	62.8	Low	1 Å²	1	69.1 Å²	69.1	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-73.6	-40.1	176.1	-152.1	-88.2	0	0	0	111.2	A215 V217 V220 D222 P223 V229 I267 L350	A215-F225 HydrophobicContact CB-CZ 3.9Å; V217-F225 HydrophobicContact CB-CD1 4.26Å; V217-F225 HydrophobicContact CB-CE1 4.01Å; V217-F225 HydrophobicContact CG1-CD1 4.05Å; V217-F225 HydrophobicContact CG1-CE1 4.31Å; V217-F225 HydrophobicContact CG2-CD1 4.27Å; V217-F225 HydrophobicContact CG2-CE1 3.74Å; V220-F225 HydrophobicContact CB-CB 4.43Å; V220-F225 HydrophobicContact CB-CD1 3.98Å; V220-F225 HydrophobicContact CB-CD2 4.32Å; V220-F225 HydrophobicContact CB-CE1 4.34Å; V220-F225 HydrophobicContact CB-CG 4Å; V220-F225 HydrophobicContact CG1-CB 3.98Å; V220-F225 HydrophobicContact CG1-CD1 4.3Å; V220-F225 HydrophobicContact CG1-CD2 3.84Å; V220-F225 HydrophobicContact CG1-CE2 4.36Å; V220-F225 HydrophobicContact CG1-CG 3.78Å; V220-F225 HydrophobicContact CG2-CD1 4.32Å; V220-F225 HydrophobicContact CG2-CD2 4.5Å; V220-F225 HydrophobicContact CG2-CE1 4.17Å; V220-F225 HydrophobicContact CG2-CE2 4.28Å; V220-F225 HydrophobicContact CG2-CG 4.5Å; V220-F225 HydrophobicContact CG2-CZ 4.14Å; D222-F225 HydrophobicContact CB-CB 4.15Å; D222-F225 WeakPolarHBondContact O-CA 3.36Å; D222-F225 WeakPolarHBondContact O-CB 3.36Å; D222-F225 PolarHBondContact O-N 3.19Å; P223-F225 PolarHBondContact O-N 2.83Å; F225-V229 WeakPolarHBondContact O-CG2 3.29Å; F225-V229 PolarHBondContact O-N 3.05Å; F225-I267 HydrophobicContact CD1-CD1 4.14Å; F225-I267 HydrophobicContact CE1-CD1 3.51Å; F225-I267 HydrophobicContact CE1-CG1 4.42Å; F225-I267 HydrophobicContact CZ-CD1 3.78Å; F225-L350 HydrophobicContact CD2-CB 4.44Å; F225-L350 HydrophobicContact CD2-CD2 4.47Å; F225-L350 HydrophobicContact CD2-CG 4.08Å; F225-L350 HydrophobicContact CE2-CB 3.93Å; F225-L350 HydrophobicContact CE2-CD2 3.41Å; F225-L350 VanDerWaalsContact CE2-CD2 3.41Å; F225-L350 HydrophobicContact CE2-CG 3.45Å; F225-L350 VanDerWaalsContact CE2-CG 3.45Å; F225-L350 HydrophobicContact CZ-CD2 3.78Å; F225-L350 HydrophobicContact CZ-CG 4.25Å
226	H	59.1	Low	60.8	Low	72 Å²	72	74 Å²	74	33%	0.333	37%	0.367	S	S	.	.	H	α-helix	trans	-68	-38.5	176.4	-72.1	-68.4	0	0	0	112.3	V220 D222 P223 I228 V229 E230	V220-H226 PolarHBondContact O-NE2 3.48Å; D222-H226 PolarHBondContact O-N 2.87Å; P223-H226 PolarHBondContact O-N 2.61Å; H226-I228 VanDerWaalsContact C-N 3.35Å; H226-I228 PolarHBondContact O-N 3.2Å; H226-V229 PolarHBondContact O-N 3.37Å; H226-E230 WeakPolarHBondContact O-CG 3.18Å; H226-E230 PolarHBondContact O-N 3.29Å
227	S	59.5	Low	58.7	Low	61 Å²	61	75.6 Å²	75.6	43%	0.427	38%	0.38	S	S	.	.	H	α-helix	trans	-64.8	-36.4	177	59.1	0	0	0	0	113.1	P223 S224 V229 E230 E231	P223-S227 PolarHBondContact O-N 3.09Å; P223-S227 VanDerWaalsContact O-N 3.1Å; S224-S227 WeakPolarHBondContact CA-OG 3.47Å; S224-S227 PolarHBondContact O-OG 3.27Å; S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.96Å; S227-E230 PolarHBondContact O-N 3.44Å; S227-E231 WeakPolarHBondContact O-CB 3.45Å; S227-E231 PolarHBondContact O-N 3.05Å
228	I	62.7	Low	57.3	Low	19 Å²	19	79.5 Å²	79.5	10%	0.097	40%	0.4	C	S	.	.	H	α-helix	trans	-61.7	-40.4	175	-66.9	160.9	0	0	0	110.3	S224 H226 E231 M232 I267 T348 T362	S224-I228 VanDerWaalsContact O-CD1 3.29Å; S224-I228 WeakPolarHBondContact O-CD1 3.47Å; S224-I228 VanDerWaalsContact O-CG1 3.23Å; S224-I228 WeakPolarHBondContact O-CG1 3.26Å; S224-I228 PolarHBondContact O-N 2.67Å; H226-I228 VanDerWaalsContact C-N 3.35Å; H226-I228 PolarHBondContact O-N 3.2Å; I228-E231 PolarHBondContact O-N 3.33Å; I228-M232 HydrophobicContact CG2-CG 4.43Å; I228-M232 HydrophobicContact CG2-SD 4.04Å; I228-M232 WeakPolarHBondContact O-CB 3.29Å; I228-M232 VanDerWaalsContact O-CG 3.27Å; I228-M232 WeakPolarHBondContact O-CG 3.34Å; I228-M232 PolarHBondContact O-N 2.75Å; I228-I267 HydrophobicContact CG2-CD1 4.3Å; I228-T348 HydrophobicContact CD1-CG2 3.44Å; I228-T348 VanDerWaalsContact CD1-CG2 3.44Å; I228-T348 HydrophobicContact CG1-CG2 4.07Å; I228-T362 HydrophobicContact CG2-CG2 4.48Å
229	V	58.8	Low	56.1	Low	10 Å²	10	81.8 Å²	81.8	6%	0.061	41%	0.408	C	S	.	.	H	α-helix	trans	-71.5	-40.9	-179.1	177.1	0	0	0	0	111.1	V217 F225 H226 S227 E231 M232 E233 I267	V217-V229 HydrophobicContact CB-CG2 4.1Å; V217-V229 HydrophobicContact CG1-CB 4.31Å; V217-V229 HydrophobicContact CG1-CG1 4.36Å; V217-V229 HydrophobicContact CG1-CG2 3.63Å; V217-V229 HydrophobicContact CG2-CB 4.45Å; V217-V229 HydrophobicContact CG2-CG1 4.37Å; V217-V229 HydrophobicContact CG2-CG2 3.3Å; F225-V229 WeakPolarHBondContact O-CG2 3.29Å; F225-V229 PolarHBondContact O-N 3.05Å; H226-V229 PolarHBondContact O-N 3.37Å; S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.96Å; V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 2.98Å; V229-M232 PolarHBondContact O-N 2.95Å; V229-E233 HydrophobicContact CG1-CG 4.23Å; V229-E233 VanDerWaalsContact O-CB 3.27Å; V229-E233 WeakPolarHBondContact O-CB 3.41Å; V229-E233 VanDerWaalsContact O-CG 3.3Å; V229-E233 WeakPolarHBondContact O-CG 3.35Å; V229-E233 PolarHBondContact O-N 3.13Å; V229-I267 HydrophobicContact CG2-CD1 3.44Å; V229-I267 VanDerWaalsContact CG2-CD1 3.44Å; V229-I267 HydrophobicContact CG2-CG1 3.84Å
230	E	60	Low	54.8	Low	137 Å²	137	80.2 Å²	80.2	64%	0.64	41%	0.412	S	S	*	.	H	α-helix	trans	-62.3	-38.3	173.7	-73.1	179.3	178.8	0	0	111.7	H226 S227 R234	H226-E230 WeakPolarHBondContact O-CG 3.18Å; H226-E230 PolarHBondContact O-N 3.29Å; S227-E230 PolarHBondContact O-N 3.44Å; E230-R234 VanDerWaalsContact O-CB 3.28Å; E230-R234 WeakPolarHBondContact O-CB 3.39Å; E230-R234 PolarHBondContact O-N 3.08Å
231	E	61.5	Low	53.3	Low	120 Å²	120	89.8 Å²	89.8	56%	0.561	45%	0.447	S	S	*	.	H	α-helix	trans	-68.1	-45.1	175.9	-170	167.8	-151.7	0	0	112	S227 I228 V229 R234 E235	S227-E231 WeakPolarHBondContact O-CB 3.45Å; S227-E231 PolarHBondContact O-N 3.05Å; I228-E231 PolarHBondContact O-N 3.33Å; V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 2.98Å; E231-R234 WeakPolarHBondContact O-CB 3.47Å; E231-R234 PolarHBondContact O-N 3.13Å; E231-E235 PolarHBondContact O-N 3.23Å
232	M	57.8	Low	52.2	Low	60 Å²	60	85.8 Å²	85.8	30%	0.296	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-44	174.8	-71.7	-179	67.8	0	0	112.5	I228 V229 R234 E235 D236 I267	I228-M232 HydrophobicContact CG2-CG 4.43Å; I228-M232 HydrophobicContact CG2-SD 4.04Å; I228-M232 WeakPolarHBondContact O-CB 3.29Å; I228-M232 VanDerWaalsContact O-CG 3.27Å; I228-M232 WeakPolarHBondContact O-CG 3.34Å; I228-M232 PolarHBondContact O-N 2.75Å; V229-M232 PolarHBondContact O-N 2.95Å; M232-R234 PolarHBondContact O-N 3.49Å; M232-E235 PolarHBondContact O-N 2.99Å; M232-D236 PolarHBondContact O-N 2.81Å; M232-I267 HydrophobicContact CE-CG2 4.46Å; M232-I267 HydrophobicContact SD-CG2 3.97Å
233	E	57.4	Low	51.1	Low	66 Å²	66	89.1 Å²	89.1	31%	0.308	45%	0.45	S	S	.	.	H	α-helix	trans	-62.2	-34.5	174.3	-76.3	-178.2	173.7	0	0	110.5	V229 L237 R265	V229-E233 HydrophobicContact CG1-CG 4.23Å; V229-E233 VanDerWaalsContact O-CB 3.27Å; V229-E233 WeakPolarHBondContact O-CB 3.41Å; V229-E233 VanDerWaalsContact O-CG 3.3Å; V229-E233 WeakPolarHBondContact O-CG 3.35Å; V229-E233 PolarHBondContact O-N 3.13Å; E233-L237 WeakPolarHBondContact O-CB 3.22Å; E233-L237 WeakPolarHBondContact O-CD1 3.34Å; E233-L237 WeakPolarHBondContact O-CG 3.36Å; E233-L237 PolarHBondContact O-N 3.44Å; E233-R265 IonicContact OE1-CZ 2.69Å; E233-R265 VanDerWaalsContact OE1-CZ 3.31Å; E233-R265 IonicContact OE1-NE 2.75Å; E233-R265 PolarHBondContact OE1-NE 2.91Å; E233-R265 IonicContact OE1-NH2 2.77Å; E233-R265 PolarHBondContact OE1-NH2 2.94Å; E233-R265 VanDerWaalsContact OE1-NH2 3.07Å; E233-R265 IonicContact OE2-CZ 3.47Å; E233-R265 IonicContact OE2-NH2 3.62Å; E233-R265 PolarHBondContact OE2-NH2 2.8Å
234	R	56.4	Low	49.9	Very low	165 Å²	165	89.9 Å²	89.9	62%	0.623	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-43	173.9	-162	-176.1	87.1	157.9	5.4	111.9	E230 E231 M232 L237 L238	E230-R234 VanDerWaalsContact O-CB 3.28Å; E230-R234 WeakPolarHBondContact O-CB 3.39Å; E230-R234 PolarHBondContact O-N 3.08Å; E231-R234 WeakPolarHBondContact O-CB 3.47Å; E231-R234 PolarHBondContact O-N 3.13Å; M232-R234 PolarHBondContact O-N 3.49Å; R234-L237 PolarHBondContact O-N 3.29Å; R234-L238 HydrophobicContact CG-CD1 4.12Å; R234-L238 WeakPolarHBondContact O-CB 3.25Å; R234-L238 WeakPolarHBondContact O-CD1 3.45Å; R234-L238 WeakPolarHBondContact O-CG 3.46Å; R234-L238 PolarHBondContact O-N 2.98Å
235	E	54.8	Low	48.8	Very low	97 Å²	97	90.8 Å²	90.8	45%	0.453	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-48.1	174.1	-73.3	-172	160.2	0	0	111.3	E231 M232 L237 L238 E239	E231-E235 PolarHBondContact O-N 3.23Å; M232-E235 PolarHBondContact O-N 2.99Å; E235-L237 PolarHBondContact O-N 3.39Å; E235-L238 PolarHBondContact O-N 2.95Å; E235-E239 PolarHBondContact O-N 3.43Å
236	D	47	Very low	47.7	Very low	102 Å²	102	98.6 Å²	98.6	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-38.8	177.3	-78.2	-15.6	0	0	0	112.4	M232 A240	M232-D236 PolarHBondContact O-N 2.81Å; D236-A240 WeakPolarHBondContact O-CB 3.43Å; D236-A240 PolarHBondContact O-N 2.95Å
237	L	41.6	Very low	46.4	Very low	98 Å²	98	98.9 Å²	98.9	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-71.2	-35.5	176.8	-76	169	0	0	0	112.2	E233 R234 E235 A240 W241	E233-L237 WeakPolarHBondContact O-CB 3.22Å; E233-L237 WeakPolarHBondContact O-CD1 3.34Å; E233-L237 WeakPolarHBondContact O-CG 3.36Å; E233-L237 PolarHBondContact O-N 3.44Å; R234-L237 PolarHBondContact O-N 3.29Å; E235-L237 PolarHBondContact O-N 3.39Å; L237-A240 PolarHBondContact O-N 3.19Å; L237-W241 VanDerWaalsContact O-CB 3.3Å; L237-W241 WeakPolarHBondContact O-CB 3.38Å; L237-W241 PolarHBondContact O-N 3.49Å
238	L	41	Very low	45.3	Very low	82 Å²	82	99.1 Å²	99.1	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-66.2	-44.8	173.4	-74.1	166.2	0	0	0	110.3	R234 E235 A240 W241 E242	R234-L238 HydrophobicContact CG-CD1 4.12Å; R234-L238 WeakPolarHBondContact O-CB 3.25Å; R234-L238 WeakPolarHBondContact O-CD1 3.45Å; R234-L238 WeakPolarHBondContact O-CG 3.46Å; R234-L238 PolarHBondContact O-N 2.98Å; E235-L238 PolarHBondContact O-N 2.95Å; L238-A240 PolarHBondContact O-N 3.41Å; L238-W241 PolarHBondContact O-N 3Å; L238-E242 WeakPolarHBondContact O-CB 3.27Å; L238-E242 VanDerWaalsContact O-CG 3.3Å; L238-E242 WeakPolarHBondContact O-CG 3.48Å; L238-E242 PolarHBondContact O-N 3.46Å
239	E	41.6	Very low	43.9	Very low	131 Å²	131	105.8 Å²	105.8	61%	0.612	59%	0.589	S	S	*	*	H	α-helix	trans	-58	-37.4	171.4	-76.4	-163.4	163.8	0	0	112.2	E235	E235-E239 PolarHBondContact O-N 3.43Å
240	A	36.2	Very low	42.5	Very low	65 Å²	65	109.1 Å²	109.1	54%	0.537	63%	0.625	S	S	.	*	H	α-helix	trans	-76.6	-29.8	178.9	0	0	0	0	0	114.2	D236 L237 L238	D236-A240 WeakPolarHBondContact O-CB 3.43Å; D236-A240 PolarHBondContact O-N 2.95Å; L237-A240 PolarHBondContact O-N 3.19Å; L238-A240 PolarHBondContact O-N 3.41Å
241	W	30.7	Very low	41.1	Very low	208 Å²	208	107.4 Å²	107.4	79%	0.788	64%	0.635	S	S	*	*	H	α-helix	trans	-89.1	-16.3	-178.8	-79.5	27.8	0	0	0	113.3	L237 L238 V243	L237-W241 VanDerWaalsContact O-CB 3.3Å; L237-W241 WeakPolarHBondContact O-CB 3.38Å; L237-W241 PolarHBondContact O-N 3.49Å; L238-W241 PolarHBondContact O-N 3Å; W241-V243 PolarHBondContact O-N 3.19Å
242	E	34.4	Very low	39.8	Very low	110 Å²	110	108 Å²	108	51%	0.514	65%	0.646	S	S	.	*			trans	-74.2	16.4	175.4	-78.8	-174.3	-178	0	0	114.8	L238 P244 P443	L238-E242 WeakPolarHBondContact O-CB 3.27Å; L238-E242 VanDerWaalsContact O-CG 3.3Å; L238-E242 WeakPolarHBondContact O-CG 3.48Å; L238-E242 PolarHBondContact O-N 3.46Å; E242-P244 WeakPolarHBondContact O-CD 3.39Å; E242-P443 WeakPolarHBondContact OE2-CB 3.15Å
243	V	35.8	Very low	38.5	Very low	114 Å²	114	113 Å²	113	69%	0.691	67%	0.673	S	S	*	*			trans	-102.5	72.4	164.6	-166.4	0	0	0	0	111.4	W241 G245	W241-V243 PolarHBondContact O-N 3.19Å; V243-G245 PolarHBondContact O-N 3.06Å
244	P	34	Very low	37.1	Very low	119 Å²	119	119.3 Å²	119.3	77%	0.773	70%	0.703	S	S	*	*			trans	-88.1	104.9	168.3	32.9	-28.5	0	0	0	109.1	E242	E242-P244 WeakPolarHBondContact O-CD 3.39Å
245	G	35.6	Very low	35.7	Very low	70 Å²	70	119.8 Å²	119.8	72%	0.722	71%	0.712	S	S	*	*			trans	156.7	7.5	167.7	0	0	0	0	0	120.4	V243	V243-G245 PolarHBondContact O-N 3.06Å
246	L	35	Very low	34.7	Very low	165 Å²	165	120.7 Å²	120.7	86%	0.864	73%	0.726	S	S	*	*			trans	-117	94.3	160.9	-99.9	99.1	0	0	0	109.6
247	G	33.5	Very low	33.7	Very low	77 Å²	77	119.4 Å²	119.4	79%	0.794	74%	0.737	S	S	*	*			trans	-62	132.6	158	0	0	0	0	0	109.7
248	G	36.3	Very low	33.5	Very low	66 Å²	66	124.5 Å²	124.5	68%	0.68	76%	0.758	S	S	*	*	S	Bend	trans	80.2	116.1	149.6	0	0	0	0	0	117.3
249	V	33	Very low	32.9	Very low	159 Å²	159	125.5 Å²	125.5	96%	0.964	77%	0.772	S	S	*	*	S	Bend	trans	79.6	97.3	153.6	-159.7	0	0	0	0	115.3
250	G	29.9	Very low	32.6	Very low	80 Å²	80	123.2 Å²	123.2	83%	0.825	78%	0.784	S	S	*	*	S	Bend	trans	159.4	10.9	161.3	0	0	0	0	0	120.1
251	A	30.2	Very low	32.6	Very low	101 Å²	101	127 Å²	127	84%	0.835	80%	0.795	S	S	*	*	S	Bend	trans	-156.3	23.2	169.7	0	0	0	0	0	114.6
252	V	34.1	Very low	33.2	Very low	133 Å²	133	125.6 Å²	125.6	81%	0.806	80%	0.797	S	S	*	*			trans	-118.6	72	173.9	-175.4	0	0	0	0	108.4
253	L	30.6	Very low	33.9	Very low	165 Å²	165	129.7 Å²	129.7	86%	0.864	81%	0.814	S	S	*	*			trans	-151.1	74.3	159.1	-85.2	-176.7	0	0	0	109.5
254	Q	27.1	Very low	35	Very low	199 Å²	199	129.1 Å²	129.1	93%	0.93	80%	0.803	S	S	*	*			trans	-144.7	95.6	138.2	-107.4	171.3	16.9	0	0	106.5
255	Q	27.6	Very low	36.9	Very low	174 Å²	174	128.5 Å²	128.5	81%	0.813	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-90.2	164.6	170.1	-96.3	-134.4	6.7	0	0	110
256	P	34.8	Very low	39.1	Very low	116 Å²	116	128.7 Å²	128.7	75%	0.753	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-87.2	129.2	-132.1	32.5	-33.2	0	0	0	112.8
257	G	25.7	Very low	41.5	Very low	75 Å²	75	121 Å²	121	77%	0.773	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-99.1	122.8	161.8	0	0	0	0	0	109.1	S259	G257-S259 PolarHBondContact O-N 3.4Å
258	E	36.6	Very low	44.2	Very low	205 Å²	205	118.2 Å²	118.2	96%	0.958	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-52.1	118	179.4	-64.9	172.2	143.2	0	0	113.1
259	S	29.4	Very low	47	Very low	104 Å²	104	115.1 Å²	115.1	73%	0.727	67%	0.665	S	S	*	*			trans	-165.2	113.1	147	175.1	0	0	0	0	106.9	G257 N261	G257-S259 PolarHBondContact O-N 3.4Å; S259-N261 VanDerWaalsContact C-N 3.3Å; S259-N261 PolarHBondContact O-N 3.25Å
260	G	34.7	Very low	50	Low	83 Å²	83	107.9 Å²	107.9	86%	0.856	62%	0.622	S	S	*	*			trans	-68.2	82.2	179.7	0	0	0	0	0	112.3
261	N	35.7	Very low	53.1	Low	145 Å²	145	104 Å²	104	78%	0.775	58%	0.583	S	S	*	*			trans	-105.5	103.3	159.1	-105.6	7.4	0	0	0	107.5	S259 K263	S259-N261 VanDerWaalsContact C-N 3.3Å; S259-N261 PolarHBondContact O-N 3.25Å; N261-K263 PolarHBondContact O-N 3Å; N261-K263 VanDerWaalsContact O-N 3.13Å
262	E	43.2	Very low	56.3	Low	177 Å²	177	100.2 Å²	100.2	83%	0.827	55%	0.547	S	S	*	.			trans	-45	120.6	155.3	-70.7	173	156.8	0	0	107	E264	E262-E264 PolarHBondContact O-N 2.97Å
263	K	49.1	Very low	59.3	Low	197 Å²	197	93.9 Å²	93.9	86%	0.857	51%	0.509	S	S	*	.			trans	-59.8	107.9	174.6	-82.6	-179.2	175.9	179.3	0	106.6	N261 R265	N261-K263 PolarHBondContact O-N 3Å; N261-K263 VanDerWaalsContact O-N 3.13Å; K263-R265 PolarHBondContact O-N 3.07Å
264	E	59.1	Low	62.3	Low	102 Å²	102	86.4 Å²	86.4	48%	0.477	47%	0.47	S	S	.	.			trans	-51.5	116.8	177.2	-69.5	179.8	165.3	0	0	108.9	R216 E262 L266	R216-E264 IonicContact CZ-OE1 3.69Å; R216-E264 IonicContact CZ-OE2 2.69Å; R216-E264 IonicContact NE-OE2 2.82Å; R216-E264 IonicContact NH1-OE1 2.6Å; R216-E264 PolarHBondContact NH1-OE1 2.87Å; R216-E264 IonicContact NH1-OE2 3.83Å; R216-E264 PolarHBondContact NH1-OE2 3.31Å; R216-E264 IonicContact NH2-OE1 3.61Å; R216-E264 IonicContact NH2-OE2 2.86Å; R216-E264 PolarHBondContact NH2-OE2 3.35Å; E262-E264 PolarHBondContact O-N 2.97Å; E264-L266 PolarHBondContact O-N 2.79Å
265	R	73.5	Confident	65.5	Low	105 Å²	105	77.7 Å²	77.7	40%	0.396	43%	0.429	S	S	.	.			trans	-74.4	114.5	177.8	-79.8	171.8	157.4	170.3	-7.6	108.4	V217 D218 E233 K263	V217-R265 HydrophobicContact CB-CB 3.68Å; V217-R265 HydrophobicContact CG1-CB 4.34Å; V217-R265 HydrophobicContact CG2-CB 3.79Å; V217-R265 VanDerWaalsContact CG2-O 3.31Å; V217-R265 WeakPolarHBondContact CG2-O 3.48Å; V217-R265 PolarHBondContact N-O 3.47Å; D218-R265 PolarHBondContact OD2-N 3.45Å; E233-R265 IonicContact OE1-CZ 2.69Å; E233-R265 VanDerWaalsContact OE1-CZ 3.31Å; E233-R265 IonicContact OE1-NE 2.75Å; E233-R265 PolarHBondContact OE1-NE 2.91Å; E233-R265 IonicContact OE1-NH2 2.77Å; E233-R265 PolarHBondContact OE1-NH2 2.94Å; E233-R265 VanDerWaalsContact OE1-NH2 3.07Å; E233-R265 IonicContact OE2-CZ 3.47Å; E233-R265 IonicContact OE2-NH2 3.62Å; E233-R265 PolarHBondContact OE2-NH2 2.8Å; K263-R265 PolarHBondContact O-N 3.07Å
266	L	82.5	Confident	68.5	Low	74 Å²	74	72.8 Å²	72.8	39%	0.387	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.3	-176.1	-64.5	177.1	0	0	0	110.8	W214 A215 R216 E264	W214-L266 HydrophobicContact CB-CB 4.46Å; W214-L266 HydrophobicContact CB-CD2 4.38Å; W214-L266 HydrophobicContact CE3-CB 3.9Å; A215-L266 WeakPolarHBondContact O-CA 3.46Å; R216-L266 HydrophobicContact CB-CD2 4.39Å; R216-L266 HydrophobicContact CG-CD2 3.7Å; E264-L266 PolarHBondContact O-N 2.79Å
267	I	84.9	Confident	71.1	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.015	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.8	171.7	-54.8	176.8	0	0	0	108.7	W214 A215 V217 F225 I228 V229 M232 V269 T362	W214-I267 CarbonylContact C-O 3.51Å; W214-I267 WeakPolarHBondContact CA-O 3.24Å; A215-I267 PolarHBondContact N-O 3.21Å; A215-I267 PolarHBondContact O-N 3.38Å; V217-I267 HydrophobicContact CG2-CD1 3.84Å; V217-I267 HydrophobicContact CG2-CG1 3.61Å; F225-I267 HydrophobicContact CD1-CD1 4.14Å; F225-I267 HydrophobicContact CE1-CD1 3.51Å; F225-I267 HydrophobicContact CE1-CG1 4.42Å; F225-I267 HydrophobicContact CZ-CD1 3.78Å; I228-I267 HydrophobicContact CG2-CD1 4.3Å; V229-I267 HydrophobicContact CG2-CD1 3.44Å; V229-I267 VanDerWaalsContact CG2-CD1 3.44Å; V229-I267 HydrophobicContact CG2-CG1 3.84Å; M232-I267 HydrophobicContact CE-CG2 4.46Å; M232-I267 HydrophobicContact SD-CG2 3.97Å; I267-V269 HydrophobicContact CG2-CG1 4.33Å; I267-T362 HydrophobicContact CG2-CG2 4.24Å
268	P	91.4	Very high	74.2	Confident	20 Å²	20	66.4 Å²	66.4	13%	0.13	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.7	171.6	31.5	-35	0	0	0	110.2	W214 F363	W214-P268 HydrophobicContact CE3-CB 4Å; W214-P268 HydrophobicContact CH2-CB 4.15Å; W214-P268 HydrophobicContact CZ3-CB 3.78Å; W214-P268 HydrophobicContact CZ3-CG 4.21Å; P268-F363 HydrophobicContact CB-CB 4.15Å; P268-F363 PolarHBondContact O-N 2.79Å
269	V	93.8	Very high	76.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.3	-173	-62.2	0	0	0	0	113.9	G213 A215 I267 I271 L350 V360 E361	G213-V269 PolarHBondContact N-O 2.65Å; G213-V269 PolarHBondContact O-N 3.47Å; A215-V269 HydrophobicContact CB-CG1 3.68Å; A215-V269 HydrophobicContact CB-CG2 4.31Å; I267-V269 HydrophobicContact CG2-CG1 4.33Å; V269-I271 HydrophobicContact CG2-CD1 4.09Å; V269-I271 HydrophobicContact CG2-CG1 3.98Å; V269-L350 HydrophobicContact CG1-CD2 3.38Å; V269-V360 HydrophobicContact CB-CG1 3.87Å; V269-V360 HydrophobicContact CG1-CG1 4.11Å; V269-V360 HydrophobicContact CG2-CG1 4.17Å; V269-E361 CarbonylContact C-O 3.59Å; V269-E361 VanDerWaalsContact CA-O 3.24Å; V269-E361 WeakPolarHBondContact CA-O 3.23Å; V269-E361 WeakPolarHBondContact CB-O 3.43Å
270	A	95.8	Very high	79.6	Confident	7 Å²	7	64.9 Å²	64.9	6%	0.058	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	123.9	166.4	0	0	0	0	0	109.3	V210 Y211 V360 E361 F363	V210-A270 HydrophobicContact CG1-CB 4.05Å; Y211-A270 CarbonylContact O-C 3.58Å; Y211-A270 WeakPolarHBondContact O-CA 3.46Å; A270-V360 WeakPolarHBondContact O-CA 3.49Å; A270-E361 HydrophobicContact CB-CG 3.96Å; A270-E361 PolarHBondContact N-O 3.15Å; A270-E361 PolarHBondContact O-N 3.41Å; A270-F363 HydrophobicContact CB-CD2 4.17Å
271	I	96.6	Very high	82.3	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	100.6	-178.3	-54.2	164	0	0	0	108.6	L194 F196 V210 Y211 V269 V273 I358 V360	L194-I271 HydrophobicContact CB-CD1 4.34Å; L194-I271 HydrophobicContact CD1-CD1 4.41Å; L194-I271 HydrophobicContact CD2-CD1 4.5Å; F196-I271 HydrophobicContact CD1-CD1 4.2Å; F196-I271 HydrophobicContact CD2-CD1 4.19Å; F196-I271 HydrophobicContact CE1-CB 4.18Å; F196-I271 HydrophobicContact CE1-CD1 3.69Å; F196-I271 HydrophobicContact CE1-CG2 4.17Å; F196-I271 HydrophobicContact CE2-CD1 3.67Å; F196-I271 HydrophobicContact CG-CD1 4.43Å; F196-I271 HydrophobicContact CZ-CB 4.23Å; F196-I271 HydrophobicContact CZ-CD1 3.39Å; F196-I271 HydrophobicContact CZ-CG1 4.38Å; F196-I271 HydrophobicContact CZ-CG2 3.87Å; V210-I271 WeakPolarHBondContact CA-O 3.22Å; Y211-I271 PolarHBondContact N-O 3.41Å; Y211-I271 PolarHBondContact O-N 3.41Å; V269-I271 HydrophobicContact CG2-CD1 4.09Å; V269-I271 HydrophobicContact CG2-CG1 3.98Å; I271-V273 HydrophobicContact CG2-CG2 4Å; I271-I358 HydrophobicContact CG2-CG2 4.36Å; I271-V360 HydrophobicContact CG1-CG1 4.2Å; I271-V360 HydrophobicContact CG1-CG2 4.16Å; I271-V360 HydrophobicContact CG2-CG2 4.13Å
272	K	96.4	Very high	85	Confident	20 Å²	20	57 Å²	57	9%	0.087	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.5	178	-62.4	-179.7	168.2	159.3	0	110.2	Q209 V210 L324 E327 I358 L359 E361	Q209-K272 CarbonylContact O-C 3.57Å; Q209-K272 WeakPolarHBondContact O-CA 3.35Å; V210-K272 HydrophobicContact CB-CG 4.37Å; V210-K272 HydrophobicContact CG1-CG 3.95Å; V210-K272 HydrophobicContact CG2-CG 3.84Å; K272-L324 HydrophobicContact CB-CD1 4.13Å; K272-E327 IonicContact NZ-OE1 2.69Å; K272-E327 PolarHBondContact NZ-OE1 2.67Å; K272-I358 VanDerWaalsContact O-CA 3.26Å; K272-I358 WeakPolarHBondContact O-CA 3.34Å; K272-L359 HydrophobicContact CB-CB 4.21Å; K272-L359 HydrophobicContact CD-CD2 4.07Å; K272-L359 HydrophobicContact CD-CG 4.38Å; K272-L359 PolarHBondContact N-O 2.67Å; K272-L359 PolarHBondContact O-N 3.42Å; K272-E361 WeakPolarHBondContact CE-OE1 3.5Å; K272-E361 IonicContact NZ-OE1 3.75Å; K272-E361 PolarHBondContact NZ-OE1 3.07Å; K272-E361 IonicContact NZ-OE2 3.43Å
273	V	96.2	Very high	87.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.8	-176.4	-173	0	0	0	0	111.3	T178 C181 A208 Q209 Y211 I271 N357 I358	T178-V273 HydrophobicContact CG2-CG1 4.42Å; T178-V273 HydrophobicContact CG2-CG2 4.07Å; C181-V273 HydrophobicContact CB-CG1 3.9Å; A208-V273 CarbonylContact C-O 3.59Å; A208-V273 VanDerWaalsContact CA-O 3.22Å; A208-V273 WeakPolarHBondContact CA-O 3.3Å; A208-V273 WeakPolarHBondContact CB-O 3.27Å; Q209-V273 PolarHBondContact N-O 2.91Å; Q209-V273 PolarHBondContact O-N 3.42Å; Y211-V273 HydrophobicContact CD2-CG2 4.31Å; Y211-V273 HydrophobicContact CE2-CG2 4.32Å; I271-V273 HydrophobicContact CG2-CG2 4Å; V273-N357 WeakPolarHBondContact CA-O 3.17Å; V273-I358 HydrophobicContact CG1-CG1 4.35Å; V273-I358 HydrophobicContact CG2-CG1 4.32Å
274	V	94.4	Very high	89.4	Confident	8 Å²	8	44.1 Å²	44.1	5%	0.048	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	136.4	-178.4	176.5	0	0	0	0	111.9	H177 V207 A208 V278 L324 N357	H177-V274 PolarHBondContact NE2-O 2.87Å; V207-V274 HydrophobicContact CG1-CG1 4.38Å; A208-V274 HydrophobicContact CB-CG2 4.4Å; V274-V278 HydrophobicContact CG1-CB 4.4Å; V274-L324 HydrophobicContact CG2-CD1 3.77Å; V274-L324 HydrophobicContact CG2-CD2 4.36Å; V274-L324 HydrophobicContact CG2-CG 3.8Å; V274-N357 HydrophobicContact CB-CB 4.38Å; V274-N357 PolarHBondContact N-O 2.94Å
275	H	93.7	Very high	91.2	Very high	17 Å²	17	39.3 Å²	39.3	8%	0.079	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-61.5	152	177.6	-76.4	-58.1	0	0	0	113	H173 S204 G205 V207 Q209 G277 V278	H173-H275 AromaticContact CE1-ND1 3.96Å; H173-H275 AromaticContact CG-ND1 3.66Å; H173-H275 AromaticContact ND1-CE1 3.64Å; H173-H275 AromaticContact ND1-CG 3.79Å; H173-H275 AromaticContact ND1-ND1 2.88Å; H173-H275 PolarHBondContact ND1-ND1 2.84Å; S204-H275 PolarHBondContact OG-CE1 3.44Å; G205-H275 PolarHBondContact O-CD2 2.73Å; G205-H275 PolarHBondContact O-NE2 2.94Å; V207-H275 VanDerWaalsContact C-CD2 3.42Å; V207-H275 WeakPolarHBondContact O-CB 3.35Å; V207-H275 PolarHBondContact O-CD2 3.37Å; V207-H275 PolarHBondContact O-N 3.5Å; Q209-H275 PolarHBondContact OE1-CE1 2.91Å; H275-G277 PolarHBondContact O-N 2.89Å; H275-V278 HydrophobicContact CB-CG2 3.4Å
276	P	92	Very high	92.1	Very high	71 Å²	71	34.6 Å²	34.6	46%	0.461	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	125.7	-175.4	23.8	-33.2	0	0	0	112.5	H173 H177 V278	H173-P276 HydrophobicContact CB-CG 4.1Å; H177-P276 VanDerWaalsContact CE1-CA 3.45Å; H177-P276 WeakPolarHBondContact CE1-CA 3.27Å; P276-V278 PolarHBondContact O-N 3.17Å; P276-V278 VanDerWaalsContact O-N 3.13Å
277	G	88.8	Confident	92.7	Very high	48 Å²	48	34.8 Å²	34.8	50%	0.495	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	1.1	171.2	0	0	0	0	0	115.7	H275 R279 R280 Q281	H275-G277 PolarHBondContact O-N 2.89Å; G277-R279 VanDerWaalsContact C-N 3.29Å; G277-R279 PolarHBondContact O-N 3.42Å; G277-R280 PolarHBondContact O-N 3.45Å; G277-R280 VanDerWaalsContact O-N 3.08Å; G277-Q281 PolarHBondContact O-N 3Å
278	V	90.4	Very high	93.2	Very high	8 Å²	8	36.4 Å²	36.4	5%	0.048	18%	0.184	C	C	.	.	H	α-helix	trans	-51.4	-47.9	-177.8	166.4	0	0	0	0	111.8	P139 V207 V274 H275 P276 R280 Q281 V282 I322	P139-V278 HydrophobicContact CB-CG1 4.27Å; P139-V278 HydrophobicContact CG-CG1 4.03Å; P139-V278 HydrophobicContact CG-CG2 4.18Å; V207-V278 HydrophobicContact CG1-CG1 4.28Å; V274-V278 HydrophobicContact CG1-CB 4.4Å; H275-V278 HydrophobicContact CB-CG2 3.4Å; P276-V278 PolarHBondContact O-N 3.17Å; P276-V278 VanDerWaalsContact O-N 3.13Å; V278-R280 PolarHBondContact O-N 3.35Å; V278-Q281 PolarHBondContact O-N 2.95Å; V278-Q281 VanDerWaalsContact O-N 3.16Å; V278-V282 HydrophobicContact CG1-CG2 3.9Å; V278-V282 WeakPolarHBondContact O-CB 3.48Å; V278-V282 VanDerWaalsContact O-CG2 3.26Å; V278-V282 WeakPolarHBondContact O-CG2 3.43Å; V278-V282 PolarHBondContact O-N 3.11Å; V278-I322 HydrophobicContact CG1-CG2 4.04Å
279	R	89.4	Confident	93.3	Very high	111 Å²	111	36.9 Å²	36.9	42%	0.419	19%	0.186	S	C	.	.	H	α-helix	trans	-52.8	-51.6	178.1	173.3	171.1	179.6	153.1	6.5	113.2	G277 Q281 V282 E283 I322	G277-R279 VanDerWaalsContact C-N 3.29Å; G277-R279 PolarHBondContact O-N 3.42Å; R279-Q281 VanDerWaalsContact C-N 3.3Å; R279-Q281 PolarHBondContact O-N 3.26Å; R279-V282 PolarHBondContact O-N 3.48Å; R279-E283 HydrophobicContact CG-CG 4.48Å; R279-E283 VanDerWaalsContact CG-OE1 3.27Å; R279-E283 WeakPolarHBondContact CG-OE1 3.45Å; R279-E283 IonicContact CZ-OE1 3.07Å; R279-E283 IonicContact NE-OE1 3.31Å; R279-E283 PolarHBondContact NE-OE1 2.99Å; R279-E283 IonicContact NH2-OE1 2.79Å; R279-E283 WeakPolarHBondContact O-CB 3.42Å; R279-E283 VanDerWaalsContact O-CG 3.27Å; R279-E283 WeakPolarHBondContact O-CG 3.4Å; R279-E283 PolarHBondContact O-N 2.99Å; R279-I322 HydrophobicContact CB-CD1 4.37Å; R279-I322 HydrophobicContact CG-CD1 4.1Å
280	R	89.7	Confident	93.2	Very high	167 Å²	167	40.6 Å²	40.6	63%	0.63	20%	0.202	S	C	*	.	H	α-helix	trans	-65.8	-36.5	-178.3	-69.6	178.9	-179.6	167.1	-2.6	111.4	G277 V278 I284	G277-R280 PolarHBondContact O-N 3.45Å; G277-R280 VanDerWaalsContact O-N 3.08Å; V278-R280 PolarHBondContact O-N 3.35Å; R280-I284 VanDerWaalsContact O-CG1 3.31Å; R280-I284 WeakPolarHBondContact O-CG1 3.27Å; R280-I284 PolarHBondContact O-N 3.38Å; R280-I284 VanDerWaalsContact O-N 3.14Å
281	Q	91.4	Very high	93	Very high	61 Å²	61	42.9 Å²	42.9	29%	0.285	22%	0.221	S	C	.	.	H	α-helix	trans	-67.4	-45.7	176.9	-179	172.5	-15.8	0	0	111.3	G277 V278 R279 I284 D285	G277-Q281 PolarHBondContact O-N 3Å; V278-Q281 PolarHBondContact O-N 2.95Å; V278-Q281 VanDerWaalsContact O-N 3.16Å; R279-Q281 VanDerWaalsContact C-N 3.3Å; R279-Q281 PolarHBondContact O-N 3.26Å; Q281-I284 PolarHBondContact O-N 2.87Å; Q281-D285 WeakPolarHBondContact O-CB 3.3Å; Q281-D285 PolarHBondContact O-N 2.83Å
282	V	91.9	Very high	92.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-44.7	176.2	172	0	0	0	0	110.9	P139 T140 V278 R279 I284 D285 L286 M318 I322	P139-V282 HydrophobicContact CG-CG2 4.22Å; T140-V282 WeakPolarHBondContact OG1-CA 3.31Å; T140-V282 WeakPolarHBondContact OG1-CG2 3.35Å; V278-V282 HydrophobicContact CG1-CG2 3.9Å; V278-V282 WeakPolarHBondContact O-CB 3.48Å; V278-V282 VanDerWaalsContact O-CG2 3.26Å; V278-V282 WeakPolarHBondContact O-CG2 3.43Å; V278-V282 PolarHBondContact O-N 3.11Å; R279-V282 PolarHBondContact O-N 3.48Å; V282-I284 VanDerWaalsContact C-N 3.33Å; V282-I284 PolarHBondContact O-N 2.96Å; V282-D285 PolarHBondContact O-N 3.11Å; V282-L286 HydrophobicContact CG1-CD1 3.69Å; V282-L286 HydrophobicContact CG1-CG 4.16Å; V282-L286 WeakPolarHBondContact O-CB 3.27Å; V282-L286 VanDerWaalsContact O-CG 3.23Å; V282-L286 WeakPolarHBondContact O-CG 3.35Å; V282-L286 PolarHBondContact O-N 3.12Å; V282-M318 HydrophobicContact CG1-CB 4.26Å; V282-M318 HydrophobicContact CG1-CE 4.05Å; V282-M318 HydrophobicContact CG2-CE 3.96Å; V282-I322 HydrophobicContact CG1-CD1 4.45Å; V282-I322 HydrophobicContact CG1-CG2 4.45Å; V282-I322 HydrophobicContact CG2-CG2 4.15Å
283	E	92.1	Very high	92.3	Very high	87 Å²	87	43.7 Å²	43.7	41%	0.407	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-43.6	175.1	-74.5	167.8	-174.9	0	0	112.1	R279 L287	R279-E283 HydrophobicContact CG-CG 4.48Å; R279-E283 VanDerWaalsContact CG-OE1 3.27Å; R279-E283 WeakPolarHBondContact CG-OE1 3.45Å; R279-E283 IonicContact CZ-OE1 3.07Å; R279-E283 IonicContact NE-OE1 3.31Å; R279-E283 PolarHBondContact NE-OE1 2.99Å; R279-E283 IonicContact NH2-OE1 2.79Å; R279-E283 WeakPolarHBondContact O-CB 3.42Å; R279-E283 VanDerWaalsContact O-CG 3.27Å; R279-E283 WeakPolarHBondContact O-CG 3.4Å; R279-E283 PolarHBondContact O-N 2.99Å; E283-L287 WeakPolarHBondContact O-CB 3.46Å; E283-L287 PolarHBondContact O-N 3.35Å
284	I	94.2	Very high	91.8	Very high	17 Å²	17	52 Å²	52	9%	0.087	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-46.7	176.5	-72.1	170.6	0	0	0	111.2	F91 R94 L95 R98 R280 Q281 V282 L286 L287 L288	F91-I284 HydrophobicContact CE2-CG1 4.1Å; R94-I284 HydrophobicContact CB-CD1 4.15Å; L95-I284 HydrophobicContact CD1-CG2 3.78Å; R98-I284 HydrophobicContact CB-CG2 3.9Å; R98-I284 HydrophobicContact CG-CG2 3.74Å; R280-I284 VanDerWaalsContact O-CG1 3.31Å; R280-I284 WeakPolarHBondContact O-CG1 3.27Å; R280-I284 PolarHBondContact O-N 3.38Å; R280-I284 VanDerWaalsContact O-N 3.14Å; Q281-I284 PolarHBondContact O-N 2.87Å; V282-I284 VanDerWaalsContact C-N 3.33Å; V282-I284 PolarHBondContact O-N 2.96Å; I284-L286 PolarHBondContact O-N 3.04Å; I284-L287 PolarHBondContact O-N 3Å; I284-L288 HydrophobicContact CG2-CD1 4.17Å; I284-L288 WeakPolarHBondContact O-CG 3.09Å; I284-L288 PolarHBondContact O-N 3.33Å
285	D	95.6	Very high	91.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-43.5	-178.2	-71	-20.6	0	0	0	111.3	R98 T140 F141 Q281 V282 L287 L288 M289	R98-D285 IonicContact CZ-OD1 3.27Å; R98-D285 VanDerWaalsContact CZ-OD1 3.27Å; R98-D285 IonicContact CZ-OD2 3.83Å; R98-D285 IonicContact NE-OD1 2.73Å; R98-D285 PolarHBondContact NE-OD1 2.98Å; R98-D285 IonicContact NE-OD2 3.69Å; R98-D285 VanDerWaalsContact NH2-CG 3.26Å; R98-D285 IonicContact NH2-OD1 2.92Å; R98-D285 PolarHBondContact NH2-OD1 3.42Å; R98-D285 IonicContact NH2-OD2 3.03Å; R98-D285 PolarHBondContact NH2-OD2 2.86Å; T140-D285 VanDerWaalsContact CB-OD2 3.31Å; T140-D285 WeakPolarHBondContact CB-OD2 3.48Å; T140-D285 HydrophobicContact CG2-CB 3.68Å; T140-D285 WeakPolarHBondContact OG1-CB 3.42Å; T140-D285 PolarHBondContact OG1-OD2 2.97Å; F141-D285 HydrophobicContact CE2-CB 4.33Å; Q281-D285 WeakPolarHBondContact O-CB 3.3Å; Q281-D285 PolarHBondContact O-N 2.83Å; V282-D285 PolarHBondContact O-N 3.11Å; D285-L287 VanDerWaalsContact C-N 3.33Å; D285-L287 PolarHBondContact O-N 3.36Å; D285-L288 PolarHBondContact O-N 3.3Å; D285-M289 VanDerWaalsContact O-CG 3.29Å; D285-M289 WeakPolarHBondContact O-CG 3.44Å; D285-M289 PolarHBondContact O-N 3.29Å
286	L	94.1	Very high	90.8	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-38.6	176.6	-69.7	171.7	0	0	0	111.9	T140 V282 I284 L288 M289 K290 F314 E315 M318	T140-L286 HydrophobicContact CG2-CD2 4.42Å; V282-L286 HydrophobicContact CG1-CD1 3.69Å; V282-L286 HydrophobicContact CG1-CG 4.16Å; V282-L286 WeakPolarHBondContact O-CB 3.27Å; V282-L286 VanDerWaalsContact O-CG 3.23Å; V282-L286 WeakPolarHBondContact O-CG 3.35Å; V282-L286 PolarHBondContact O-N 3.12Å; I284-L286 PolarHBondContact O-N 3.04Å; L286-L288 VanDerWaalsContact C-N 3.34Å; L286-M289 HydrophobicContact CD2-SD 4.38Å; L286-M289 PolarHBondContact O-N 2.91Å; L286-K290 WeakPolarHBondContact O-CG 3.48Å; L286-K290 PolarHBondContact O-N 3.43Å; L286-F314 HydrophobicContact CD2-CD1 3.86Å; L286-F314 HydrophobicContact CD2-CE1 4.01Å; L286-E315 HydrophobicContact CD1-CB 4.26Å; L286-E315 HydrophobicContact CD1-CG 4.04Å; L286-E315 HydrophobicContact CD2-CB 4.02Å; L286-M318 HydrophobicContact CD1-CB 4.44Å
287	L	94.1	Very high	90.2	Very high	77 Å²	77	60.1 Å²	60.1	40%	0.403	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-41.1	174.6	-172.5	143	0	0	0	111.7	F91 L95 E283 I284 D285 K290 A291	F91-L287 HydrophobicContact CZ-CD1 4.47Å; L95-L287 HydrophobicContact CD1-CD2 3.66Å; L95-L287 HydrophobicContact CD2-CD2 3.69Å; L95-L287 HydrophobicContact CG-CD2 4.33Å; E283-L287 WeakPolarHBondContact O-CB 3.46Å; E283-L287 PolarHBondContact O-N 3.35Å; I284-L287 PolarHBondContact O-N 3Å; D285-L287 VanDerWaalsContact C-N 3.33Å; D285-L287 PolarHBondContact O-N 3.36Å; L287-K290 PolarHBondContact O-N 3.04Å; L287-A291 PolarHBondContact O-N 3.33Å
288	L	94.9	Very high	89.8	Confident	37 Å²	37	61.8 Å²	61.8	19%	0.194	30%	0.304	C	S	.	.	H	α-helix	trans	-66.1	-41	174.6	-68.9	174.8	0	0	0	112	L95 R98 A99 L102 I284 D285 L286 A291 G292	L95-L288 HydrophobicContact CD1-CD1 4.19Å; L95-L288 HydrophobicContact CD1-CD2 3.48Å; L95-L288 VanDerWaalsContact CD1-CD2 3.48Å; L95-L288 HydrophobicContact CD1-CG 3.62Å; L95-L288 HydrophobicContact CG-CD2 4.22Å; R98-L288 HydrophobicContact CB-CD1 4.24Å; R98-L288 HydrophobicContact CG-CD1 3.86Å; A99-L288 HydrophobicContact CB-CD1 4.13Å; A99-L288 HydrophobicContact CB-CD2 3.76Å; L102-L288 HydrophobicContact CD1-CD1 3.87Å; I284-L288 HydrophobicContact CG2-CD1 4.17Å; I284-L288 WeakPolarHBondContact O-CG 3.09Å; I284-L288 PolarHBondContact O-N 3.33Å; D285-L288 PolarHBondContact O-N 3.3Å; L286-L288 VanDerWaalsContact C-N 3.34Å; L288-A291 PolarHBondContact O-N 3.17Å; L288-G292 PolarHBondContact O-N 2.98Å
289	M	93.8	Very high	89.2	Confident	31 Å²	31	66.1 Å²	66.1	15%	0.153	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-42.9	176.3	-72.7	175.8	67.5	0	0	111.6	T140 L144 D285 L286 G292 S293 V311 F314	T140-M289 HydrophobicContact CG2-SD 4.09Å; L144-M289 HydrophobicContact CD1-CE 4.16Å; L144-M289 HydrophobicContact CD2-CE 3.75Å; D285-M289 VanDerWaalsContact O-CG 3.29Å; D285-M289 WeakPolarHBondContact O-CG 3.44Å; D285-M289 PolarHBondContact O-N 3.29Å; L286-M289 HydrophobicContact CD2-SD 4.38Å; L286-M289 PolarHBondContact O-N 2.91Å; M289-G292 PolarHBondContact O-N 3.24Å; M289-S293 WeakPolarHBondContact O-CB 3.43Å; M289-S293 PolarHBondContact O-N 3.02Å; M289-S293 PolarHBondContact O-OG 2.78Å; M289-V311 HydrophobicContact CB-CG1 3.82Å; M289-V311 HydrophobicContact CB-CG2 4.21Å; M289-V311 HydrophobicContact CE-CG2 4.17Å; M289-F314 HydrophobicContact CE-CD1 3.68Å; M289-F314 HydrophobicContact CE-CE1 4Å; M289-F314 HydrophobicContact SD-CD1 4.21Å; M289-F314 HydrophobicContact SD-CE1 4.07Å
290	K	91.9	Very high	88.3	Confident	78 Å²	78	66.7 Å²	66.7	34%	0.339	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-43.7	175.6	-74.8	175.6	171.3	-179.6	0	112.7	L286 L287 G292 S293 W294 V311 E315	L286-K290 WeakPolarHBondContact O-CG 3.48Å; L286-K290 PolarHBondContact O-N 3.43Å; L287-K290 PolarHBondContact O-N 3.04Å; K290-G292 VanDerWaalsContact C-N 3.32Å; K290-S293 PolarHBondContact O-N 3.07Å; K290-S293 PolarHBondContact O-OG 3.46Å; K290-W294 WeakPolarHBondContact O-CB 3.48Å; K290-W294 PolarHBondContact O-N 2.77Å; K290-V311 HydrophobicContact CG-CG1 3.68Å; K290-E315 VanDerWaalsContact CE-CD 3.47Å; K290-E315 WeakPolarHBondContact CE-OE1 3.47Å; K290-E315 WeakPolarHBondContact CE-OE2 3.46Å; K290-E315 IonicContact NZ-OE1 2.7Å; K290-E315 PolarHBondContact NZ-OE1 3.48Å; K290-E315 IonicContact NZ-OE2 3.42Å; K290-E315 PolarHBondContact NZ-OE2 2.99Å
291	A	91.4	Very high	87.3	Confident	55 Å²	55	61.7 Å²	61.7	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.8	0	0	0	0	0	111.2	L287 L288 L295	L287-A291 PolarHBondContact O-N 3.33Å; L288-A291 PolarHBondContact O-N 3.17Å; A291-L295 PolarHBondContact O-N 3.24Å; A291-L295 VanDerWaalsContact O-N 3.08Å
292	G	89.8	Confident	86	Confident	28 Å²	28	61.5 Å²	61.5	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-42.6	176.5	0	0	0	0	0	113.2	L288 M289 K290 W294 L295 L296	L288-G292 PolarHBondContact O-N 2.98Å; M289-G292 PolarHBondContact O-N 3.24Å; K290-G292 VanDerWaalsContact C-N 3.32Å; G292-W294 VanDerWaalsContact C-N 3.32Å; G292-W294 PolarHBondContact O-N 3.4Å; G292-L295 PolarHBondContact O-N 2.95Å; G292-L296 WeakPolarHBondContact O-CG 3.43Å; G292-L296 PolarHBondContact O-N 2.56Å
293	S	88.3	Confident	84.7	Confident	9 Å²	9	67.5 Å²	67.5	6%	0.063	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-39.5	177.9	67.8	0	0	0	0	111.5	M289 K290 L296 H297	M289-S293 WeakPolarHBondContact O-CB 3.43Å; M289-S293 PolarHBondContact O-N 3.02Å; M289-S293 PolarHBondContact O-OG 2.78Å; K290-S293 PolarHBondContact O-N 3.07Å; K290-S293 PolarHBondContact O-OG 3.46Å; S293-L296 PolarHBondContact O-N 3.19Å; S293-H297 WeakPolarHBondContact O-CB 3.29Å; S293-H297 PolarHBondContact O-N 3.45Å
294	W	86.8	Confident	83.3	Confident	174 Å²	174	70.6 Å²	70.6	66%	0.659	38%	0.378	S	S	*	.	H	α-helix	trans	-63.4	-43.7	174.3	-178.4	84.3	0	0	0	112.1	K290 G292 L296 H297 C298	K290-W294 WeakPolarHBondContact O-CB 3.48Å; K290-W294 PolarHBondContact O-N 2.77Å; G292-W294 VanDerWaalsContact C-N 3.32Å; G292-W294 PolarHBondContact O-N 3.4Å; W294-L296 PolarHBondContact O-N 3.1Å; W294-H297 WeakPolarHBondContact O-CB 3.05Å; W294-H297 PolarHBondContact O-N 3.33Å; W294-C298 PolarHBondContact O-N 3.45Å
295	L	85.3	Confident	81.9	Confident	115 Å²	115	72.3 Å²	72.3	60%	0.602	39%	0.386	S	S	*	.	H	α-helix	trans	-61.2	-45.4	176.5	-172.5	77.2	0	0	0	111.8	A291 G292 H297 C298	A291-L295 PolarHBondContact O-N 3.24Å; A291-L295 VanDerWaalsContact O-N 3.08Å; G292-L295 PolarHBondContact O-N 2.95Å; L295-H297 VanDerWaalsContact C-N 3.32Å; L295-H297 PolarHBondContact O-N 3.37Å; L295-C298 WeakPolarHBondContact O-CB 3.48Å; L295-C298 PolarHBondContact O-N 2.92Å
296	L	81.8	Confident	80.7	Confident	66 Å²	66	73.4 Å²	73.4	35%	0.346	39%	0.394	S	S	.	.	H	α-helix	trans	-68.8	-30.6	179.4	-70.1	173.3	0	0	0	112.5	G292 S293 W294 C298 M299 L302 L307	G292-L296 WeakPolarHBondContact O-CG 3.43Å; G292-L296 PolarHBondContact O-N 2.56Å; S293-L296 PolarHBondContact O-N 3.19Å; W294-L296 PolarHBondContact O-N 3.1Å; L296-C298 PolarHBondContact O-N 3.38Å; L296-M299 HydrophobicContact CD2-SD 3.84Å; L296-M299 WeakPolarHBondContact O-CB 3.41Å; L296-M299 PolarHBondContact O-N 3.48Å; L296-L302 HydrophobicContact CD2-CD1 4.13Å; L296-L307 HydrophobicContact CB-CD1 3.93Å; L296-L307 HydrophobicContact CD1-CD1 3.71Å; L296-L307 HydrophobicContact CG-CD1 4.48Å
297	H	79.1	Confident	79.9	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.398	41%	0.405	S	S	.	.	H	α-helix	trans	-63.3	-29.2	176.3	-171.1	79.9	0	0	0	112.7	S293 W294 L295 M299	S293-H297 WeakPolarHBondContact O-CB 3.29Å; S293-H297 PolarHBondContact O-N 3.45Å; W294-H297 WeakPolarHBondContact O-CB 3.05Å; W294-H297 PolarHBondContact O-N 3.33Å; L295-H297 VanDerWaalsContact C-N 3.32Å; L295-H297 PolarHBondContact O-N 3.37Å; H297-M299 PolarHBondContact O-N 3.01Å
298	C	80.1	Confident	79.2	Confident	83 Å²	83	73.5 Å²	73.5	56%	0.561	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.5	174.3	-65.3	0	0	0	0	113.1	W294 L295 L296	W294-C298 PolarHBondContact O-N 3.45Å; L295-C298 WeakPolarHBondContact O-CB 3.48Å; L295-C298 PolarHBondContact O-N 2.92Å; L296-C298 PolarHBondContact O-N 3.38Å
299	M	78.3	Confident	78.4	Confident	99 Å²	99	75.8 Å²	75.8	49%	0.488	41%	0.407	S	S	.	.	S	Bend	trans	-82.7	126.9	-179.1	-62.8	-177.7	66	0	0	111.8	L296 H297 G301 L302	L296-M299 HydrophobicContact CD2-SD 3.84Å; L296-M299 WeakPolarHBondContact O-CB 3.41Å; L296-M299 PolarHBondContact O-N 3.48Å; H297-M299 PolarHBondContact O-N 3.01Å; M299-G301 PolarHBondContact O-N 3.02Å; M299-L302 HydrophobicContact CB-CD1 4.23Å; M299-L302 PolarHBondContact O-N 2.88Å; M299-L302 HydrophobicContact SD-CD1 4.27Å
300	P	70	Confident	77.7	Confident	123 Å²	123	76.2 Å²	76.2	80%	0.799	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	132.2	175.6	24.5	-30.4	0	0	0	110.6
301	G	67.8	Low	77.5	Confident	61 Å²	61	73.1 Å²	73.1	63%	0.629	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.4	-17	179.5	0	0	0	0	0	115.8	M299 W304	M299-G301 PolarHBondContact O-N 3.02Å; G301-W304 PolarHBondContact O-NE1 3.3Å
302	L	65.8	Low	77.2	Confident	57 Å²	57	75.1 Å²	75.1	30%	0.298	40%	0.399	S	S	.	.			trans	-100.6	-3.3	175.8	-65.7	173.7	0	0	0	113.7	L296 M299 W304 L305	L296-L302 HydrophobicContact CD2-CD1 4.13Å; M299-L302 HydrophobicContact CB-CD1 4.23Å; M299-L302 PolarHBondContact O-N 2.88Å; M299-L302 HydrophobicContact SD-CD1 4.27Å; L302-W304 VanDerWaalsContact C-N 3.25Å; L302-W304 PolarHBondContact O-N 3.27Å; L302-L305 HydrophobicContact CD2-CD1 3.64Å; L302-L305 WeakPolarHBondContact O-CB 3.42Å; L302-L305 PolarHBondContact O-N 3.29Å; L302-L305 VanDerWaalsContact O-N 3.12Å
303	K	64.3	Low	76.7	Confident	128 Å²	128	75.9 Å²	75.9	56%	0.557	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-58.3	-34.1	-178.1	-69.3	-173.1	176.1	-174.3	0	113.7	L305 S306	K303-L305 PolarHBondContact O-N 2.93Å; K303-S306 PolarHBondContact O-N 2.69Å
304	W	62.1	Low	76.6	Confident	152 Å²	152	75.6 Å²	75.6	58%	0.576	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.8	-179.6	75.8	-89.4	0	0	0	113.4	G301 L302 S306	G301-W304 PolarHBondContact O-NE1 3.3Å; L302-W304 VanDerWaalsContact C-N 3.25Å; L302-W304 PolarHBondContact O-N 3.27Å; W304-S306 VanDerWaalsContact C-N 3.25Å; W304-S306 PolarHBondContact O-N 3.26Å
305	L	64.8	Low	76.7	Confident	52 Å²	52	69.9 Å²	69.9	27%	0.272	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-76	-10.2	-179.5	-69.3	170.8	0	0	0	113.4	L302 K303 L307	L302-L305 HydrophobicContact CD2-CD1 3.64Å; L302-L305 WeakPolarHBondContact O-CB 3.42Å; L302-L305 PolarHBondContact O-N 3.29Å; L302-L305 VanDerWaalsContact O-N 3.12Å; K303-L305 PolarHBondContact O-N 2.93Å; L305-L307 HydrophobicContact CB-CD2 3.95Å; L305-L307 HydrophobicContact CB-CG 3.91Å; L305-L307 HydrophobicContact CD1-CD2 4.5Å; L305-L307 PolarHBondContact O-N 3.04Å
306	S	70	Confident	76.7	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.161	37%	0.368	C	S	.	.			trans	43.1	42.7	-177.6	-78.1	0	0	0	0	113.4	K303 W304 C308 E309 V310 K541	K303-S306 PolarHBondContact O-N 2.69Å; W304-S306 VanDerWaalsContact C-N 3.25Å; W304-S306 PolarHBondContact O-N 3.26Å; S306-C308 PolarHBondContact O-N 3.15Å; S306-E309 VanDerWaalsContact CB-OE1 3.28Å; S306-E309 WeakPolarHBondContact CB-OE1 3.49Å; S306-E309 WeakPolarHBondContact O-CB 3.37Å; S306-E309 PolarHBondContact O-N 3.02Å; S306-E309 PolarHBondContact OG-OE1 2.84Å; S306-V310 PolarHBondContact O-N 3.16Å; S306-V310 VanDerWaalsContact O-N 3.14Å; S306-K541 PolarHBondContact OG-NZ 3.01Å
307	L	77.4	Confident	76.8	Confident	50 Å²	50	68.4 Å²	68.4	26%	0.262	36%	0.361	S	S	.	.	H	α-helix	trans	-56.4	-31.9	-171.4	-66.8	177.6	0	0	0	113.4	L296 L305 V310 V311	L296-L307 HydrophobicContact CB-CD1 3.93Å; L296-L307 HydrophobicContact CD1-CD1 3.71Å; L296-L307 HydrophobicContact CG-CD1 4.48Å; L305-L307 HydrophobicContact CB-CD2 3.95Å; L305-L307 HydrophobicContact CB-CG 3.91Å; L305-L307 HydrophobicContact CD1-CD2 4.5Å; L305-L307 PolarHBondContact O-N 3.04Å; L307-V310 PolarHBondContact O-N 3.15Å; L307-V311 VanDerWaalsContact O-CG2 3.32Å; L307-V311 WeakPolarHBondContact O-CG2 3.41Å; L307-V311 PolarHBondContact O-N 3.1Å
308	C	80.8	Confident	77.2	Confident	37 Å²	37	64.4 Å²	64.4	25%	0.25	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-47.7	175.1	-61.3	0	0	0	0	111.8	S306 V310 V311 E312	S306-C308 PolarHBondContact O-N 3.15Å; C308-V310 VanDerWaalsContact C-N 3.32Å; C308-V310 PolarHBondContact O-N 2.88Å; C308-V311 PolarHBondContact O-N 3.07Å; C308-E312 WeakPolarHBondContact O-CG 3.42Å; C308-E312 PolarHBondContact O-N 3.42Å
309	E	77.3	Confident	77.6	Confident	85 Å²	85	63.7 Å²	63.7	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-40.4	177.6	-61.3	171	-128.2	0	0	110.9	S306 V311 E312 E313 K541	S306-E309 VanDerWaalsContact CB-OE1 3.28Å; S306-E309 WeakPolarHBondContact CB-OE1 3.49Å; S306-E309 WeakPolarHBondContact O-CB 3.37Å; S306-E309 PolarHBondContact O-N 3.02Å; S306-E309 PolarHBondContact OG-OE1 2.84Å; E309-V311 VanDerWaalsContact C-N 3.33Å; E309-V311 PolarHBondContact O-N 2.79Å; E309-E312 PolarHBondContact O-N 2.87Å; E309-E313 WeakPolarHBondContact O-CG 3.47Å; E309-E313 PolarHBondContact O-N 3.31Å; E309-K541 IonicContact OE1-NZ 3.57Å; E309-K541 PolarHBondContact OE1-NZ 2.87Å; E309-K541 IonicContact OE2-NZ 2.73Å; E309-K541 PolarHBondContact OE2-NZ 3.36Å
310	V	79.4	Confident	78	Confident	39 Å²	39	63.1 Å²	63.1	24%	0.236	33%	0.33	C	S	.	.	H	α-helix	trans	-59.7	-44.3	176.8	170.5	0	0	0	0	111.4	W147 S306 L307 C308 E313 F314	W147-V310 HydrophobicContact CH2-CG1 3.7Å; W147-V310 HydrophobicContact CZ3-CG1 3.86Å; S306-V310 PolarHBondContact O-N 3.16Å; S306-V310 VanDerWaalsContact O-N 3.14Å; L307-V310 PolarHBondContact O-N 3.15Å; C308-V310 VanDerWaalsContact C-N 3.32Å; C308-V310 PolarHBondContact O-N 2.88Å; V310-E313 PolarHBondContact O-N 3.41Å; V310-F314 WeakPolarHBondContact O-CB 3.28Å; V310-F314 PolarHBondContact O-N 3.05Å
311	V	86.5	Confident	78.9	Confident	13 Å²	13	58.1 Å²	58.1	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-38.7	178.2	172.8	0	0	0	0	111.5	M289 K290 L307 C308 E309 F314 E315	M289-V311 HydrophobicContact CB-CG1 3.82Å; M289-V311 HydrophobicContact CB-CG2 4.21Å; M289-V311 HydrophobicContact CE-CG2 4.17Å; K290-V311 HydrophobicContact CG-CG1 3.68Å; L307-V311 VanDerWaalsContact O-CG2 3.32Å; L307-V311 WeakPolarHBondContact O-CG2 3.41Å; L307-V311 PolarHBondContact O-N 3.1Å; C308-V311 PolarHBondContact O-N 3.07Å; E309-V311 VanDerWaalsContact C-N 3.33Å; E309-V311 PolarHBondContact O-N 2.79Å; V311-F314 PolarHBondContact O-N 3.22Å; V311-E315 WeakPolarHBondContact O-CB 3.38Å; V311-E315 PolarHBondContact O-N 3.42Å
312	E	84.9	Confident	79.9	Confident	98 Å²	98	56 Å²	56	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-43.7	175.8	-74.2	174.2	-170.1	0	0	112.2	C308 E309 E315 K316	C308-E312 WeakPolarHBondContact O-CG 3.42Å; C308-E312 PolarHBondContact O-N 3.42Å; E309-E312 PolarHBondContact O-N 2.87Å; E312-E315 PolarHBondContact O-N 3.13Å; E312-K316 WeakPolarHBondContact O-CG 3.4Å; E312-K316 PolarHBondContact O-N 3.01Å; E312-K316 VanDerWaalsContact O-N 3.1Å
313	E	80.4	Confident	81.2	Confident	43 Å²	43	53.9 Å²	53.9	20%	0.201	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-43	175.7	-69.5	-60.4	110.1	0	0	111.3	E309 V310 E315 K316 L317 S544	E309-E313 WeakPolarHBondContact O-CG 3.47Å; E309-E313 PolarHBondContact O-N 3.31Å; V310-E313 PolarHBondContact O-N 3.41Å; E313-E315 PolarHBondContact O-N 3.12Å; E313-K316 PolarHBondContact O-N 3.5Å; E313-K316 IonicContact OE1-NZ 2.91Å; E313-K316 PolarHBondContact OE1-NZ 3.45Å; E313-L317 PolarHBondContact O-N 3.05Å; E313-S544 WeakPolarHBondContact OE2-CB 3.31Å; E313-S544 PolarHBondContact OE2-OG 2.92Å
314	F	86.1	Confident	82.6	Confident	3 Å²	3	48 Å²	48	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-40.2	175.7	179.8	-108.3	0	0	0	112.6	T140 K143 L144 L286 M289 V310 V311 K316 L317 M318	T140-F314 HydrophobicContact CG2-CE1 3.73Å; T140-F314 HydrophobicContact CG2-CZ 4.23Å; T140-F314 VanDerWaalsContact O-CZ 3.31Å; T140-F314 WeakPolarHBondContact O-CZ 3.24Å; K143-F314 HydrophobicContact CB-CE2 4.39Å; K143-F314 HydrophobicContact CB-CZ 4.36Å; L144-F314 VanDerWaalsContact CA-CE2 3.45Å; L144-F314 HydrophobicContact CB-CE1 4.13Å; L144-F314 HydrophobicContact CB-CE2 3.87Å; L144-F314 HydrophobicContact CB-CZ 3.6Å; L144-F314 HydrophobicContact CD1-CD1 4.09Å; L144-F314 HydrophobicContact CD1-CD2 3.79Å; L144-F314 HydrophobicContact CD1-CE1 4.19Å; L144-F314 HydrophobicContact CD1-CE2 3.93Å; L144-F314 HydrophobicContact CD1-CG 3.88Å; L144-F314 HydrophobicContact CD1-CZ 4.12Å; L144-F314 HydrophobicContact CG-CZ 4.45Å; L286-F314 HydrophobicContact CD2-CD1 3.86Å; L286-F314 HydrophobicContact CD2-CE1 4.01Å; M289-F314 HydrophobicContact CE-CD1 3.68Å; M289-F314 HydrophobicContact CE-CE1 4Å; M289-F314 HydrophobicContact SD-CD1 4.21Å; M289-F314 HydrophobicContact SD-CE1 4.07Å; V310-F314 WeakPolarHBondContact O-CB 3.28Å; V310-F314 PolarHBondContact O-N 3.05Å; V311-F314 PolarHBondContact O-N 3.22Å; F314-K316 VanDerWaalsContact C-N 3.34Å; F314-K316 PolarHBondContact O-N 2.63Å; F314-L317 PolarHBondContact O-N 3.02Å; F314-M318 HydrophobicContact CD1-CG 4.01Å; F314-M318 HydrophobicContact CD2-CG 4.14Å; F314-M318 HydrophobicContact CE1-CG 3.44Å; F314-M318 VanDerWaalsContact CE1-CG 3.44Å; F314-M318 HydrophobicContact CE1-SD 4.37Å; F314-M318 HydrophobicContact CE2-CG 3.57Å; F314-M318 HydrophobicContact CE2-SD 3.89Å; F314-M318 HydrophobicContact CG-CG 4.34Å; F314-M318 HydrophobicContact CZ-CG 3.17Å; F314-M318 HydrophobicContact CZ-SD 3.58Å; F314-M318 VanDerWaalsContact CZ-SD 3.58Å; F314-M318 WeakPolarHBondContact O-CB 3.29Å; F314-M318 WeakPolarHBondContact O-CG 3.23Å; F314-M318 PolarHBondContact O-N 3.04Å
315	E	89.1	Confident	84.2	Confident	54 Å²	54	44.3 Å²	44.3	25%	0.252	22%	0.22	S	C	.	.	H	α-helix	trans	-58.2	-44.9	173.9	167.5	176.9	-130.1	0	0	111.8	L286 K290 V311 E312 E313 L317 M318 T319	L286-E315 HydrophobicContact CD1-CB 4.26Å; L286-E315 HydrophobicContact CD1-CG 4.04Å; L286-E315 HydrophobicContact CD2-CB 4.02Å; K290-E315 VanDerWaalsContact CE-CD 3.47Å; K290-E315 WeakPolarHBondContact CE-OE1 3.47Å; K290-E315 WeakPolarHBondContact CE-OE2 3.46Å; K290-E315 IonicContact NZ-OE1 2.7Å; K290-E315 PolarHBondContact NZ-OE1 3.48Å; K290-E315 IonicContact NZ-OE2 3.42Å; K290-E315 PolarHBondContact NZ-OE2 2.99Å; V311-E315 WeakPolarHBondContact O-CB 3.38Å; V311-E315 PolarHBondContact O-N 3.42Å; E312-E315 PolarHBondContact O-N 3.13Å; E313-E315 PolarHBondContact O-N 3.12Å; E315-L317 VanDerWaalsContact C-N 3.29Å; E315-L317 PolarHBondContact O-N 3.31Å; E315-M318 PolarHBondContact O-N 3.49Å; E315-T319 WeakPolarHBondContact O-CB 3.41Å; E315-T319 PolarHBondContact O-N 2.7Å; E315-T319 PolarHBondContact O-OG1 3.31Å
316	K	85.6	Confident	85.6	Confident	113 Å²	113	44.9 Å²	44.9	49%	0.491	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-42.9	178.6	-70	170.3	-169.8	168.5	0	111.1	E312 E313 F314 K320	E312-K316 WeakPolarHBondContact O-CG 3.4Å; E312-K316 PolarHBondContact O-N 3.01Å; E312-K316 VanDerWaalsContact O-N 3.1Å; E313-K316 PolarHBondContact O-N 3.5Å; E313-K316 IonicContact OE1-NZ 2.91Å; E313-K316 PolarHBondContact OE1-NZ 3.45Å; F314-K316 VanDerWaalsContact C-N 3.34Å; F314-K316 PolarHBondContact O-N 2.63Å; K316-K320 WeakPolarHBondContact O-CG 3.49Å; K316-K320 PolarHBondContact O-N 3.12Å
317	L	83.6	Confident	86.8	Confident	37 Å²	37	44.5 Å²	44.5	19%	0.194	22%	0.216	C	C	.	.	H	α-helix	trans	-66.3	-49.1	176.9	-66.7	174.2	0	0	0	111.7	E313 F314 E315 T319 K320 Q321 I455	E313-L317 PolarHBondContact O-N 3.05Å; F314-L317 PolarHBondContact O-N 3.02Å; E315-L317 VanDerWaalsContact C-N 3.29Å; E315-L317 PolarHBondContact O-N 3.31Å; L317-T319 VanDerWaalsContact C-N 3.32Å; L317-T319 PolarHBondContact O-N 3.42Å; L317-K320 PolarHBondContact O-N 2.85Å; L317-Q321 PolarHBondContact O-N 3.15Å; L317-Q321 VanDerWaalsContact O-N 3.14Å; L317-I455 HydrophobicContact CD2-CG2 4.02Å
318	M	87.8	Confident	87.6	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.015	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-37.4	-179	-78.2	-55.6	-59.2	0	0	113.2	K143 V282 L286 F314 E315 K320 Q321 I322	K143-M318 HydrophobicContact CB-CE 4.08Å; K143-M318 HydrophobicContact CB-SD 3.29Å; K143-M318 WeakPolarHBondContact CB-SD 3.33Å; K143-M318 HydrophobicContact CG-CE 4.15Å; K143-M318 HydrophobicContact CG-SD 3.67Å; V282-M318 HydrophobicContact CG1-CB 4.26Å; V282-M318 HydrophobicContact CG1-CE 4.05Å; V282-M318 HydrophobicContact CG2-CE 3.96Å; L286-M318 HydrophobicContact CD1-CB 4.44Å; F314-M318 HydrophobicContact CD1-CG 4.01Å; F314-M318 HydrophobicContact CD2-CG 4.14Å; F314-M318 HydrophobicContact CE1-CG 3.44Å; F314-M318 VanDerWaalsContact CE1-CG 3.44Å; F314-M318 HydrophobicContact CE1-SD 4.37Å; F314-M318 HydrophobicContact CE2-CG 3.57Å; F314-M318 HydrophobicContact CE2-SD 3.89Å; F314-M318 HydrophobicContact CG-CG 4.34Å; F314-M318 HydrophobicContact CZ-CG 3.17Å; F314-M318 HydrophobicContact CZ-SD 3.58Å; F314-M318 VanDerWaalsContact CZ-SD 3.58Å; F314-M318 WeakPolarHBondContact O-CB 3.29Å; F314-M318 WeakPolarHBondContact O-CG 3.23Å; F314-M318 PolarHBondContact O-N 3.04Å; E315-M318 PolarHBondContact O-N 3.49Å; M318-K320 VanDerWaalsContact C-N 3.3Å; M318-K320 PolarHBondContact O-N 3.35Å; M318-Q321 PolarHBondContact O-N 3.08Å; M318-I322 PolarHBondContact O-N 3.01Å
319	T	87.4	Confident	88.4	Confident	67 Å²	67	45 Å²	45	41%	0.411	21%	0.209	S	C	.	.	H	α-helix	trans	-66.3	-34.7	180	-54.9	0	0	0	0	111.6	E315 L317 I322	E315-T319 WeakPolarHBondContact O-CB 3.41Å; E315-T319 PolarHBondContact O-N 2.7Å; E315-T319 PolarHBondContact O-OG1 3.31Å; L317-T319 VanDerWaalsContact C-N 3.32Å; L317-T319 PolarHBondContact O-N 3.42Å; T319-I322 WeakPolarHBondContact O-CG1 3.41Å
320	K	87.7	Confident	89.3	Confident	88 Å²	88	42 Å²	42	38%	0.383	20%	0.196	S	C	.	.	H	α-helix	trans	-69.2	-41.1	174	-68.3	176.2	-178.4	-176.9	0	111.6	K316 L317 M318 I322 D323 F326	K316-K320 WeakPolarHBondContact O-CG 3.49Å; K316-K320 PolarHBondContact O-N 3.12Å; L317-K320 PolarHBondContact O-N 2.85Å; M318-K320 VanDerWaalsContact C-N 3.3Å; M318-K320 PolarHBondContact O-N 3.35Å; K320-I322 VanDerWaalsContact C-N 3.34Å; K320-I322 PolarHBondContact O-N 2.86Å; K320-D323 PolarHBondContact O-N 2.9Å; K320-F326 HydrophobicContact CB-CB 4.44Å; K320-F326 HydrophobicContact CB-CG 4.33Å; K320-F326 HydrophobicContact CG-CD1 4.21Å; K320-F326 HydrophobicContact CG-CE1 4.47Å; K320-F326 HydrophobicContact CG-CG 4.34Å
321	Q	87.7	Confident	90.1	Very high	18 Å²	18	40.3 Å²	40.3	8%	0.084	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-32.2	-179.3	-80.2	-82.4	-52.2	0	0	114.1	K143 V207 L317 M318 D323 G454 I455	K143-Q321 VanDerWaalsContact CE-OE1 3.25Å; V207-Q321 WeakPolarHBondContact CG1-O 2.86Å; L317-Q321 PolarHBondContact O-N 3.15Å; L317-Q321 VanDerWaalsContact O-N 3.14Å; M318-Q321 PolarHBondContact O-N 3.08Å; Q321-D323 VanDerWaalsContact C-N 3.34Å; Q321-G454 PolarHBondContact NE2-O 3.36Å; Q321-I455 HydrophobicContact CG-CD1 4.12Å; Q321-I455 HydrophobicContact CG-CG1 3.95Å
322	I	89.6	Confident	90.5	Very high	15 Å²	15	42.1 Å²	42.1	8%	0.077	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-1.2	-178.9	63.9	173	0	0	0	114.8	V207 V278 R279 V282 M318 T319 K320	V207-I322 HydrophobicContact CG1-CG2 4.17Å; V207-I322 HydrophobicContact CG2-CG2 4.44Å; V278-I322 HydrophobicContact CG1-CG2 4.04Å; R279-I322 HydrophobicContact CB-CD1 4.37Å; R279-I322 HydrophobicContact CG-CD1 4.1Å; V282-I322 HydrophobicContact CG1-CD1 4.45Å; V282-I322 HydrophobicContact CG1-CG2 4.45Å; V282-I322 HydrophobicContact CG2-CG2 4.15Å; M318-I322 PolarHBondContact O-N 3.01Å; T319-I322 WeakPolarHBondContact O-CG1 3.41Å; K320-I322 VanDerWaalsContact C-N 3.34Å; K320-I322 PolarHBondContact O-N 2.86Å
323	D	92.6	Very high	91.1	Very high	14 Å²	14	43.1 Å²	43.1	8%	0.075	19%	0.192	C	C	.	.			trans	-125.7	98.9	177.4	-179.4	-15.8	0	0	0	109.2	K320 Q321 R325 F326 R356	K320-D323 PolarHBondContact O-N 2.9Å; Q321-D323 VanDerWaalsContact C-N 3.34Å; D323-R325 PolarHBondContact O-N 3.12Å; D323-R325 VanDerWaalsContact OD1-CB 3.29Å; D323-R325 WeakPolarHBondContact OD1-CB 3.44Å; D323-R325 VanDerWaalsContact OD1-CG 3.31Å; D323-R325 WeakPolarHBondContact OD1-CG 3.07Å; D323-R325 IonicContact OD1-CZ 2.78Å; D323-R325 PolarHBondContact OD1-N 2.88Å; D323-R325 IonicContact OD1-NE 3.68Å; D323-R325 PolarHBondContact OD1-NE 2.93Å; D323-R325 IonicContact OD1-NH2 3.52Å; D323-R325 IonicContact OD2-CZ 3.46Å; D323-R325 IonicContact OD2-NE 3.31Å; D323-R325 PolarHBondContact OD2-NE 3.4Å; D323-R325 IonicContact OD2-NH2 2.69Å; D323-R325 PolarHBondContact OD2-NH2 3.15Å; D323-F326 HydrophobicContact CB-CD2 3.8Å; D323-F326 HydrophobicContact CB-CE2 4.05Å; D323-F326 WeakPolarHBondContact O-CD2 3.32Å; D323-F326 PolarHBondContact O-N 3.17Å; D323-R356 WeakPolarHBondContact OD1-CA 3.46Å; D323-R356 IonicContact OD2-NE 3.97Å
324	L	94.6	Very high	91.9	Very high	4 Å²	4	41 Å²	41	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-10.7	-172.6	-61	-179.6	0	0	0	114	K272 V274 F326 E327 A328 R356 L359	K272-L324 HydrophobicContact CB-CD1 4.13Å; V274-L324 HydrophobicContact CG2-CD1 3.77Å; V274-L324 HydrophobicContact CG2-CD2 4.36Å; V274-L324 HydrophobicContact CG2-CG 3.8Å; L324-F326 VanDerWaalsContact C-N 3.26Å; L324-F326 PolarHBondContact O-N 2.92Å; L324-E327 PolarHBondContact O-N 3.31Å; L324-A328 PolarHBondContact O-N 3.38Å; L324-A328 VanDerWaalsContact O-N 3.09Å; L324-R356 PolarHBondContact N-O 2.96Å; L324-R356 VanDerWaalsContact N-O 3.13Å; L324-L359 HydrophobicContact CB-CB 3.82Å; L324-L359 HydrophobicContact CD1-CB 3.96Å; L324-L359 HydrophobicContact CG-CB 4.44Å
325	R	94.1	Very high	92.3	Very high	75 Å²	75	43.4 Å²	43.4	28%	0.283	19%	0.194	S	C	.	.	H	α-helix	trans	-68.9	-25.5	172.7	-54.7	176.9	-63.3	156.8	8.4	112.4	D323 R329 V354 T355 R356	D323-R325 PolarHBondContact O-N 3.12Å; D323-R325 VanDerWaalsContact OD1-CB 3.29Å; D323-R325 WeakPolarHBondContact OD1-CB 3.44Å; D323-R325 VanDerWaalsContact OD1-CG 3.31Å; D323-R325 WeakPolarHBondContact OD1-CG 3.07Å; D323-R325 IonicContact OD1-CZ 2.78Å; D323-R325 PolarHBondContact OD1-N 2.88Å; D323-R325 IonicContact OD1-NE 3.68Å; D323-R325 PolarHBondContact OD1-NE 2.93Å; D323-R325 IonicContact OD1-NH2 3.52Å; D323-R325 IonicContact OD2-CZ 3.46Å; D323-R325 IonicContact OD2-NE 3.31Å; D323-R325 PolarHBondContact OD2-NE 3.4Å; D323-R325 IonicContact OD2-NH2 2.69Å; D323-R325 PolarHBondContact OD2-NH2 3.15Å; R325-R329 WeakPolarHBondContact O-CG 3.42Å; R325-R329 PolarHBondContact O-N 2.87Å; R325-R329 PolarHBondContact O-NH1 3.41Å; R325-R329 VanDerWaalsContact O-NH1 3.08Å; R325-V354 HydrophobicContact CG-CG1 4.24Å; R325-T355 WeakPolarHBondContact CG-O 3.41Å; R325-R356 VanDerWaalsContact NE-CG 3.26Å
326	F	94.3	Very high	92.6	Very high	64 Å²	64	46.1 Å²	46.1	28%	0.281	21%	0.207	S	C	.	.	H	α-helix	trans	-69.7	-45.7	173.9	-75.4	-83.9	0	0	0	110.6	K320 D323 L324 A328 R329 N330	K320-F326 HydrophobicContact CB-CB 4.44Å; K320-F326 HydrophobicContact CB-CG 4.33Å; K320-F326 HydrophobicContact CG-CD1 4.21Å; K320-F326 HydrophobicContact CG-CE1 4.47Å; K320-F326 HydrophobicContact CG-CG 4.34Å; D323-F326 HydrophobicContact CB-CD2 3.8Å; D323-F326 HydrophobicContact CB-CE2 4.05Å; D323-F326 WeakPolarHBondContact O-CD2 3.32Å; D323-F326 PolarHBondContact O-N 3.17Å; L324-F326 VanDerWaalsContact C-N 3.26Å; L324-F326 PolarHBondContact O-N 2.92Å; F326-A328 PolarHBondContact O-N 2.87Å; F326-R329 VanDerWaalsContact CG-NH2 3.3Å; F326-R329 PolarHBondContact O-N 2.92Å; F326-N330 PolarHBondContact O-N 2.97Å; F326-N330 PolarHBondContact O-ND2 2.62Å; F326-N330 PolarHBondContact O-OD1 2.9Å
327	E	95.2	Very high	93.1	Very high	14 Å²	14	41.8 Å²	41.8	7%	0.065	19%	0.189	C	C	.	.	H	α-helix	trans	-56.8	-50.7	175.2	-174.4	176.8	169	0	0	110.8	K272 L324 R329 N330 I331 L359	K272-E327 IonicContact NZ-OE1 2.69Å; K272-E327 PolarHBondContact NZ-OE1 2.67Å; L324-E327 PolarHBondContact O-N 3.31Å; E327-R329 VanDerWaalsContact C-N 3.34Å; E327-R329 PolarHBondContact O-N 3.2Å; E327-N330 WeakPolarHBondContact O-CB 3.43Å; E327-N330 PolarHBondContact O-N 3.17Å; E327-I331 HydrophobicContact CG-CD1 4.12Å; E327-I331 WeakPolarHBondContact O-CG1 3.47Å; E327-I331 PolarHBondContact O-N 3.34Å; E327-L359 HydrophobicContact CB-CD2 4.12Å; E327-L359 HydrophobicContact CG-CD2 3.91Å
328	A	95.6	Very high	93.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-54.6	-46	176.3	0	0	0	0	0	113.4	L324 F326 N330 I331 E332 P349 V354 L359	L324-A328 PolarHBondContact O-N 3.38Å; L324-A328 VanDerWaalsContact O-N 3.09Å; F326-A328 PolarHBondContact O-N 2.87Å; A328-N330 VanDerWaalsContact C-N 3.33Å; A328-N330 PolarHBondContact O-N 3.43Å; A328-I331 PolarHBondContact O-N 3.1Å; A328-E332 VanDerWaalsContact O-CG 3.3Å; A328-E332 WeakPolarHBondContact O-CG 3.42Å; A328-E332 PolarHBondContact O-N 3.37Å; A328-P349 HydrophobicContact CB-CB 4.09Å; A328-P349 HydrophobicContact CB-CG 4.24Å; A328-V354 HydrophobicContact CB-CG1 3.54Å; A328-V354 HydrophobicContact CB-CG2 4.36Å; A328-L359 HydrophobicContact CB-CD1 3.81Å
329	R	96.1	Very high	93.9	Very high	97 Å²	97	49.4 Å²	49.4	37%	0.366	22%	0.215	S	C	.	.	H	α-helix	trans	-66	-35.4	177.8	-76.8	-167.8	-57.5	-79.3	-2.9	113	R325 F326 E327 E332 R333	R325-R329 WeakPolarHBondContact O-CG 3.42Å; R325-R329 PolarHBondContact O-N 2.87Å; R325-R329 PolarHBondContact O-NH1 3.41Å; R325-R329 VanDerWaalsContact O-NH1 3.08Å; F326-R329 VanDerWaalsContact CG-NH2 3.3Å; F326-R329 PolarHBondContact O-N 2.92Å; E327-R329 VanDerWaalsContact C-N 3.34Å; E327-R329 PolarHBondContact O-N 3.2Å; R329-E332 WeakPolarHBondContact CA-OE2 3.33Å; R329-R333 WeakPolarHBondContact O-CB 3.45Å; R329-R333 PolarHBondContact O-N 2.79Å
330	N	96.7	Very high	93.9	Very high	24 Å²	24	52.4 Å²	52.4	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-41.8	177	-66.1	-18.3	0	0	0	110.3	F326 E327 A328 R333 F334 F402 A453 V456	F326-N330 PolarHBondContact O-N 2.97Å; F326-N330 PolarHBondContact O-ND2 2.62Å; F326-N330 PolarHBondContact O-OD1 2.9Å; E327-N330 WeakPolarHBondContact O-CB 3.43Å; E327-N330 PolarHBondContact O-N 3.17Å; A328-N330 VanDerWaalsContact C-N 3.33Å; A328-N330 PolarHBondContact O-N 3.43Å; N330-R333 PolarHBondContact O-N 2.84Å; N330-F334 WeakPolarHBondContact O-CD2 2.94Å; N330-F334 PolarHBondContact O-N 3.22Å; N330-F402 HydrophobicContact CB-CZ 4.28Å; N330-A453 HydrophobicContact CB-CB 3.95Å; N330-A453 VanDerWaalsContact CB-O 3.23Å; N330-A453 WeakPolarHBondContact CB-O 3.34Å; N330-A453 PolarHBondContact ND2-O 3Å; N330-V456 HydrophobicContact CB-CG2 3.97Å
331	I	96.4	Very high	94	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-51.6	174.1	-66.7	175.2	0	0	0	110.5	E327 A328 R333 F334 Q335 F346 P347 P349 E361 A453	E327-I331 HydrophobicContact CG-CD1 4.12Å; E327-I331 WeakPolarHBondContact O-CG1 3.47Å; E327-I331 PolarHBondContact O-N 3.34Å; A328-I331 PolarHBondContact O-N 3.1Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 3.46Å; I331-F334 CarbonylContact O-C 3.51Å; I331-F334 WeakPolarHBondContact O-CA 3.38Å; I331-F334 WeakPolarHBondContact O-CB 3.44Å; I331-F334 PolarHBondContact O-N 3.3Å; I331-Q335 WeakPolarHBondContact O-CG 3.48Å; I331-Q335 PolarHBondContact O-N 3.33Å; I331-F346 HydrophobicContact CG2-CB 4.25Å; I331-P347 WeakPolarHBondContact CG2-O 3.46Å; I331-P349 HydrophobicContact CB-CG 3.94Å; I331-P349 HydrophobicContact CD1-CG 4.5Å; I331-P349 HydrophobicContact CG2-CG 3.71Å; I331-E361 WeakPolarHBondContact CD1-OE2 3.39Å; I331-A453 HydrophobicContact CG1-CB 3.72Å
332	E	95.5	Very high	93.9	Very high	52 Å²	52	56.7 Å²	56.7	24%	0.243	25%	0.25	C	S	.	.	H	α-helix	trans	-53.3	-44.5	176.1	-72.6	161.4	172.4	0	0	111	A328 R329 F334 Q335 E336 P349 R351	A328-E332 VanDerWaalsContact O-CG 3.3Å; A328-E332 WeakPolarHBondContact O-CG 3.42Å; A328-E332 PolarHBondContact O-N 3.37Å; R329-E332 WeakPolarHBondContact CA-OE2 3.33Å; E332-F334 PolarHBondContact O-N 3.26Å; E332-Q335 WeakPolarHBondContact O-CB 3.32Å; E332-Q335 PolarHBondContact O-N 3.03Å; E332-E336 PolarHBondContact O-N 3.06Å; E332-P349 HydrophobicContact CG-CG 4.14Å; E332-R351 VanDerWaalsContact CD-NH2 3.31Å; E332-R351 IonicContact OE1-CZ 2.99Å; E332-R351 VanDerWaalsContact OE1-CZ 3.24Å; E332-R351 IonicContact OE1-NE 3.75Å; E332-R351 PolarHBondContact OE1-NE 2.89Å; E332-R351 IonicContact OE1-NH2 3.86Å; E332-R351 PolarHBondContact OE1-NH2 3.3Å; E332-R351 IonicContact OE2-NH2 2.73Å; E332-R351 PolarHBondContact OE2-NH2 2.97Å
333	R	97	Very high	94	Very high	118 Å²	118	58 Å²	58	45%	0.445	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-37.4	177.1	-176.3	56	176.1	177.7	4.6	113	R329 N330 I331 E336 N337 F402	R329-R333 WeakPolarHBondContact O-CB 3.45Å; R329-R333 PolarHBondContact O-N 2.79Å; N330-R333 PolarHBondContact O-N 2.84Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 3.46Å; R333-E336 WeakPolarHBondContact CD-OE2 3.28Å; R333-E336 IonicContact CZ-OE2 3.25Å; R333-E336 IonicContact NH1-OE2 3.39Å; R333-E336 PolarHBondContact NH1-OE2 2.93Å; R333-E336 PolarHBondContact O-N 3.07Å; R333-N337 PolarHBondContact NE-OD1 3.07Å; R333-N337 WeakPolarHBondContact O-CB 3.5Å; R333-N337 VanDerWaalsContact O-CG 3.25Å; R333-N337 PolarHBondContact O-N 3.42Å; R333-F402 HydrophobicContact CB-CE1 4.07Å; R333-F402 HydrophobicContact CB-CZ 4.18Å; R333-F402 HydrophobicContact CG-CD1 4.17Å; R333-F402 HydrophobicContact CG-CE1 3.87Å; R333-F402 HydrophobicContact CG-CE2 4.4Å; R333-F402 HydrophobicContact CG-CZ 3.99Å
334	F	97.1	Very high	94	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-42.1	174	-81.3	-59.6	0	0	0	111.3	N330 I331 E332 E336 N337 F338 F346 M396 F402 H404 A453 V456	N330-F334 WeakPolarHBondContact O-CD2 2.94Å; N330-F334 PolarHBondContact O-N 3.22Å; I331-F334 CarbonylContact O-C 3.51Å; I331-F334 WeakPolarHBondContact O-CA 3.38Å; I331-F334 WeakPolarHBondContact O-CB 3.44Å; I331-F334 PolarHBondContact O-N 3.3Å; E332-F334 PolarHBondContact O-N 3.26Å; F334-E336 VanDerWaalsContact C-N 3.32Å; F334-E336 PolarHBondContact O-N 2.91Å; F334-N337 PolarHBondContact O-N 2.82Å; F334-F338 HydrophobicContact CD1-CD2 4.31Å; F334-F338 HydrophobicContact CD1-CE2 4.01Å; F334-F338 WeakPolarHBondContact O-CB 3.41Å; F334-F338 VanDerWaalsContact O-CD2 3.31Å; F334-F338 WeakPolarHBondContact O-CD2 3Å; F334-F338 PolarHBondContact O-N 2.9Å; F334-F346 HydrophobicContact CB-CD1 3.68Å; F334-F346 HydrophobicContact CB-CD2 3.91Å; F334-F346 HydrophobicContact CB-CE1 3.48Å; F334-F346 VanDerWaalsContact CB-CE1 3.48Å; F334-F346 HydrophobicContact CB-CE2 3.75Å; F334-F346 HydrophobicContact CB-CG 3.88Å; F334-F346 HydrophobicContact CB-CZ 3.52Å; F334-F346 HydrophobicContact CD1-CE1 4.03Å; F334-F346 HydrophobicContact CD1-CE2 4.45Å; F334-F346 AromaticContact CD1-CZ 3.72Å; F334-F346 HydrophobicContact CD1-CZ 3.72Å; F334-F346 HydrophobicContact CD2-CD1 4.34Å; F334-F346 AromaticContact CD2-CE1 3.79Å; F334-F346 HydrophobicContact CD2-CE1 3.79Å; F334-F346 HydrophobicContact CD2-CZ 4.33Å; F334-F346 HydrophobicContact CG-CD1 4.15Å; F334-F346 AromaticContact CG-CE1 3.51Å; F334-F346 HydrophobicContact CG-CE1 3.51Å; F334-F346 HydrophobicContact CG-CE2 4.32Å; F334-F346 AromaticContact CG-CZ 3.62Å; F334-F346 HydrophobicContact CG-CZ 3.62Å; F334-M396 HydrophobicContact CE1-CG 4.22Å; F334-M396 HydrophobicContact CE1-SD 3.81Å; F334-M396 HydrophobicContact CZ-SD 4.39Å; F334-F402 AromaticContact CD1-CD1 3.99Å; F334-F402 HydrophobicContact CD1-CD1 3.99Å; F334-F402 HydrophobicContact CD1-CE1 4.28Å; F334-F402 HydrophobicContact CD2-CD1 4.46Å; F334-F402 AromaticContact CD2-CE1 3.97Å; F334-F402 HydrophobicContact CD2-CE1 3.97Å; F334-F402 AromaticContact CE1-CD1 3.54Å; F334-F402 HydrophobicContact CE1-CD1 3.54Å; F334-F402 AromaticContact CE1-CE1 3.99Å; F334-F402 HydrophobicContact CE1-CE1 3.99Å; F334-F402 WeakPolarHBondContact CE1-O 3.41Å; F334-F402 HydrophobicContact CE2-CD1 4.05Å; F334-F402 AromaticContact CE2-CE1 3.64Å; F334-F402 HydrophobicContact CE2-CE1 3.64Å; F334-F402 HydrophobicContact CG-CD1 4.42Å; F334-F402 HydrophobicContact CG-CE1 4.26Å; F334-F402 AromaticContact CZ-CD1 3.55Å; F334-F402 HydrophobicContact CZ-CD1 3.55Å; F334-F402 AromaticContact CZ-CE1 3.64Å; F334-F402 HydrophobicContact CZ-CE1 3.64Å; F334-H404 HydrophobicContact CE2-CB 4.47Å; F334-H404 HydrophobicContact CZ-CB 3.92Å; F334-A453 HydrophobicContact CD2-CB 3.79Å; F334-A453 HydrophobicContact CE2-CB 3.77Å; F334-V456 HydrophobicContact CE2-CG2 3.77Å; F334-V456 HydrophobicContact CZ-CG2 4.03Å
335	Q	95.3	Very high	93.9	Very high	53 Å²	53	60.2 Å²	60.2	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-57.3	-45.4	174.2	-68.4	-177.1	-49.7	0	0	111.5	I331 E332 N337 F338 R339 F346 P347 T348	I331-Q335 WeakPolarHBondContact O-CG 3.48Å; I331-Q335 PolarHBondContact O-N 3.33Å; E332-Q335 WeakPolarHBondContact O-CB 3.32Å; E332-Q335 PolarHBondContact O-N 3.03Å; Q335-N337 PolarHBondContact O-N 3.41Å; Q335-F338 PolarHBondContact O-N 3.09Å; Q335-R339 PolarHBondContact O-N 3.4Å; Q335-F346 HydrophobicContact CG-CB 3.86Å; Q335-F346 PolarHBondContact NE2-O 3.13Å; Q335-F346 VanDerWaalsContact NE2-O 3.15Å; Q335-P347 PolarHBondContact NE2-O 2.91Å; Q335-P347 VanDerWaalsContact NE2-O 3.16Å; Q335-T348 PolarHBondContact NE2-OG1 2.81Å
336	E	95.2	Very high	94	Very high	111 Å²	111	57 Å²	57	52%	0.519	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-46.9	174.8	-71	175.7	178.5	0	0	112.6	E332 R333 F334 F338 R339	E332-E336 PolarHBondContact O-N 3.06Å; R333-E336 WeakPolarHBondContact CD-OE2 3.28Å; R333-E336 IonicContact CZ-OE2 3.25Å; R333-E336 IonicContact NH1-OE2 3.39Å; R333-E336 PolarHBondContact NH1-OE2 2.93Å; R333-E336 PolarHBondContact O-N 3.07Å; F334-E336 VanDerWaalsContact C-N 3.32Å; F334-E336 PolarHBondContact O-N 2.91Å; E336-F338 VanDerWaalsContact C-N 3.27Å; E336-F338 PolarHBondContact O-N 3.5Å; E336-R339 WeakPolarHBondContact O-CG 3.26Å
337	N	95.8	Very high	94	Very high	21 Å²	21	54 Å²	54	11%	0.112	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-35	-178.7	-75.2	-7.7	0	0	0	111.6	R333 F334 Q335 K395	R333-N337 PolarHBondContact NE-OD1 3.07Å; R333-N337 WeakPolarHBondContact O-CB 3.5Å; R333-N337 VanDerWaalsContact O-CG 3.25Å; R333-N337 PolarHBondContact O-N 3.42Å; F334-N337 PolarHBondContact O-N 2.82Å; Q335-N337 PolarHBondContact O-N 3.41Å; N337-K395 VanDerWaalsContact O-CE 3.27Å; N337-K395 WeakPolarHBondContact O-CE 2.93Å; N337-K395 PolarHBondContact O-NZ 2.93Å
338	F	95.3	Very high	93.9	Very high	6 Å²	6	55 Å²	55	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-102.3	7.3	-173.7	-75.4	-88	0	0	0	114.3	F334 Q335 E336 D340 M341 I344 F346 T392 K395 M396	F334-F338 HydrophobicContact CD1-CD2 4.31Å; F334-F338 HydrophobicContact CD1-CE2 4.01Å; F334-F338 WeakPolarHBondContact O-CB 3.41Å; F334-F338 VanDerWaalsContact O-CD2 3.31Å; F334-F338 WeakPolarHBondContact O-CD2 3Å; F334-F338 PolarHBondContact O-N 2.9Å; Q335-F338 PolarHBondContact O-N 3.09Å; E336-F338 VanDerWaalsContact C-N 3.27Å; E336-F338 PolarHBondContact O-N 3.5Å; F338-D340 PolarHBondContact O-N 2.79Å; F338-M341 HydrophobicContact CD1-CB 4.35Å; F338-M341 HydrophobicContact CD1-CG 4.47Å; F338-M341 HydrophobicContact CD1-SD 3.64Å; F338-M341 HydrophobicContact CE1-SD 3.8Å; F338-M341 PolarHBondContact O-N 3.4Å; F338-I344 HydrophobicContact CB-CG2 4.44Å; F338-I344 HydrophobicContact CD1-CB 3.95Å; F338-I344 HydrophobicContact CD1-CG1 4.17Å; F338-I344 HydrophobicContact CD1-CG2 3.78Å; F338-I344 HydrophobicContact CE1-CG1 4.46Å; F338-I344 HydrophobicContact CE1-CG2 4.25Å; F338-I344 HydrophobicContact CG-CG2 4.11Å; F338-F346 HydrophobicContact CB-CE2 4.29Å; F338-F346 AromaticContact CD2-CE2 3.66Å; F338-F346 HydrophobicContact CD2-CE2 3.66Å; F338-F346 HydrophobicContact CD2-CZ 4.2Å; F338-F346 HydrophobicContact CE2-CE2 4.22Å; F338-F346 HydrophobicContact CE2-CZ 4.34Å; F338-F346 AromaticContact CG-CE2 3.99Å; F338-F346 HydrophobicContact CG-CE2 3.99Å; F338-T392 HydrophobicContact CE1-CG2 3.77Å; F338-T392 HydrophobicContact CZ-CG2 3.78Å; F338-K395 HydrophobicContact CD1-CD 4.21Å; F338-K395 HydrophobicContact CE1-CD 3.74Å; F338-K395 HydrophobicContact CZ-CD 4.11Å; F338-M396 HydrophobicContact CE2-CG 3.96Å; F338-M396 HydrophobicContact CZ-CG 3.75Å
339	R	91.7	Very high	93.8	Very high	195 Å²	195	55.5 Å²	55.5	74%	0.736	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-29.5	-179.3	74.8	-175.4	-172.2	174.8	0.4	114.9	Q335 E336 M341	Q335-R339 PolarHBondContact O-N 3.4Å; E336-R339 WeakPolarHBondContact O-CG 3.26Å; R339-M341 VanDerWaalsContact C-N 3.33Å
340	D	89	Confident	93.4	Very high	130 Å²	130	50.9 Å²	50.9	70%	0.695	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	5.2	-177.4	-56.2	-50.9	0	0	0	112.1	F338	F338-D340 PolarHBondContact O-N 2.79Å
341	M	89.7	Confident	92.8	Very high	41 Å²	41	53.3 Å²	53.3	20%	0.202	24%	0.242	C	C	.	.			trans	-121.5	92.6	-178.6	-69.1	-174.4	69.2	0	0	111.2	F338 R339 N343 I344 K395	F338-M341 HydrophobicContact CD1-CB 4.35Å; F338-M341 HydrophobicContact CD1-CG 4.47Å; F338-M341 HydrophobicContact CD1-SD 3.64Å; F338-M341 HydrophobicContact CE1-SD 3.8Å; F338-M341 PolarHBondContact O-N 3.4Å; R339-M341 VanDerWaalsContact C-N 3.33Å; M341-N343 PolarHBondContact O-N 3.35Å; M341-N343 VanDerWaalsContact O-N 3.08Å; M341-I344 HydrophobicContact CB-CG1 4.42Å; M341-I344 HydrophobicContact CE-CG1 3.88Å; M341-I344 PolarHBondContact O-N 2.7Å; M341-I344 VanDerWaalsContact O-N 3.15Å; M341-K395 HydrophobicContact SD-CD 3.49Å; M341-K395 WeakPolarHBondContact SD-CD 3.13Å
342	E	85.6	Confident	92.2	Very high	155 Å²	155	56.9 Å²	56.9	72%	0.724	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.5	-178.1	-63.1	176.9	-178.9	0	0	114.4	Q447	E342-Q447 PolarHBondContact O-NE2 3.34Å
343	N	90.3	Very high	91.9	Very high	42 Å²	42	55.1 Å²	55.1	23%	0.225	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.8	-179.4	64.2	-26.2	0	0	0	113.9	M341 M388 Q447 L448	M341-N343 PolarHBondContact O-N 3.35Å; M341-N343 VanDerWaalsContact O-N 3.08Å; N343-M388 HydrophobicContact CB-SD 3.77Å; N343-M388 WeakPolarHBondContact ND2-CG 3.41Å; N343-Q447 CarbonylContact O-C 3.43Å; N343-Q447 VanDerWaalsContact O-CA 3.26Å; N343-Q447 WeakPolarHBondContact O-CA 3.2Å; N343-L448 PolarHBondContact O-N 2.86Å
344	I	93.6	Very high	91.7	Very high	12 Å²	12	50.1 Å²	50.1	6%	0.062	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.8	178.9	-54.1	-58.9	0	0	0	109.3	F338 M341 F346 M388 T392 L448 L450	F338-I344 HydrophobicContact CB-CG2 4.44Å; F338-I344 HydrophobicContact CD1-CB 3.95Å; F338-I344 HydrophobicContact CD1-CG1 4.17Å; F338-I344 HydrophobicContact CD1-CG2 3.78Å; F338-I344 HydrophobicContact CE1-CG1 4.46Å; F338-I344 HydrophobicContact CE1-CG2 4.25Å; F338-I344 HydrophobicContact CG-CG2 4.11Å; M341-I344 HydrophobicContact CB-CG1 4.42Å; M341-I344 HydrophobicContact CE-CG1 3.88Å; M341-I344 PolarHBondContact O-N 2.7Å; M341-I344 VanDerWaalsContact O-N 3.15Å; I344-F346 HydrophobicContact CG2-CD2 4.33Å; I344-F346 HydrophobicContact CG2-CE2 3.76Å; I344-M388 HydrophobicContact CD1-CB 4.47Å; I344-T392 HydrophobicContact CD1-CG2 4.45Å; I344-T392 WeakPolarHBondContact CD1-OG1 3.42Å; I344-T392 WeakPolarHBondContact CG1-OG1 3.38Å; I344-T392 HydrophobicContact CG2-CG2 4.42Å; I344-L448 HydrophobicContact CD1-CB 3.86Å; I344-L448 HydrophobicContact CD1-CD1 4.07Å; I344-L448 HydrophobicContact CD1-CG 4.2Å; I344-L450 HydrophobicContact CG2-CD1 4.45Å
345	K	92.9	Very high	91.5	Very high	52 Å²	52	51.6 Å²	51.6	23%	0.226	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.8	-178.1	-164.3	176.5	-170.5	-172.2	0	110.9	E364 L448 V449 L450	K345-E364 WeakPolarHBondContact CD-OE2 3.24Å; K345-E364 WeakPolarHBondContact CE-OE2 3.09Å; K345-E364 IonicContact NZ-OE2 2.67Å; K345-E364 PolarHBondContact NZ-OE2 2.97Å; K345-L448 PolarHBondContact N-O 2.69Å; K345-V449 HydrophobicContact CB-CG2 4.24Å; K345-V449 CarbonylContact O-C 3.54Å; K345-V449 VanDerWaalsContact O-CA 3.3Å; K345-V449 WeakPolarHBondContact O-CA 3.16Å; K345-L450 PolarHBondContact O-N 3.3Å
346	F	95.1	Very high	91.4	Very high	7 Å²	7	54.7 Å²	54.7	3%	0.031	26%	0.258	C	S	.	.			trans	-124.7	144.3	168.5	-69.2	-99.8	0	0	0	107.8	I331 F334 Q335 F338 I344 L450	I331-F346 HydrophobicContact CG2-CB 4.25Å; F334-F346 HydrophobicContact CB-CD1 3.68Å; F334-F346 HydrophobicContact CB-CD2 3.91Å; F334-F346 HydrophobicContact CB-CE1 3.48Å; F334-F346 VanDerWaalsContact CB-CE1 3.48Å; F334-F346 HydrophobicContact CB-CE2 3.75Å; F334-F346 HydrophobicContact CB-CG 3.88Å; F334-F346 HydrophobicContact CB-CZ 3.52Å; F334-F346 HydrophobicContact CD1-CE1 4.03Å; F334-F346 HydrophobicContact CD1-CE2 4.45Å; F334-F346 AromaticContact CD1-CZ 3.72Å; F334-F346 HydrophobicContact CD1-CZ 3.72Å; F334-F346 HydrophobicContact CD2-CD1 4.34Å; F334-F346 AromaticContact CD2-CE1 3.79Å; F334-F346 HydrophobicContact CD2-CE1 3.79Å; F334-F346 HydrophobicContact CD2-CZ 4.33Å; F334-F346 HydrophobicContact CG-CD1 4.15Å; F334-F346 AromaticContact CG-CE1 3.51Å; F334-F346 HydrophobicContact CG-CE1 3.51Å; F334-F346 HydrophobicContact CG-CE2 4.32Å; F334-F346 AromaticContact CG-CZ 3.62Å; F334-F346 HydrophobicContact CG-CZ 3.62Å; Q335-F346 HydrophobicContact CG-CB 3.86Å; Q335-F346 PolarHBondContact NE2-O 3.13Å; Q335-F346 VanDerWaalsContact NE2-O 3.15Å; F338-F346 HydrophobicContact CB-CE2 4.29Å; F338-F346 AromaticContact CD2-CE2 3.66Å; F338-F346 HydrophobicContact CD2-CE2 3.66Å; F338-F346 HydrophobicContact CD2-CZ 4.2Å; F338-F346 HydrophobicContact CE2-CE2 4.22Å; F338-F346 HydrophobicContact CE2-CZ 4.34Å; F338-F346 AromaticContact CG-CE2 3.99Å; F338-F346 HydrophobicContact CG-CE2 3.99Å; I344-F346 HydrophobicContact CG2-CD2 4.33Å; I344-F346 HydrophobicContact CG2-CE2 3.76Å; F346-L450 HydrophobicContact CD1-CB 3.89Å; F346-L450 WeakPolarHBondContact CD1-O 3.18Å; F346-L450 HydrophobicContact CE1-CB 3.51Å; F346-L450 HydrophobicContact CE1-CD1 4.05Å; F346-L450 HydrophobicContact CE1-CG 4.29Å; F346-L450 HydrophobicContact CE2-CD1 4.29Å; F346-L450 HydrophobicContact CZ-CB 3.87Å; F346-L450 HydrophobicContact CZ-CD1 3.6Å; F346-L450 HydrophobicContact CZ-CG 4.14Å
347	P	94.3	Very high	91.4	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-53.7	150.2	173.4	-23.9	32.6	0	0	0	111.2	I331 Q335 P349 E361 T362 E364 L450 L451	I331-P347 WeakPolarHBondContact CG2-O 3.46Å; Q335-P347 PolarHBondContact NE2-O 2.91Å; Q335-P347 VanDerWaalsContact NE2-O 3.16Å; P347-P349 WeakPolarHBondContact O-CD 3.41Å; P347-E361 HydrophobicContact CB-CB 4.06Å; P347-E361 HydrophobicContact CB-CG 3.99Å; P347-T362 WeakPolarHBondContact CA-OG1 3.4Å; P347-E364 HydrophobicContact CB-CG 4.49Å; P347-E364 HydrophobicContact CG-CG 4.18Å; P347-L450 WeakPolarHBondContact CD-O 3.3Å; P347-L451 HydrophobicContact CG-CD2 3.42Å; P347-L451 VanDerWaalsContact CG-CD2 3.42Å
348	T	93.3	Very high	91.4	Very high	37 Å²	37	51.8 Å²	51.8	23%	0.227	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-95.3	118.4	175.7	-56	0	0	0	0	109.6	I228 Q335 L350 E361 T362	I228-T348 HydrophobicContact CD1-CG2 3.44Å; I228-T348 VanDerWaalsContact CD1-CG2 3.44Å; I228-T348 HydrophobicContact CG1-CG2 4.07Å; Q335-T348 PolarHBondContact NE2-OG1 2.81Å; T348-L350 WeakPolarHBondContact O-CD1 3Å; T348-L350 PolarHBondContact O-N 2.81Å; T348-E361 CarbonylContact O-C 3.6Å; T348-E361 WeakPolarHBondContact O-CA 3.43Å; T348-E361 WeakPolarHBondContact O-CB 3.31Å; T348-T362 PolarHBondContact N-OG1 3.27Å; T348-T362 PolarHBondContact O-N 2.93Å
349	P	93.7	Very high	91.4	Very high	9 Å²	9	51.5 Å²	51.5	6%	0.058	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	128.1	172.8	-24	37.6	0	0	0	111.2	A328 I331 E332 P347 R351 V354 L359	A328-P349 HydrophobicContact CB-CB 4.09Å; A328-P349 HydrophobicContact CB-CG 4.24Å; I331-P349 HydrophobicContact CB-CG 3.94Å; I331-P349 HydrophobicContact CD1-CG 4.5Å; I331-P349 HydrophobicContact CG2-CG 3.71Å; E332-P349 HydrophobicContact CG-CG 4.14Å; P347-P349 WeakPolarHBondContact O-CD 3.41Å; P349-R351 PolarHBondContact O-N 2.86Å; P349-V354 HydrophobicContact CB-CG2 4.24Å; P349-L359 HydrophobicContact CB-CD1 4.12Å
350	L	88.9	Confident	91.6	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	98.9	-178	-85.5	58	0	0	0	109.8	A215 F225 V269 T348 F353 V360 T362	A215-L350 HydrophobicContact CB-CD2 4.05Å; F225-L350 HydrophobicContact CD2-CB 4.44Å; F225-L350 HydrophobicContact CD2-CD2 4.47Å; F225-L350 HydrophobicContact CD2-CG 4.08Å; F225-L350 HydrophobicContact CE2-CB 3.93Å; F225-L350 HydrophobicContact CE2-CD2 3.41Å; F225-L350 VanDerWaalsContact CE2-CD2 3.41Å; F225-L350 HydrophobicContact CE2-CG 3.45Å; F225-L350 VanDerWaalsContact CE2-CG 3.45Å; F225-L350 HydrophobicContact CZ-CD2 3.78Å; F225-L350 HydrophobicContact CZ-CG 4.25Å; V269-L350 HydrophobicContact CG1-CD2 3.38Å; T348-L350 WeakPolarHBondContact O-CD1 3Å; T348-L350 PolarHBondContact O-N 2.81Å; L350-F353 HydrophobicContact CB-CD2 4.49Å; L350-F353 CarbonylContact O-C 3.36Å; L350-F353 WeakPolarHBondContact O-CA 3.15Å; L350-F353 WeakPolarHBondContact O-CB 3.48Å; L350-F353 PolarHBondContact O-N 3.03Å; L350-V360 HydrophobicContact CB-CB 4.4Å; L350-V360 HydrophobicContact CB-CG1 4.23Å; L350-V360 HydrophobicContact CD2-CG1 3.95Å; L350-V360 PolarHBondContact N-O 2.8Å; L350-T362 HydrophobicContact CD1-CG2 3.88Å
351	R	82.6	Confident	91.8	Very high	74 Å²	74	36.2 Å²	36.2	28%	0.279	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.9	165.8	-58	-63.1	-177.8	166	0	108.5	E332 P349	E332-R351 VanDerWaalsContact CD-NH2 3.31Å; E332-R351 IonicContact OE1-CZ 2.99Å; E332-R351 VanDerWaalsContact OE1-CZ 3.24Å; E332-R351 IonicContact OE1-NE 3.75Å; E332-R351 PolarHBondContact OE1-NE 2.89Å; E332-R351 IonicContact OE1-NH2 3.86Å; E332-R351 PolarHBondContact OE1-NH2 3.3Å; E332-R351 IonicContact OE2-NH2 2.73Å; E332-R351 PolarHBondContact OE2-NH2 2.97Å; P349-R351 PolarHBondContact O-N 2.86Å
352	P	84.3	Confident	92	Very high	78 Å²	78	34.7 Å²	34.7	51%	0.506	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-88	10.4	6.1	36.4	-37.8	0	0	0	115.6	V354	P352-V354 PolarHBondContact O-N 2.67Å
353	F	89.7	Confident	92.3	Very high	15 Å²	15	29.7 Å²	29.7	7%	0.066	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	30.4	-172.5	-58	-73.4	0	0	0	115	F186 V193 L194 V220 L350 V360	F186-F353 HydrophobicContact CD1-CD1 4.22Å; F186-F353 HydrophobicContact CD2-CD1 4.28Å; F186-F353 HydrophobicContact CE1-CB 4.45Å; F186-F353 HydrophobicContact CE1-CD1 4.09Å; F186-F353 HydrophobicContact CE2-CD1 4.13Å; F186-F353 HydrophobicContact CG-CD1 4.33Å; F186-F353 HydrophobicContact CZ-CB 4.04Å; F186-F353 HydrophobicContact CZ-CD1 4.05Å; V193-F353 HydrophobicContact CB-CE1 4.4Å; V193-F353 HydrophobicContact CB-CZ 3.99Å; V193-F353 HydrophobicContact CG1-CE1 4.25Å; V193-F353 HydrophobicContact CG1-CE2 3.85Å; V193-F353 HydrophobicContact CG1-CZ 3.47Å; V193-F353 VanDerWaalsContact CG1-CZ 3.47Å; V193-F353 HydrophobicContact CG2-CZ 4.2Å; L194-F353 HydrophobicContact CD1-CD1 4.32Å; V220-F353 HydrophobicContact CG1-CE2 4.31Å; V220-F353 HydrophobicContact CG2-CE2 3.76Å; V220-F353 HydrophobicContact CG2-CZ 4.16Å; L350-F353 HydrophobicContact CB-CD2 4.49Å; L350-F353 CarbonylContact O-C 3.36Å; L350-F353 WeakPolarHBondContact O-CA 3.15Å; L350-F353 WeakPolarHBondContact O-CB 3.48Å; L350-F353 PolarHBondContact O-N 3.03Å; F353-V360 HydrophobicContact CB-CB 3.69Å; F353-V360 HydrophobicContact CB-CG1 4.49Å; F353-V360 HydrophobicContact CB-CG2 3.6Å; F353-V360 HydrophobicContact CG-CG2 4.5Å; F353-V360 PolarHBondContact O-N 2.66Å
354	V	92	Very high	92.2	Very high	13 Å²	13	28.7 Å²	28.7	8%	0.079	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.4	179.1	-179.1	0	0	0	0	109.9	R325 A328 P349 P352 L359	R325-V354 HydrophobicContact CG-CG1 4.24Å; A328-V354 HydrophobicContact CB-CG1 3.54Å; A328-V354 HydrophobicContact CB-CG2 4.36Å; P349-V354 HydrophobicContact CB-CG2 4.24Å; P352-V354 PolarHBondContact O-N 2.67Å; V354-L359 HydrophobicContact CG1-CD1 4.28Å; V354-L359 HydrophobicContact CG2-CD1 3.78Å
355	T	93.8	Very high	91.8	Very high	31 Å²	31	33.2 Å²	33.2	19%	0.19	16%	0.162	C	C	.	.			trans	-132.1	179.2	177.4	72.6	0	0	0	0	110.6	A185 F186 R325 N357 I358	A185-T355 HydrophobicContact CB-CG2 3.92Å; F186-T355 HydrophobicContact CE1-CG2 3.64Å; F186-T355 HydrophobicContact CZ-CG2 3.95Å; R325-T355 WeakPolarHBondContact CG-O 3.41Å; T355-N357 PolarHBondContact O-N 2.77Å; T355-N357 PolarHBondContact OG1-N 3.45Å; T355-I358 PolarHBondContact N-O 3.47Å; T355-I358 VanDerWaalsContact O-O 3.04Å; T355-I358 PolarHBondContact OG1-N 3.48Å; T355-I358 VanDerWaalsContact OG1-N 3.12Å; T355-I358 PolarHBondContact OG1-O 2.82Å
356	R	92.6	Very high	91.6	Very high	117 Å²	117	32.1 Å²	32.1	44%	0.442	16%	0.16	S	C	.	.	S	Bend	trans	-58.5	-32.2	175.7	-66.5	-173.2	172	162.8	0.7	113.4	D323 L324 R325	D323-R356 WeakPolarHBondContact OD1-CA 3.46Å; D323-R356 IonicContact OD2-NE 3.97Å; L324-R356 PolarHBondContact N-O 2.96Å; L324-R356 VanDerWaalsContact N-O 3.13Å; R325-R356 VanDerWaalsContact NE-CG 3.26Å
357	N	94.6	Very high	91.4	Very high	71 Å²	71	35.6 Å²	35.6	38%	0.38	18%	0.177	S	C	.	.	S	Bend	trans	-111.3	-10.7	-170.5	-60.5	-36	0	0	0	113.5	V273 V274 T355	V273-N357 WeakPolarHBondContact CA-O 3.17Å; V274-N357 HydrophobicContact CB-CB 4.38Å; V274-N357 PolarHBondContact N-O 2.94Å; T355-N357 PolarHBondContact O-N 2.77Å; T355-N357 PolarHBondContact OG1-N 3.45Å
358	I	95.6	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	131.9	-177.6	-63.8	160.4	0	0	0	109	C181 L182 A185 F186 I271 K272 V273 T355 V360	C181-I358 VanDerWaalsContact C-CD1 3.48Å; C181-I358 HydrophobicContact CB-CD1 4.01Å; C181-I358 HydrophobicContact CB-CG1 4.35Å; L182-I358 HydrophobicContact CB-CD1 4.41Å; L182-I358 HydrophobicContact CD2-CD1 3.76Å; L182-I358 HydrophobicContact CD2-CG2 4.38Å; L182-I358 HydrophobicContact CG-CD1 4.09Å; A185-I358 HydrophobicContact CB-CD1 3.66Å; F186-I358 HydrophobicContact CD2-CD1 4.45Å; F186-I358 HydrophobicContact CE2-CB 4.29Å; F186-I358 HydrophobicContact CE2-CD1 3.9Å; F186-I358 HydrophobicContact CE2-CG2 3.85Å; F186-I358 HydrophobicContact CZ-CB 4.32Å; F186-I358 HydrophobicContact CZ-CG2 4.07Å; I271-I358 HydrophobicContact CG2-CG2 4.36Å; K272-I358 VanDerWaalsContact O-CA 3.26Å; K272-I358 WeakPolarHBondContact O-CA 3.34Å; V273-I358 HydrophobicContact CG1-CG1 4.35Å; V273-I358 HydrophobicContact CG2-CG1 4.32Å; T355-I358 PolarHBondContact N-O 3.47Å; T355-I358 VanDerWaalsContact O-O 3.04Å; T355-I358 PolarHBondContact OG1-N 3.48Å; T355-I358 VanDerWaalsContact OG1-N 3.12Å; T355-I358 PolarHBondContact OG1-O 2.82Å; I358-V360 HydrophobicContact CG2-CG2 4.1Å
359	L	96.1	Very high	91	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121	169.2	163.4	57.7	0	0	0	107.5	K272 L324 E327 A328 P349 V354	K272-L359 HydrophobicContact CB-CB 4.21Å; K272-L359 HydrophobicContact CD-CD2 4.07Å; K272-L359 HydrophobicContact CD-CG 4.38Å; K272-L359 PolarHBondContact N-O 2.67Å; K272-L359 PolarHBondContact O-N 3.42Å; L324-L359 HydrophobicContact CB-CB 3.82Å; L324-L359 HydrophobicContact CD1-CB 3.96Å; L324-L359 HydrophobicContact CG-CB 4.44Å; E327-L359 HydrophobicContact CB-CD2 4.12Å; E327-L359 HydrophobicContact CG-CD2 3.91Å; A328-L359 HydrophobicContact CB-CD1 3.81Å; P349-L359 HydrophobicContact CB-CD1 4.12Å; V354-L359 HydrophobicContact CG1-CD1 4.28Å; V354-L359 HydrophobicContact CG2-CD1 3.78Å
360	V	95.4	Very high	90.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.7	169.2	-174.9	0	0	0	0	107.6	L194 V269 A270 I271 L350 F353 I358	L194-V360 HydrophobicContact CD1-CG2 4.07Å; L194-V360 HydrophobicContact CD2-CG1 4.17Å; V269-V360 HydrophobicContact CB-CG1 3.87Å; V269-V360 HydrophobicContact CG1-CG1 4.11Å; V269-V360 HydrophobicContact CG2-CG1 4.17Å; A270-V360 WeakPolarHBondContact O-CA 3.49Å; I271-V360 HydrophobicContact CG1-CG1 4.2Å; I271-V360 HydrophobicContact CG1-CG2 4.16Å; I271-V360 HydrophobicContact CG2-CG2 4.13Å; L350-V360 HydrophobicContact CB-CB 4.4Å; L350-V360 HydrophobicContact CB-CG1 4.23Å; L350-V360 HydrophobicContact CD2-CG1 3.95Å; L350-V360 PolarHBondContact N-O 2.8Å; F353-V360 HydrophobicContact CB-CB 3.69Å; F353-V360 HydrophobicContact CB-CG1 4.49Å; F353-V360 HydrophobicContact CB-CG2 3.6Å; F353-V360 HydrophobicContact CG-CG2 4.5Å; F353-V360 PolarHBondContact O-N 2.66Å; I358-V360 HydrophobicContact CG2-CG2 4.1Å
361	E	94.6	Very high	90.6	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.019	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	164.7	178.5	63.1	-166.4	-170.4	0	0	109.7	V269 A270 K272 I331 P347 T348	V269-E361 CarbonylContact C-O 3.59Å; V269-E361 VanDerWaalsContact CA-O 3.24Å; V269-E361 WeakPolarHBondContact CA-O 3.23Å; V269-E361 WeakPolarHBondContact CB-O 3.43Å; A270-E361 HydrophobicContact CB-CG 3.96Å; A270-E361 PolarHBondContact N-O 3.15Å; A270-E361 PolarHBondContact O-N 3.41Å; K272-E361 WeakPolarHBondContact CE-OE1 3.5Å; K272-E361 IonicContact NZ-OE1 3.75Å; K272-E361 PolarHBondContact NZ-OE1 3.07Å; K272-E361 IonicContact NZ-OE2 3.43Å; I331-E361 WeakPolarHBondContact CD1-OE2 3.39Å; P347-E361 HydrophobicContact CB-CB 4.06Å; P347-E361 HydrophobicContact CB-CG 3.99Å; T348-E361 CarbonylContact O-C 3.6Å; T348-E361 WeakPolarHBondContact O-CA 3.43Å; T348-E361 WeakPolarHBondContact O-CB 3.31Å
362	T	92.6	Very high	90.9	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	143	174.9	53.4	0	0	0	0	110.7	I228 I267 P347 T348 L350 E364	I228-T362 HydrophobicContact CG2-CG2 4.48Å; I267-T362 HydrophobicContact CG2-CG2 4.24Å; P347-T362 WeakPolarHBondContact CA-OG1 3.4Å; T348-T362 PolarHBondContact N-OG1 3.27Å; T348-T362 PolarHBondContact O-N 2.93Å; L350-T362 HydrophobicContact CD1-CG2 3.88Å; T362-E364 WeakPolarHBondContact CB-OE1 3.21Å; T362-E364 PolarHBondContact OG1-OE1 3.36Å
363	F	91.8	Very high	90.9	Very high	50 Å²	50	39 Å²	39	22%	0.219	20%	0.201	C	C	.	.			trans	-91.6	115.9	172.3	-174.3	-91.5	0	0	0	109.1	R212 P268 A270 E365	R212-F363 HydrophobicContact CB-CD2 4.49Å; R212-F363 HydrophobicContact CB-CE2 4.37Å; R212-F363 HydrophobicContact CG-CD1 4.39Å; R212-F363 HydrophobicContact CG-CD2 3.92Å; R212-F363 HydrophobicContact CG-CE1 4.43Å; R212-F363 HydrophobicContact CG-CE2 3.98Å; R212-F363 HydrophobicContact CG-CG 4.14Å; R212-F363 HydrophobicContact CG-CZ 4.24Å; P268-F363 HydrophobicContact CB-CB 4.15Å; P268-F363 PolarHBondContact O-N 2.79Å; A270-F363 HydrophobicContact CB-CD2 4.17Å; F363-E365 HydrophobicContact CD1-CG 4.28Å; F363-E365 WeakPolarHBondContact CD1-OE1 3.38Å; F363-E365 VanDerWaalsContact CE1-CD 3.5Å; F363-E365 HydrophobicContact CE1-CG 4.35Å; F363-E365 WeakPolarHBondContact CE1-OE1 3.32Å
364	E	89	Confident	90.6	Very high	21 Å²	21	40.5 Å²	40.5	10%	0.098	21%	0.213	C	C	.	.			trans	-88.7	112.1	179.3	-55.5	-56.8	145.4	0	0	110	K345 P347 T362 S366 V449	K345-E364 WeakPolarHBondContact CD-OE2 3.24Å; K345-E364 WeakPolarHBondContact CE-OE2 3.09Å; K345-E364 IonicContact NZ-OE2 2.67Å; K345-E364 PolarHBondContact NZ-OE2 2.97Å; P347-E364 HydrophobicContact CB-CG 4.49Å; P347-E364 HydrophobicContact CG-CG 4.18Å; T362-E364 WeakPolarHBondContact CB-OE1 3.21Å; T362-E364 PolarHBondContact OG1-OE1 3.36Å; E364-S366 PolarHBondContact O-N 3.5Å; E364-V449 HydrophobicContact CB-CG1 3.71Å; E364-V449 HydrophobicContact CB-CG2 4.32Å; E364-V449 HydrophobicContact CG-CG1 3.65Å
365	E	85.9	Confident	89.9	Confident	107 Å²	107	45.4 Å²	45.4	50%	0.5	25%	0.248	S	C	.	.			trans	-70.7	95.8	177.2	-70	-66.1	162.6	0	0	109.7	R212 F363	R212-E365 IonicContact CZ-OE1 3.65Å; R212-E365 IonicContact NE-OE1 2.98Å; R212-E365 PolarHBondContact NE-OE1 2.88Å; R212-E365 IonicContact NH2-OE1 2.63Å; R212-E365 PolarHBondContact NH2-OE1 2.67Å; F363-E365 HydrophobicContact CD1-CG 4.28Å; F363-E365 WeakPolarHBondContact CD1-OE1 3.38Å; F363-E365 VanDerWaalsContact CE1-CD 3.5Å; F363-E365 HydrophobicContact CE1-CG 4.35Å; F363-E365 WeakPolarHBondContact CE1-OE1 3.32Å
366	S	88.3	Confident	89.5	Confident	29 Å²	29	52.2 Å²	52.2	20%	0.203	28%	0.277	C	S	.	.			trans	-151.1	163	-171	-63.2	0	0	0	0	112.3	E364 Q415 V449	E364-S366 PolarHBondContact O-N 3.5Å; S366-Q415 WeakPolarHBondContact OG-CB 3.37Å; S366-V449 WeakPolarHBondContact OG-CG2 3.5Å
367	E	89.4	Confident	89.2	Confident	79 Å²	79	48.9 Å²	48.9	37%	0.369	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.8	178.3	-67.8	-167.4	171.5	0	0	111.7	I369 Y372 L413 V414	E367-I369 PolarHBondContact O-N 3.24Å; E367-Y372 HydrophobicContact CB-CE2 4.03Å; E367-L413 CarbonylContact O-C 3.58Å; E367-L413 VanDerWaalsContact O-CA 3.28Å; E367-L413 WeakPolarHBondContact O-CA 3.45Å; E367-L413 WeakPolarHBondContact O-CB 3.41Å; E367-V414 PolarHBondContact N-O 3.36Å; E367-V414 PolarHBondContact O-N 3.07Å
368	P	89.9	Confident	88.9	Confident	51 Å²	51	49.3 Å²	49.3	33%	0.331	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	139.8	175.6	-23.9	34	0	0	0	112.3	S370 N371 L413	P368-S370 PolarHBondContact O-N 3.21Å; P368-N371 WeakPolarHBondContact O-CB 3.44Å; P368-N371 PolarHBondContact O-N 3.38Å; P368-L413 HydrophobicContact CB-CD2 4.35Å; P368-L413 HydrophobicContact CG-CD2 4.32Å
369	I	89.8	Confident	88.5	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-57.6	-24.2	178.5	-166.4	157.7	0	0	0	113	E367 N371 Y372 I385 P409 I412 V414 L559 L563	E367-I369 PolarHBondContact O-N 3.24Å; I369-N371 PolarHBondContact O-N 3.25Å; I369-Y372 WeakPolarHBondContact O-CB 3.31Å; I369-Y372 PolarHBondContact O-N 2.85Å; I369-I385 HydrophobicContact CD1-CG2 3.53Å; I369-I385 HydrophobicContact CG1-CG2 4.05Å; I369-P409 HydrophobicContact CG2-CB 3.82Å; I369-P409 WeakPolarHBondContact CG2-O 3.41Å; I369-I412 HydrophobicContact CB-CB 4.27Å; I369-I412 HydrophobicContact CB-CG2 4.09Å; I369-I412 WeakPolarHBondContact CB-O 3.41Å; I369-I412 HydrophobicContact CD1-CB 4.42Å; I369-I412 HydrophobicContact CD1-CG2 3.62Å; I369-I412 HydrophobicContact CG1-CG2 4.47Å; I369-I412 HydrophobicContact CG2-CB 3.93Å; I369-I412 HydrophobicContact CG2-CG2 4.25Å; I369-I412 WeakPolarHBondContact CG2-O 3.28Å; I369-I412 PolarHBondContact N-O 2.98Å; I369-V414 HydrophobicContact CB-CG2 4.01Å; I369-V414 HydrophobicContact CD1-CG2 4.28Å; I369-V414 HydrophobicContact CG1-CG2 3.93Å; I369-L559 HydrophobicContact CD1-CD2 3.94Å; I369-L559 HydrophobicContact CD1-CG 4.41Å; I369-L559 HydrophobicContact CG2-CD1 4.33Å; I369-L559 HydrophobicContact CG2-CD2 4.1Å; I369-L563 HydrophobicContact CD1-CD1 4.13Å; I369-L563 HydrophobicContact CG1-CD1 4.36Å
370	S	87.3	Confident	88.1	Confident	60 Å²	60	59.5 Å²	59.5	42%	0.42	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-58.9	-29.4	174.8	54.1	0	0	0	0	113.4	P368 Y372 L373	P368-S370 PolarHBondContact O-N 3.21Å; S370-Y372 PolarHBondContact O-N 3.04Å; S370-L373 WeakPolarHBondContact O-CB 3.2Å; S370-L373 PolarHBondContact O-N 3.3Å
371	N	88	Confident	87.8	Confident	76 Å²	76	60.3 Å²	60.3	41%	0.406	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-66.2	-25.6	176.3	-67.6	3.7	0	0	0	111.7	P368 I369 L373 S374	P368-N371 WeakPolarHBondContact O-CB 3.44Å; P368-N371 PolarHBondContact O-N 3.38Å; I369-N371 PolarHBondContact O-N 3.25Å; N371-L373 VanDerWaalsContact C-N 3.28Å; N371-L373 PolarHBondContact O-N 2.67Å; N371-S374 PolarHBondContact O-OG 3Å
372	Y	88.6	Confident	87.5	Confident	15 Å²	15	60.9 Å²	60.9	6%	0.059	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-85.2	-0.9	-178.4	-65.5	-100.3	0	0	0	113.6	E367 I369 S370 I377 V381 K382 I385 V414 Y416 L563	E367-Y372 HydrophobicContact CB-CE2 4.03Å; I369-Y372 WeakPolarHBondContact O-CB 3.31Å; I369-Y372 PolarHBondContact O-N 2.85Å; S370-Y372 PolarHBondContact O-N 3.04Å; Y372-I377 HydrophobicContact CD1-CG1 4.45Å; Y372-I377 HydrophobicContact CD1-CG2 4.13Å; Y372-V381 HydrophobicContact CD1-CG1 4.47Å; Y372-K382 VanDerWaalsContact O-CE 3.27Å; Y372-K382 WeakPolarHBondContact O-CE 3.14Å; Y372-I385 HydrophobicContact CD1-CD1 3.39Å; Y372-I385 HydrophobicContact CE1-CD1 4.1Å; Y372-I385 HydrophobicContact CG-CD1 3.68Å; Y372-V414 HydrophobicContact CD1-CG1 4.3Å; Y372-V414 HydrophobicContact CD2-CB 3.86Å; Y372-V414 HydrophobicContact CD2-CG1 4.28Å; Y372-V414 HydrophobicContact CD2-CG2 3.82Å; Y372-V414 HydrophobicContact CE1-CB 4.35Å; Y372-V414 HydrophobicContact CE1-CG1 3.77Å; Y372-V414 HydrophobicContact CE2-CB 3.43Å; Y372-V414 VanDerWaalsContact CE2-CB 3.43Å; Y372-V414 HydrophobicContact CE2-CG1 3.78Å; Y372-V414 HydrophobicContact CE2-CG2 3.95Å; Y372-V414 HydrophobicContact CG-CG2 4.3Å; Y372-V414 VanDerWaalsContact CZ-CG1 3.48Å; Y372-Y416 WeakPolarHBondContact OH-CB 3.37Å; Y372-L563 WeakPolarHBondContact O-CD2 3.37Å
373	L	83.7	Confident	87.4	Confident	66 Å²	66	64.1 Å²	64.1	35%	0.346	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-80.5	-17.8	174	-59.8	177	0	0	0	112.5	S370 N371 L559 L563	S370-L373 WeakPolarHBondContact O-CB 3.2Å; S370-L373 PolarHBondContact O-N 3.3Å; N371-L373 VanDerWaalsContact C-N 3.28Å; N371-L373 PolarHBondContact O-N 2.67Å; L373-L559 HydrophobicContact CD2-CD1 4.19Å; L373-L563 HydrophobicContact CD2-CD2 3.73Å; L373-L563 HydrophobicContact CD2-CG 3.83Å
374	S	83.5	Confident	87.3	Confident	46 Å²	46	66.6 Å²	66.6	32%	0.322	35%	0.352	S	S	.	.	S	Bend	trans	-64	150.2	-176.7	77.3	0	0	0	0	112	N371 E376 I377 K382	N371-S374 PolarHBondContact O-OG 3Å; S374-E376 PolarHBondContact O-N 3.47Å; S374-E376 VanDerWaalsContact O-N 3.16Å; S374-I377 PolarHBondContact O-N 3.22Å; S374-K382 WeakPolarHBondContact O-CE 3.3Å; S374-K382 PolarHBondContact O-NZ 2.97Å
375	S	78.4	Confident	87.5	Confident	116 Å²	116	65.7 Å²	65.7	81%	0.811	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.8	178.1	50.3	0	0	0	0	114
376	E	85.3	Confident	87.7	Confident	173 Å²	173	60.7 Å²	60.7	81%	0.808	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-24.6	-177.7	-62.7	174.8	-177.4	0	0	112.5	S374	S374-E376 PolarHBondContact O-N 3.47Å; S374-E376 VanDerWaalsContact O-N 3.16Å
377	I	86.4	Confident	87.8	Confident	47 Å²	47	66.1 Å²	66.1	24%	0.241	34%	0.34	C	S	.	.	S	Bend	trans	-77.6	131.7	179.4	-59.6	-57.6	0	0	0	110.4	Y372 S374 Q379 V381 K382	Y372-I377 HydrophobicContact CD1-CG1 4.45Å; Y372-I377 HydrophobicContact CD1-CG2 4.13Å; S374-I377 PolarHBondContact O-N 3.22Å; I377-Q379 PolarHBondContact O-N 3.04Å; I377-V381 HydrophobicContact CG2-CB 4.1Å; I377-V381 HydrophobicContact CG2-CG1 4.18Å; I377-K382 HydrophobicContact CB-CG 4.43Å; I377-K382 HydrophobicContact CG2-CG 3.95Å; I377-K382 WeakPolarHBondContact O-CE 3.44Å
378	P	87.9	Confident	87.9	Confident	81 Å²	81	63 Å²	63	53%	0.526	33%	0.326	S	S	.	.			trans	-55.5	137.4	177.9	-25.4	33.9	0	0	0	112.6	E380 V381 K382	P378-E380 PolarHBondContact O-N 2.92Å; P378-V381 HydrophobicContact CB-CG2 4.25Å; P378-V381 HydrophobicContact CG-CG2 4.49Å; P378-V381 PolarHBondContact O-N 3.19Å; P378-K382 PolarHBondContact O-N 2.99Å
379	Q	87.1	Confident	88	Confident	84 Å²	84	61.5 Å²	61.5	39%	0.393	32%	0.32	S	S	.	.	H	α-helix	trans	-59.4	-34.8	-176.2	-170.9	59	27.3	0	0	112.8	I377 V381 K382 Q383 L563	I377-Q379 PolarHBondContact O-N 3.04Å; Q379-V381 VanDerWaalsContact C-N 3.32Å; Q379-V381 PolarHBondContact O-N 3.37Å; Q379-K382 WeakPolarHBondContact O-CB 3.22Å; Q379-K382 PolarHBondContact O-N 3.45Å; Q379-Q383 HydrophobicContact CG-CG 4.41Å; Q379-Q383 WeakPolarHBondContact O-CB 3.29Å; Q379-Q383 VanDerWaalsContact O-CG 3.32Å; Q379-Q383 WeakPolarHBondContact O-CG 3.49Å; Q379-Q383 PolarHBondContact O-N 2.83Å; Q379-L563 PolarHBondContact NE2-O 3.05Å
380	E	87.3	Confident	87.9	Confident	130 Å²	130	61.4 Å²	61.4	61%	0.607	32%	0.319	S	S	*	.	H	α-helix	trans	-59.6	-41.2	176.3	-175	178.3	-175	0	0	112.3	P378 Q383 R384	P378-E380 PolarHBondContact O-N 2.92Å; E380-Q383 PolarHBondContact O-N 3.28Å; E380-R384 WeakPolarHBondContact O-CG 3.39Å; E380-R384 PolarHBondContact O-N 3.43Å
381	V	88.4	Confident	88.1	Confident	16 Å²	16	61.4 Å²	61.4	10%	0.097	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-44.8	177.1	178.9	0	0	0	0	109.8	Y372 I377 P378 Q379 Q383 R384 I385 L446	Y372-V381 HydrophobicContact CD1-CG1 4.47Å; I377-V381 HydrophobicContact CG2-CB 4.1Å; I377-V381 HydrophobicContact CG2-CG1 4.18Å; P378-V381 HydrophobicContact CB-CG2 4.25Å; P378-V381 HydrophobicContact CG-CG2 4.49Å; P378-V381 PolarHBondContact O-N 3.19Å; Q379-V381 VanDerWaalsContact C-N 3.32Å; Q379-V381 PolarHBondContact O-N 3.37Å; V381-Q383 VanDerWaalsContact C-N 3.32Å; V381-Q383 PolarHBondContact O-N 3.08Å; V381-R384 PolarHBondContact O-N 2.96Å; V381-I385 HydrophobicContact CG1-CD1 3.98Å; V381-I385 HydrophobicContact CG1-CG1 4.42Å; V381-I385 VanDerWaalsContact O-CG1 3.31Å; V381-I385 WeakPolarHBondContact O-CG1 3.38Å; V381-I385 PolarHBondContact O-N 3.39Å; V381-L446 HydrophobicContact CG1-CD1 4.42Å; V381-L446 HydrophobicContact CG1-CD2 4.5Å
382	K	89.6	Confident	88.3	Confident	17 Å²	17	58 Å²	58	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-43.6	176.7	-62	-174.7	-178	-179.8	0	112.1	Y372 S374 I377 P378 Q379 I385 A386 L563	Y372-K382 VanDerWaalsContact O-CE 3.27Å; Y372-K382 WeakPolarHBondContact O-CE 3.14Å; S374-K382 WeakPolarHBondContact O-CE 3.3Å; S374-K382 PolarHBondContact O-NZ 2.97Å; I377-K382 HydrophobicContact CB-CG 4.43Å; I377-K382 HydrophobicContact CG2-CG 3.95Å; I377-K382 WeakPolarHBondContact O-CE 3.44Å; P378-K382 PolarHBondContact O-N 2.99Å; Q379-K382 WeakPolarHBondContact O-CB 3.22Å; Q379-K382 PolarHBondContact O-N 3.45Å; K382-I385 PolarHBondContact O-N 2.92Å; K382-A386 WeakPolarHBondContact O-CB 3.33Å; K382-A386 PolarHBondContact O-N 3.39Å; K382-L563 HydrophobicContact CB-CB 4.19Å; K382-L563 HydrophobicContact CB-CD2 4.12Å; K382-L563 WeakPolarHBondContact CB-O 3.48Å; K382-L563 HydrophobicContact CG-CD2 4.16Å
383	Q	90.4	Very high	88.4	Confident	78 Å²	78	57.3 Å²	57.3	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-41.1	176.9	-74.1	177.1	-24.1	0	0	112	Q379 E380 V381 A386 R387 D564	Q379-Q383 HydrophobicContact CG-CG 4.41Å; Q379-Q383 WeakPolarHBondContact O-CB 3.29Å; Q379-Q383 VanDerWaalsContact O-CG 3.32Å; Q379-Q383 WeakPolarHBondContact O-CG 3.49Å; Q379-Q383 PolarHBondContact O-N 2.83Å; E380-Q383 PolarHBondContact O-N 3.28Å; V381-Q383 VanDerWaalsContact C-N 3.32Å; V381-Q383 PolarHBondContact O-N 3.08Å; Q383-A386 PolarHBondContact O-N 3.14Å; Q383-R387 WeakPolarHBondContact O-CB 3.34Å; Q383-R387 PolarHBondContact O-N 3.37Å; Q383-D564 HydrophobicContact CG-CB 3.97Å
384	R	90.1	Very high	88.7	Confident	102 Å²	102	54.5 Å²	54.5	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-61.1	-49.2	173.2	-71.8	175.3	69.4	-179.2	2.2	111.2	E380 V381 A386 R387 M388 D442 L446	E380-R384 WeakPolarHBondContact O-CG 3.39Å; E380-R384 PolarHBondContact O-N 3.43Å; V381-R384 PolarHBondContact O-N 2.96Å; R384-A386 VanDerWaalsContact C-N 3.34Å; R384-A386 PolarHBondContact O-N 2.7Å; R384-R387 PolarHBondContact O-N 2.84Å; R384-M388 VanDerWaalsContact O-CG 3.26Å; R384-M388 WeakPolarHBondContact O-CG 3.46Å; R384-M388 PolarHBondContact O-N 3.26Å; R384-D442 IonicContact NH1-OD2 3.24Å; R384-L446 HydrophobicContact CB-CD2 3.75Å
385	I	92.3	Very high	89.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-56.9	-47.4	176.2	-64.3	172.2	0	0	0	110.9	I369 Y372 V381 K382 R387 M388 G389 V414 L446 L448 L563	I369-I385 HydrophobicContact CD1-CG2 3.53Å; I369-I385 HydrophobicContact CG1-CG2 4.05Å; Y372-I385 HydrophobicContact CD1-CD1 3.39Å; Y372-I385 HydrophobicContact CE1-CD1 4.1Å; Y372-I385 HydrophobicContact CG-CD1 3.68Å; V381-I385 HydrophobicContact CG1-CD1 3.98Å; V381-I385 HydrophobicContact CG1-CG1 4.42Å; V381-I385 VanDerWaalsContact O-CG1 3.31Å; V381-I385 WeakPolarHBondContact O-CG1 3.38Å; V381-I385 PolarHBondContact O-N 3.39Å; K382-I385 PolarHBondContact O-N 2.92Å; I385-R387 PolarHBondContact O-N 3.46Å; I385-M388 HydrophobicContact CB-CE 4.48Å; I385-M388 HydrophobicContact CG1-CE 4.25Å; I385-M388 PolarHBondContact O-N 3.27Å; I385-G389 PolarHBondContact O-N 3.36Å; I385-V414 HydrophobicContact CD1-CG1 3.99Å; I385-V414 HydrophobicContact CD1-CG2 4.13Å; I385-V414 HydrophobicContact CG1-CG1 4.43Å; I385-V414 HydrophobicContact CG2-CG2 4.35Å; I385-L446 HydrophobicContact CD1-CD1 4.39Å; I385-L446 HydrophobicContact CG1-CD1 4.14Å; I385-L446 HydrophobicContact CG1-CD2 3.79Å; I385-L446 HydrophobicContact CG1-CG 4.41Å; I385-L448 HydrophobicContact CG2-CD2 3.98Å; I385-L563 HydrophobicContact CB-CD1 4.18Å; I385-L563 HydrophobicContact CG2-CD1 3.51Å
386	A	90.8	Very high	89.9	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.017	23%	0.233	C	C	.	.	H	α-helix	trans	-59.3	-47.1	179.1	0	0	0	0	0	111.7	K382 Q383 R384 G389 V390 G560 L563 D564 L567	K382-A386 WeakPolarHBondContact O-CB 3.33Å; K382-A386 PolarHBondContact O-N 3.39Å; Q383-A386 PolarHBondContact O-N 3.14Å; R384-A386 VanDerWaalsContact C-N 3.34Å; R384-A386 PolarHBondContact O-N 2.7Å; A386-G389 PolarHBondContact O-N 3.27Å; A386-V390 PolarHBondContact O-N 3.24Å; A386-V390 VanDerWaalsContact O-N 3.08Å; A386-G560 WeakPolarHBondContact CB-O 3.43Å; A386-L563 HydrophobicContact CB-CB 3.9Å; A386-L563 HydrophobicContact CB-CD1 4.47Å; A386-D564 HydrophobicContact CB-CB 3.84Å; A386-L567 HydrophobicContact CB-CD2 4.44Å
387	R	89.9	Confident	90.1	Very high	144 Å²	144	40.5 Å²	40.5	54%	0.543	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-46.2	178.6	177.6	159.8	-98.3	-180	-6.8	112	Q383 R384 I385 G389 V390 D391	Q383-R387 WeakPolarHBondContact O-CB 3.34Å; Q383-R387 PolarHBondContact O-N 3.37Å; R384-R387 PolarHBondContact O-N 2.84Å; I385-R387 PolarHBondContact O-N 3.46Å; R387-G389 VanDerWaalsContact C-N 3.3Å; R387-G389 PolarHBondContact O-N 3.2Å; R387-V390 PolarHBondContact O-N 3.4Å; R387-D391 VanDerWaalsContact O-CG 3.31Å; R387-D391 PolarHBondContact O-N 3.5Å
388	M	91.5	Very high	90.3	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.069	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-42.2	175.6	-66	-172.5	-58.2	0	0	112.2	N343 I344 R384 I385 V390 D391 T392 L446 L448	N343-M388 HydrophobicContact CB-SD 3.77Å; N343-M388 WeakPolarHBondContact ND2-CG 3.41Å; I344-M388 HydrophobicContact CD1-CB 4.47Å; R384-M388 VanDerWaalsContact O-CG 3.26Å; R384-M388 WeakPolarHBondContact O-CG 3.46Å; R384-M388 PolarHBondContact O-N 3.26Å; I385-M388 HydrophobicContact CB-CE 4.48Å; I385-M388 HydrophobicContact CG1-CE 4.25Å; I385-M388 PolarHBondContact O-N 3.27Å; M388-V390 PolarHBondContact O-N 3.29Å; M388-D391 PolarHBondContact O-N 2.92Å; M388-T392 VanDerWaalsContact O-CB 3.29Å; M388-T392 WeakPolarHBondContact O-CB 3.29Å; M388-T392 PolarHBondContact O-N 3.37Å; M388-T392 PolarHBondContact O-OG1 3.14Å; M388-L446 HydrophobicContact CE-CD2 3.41Å; M388-L446 VanDerWaalsContact CE-CD2 3.41Å; M388-L446 HydrophobicContact CE-CG 3.6Å; M388-L446 HydrophobicContact SD-CD2 4.38Å; M388-L448 HydrophobicContact CB-CD1 3.62Å; M388-L448 HydrophobicContact CB-CG 4.08Å; M388-L448 HydrophobicContact CE-CD1 4.38Å; M388-L448 HydrophobicContact CE-CD2 3.84Å; M388-L448 HydrophobicContact CE-CG 3.74Å; M388-L448 HydrophobicContact SD-CG 4.5Å
389	G	91.4	Very high	90.4	Very high	19 Å²	19	39 Å²	39	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-42	177.7	0	0	0	0	0	112.7	I385 A386 R387 L393	I385-G389 PolarHBondContact O-N 3.36Å; A386-G389 PolarHBondContact O-N 3.27Å; R387-G389 VanDerWaalsContact C-N 3.3Å; R387-G389 PolarHBondContact O-N 3.2Å; G389-L393 WeakPolarHBondContact O-CB 3.49Å; G389-L393 PolarHBondContact O-N 3.42Å
390	V	88.8	Confident	90.7	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-69.9	-44.5	176.8	176	0	0	0	0	112	A386 R387 M388 T392 L393 L394 L567 I569 L572	A386-V390 PolarHBondContact O-N 3.24Å; A386-V390 VanDerWaalsContact O-N 3.08Å; R387-V390 PolarHBondContact O-N 3.4Å; M388-V390 PolarHBondContact O-N 3.29Å; V390-T392 PolarHBondContact O-N 3.49Å; V390-L393 WeakPolarHBondContact O-CB 3.28Å; V390-L393 PolarHBondContact O-N 3.43Å; V390-L394 HydrophobicContact CG1-CD1 3.72Å; V390-L394 HydrophobicContact CG1-CG 3.98Å; V390-L394 WeakPolarHBondContact O-CB 3.38Å; V390-L394 VanDerWaalsContact O-CG 3.3Å; V390-L394 WeakPolarHBondContact O-CG 3.34Å; V390-L394 PolarHBondContact O-N 2.98Å; V390-L567 HydrophobicContact CG2-CD1 3.94Å; V390-L567 HydrophobicContact CG2-CD2 3.44Å; V390-L567 VanDerWaalsContact CG2-CD2 3.44Å; V390-L567 HydrophobicContact CG2-CG 4.03Å; V390-I569 HydrophobicContact CG1-CB 4.48Å; V390-I569 HydrophobicContact CG1-CG1 4.03Å; V390-I569 HydrophobicContact CG1-CG2 4.27Å; V390-I569 HydrophobicContact CG2-CD1 4.13Å; V390-I569 HydrophobicContact CG2-CG1 3.93Å; V390-L572 HydrophobicContact CB-CD1 4.24Å; V390-L572 HydrophobicContact CG1-CB 4.31Å; V390-L572 HydrophobicContact CG1-CD1 3.67Å
391	D	90	Very high	91	Very high	61 Å²	61	30.9 Å²	30.9	33%	0.326	15%	0.149	S	C	.	.	H	α-helix	trans	-59.6	-41.5	178.6	-68.7	-22.2	0	0	0	110.6	R387 M388 L394 K395	R387-D391 VanDerWaalsContact O-CG 3.31Å; R387-D391 PolarHBondContact O-N 3.5Å; M388-D391 PolarHBondContact O-N 2.92Å; D391-L394 PolarHBondContact O-N 3.45Å; D391-K395 WeakPolarHBondContact O-CB 3.45Å; D391-K395 PolarHBondContact O-N 3.26Å
392	T	93	Very high	91.3	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.025	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-48.4	174.8	-57.2	0	0	0	0	111.8	F338 I344 M388 V390 K395 M396 L450	F338-T392 HydrophobicContact CE1-CG2 3.77Å; F338-T392 HydrophobicContact CZ-CG2 3.78Å; I344-T392 HydrophobicContact CD1-CG2 4.45Å; I344-T392 WeakPolarHBondContact CD1-OG1 3.42Å; I344-T392 WeakPolarHBondContact CG1-OG1 3.38Å; I344-T392 HydrophobicContact CG2-CG2 4.42Å; M388-T392 VanDerWaalsContact O-CB 3.29Å; M388-T392 WeakPolarHBondContact O-CB 3.29Å; M388-T392 PolarHBondContact O-N 3.37Å; M388-T392 PolarHBondContact O-OG1 3.14Å; V390-T392 PolarHBondContact O-N 3.49Å; T392-K395 PolarHBondContact O-N 2.61Å; T392-M396 HydrophobicContact CG2-CE 4.13Å; T392-M396 WeakPolarHBondContact O-CG 3.01Å; T392-M396 PolarHBondContact O-N 2.94Å; T392-L450 HydrophobicContact CG2-CD1 3.83Å
393	L	90.7	Very high	91.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-51	176	172.2	60.6	0	0	0	112	G389 V390 K395 M396 V397 I553 L556 I569	G389-L393 WeakPolarHBondContact O-CB 3.49Å; G389-L393 PolarHBondContact O-N 3.42Å; V390-L393 WeakPolarHBondContact O-CB 3.28Å; V390-L393 PolarHBondContact O-N 3.43Å; L393-K395 VanDerWaalsContact C-N 3.31Å; L393-K395 PolarHBondContact O-N 3.18Å; L393-M396 PolarHBondContact O-N 2.81Å; L393-V397 HydrophobicContact CD1-CG2 3.84Å; L393-V397 VanDerWaalsContact O-CG2 3.29Å; L393-V397 WeakPolarHBondContact O-CG2 3.41Å; L393-V397 PolarHBondContact O-N 2.95Å; L393-I553 HydrophobicContact CD1-CG1 3.88Å; L393-I553 HydrophobicContact CD2-CB 4.23Å; L393-I553 HydrophobicContact CD2-CG1 4.08Å; L393-I553 HydrophobicContact CD2-CG2 4.26Å; L393-I553 HydrophobicContact CG-CG1 4.27Å; L393-L556 HydrophobicContact CB-CD1 3.95Å; L393-L556 HydrophobicContact CD1-CD1 3.57Å; L393-L556 HydrophobicContact CD2-CB 3.92Å; L393-L556 HydrophobicContact CD2-CD1 4.14Å; L393-L556 HydrophobicContact CG-CD1 4.07Å; L393-I569 HydrophobicContact CD2-CD1 4.34Å
394	L	90.5	Very high	91.5	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-63.3	-39.7	-176.6	-70	178.2	0	0	0	111.4	V390 D391 V397 F398 I569 L572 A573 L576	V390-L394 HydrophobicContact CG1-CD1 3.72Å; V390-L394 HydrophobicContact CG1-CG 3.98Å; V390-L394 WeakPolarHBondContact O-CB 3.38Å; V390-L394 VanDerWaalsContact O-CG 3.3Å; V390-L394 WeakPolarHBondContact O-CG 3.34Å; V390-L394 PolarHBondContact O-N 2.98Å; D391-L394 PolarHBondContact O-N 3.45Å; L394-V397 PolarHBondContact O-N 3.06Å; L394-F398 HydrophobicContact CB-CD2 4.49Å; L394-F398 HydrophobicContact CD2-CD2 3.88Å; L394-F398 HydrophobicContact CD2-CE2 3.66Å; L394-F398 WeakPolarHBondContact O-CB 3.44Å; L394-F398 PolarHBondContact O-N 2.73Å; L394-I569 HydrophobicContact CD2-CG2 3.97Å; L394-L572 HydrophobicContact CD1-CB 3.85Å; L394-A573 HydrophobicContact CD1-CB 4.3Å; L394-A573 HydrophobicContact CD2-CB 3.71Å; L394-L576 HydrophobicContact CB-CD1 3.7Å; L394-L576 HydrophobicContact CD1-CD1 4.32Å
395	K	92.4	Very high	91.2	Very high	37 Å²	37	23 Å²	23	16%	0.161	12%	0.122	C	C	.	.	I	π-helix	trans	-62.8	-50.4	174.2	-172.3	-177.1	177.7	-55.8	0	111.6	N337 F338 M341 D391 T392 L393 V397 V399 D400	N337-K395 VanDerWaalsContact O-CE 3.27Å; N337-K395 WeakPolarHBondContact O-CE 2.93Å; N337-K395 PolarHBondContact O-NZ 2.93Å; F338-K395 HydrophobicContact CD1-CD 4.21Å; F338-K395 HydrophobicContact CE1-CD 3.74Å; F338-K395 HydrophobicContact CZ-CD 4.11Å; M341-K395 HydrophobicContact SD-CD 3.49Å; M341-K395 WeakPolarHBondContact SD-CD 3.13Å; D391-K395 WeakPolarHBondContact O-CB 3.45Å; D391-K395 PolarHBondContact O-N 3.26Å; T392-K395 PolarHBondContact O-N 2.61Å; L393-K395 VanDerWaalsContact C-N 3.31Å; L393-K395 PolarHBondContact O-N 3.18Å; K395-V397 VanDerWaalsContact C-N 3.26Å; K395-V397 PolarHBondContact O-N 2.63Å; K395-V399 HydrophobicContact CG-CB 4.01Å; K395-V399 HydrophobicContact CG-CG1 4.45Å; K395-V399 HydrophobicContact CG-CG2 4.3Å; K395-V399 WeakPolarHBondContact O-CA 3.48Å; K395-V399 VanDerWaalsContact O-CB 3.3Å; K395-V399 WeakPolarHBondContact O-CB 3.33Å; K395-V399 PolarHBondContact O-N 2.99Å; K395-D400 IonicContact NZ-OD1 2.67Å; K395-D400 PolarHBondContact NZ-OD1 2.81Å; K395-D400 IonicContact NZ-OD2 2.66Å; K395-D400 PolarHBondContact NZ-OD2 2.78Å; K395-D400 PolarHBondContact O-N 2.82Å
396	M	94.1	Very high	90.6	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.126	C	C	.	.	I	π-helix	trans	-54.9	-42.4	177.9	-76.4	-170.2	-65.9	0	0	112.4	F334 F338 T392 L393 N401 F402 V403 H404 L407	F334-M396 HydrophobicContact CE1-CG 4.22Å; F334-M396 HydrophobicContact CE1-SD 3.81Å; F334-M396 HydrophobicContact CZ-SD 4.39Å; F338-M396 HydrophobicContact CE2-CG 3.96Å; F338-M396 HydrophobicContact CZ-CG 3.75Å; T392-M396 HydrophobicContact CG2-CE 4.13Å; T392-M396 WeakPolarHBondContact O-CG 3.01Å; T392-M396 PolarHBondContact O-N 2.94Å; L393-M396 PolarHBondContact O-N 2.81Å; M396-N401 WeakPolarHBondContact O-CA 3.31Å; M396-N401 PolarHBondContact O-N 3.38Å; M396-F402 PolarHBondContact O-N 3.26Å; M396-V403 HydrophobicContact CB-CG2 4.29Å; M396-H404 HydrophobicContact CE-CB 4.43Å; M396-H404 HydrophobicContact SD-CB 3.82Å; M396-L407 HydrophobicContact CE-CD2 3.83Å
397	V	90.4	Very high	90.2	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.012	13%	0.128	C	C	.	.	I	π-helix	trans	-79.1	-53.2	-175	174.5	0	0	0	0	112.2	L393 L394 K395 V403 F467 I549 I553	L393-V397 HydrophobicContact CD1-CG2 3.84Å; L393-V397 VanDerWaalsContact O-CG2 3.29Å; L393-V397 WeakPolarHBondContact O-CG2 3.41Å; L393-V397 PolarHBondContact O-N 2.95Å; L394-V397 PolarHBondContact O-N 3.06Å; K395-V397 VanDerWaalsContact C-N 3.26Å; K395-V397 PolarHBondContact O-N 2.63Å; V397-V403 HydrophobicContact CB-CG2 4.32Å; V397-V403 HydrophobicContact CG2-CG1 4.25Å; V397-V403 HydrophobicContact CG2-CG2 3.71Å; V397-F467 HydrophobicContact CG1-CD1 4.28Å; V397-F467 HydrophobicContact CG1-CE1 3.48Å; V397-F467 VanDerWaalsContact CG1-CE1 3.48Å; V397-F467 HydrophobicContact CG1-CZ 4.01Å; V397-I549 HydrophobicContact CG1-CG2 3.96Å; V397-I549 HydrophobicContact CG2-CG2 3.89Å; V397-I553 HydrophobicContact CG1-CD1 4.47Å; V397-I553 HydrophobicContact CG2-CD1 4.39Å; V397-I553 HydrophobicContact CG2-CG1 4.32Å
398	F	89	Confident	89.7	Confident	9 Å²	9	19.5 Å²	19.5	4%	0.039	11%	0.112	C	C	.	.	I	π-helix	trans	-97.8	-23.9	-166.9	-64.9	-65.4	0	0	0	114.2	L394 F467 K468 F471 A573 L577	L394-F398 HydrophobicContact CB-CD2 4.49Å; L394-F398 HydrophobicContact CD2-CD2 3.88Å; L394-F398 HydrophobicContact CD2-CE2 3.66Å; L394-F398 WeakPolarHBondContact O-CB 3.44Å; L394-F398 PolarHBondContact O-N 2.73Å; F398-F467 HydrophobicContact CD1-CD1 4.44Å; F398-F467 HydrophobicContact CD1-CE1 4.42Å; F398-F467 AromaticContact CE1-CD1 3.71Å; F398-F467 HydrophobicContact CE1-CD1 3.71Å; F398-F467 AromaticContact CE1-CE1 3.52Å; F398-F467 HydrophobicContact CE1-CE1 3.52Å; F398-F467 HydrophobicContact CZ-CD1 4.41Å; F398-F467 AromaticContact CZ-CE1 3.77Å; F398-F467 HydrophobicContact CZ-CE1 3.77Å; F398-K468 HydrophobicContact CD1-CG 3.96Å; F398-K468 HydrophobicContact CE1-CG 4.37Å; F398-K468 WeakPolarHBondContact O-CE 3.32Å; F398-K468 PolarHBondContact O-NZ 2.9Å; F398-F471 HydrophobicContact CE1-CB 4.38Å; F398-F471 HydrophobicContact CE1-CG 4.31Å; F398-F471 HydrophobicContact CZ-CB 4.31Å; F398-F471 AromaticContact CZ-CD1 3.87Å; F398-F471 HydrophobicContact CZ-CD1 3.87Å; F398-F471 HydrophobicContact CZ-CD2 4.48Å; F398-F471 HydrophobicContact CZ-CE1 4.3Å; F398-F471 AromaticContact CZ-CG 3.95Å; F398-F471 HydrophobicContact CZ-CG 3.95Å; F398-A573 HydrophobicContact CE2-CB 4.41Å; F398-L577 HydrophobicContact CD1-CD2 3.74Å; F398-L577 HydrophobicContact CE1-CD2 3.48Å; F398-L577 VanDerWaalsContact CE1-CD2 3.48Å; F398-L577 HydrophobicContact CG-CD2 4.39Å; F398-L577 HydrophobicContact CZ-CD2 3.94Å
399	V	90.5	Very high	89.2	Confident	87 Å²	87	21 Å²	21	53%	0.527	12%	0.123	S	C	.	.	I	π-helix	trans	-100.3	-58.4	-178.2	-175.9	0	0	0	0	109.9	K395 L576	K395-V399 HydrophobicContact CG-CB 4.01Å; K395-V399 HydrophobicContact CG-CG1 4.45Å; K395-V399 HydrophobicContact CG-CG2 4.3Å; K395-V399 WeakPolarHBondContact O-CA 3.48Å; K395-V399 VanDerWaalsContact O-CB 3.3Å; K395-V399 WeakPolarHBondContact O-CB 3.33Å; K395-V399 PolarHBondContact O-N 2.99Å; V399-L576 HydrophobicContact CG2-CD2 4.27Å
400	D	93.3	Very high	88.6	Confident	34 Å²	34	22.3 Å²	22.3	18%	0.182	14%	0.137	C	C	.	.	S	Bend	trans	-85.8	-23.3	-170.8	-56.8	-24.5	0	0	0	113.2	K395 F402	K395-D400 IonicContact NZ-OD1 2.67Å; K395-D400 PolarHBondContact NZ-OD1 2.81Å; K395-D400 IonicContact NZ-OD2 2.66Å; K395-D400 PolarHBondContact NZ-OD2 2.78Å; K395-D400 PolarHBondContact O-N 2.82Å; D400-F402 HydrophobicContact CB-CB 4.26Å; D400-F402 PolarHBondContact O-N 3.12Å
401	N	93.4	Very high	88.6	Confident	10 Å²	10	23 Å²	23	5%	0.053	14%	0.14	C	C	.	.			trans	49.3	41.1	-169.6	-175.7	28.7	0	0	0	111.7	M396 Q458 L459 L464	M396-N401 WeakPolarHBondContact O-CA 3.31Å; M396-N401 PolarHBondContact O-N 3.38Å; N401-Q458 VanDerWaalsContact O-CG 3.24Å; N401-Q458 WeakPolarHBondContact O-CG 3.18Å; N401-L459 PolarHBondContact ND2-O 3.35Å; N401-L459 WeakPolarHBondContact OD1-CB 3.4Å; N401-L459 PolarHBondContact OD1-N 3.03Å; N401-L464 HydrophobicContact CB-CD1 4.24Å; N401-L464 HydrophobicContact CB-CD2 3.78Å
402	F	94.4	Very high	88.7	Confident	22 Å²	22	20.3 Å²	20.3	10%	0.096	13%	0.126	C	C	.	.			trans	-143.2	92.2	-177.4	-165.5	-101.7	0	0	0	107.8	N330 R333 F334 M396 D400 V456	N330-F402 HydrophobicContact CB-CZ 4.28Å; R333-F402 HydrophobicContact CB-CE1 4.07Å; R333-F402 HydrophobicContact CB-CZ 4.18Å; R333-F402 HydrophobicContact CG-CD1 4.17Å; R333-F402 HydrophobicContact CG-CE1 3.87Å; R333-F402 HydrophobicContact CG-CE2 4.4Å; R333-F402 HydrophobicContact CG-CZ 3.99Å; F334-F402 AromaticContact CD1-CD1 3.99Å; F334-F402 HydrophobicContact CD1-CD1 3.99Å; F334-F402 HydrophobicContact CD1-CE1 4.28Å; F334-F402 HydrophobicContact CD2-CD1 4.46Å; F334-F402 AromaticContact CD2-CE1 3.97Å; F334-F402 HydrophobicContact CD2-CE1 3.97Å; F334-F402 AromaticContact CE1-CD1 3.54Å; F334-F402 HydrophobicContact CE1-CD1 3.54Å; F334-F402 AromaticContact CE1-CE1 3.99Å; F334-F402 HydrophobicContact CE1-CE1 3.99Å; F334-F402 WeakPolarHBondContact CE1-O 3.41Å; F334-F402 HydrophobicContact CE2-CD1 4.05Å; F334-F402 AromaticContact CE2-CE1 3.64Å; F334-F402 HydrophobicContact CE2-CE1 3.64Å; F334-F402 HydrophobicContact CG-CD1 4.42Å; F334-F402 HydrophobicContact CG-CE1 4.26Å; F334-F402 AromaticContact CZ-CD1 3.55Å; F334-F402 HydrophobicContact CZ-CD1 3.55Å; F334-F402 AromaticContact CZ-CE1 3.64Å; F334-F402 HydrophobicContact CZ-CE1 3.64Å; M396-F402 PolarHBondContact O-N 3.26Å; D400-F402 HydrophobicContact CB-CB 4.26Å; D400-F402 PolarHBondContact O-N 3.12Å; F402-V456 HydrophobicContact CD1-CG1 3.93Å; F402-V456 HydrophobicContact CD2-CG1 3.57Å; F402-V456 HydrophobicContact CE1-CB 4.45Å; F402-V456 HydrophobicContact CE1-CG1 3.85Å; F402-V456 HydrophobicContact CE1-CG2 3.91Å; F402-V456 HydrophobicContact CE2-CB 4.27Å; F402-V456 HydrophobicContact CE2-CG1 3.49Å; F402-V456 VanDerWaalsContact CE2-CG1 3.49Å; F402-V456 HydrophobicContact CG-CG1 3.8Å; F402-V456 HydrophobicContact CZ-CB 4.1Å; F402-V456 HydrophobicContact CZ-CG1 3.63Å; F402-V456 HydrophobicContact CZ-CG2 3.85Å
403	V	92.9	Very high	88.7	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.2	-165.5	-175	0	0	0	0	110.9	M396 V397 G405 V456 A457 I549 A552	M396-V403 HydrophobicContact CB-CG2 4.29Å; V397-V403 HydrophobicContact CB-CG2 4.32Å; V397-V403 HydrophobicContact CG2-CG1 4.25Å; V397-V403 HydrophobicContact CG2-CG2 3.71Å; V403-G405 PolarHBondContact O-N 2.75Å; V403-G405 VanDerWaalsContact O-N 3.1Å; V403-V456 CarbonylContact O-C 3.6Å; V403-V456 WeakPolarHBondContact O-CA 3.47Å; V403-V456 WeakPolarHBondContact O-CG1 3.34Å; V403-A457 PolarHBondContact N-O 3.24Å; V403-A457 PolarHBondContact O-N 3.24Å; V403-I549 HydrophobicContact CB-CG1 4.13Å; V403-I549 HydrophobicContact CG1-CG1 4.4Å; V403-I549 HydrophobicContact CG2-CD1 4.07Å; V403-I549 HydrophobicContact CG2-CG1 3.95Å; V403-I549 HydrophobicContact CG2-CG2 4.48Å; V403-A552 HydrophobicContact CG1-CB 4Å
404	H	92.1	Very high	88.8	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	111.4	173.2	-165.5	-63.4	0	0	0	110.6	F334 M396 D406 L407 L451 D452 A453	F334-H404 HydrophobicContact CE2-CB 4.47Å; F334-H404 HydrophobicContact CZ-CB 3.92Å; M396-H404 HydrophobicContact CE-CB 4.43Å; M396-H404 HydrophobicContact SD-CB 3.82Å; H404-D406 PolarHBondContact ND1-N 2.97Å; H404-L407 HydrophobicContact CB-CB 4.1Å; H404-L407 HydrophobicContact CB-CD2 4.22Å; H404-L407 PolarHBondContact ND1-N 3.14Å; H404-L451 PolarHBondContact NE2-O 3.12Å; H404-L451 VanDerWaalsContact NE2-O 3.12Å; H404-D452 PolarHBondContact CE1-O 2.89Å; H404-D452 VanDerWaalsContact NE2-C 3.33Å; H404-D452 PolarHBondContact NE2-O 2.8Å; H404-A453 WeakPolarHBondContact NE2-CA 3.26Å; H404-A453 PolarHBondContact NE2-N 3.48Å
405	G	83	Confident	88.7	Confident	23 Å²	23	23.5 Å²	23.5	24%	0.237	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.4	-167.8	0	0	0	0	0	115.6	V403 I455	V403-G405 PolarHBondContact O-N 2.75Å; V403-G405 VanDerWaalsContact O-N 3.1Å; G405-I455 PolarHBondContact N-O 2.85Å
406	D	80.3	Confident	88	Confident	19 Å²	19	25.8 Å²	25.8	10%	0.102	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.5	39.7	175.5	-153.9	8.3	0	0	0	111.4	K143 H167 H404 H408 N411 I455	K143-D406 IonicContact NZ-OD2 2.88Å; H167-D406 IonicContact CE1-OD1 3.33Å; H404-D406 PolarHBondContact ND1-N 2.97Å; D406-H408 PolarHBondContact O-CD2 2.77Å; D406-H408 PolarHBondContact O-N 3.33Å; D406-H408 VanDerWaalsContact O-N 3.12Å; D406-H408 IonicContact OD1-CD2 3.64Å; D406-H408 PolarHBondContact OD1-CD2 3.48Å; D406-N411 PolarHBondContact O-ND2 3.38Å; D406-I455 HydrophobicContact CB-CD1 4.43Å
407	L	82.1	Confident	86.5	Confident	10 Å²	10	27.2 Å²	27.2	5%	0.052	16%	0.158	C	C	.	.			trans	-84.2	85.1	-176.1	-161.8	57.2	0	0	0	111.2	M396 H404 I412 L450 V555 L556	M396-L407 HydrophobicContact CE-CD2 3.83Å; H404-L407 HydrophobicContact CB-CB 4.1Å; H404-L407 HydrophobicContact CB-CD2 4.22Å; H404-L407 PolarHBondContact ND1-N 3.14Å; L407-I412 HydrophobicContact CD1-CD1 4.19Å; L407-I412 HydrophobicContact CD1-CG1 3.6Å; L407-I412 HydrophobicContact CG-CD1 4.03Å; L407-I412 HydrophobicContact CG-CG1 4.01Å; L407-L450 HydrophobicContact CD1-CD1 4.41Å; L407-L450 HydrophobicContact CD1-CD2 4.15Å; L407-L450 HydrophobicContact CD2-CD1 4.2Å; L407-V555 WeakPolarHBondContact O-CG1 3.27Å; L407-L556 HydrophobicContact CB-CD1 4.49Å; L407-L556 HydrophobicContact CD2-CD1 3.78Å; L407-L556 HydrophobicContact CD2-CD2 3.93Å; L407-L556 HydrophobicContact CD2-CG 4.38Å; L407-L556 HydrophobicContact CG-CD1 4.36Å; L407-L556 HydrophobicContact CG-CD2 4.04Å
408	H	80.3	Confident	84.6	Confident	45 Å²	45	35.2 Å²	35.2	21%	0.208	19%	0.193	C	C	.	.			trans	-114.9	169.6	176.2	69.1	83.3	0	0	0	111	H167 D406 G410 N411 V555	H167-H408 AromaticContact ND1-NE2 3.74Å; D406-H408 PolarHBondContact O-CD2 2.77Å; D406-H408 PolarHBondContact O-N 3.33Å; D406-H408 VanDerWaalsContact O-N 3.12Å; D406-H408 IonicContact OD1-CD2 3.64Å; D406-H408 PolarHBondContact OD1-CD2 3.48Å; H408-G410 PolarHBondContact ND1-N 3.47Å; H408-G410 VanDerWaalsContact ND1-N 3.1Å; H408-G410 PolarHBondContact O-N 3.41Å; H408-N411 PolarHBondContact NE2-ND2 3.22Å; H408-N411 PolarHBondContact O-N 2.84Å; H408-V555 HydrophobicContact CB-CG1 4.48Å
409	P	80.9	Confident	82.3	Confident	47 Å²	47	39.9 Å²	39.9	31%	0.305	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.5	-175	-27.5	35.4	0	0	0	116.4	I369 L559	I369-P409 HydrophobicContact CG2-CB 3.82Å; I369-P409 WeakPolarHBondContact CG2-O 3.41Å; P409-L559 HydrophobicContact CG-CD1 4.14Å; P409-L559 HydrophobicContact CG-CD2 4.25Å
410	G	79.5	Confident	80.1	Confident	46 Å²	46	39.2 Å²	39.2	47%	0.474	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.9	175.7	0	0	0	0	0	113.7	H408	H408-G410 PolarHBondContact ND1-N 3.47Å; H408-G410 VanDerWaalsContact ND1-N 3.1Å; H408-G410 PolarHBondContact O-N 3.41Å
411	N	88.7	Confident	77.5	Confident	16 Å²	16	42.3 Å²	42.3	9%	0.086	25%	0.251	C	S	.	.	S	Bend	trans	-107.6	7.7	-179.4	-72.7	-12.7	0	0	0	112.2	D406 H408 L451	D406-N411 PolarHBondContact O-ND2 3.38Å; H408-N411 PolarHBondContact NE2-ND2 3.22Å; H408-N411 PolarHBondContact O-N 2.84Å; N411-L451 WeakPolarHBondContact CB-O 3.26Å; N411-L451 PolarHBondContact O-N 3.2Å
412	I	91.8	Very high	74.8	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	113	176.8	-52.9	165.6	0	0	0	107	I369 L407 L448 L450 L556 L559	I369-I412 HydrophobicContact CB-CB 4.27Å; I369-I412 HydrophobicContact CB-CG2 4.09Å; I369-I412 WeakPolarHBondContact CB-O 3.41Å; I369-I412 HydrophobicContact CD1-CB 4.42Å; I369-I412 HydrophobicContact CD1-CG2 3.62Å; I369-I412 HydrophobicContact CG1-CG2 4.47Å; I369-I412 HydrophobicContact CG2-CB 3.93Å; I369-I412 HydrophobicContact CG2-CG2 4.25Å; I369-I412 WeakPolarHBondContact CG2-O 3.28Å; I369-I412 PolarHBondContact N-O 2.98Å; L407-I412 HydrophobicContact CD1-CD1 4.19Å; L407-I412 HydrophobicContact CD1-CG1 3.6Å; L407-I412 HydrophobicContact CG-CD1 4.03Å; L407-I412 HydrophobicContact CG-CG1 4.01Å; I412-L448 HydrophobicContact CG2-CD2 4.5Å; I412-L450 HydrophobicContact CB-CD2 4.31Å; I412-L450 HydrophobicContact CG1-CD2 4.06Å; I412-L450 HydrophobicContact CG2-CD2 3.9Å; I412-L556 HydrophobicContact CD1-CD2 3.77Å; I412-L559 HydrophobicContact CD1-CD2 3.51Å
413	L	92.9	Very high	71.9	Confident	22 Å²	22	47.6 Å²	47.6	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	158.4	171	-43.3	-178.5	0	0	0	109.7	E367 P368 L448 V449 L451	E367-L413 CarbonylContact O-C 3.58Å; E367-L413 VanDerWaalsContact O-CA 3.28Å; E367-L413 WeakPolarHBondContact O-CA 3.45Å; E367-L413 WeakPolarHBondContact O-CB 3.41Å; P368-L413 HydrophobicContact CB-CD2 4.35Å; P368-L413 HydrophobicContact CG-CD2 4.32Å; L413-L448 WeakPolarHBondContact O-CA 3.45Å; L413-V449 HydrophobicContact CB-CB 4.15Å; L413-V449 PolarHBondContact N-O 3.33Å; L413-V449 PolarHBondContact O-N 2.88Å; L413-L451 HydrophobicContact CD1-CD1 3.62Å; L413-L451 HydrophobicContact CD1-CG 4.26Å; L413-L451 HydrophobicContact CD2-CD1 4.41Å; L413-L451 HydrophobicContact CG-CD1 3.91Å; L413-L451 HydrophobicContact CG-CG 4.31Å
414	V	92.6	Very high	69	Low	1 Å²	1	58.8 Å²	58.8	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.4	176	-179.8	0	0	0	0	106.8	E367 I369 Y372 I385 L446 Q447 L448	E367-V414 PolarHBondContact N-O 3.36Å; E367-V414 PolarHBondContact O-N 3.07Å; I369-V414 HydrophobicContact CB-CG2 4.01Å; I369-V414 HydrophobicContact CD1-CG2 4.28Å; I369-V414 HydrophobicContact CG1-CG2 3.93Å; Y372-V414 HydrophobicContact CD1-CG1 4.3Å; Y372-V414 HydrophobicContact CD2-CB 3.86Å; Y372-V414 HydrophobicContact CD2-CG1 4.28Å; Y372-V414 HydrophobicContact CD2-CG2 3.82Å; Y372-V414 HydrophobicContact CE1-CB 4.35Å; Y372-V414 HydrophobicContact CE1-CG1 3.77Å; Y372-V414 HydrophobicContact CE2-CB 3.43Å; Y372-V414 VanDerWaalsContact CE2-CB 3.43Å; Y372-V414 HydrophobicContact CE2-CG1 3.78Å; Y372-V414 HydrophobicContact CE2-CG2 3.95Å; Y372-V414 HydrophobicContact CG-CG2 4.3Å; Y372-V414 VanDerWaalsContact CZ-CG1 3.48Å; I385-V414 HydrophobicContact CD1-CG1 3.99Å; I385-V414 HydrophobicContact CD1-CG2 4.13Å; I385-V414 HydrophobicContact CG1-CG1 4.43Å; I385-V414 HydrophobicContact CG2-CG2 4.35Å; V414-L446 HydrophobicContact CG1-CD1 3.51Å; V414-Q447 WeakPolarHBondContact CA-O 3.31Å; V414-L448 HydrophobicContact CG2-CD2 3.98Å
415	Q	88.8	Confident	66.2	Low	55 Å²	55	66.7 Å²	66.7	26%	0.257	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.5	170.7	-166.7	168.9	-14.8	0	0	107.5	S366 Q447 V449	S366-Q415 WeakPolarHBondContact OG-CB 3.37Å; Q415-Q447 HydrophobicContact CB-CB 4.26Å; Q415-Q447 PolarHBondContact N-O 3.33Å; Q415-Q447 PolarHBondContact O-N 3.18Å; Q415-Q447 VanDerWaalsContact O-N 3.08Å; Q415-V449 HydrophobicContact CB-CG2 4.19Å
416	Y	76.2	Confident	64	Low	86 Å²	86	71.8 Å²	71.8	34%	0.337	40%	0.403	S	S	.	.			trans	-125.6	130.5	178.5	-171.2	-97.3	0	0	0	109.1	Y372 K418 L420 L446	Y372-Y416 WeakPolarHBondContact OH-CB 3.37Å; Y416-K418 PolarHBondContact O-N 2.87Å; Y416-K418 VanDerWaalsContact O-N 3.09Å; Y416-L420 HydrophobicContact CE1-CB 4.29Å; Y416-L446 HydrophobicContact CD2-CD1 3.68Å; Y416-L446 HydrophobicContact CE2-CD1 4.48Å
417	P	64.3	Low	62	Low	31 Å²	31	74.6 Å²	74.6	20%	0.201	42%	0.421	C	S	.	.			trans	-63.2	116	179.1	22.3	-30.4	0	0	0	110.3	S419 L420	P417-S419 PolarHBondContact O-N 2.82Å; P417-S419 VanDerWaalsContact O-N 3.09Å; P417-L420 HydrophobicContact CG-CD1 3.98Å; P417-L420 PolarHBondContact O-N 3.41Å
418	K	49.8	Very low	59.9	Low	169 Å²	169	80.3 Å²	80.3	74%	0.735	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-65	-11	179.6	-73.2	179.9	176.8	172.3	0	113.5	Y416 L420	Y416-K418 PolarHBondContact O-N 2.87Å; Y416-K418 VanDerWaalsContact O-N 3.09Å; K418-L420 VanDerWaalsContact C-N 3.27Å; K418-L420 PolarHBondContact O-N 3.18Å
419	S	41.6	Very low	58	Low	108 Å²	108	81.9 Å²	81.9	76%	0.755	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-70.1	-15.4	179.2	-161.4	0	0	0	0	114.3	P417	P417-S419 PolarHBondContact O-N 2.82Å; P417-S419 VanDerWaalsContact O-N 3.09Å
420	L	43.9	Very low	55.8	Low	72 Å²	72	86 Å²	86	38%	0.377	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-94.7	-3.9	-177.7	-87.4	137.6	0	0	0	115.3	Y416 P417 K418 G422	Y416-L420 HydrophobicContact CE1-CB 4.29Å; P417-L420 HydrophobicContact CG-CD1 3.98Å; P417-L420 PolarHBondContact O-N 3.41Å; K418-L420 VanDerWaalsContact C-N 3.27Å; K418-L420 PolarHBondContact O-N 3.18Å; L420-G422 PolarHBondContact O-N 2.82Å
421	A	37.8	Very low	54	Low	100 Å²	100	90 Å²	90	83%	0.826	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-76.5	-7.4	177	0	0	0	0	0	113.3
422	G	37.2	Very low	51.7	Low	56 Å²	56	97.4 Å²	97.4	58%	0.577	53%	0.532	S	S	*	.	S	Bend	trans	-133.1	103.6	178.3	0	0	0	0	0	112.4	L420	L420-G422 PolarHBondContact O-N 2.82Å
423	S	32.4	Very low	49.2	Very low	87 Å²	87	105.1 Å²	105.1	61%	0.608	57%	0.573	S	S	*	*			trans	80.7	94.5	167.1	-149.7	0	0	0	0	116.5	K425	S423-K425 PolarHBondContact O-N 3.08Å; S423-K425 VanDerWaalsContact OG-CG 3.29Å; S423-K425 WeakPolarHBondContact OG-CG 3.35Å
424	R	32.1	Very low	46.8	Very low	236 Å²	236	108.4 Å²	108.4	89%	0.891	59%	0.594	S	S	*	*			trans	-57.1	90.3	146.1	-89.3	-179.8	170.5	161	-2.8	108	T426	R424-T426 PolarHBondContact O-N 2.98Å
425	K	34.6	Very low	44.2	Very low	166 Å²	166	112.8 Å²	112.8	72%	0.722	62%	0.621	S	S	*	*			trans	-85.2	89	167.6	-74.8	-172.6	177.5	173.2	0	109.1	S423 T427	S423-K425 PolarHBondContact O-N 3.08Å; S423-K425 VanDerWaalsContact OG-CG 3.29Å; S423-K425 WeakPolarHBondContact OG-CG 3.35Å; K425-T427 PolarHBondContact O-N 3.03Å; K425-T427 VanDerWaalsContact O-N 3.14Å
426	T	37	Very low	41.9	Very low	130 Å²	130	114.2 Å²	114.2	80%	0.798	63%	0.633	S	S	*	*			trans	-61.2	108.7	156.4	43	0	0	0	0	107.7	R424	R424-T426 PolarHBondContact O-N 2.98Å
427	T	38.4	Very low	40.1	Very low	78 Å²	78	115.5 Å²	115.5	48%	0.479	65%	0.649	S	S	.	*			trans	-91.7	108.4	173.8	-45.8	0	0	0	0	107.1	K425	K425-T427 PolarHBondContact O-N 3.03Å; K425-T427 VanDerWaalsContact O-N 3.14Å
428	L	36.5	Very low	38.8	Very low	131 Å²	131	118 Å²	118	69%	0.686	67%	0.668	S	S	*	*			trans	-85.7	106.1	169	-103.2	156.1	0	0	0	107	V435	L428-V435 HydrophobicContact CD2-CG1 3.6Å
429	T	41	Very low	38.4	Very low	78 Å²	78	115.8 Å²	115.8	48%	0.479	67%	0.668	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.8	113.3	168.2	24.6	0	0	0	0	108.4
430	D	35.2	Very low	38.5	Very low	134 Å²	134	119.5 Å²	119.5	72%	0.717	67%	0.666	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.2	109.3	175	-157	8.7	0	0	0	108.4
431	L	40.6	Very low	38.4	Very low	130 Å²	130	121.7 Å²	121.7	68%	0.681	68%	0.684	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.5	106	171.5	-76.9	169.2	0	0	0	106.5	D433 T434	L431-D433 PolarHBondContact O-N 3.38Å; L431-T434 PolarHBondContact O-N 2.9Å; L431-T434 VanDerWaalsContact O-N 3.14Å
432	L	41.4	Very low	38.7	Very low	171 Å²	171	121.3 Å²	121.3	90%	0.895	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	27.6	77.5	163.7	-74.8	154.7	0	0	0	114
433	D	39.5	Very low	39.3	Very low	167 Å²	167	122.5 Å²	122.5	89%	0.893	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	71	17.4	172.1	-64.5	-27	0	0	0	118.1	L431	L431-D433 PolarHBondContact O-N 3.38Å
434	T	42.1	Very low	40.2	Very low	90 Å²	90	120.8 Å²	120.8	55%	0.552	65%	0.653	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-135.7	113.5	167.5	-46.4	0	0	0	0	112.3	L431 V436	L431-T434 PolarHBondContact O-N 2.9Å; L431-T434 VanDerWaalsContact O-N 3.14Å; T434-V436 HydrophobicContact CG2-CG2 4.34Å; T434-V436 PolarHBondContact O-N 3.38Å; T434-V436 VanDerWaalsContact O-N 3.14Å
435	V	38.9	Very low	42.1	Very low	94 Å²	94	112 Å²	112	57%	0.57	63%	0.626	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.1	100.1	172.8	178.9	0	0	0	0	109.2	L428 V437	L428-V435 HydrophobicContact CD2-CG1 3.6Å; V435-V437 HydrophobicContact CG1-CG2 4.21Å; V435-V437 PolarHBondContact O-N 3.04Å
436	V	38.6	Very low	44.6	Very low	84 Å²	84	104.4 Å²	104.4	51%	0.509	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.7	103.6	173.3	-177.5	0	0	0	0	109	T434 S438	T434-V436 HydrophobicContact CG2-CG2 4.34Å; T434-V436 PolarHBondContact O-N 3.38Å; T434-V436 VanDerWaalsContact O-N 3.14Å; V436-S438 PolarHBondContact O-N 3.41Å; V436-S438 VanDerWaalsContact O-N 3.14Å
437	V	40.3	Very low	47.2	Very low	113 Å²	113	99.4 Å²	99.4	69%	0.685	56%	0.561	S	S	*	*			trans	-78.6	91.6	168.5	-177.2	0	0	0	0	108.1	V435 V439	V435-V437 HydrophobicContact CG1-CG2 4.21Å; V435-V437 PolarHBondContact O-N 3.04Å; V437-V439 HydrophobicContact CG1-CG2 4.19Å; V437-V439 PolarHBondContact O-N 3.19Å; V437-V439 VanDerWaalsContact O-N 3.16Å
438	S	36.6	Very low	49.9	Very low	84 Å²	84	95.9 Å²	95.9	59%	0.587	54%	0.539	S	S	*	.			trans	-77.7	96.5	172.1	179.6	0	0	0	0	109.7	V436 R440	V436-S438 PolarHBondContact O-N 3.41Å; V436-S438 VanDerWaalsContact O-N 3.14Å; S438-R440 PolarHBondContact O-N 3.03Å
439	V	40.9	Very low	52.6	Low	122 Å²	122	89.6 Å²	89.6	74%	0.739	51%	0.507	S	S	*	.			trans	-73.8	110.8	165.7	-178.2	0	0	0	0	107.3	V437	V437-V439 HydrophobicContact CG1-CG2 4.19Å; V437-V439 PolarHBondContact O-N 3.19Å; V437-V439 VanDerWaalsContact O-N 3.16Å
440	R	43.3	Very low	55.2	Low	187 Å²	187	86.1 Å²	86.1	71%	0.706	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-69.9	130.5	173.6	-63.5	-175.6	-176.6	-175.4	-1	108.6	S438	S438-R440 PolarHBondContact O-N 3.03Å
441	P	42.1	Very low	58	Low	117 Å²	117	81.7 Å²	81.7	76%	0.76	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-64.2	140.9	165.9	25.6	-28.5	0	0	0	109.3
442	D	44.3	Very low	60.3	Low	93 Å²	93	77.3 Å²	77.3	50%	0.497	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-59.2	127	-177	-80.8	-36	0	0	0	110.6	R384 C444	R384-D442 IonicContact NH1-OD2 3.24Å; D442-C444 VanDerWaalsContact C-N 3.28Å; D442-C444 PolarHBondContact O-N 3.43Å
443	P	49.3	Very low	62.7	Low	81 Å²	81	69.2 Å²	69.2	53%	0.526	40%	0.396	S	S	.	.	S	Bend	trans	-75.7	-2.9	-165.6	27.6	-33.5	0	0	0	115.6	E242	E242-P443 WeakPolarHBondContact OE2-CB 3.15Å
444	C	52.6	Low	65	Low	50 Å²	50	61.3 Å²	61.3	34%	0.338	35%	0.354	S	S	.	.	S	Bend	trans	-160.8	127.3	166.2	-160.7	0	0	0	0	108.9	D442 L446	D442-C444 VanDerWaalsContact C-N 3.28Å; D442-C444 PolarHBondContact O-N 3.43Å; C444-L446 PolarHBondContact O-N 3.44Å
445	P	71.6	Confident	67	Low	52 Å²	52	58.5 Å²	58.5	34%	0.338	34%	0.336	S	S	.	.			trans	-69.1	137.4	-174	27.4	-32.5	0	0	0	110.1	Q447	P445-Q447 WeakPolarHBondContact O-CG 3.4Å; P445-Q447 PolarHBondContact O-N 3Å
446	L	86.7	Confident	69.4	Low	6 Å²	6	54.9 Å²	54.9	3%	0.031	31%	0.314	C	S	.	.			trans	-42.7	124.1	163.9	170.6	80.9	0	0	0	110.5	V381 R384 I385 M388 V414 Y416 C444	V381-L446 HydrophobicContact CG1-CD1 4.42Å; V381-L446 HydrophobicContact CG1-CD2 4.5Å; R384-L446 HydrophobicContact CB-CD2 3.75Å; I385-L446 HydrophobicContact CD1-CD1 4.39Å; I385-L446 HydrophobicContact CG1-CD1 4.14Å; I385-L446 HydrophobicContact CG1-CD2 3.79Å; I385-L446 HydrophobicContact CG1-CG 4.41Å; M388-L446 HydrophobicContact CE-CD2 3.41Å; M388-L446 VanDerWaalsContact CE-CD2 3.41Å; M388-L446 HydrophobicContact CE-CG 3.6Å; M388-L446 HydrophobicContact SD-CD2 4.38Å; V414-L446 HydrophobicContact CG1-CD1 3.51Å; Y416-L446 HydrophobicContact CD2-CD1 3.68Å; Y416-L446 HydrophobicContact CE2-CD1 4.48Å; C444-L446 PolarHBondContact O-N 3.44Å
447	Q	91.9	Very high	71.8	Confident	26 Å²	26	51.1 Å²	51.1	12%	0.121	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	148.6	-179.2	-52.8	-178.8	-44.2	0	0	112.3	E342 N343 V414 Q415 P445	E342-Q447 PolarHBondContact O-NE2 3.34Å; N343-Q447 CarbonylContact O-C 3.43Å; N343-Q447 VanDerWaalsContact O-CA 3.26Å; N343-Q447 WeakPolarHBondContact O-CA 3.2Å; V414-Q447 WeakPolarHBondContact CA-O 3.31Å; Q415-Q447 HydrophobicContact CB-CB 4.26Å; Q415-Q447 PolarHBondContact N-O 3.33Å; Q415-Q447 PolarHBondContact O-N 3.18Å; Q415-Q447 VanDerWaalsContact O-N 3.08Å; P445-Q447 WeakPolarHBondContact O-CG 3.4Å; P445-Q447 PolarHBondContact O-N 3Å
448	L	94	Very high	74.2	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.6	164.2	-59.5	-176.2	0	0	0	109.7	N343 I344 K345 I385 M388 I412 L413 V414 L450	N343-L448 PolarHBondContact O-N 2.86Å; I344-L448 HydrophobicContact CD1-CB 3.86Å; I344-L448 HydrophobicContact CD1-CD1 4.07Å; I344-L448 HydrophobicContact CD1-CG 4.2Å; K345-L448 PolarHBondContact N-O 2.69Å; I385-L448 HydrophobicContact CG2-CD2 3.98Å; M388-L448 HydrophobicContact CB-CD1 3.62Å; M388-L448 HydrophobicContact CB-CG 4.08Å; M388-L448 HydrophobicContact CE-CD1 4.38Å; M388-L448 HydrophobicContact CE-CD2 3.84Å; M388-L448 HydrophobicContact CE-CG 3.74Å; M388-L448 HydrophobicContact SD-CG 4.5Å; I412-L448 HydrophobicContact CG2-CD2 4.5Å; L413-L448 WeakPolarHBondContact O-CA 3.45Å; V414-L448 HydrophobicContact CG2-CD2 3.98Å; L448-L450 HydrophobicContact CB-CD2 4.38Å
449	V	94.8	Very high	76.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.4	173.3	-175.9	0	0	0	0	108.9	K345 E364 S366 L413 Q415 L451	K345-V449 HydrophobicContact CB-CG2 4.24Å; K345-V449 CarbonylContact O-C 3.54Å; K345-V449 VanDerWaalsContact O-CA 3.3Å; K345-V449 WeakPolarHBondContact O-CA 3.16Å; E364-V449 HydrophobicContact CB-CG1 3.71Å; E364-V449 HydrophobicContact CB-CG2 4.32Å; E364-V449 HydrophobicContact CG-CG1 3.65Å; S366-V449 WeakPolarHBondContact OG-CG2 3.5Å; L413-V449 HydrophobicContact CB-CB 4.15Å; L413-V449 PolarHBondContact N-O 3.33Å; L413-V449 PolarHBondContact O-N 2.88Å; Q415-V449 HydrophobicContact CB-CG2 4.19Å; V449-L451 HydrophobicContact CG1-CD2 3.98Å
450	L	95.4	Very high	78.8	Confident	4 Å²	4	44 Å²	44	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.8	-178.6	-54.7	-167.7	0	0	0	110.8	I344 K345 F346 P347 T392 L407 I412 L448	I344-L450 HydrophobicContact CG2-CD1 4.45Å; K345-L450 PolarHBondContact O-N 3.3Å; F346-L450 HydrophobicContact CD1-CB 3.89Å; F346-L450 WeakPolarHBondContact CD1-O 3.18Å; F346-L450 HydrophobicContact CE1-CB 3.51Å; F346-L450 HydrophobicContact CE1-CD1 4.05Å; F346-L450 HydrophobicContact CE1-CG 4.29Å; F346-L450 HydrophobicContact CE2-CD1 4.29Å; F346-L450 HydrophobicContact CZ-CB 3.87Å; F346-L450 HydrophobicContact CZ-CD1 3.6Å; F346-L450 HydrophobicContact CZ-CG 4.14Å; P347-L450 WeakPolarHBondContact CD-O 3.3Å; T392-L450 HydrophobicContact CG2-CD1 3.83Å; L407-L450 HydrophobicContact CD1-CD1 4.41Å; L407-L450 HydrophobicContact CD1-CD2 4.15Å; L407-L450 HydrophobicContact CD2-CD1 4.2Å; I412-L450 HydrophobicContact CB-CD2 4.31Å; I412-L450 HydrophobicContact CG1-CD2 4.06Å; I412-L450 HydrophobicContact CG2-CD2 3.9Å; L448-L450 HydrophobicContact CB-CD2 4.38Å
451	L	92.6	Very high	80.9	Confident	41 Å²	41	41.6 Å²	41.6	22%	0.215	24%	0.241	C	C	.	.			trans	-113.1	164	-176.1	-56.4	-174.1	0	0	0	112.3	P347 H404 N411 L413 V449	P347-L451 HydrophobicContact CG-CD2 3.42Å; P347-L451 VanDerWaalsContact CG-CD2 3.42Å; H404-L451 PolarHBondContact NE2-O 3.12Å; H404-L451 VanDerWaalsContact NE2-O 3.12Å; N411-L451 WeakPolarHBondContact CB-O 3.26Å; N411-L451 PolarHBondContact O-N 3.2Å; L413-L451 HydrophobicContact CD1-CD1 3.62Å; L413-L451 HydrophobicContact CD1-CG 4.26Å; L413-L451 HydrophobicContact CD2-CD1 4.41Å; L413-L451 HydrophobicContact CG-CD1 3.91Å; L413-L451 HydrophobicContact CG-CG 4.31Å; V449-L451 HydrophobicContact CG1-CD2 3.98Å
452	D	89.4	Confident	83	Confident	38 Å²	38	41.5 Å²	41.5	20%	0.203	23%	0.23	C	C	.	.			trans	56.8	60.9	172.2	-169.2	4.9	0	0	0	114.2	H404 G454	H404-D452 PolarHBondContact CE1-O 2.89Å; H404-D452 VanDerWaalsContact NE2-C 3.33Å; H404-D452 PolarHBondContact NE2-O 2.8Å; D452-G454 PolarHBondContact O-N 2.76Å; D452-G454 PolarHBondContact OD1-N 3.12Å
453	A	91.3	Very high	85	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.008	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	31	173.2	0	0	0	0	0	113.1	N330 I331 F334 H404 I455	N330-A453 HydrophobicContact CB-CB 3.95Å; N330-A453 VanDerWaalsContact CB-O 3.23Å; N330-A453 WeakPolarHBondContact CB-O 3.34Å; N330-A453 PolarHBondContact ND2-O 3Å; I331-A453 HydrophobicContact CG1-CB 3.72Å; F334-A453 HydrophobicContact CD2-CB 3.79Å; F334-A453 HydrophobicContact CE2-CB 3.77Å; H404-A453 WeakPolarHBondContact NE2-CA 3.26Å; H404-A453 PolarHBondContact NE2-N 3.48Å; A453-I455 VanDerWaalsContact C-N 3.29Å; A453-I455 PolarHBondContact O-N 3.46Å
454	G	87.6	Confident	86.8	Confident	2 Å²	2	35.5 Å²	35.5	2%	0.021	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.3	-177.3	0	0	0	0	0	113.8	Q321 D452	Q321-G454 PolarHBondContact NE2-O 3.36Å; D452-G454 PolarHBondContact O-N 2.76Å; D452-G454 PolarHBondContact OD1-N 3.12Å
455	I	85.7	Confident	88.5	Confident	31 Å²	31	36 Å²	36	16%	0.159	20%	0.201	C	C	.	.			trans	-120.6	126.3	174.4	-68.1	153.8	0	0	0	109.1	L317 Q321 G405 D406 A453	L317-I455 HydrophobicContact CD2-CG2 4.02Å; Q321-I455 HydrophobicContact CG-CD1 4.12Å; Q321-I455 HydrophobicContact CG-CG1 3.95Å; G405-I455 PolarHBondContact N-O 2.85Å; D406-I455 HydrophobicContact CB-CD1 4.43Å; A453-I455 VanDerWaalsContact C-N 3.29Å; A453-I455 PolarHBondContact O-N 3.46Å
456	V	89.7	Confident	89.2	Confident	18 Å²	18	34.3 Å²	34.3	11%	0.109	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.7	173.1	176.8	0	0	0	0	109.3	N330 F334 F402 V403	N330-V456 HydrophobicContact CB-CG2 3.97Å; F334-V456 HydrophobicContact CE2-CG2 3.77Å; F334-V456 HydrophobicContact CZ-CG2 4.03Å; F402-V456 HydrophobicContact CD1-CG1 3.93Å; F402-V456 HydrophobicContact CD2-CG1 3.57Å; F402-V456 HydrophobicContact CE1-CB 4.45Å; F402-V456 HydrophobicContact CE1-CG1 3.85Å; F402-V456 HydrophobicContact CE1-CG2 3.91Å; F402-V456 HydrophobicContact CE2-CB 4.27Å; F402-V456 HydrophobicContact CE2-CG1 3.49Å; F402-V456 VanDerWaalsContact CE2-CG1 3.49Å; F402-V456 HydrophobicContact CG-CG1 3.8Å; F402-V456 HydrophobicContact CZ-CB 4.1Å; F402-V456 HydrophobicContact CZ-CG1 3.63Å; F402-V456 HydrophobicContact CZ-CG2 3.85Å; V403-V456 CarbonylContact O-C 3.6Å; V403-V456 WeakPolarHBondContact O-CA 3.47Å; V403-V456 WeakPolarHBondContact O-CG1 3.34Å
457	A	87.7	Confident	89.3	Confident	4 Å²	4	34 Å²	34	3%	0.033	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.4	170.5	0	0	0	0	0	110	V403 I549	V403-A457 PolarHBondContact N-O 3.24Å; V403-A457 PolarHBondContact O-N 3.24Å; A457-I549 HydrophobicContact CB-CD1 4.46Å; A457-I549 HydrophobicContact CB-CG1 3.86Å
458	Q	89.9	Confident	89.1	Confident	108 Å²	108	35.7 Å²	35.7	51%	0.505	19%	0.194	S	C	.	.			trans	-140.7	132.3	177.2	174.7	164.9	27.3	0	0	108	N401 N545	N401-Q458 VanDerWaalsContact O-CG 3.24Å; N401-Q458 WeakPolarHBondContact O-CG 3.18Å; Q458-N545 PolarHBondContact O-ND2 3.13Å
459	L	87.7	Confident	88.8	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.026	21%	0.208	C	C	.	.			trans	-87.6	153.8	175.4	-63	173.9	0	0	0	109.9	N401 D463 L464 F467 N545 I549	N401-L459 PolarHBondContact ND2-O 3.35Å; N401-L459 WeakPolarHBondContact OD1-CB 3.4Å; N401-L459 PolarHBondContact OD1-N 3.03Å; L459-D463 HydrophobicContact CB-CB 4.14Å; L459-D463 HydrophobicContact CD2-CB 4.3Å; L459-L464 HydrophobicContact CB-CB 4.11Å; L459-L464 HydrophobicContact CD1-CD1 4.28Å; L459-F467 HydrophobicContact CD1-CB 3.84Å; L459-F467 HydrophobicContact CD1-CD2 3.99Å; L459-F467 HydrophobicContact CD1-CG 3.95Å; L459-N545 HydrophobicContact CD2-CB 3.79Å; L459-I549 HydrophobicContact CD1-CD1 3.65Å; L459-I549 HydrophobicContact CD2-CD1 3.87Å; L459-I549 HydrophobicContact CG-CD1 3.42Å; L459-I549 VanDerWaalsContact CG-CD1 3.42Å
460	S	88.1	Confident	88.5	Confident	56 Å²	56	37.7 Å²	37.7	39%	0.392	21%	0.21	S	C	.	.			trans	-65.8	160.8	163.5	79.3	0	0	0	0	109.7	H462 D463 L464	S460-H462 PolarHBondContact O-N 2.87Å; S460-D463 WeakPolarHBondContact CB-OD2 2.98Å; S460-D463 PolarHBondContact O-N 2.85Å; S460-D463 VanDerWaalsContact O-N 3.08Å; S460-D463 PolarHBondContact OG-N 2.99Å; S460-D463 VanDerWaalsContact OG-N 3.13Å; S460-D463 PolarHBondContact OG-OD2 3.44Å; S460-L464 WeakPolarHBondContact O-CB 3.39Å; S460-L464 PolarHBondContact O-N 3.2Å
461	D	87.8	Confident	88.1	Confident	137 Å²	137	38.2 Å²	38.2	73%	0.733	21%	0.212	S	C	*	.	H	α-helix	trans	-58.3	-36.5	178.9	-62.7	-34.3	0	0	0	112.2	A465	D461-A465 WeakPolarHBondContact O-CB 3.29Å; D461-A465 PolarHBondContact O-N 2.72Å
462	H	85.8	Confident	87.8	Confident	116 Å²	116	37.2 Å²	37.2	54%	0.537	21%	0.208	S	C	.	.	H	α-helix	trans	-64.2	-47.8	174.4	176.3	-94.8	0	0	0	111.8	S460 L464 A465 N466 H489	S460-H462 PolarHBondContact O-N 2.87Å; H462-L464 VanDerWaalsContact C-N 3.34Å; H462-L464 PolarHBondContact O-N 3.45Å; H462-A465 PolarHBondContact O-N 3.1Å; H462-N466 PolarHBondContact O-N 3.33Å; H462-H489 AromaticContact CE1-CD2 3.19Å; H462-H489 PolarHBondContact CE1-CD2 3.37Å; H462-H489 AromaticContact CE1-NE2 3.39Å; H462-H489 PolarHBondContact CE1-NE2 3.4Å; H462-H489 AromaticContact ND1-CD2 3.89Å; H462-H489 AromaticContact NE2-CD2 3.89Å; H462-H489 AromaticContact NE2-NE2 3.6Å
463	D	85.2	Confident	87.8	Confident	28 Å²	28	35.6 Å²	35.6	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-71.4	-32.3	-178.1	-55.6	-38.8	0	0	0	111.5	L459 S460 N466 F467 E543	L459-D463 HydrophobicContact CB-CB 4.14Å; L459-D463 HydrophobicContact CD2-CB 4.3Å; S460-D463 WeakPolarHBondContact CB-OD2 2.98Å; S460-D463 PolarHBondContact O-N 2.85Å; S460-D463 VanDerWaalsContact O-N 3.08Å; S460-D463 PolarHBondContact OG-N 2.99Å; S460-D463 VanDerWaalsContact OG-N 3.13Å; S460-D463 PolarHBondContact OG-OD2 3.44Å; D463-N466 PolarHBondContact O-N 3.27Å; D463-F467 WeakPolarHBondContact O-CB 3.49Å; D463-F467 PolarHBondContact O-N 2.81Å; D463-E543 VanDerWaalsContact CG-OE2 3.26Å
464	L	87.8	Confident	87.5	Confident	20 Å²	20	36.3 Å²	36.3	11%	0.105	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-43.6	171.7	-178.6	66.9	0	0	0	111.3	N401 L459 S460 H462 N466 F467 K468	N401-L464 HydrophobicContact CB-CD1 4.24Å; N401-L464 HydrophobicContact CB-CD2 3.78Å; L459-L464 HydrophobicContact CB-CB 4.11Å; L459-L464 HydrophobicContact CD1-CD1 4.28Å; S460-L464 WeakPolarHBondContact O-CB 3.39Å; S460-L464 PolarHBondContact O-N 3.2Å; H462-L464 VanDerWaalsContact C-N 3.34Å; H462-L464 PolarHBondContact O-N 3.45Å; L464-N466 VanDerWaalsContact C-N 3.34Å; L464-F467 WeakPolarHBondContact O-CB 3.47Å; L464-F467 PolarHBondContact O-N 2.88Å; L464-K468 HydrophobicContact CG-CD 4.43Å; L464-K468 WeakPolarHBondContact O-CB 3.31Å; L464-K468 WeakPolarHBondContact O-CG 3.44Å; L464-K468 PolarHBondContact O-N 3.41Å
465	A	87.7	Confident	87.2	Confident	60 Å²	60	37.5 Å²	37.5	50%	0.496	21%	0.211	S	C	.	.	H	α-helix	trans	-62.1	-44.1	176.2	0	0	0	0	0	111.1	D461 H462 K468 A469	D461-A465 WeakPolarHBondContact O-CB 3.29Å; D461-A465 PolarHBondContact O-N 2.72Å; H462-A465 PolarHBondContact O-N 3.1Å; A465-K468 PolarHBondContact O-N 2.95Å; A465-A469 WeakPolarHBondContact O-CB 3.22Å; A465-A469 PolarHBondContact O-N 3.47Å
466	N	87.1	Confident	87.1	Confident	16 Å²	16	39.9 Å²	39.9	9%	0.086	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-43.5	174.1	-178.6	51.9	0	0	0	112.1	H462 D463 L464 K468 A469 V470 H489	H462-N466 PolarHBondContact O-N 3.33Å; D463-N466 PolarHBondContact O-N 3.27Å; L464-N466 VanDerWaalsContact C-N 3.34Å; N466-K468 PolarHBondContact O-N 2.85Å; N466-A469 WeakPolarHBondContact O-CB 3.38Å; N466-A469 PolarHBondContact O-N 3.44Å; N466-A469 VanDerWaalsContact O-N 3.13Å; N466-V470 WeakPolarHBondContact O-CG2 3.44Å; N466-V470 PolarHBondContact O-N 2.79Å; N466-H489 VanDerWaalsContact CG-CD2 3.46Å; N466-H489 VanDerWaalsContact CG-CE1 3.47Å; N466-H489 VanDerWaalsContact CG-ND1 3.3Å; N466-H489 WeakPolarHBondContact ND2-CB 3.43Å; N466-H489 VanDerWaalsContact ND2-CG 3.26Å; N466-H489 PolarHBondContact OD1-CE1 2.94Å; N466-H489 PolarHBondContact OD1-ND1 3.29Å
467	F	87.4	Confident	86.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.8	-48.8	176	-173.7	-85.9	0	0	0	111.1	V397 F398 L459 D463 L464 A469 V470 F471 F546 I549 V550 I553	V397-F467 HydrophobicContact CG1-CD1 4.28Å; V397-F467 HydrophobicContact CG1-CE1 3.48Å; V397-F467 VanDerWaalsContact CG1-CE1 3.48Å; V397-F467 HydrophobicContact CG1-CZ 4.01Å; F398-F467 HydrophobicContact CD1-CD1 4.44Å; F398-F467 HydrophobicContact CD1-CE1 4.42Å; F398-F467 AromaticContact CE1-CD1 3.71Å; F398-F467 HydrophobicContact CE1-CD1 3.71Å; F398-F467 AromaticContact CE1-CE1 3.52Å; F398-F467 HydrophobicContact CE1-CE1 3.52Å; F398-F467 HydrophobicContact CZ-CD1 4.41Å; F398-F467 AromaticContact CZ-CE1 3.77Å; F398-F467 HydrophobicContact CZ-CE1 3.77Å; L459-F467 HydrophobicContact CD1-CB 3.84Å; L459-F467 HydrophobicContact CD1-CD2 3.99Å; L459-F467 HydrophobicContact CD1-CG 3.95Å; D463-F467 WeakPolarHBondContact O-CB 3.49Å; D463-F467 PolarHBondContact O-N 2.81Å; L464-F467 WeakPolarHBondContact O-CB 3.47Å; L464-F467 PolarHBondContact O-N 2.88Å; F467-A469 VanDerWaalsContact C-N 3.33Å; F467-A469 PolarHBondContact O-N 2.87Å; F467-V470 PolarHBondContact O-N 2.99Å; F467-F471 AromaticContact CD1-CD2 3.85Å; F467-F471 HydrophobicContact CD1-CD2 3.85Å; F467-F471 HydrophobicContact CD1-CE2 4.08Å; F467-F471 HydrophobicContact CD2-CE2 4.25Å; F467-F471 AromaticContact CE1-CD2 3.51Å; F467-F471 HydrophobicContact CE1-CD2 3.51Å; F467-F471 AromaticContact CE1-CE2 3.37Å; F467-F471 HydrophobicContact CE1-CE2 3.37Å; F467-F471 HydrophobicContact CE1-CG 4.28Å; F467-F471 HydrophobicContact CE1-CZ 4.02Å; F467-F471 HydrophobicContact CE2-CD2 4.23Å; F467-F471 AromaticContact CE2-CE2 3.56Å; F467-F471 HydrophobicContact CE2-CE2 3.56Å; F467-F471 HydrophobicContact CE2-CZ 4.37Å; F467-F471 HydrophobicContact CG-CD2 4.34Å; F467-F471 HydrophobicContact CG-CE2 4.47Å; F467-F471 AromaticContact CZ-CD2 3.71Å; F467-F471 HydrophobicContact CZ-CD2 3.71Å; F467-F471 AromaticContact CZ-CE2 3.05Å; F467-F471 HydrophobicContact CZ-CE2 3.05Å; F467-F471 AromaticContact CZ-CZ 3.61Å; F467-F471 HydrophobicContact CZ-CZ 3.61Å; F467-F471 WeakPolarHBondContact O-CD2 3.49Å; F467-F471 PolarHBondContact O-N 3.34Å; F467-F546 HydrophobicContact CB-CE2 4.32Å; F467-F546 AromaticContact CD2-CD2 3.43Å; F467-F546 HydrophobicContact CD2-CD2 3.43Å; F467-F546 VanDerWaalsContact CD2-CD2 3.43Å; F467-F546 AromaticContact CD2-CE2 3.19Å; F467-F546 HydrophobicContact CD2-CE2 3.19Å; F467-F546 HydrophobicContact CD2-CG 4.34Å; F467-F546 AromaticContact CD2-CZ 3.96Å; F467-F546 HydrophobicContact CD2-CZ 3.96Å; F467-F546 HydrophobicContact CE2-CD2 4.06Å; F467-F546 AromaticContact CE2-CE2 3.78Å; F467-F546 HydrophobicContact CE2-CE2 3.78Å; F467-F546 HydrophobicContact CE2-CZ 4.11Å; F467-F546 HydrophobicContact CG-CD2 4.48Å; F467-F546 HydrophobicContact CG-CE2 4.13Å; F467-I549 HydrophobicContact CE1-CG2 4.49Å; F467-I549 HydrophobicContact CE2-CG2 3.94Å; F467-I549 HydrophobicContact CZ-CG2 3.71Å; F467-V550 HydrophobicContact CE2-CG2 4.02Å; F467-I553 HydrophobicContact CZ-CD1 3.89Å
468	K	88.5	Confident	86.8	Confident	61 Å²	61	51 Å²	51	27%	0.265	27%	0.266	S	S	.	.	H	α-helix	trans	-59.4	-42.3	174.6	-75	177.9	177.9	-176	0	111.7	F398 L464 A465 N466 F471 T472 L577	F398-K468 HydrophobicContact CD1-CG 3.96Å; F398-K468 HydrophobicContact CE1-CG 4.37Å; F398-K468 WeakPolarHBondContact O-CE 3.32Å; F398-K468 PolarHBondContact O-NZ 2.9Å; L464-K468 HydrophobicContact CG-CD 4.43Å; L464-K468 WeakPolarHBondContact O-CB 3.31Å; L464-K468 WeakPolarHBondContact O-CG 3.44Å; L464-K468 PolarHBondContact O-N 3.41Å; A465-K468 PolarHBondContact O-N 2.95Å; N466-K468 PolarHBondContact O-N 2.85Å; K468-F471 PolarHBondContact O-N 3.38Å; K468-T472 VanDerWaalsContact O-CB 3.26Å; K468-T472 WeakPolarHBondContact O-CB 3.32Å; K468-T472 PolarHBondContact O-N 2.87Å; K468-T472 PolarHBondContact O-OG1 2.72Å; K468-L577 HydrophobicContact CG-CD2 4.48Å
469	A	88.8	Confident	86.7	Confident	36 Å²	36	46 Å²	46	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-63.7	-41	177.7	0	0	0	0	0	112.3	A465 N466 F467 T472 A473 L485	A465-A469 WeakPolarHBondContact O-CB 3.22Å; A465-A469 PolarHBondContact O-N 3.47Å; N466-A469 WeakPolarHBondContact O-CB 3.38Å; N466-A469 PolarHBondContact O-N 3.44Å; N466-A469 VanDerWaalsContact O-N 3.13Å; F467-A469 VanDerWaalsContact C-N 3.33Å; F467-A469 PolarHBondContact O-N 2.87Å; A469-T472 PolarHBondContact O-N 2.86Å; A469-A473 WeakPolarHBondContact O-CB 3.28Å; A469-A473 PolarHBondContact O-N 2.87Å; A469-L485 HydrophobicContact CB-CD1 3.77Å; A469-L485 HydrophobicContact CB-CD2 4.08Å
470	V	87.6	Confident	86.8	Confident	10 Å²	10	49.9 Å²	49.9	6%	0.061	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-51.2	176.1	169.4	0	0	0	0	110.4	N466 F467 T472 A473 V474 V482 L485 I486	N466-V470 WeakPolarHBondContact O-CG2 3.44Å; N466-V470 PolarHBondContact O-N 2.79Å; F467-V470 PolarHBondContact O-N 2.99Å; V470-T472 VanDerWaalsContact C-N 3.31Å; V470-T472 PolarHBondContact O-N 3.49Å; V470-A473 PolarHBondContact O-N 3.47Å; V470-A473 VanDerWaalsContact O-N 3.15Å; V470-V474 WeakPolarHBondContact O-CG2 3.34Å; V470-V474 PolarHBondContact O-N 3.4Å; V470-V482 HydrophobicContact CG1-CG1 4.26Å; V470-L485 HydrophobicContact CG2-CB 3.66Å; V470-L485 HydrophobicContact CG2-CD1 4.07Å; V470-I486 HydrophobicContact CG2-CG1 4.34Å
471	F	85.9	Confident	86.9	Confident	14 Å²	14	53.1 Å²	53.1	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-39	178.1	-88.8	-101.4	0	0	0	112.2	F398 F467 K468 V474 V475 I553 L570 L577	F398-F471 HydrophobicContact CE1-CB 4.38Å; F398-F471 HydrophobicContact CE1-CG 4.31Å; F398-F471 HydrophobicContact CZ-CB 4.31Å; F398-F471 AromaticContact CZ-CD1 3.87Å; F398-F471 HydrophobicContact CZ-CD1 3.87Å; F398-F471 HydrophobicContact CZ-CD2 4.48Å; F398-F471 HydrophobicContact CZ-CE1 4.3Å; F398-F471 AromaticContact CZ-CG 3.95Å; F398-F471 HydrophobicContact CZ-CG 3.95Å; F467-F471 AromaticContact CD1-CD2 3.85Å; F467-F471 HydrophobicContact CD1-CD2 3.85Å; F467-F471 HydrophobicContact CD1-CE2 4.08Å; F467-F471 HydrophobicContact CD2-CE2 4.25Å; F467-F471 AromaticContact CE1-CD2 3.51Å; F467-F471 HydrophobicContact CE1-CD2 3.51Å; F467-F471 AromaticContact CE1-CE2 3.37Å; F467-F471 HydrophobicContact CE1-CE2 3.37Å; F467-F471 HydrophobicContact CE1-CG 4.28Å; F467-F471 HydrophobicContact CE1-CZ 4.02Å; F467-F471 HydrophobicContact CE2-CD2 4.23Å; F467-F471 AromaticContact CE2-CE2 3.56Å; F467-F471 HydrophobicContact CE2-CE2 3.56Å; F467-F471 HydrophobicContact CE2-CZ 4.37Å; F467-F471 HydrophobicContact CG-CD2 4.34Å; F467-F471 HydrophobicContact CG-CE2 4.47Å; F467-F471 AromaticContact CZ-CD2 3.71Å; F467-F471 HydrophobicContact CZ-CD2 3.71Å; F467-F471 AromaticContact CZ-CE2 3.05Å; F467-F471 HydrophobicContact CZ-CE2 3.05Å; F467-F471 AromaticContact CZ-CZ 3.61Å; F467-F471 HydrophobicContact CZ-CZ 3.61Å; F467-F471 WeakPolarHBondContact O-CD2 3.49Å; F467-F471 PolarHBondContact O-N 3.34Å; K468-F471 PolarHBondContact O-N 3.38Å; F471-V474 PolarHBondContact O-N 3.46Å; F471-V475 WeakPolarHBondContact O-CG2 3.48Å; F471-V475 PolarHBondContact O-N 3.09Å; F471-I553 HydrophobicContact CE1-CD1 4.37Å; F471-I553 HydrophobicContact CZ-CD1 3.87Å; F471-L570 HydrophobicContact CD1-CD2 4.23Å; F471-L577 HydrophobicContact CB-CD1 3.91Å; F471-L577 HydrophobicContact CB-CD2 4.09Å
472	T	87.6	Confident	87.1	Confident	20 Å²	20	46.7 Å²	46.7	12%	0.123	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-42.2	174.4	-57.2	0	0	0	0	111.3	K468 A469 V470 V474 V475 L476 L578	K468-T472 VanDerWaalsContact O-CB 3.26Å; K468-T472 WeakPolarHBondContact O-CB 3.32Å; K468-T472 PolarHBondContact O-N 2.87Å; K468-T472 PolarHBondContact O-OG1 2.72Å; A469-T472 PolarHBondContact O-N 2.86Å; V470-T472 VanDerWaalsContact C-N 3.31Å; V470-T472 PolarHBondContact O-N 3.49Å; T472-V474 VanDerWaalsContact C-N 3.33Å; T472-V474 PolarHBondContact O-N 2.74Å; T472-V475 PolarHBondContact O-N 3Å; T472-L476 HydrophobicContact CG2-CD1 3.84Å; T472-L476 HydrophobicContact CG2-CG 4.24Å; T472-L476 WeakPolarHBondContact O-CB 3.42Å; T472-L476 VanDerWaalsContact O-CG 3.27Å; T472-L476 WeakPolarHBondContact O-CG 3.09Å; T472-L476 PolarHBondContact O-N 2.93Å; T472-L578 HydrophobicContact CG2-CD2 4.14Å
473	A	88.4	Confident	87.3	Confident	5 Å²	5	41.2 Å²	41.2	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-35.4	176.9	0	0	0	0	0	112.4	A469 V470 L476 R477 K478 R481 V482 L485	A469-A473 WeakPolarHBondContact O-CB 3.28Å; A469-A473 PolarHBondContact O-N 2.87Å; V470-A473 PolarHBondContact O-N 3.47Å; V470-A473 VanDerWaalsContact O-N 3.15Å; A473-L476 PolarHBondContact O-N 2.88Å; A473-R477 PolarHBondContact O-N 3.07Å; A473-R477 VanDerWaalsContact O-N 3.17Å; A473-K478 HydrophobicContact CB-CB 4.4Å; A473-K478 PolarHBondContact O-N 3.4Å; A473-R481 HydrophobicContact CB-CB 4.21Å; A473-R481 HydrophobicContact CB-CG 4.15Å; A473-V482 HydrophobicContact CB-CG2 3.64Å; A473-L485 HydrophobicContact CB-CD1 4.27Å
474	V	84.9	Confident	87.5	Confident	16 Å²	16	43.1 Å²	43.1	10%	0.097	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-49.4	171.5	172.8	0	0	0	0	110.6	V470 F471 T472 L476 R477 V482 L527 L570	V470-V474 WeakPolarHBondContact O-CG2 3.34Å; V470-V474 PolarHBondContact O-N 3.4Å; F471-V474 PolarHBondContact O-N 3.46Å; T472-V474 VanDerWaalsContact C-N 3.33Å; T472-V474 PolarHBondContact O-N 2.74Å; V474-L476 VanDerWaalsContact C-N 3.3Å; V474-L476 PolarHBondContact O-N 3.39Å; V474-R477 PolarHBondContact O-N 3.4Å; V474-R477 VanDerWaalsContact O-N 3.11Å; V474-V482 HydrophobicContact CG2-CG2 3.73Å; V474-L527 HydrophobicContact CG1-CD2 3.77Å; V474-L570 HydrophobicContact CG1-CD1 4.17Å
475	V	81.6	Confident	87.5	Confident	27 Å²	27	43 Å²	43	16%	0.164	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-38.8	178.2	169.6	0	0	0	0	111.9	F471 T472 R477 L570 K574 L577	F471-V475 WeakPolarHBondContact O-CG2 3.48Å; F471-V475 PolarHBondContact O-N 3.09Å; T472-V475 PolarHBondContact O-N 3Å; V475-R477 VanDerWaalsContact C-N 3.27Å; V475-R477 PolarHBondContact O-N 3.08Å; V475-L570 HydrophobicContact CG2-CD2 4.25Å; V475-K574 HydrophobicContact CG1-CG 3.77Å; V475-L577 HydrophobicContact CG2-CD1 4.04Å
476	L	84.8	Confident	87.5	Confident	81 Å²	81	40.5 Å²	40.5	42%	0.424	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5.1	178.9	-65.3	179.7	0	0	0	114.1	T472 A473 V474 K478 L578	T472-L476 HydrophobicContact CG2-CD1 3.84Å; T472-L476 HydrophobicContact CG2-CG 4.24Å; T472-L476 WeakPolarHBondContact O-CB 3.42Å; T472-L476 VanDerWaalsContact O-CG 3.27Å; T472-L476 WeakPolarHBondContact O-CG 3.09Å; T472-L476 PolarHBondContact O-N 2.93Å; A473-L476 PolarHBondContact O-N 2.88Å; V474-L476 VanDerWaalsContact C-N 3.3Å; V474-L476 PolarHBondContact O-N 3.39Å; L476-K478 VanDerWaalsContact C-N 3.32Å; L476-K478 HydrophobicContact CB-CD 4.3Å; L476-K478 HydrophobicContact CB-CG 4.24Å; L476-K478 PolarHBondContact O-N 2.82Å; L476-L578 HydrophobicContact CD2-CD2 4.47Å
477	R	83.8	Confident	87.4	Confident	138 Å²	138	40.8 Å²	40.8	52%	0.521	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	40	179.9	-47.7	-179.1	-175.7	-163.4	-10.3	113.4	A473 V474 V475 V513	A473-R477 PolarHBondContact O-N 3.07Å; A473-R477 VanDerWaalsContact O-N 3.17Å; V474-R477 PolarHBondContact O-N 3.4Å; V474-R477 VanDerWaalsContact O-N 3.11Å; V475-R477 VanDerWaalsContact C-N 3.27Å; V475-R477 PolarHBondContact O-N 3.08Å; R477-V513 HydrophobicContact CG-CB 4.44Å; R477-V513 HydrophobicContact CG-CG1 4Å; R477-V513 HydrophobicContact CG-CG2 4.29Å
478	K	87.6	Confident	87.1	Confident	117 Å²	117	48 Å²	48	51%	0.509	23%	0.229	S	C	.	.			trans	-109.3	69.2	179.5	-64.1	-178	179.8	178.5	0	110.1	A473 L476 D480 R481 V482	A473-K478 HydrophobicContact CB-CB 4.4Å; A473-K478 PolarHBondContact O-N 3.4Å; L476-K478 VanDerWaalsContact C-N 3.32Å; L476-K478 HydrophobicContact CB-CD 4.3Å; L476-K478 HydrophobicContact CB-CG 4.24Å; L476-K478 PolarHBondContact O-N 2.82Å; K478-D480 VanDerWaalsContact C-N 3.33Å; K478-D480 PolarHBondContact O-N 3.31Å; K478-R481 HydrophobicContact CB-CB 3.78Å; K478-R481 WeakPolarHBondContact O-CA 3.07Å; K478-R481 WeakPolarHBondContact O-CB 3.37Å; K478-R481 PolarHBondContact O-N 2.83Å; K478-V482 PolarHBondContact O-N 2.91Å
479	G	87.4	Confident	86.6	Confident	3 Å²	3	47.5 Å²	47.5	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-31.7	-175.5	0	0	0	0	0	114.4	R481 V482 A483 M505	G479-R481 VanDerWaalsContact C-N 3.27Å; G479-R481 PolarHBondContact O-N 3.36Å; G479-V482 WeakPolarHBondContact O-CB 3.35Å; G479-V482 PolarHBondContact O-N 2.95Å; G479-A483 PolarHBondContact O-N 3.16Å; G479-A483 VanDerWaalsContact O-N 3.07Å; G479-M505 WeakPolarHBondContact O-CG 3.44Å
480	D	88.9	Confident	85.7	Confident	87 Å²	87	46.6 Å²	46.6	47%	0.465	22%	0.22	S	C	.	.	H	α-helix	trans	-59	-41	169.3	-71.6	-45.8	0	0	0	111.9	K478 V482 A483 E484	K478-D480 VanDerWaalsContact C-N 3.33Å; K478-D480 PolarHBondContact O-N 3.31Å; D480-V482 VanDerWaalsContact C-N 3.35Å; D480-A483 PolarHBondContact O-N 2.94Å; D480-E484 WeakPolarHBondContact O-CG 3.43Å; D480-E484 PolarHBondContact O-N 3.24Å
481	R	91	Very high	84.4	Confident	124 Å²	124	54.8 Å²	54.8	47%	0.468	25%	0.25	S	C	.	.	H	α-helix	trans	-68.7	-35.9	178.7	-172.7	57.9	176.8	171.1	1.7	111.6	A473 K478 G479 A483 E484 L485	A473-R481 HydrophobicContact CB-CB 4.21Å; A473-R481 HydrophobicContact CB-CG 4.15Å; K478-R481 HydrophobicContact CB-CB 3.78Å; K478-R481 WeakPolarHBondContact O-CA 3.07Å; K478-R481 WeakPolarHBondContact O-CB 3.37Å; K478-R481 PolarHBondContact O-N 2.83Å; G479-R481 VanDerWaalsContact C-N 3.27Å; G479-R481 PolarHBondContact O-N 3.36Å; R481-A483 VanDerWaalsContact C-N 3.34Å; R481-E484 IonicContact CZ-OE2 2.68Å; R481-E484 IonicContact NH1-OE2 2.79Å; R481-E484 PolarHBondContact NH1-OE2 2.69Å; R481-E484 PolarHBondContact O-N 3.47Å; R481-L485 HydrophobicContact CG-CD1 4.11Å; R481-L485 HydrophobicContact CG-CG 4.42Å; R481-L485 WeakPolarHBondContact O-CB 3.42Å; R481-L485 VanDerWaalsContact O-CG 3.27Å; R481-L485 WeakPolarHBondContact O-CG 3.3Å; R481-L485 PolarHBondContact O-N 3.02Å
482	V	90.5	Very high	83.2	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-58.3	-48.7	172.3	172.7	0	0	0	0	110.2	V470 A473 V474 K478 G479 D480 E484 L485 I486 M505 V509	V470-V482 HydrophobicContact CG1-CG1 4.26Å; A473-V482 HydrophobicContact CB-CG2 3.64Å; V474-V482 HydrophobicContact CG2-CG2 3.73Å; K478-V482 PolarHBondContact O-N 2.91Å; G479-V482 WeakPolarHBondContact O-CB 3.35Å; G479-V482 PolarHBondContact O-N 2.95Å; D480-V482 VanDerWaalsContact C-N 3.35Å; V482-E484 VanDerWaalsContact C-N 3.34Å; V482-E484 PolarHBondContact O-N 3.49Å; V482-L485 PolarHBondContact O-N 2.98Å; V482-I486 HydrophobicContact CG1-CD1 3.75Å; V482-I486 WeakPolarHBondContact O-CG1 3.43Å; V482-I486 PolarHBondContact O-N 3.31Å; V482-M505 HydrophobicContact CB-CG 4.17Å; V482-M505 HydrophobicContact CG1-CG 3.96Å; V482-M505 HydrophobicContact CG1-SD 4.01Å; V482-V509 HydrophobicContact CG2-CG2 4.47Å
483	A	90.1	Very high	82.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-42.9	177.9	0	0	0	0	0	112.5	G479 D480 R481 I486 L487 F501 K502 M505	G479-A483 PolarHBondContact O-N 3.16Å; G479-A483 VanDerWaalsContact O-N 3.07Å; D480-A483 PolarHBondContact O-N 2.94Å; R481-A483 VanDerWaalsContact C-N 3.34Å; A483-I486 PolarHBondContact O-N 3.02Å; A483-L487 WeakPolarHBondContact O-CB 3.4Å; A483-L487 VanDerWaalsContact O-CG 3.23Å; A483-L487 WeakPolarHBondContact O-CG 3.49Å; A483-L487 PolarHBondContact O-N 3.1Å; A483-F501 HydrophobicContact CB-CD1 3.89Å; A483-F501 HydrophobicContact CB-CE1 3.61Å; A483-F501 HydrophobicContact CB-CZ 4.49Å; A483-K502 HydrophobicContact CB-CB 4.21Å; A483-K502 HydrophobicContact CB-CG 3.78Å; A483-M505 HydrophobicContact CB-CB 3.81Å; A483-M505 HydrophobicContact CB-CG 3.97Å
484	E	89.6	Confident	81.2	Confident	68 Å²	68	63.4 Å²	63.4	32%	0.318	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-48.1	176.2	-74.6	178.2	174.7	0	0	113.2	D480 R481 V482 I486 L487 H488 K502	D480-E484 WeakPolarHBondContact O-CG 3.43Å; D480-E484 PolarHBondContact O-N 3.24Å; R481-E484 IonicContact CZ-OE2 2.68Å; R481-E484 IonicContact NH1-OE2 2.79Å; R481-E484 PolarHBondContact NH1-OE2 2.69Å; R481-E484 PolarHBondContact O-N 3.47Å; V482-E484 VanDerWaalsContact C-N 3.34Å; V482-E484 PolarHBondContact O-N 3.49Å; E484-I486 VanDerWaalsContact C-N 3.32Å; E484-I486 PolarHBondContact O-N 3.19Å; E484-L487 PolarHBondContact O-N 3.28Å; E484-H488 WeakPolarHBondContact O-CB 3.46Å; E484-H488 PolarHBondContact O-N 3.04Å; E484-K502 HydrophobicContact CG-CD 4.42Å; E484-K502 VanDerWaalsContact CG-CE 3.48Å; E484-K502 VanDerWaalsContact CG-NZ 3.27Å; E484-K502 IonicContact OE1-NZ 2.84Å; E484-K502 PolarHBondContact OE1-NZ 2.6Å
485	L	89	Confident	80.8	Confident	17 Å²	17	63.4 Å²	63.4	9%	0.089	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-42.2	-179.2	-72.6	168.8	0	0	0	111.2	A469 V470 A473 R481 V482 H489	A469-L485 HydrophobicContact CB-CD1 3.77Å; A469-L485 HydrophobicContact CB-CD2 4.08Å; V470-L485 HydrophobicContact CG2-CB 3.66Å; V470-L485 HydrophobicContact CG2-CD1 4.07Å; A473-L485 HydrophobicContact CB-CD1 4.27Å; R481-L485 HydrophobicContact CG-CD1 4.11Å; R481-L485 HydrophobicContact CG-CG 4.42Å; R481-L485 WeakPolarHBondContact O-CB 3.42Å; R481-L485 VanDerWaalsContact O-CG 3.27Å; R481-L485 WeakPolarHBondContact O-CG 3.3Å; R481-L485 PolarHBondContact O-N 3.02Å; V482-L485 PolarHBondContact O-N 2.98Å; L485-H489 PolarHBondContact O-N 3.27Å; L485-H489 PolarHBondContact O-ND1 2.93Å
486	I	86.3	Confident	80.7	Confident	9 Å²	9	72.1 Å²	72.1	5%	0.046	33%	0.333	C	S	.	.	H	α-helix	trans	-66.5	-45.2	177.3	-64.9	169.9	0	0	0	111.2	V470 V482 A483 E484 H488 H489 A490 M505 V531 L535 V540	V470-I486 HydrophobicContact CG2-CG1 4.34Å; V482-I486 HydrophobicContact CG1-CD1 3.75Å; V482-I486 WeakPolarHBondContact O-CG1 3.43Å; V482-I486 PolarHBondContact O-N 3.31Å; A483-I486 PolarHBondContact O-N 3.02Å; E484-I486 VanDerWaalsContact C-N 3.32Å; E484-I486 PolarHBondContact O-N 3.19Å; I486-H488 PolarHBondContact O-N 2.87Å; I486-H489 PolarHBondContact O-N 2.92Å; I486-A490 WeakPolarHBondContact O-CB 3.22Å; I486-A490 PolarHBondContact O-N 3.14Å; I486-M505 HydrophobicContact CD1-CE 4.23Å; I486-V531 HydrophobicContact CD1-CG1 4.4Å; I486-L535 HydrophobicContact CD1-CD2 4.49Å; I486-L535 HydrophobicContact CG2-CD2 3.65Å; I486-V540 HydrophobicContact CG2-CG1 3.84Å
487	L	84.9	Confident	80.8	Confident	21 Å²	21	71.9 Å²	71.9	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-38.4	-179.6	-73.1	169.1	0	0	0	112.7	A483 E484 H489 N493 C495 V498 F501 V540	A483-L487 WeakPolarHBondContact O-CB 3.4Å; A483-L487 VanDerWaalsContact O-CG 3.23Å; A483-L487 WeakPolarHBondContact O-CG 3.49Å; A483-L487 PolarHBondContact O-N 3.1Å; E484-L487 PolarHBondContact O-N 3.28Å; L487-H489 VanDerWaalsContact C-N 3.28Å; L487-H489 PolarHBondContact O-N 3.41Å; L487-N493 WeakPolarHBondContact CD2-ND2 3.23Å; L487-C495 HydrophobicContact CD2-CB 4.14Å; L487-V498 HydrophobicContact CD1-CB 4.47Å; L487-V498 HydrophobicContact CD1-CG1 3.61Å; L487-V498 HydrophobicContact CD1-CG2 4.4Å; L487-F501 HydrophobicContact CD1-CD1 3.72Å; L487-F501 HydrophobicContact CD1-CE1 4.01Å; L487-F501 HydrophobicContact CD2-CD1 4Å; L487-F501 HydrophobicContact CD2-CE1 4.03Å; L487-F501 HydrophobicContact CG-CD1 3.88Å; L487-F501 HydrophobicContact CG-CE1 3.73Å; L487-V540 HydrophobicContact CD2-CG1 4.44Å; L487-V540 HydrophobicContact CD2-CG2 3.92Å
488	H	82.8	Confident	81.1	Confident	152 Å²	152	67.9 Å²	67.9	70%	0.704	32%	0.324	S	S	*	.	H	α-helix	trans	-68.3	-28.5	-179.7	-171.8	-86.4	0	0	0	112.6	E484 I486	E484-H488 WeakPolarHBondContact O-CB 3.46Å; E484-H488 PolarHBondContact O-N 3.04Å; I486-H488 PolarHBondContact O-N 2.87Å
489	H	76.4	Confident	81.2	Confident	51 Å²	51	67.8 Å²	67.8	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-105.3	-1.1	-175.8	-66	81.3	0	0	0	113.7	H462 N466 L485 I486 L487 R491	H462-H489 AromaticContact CE1-CD2 3.19Å; H462-H489 PolarHBondContact CE1-CD2 3.37Å; H462-H489 AromaticContact CE1-NE2 3.39Å; H462-H489 PolarHBondContact CE1-NE2 3.4Å; H462-H489 AromaticContact ND1-CD2 3.89Å; H462-H489 AromaticContact NE2-CD2 3.89Å; H462-H489 AromaticContact NE2-NE2 3.6Å; N466-H489 VanDerWaalsContact CG-CD2 3.46Å; N466-H489 VanDerWaalsContact CG-CE1 3.47Å; N466-H489 VanDerWaalsContact CG-ND1 3.3Å; N466-H489 WeakPolarHBondContact ND2-CB 3.43Å; N466-H489 VanDerWaalsContact ND2-CG 3.26Å; N466-H489 PolarHBondContact OD1-CE1 2.94Å; N466-H489 PolarHBondContact OD1-ND1 3.29Å; L485-H489 PolarHBondContact O-N 3.27Å; L485-H489 PolarHBondContact O-ND1 2.93Å; I486-H489 PolarHBondContact O-N 2.92Å; L487-H489 VanDerWaalsContact C-N 3.28Å; L487-H489 PolarHBondContact O-N 3.41Å; H489-R491 PolarHBondContact O-N 2.95Å
490	A	71.3	Confident	81.4	Confident	17 Å²	17	70.8 Å²	70.8	14%	0.14	35%	0.348	C	S	.	.			trans	-69.4	115.9	174.2	0	0	0	0	0	110.3	I486 A492 N493 V540 K541	I486-A490 WeakPolarHBondContact O-CB 3.22Å; I486-A490 PolarHBondContact O-N 3.14Å; A490-A492 PolarHBondContact O-N 2.86Å; A490-A492 VanDerWaalsContact O-N 3.15Å; A490-N493 HydrophobicContact CB-CB 4.41Å; A490-V540 HydrophobicContact CB-CG1 3.86Å; A490-K541 WeakPolarHBondContact CA-O 3.47Å; A490-K541 WeakPolarHBondContact CB-O 3.45Å
491	R	60.4	Low	81.5	Confident	182 Å²	182	66.7 Å²	66.7	69%	0.687	33%	0.325	S	S	*	.	S	Bend	trans	-56.4	-30.7	178.7	-71.8	-171.9	-178.3	-163.8	2.2	113.5	H489 E543	H489-R491 PolarHBondContact O-N 2.95Å; R491-E543 IonicContact CZ-OE1 3.73Å; R491-E543 IonicContact NE-OE1 2.7Å; R491-E543 IonicContact NH2-OE1 3.85Å; R491-E543 PolarHBondContact NH2-OE1 3.08Å
492	A	60.9	Low	81.5	Confident	42 Å²	42	63.5 Å²	63.5	35%	0.347	32%	0.315	S	S	.	.	S	Bend	trans	-138.4	105.5	175.5	0	0	0	0	0	108.5	A490 K541	A490-A492 PolarHBondContact O-N 2.86Å; A490-A492 VanDerWaalsContact O-N 3.15Å; A492-K541 HydrophobicContact CB-CB 4.44Å; A492-K541 HydrophobicContact CB-CD 4.22Å; A492-K541 WeakPolarHBondContact O-CB 3.33Å; A492-K541 PolarHBondContact O-N 3.14Å
493	N	64.4	Low	81.7	Confident	71 Å²	71	69.3 Å²	69.3	38%	0.38	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-101	101.7	176.9	-170.1	9.9	0	0	0	109.5	L487 A490 C495	L487-N493 WeakPolarHBondContact CD2-ND2 3.23Å; A490-N493 HydrophobicContact CB-CB 4.41Å; N493-C495 VanDerWaalsContact C-N 3.32Å; N493-C495 WeakPolarHBondContact OD1-CB 3.43Å; N493-C495 PolarHBondContact OD1-N 3.37Å
494	E	67.7	Low	81.8	Confident	107 Å²	107	71 Å²	71	50%	0.5	35%	0.348	S	S	.	.			trans	-95.2	12.7	169.7	-66.1	-169.9	179	0	0	112	K496 K539	E494-K496 PolarHBondContact O-N 3.46Å; E494-K496 VanDerWaalsContact O-N 3.08Å; E494-K539 HydrophobicContact CB-CB 4.11Å
495	C	77.1	Confident	81.9	Confident	16 Å²	16	67.8 Å²	67.8	11%	0.108	33%	0.333	C	S	.	.			trans	-63.3	114	179.8	-173.7	0	0	0	0	110	L487 N493 H538 V540	L487-C495 HydrophobicContact CD2-CB 4.14Å; N493-C495 VanDerWaalsContact C-N 3.32Å; N493-C495 WeakPolarHBondContact OD1-CB 3.43Å; N493-C495 PolarHBondContact OD1-N 3.37Å; C495-H538 WeakPolarHBondContact CA-O 3.36Å; C495-V540 HydrophobicContact CB-CG2 3.93Å
496	K	80.1	Confident	82	Confident	209 Å²	209	67.7 Å²	67.7	91%	0.909	33%	0.334	S	S	*	.	S	Bend	trans	-81.6	-30.3	179.1	-64	-173	177.6	-173.7	0	112.6	E494	E494-K496 PolarHBondContact O-N 3.46Å; E494-K496 VanDerWaalsContact O-N 3.08Å
497	D	87.3	Confident	82.3	Confident	76 Å²	76	71.3 Å²	71.3	41%	0.406	35%	0.351	S	S	.	.			trans	-124.2	79.2	-175.6	-166.1	-16.5	0	0	0	110.9	V499 L500 F501	D497-V499 VanDerWaalsContact C-N 3.25Å; D497-V499 PolarHBondContact O-N 3.49Å; D497-V499 PolarHBondContact OD1-N 3.47Å; D497-L500 HydrophobicContact CB-CB 4.12Å; D497-L500 PolarHBondContact O-N 2.96Å; D497-L500 WeakPolarHBondContact OD1-CB 3.27Å; D497-L500 PolarHBondContact OD1-N 3.13Å; D497-L500 WeakPolarHBondContact OD2-CB 3.46Å; D497-F501 PolarHBondContact O-N 3.45Å
498	V	88.4	Confident	82.4	Confident	55 Å²	55	71.4 Å²	71.4	33%	0.333	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-33.7	-179.9	170.4	0	0	0	0	111.7	L487 F501 K502	L487-V498 HydrophobicContact CD1-CB 4.47Å; L487-V498 HydrophobicContact CD1-CG1 3.61Å; L487-V498 HydrophobicContact CD1-CG2 4.4Å; V498-F501 PolarHBondContact O-N 3.07Å; V498-K502 HydrophobicContact CG1-CD 4.49Å; V498-K502 HydrophobicContact CG1-CG 4.49Å; V498-K502 WeakPolarHBondContact O-CG 3.36Å; V498-K502 PolarHBondContact O-N 3.32Å
499	V	90.9	Very high	82.6	Confident	114 Å²	114	64.2 Å²	64.2	69%	0.691	32%	0.319	S	S	*	.	H	α-helix	trans	-69.9	-46.7	-177.5	-179.4	0	0	0	0	110	D497 F501 K502 K503	D497-V499 VanDerWaalsContact C-N 3.25Å; D497-V499 PolarHBondContact O-N 3.49Å; D497-V499 PolarHBondContact OD1-N 3.47Å; V499-F501 VanDerWaalsContact C-N 3.33Å; V499-F501 PolarHBondContact O-N 3.38Å; V499-K502 PolarHBondContact O-N 3.24Å; V499-K503 PolarHBondContact O-N 3.35Å
500	L	91.3	Very high	83	Confident	67 Å²	67	65.9 Å²	65.9	35%	0.351	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-41.8	175.1	-177.7	61.5	0	0	0	111.5	D497 K502 K503 E504	D497-L500 HydrophobicContact CB-CB 4.12Å; D497-L500 PolarHBondContact O-N 2.96Å; D497-L500 WeakPolarHBondContact OD1-CB 3.27Å; D497-L500 PolarHBondContact OD1-N 3.13Å; D497-L500 WeakPolarHBondContact OD2-CB 3.46Å; L500-K502 PolarHBondContact O-N 2.9Å; L500-K503 PolarHBondContact O-N 3.16Å; L500-E504 HydrophobicContact CD1-CG 4.12Å; L500-E504 HydrophobicContact CG-CG 4.36Å; L500-E504 WeakPolarHBondContact O-CG 3.39Å; L500-E504 PolarHBondContact O-N 3.29Å
501	F	91.1	Very high	83.5	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-45.8	176.6	174.8	-104.6	0	0	0	112.5	A483 L487 D497 V498 V499 K503 E504 M505 L534 L535 H538 V540	A483-F501 HydrophobicContact CB-CD1 3.89Å; A483-F501 HydrophobicContact CB-CE1 3.61Å; A483-F501 HydrophobicContact CB-CZ 4.49Å; L487-F501 HydrophobicContact CD1-CD1 3.72Å; L487-F501 HydrophobicContact CD1-CE1 4.01Å; L487-F501 HydrophobicContact CD2-CD1 4Å; L487-F501 HydrophobicContact CD2-CE1 4.03Å; L487-F501 HydrophobicContact CG-CD1 3.88Å; L487-F501 HydrophobicContact CG-CE1 3.73Å; D497-F501 PolarHBondContact O-N 3.45Å; V498-F501 PolarHBondContact O-N 3.07Å; V499-F501 VanDerWaalsContact C-N 3.33Å; V499-F501 PolarHBondContact O-N 3.38Å; F501-K503 PolarHBondContact O-N 3.35Å; F501-E504 PolarHBondContact O-N 3.29Å; F501-M505 HydrophobicContact CE1-CE 4.41Å; F501-M505 HydrophobicContact CE2-CE 3.68Å; F501-M505 HydrophobicContact CZ-CE 3.5Å; F501-M505 VanDerWaalsContact CZ-CE 3.5Å; F501-M505 WeakPolarHBondContact O-CB 3.47Å; F501-M505 PolarHBondContact O-N 2.95Å; F501-L534 HydrophobicContact CE2-CB 4.3Å; F501-L535 HydrophobicContact CE2-CD2 3.84Å; F501-L535 HydrophobicContact CZ-CD2 3.65Å; F501-H538 HydrophobicContact CD2-CB 3.85Å; F501-H538 AromaticContact CD2-CD2 3.57Å; F501-H538 AromaticContact CD2-CG 3.73Å; F501-H538 HydrophobicContact CG-CB 4.46Å; F501-V540 HydrophobicContact CE2-CG2 4.39Å; F501-V540 HydrophobicContact CZ-CG2 4.42Å
502	K	91.9	Very high	84.1	Confident	57 Å²	57	63 Å²	63	25%	0.248	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-47.9	176.3	-75.3	-173.7	178.8	-163.7	0	111.4	A483 E484 V498 V499 L500 M505 A506	A483-K502 HydrophobicContact CB-CB 4.21Å; A483-K502 HydrophobicContact CB-CG 3.78Å; E484-K502 HydrophobicContact CG-CD 4.42Å; E484-K502 VanDerWaalsContact CG-CE 3.48Å; E484-K502 VanDerWaalsContact CG-NZ 3.27Å; E484-K502 IonicContact OE1-NZ 2.84Å; E484-K502 PolarHBondContact OE1-NZ 2.6Å; V498-K502 HydrophobicContact CG1-CD 4.49Å; V498-K502 HydrophobicContact CG1-CG 4.49Å; V498-K502 WeakPolarHBondContact O-CG 3.36Å; V498-K502 PolarHBondContact O-N 3.32Å; V499-K502 PolarHBondContact O-N 3.24Å; L500-K502 PolarHBondContact O-N 2.9Å; K502-M505 PolarHBondContact O-N 2.81Å; K502-A506 PolarHBondContact O-N 3.48Å
503	K	93.2	Very high	84.4	Confident	125 Å²	125	61.5 Å²	61.5	54%	0.543	31%	0.31	S	S	.	.	H	α-helix	trans	-59.5	-49.5	178.4	-175.4	-178	173	-175.1	0	112.3	V499 L500 F501 M505 A506 E507	V499-K503 PolarHBondContact O-N 3.35Å; L500-K503 PolarHBondContact O-N 3.16Å; F501-K503 PolarHBondContact O-N 3.35Å; K503-M505 VanDerWaalsContact C-N 3.29Å; K503-M505 PolarHBondContact O-N 2.88Å; K503-A506 WeakPolarHBondContact O-CB 3.5Å; K503-A506 PolarHBondContact O-N 3.33Å; K503-E507 WeakPolarHBondContact CE-OE1 3.46Å; K503-E507 IonicContact NZ-OE1 3.57Å; K503-E507 WeakPolarHBondContact O-CG 3.45Å; K503-E507 PolarHBondContact O-N 2.83Å
504	E	92.9	Very high	84.5	Confident	36 Å²	36	60.5 Å²	60.5	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-33.5	179.8	-71.3	-175.7	166.7	0	0	112.1	L500 F501 L508 L534 K537 H538	L500-E504 HydrophobicContact CD1-CG 4.12Å; L500-E504 HydrophobicContact CG-CG 4.36Å; L500-E504 WeakPolarHBondContact O-CG 3.39Å; L500-E504 PolarHBondContact O-N 3.29Å; F501-E504 PolarHBondContact O-N 3.29Å; E504-L508 VanDerWaalsContact O-CB 3.24Å; E504-L508 WeakPolarHBondContact O-CB 3.26Å; E504-L508 PolarHBondContact O-N 2.8Å; E504-L534 HydrophobicContact CB-CD1 4.08Å; E504-L534 HydrophobicContact CB-CD2 4.03Å; E504-L534 WeakPolarHBondContact OE2-CD2 2.91Å; E504-K537 IonicContact OE1-NZ 3.96Å; E504-K537 PolarHBondContact OE1-NZ 3.5Å; E504-K537 IonicContact OE2-NZ 3.71Å; E504-K537 PolarHBondContact OE2-NZ 3.26Å; E504-H538 IonicContact OE2-CD2 3.54Å; E504-H538 IonicContact OE2-CE1 3.67Å; E504-H538 IonicContact OE2-NE2 2.77Å; E504-H538 PolarHBondContact OE2-NE2 3.38Å
505	M	92.3	Very high	84.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.9	-40.9	174.2	-168.9	64.3	68.2	0	0	112.1	G479 V482 A483 I486 F501 K502 K503 L508 V509 V531 L534	G479-M505 WeakPolarHBondContact O-CG 3.44Å; V482-M505 HydrophobicContact CB-CG 4.17Å; V482-M505 HydrophobicContact CG1-CG 3.96Å; V482-M505 HydrophobicContact CG1-SD 4.01Å; A483-M505 HydrophobicContact CB-CB 3.81Å; A483-M505 HydrophobicContact CB-CG 3.97Å; I486-M505 HydrophobicContact CD1-CE 4.23Å; F501-M505 HydrophobicContact CE1-CE 4.41Å; F501-M505 HydrophobicContact CE2-CE 3.68Å; F501-M505 HydrophobicContact CZ-CE 3.5Å; F501-M505 VanDerWaalsContact CZ-CE 3.5Å; F501-M505 WeakPolarHBondContact O-CB 3.47Å; F501-M505 PolarHBondContact O-N 2.95Å; K502-M505 PolarHBondContact O-N 2.81Å; K503-M505 VanDerWaalsContact C-N 3.29Å; K503-M505 PolarHBondContact O-N 2.88Å; M505-L508 PolarHBondContact O-N 2.94Å; M505-V509 WeakPolarHBondContact O-CG2 3.44Å; M505-V509 PolarHBondContact O-N 3.48Å; M505-V531 HydrophobicContact CE-CG1 4.11Å; M505-V531 HydrophobicContact SD-CG1 4.42Å; M505-V531 HydrophobicContact SD-CG2 3.98Å; M505-L534 HydrophobicContact CE-CB 4.47Å; M505-L534 HydrophobicContact CE-CD1 4.12Å; M505-L534 HydrophobicContact SD-CD1 4.34Å
506	A	91.1	Very high	83.1	Confident	14 Å²	14	59.8 Å²	59.8	12%	0.116	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-52.5	174.9	0	0	0	0	0	111.2	K502 K503 L508 V509 D510	K502-A506 PolarHBondContact O-N 3.48Å; K503-A506 WeakPolarHBondContact O-CB 3.5Å; K503-A506 PolarHBondContact O-N 3.33Å; A506-L508 VanDerWaalsContact C-N 3.29Å; A506-L508 PolarHBondContact O-N 3.34Å; A506-V509 PolarHBondContact O-N 3.44Å; A506-D510 WeakPolarHBondContact O-CB 3.44Å; A506-D510 PolarHBondContact O-N 3.46Å
507	E	91.1	Very high	81.7	Confident	86 Å²	86	56.4 Å²	56.4	40%	0.402	30%	0.3	S	S	.	.	H	α-helix	trans	-56.2	-44	176.4	-70.9	173.3	-178.7	0	0	111.6	K503 D510 H511	K503-E507 WeakPolarHBondContact CE-OE1 3.46Å; K503-E507 IonicContact NZ-OE1 3.57Å; K503-E507 WeakPolarHBondContact O-CG 3.45Å; K503-E507 PolarHBondContact O-N 2.83Å; E507-D510 PolarHBondContact O-N 3.26Å; E507-H511 VanDerWaalsContact O-CB 3.31Å; E507-H511 WeakPolarHBondContact O-CB 3.36Å; E507-H511 PolarHBondContact O-CD2 3.2Å; E507-H511 PolarHBondContact O-N 3.03Å
508	L	89	Confident	79.9	Confident	22 Å²	22	57.7 Å²	57.7	12%	0.115	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-45.1	-179.9	179.8	160.3	0	0	0	112.4	E504 M505 A506 H511 A512 L527 K530 V531 L534	E504-L508 VanDerWaalsContact O-CB 3.24Å; E504-L508 WeakPolarHBondContact O-CB 3.26Å; E504-L508 PolarHBondContact O-N 2.8Å; M505-L508 PolarHBondContact O-N 2.94Å; A506-L508 VanDerWaalsContact C-N 3.29Å; A506-L508 PolarHBondContact O-N 3.34Å; L508-H511 PolarHBondContact O-N 3.32Å; L508-A512 WeakPolarHBondContact O-CB 3.23Å; L508-A512 PolarHBondContact O-N 2.94Å; L508-L527 HydrophobicContact CD2-CD1 3.21Å; L508-L527 HydrophobicContact CG-CD1 4.48Å; L508-K530 HydrophobicContact CD1-CB 3.54Å; L508-K530 HydrophobicContact CG-CB 4.22Å; L508-V531 HydrophobicContact CD1-CG2 4.34Å; L508-V531 HydrophobicContact CD2-CG2 3.68Å; L508-L534 HydrophobicContact CB-CD1 4.33Å; L508-L534 HydrophobicContact CD1-CD1 3.52Å; L508-L534 HydrophobicContact CD1-CG 4.02Å
509	V	86.6	Confident	78	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-67.2	-42.2	178.3	173	0	0	0	0	110.5	V482 M505 A506 H511 A512 V513	V482-V509 HydrophobicContact CG2-CG2 4.47Å; M505-V509 WeakPolarHBondContact O-CG2 3.44Å; M505-V509 PolarHBondContact O-N 3.48Å; A506-V509 PolarHBondContact O-N 3.44Å; V509-H511 VanDerWaalsContact C-N 3.34Å; V509-H511 PolarHBondContact O-N 3.32Å; V509-A512 PolarHBondContact O-N 2.96Å; V509-V513 WeakPolarHBondContact O-CG2 3.44Å; V509-V513 PolarHBondContact O-N 2.78Å
510	D	84.6	Confident	76.2	Confident	86 Å²	86	58.5 Å²	58.5	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-39.7	176.8	-72	-18.2	0	0	0	112	A506 E507 V513 S514	A506-D510 WeakPolarHBondContact O-CB 3.44Å; A506-D510 PolarHBondContact O-N 3.46Å; E507-D510 PolarHBondContact O-N 3.26Å; D510-V513 PolarHBondContact O-N 2.96Å; D510-S514 WeakPolarHBondContact O-CB 3.44Å; D510-S514 PolarHBondContact O-N 3.48Å; D510-S514 PolarHBondContact O-OG 3.32Å
511	H	81.4	Confident	74.8	Confident	117 Å²	117	56.7 Å²	56.7	54%	0.542	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-41.8	175	-82.2	-56.8	0	0	0	113	E507 L508 V509 V513 S514 N515	E507-H511 VanDerWaalsContact O-CB 3.31Å; E507-H511 WeakPolarHBondContact O-CB 3.36Å; E507-H511 PolarHBondContact O-CD2 3.2Å; E507-H511 PolarHBondContact O-N 3.03Å; L508-H511 PolarHBondContact O-N 3.32Å; V509-H511 VanDerWaalsContact C-N 3.34Å; V509-H511 PolarHBondContact O-N 3.32Å; H511-V513 PolarHBondContact O-N 3.42Å; H511-S514 VanDerWaalsContact CA-OG 3.32Å; H511-S514 WeakPolarHBondContact CA-OG 3.29Å; H511-S514 PolarHBondContact O-OG 2.88Å; H511-S514 VanDerWaalsContact O-OG 3.14Å; H511-N515 WeakPolarHBondContact O-CB 3.42Å; H511-N515 PolarHBondContact O-N 3.42Å; H511-N515 VanDerWaalsContact O-N 3.17Å; H511-N515 PolarHBondContact O-ND2 3.02Å
512	A	73.3	Confident	73.7	Confident	20 Å²	20	57.5 Å²	57.5	17%	0.165	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-34.9	178.8	0	0	0	0	0	112	L508 V509 T516 L527	L508-A512 WeakPolarHBondContact O-CB 3.23Å; L508-A512 PolarHBondContact O-N 2.94Å; V509-A512 PolarHBondContact O-N 2.96Å; A512-T516 PolarHBondContact O-OG1 2.82Å; A512-L527 HydrophobicContact CB-CB 4.49Å; A512-L527 HydrophobicContact CB-CD1 3.61Å; A512-L527 HydrophobicContact CB-CD2 4.45Å; A512-L527 HydrophobicContact CB-CG 4.4Å
513	V	66.8	Low	72.8	Confident	11 Å²	11	60 Å²	60	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-89.9	-29.8	-176.7	-175.4	0	0	0	0	113	R477 V509 D510 H511 N515 T516 I522	R477-V513 HydrophobicContact CG-CB 4.44Å; R477-V513 HydrophobicContact CG-CG1 4Å; R477-V513 HydrophobicContact CG-CG2 4.29Å; V509-V513 WeakPolarHBondContact O-CG2 3.44Å; V509-V513 PolarHBondContact O-N 2.78Å; D510-V513 PolarHBondContact O-N 2.96Å; H511-V513 PolarHBondContact O-N 3.42Å; V513-N515 VanDerWaalsContact C-N 3.35Å; V513-T516 WeakPolarHBondContact CA-OG1 3.39Å; V513-T516 WeakPolarHBondContact O-CB 3.37Å; V513-T516 PolarHBondContact O-N 3.47Å; V513-T516 PolarHBondContact O-OG1 3.32Å; V513-T516 VanDerWaalsContact O-OG1 3.08Å; V513-I522 HydrophobicContact CG2-CD1 4.02Å
514	S	66.4	Low	72.1	Confident	50 Å²	50	54.2 Å²	54.2	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-67.9	-35	172	50.7	0	0	0	0	112.1	D510 H511 T516 L517	D510-S514 WeakPolarHBondContact O-CB 3.44Å; D510-S514 PolarHBondContact O-N 3.48Å; D510-S514 PolarHBondContact O-OG 3.32Å; H511-S514 VanDerWaalsContact CA-OG 3.32Å; H511-S514 WeakPolarHBondContact CA-OG 3.29Å; H511-S514 PolarHBondContact O-OG 2.88Å; H511-S514 VanDerWaalsContact O-OG 3.14Å; S514-T516 PolarHBondContact O-N 3.37Å; S514-L517 WeakPolarHBondContact O-CB 3.42Å; S514-L517 PolarHBondContact O-N 3.09Å; S514-L517 VanDerWaalsContact O-N 3.08Å
515	N	59.1	Low	71.1	Confident	79 Å²	79	53.6 Å²	53.6	42%	0.422	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-23.1	171.5	-76.5	-22.4	0	0	0	113	H511 V513 L517 S518 L519	H511-N515 WeakPolarHBondContact O-CB 3.42Å; H511-N515 PolarHBondContact O-N 3.42Å; H511-N515 VanDerWaalsContact O-N 3.17Å; H511-N515 PolarHBondContact O-ND2 3.02Å; V513-N515 VanDerWaalsContact C-N 3.35Å; N515-L517 VanDerWaalsContact C-N 3.29Å; N515-L517 PolarHBondContact O-N 2.77Å; N515-S518 PolarHBondContact O-N 2.95Å; N515-L519 WeakPolarHBondContact O-CB 3.35Å; N515-L519 PolarHBondContact O-N 3.21Å
516	T	55.6	Low	70.5	Confident	30 Å²	30	57 Å²	57	18%	0.184	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-32.6	171.4	-39.5	0	0	0	0	112.4	A512 V513 S514 S518 G520 I522	A512-T516 PolarHBondContact O-OG1 2.82Å; V513-T516 WeakPolarHBondContact CA-OG1 3.39Å; V513-T516 WeakPolarHBondContact O-CB 3.37Å; V513-T516 PolarHBondContact O-N 3.47Å; V513-T516 PolarHBondContact O-OG1 3.32Å; V513-T516 VanDerWaalsContact O-OG1 3.08Å; S514-T516 PolarHBondContact O-N 3.37Å; T516-S518 VanDerWaalsContact C-N 3.25Å; T516-S518 PolarHBondContact O-N 2.73Å; T516-G520 WeakPolarHBondContact O-CA 3.31Å; T516-G520 PolarHBondContact O-N 3.22Å; T516-I522 HydrophobicContact CG2-CG1 4.06Å; T516-I522 WeakPolarHBondContact OG1-CG1 3.37Å
517	L	50.8	Low	70.1	Confident	138 Å²	138	56.8 Å²	56.8	72%	0.723	33%	0.325	S	S	*	.	H	α-helix	trans	-71.4	-23.9	177.9	-67.1	165.7	0	0	0	112	S514 N515	S514-L517 WeakPolarHBondContact O-CB 3.42Å; S514-L517 PolarHBondContact O-N 3.09Å; S514-L517 VanDerWaalsContact O-N 3.08Å; N515-L517 VanDerWaalsContact C-N 3.29Å; N515-L517 PolarHBondContact O-N 2.77Å
518	S	49.7	Very low	69.6	Low	103 Å²	103	53.6 Å²	53.6	72%	0.72	31%	0.31	S	S	*	.	H	α-helix	trans	-98	-33	-179.8	-53.7	0	0	0	0	113.9	N515 T516	N515-S518 PolarHBondContact O-N 2.95Å; T516-S518 VanDerWaalsContact C-N 3.25Å; T516-S518 PolarHBondContact O-N 2.73Å
519	L	49.6	Very low	69.1	Low	133 Å²	133	54.5 Å²	54.5	70%	0.696	32%	0.319	S	S	*	.	H	α-helix	trans	-115.4	-5.9	-176.4	-77.6	116.4	0	0	0	114.5	N515 T521	N515-L519 WeakPolarHBondContact O-CB 3.35Å; N515-L519 PolarHBondContact O-N 3.21Å; L519-T521 VanDerWaalsContact C-N 3.3Å; L519-T521 PolarHBondContact O-N 3.39Å
520	G	52.2	Low	69.1	Low	52 Å²	52	59.3 Å²	59.3	54%	0.536	34%	0.339	S	S	.	.	S	Bend	trans	80.1	-14.7	174.6	0	0	0	0	0	117	T516	T516-G520 WeakPolarHBondContact O-CA 3.31Å; T516-G520 PolarHBondContact O-N 3.22Å
521	T	62.3	Low	69.1	Low	29 Å²	29	56 Å²	56	18%	0.178	32%	0.322	C	S	.	.	S	Bend	trans	-142.8	140.7	-175.8	57.7	0	0	0	0	113.2	L519 N566 D568	L519-T521 VanDerWaalsContact C-N 3.3Å; L519-T521 PolarHBondContact O-N 3.39Å; T521-N566 WeakPolarHBondContact CG2-O 3.46Å; T521-D568 HydrophobicContact CG2-CB 4.39Å
522	I	67.1	Low	69	Low	18 Å²	18	51.4 Å²	51.4	9%	0.092	30%	0.301	C	S	.	.			trans	-86.8	122.1	174.3	-63.5	172.2	0	0	0	110.3	V513 T516 V524 L527 R561 D568 L570	V513-I522 HydrophobicContact CG2-CD1 4.02Å; T516-I522 HydrophobicContact CG2-CG1 4.06Å; T516-I522 WeakPolarHBondContact OG1-CG1 3.37Å; I522-V524 HydrophobicContact CG2-CG2 4.41Å; I522-V524 PolarHBondContact O-N 3.05Å; I522-V524 VanDerWaalsContact O-N 3.16Å; I522-L527 HydrophobicContact CG2-CD2 4.48Å; I522-R561 PolarHBondContact O-NH2 2.9Å; I522-D568 PolarHBondContact N-OD2 3.01Å; I522-L570 HydrophobicContact CB-CD1 4.01Å; I522-L570 HydrophobicContact CD1-CD1 3.7Å; I522-L570 HydrophobicContact CG1-CD1 4.44Å; I522-L570 HydrophobicContact CG2-CD1 3.66Å
523	Q	74.1	Confident	69.3	Low	110 Å²	110	52.2 Å²	52.2	51%	0.514	31%	0.311	S	S	.	.			trans	-79.4	95.1	168.4	-50.7	-162.6	-13.8	0	0	111.8	A525 D526 L527 R561	Q523-A525 VanDerWaalsContact C-N 3.26Å; Q523-A525 PolarHBondContact O-N 2.6Å; Q523-D526 HydrophobicContact CB-CB 3.93Å; Q523-D526 PolarHBondContact O-N 3.26Å; Q523-L527 PolarHBondContact O-N 3.11Å; Q523-R561 VanDerWaalsContact CB-NH1 3.25Å; Q523-R561 VanDerWaalsContact CG-NH1 3.25Å
524	V	77.8	Confident	70.2	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-37.9	-178	179.8	0	0	0	0	110.3	I522 D526 L527 L528 I553 E557 I569 L570	I522-V524 HydrophobicContact CG2-CG2 4.41Å; I522-V524 PolarHBondContact O-N 3.05Å; I522-V524 VanDerWaalsContact O-N 3.16Å; V524-D526 PolarHBondContact O-N 3.35Å; V524-L527 PolarHBondContact O-N 3.17Å; V524-L528 HydrophobicContact CG1-CD1 3.54Å; V524-L528 HydrophobicContact CG1-CG 4.04Å; V524-L528 VanDerWaalsContact O-CB 3.29Å; V524-L528 WeakPolarHBondContact O-CB 3.46Å; V524-L528 WeakPolarHBondContact O-CD1 3.21Å; V524-L528 WeakPolarHBondContact O-CG 3.31Å; V524-L528 PolarHBondContact O-N 3.46Å; V524-I553 HydrophobicContact CG1-CG2 4.19Å; V524-E557 VanDerWaalsContact CB-OE2 3.23Å; V524-E557 WeakPolarHBondContact CB-OE2 3.22Å; V524-E557 PolarHBondContact N-OE1 3.43Å; V524-I569 HydrophobicContact CG2-CB 4.41Å; V524-L570 HydrophobicContact CG2-CD1 3.84Å; V524-L570 HydrophobicContact CG2-CD2 4.28Å; V524-L570 HydrophobicContact CG2-CG 3.54Å
525	A	73.3	Confident	71	Confident	24 Å²	24	50.6 Å²	50.6	20%	0.198	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-37.9	178	0	0	0	0	0	112.8	Q523 S529 M554 E557	Q523-A525 VanDerWaalsContact C-N 3.26Å; Q523-A525 PolarHBondContact O-N 2.6Å; A525-S529 VanDerWaalsContact O-CB 3.25Å; A525-S529 WeakPolarHBondContact O-CB 3.48Å; A525-S529 PolarHBondContact O-N 3.37Å; A525-S529 PolarHBondContact O-OG 3.06Å; A525-M554 HydrophobicContact CB-CB 4.23Å; A525-M554 HydrophobicContact CB-CE 4.32Å; A525-M554 HydrophobicContact CB-CG 4.15Å; A525-E557 WeakPolarHBondContact CA-OE2 3.33Å; A525-E557 VanDerWaalsContact CB-OE2 3.29Å; A525-E557 WeakPolarHBondContact CB-OE2 3.48Å; A525-E557 PolarHBondContact N-OE1 3.38Å; A525-E557 PolarHBondContact N-OE2 3.36Å
526	D	79.2	Confident	71.8	Confident	71 Å²	71	51 Å²	51	38%	0.38	30%	0.299	S	S	.	.	H	α-helix	trans	-70.4	-45.1	174.9	-178.8	52	0	0	0	110.8	Q523 V524 L528 S529 K530	Q523-D526 HydrophobicContact CB-CB 3.93Å; Q523-D526 PolarHBondContact O-N 3.26Å; V524-D526 PolarHBondContact O-N 3.35Å; D526-L528 PolarHBondContact O-N 2.93Å; D526-S529 PolarHBondContact O-N 3.17Å; D526-K530 WeakPolarHBondContact O-CG 3.5Å; D526-K530 PolarHBondContact O-N 3.3Å; D526-K530 WeakPolarHBondContact OD1-CE 3.41Å; D526-K530 IonicContact OD1-NZ 3.96Å; D526-K530 WeakPolarHBondContact OD2-CE 3.34Å; D526-K530 IonicContact OD2-NZ 2.77Å; D526-K530 PolarHBondContact OD2-NZ 3.43Å
527	L	83.2	Confident	73.1	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-55.5	-54.1	174.7	172.1	65.6	0	0	0	111.1	V474 L508 A512 I522 Q523 V524 S529 K530 V531	V474-L527 HydrophobicContact CG1-CD2 3.77Å; L508-L527 HydrophobicContact CD2-CD1 3.21Å; L508-L527 HydrophobicContact CG-CD1 4.48Å; A512-L527 HydrophobicContact CB-CB 4.49Å; A512-L527 HydrophobicContact CB-CD1 3.61Å; A512-L527 HydrophobicContact CB-CD2 4.45Å; A512-L527 HydrophobicContact CB-CG 4.4Å; I522-L527 HydrophobicContact CG2-CD2 4.48Å; Q523-L527 PolarHBondContact O-N 3.11Å; V524-L527 PolarHBondContact O-N 3.17Å; L527-S529 VanDerWaalsContact C-N 3.34Å; L527-S529 PolarHBondContact O-N 3.08Å; L527-K530 PolarHBondContact O-N 2.92Å; L527-V531 HydrophobicContact CD1-CG2 4.34Å; L527-V531 WeakPolarHBondContact O-CG2 3.45Å; L527-V531 PolarHBondContact O-N 3.46Å
528	L	80.3	Confident	74.8	Confident	20 Å²	20	49.8 Å²	49.8	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-40.7	179.5	-69.8	166.6	0	0	0	111.7	V524 D526 K530 V531 F532 V550 I553 M554	V524-L528 HydrophobicContact CG1-CD1 3.54Å; V524-L528 HydrophobicContact CG1-CG 4.04Å; V524-L528 VanDerWaalsContact O-CB 3.29Å; V524-L528 WeakPolarHBondContact O-CB 3.46Å; V524-L528 WeakPolarHBondContact O-CD1 3.21Å; V524-L528 WeakPolarHBondContact O-CG 3.31Å; V524-L528 PolarHBondContact O-N 3.46Å; D526-L528 PolarHBondContact O-N 2.93Å; L528-K530 VanDerWaalsContact C-N 3.32Å; L528-K530 PolarHBondContact O-N 3.22Å; L528-V531 PolarHBondContact O-N 3.49Å; L528-F532 HydrophobicContact CB-CE2 4.48Å; L528-F532 WeakPolarHBondContact O-CD2 3.38Å; L528-F532 PolarHBondContact O-N 2.94Å; L528-V550 HydrophobicContact CB-CG1 4.11Å; L528-V550 HydrophobicContact CD1-CG1 3.54Å; L528-V550 HydrophobicContact CD2-CG1 3.71Å; L528-V550 HydrophobicContact CG-CG1 3.98Å; L528-I553 HydrophobicContact CD1-CG2 4.49Å; L528-M554 HydrophobicContact CB-CG 4.4Å; L528-M554 HydrophobicContact CB-SD 4.18Å; L528-M554 HydrophobicContact CD1-CG 3.82Å
529	S	78.8	Confident	76.1	Confident	41 Å²	41	50.2 Å²	50.2	29%	0.287	28%	0.275	S	S	.	.	H	α-helix	trans	-59.6	-42.6	175.4	-63.6	0	0	0	0	111.7	A525 D526 L527 G533 M554	A525-S529 VanDerWaalsContact O-CB 3.25Å; A525-S529 WeakPolarHBondContact O-CB 3.48Å; A525-S529 PolarHBondContact O-N 3.37Å; A525-S529 PolarHBondContact O-OG 3.06Å; D526-S529 PolarHBondContact O-N 3.17Å; L527-S529 VanDerWaalsContact C-N 3.34Å; L527-S529 PolarHBondContact O-N 3.08Å; S529-G533 PolarHBondContact O-N 3.02Å; S529-M554 VanDerWaalsContact OG-CE 3.24Å; S529-M554 WeakPolarHBondContact OG-CE 3.33Å
530	K	85	Confident	77.5	Confident	102 Å²	102	44.3 Å²	44.3	44%	0.443	24%	0.244	S	C	.	.	H	α-helix	trans	-68.2	-40.6	176.1	-68.4	167.5	174.5	166.9	0	111.8	L508 D526 L527 L528 G533 L534	L508-K530 HydrophobicContact CD1-CB 3.54Å; L508-K530 HydrophobicContact CG-CB 4.22Å; D526-K530 WeakPolarHBondContact O-CG 3.5Å; D526-K530 PolarHBondContact O-N 3.3Å; D526-K530 WeakPolarHBondContact OD1-CE 3.41Å; D526-K530 IonicContact OD1-NZ 3.96Å; D526-K530 WeakPolarHBondContact OD2-CE 3.34Å; D526-K530 IonicContact OD2-NZ 2.77Å; D526-K530 PolarHBondContact OD2-NZ 3.43Å; L527-K530 PolarHBondContact O-N 2.92Å; L528-K530 VanDerWaalsContact C-N 3.32Å; L528-K530 PolarHBondContact O-N 3.22Å; K530-G533 WeakPolarHBondContact O-CA 3.28Å; K530-G533 PolarHBondContact O-N 3.32Å; K530-G533 VanDerWaalsContact O-N 3.17Å; K530-L534 PolarHBondContact O-N 2.7Å
531	V	84.8	Confident	78.3	Confident	18 Å²	18	44.7 Å²	44.7	11%	0.109	23%	0.231	C	C	.	.	H	α-helix	trans	-57.4	-51.4	173.7	168.9	0	0	0	0	109.9	I486 M505 L508 L527 L528 G533 L534 L535	I486-V531 HydrophobicContact CD1-CG1 4.4Å; M505-V531 HydrophobicContact CE-CG1 4.11Å; M505-V531 HydrophobicContact SD-CG1 4.42Å; M505-V531 HydrophobicContact SD-CG2 3.98Å; L508-V531 HydrophobicContact CD1-CG2 4.34Å; L508-V531 HydrophobicContact CD2-CG2 3.68Å; L527-V531 HydrophobicContact CD1-CG2 4.34Å; L527-V531 WeakPolarHBondContact O-CG2 3.45Å; L527-V531 PolarHBondContact O-N 3.46Å; L528-V531 PolarHBondContact O-N 3.49Å; V531-G533 VanDerWaalsContact C-N 3.28Å; V531-G533 PolarHBondContact O-N 2.95Å; V531-L534 WeakPolarHBondContact O-CB 3.36Å; V531-L534 PolarHBondContact O-N 3.19Å; V531-L535 HydrophobicContact CG1-CD1 4.15Å; V531-L535 HydrophobicContact CG1-CG 4.4Å; V531-L535 WeakPolarHBondContact O-CG 3.28Å; V531-L535 PolarHBondContact O-N 3.12Å
532	F	79.1	Confident	78.7	Confident	19 Å²	19	45 Å²	45	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-58.6	-40	175.8	-75.8	-64.8	0	0	0	112.3	D153 L528 L534 L535 I536 L542 V550 M554	D153-F532 HydrophobicContact CB-CB 4.27Å; D153-F532 HydrophobicContact CB-CD1 3.54Å; D153-F532 HydrophobicContact CB-CE1 4.01Å; D153-F532 HydrophobicContact CB-CG 4.02Å; L528-F532 HydrophobicContact CB-CE2 4.48Å; L528-F532 WeakPolarHBondContact O-CD2 3.38Å; L528-F532 PolarHBondContact O-N 2.94Å; F532-L534 VanDerWaalsContact C-N 3.3Å; F532-L534 PolarHBondContact O-N 3.45Å; F532-L535 HydrophobicContact CD1-CD1 4.17Å; F532-L535 PolarHBondContact O-N 3.03Å; F532-L535 VanDerWaalsContact O-N 3.12Å; F532-I536 VanDerWaalsContact O-CG1 3.26Å; F532-I536 WeakPolarHBondContact O-CG1 3.27Å; F532-I536 PolarHBondContact O-N 3.39Å; F532-L542 HydrophobicContact CD1-CD1 3.87Å; F532-L542 HydrophobicContact CE1-CD1 3.36Å; F532-L542 HydrophobicContact CZ-CD1 4.3Å; F532-V550 HydrophobicContact CE2-CB 4.24Å; F532-V550 HydrophobicContact CE2-CG1 3.4Å; F532-V550 VanDerWaalsContact CE2-CG1 3.4Å; F532-V550 HydrophobicContact CZ-CB 3.97Å; F532-V550 HydrophobicContact CZ-CG1 3.61Å; F532-V550 HydrophobicContact CZ-CG2 4.46Å; F532-M554 HydrophobicContact CE2-SD 4.45Å
533	G	80.5	Confident	78.7	Confident	37 Å²	37	45.6 Å²	45.6	38%	0.381	23%	0.234	S	C	.	.	H	α-helix	trans	-54.8	-43.3	172.7	0	0	0	0	0	113.1	S529 K530 V531 K537	S529-G533 PolarHBondContact O-N 3.02Å; K530-G533 WeakPolarHBondContact O-CA 3.28Å; K530-G533 PolarHBondContact O-N 3.32Å; K530-G533 VanDerWaalsContact O-N 3.17Å; V531-G533 VanDerWaalsContact C-N 3.28Å; V531-G533 PolarHBondContact O-N 2.95Å; G533-K537 WeakPolarHBondContact O-CB 3.49Å; G533-K537 PolarHBondContact O-N 2.96Å
534	L	86.1	Confident	78.3	Confident	21 Å²	21	41.7 Å²	41.7	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.1	-70.2	-175.5	0	0	0	112.2	F501 E504 M505 L508 K530 V531 F532 I536 K537 H538	F501-L534 HydrophobicContact CE2-CB 4.3Å; E504-L534 HydrophobicContact CB-CD1 4.08Å; E504-L534 HydrophobicContact CB-CD2 4.03Å; E504-L534 WeakPolarHBondContact OE2-CD2 2.91Å; M505-L534 HydrophobicContact CE-CB 4.47Å; M505-L534 HydrophobicContact CE-CD1 4.12Å; M505-L534 HydrophobicContact SD-CD1 4.34Å; L508-L534 HydrophobicContact CB-CD1 4.33Å; L508-L534 HydrophobicContact CD1-CD1 3.52Å; L508-L534 HydrophobicContact CD1-CG 4.02Å; K530-L534 PolarHBondContact O-N 2.7Å; V531-L534 WeakPolarHBondContact O-CB 3.36Å; V531-L534 PolarHBondContact O-N 3.19Å; F532-L534 VanDerWaalsContact C-N 3.3Å; F532-L534 PolarHBondContact O-N 3.45Å; L534-I536 VanDerWaalsContact C-N 3.33Å; L534-I536 PolarHBondContact O-N 3.27Å; L534-K537 HydrophobicContact CD2-CD 4.5Å; L534-K537 PolarHBondContact O-N 3.03Å; L534-H538 WeakPolarHBondContact O-CB 3.48Å; L534-H538 PolarHBondContact O-CD2 3.13Å; L534-H538 VanDerWaalsContact O-CD2 3.29Å; L534-H538 PolarHBondContact O-N 2.89Å
535	L	82.4	Confident	78.1	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-41.7	178.7	-61.8	176.4	0	0	0	111.9	I486 F501 V531 F532 H538 K539 V540 L542	I486-L535 HydrophobicContact CD1-CD2 4.49Å; I486-L535 HydrophobicContact CG2-CD2 3.65Å; F501-L535 HydrophobicContact CE2-CD2 3.84Å; F501-L535 HydrophobicContact CZ-CD2 3.65Å; V531-L535 HydrophobicContact CG1-CD1 4.15Å; V531-L535 HydrophobicContact CG1-CG 4.4Å; V531-L535 WeakPolarHBondContact O-CG 3.28Å; V531-L535 PolarHBondContact O-N 3.12Å; F532-L535 HydrophobicContact CD1-CD1 4.17Å; F532-L535 PolarHBondContact O-N 3.03Å; F532-L535 VanDerWaalsContact O-N 3.12Å; L535-H538 CarbonylContact O-C 3.57Å; L535-K539 CarbonylContact O-C 3.52Å; L535-K539 WeakPolarHBondContact O-CA 3.47Å; L535-K539 PolarHBondContact O-N 3.07Å; L535-V540 HydrophobicContact CB-CB 4.4Å; L535-V540 HydrophobicContact CD2-CB 3.75Å; L535-V540 HydrophobicContact CD2-CG1 3.82Å; L535-V540 HydrophobicContact CD2-CG2 4.44Å; L535-V540 PolarHBondContact O-N 3.25Å; L535-L542 HydrophobicContact CD1-CD1 3.18Å; L535-L542 HydrophobicContact CD1-CG 3.77Å
536	I	77.3	Confident	78.3	Confident	87 Å²	87	44 Å²	44	45%	0.446	23%	0.226	S	C	.	.	H	α-helix	trans	-63.3	-49.5	174.2	-62.3	162.8	0	0	0	110.5	D153 F532 L534 H538 K539	D153-I536 WeakPolarHBondContact O-CD1 3.46Å; D153-I536 WeakPolarHBondContact O-CG1 3.38Å; F532-I536 VanDerWaalsContact O-CG1 3.26Å; F532-I536 WeakPolarHBondContact O-CG1 3.27Å; F532-I536 PolarHBondContact O-N 3.39Å; L534-I536 VanDerWaalsContact C-N 3.33Å; L534-I536 PolarHBondContact O-N 3.27Å; I536-H538 VanDerWaalsContact C-N 3.26Å; I536-H538 PolarHBondContact O-N 3.08Å; I536-K539 PolarHBondContact O-N 2.86Å; I536-K539 VanDerWaalsContact O-N 3.15Å
537	K	82.8	Confident	77.9	Confident	124 Å²	124	40.8 Å²	40.8	54%	0.539	21%	0.21	S	C	.	.	H	α-helix	trans	-56.1	-42.6	-179.2	178.8	-175.4	172.4	-167.7	0	111.5	E504 G533 L534	E504-K537 IonicContact OE1-NZ 3.96Å; E504-K537 PolarHBondContact OE1-NZ 3.5Å; E504-K537 IonicContact OE2-NZ 3.71Å; E504-K537 PolarHBondContact OE2-NZ 3.26Å; G533-K537 WeakPolarHBondContact O-CB 3.49Å; G533-K537 PolarHBondContact O-N 2.96Å; L534-K537 HydrophobicContact CD2-CD 4.5Å; L534-K537 PolarHBondContact O-N 3.03Å
538	H	85	Confident	77.5	Confident	20 Å²	20	41.9 Å²	41.9	9%	0.093	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	4.5	-177.7	-71.1	-79.1	0	0	0	114.2	C495 F501 E504 L534 L535 I536 V540	C495-H538 WeakPolarHBondContact CA-O 3.36Å; F501-H538 HydrophobicContact CD2-CB 3.85Å; F501-H538 AromaticContact CD2-CD2 3.57Å; F501-H538 AromaticContact CD2-CG 3.73Å; F501-H538 HydrophobicContact CG-CB 4.46Å; E504-H538 IonicContact OE2-CD2 3.54Å; E504-H538 IonicContact OE2-CE1 3.67Å; E504-H538 IonicContact OE2-NE2 2.77Å; E504-H538 PolarHBondContact OE2-NE2 3.38Å; L534-H538 WeakPolarHBondContact O-CB 3.48Å; L534-H538 PolarHBondContact O-CD2 3.13Å; L534-H538 VanDerWaalsContact O-CD2 3.29Å; L534-H538 PolarHBondContact O-N 2.89Å; L535-H538 CarbonylContact O-C 3.57Å; I536-H538 VanDerWaalsContact C-N 3.26Å; I536-H538 PolarHBondContact O-N 3.08Å; H538-V540 VanDerWaalsContact C-N 3.28Å; H538-V540 HydrophobicContact CB-CG2 4.12Å; H538-V540 PolarHBondContact O-N 3.42Å
539	K	77.6	Confident	77.7	Confident	112 Å²	112	41 Å²	41	49%	0.487	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	41	-179.9	-55.8	-176.4	174.6	-168	0	113.8	E494 L535 I536	E494-K539 HydrophobicContact CB-CB 4.11Å; L535-K539 CarbonylContact O-C 3.52Å; L535-K539 WeakPolarHBondContact O-CA 3.47Å; L535-K539 PolarHBondContact O-N 3.07Å; I536-K539 PolarHBondContact O-N 2.86Å; I536-K539 VanDerWaalsContact O-N 3.15Å
540	V	79	Confident	77.7	Confident	8 Å²	8	39 Å²	39	5%	0.048	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-92.3	116.9	174.6	-177.6	0	0	0	0	108.3	I486 L487 A490 C495 F501 L535 H538	I486-V540 HydrophobicContact CG2-CG1 3.84Å; L487-V540 HydrophobicContact CD2-CG1 4.44Å; L487-V540 HydrophobicContact CD2-CG2 3.92Å; A490-V540 HydrophobicContact CB-CG1 3.86Å; C495-V540 HydrophobicContact CB-CG2 3.93Å; F501-V540 HydrophobicContact CE2-CG2 4.39Å; F501-V540 HydrophobicContact CZ-CG2 4.42Å; L535-V540 HydrophobicContact CB-CB 4.4Å; L535-V540 HydrophobicContact CD2-CB 3.75Å; L535-V540 HydrophobicContact CD2-CG1 3.82Å; L535-V540 HydrophobicContact CD2-CG2 4.44Å; L535-V540 PolarHBondContact O-N 3.25Å; H538-V540 VanDerWaalsContact C-N 3.28Å; H538-V540 HydrophobicContact CB-CG2 4.12Å; H538-V540 PolarHBondContact O-N 3.42Å
541	K	69.7	Low	77.3	Confident	61 Å²	61	36.2 Å²	36.2	27%	0.265	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-89.8	123.4	-176.4	-171.3	176.4	176.6	-176.2	0	111.5	S306 E309 A490 A492	S306-K541 PolarHBondContact OG-NZ 3.01Å; E309-K541 IonicContact OE1-NZ 3.57Å; E309-K541 PolarHBondContact OE1-NZ 2.87Å; E309-K541 IonicContact OE2-NZ 2.73Å; E309-K541 PolarHBondContact OE2-NZ 3.36Å; A490-K541 WeakPolarHBondContact CA-O 3.47Å; A490-K541 WeakPolarHBondContact CB-O 3.45Å; A492-K541 HydrophobicContact CB-CB 4.44Å; A492-K541 HydrophobicContact CB-CD 4.22Å; A492-K541 WeakPolarHBondContact O-CB 3.33Å; A492-K541 PolarHBondContact O-N 3.14Å
542	L	68.8	Low	77	Confident	35 Å²	35	35.6 Å²	35.6	18%	0.183	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-86.7	156.8	170.3	-84.4	167.4	0	0	0	112.1	F532 L535 F546	F532-L542 HydrophobicContact CD1-CD1 3.87Å; F532-L542 HydrophobicContact CE1-CD1 3.36Å; F532-L542 HydrophobicContact CZ-CD1 4.3Å; L535-L542 HydrophobicContact CD1-CD1 3.18Å; L535-L542 HydrophobicContact CD1-CG 3.77Å; L542-F546 HydrophobicContact CD1-CD1 3.87Å; L542-F546 HydrophobicContact CD1-CE1 3.89Å; L542-F546 HydrophobicContact CD2-CD1 3.54Å; L542-F546 HydrophobicContact CD2-CE1 3.67Å; L542-F546 HydrophobicContact CD2-CG 4.01Å; L542-F546 HydrophobicContact CD2-CZ 4.26Å; L542-F546 HydrophobicContact CG-CD1 4.21Å; L542-F546 HydrophobicContact CG-CE1 4.43Å
543	E	68.9	Low	77.3	Confident	31 Å²	31	34.9 Å²	34.9	15%	0.145	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-70.5	147.4	171.5	-172	173.7	-143.1	0	0	112	D463 R491 N545 F546 A547	D463-E543 VanDerWaalsContact CG-OE2 3.26Å; R491-E543 IonicContact CZ-OE1 3.73Å; R491-E543 IonicContact NE-OE1 2.7Å; R491-E543 IonicContact NH2-OE1 3.85Å; R491-E543 PolarHBondContact NH2-OE1 3.08Å; E543-N545 PolarHBondContact O-N 2.73Å; E543-F546 HydrophobicContact CB-CB 4.31Å; E543-F546 WeakPolarHBondContact O-CB 3.42Å; E543-F546 PolarHBondContact O-N 3.26Å; E543-A547 PolarHBondContact O-N 3.04Å; E543-A547 VanDerWaalsContact O-N 3.13Å
544	S	65.4	Low	77.2	Confident	28 Å²	28	34 Å²	34	20%	0.196	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-46.9	-178.6	47.5	0	0	0	0	112.9	E313 F546 A547 S548	E313-S544 WeakPolarHBondContact OE2-CB 3.31Å; E313-S544 PolarHBondContact OE2-OG 2.92Å; S544-F546 VanDerWaalsContact C-N 3.31Å; S544-F546 PolarHBondContact O-N 2.83Å; S544-A547 PolarHBondContact O-N 2.98Å; S544-S548 PolarHBondContact O-N 3.46Å; S544-S548 PolarHBondContact O-OG 2.87Å
545	N	72.1	Confident	76.9	Confident	54 Å²	54	34.7 Å²	34.7	29%	0.289	17%	0.172	S	C	.	.	H	α-helix	trans	-64.8	-35.5	179.9	-69.7	-17.3	0	0	0	112.1	Q458 L459 E543 S548 I549	Q458-N545 PolarHBondContact O-ND2 3.13Å; L459-N545 HydrophobicContact CD2-CB 3.79Å; E543-N545 PolarHBondContact O-N 2.73Å; N545-S548 PolarHBondContact O-N 2.67Å; N545-I549 WeakPolarHBondContact O-CG1 3.37Å; N545-I549 PolarHBondContact O-N 3.04Å; N545-I549 VanDerWaalsContact O-N 3.12Å
546	F	77.7	Confident	76.9	Confident	20 Å²	20	34.9 Å²	34.9	9%	0.088	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-49.4	173.5	-173.2	-81.1	0	0	0	110.6	F467 L542 E543 S544 S548 I549 V550	F467-F546 HydrophobicContact CB-CE2 4.32Å; F467-F546 AromaticContact CD2-CD2 3.43Å; F467-F546 HydrophobicContact CD2-CD2 3.43Å; F467-F546 VanDerWaalsContact CD2-CD2 3.43Å; F467-F546 AromaticContact CD2-CE2 3.19Å; F467-F546 HydrophobicContact CD2-CE2 3.19Å; F467-F546 HydrophobicContact CD2-CG 4.34Å; F467-F546 AromaticContact CD2-CZ 3.96Å; F467-F546 HydrophobicContact CD2-CZ 3.96Å; F467-F546 HydrophobicContact CE2-CD2 4.06Å; F467-F546 AromaticContact CE2-CE2 3.78Å; F467-F546 HydrophobicContact CE2-CE2 3.78Å; F467-F546 HydrophobicContact CE2-CZ 4.11Å; F467-F546 HydrophobicContact CG-CD2 4.48Å; F467-F546 HydrophobicContact CG-CE2 4.13Å; L542-F546 HydrophobicContact CD1-CD1 3.87Å; L542-F546 HydrophobicContact CD1-CE1 3.89Å; L542-F546 HydrophobicContact CD2-CD1 3.54Å; L542-F546 HydrophobicContact CD2-CE1 3.67Å; L542-F546 HydrophobicContact CD2-CG 4.01Å; L542-F546 HydrophobicContact CD2-CZ 4.26Å; L542-F546 HydrophobicContact CG-CD1 4.21Å; L542-F546 HydrophobicContact CG-CE1 4.43Å; E543-F546 HydrophobicContact CB-CB 4.31Å; E543-F546 WeakPolarHBondContact O-CB 3.42Å; E543-F546 PolarHBondContact O-N 3.26Å; S544-F546 VanDerWaalsContact C-N 3.31Å; S544-F546 PolarHBondContact O-N 2.83Å; F546-S548 VanDerWaalsContact C-N 3.32Å; F546-S548 PolarHBondContact O-N 3.21Å; F546-I549 PolarHBondContact O-N 3.44Å; F546-V550 HydrophobicContact CD1-CG2 3.74Å; F546-V550 HydrophobicContact CE1-CG2 3.5Å; F546-V550 HydrophobicContact CZ-CG2 4.13Å; F546-V550 VanDerWaalsContact O-CG2 3.27Å; F546-V550 WeakPolarHBondContact O-CG2 3.34Å; F546-V550 PolarHBondContact O-N 3.33Å
547	A	72.1	Confident	77.3	Confident	4 Å²	4	30.8 Å²	30.8	3%	0.033	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-40.8	178.6	0	0	0	0	0	112.5	E543 S544 V550 F551	E543-A547 PolarHBondContact O-N 3.04Å; E543-A547 VanDerWaalsContact O-N 3.13Å; S544-A547 PolarHBondContact O-N 2.98Å; A547-V550 PolarHBondContact O-N 3.32Å; A547-F551 WeakPolarHBondContact O-CB 3.44Å; A547-F551 PolarHBondContact O-N 2.88Å
548	S	74.4	Confident	77.2	Confident	31 Å²	31	26.7 Å²	26.7	22%	0.217	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-43	176.6	-70	0	0	0	0	113	S544 N545 F546 F551 A552	S544-S548 PolarHBondContact O-N 3.46Å; S544-S548 PolarHBondContact O-OG 2.87Å; N545-S548 PolarHBondContact O-N 2.67Å; F546-S548 VanDerWaalsContact C-N 3.32Å; F546-S548 PolarHBondContact O-N 3.21Å; S548-F551 PolarHBondContact O-N 3.3Å; S548-A552 PolarHBondContact O-N 2.78Å
549	I	83.6	Confident	77.2	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-44.8	178.4	-69.6	173.8	0	0	0	111	V397 V403 A457 L459 F467 N545 F546 F551 A552 I553	V397-I549 HydrophobicContact CG1-CG2 3.96Å; V397-I549 HydrophobicContact CG2-CG2 3.89Å; V403-I549 HydrophobicContact CB-CG1 4.13Å; V403-I549 HydrophobicContact CG1-CG1 4.4Å; V403-I549 HydrophobicContact CG2-CD1 4.07Å; V403-I549 HydrophobicContact CG2-CG1 3.95Å; V403-I549 HydrophobicContact CG2-CG2 4.48Å; A457-I549 HydrophobicContact CB-CD1 4.46Å; A457-I549 HydrophobicContact CB-CG1 3.86Å; L459-I549 HydrophobicContact CD1-CD1 3.65Å; L459-I549 HydrophobicContact CD2-CD1 3.87Å; L459-I549 HydrophobicContact CG-CD1 3.42Å; L459-I549 VanDerWaalsContact CG-CD1 3.42Å; F467-I549 HydrophobicContact CE1-CG2 4.49Å; F467-I549 HydrophobicContact CE2-CG2 3.94Å; F467-I549 HydrophobicContact CZ-CG2 3.71Å; N545-I549 WeakPolarHBondContact O-CG1 3.37Å; N545-I549 PolarHBondContact O-N 3.04Å; N545-I549 VanDerWaalsContact O-N 3.12Å; F546-I549 PolarHBondContact O-N 3.44Å; I549-F551 PolarHBondContact O-N 3.41Å; I549-A552 WeakPolarHBondContact O-CB 3.42Å; I549-A552 PolarHBondContact O-N 2.71Å; I549-A552 VanDerWaalsContact O-N 3.17Å; I549-I553 HydrophobicContact CG2-CD1 4.1Å; I549-I553 WeakPolarHBondContact O-CG1 3.41Å; I549-I553 PolarHBondContact O-N 3.02Å
550	V	79.6	Confident	77.5	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60	-39.7	177.5	178.2	0	0	0	0	110.8	F467 L528 F532 F546 A547 I553 M554	F467-V550 HydrophobicContact CE2-CG2 4.02Å; L528-V550 HydrophobicContact CB-CG1 4.11Å; L528-V550 HydrophobicContact CD1-CG1 3.54Å; L528-V550 HydrophobicContact CD2-CG1 3.71Å; L528-V550 HydrophobicContact CG-CG1 3.98Å; F532-V550 HydrophobicContact CE2-CB 4.24Å; F532-V550 HydrophobicContact CE2-CG1 3.4Å; F532-V550 VanDerWaalsContact CE2-CG1 3.4Å; F532-V550 HydrophobicContact CZ-CB 3.97Å; F532-V550 HydrophobicContact CZ-CG1 3.61Å; F532-V550 HydrophobicContact CZ-CG2 4.46Å; F546-V550 HydrophobicContact CD1-CG2 3.74Å; F546-V550 HydrophobicContact CE1-CG2 3.5Å; F546-V550 HydrophobicContact CZ-CG2 4.13Å; F546-V550 VanDerWaalsContact O-CG2 3.27Å; F546-V550 WeakPolarHBondContact O-CG2 3.34Å; F546-V550 PolarHBondContact O-N 3.33Å; A547-V550 PolarHBondContact O-N 3.32Å; V550-I553 WeakPolarHBondContact O-CB 3.41Å; V550-I553 PolarHBondContact O-N 2.96Å; V550-M554 HydrophobicContact CG1-SD 4.38Å; V550-M554 VanDerWaalsContact O-CG 3.29Å; V550-M554 WeakPolarHBondContact O-CG 3.17Å; V550-M554 PolarHBondContact O-N 3.47Å
551	F	75.8	Confident	77.8	Confident	44 Å²	44	22.5 Å²	22.5	19%	0.193	13%	0.127	C	C	.	.	H	α-helix	trans	-64.4	-43.5	174.9	-176.7	-96.8	0	0	0	113	T150 A547 S548 I549 I553 M554 V555	T150-F551 HydrophobicContact CG2-CD1 3.89Å; T150-F551 HydrophobicContact CG2-CE1 3.19Å; T150-F551 HydrophobicContact CG2-CE2 4.06Å; T150-F551 HydrophobicContact CG2-CZ 3.29Å; T150-F551 WeakPolarHBondContact O-CD2 3.14Å; T150-F551 VanDerWaalsContact O-CE2 3.28Å; T150-F551 WeakPolarHBondContact O-CE2 3.15Å; A547-F551 WeakPolarHBondContact O-CB 3.44Å; A547-F551 PolarHBondContact O-N 2.88Å; S548-F551 PolarHBondContact O-N 3.3Å; I549-F551 PolarHBondContact O-N 3.41Å; F551-I553 VanDerWaalsContact C-N 3.25Å; F551-I553 PolarHBondContact O-N 3.46Å; F551-M554 PolarHBondContact O-N 2.92Å; F551-M554 VanDerWaalsContact O-N 3.11Å; F551-V555 HydrophobicContact CD1-CG2 3.91Å; F551-V555 HydrophobicContact CD2-CG2 4.47Å; F551-V555 HydrophobicContact CE1-CG2 3.28Å; F551-V555 HydrophobicContact CE2-CG2 3.94Å; F551-V555 HydrophobicContact CG-CG2 4.47Å; F551-V555 HydrophobicContact CZ-CG2 3.3Å; F551-V555 PolarHBondContact O-N 3.31Å
552	A	79.8	Confident	78.5	Confident	4 Å²	4	23.2 Å²	23.2	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-57.2	-42.1	175.3	0	0	0	0	0	111.2	V403 S548 I549 V555 L556	V403-A552 HydrophobicContact CG1-CB 4Å; S548-A552 PolarHBondContact O-N 2.78Å; I549-A552 WeakPolarHBondContact O-CB 3.42Å; I549-A552 PolarHBondContact O-N 2.71Å; I549-A552 VanDerWaalsContact O-N 3.17Å; A552-V555 PolarHBondContact O-N 2.86Å; A552-L556 WeakPolarHBondContact O-CB 3.42Å; A552-L556 WeakPolarHBondContact O-CD1 3.39Å; A552-L556 WeakPolarHBondContact O-CG 3.26Å; A552-L556 PolarHBondContact O-N 2.93Å; A552-L556 VanDerWaalsContact O-N 3.11Å
553	I	84.1	Confident	79.4	Confident	5 Å²	5	21.7 Å²	21.7	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-47.9	174	-64.7	167	0	0	0	111	L393 V397 F467 F471 V524 L528 I549 V550 F551 V555 L556 E557	L393-I553 HydrophobicContact CD1-CG1 3.88Å; L393-I553 HydrophobicContact CD2-CB 4.23Å; L393-I553 HydrophobicContact CD2-CG1 4.08Å; L393-I553 HydrophobicContact CD2-CG2 4.26Å; L393-I553 HydrophobicContact CG-CG1 4.27Å; V397-I553 HydrophobicContact CG1-CD1 4.47Å; V397-I553 HydrophobicContact CG2-CD1 4.39Å; V397-I553 HydrophobicContact CG2-CG1 4.32Å; F467-I553 HydrophobicContact CZ-CD1 3.89Å; F471-I553 HydrophobicContact CE1-CD1 4.37Å; F471-I553 HydrophobicContact CZ-CD1 3.87Å; V524-I553 HydrophobicContact CG1-CG2 4.19Å; L528-I553 HydrophobicContact CD1-CG2 4.49Å; I549-I553 HydrophobicContact CG2-CD1 4.1Å; I549-I553 WeakPolarHBondContact O-CG1 3.41Å; I549-I553 PolarHBondContact O-N 3.02Å; V550-I553 WeakPolarHBondContact O-CB 3.41Å; V550-I553 PolarHBondContact O-N 2.96Å; F551-I553 VanDerWaalsContact C-N 3.25Å; F551-I553 PolarHBondContact O-N 3.46Å; I553-V555 PolarHBondContact O-N 3.3Å; I553-L556 PolarHBondContact O-N 2.87Å; I553-E557 VanDerWaalsContact O-CB 3.26Å; I553-E557 WeakPolarHBondContact O-CB 3.45Å; I553-E557 PolarHBondContact O-N 2.84Å
554	M	80	Confident	80.3	Confident	17 Å²	17	21.3 Å²	21.3	8%	0.084	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-42.7	-179.3	-69	176.7	64.5	0	0	113.2	A525 L528 S529 F532 V550 F551 G558	A525-M554 HydrophobicContact CB-CB 4.23Å; A525-M554 HydrophobicContact CB-CE 4.32Å; A525-M554 HydrophobicContact CB-CG 4.15Å; L528-M554 HydrophobicContact CB-CG 4.4Å; L528-M554 HydrophobicContact CB-SD 4.18Å; L528-M554 HydrophobicContact CD1-CG 3.82Å; S529-M554 VanDerWaalsContact OG-CE 3.24Å; S529-M554 WeakPolarHBondContact OG-CE 3.33Å; F532-M554 HydrophobicContact CE2-SD 4.45Å; V550-M554 HydrophobicContact CG1-SD 4.38Å; V550-M554 VanDerWaalsContact O-CG 3.29Å; V550-M554 WeakPolarHBondContact O-CG 3.17Å; V550-M554 PolarHBondContact O-N 3.47Å; F551-M554 PolarHBondContact O-N 2.92Å; F551-M554 VanDerWaalsContact O-N 3.11Å; M554-G558 PolarHBondContact O-N 3.39Å
555	V	79.2	Confident	81.2	Confident	36 Å²	36	23.9 Å²	23.9	22%	0.218	15%	0.147	C	C	.	.	H	α-helix	trans	-66.7	-47.1	-179.9	171.7	0	0	0	0	111	L407 H408 F551 A552 I553 G558 L559	L407-V555 WeakPolarHBondContact O-CG1 3.27Å; H408-V555 HydrophobicContact CB-CG1 4.48Å; F551-V555 HydrophobicContact CD1-CG2 3.91Å; F551-V555 HydrophobicContact CD2-CG2 4.47Å; F551-V555 HydrophobicContact CE1-CG2 3.28Å; F551-V555 HydrophobicContact CE2-CG2 3.94Å; F551-V555 HydrophobicContact CG-CG2 4.47Å; F551-V555 HydrophobicContact CZ-CG2 3.3Å; F551-V555 PolarHBondContact O-N 3.31Å; A552-V555 PolarHBondContact O-N 2.86Å; I553-V555 PolarHBondContact O-N 3.3Å; V555-G558 PolarHBondContact O-N 2.84Å; V555-L559 PolarHBondContact O-N 3.07Å
556	L	83	Confident	81.8	Confident	11 Å²	11	27.1 Å²	27.1	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-70.2	-33.4	-178.1	-74.4	163.6	0	0	0	112.4	L393 L407 I412 A552 I553 L559 G560	L393-L556 HydrophobicContact CB-CD1 3.95Å; L393-L556 HydrophobicContact CD1-CD1 3.57Å; L393-L556 HydrophobicContact CD2-CB 3.92Å; L393-L556 HydrophobicContact CD2-CD1 4.14Å; L393-L556 HydrophobicContact CG-CD1 4.07Å; L407-L556 HydrophobicContact CB-CD1 4.49Å; L407-L556 HydrophobicContact CD2-CD1 3.78Å; L407-L556 HydrophobicContact CD2-CD2 3.93Å; L407-L556 HydrophobicContact CD2-CG 4.38Å; L407-L556 HydrophobicContact CG-CD1 4.36Å; L407-L556 HydrophobicContact CG-CD2 4.04Å; I412-L556 HydrophobicContact CD1-CD2 3.77Å; A552-L556 WeakPolarHBondContact O-CB 3.42Å; A552-L556 WeakPolarHBondContact O-CD1 3.39Å; A552-L556 WeakPolarHBondContact O-CG 3.26Å; A552-L556 PolarHBondContact O-N 2.93Å; A552-L556 VanDerWaalsContact O-N 3.11Å; I553-L556 PolarHBondContact O-N 2.87Å; L556-L559 PolarHBondContact O-N 3.27Å; L556-G560 PolarHBondContact O-N 3.41Å
557	E	83.8	Confident	82	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-46.6	169.6	-172.6	-170.4	177	0	0	112	V524 A525 I553 L559 G560 R561 I569	V524-E557 VanDerWaalsContact CB-OE2 3.23Å; V524-E557 WeakPolarHBondContact CB-OE2 3.22Å; V524-E557 PolarHBondContact N-OE1 3.43Å; A525-E557 WeakPolarHBondContact CA-OE2 3.33Å; A525-E557 VanDerWaalsContact CB-OE2 3.29Å; A525-E557 WeakPolarHBondContact CB-OE2 3.48Å; A525-E557 PolarHBondContact N-OE1 3.38Å; A525-E557 PolarHBondContact N-OE2 3.36Å; I553-E557 VanDerWaalsContact O-CB 3.26Å; I553-E557 WeakPolarHBondContact O-CB 3.45Å; I553-E557 PolarHBondContact O-N 2.84Å; E557-L559 VanDerWaalsContact C-N 3.26Å; E557-L559 PolarHBondContact O-N 3.41Å; E557-G560 PolarHBondContact O-N 3.22Å; E557-R561 WeakPolarHBondContact O-CB 3.42Å; E557-R561 PolarHBondContact O-N 3.35Å; E557-R561 IonicContact OE1-CZ 3.97Å; E557-R561 VanDerWaalsContact OE1-CZ 3.25Å; E557-R561 IonicContact OE1-NH1 2.89Å; E557-R561 PolarHBondContact OE1-NH1 3.49Å; E557-R561 IonicContact OE1-NH2 3.93Å; E557-R561 PolarHBondContact OE1-NH2 3.47Å; E557-I569 HydrophobicContact CB-CD1 3.39Å; E557-I569 HydrophobicContact CG-CD1 3.53Å; E557-I569 HydrophobicContact CG-CG1 4.2Å
558	G	81.8	Confident	82.5	Confident	37 Å²	37	27.6 Å²	27.6	38%	0.381	17%	0.167	S	C	.	.	H	α-helix	trans	-58.6	-41.5	177.7	0	0	0	0	0	111.6	M554 V555 S562	M554-G558 PolarHBondContact O-N 3.39Å; V555-G558 PolarHBondContact O-N 2.84Å; G558-S562 PolarHBondContact O-N 3.47Å; G558-S562 VanDerWaalsContact O-N 3.13Å; G558-S562 PolarHBondContact O-OG 3.24Å
559	L	83.9	Confident	82.9	Confident	13 Å²	13	26.4 Å²	26.4	7%	0.068	16%	0.158	C	C	.	.	H	α-helix	trans	-66.7	-49	173.9	179.5	59.3	0	0	0	111.9	I369 L373 P409 I412 V555 L556 E557 R561 S562 L563	I369-L559 HydrophobicContact CD1-CD2 3.94Å; I369-L559 HydrophobicContact CD1-CG 4.41Å; I369-L559 HydrophobicContact CG2-CD1 4.33Å; I369-L559 HydrophobicContact CG2-CD2 4.1Å; L373-L559 HydrophobicContact CD2-CD1 4.19Å; P409-L559 HydrophobicContact CG-CD1 4.14Å; P409-L559 HydrophobicContact CG-CD2 4.25Å; I412-L559 HydrophobicContact CD1-CD2 3.51Å; V555-L559 PolarHBondContact O-N 3.07Å; L556-L559 PolarHBondContact O-N 3.27Å; E557-L559 VanDerWaalsContact C-N 3.26Å; E557-L559 PolarHBondContact O-N 3.41Å; L559-R561 PolarHBondContact O-N 3.47Å; L559-S562 WeakPolarHBondContact O-CB 3.14Å; L559-S562 PolarHBondContact O-N 2.77Å; L559-L563 PolarHBondContact O-N 2.94Å
560	G	85.8	Confident	82.7	Confident	5 Å²	5	26.7 Å²	26.7	5%	0.052	16%	0.16	C	C	.	.	H	α-helix	trans	-57	-38.2	179.2	0	0	0	0	0	112.3	A386 L556 E557 L563 D564	A386-G560 WeakPolarHBondContact CB-O 3.43Å; L556-G560 PolarHBondContact O-N 3.41Å; E557-G560 PolarHBondContact O-N 3.22Å; G560-L563 WeakPolarHBondContact O-CB 3.31Å; G560-L563 PolarHBondContact O-N 3.41Å; G560-D564 PolarHBondContact O-N 2.92Å
561	R	84.6	Confident	82.8	Confident	34 Å²	34	30.6 Å²	30.6	13%	0.128	18%	0.181	C	C	.	.	H	α-helix	trans	-76.3	-27.2	175	-81.3	-164.2	173.7	120.1	15	115.7	I522 Q523 E557 L559 L563 D564 L567	I522-R561 PolarHBondContact O-NH2 2.9Å; Q523-R561 VanDerWaalsContact CB-NH1 3.25Å; Q523-R561 VanDerWaalsContact CG-NH1 3.25Å; E557-R561 WeakPolarHBondContact O-CB 3.42Å; E557-R561 PolarHBondContact O-N 3.35Å; E557-R561 IonicContact OE1-CZ 3.97Å; E557-R561 VanDerWaalsContact OE1-CZ 3.25Å; E557-R561 IonicContact OE1-NH1 2.89Å; E557-R561 PolarHBondContact OE1-NH1 3.49Å; E557-R561 IonicContact OE1-NH2 3.93Å; E557-R561 PolarHBondContact OE1-NH2 3.47Å; L559-R561 PolarHBondContact O-N 3.47Å; R561-L563 PolarHBondContact O-N 3Å; R561-D564 WeakPolarHBondContact CA-O 3.48Å; R561-D564 CarbonylContact O-C 3.47Å; R561-L567 HydrophobicContact CG-CB 4.33Å; R561-L567 PolarHBondContact NE-O 2.92Å; R561-L567 PolarHBondContact NH2-O 3.31Å; R561-L567 VanDerWaalsContact NH2-O 3.1Å
562	S	84.9	Confident	83.1	Confident	76 Å²	76	30.2 Å²	30.2	53%	0.531	18%	0.18	S	C	.	.	H	α-helix	trans	-67	-22.8	171.7	-57.1	0	0	0	0	110.9	G558 L559	G558-S562 PolarHBondContact O-N 3.47Å; G558-S562 VanDerWaalsContact O-N 3.13Å; G558-S562 PolarHBondContact O-OG 3.24Å; L559-S562 WeakPolarHBondContact O-CB 3.14Å; L559-S562 PolarHBondContact O-N 2.77Å
563	L	86.6	Confident	83.3	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-92	-45.7	173.3	-67.9	164.6	0	0	0	112.4	I369 Y372 L373 Q379 K382 I385 A386 L559 G560 R561	I369-L563 HydrophobicContact CD1-CD1 4.13Å; I369-L563 HydrophobicContact CG1-CD1 4.36Å; Y372-L563 WeakPolarHBondContact O-CD2 3.37Å; L373-L563 HydrophobicContact CD2-CD2 3.73Å; L373-L563 HydrophobicContact CD2-CG 3.83Å; Q379-L563 PolarHBondContact NE2-O 3.05Å; K382-L563 HydrophobicContact CB-CB 4.19Å; K382-L563 HydrophobicContact CB-CD2 4.12Å; K382-L563 WeakPolarHBondContact CB-O 3.48Å; K382-L563 HydrophobicContact CG-CD2 4.16Å; I385-L563 HydrophobicContact CB-CD1 4.18Å; I385-L563 HydrophobicContact CG2-CD1 3.51Å; A386-L563 HydrophobicContact CB-CB 3.9Å; A386-L563 HydrophobicContact CB-CD1 4.47Å; L559-L563 PolarHBondContact O-N 2.94Å; G560-L563 WeakPolarHBondContact O-CB 3.31Å; G560-L563 PolarHBondContact O-N 3.41Å; R561-L563 PolarHBondContact O-N 3Å
564	D	88.2	Confident	83.3	Confident	22 Å²	22	33.8 Å²	33.8	12%	0.118	20%	0.195	C	C	.	.			trans	-134	100.7	178.5	-177.2	12.2	0	0	0	112.1	Q383 A386 G560 R561 N566 L567	Q383-D564 HydrophobicContact CG-CB 3.97Å; A386-D564 HydrophobicContact CB-CB 3.84Å; G560-D564 PolarHBondContact O-N 2.92Å; R561-D564 WeakPolarHBondContact CA-O 3.48Å; R561-D564 CarbonylContact O-C 3.47Å; D564-N566 PolarHBondContact O-N 3.44Å; D564-N566 VanDerWaalsContact O-N 3.07Å; D564-N566 PolarHBondContact OD1-N 2.92Å; D564-L567 HydrophobicContact CB-CB 4.39Å; D564-L567 VanDerWaalsContact O-CB 3.23Å; D564-L567 WeakPolarHBondContact O-CB 3.3Å; D564-L567 PolarHBondContact O-N 3.09Å; D564-L567 VanDerWaalsContact O-N 3.13Å
565	P	84.6	Confident	83.5	Confident	83 Å²	83	36.7 Å²	36.7	54%	0.539	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24	-178.7	-26.9	35.7	0	0	0	114.9	L567	P565-L567 VanDerWaalsContact C-N 3.31Å
566	N	84.3	Confident	83.6	Confident	122 Å²	122	38.1 Å²	38.1	65%	0.652	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	4.8	-176.9	-63.1	-38.6	0	0	0	113.5	T521 D564 D568	T521-N566 WeakPolarHBondContact CG2-O 3.46Å; D564-N566 PolarHBondContact O-N 3.44Å; D564-N566 VanDerWaalsContact O-N 3.07Å; D564-N566 PolarHBondContact OD1-N 2.92Å; N566-D568 PolarHBondContact O-N 3.5Å
567	L	82.4	Confident	83.5	Confident	10 Å²	10	38 Å²	38	5%	0.052	22%	0.221	C	C	.	.			trans	-66.3	125.4	-179.4	-173.7	71.5	0	0	0	111.7	A386 V390 R561 D564 P565 L572	A386-L567 HydrophobicContact CB-CD2 4.44Å; V390-L567 HydrophobicContact CG2-CD1 3.94Å; V390-L567 HydrophobicContact CG2-CD2 3.44Å; V390-L567 VanDerWaalsContact CG2-CD2 3.44Å; V390-L567 HydrophobicContact CG2-CG 4.03Å; R561-L567 HydrophobicContact CG-CB 4.33Å; R561-L567 PolarHBondContact NE-O 2.92Å; R561-L567 PolarHBondContact NH2-O 3.31Å; R561-L567 VanDerWaalsContact NH2-O 3.1Å; D564-L567 HydrophobicContact CB-CB 4.39Å; D564-L567 VanDerWaalsContact O-CB 3.23Å; D564-L567 WeakPolarHBondContact O-CB 3.3Å; D564-L567 PolarHBondContact O-N 3.09Å; D564-L567 VanDerWaalsContact O-N 3.13Å; P565-L567 VanDerWaalsContact C-N 3.31Å; L567-L572 HydrophobicContact CD1-CD1 3.84Å
568	D	82.3	Confident	83.2	Confident	23 Å²	23	40.7 Å²	40.7	12%	0.123	24%	0.235	C	C	.	.			trans	-120.2	104	173.3	-166.1	-41	0	0	0	110.8	T521 I522 N566 L570 D571 L572	T521-D568 HydrophobicContact CG2-CB 4.39Å; I522-D568 PolarHBondContact N-OD2 3.01Å; N566-D568 PolarHBondContact O-N 3.5Å; D568-L570 PolarHBondContact OD1-N 3.02Å; D568-D571 HydrophobicContact CB-CB 4.03Å; D568-D571 PolarHBondContact O-N 3.27Å; D568-D571 PolarHBondContact OD1-N 3.06Å; D568-L572 WeakPolarHBondContact O-CG 3.19Å; D568-L572 PolarHBondContact O-N 2.99Å
569	I	82.6	Confident	82.2	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.031	25%	0.25	C	S	.	.	H	α-helix	trans	-68.1	-34.9	-179	-62.5	-173.5	0	0	0	111.7	V390 L393 L394 V524 E557 D571 L572 A573	V390-I569 HydrophobicContact CG1-CB 4.48Å; V390-I569 HydrophobicContact CG1-CG1 4.03Å; V390-I569 HydrophobicContact CG1-CG2 4.27Å; V390-I569 HydrophobicContact CG2-CD1 4.13Å; V390-I569 HydrophobicContact CG2-CG1 3.93Å; L393-I569 HydrophobicContact CD2-CD1 4.34Å; L394-I569 HydrophobicContact CD2-CG2 3.97Å; V524-I569 HydrophobicContact CG2-CB 4.41Å; E557-I569 HydrophobicContact CB-CD1 3.39Å; E557-I569 HydrophobicContact CG-CD1 3.53Å; E557-I569 HydrophobicContact CG-CG1 4.2Å; I569-D571 VanDerWaalsContact C-N 3.32Å; I569-L572 PolarHBondContact O-N 3.47Å; I569-A573 VanDerWaalsContact O-CB 3.27Å; I569-A573 WeakPolarHBondContact O-CB 3.48Å; I569-A573 PolarHBondContact O-N 3.24Å
570	L	80.4	Confident	80.6	Confident	8 Å²	8	51 Å²	51	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-38.8	-179.1	-73.4	173	0	0	0	110.6	F471 V474 V475 I522 V524 D568 A573 K574	F471-L570 HydrophobicContact CD1-CD2 4.23Å; V474-L570 HydrophobicContact CG1-CD1 4.17Å; V475-L570 HydrophobicContact CG2-CD2 4.25Å; I522-L570 HydrophobicContact CB-CD1 4.01Å; I522-L570 HydrophobicContact CD1-CD1 3.7Å; I522-L570 HydrophobicContact CG1-CD1 4.44Å; I522-L570 HydrophobicContact CG2-CD1 3.66Å; V524-L570 HydrophobicContact CG2-CD1 3.84Å; V524-L570 HydrophobicContact CG2-CD2 4.28Å; V524-L570 HydrophobicContact CG2-CG 3.54Å; D568-L570 PolarHBondContact OD1-N 3.02Å; L570-A573 PolarHBondContact O-N 3Å; L570-K574 WeakPolarHBondContact O-CG 3.26Å; L570-K574 PolarHBondContact O-N 3.45Å; L570-K574 VanDerWaalsContact O-N 3.1Å
571	D	81.2	Confident	78.5	Confident	82 Å²	82	53.3 Å²	53.3	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-45.3	175	-164	59.7	0	0	0	111.8	D568 I569 A573 K574	D568-D571 HydrophobicContact CB-CB 4.03Å; D568-D571 PolarHBondContact O-N 3.27Å; D568-D571 PolarHBondContact OD1-N 3.06Å; I569-D571 VanDerWaalsContact C-N 3.32Å; D571-A573 VanDerWaalsContact C-N 3.28Å; D571-A573 PolarHBondContact O-N 3.29Å; D571-K574 WeakPolarHBondContact O-CB 3.32Å; D571-K574 PolarHBondContact O-N 3.13Å; D571-K574 WeakPolarHBondContact OD1-CD 3.5Å; D571-K574 WeakPolarHBondContact OD1-CE 3.47Å; D571-K574 IonicContact OD1-NZ 2.97Å; D571-K574 PolarHBondContact OD1-NZ 3.41Å
572	L	82.8	Confident	76.1	Confident	35 Å²	35	55.5 Å²	55.5	18%	0.183	31%	0.314	C	S	.	.	H	α-helix	trans	-65.9	-28.9	175.9	-64.5	171.1	0	0	0	112.9	V390 L394 L567 D568 I569 P575	V390-L572 HydrophobicContact CB-CD1 4.24Å; V390-L572 HydrophobicContact CG1-CB 4.31Å; V390-L572 HydrophobicContact CG1-CD1 3.67Å; L394-L572 HydrophobicContact CD1-CB 3.85Å; L567-L572 HydrophobicContact CD1-CD1 3.84Å; D568-L572 WeakPolarHBondContact O-CG 3.19Å; D568-L572 PolarHBondContact O-N 2.99Å; I569-L572 PolarHBondContact O-N 3.47Å; L572-P575 WeakPolarHBondContact O-CD 3.45Å
573	A	83.9	Confident	73.7	Confident	2 Å²	2	56.5 Å²	56.5	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-78.7	-23.9	177.9	0	0	0	0	0	113.8	L394 F398 I569 L570 D571 L576 L577	L394-A573 HydrophobicContact CD1-CB 4.3Å; L394-A573 HydrophobicContact CD2-CB 3.71Å; F398-A573 HydrophobicContact CE2-CB 4.41Å; I569-A573 VanDerWaalsContact O-CB 3.27Å; I569-A573 WeakPolarHBondContact O-CB 3.48Å; I569-A573 PolarHBondContact O-N 3.24Å; L570-A573 PolarHBondContact O-N 3Å; D571-A573 VanDerWaalsContact C-N 3.28Å; D571-A573 PolarHBondContact O-N 3.29Å; A573-L576 PolarHBondContact O-N 3.44Å; A573-L577 HydrophobicContact CB-CD1 3.98Å; A573-L577 HydrophobicContact CB-CG 4.47Å; A573-L577 WeakPolarHBondContact O-CG 3.39Å; A573-L577 PolarHBondContact O-N 3.28Å
574	K	83.2	Confident	71.2	Confident	83 Å²	83	63.6 Å²	63.6	36%	0.361	36%	0.358	S	S	.	.	H	α-helix	trans	-45.7	-53.2	-179.2	-77.9	170.7	-171.8	168.8	0	113.9	V475 L570 D571 L576 L577 L578	V475-K574 HydrophobicContact CG1-CG 3.77Å; L570-K574 WeakPolarHBondContact O-CG 3.26Å; L570-K574 PolarHBondContact O-N 3.45Å; L570-K574 VanDerWaalsContact O-N 3.1Å; D571-K574 WeakPolarHBondContact O-CB 3.32Å; D571-K574 PolarHBondContact O-N 3.13Å; D571-K574 WeakPolarHBondContact OD1-CD 3.5Å; D571-K574 WeakPolarHBondContact OD1-CE 3.47Å; D571-K574 IonicContact OD1-NZ 2.97Å; D571-K574 PolarHBondContact OD1-NZ 3.41Å; K574-L576 PolarHBondContact O-N 2.95Å; K574-L577 PolarHBondContact O-N 3.03Å; K574-L578 HydrophobicContact CB-CD1 4.25Å; K574-L578 HydrophobicContact CG-CD1 4.49Å; K574-L578 VanDerWaalsContact O-CB 3.27Å; K574-L578 WeakPolarHBondContact O-CB 3.32Å; K574-L578 VanDerWaalsContact O-CG 3.31Å; K574-L578 WeakPolarHBondContact O-CG 3.4Å; K574-L578 PolarHBondContact O-N 2.9Å
575	P	84.2	Confident	68.4	Low	77 Å²	77	72.6 Å²	72.6	50%	0.5	41%	0.405	S	S	.	.	H	α-helix	trans	-63.2	-29.4	-178.3	23.1	-34	0	0	0	113.3	L572 K579	L572-P575 WeakPolarHBondContact O-CD 3.45Å; P575-K579 VanDerWaalsContact O-CB 3.22Å; P575-K579 WeakPolarHBondContact O-CB 3.46Å; P575-K579 VanDerWaalsContact O-CG 3.27Å; P575-K579 WeakPolarHBondContact O-CG 3.34Å; P575-K579 PolarHBondContact O-N 3.23Å
576	L	81	Confident	67.6	Low	66 Å²	66	72.1 Å²	72.1	35%	0.346	40%	0.398	S	S	.	.	H	α-helix	trans	-78.2	-34.8	178.2	-63.7	172.8	0	0	0	112.3	L394 V399 A573 K574	L394-L576 HydrophobicContact CB-CD1 3.7Å; L394-L576 HydrophobicContact CD1-CD1 4.32Å; V399-L576 HydrophobicContact CG2-CD2 4.27Å; A573-L576 PolarHBondContact O-N 3.44Å; K574-L576 PolarHBondContact O-N 2.95Å
577	L	80.3	Confident	66.7	Low	10 Å²	10	69.5 Å²	69.5	5%	0.052	39%	0.385	C	S	.	.	H	α-helix	trans	-79.4	-39.2	179.5	-67.6	172	0	0	0	112.2	F398 K468 F471 V475 A573 K574	F398-L577 HydrophobicContact CD1-CD2 3.74Å; F398-L577 HydrophobicContact CE1-CD2 3.48Å; F398-L577 VanDerWaalsContact CE1-CD2 3.48Å; F398-L577 HydrophobicContact CG-CD2 4.39Å; F398-L577 HydrophobicContact CZ-CD2 3.94Å; K468-L577 HydrophobicContact CG-CD2 4.48Å; F471-L577 HydrophobicContact CB-CD1 3.91Å; F471-L577 HydrophobicContact CB-CD2 4.09Å; V475-L577 HydrophobicContact CG2-CD1 4.04Å; A573-L577 HydrophobicContact CB-CD1 3.98Å; A573-L577 HydrophobicContact CB-CG 4.47Å; A573-L577 WeakPolarHBondContact O-CG 3.39Å; A573-L577 PolarHBondContact O-N 3.28Å; K574-L577 PolarHBondContact O-N 3.03Å
578	L	78.1	Confident	65.8	Low	57 Å²	57	72.8 Å²	72.8	30%	0.298	40%	0.403	S	S	.	.	H	α-helix	trans	-92.8	-12.5	-172	-59.5	175.8	0	0	0	113.9	T472 L476 K574 N580 C581	T472-L578 HydrophobicContact CG2-CD2 4.14Å; L476-L578 HydrophobicContact CD2-CD2 4.47Å; K574-L578 HydrophobicContact CB-CD1 4.25Å; K574-L578 HydrophobicContact CG-CD1 4.49Å; K574-L578 VanDerWaalsContact O-CB 3.27Å; K574-L578 WeakPolarHBondContact O-CB 3.32Å; K574-L578 VanDerWaalsContact O-CG 3.31Å; K574-L578 WeakPolarHBondContact O-CG 3.4Å; K574-L578 PolarHBondContact O-N 2.9Å; L578-N580 PolarHBondContact O-N 3.42Å; L578-N580 VanDerWaalsContact O-N 3.1Å; L578-C581 WeakPolarHBondContact O-CB 3.34Å; L578-C581 PolarHBondContact O-N 2.91Å
579	K	61.4	Low	64.8	Low	162 Å²	162	75.7 Å²	75.7	70%	0.704	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.7	176.7	-110.1	178.5	174.6	-179.5	0	113.4	P575	P575-K579 VanDerWaalsContact O-CB 3.22Å; P575-K579 WeakPolarHBondContact O-CB 3.46Å; P575-K579 VanDerWaalsContact O-CG 3.27Å; P575-K579 WeakPolarHBondContact O-CG 3.34Å; P575-K579 PolarHBondContact O-N 3.23Å
580	N	50.3	Low	63.7	Low	105 Å²	105	80.1 Å²	80.1	56%	0.561	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-7.1	176.4	-73.1	-3	0	0	0	114.3	L578 S583	L578-N580 PolarHBondContact O-N 3.42Å; L578-N580 VanDerWaalsContact O-N 3.1Å; N580-S583 PolarHBondContact O-OG 3.47Å
581	C	41.1	Very low	62.6	Low	53 Å²	53	84.9 Å²	84.9	36%	0.358	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-25.2	176.2	-69.3	0	0	0	0	112.5	L578 S583 L584 L585	L578-C581 WeakPolarHBondContact O-CB 3.34Å; L578-C581 PolarHBondContact O-N 2.91Å; C581-S583 VanDerWaalsContact C-N 3.26Å; C581-S583 PolarHBondContact O-N 3.31Å; C581-L584 PolarHBondContact O-N 3.16Å; C581-L585 PolarHBondContact O-N 3Å
582	A	35.3	Very low	61.3	Low	80 Å²	80	85.1 Å²	85.1	66%	0.661	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-13.6	177.1	0	0	0	0	0	113.6
583	S	34.1	Very low	59.6	Low	97 Å²	97	88.9 Å²	88.9	68%	0.678	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	4.8	170.7	56.6	0	0	0	0	113.2	N580 C581	N580-S583 PolarHBondContact O-OG 3.47Å; C581-S583 VanDerWaalsContact C-N 3.26Å; C581-S583 PolarHBondContact O-N 3.31Å
584	L	33.4	Very low	57.6	Low	152 Å²	152	96.2 Å²	96.2	80%	0.796	54%	0.536	S	S	*	.			trans	-125.3	-0.4	-178.4	-88.3	162.1	0	0	0	113.4	C581	C581-L584 PolarHBondContact O-N 3.16Å
585	L	28.9	Very low	55.3	Low	212 Å²	212	97.4 Å²	97.4	100%	1.11	55%	0.551	S	S	*	*			trans	-111.1	0	164.3	-76.7	169.2	0	0	0	107.9	C581	C581-L585 PolarHBondContact O-N 3Å

Retrieved 585 of 585 residues in 443.6 ms (Link to these results)

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