A0A087YD20_POEFO Loading...

Extracellular matrix protein 1b

AlphaFold DB , UniProt , Accession A0A087YD20, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 483 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	35.7	Very low	33.8	Very low	249 Å²	249	131.1 Å²	131.1	100%	1.227	81%	0.811	S	S	*	*				0	118.6	0	-74.4	165.9	80.8	0	0	107.5
2	G	33.1	Very low	33.8	Very low	68 Å²	68	127.6 Å²	127.6	70%	0.701	80%	0.804	S	S	*	*			trans	67.3	112.1	170.5	0	0	0	0	0	116.8
3	S	32.5	Very low	33.5	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	80%	0.801	S	S	*	*			cis	53.7	125	46.2	88.2	0	0	0	0	111.5
4	S	35.3	Very low	33.2	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	80%	0.8	S	S	*	*			cis	-172.1	155.2	22.5	-90.5	0	0	0	0	110.6
5	W	30.7	Very low	33.1	Very low	251 Å²	251	129.5 Å²	129.5	95%	0.951	80%	0.8	S	S	*	*			trans	83.6	138.3	137.2	-80.7	38.4	0	0	0	122.2
6	A	35.7	Very low	32.9	Very low	82 Å²	82	128 Å²	128	68%	0.678	79%	0.79	S	S	*	*			trans	-106.5	177.9	-172.9	0	0	0	0	0	111.5
7	L	37.5	Very low	32.7	Very low	161 Å²	161	131.4 Å²	131.4	84%	0.843	79%	0.791	S	S	*	*			trans	100.2	115.3	148.8	-71.9	161.1	0	0	0	119.5
8	V	35	Very low	32.5	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.685	80%	0.795	S	S	*	*				108.9	113.4	118.5	167.5	0	0	0	0	119.4
9	C	31.1	Very low	32.5	Very low	118 Å²	118	132.2 Å²	132.2	80%	0.797	80%	0.795	S	S	*	*			trans	57.5	151.2	136.7	-65.4	0	0	0	0	120.2
10	A	31.8	Very low	32.6	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	80%	0.799	S	S	*	*			cis	-170.4	166.8	-8.1	0	0	0	0	0	108.2
11	A	33.1	Very low	32.6	Very low	97 Å²	97	129.6 Å²	129.6	80%	0.802	79%	0.794	S	S	*	*			trans	84.3	121.5	148.3	0	0	0	0	0	121.8
12	A	33.7	Very low	32.6	Very low	89 Å²	89	123.8 Å²	123.8	74%	0.736	78%	0.777	S	S	*	*			trans	73.7	111.5	136.5	0	0	0	0	0	120.3
13	S	30.7	Very low	32.9	Very low	108 Å²	108	129 Å²	129	76%	0.755	78%	0.78	S	S	*	*				161.1	155.8	103.2	-68.3	0	0	0	0	112.8
14	L	29.4	Very low	32.9	Very low	151 Å²	151	130.5 Å²	130.5	79%	0.791	78%	0.779	S	S	*	*			trans	97.8	101.9	155.9	-63.5	158.4	0	0	0	119.9
15	L	30.5	Very low	33.4	Very low	153 Å²	153	131 Å²	131	80%	0.801	79%	0.789	S	S	*	*				28.8	127.4	116	-71.4	165.1	0	0	0	116.4
16	V	30.7	Very low	33.9	Very low	105 Å²	105	127.9 Å²	127.9	64%	0.636	79%	0.785	S	S	*	*				173.5	143.9	82.6	161	0	0	0	0	111.6
17	F	29.5	Very low	34.1	Very low	186 Å²	186	130.1 Å²	130.1	82%	0.816	79%	0.791	S	S	*	*			trans	53.2	123.7	158	-60.5	-49	0	0	0	123
18	L	29.1	Very low	34.3	Very low	165 Å²	165	127.9 Å²	127.9	86%	0.864	79%	0.787	S	S	*	*				179.3	120	103.6	-91.9	154.9	0	0	0	112.5
19	S	32.3	Very low	34.4	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	80%	0.795	S	S	*	*			trans	-57.2	140.1	158.3	42	0	0	0	0	112.4
20	S	35	Very low	34.6	Very low	124 Å²	124	133.8 Å²	133.8	87%	0.867	80%	0.8	S	S	*	*			trans	-134.7	124.2	152.5	70.6	0	0	0	0	111
21	A	32.4	Very low	34.7	Very low	86 Å²	86	140.6 Å²	140.6	71%	0.711	81%	0.806	S	S	*	*			trans	-78.5	141.1	179.2	0	0	0	0	0	110.5	K23	A21-K23 PolarHBondContact O-N 3.13Å
22	C	35.6	Very low	34.5	Very low	127 Å²	127	144.8 Å²	144.8	86%	0.858	81%	0.809	S	S	*	*			trans	-71.1	127.4	169.3	-143	0	0	0	0	108.8
23	K	38.4	Very low	34.4	Very low	178 Å²	178	146.4 Å²	146.4	77%	0.774	81%	0.81	S	S	*	*			trans	-109	137.7	175.1	-75	175.5	177	172.2	0	107.9	A21	A21-K23 PolarHBondContact O-N 3.13Å
24	D	34.1	Very low	34.4	Very low	146 Å²	146	147.7 Å²	147.7	78%	0.781	81%	0.813	S	S	*	*			trans	95.3	133.6	173.4	-51.6	-29	0	0	0	116.6
25	A	43.9	Very low	34.5	Very low	107 Å²	107	147.8 Å²	147.8	88%	0.884	81%	0.813	S	S	*	*	S	Bend	trans	-104.2	24	-162.6	0	0	0	0	0	114.2
26	E	43	Very low	34.5	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	81%	0.811	S	S	*	*	S	Bend	trans	-119.9	6.4	-177.9	-89.2	-178.7	166.4	0	0	115.3
27	T	39.9	Very low	35.2	Very low	129 Å²	129	145.7 Å²	145.7	79%	0.791	81%	0.813	S	S	*	*	S	Bend	trans	-124.5	8.6	-178.4	26.6	0	0	0	0	115.8
28	C	40.8	Very low	35.3	Very low	113 Å²	113	143.7 Å²	143.7	76%	0.764	81%	0.811	S	S	*	*			trans	-103.8	38.7	176.1	-63.8	0	0	0	0	113.5
29	L	37	Very low	35.2	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-87.3	124	170.3	-73.2	176.5	0	0	0	110.9	R31	L29-R31 PolarHBondContact O-N 3.09Å
30	Q	35.7	Very low	35.5	Very low	191 Å²	191	145 Å²	145	89%	0.893	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.4	125.6	173.7	-170.4	164.1	-10.6	0	0	109.7	E32	Q30-E32 PolarHBondContact O-N 3.4Å
31	R	33.1	Very low	35.7	Very low	233 Å²	233	142.6 Å²	142.6	88%	0.879	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.4	118.3	-177.9	-149.4	-179.8	-164	-166.2	3.7	109.6	L29	L29-R31 PolarHBondContact O-N 3.09Å
32	E	29.8	Very low	35.5	Very low	186 Å²	186	148 Å²	148	87%	0.869	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.6	170.2	-131.2	171.1	-167.3	0	0	108.7	Q30	Q30-E32 PolarHBondContact O-N 3.4Å
33	V	32	Very low	35.8	Very low	123 Å²	123	148.6 Å²	148.6	75%	0.745	81%	0.813	S	S	*	*			trans	-93.1	108.6	177.5	178	0	0	0	0	108.3	I35	V33-I35 HydrophobicContact CG1-CG1 4.28Å
34	T	30.3	Very low	35.5	Very low	134 Å²	134	148.2 Å²	148.2	82%	0.822	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.4	121.7	169.5	-37.1	0	0	0	0	109.1
35	I	31.8	Very low	35.3	Very low	154 Å²	154	150 Å²	150	79%	0.79	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-103.2	121.6	169.6	-62.7	171.1	0	0	0	107.7	V33	V33-I35 HydrophobicContact CG1-CG1 4.28Å
36	S	29.8	Very low	34.6	Very low	109 Å²	109	153.3 Å²	153.3	76%	0.762	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-98.8	151.8	168.9	-127.6	0	0	0	0	110.2
37	P	45.7	Very low	34.2	Very low	105 Å²	105	149.5 Å²	149.5	68%	0.682	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95.4	136.9	-167.1	35.8	-28.8	0	0	0	111.9
38	D	30.6	Very low	33.7	Very low	143 Å²	143	150.6 Å²	150.6	77%	0.765	81%	0.811	S	S	*	*			trans	-175.4	111.4	146.5	-93.8	-24.5	0	0	0	113.3
39	F	27.2	Very low	33.3	Very low	190 Å²	190	154.4 Å²	154.4	83%	0.833	82%	0.815	S	S	*	*			trans	63.3	156.4	149.3	-73.5	-88.4	0	0	0	122.6
40	P	39.5	Very low	33.2	Very low	115 Å²	115	155.8 Å²	155.8	75%	0.747	82%	0.82	S	S	*	*				-134	158.1	-60.2	34.7	-16.2	0	0	0	114
41	G	38.2	Very low	33.5	Very low	75 Å²	75	155.1 Å²	155.1	77%	0.773	82%	0.819	S	S	*	*			trans	50.7	99.2	147.3	0	0	0	0	0	119.6
42	Q	29.5	Very low	33.7	Very low	198 Å²	198	153.6 Å²	153.6	93%	0.925	82%	0.822	S	S	*	*			trans	-153.2	125.4	140.1	-108.4	164.7	27	0	0	109.9
43	V	41.8	Very low	34.4	Very low	141 Å²	141	155.7 Å²	155.7	86%	0.855	82%	0.822	S	S	*	*			trans	-59.5	127.8	176.7	174.3	0	0	0	0	109.5
44	L	31.1	Very low	34.6	Very low	169 Å²	169	159 Å²	159	89%	0.885	83%	0.829	S	S	*	*			trans	-148.6	127.2	157.8	-146.7	77.2	0	0	0	109.5
45	E	31.6	Very low	35.3	Very low	184 Å²	184	158 Å²	158	86%	0.86	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-50.5	136.3	-176.4	-77.8	162.7	117	0	0	114.2
46	E	29.1	Very low	35.6	Very low	176 Å²	176	156.6 Å²	156.6	82%	0.822	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75	129.9	165.8	-125.3	-180	170.4	0	0	109.7
47	P	33.7	Very low	36.2	Very low	106 Å²	106	156.4 Å²	156.4	69%	0.688	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.2	118.5	154.6	30.1	-23.2	0	0	0	108.5	F49	P47-F49 PolarHBondContact O-N 2.71Å; P47-F49 VanDerWaalsContact O-N 3.1Å
48	D	29.9	Very low	36.3	Very low	152 Å²	152	155 Å²	155	81%	0.813	80%	0.799	S	S	*	*			trans	-43.2	112.8	171.5	-94.8	-38.4	0	0	0	111.5	M50	D48-M50 PolarHBondContact O-N 3.47Å; D48-M50 VanDerWaalsContact O-N 3.12Å
49	F	32.3	Very low	36.9	Very low	194 Å²	194	156.3 Å²	156.3	85%	0.851	80%	0.8	S	S	*	*			trans	-67.3	106.6	163.2	-87.4	-91	0	0	0	108.3	P47 M51	P47-F49 PolarHBondContact O-N 2.71Å; P47-F49 VanDerWaalsContact O-N 3.1Å; F49-M51 PolarHBondContact O-N 3.17Å
50	M	34.8	Very low	37.6	Very low	194 Å²	194	155.4 Å²	155.4	96%	0.956	80%	0.796	S	S	*	*			trans	-62.8	93.6	170.6	-70.5	-125.1	-121.5	0	0	110.7	D48	D48-M50 PolarHBondContact O-N 3.47Å; D48-M50 VanDerWaalsContact O-N 3.12Å
51	M	41.3	Very low	37.6	Very low	177 Å²	177	156 Å²	156	87%	0.872	79%	0.793	S	S	*	*			trans	-82	116.7	161.2	-77.4	-88.2	-82.8	0	0	108.3	F49 R53	F49-M51 PolarHBondContact O-N 3.17Å; M51-R53 PolarHBondContact O-N 3.44Å
52	Q	37.7	Very low	37.6	Very low	201 Å²	201	158.2 Å²	158.2	94%	0.939	79%	0.787	S	S	*	*			trans	-71	110.2	174.9	-136.2	173.1	-8.1	0	0	108.8
53	R	45.3	Very low	38.2	Very low	230 Å²	230	156.1 Å²	156.1	87%	0.868	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-81.8	133.1	173.9	-172.7	175.2	-179	174.3	-0.2	109.3	M51 V55	M51-R53 PolarHBondContact O-N 3.44Å; R53-V55 PolarHBondContact O-N 2.92Å
54	E	35.6	Very low	38.1	Very low	191 Å²	191	156.2 Å²	156.2	89%	0.893	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.2	124.8	172.2	-68.9	179.8	164.2	0	0	109.5
55	V	45.6	Very low	38.4	Very low	115 Å²	115	155.3 Å²	155.3	70%	0.697	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-99	118.5	170.7	-179.6	0	0	0	0	107.1	R53 L57	R53-V55 PolarHBondContact O-N 2.92Å; V55-L57 HydrophobicContact CG1-CD2 4.24Å; V55-L57 HydrophobicContact CG1-CG 4.5Å; V55-L57 PolarHBondContact O-N 3.39Å
56	D	38.3	Very low	38.6	Very low	123 Å²	123	153.5 Å²	153.5	66%	0.658	76%	0.762	S	S	*	*			trans	-73.9	109.3	173.3	-171.6	-1.1	0	0	0	109.1	S58	D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 WeakPolarHBondContact OD1-CB 3.41Å; D56-S58 PolarHBondContact OD1-N 3.02Å; D56-S58 VanDerWaalsContact OD1-N 3.13Å; D56-S58 PolarHBondContact OD1-OG 3.3Å; D56-S58 PolarHBondContact OD2-OG 2.84Å
57	L	41.7	Very low	39	Very low	105 Å²	105	152.5 Å²	152.5	55%	0.55	76%	0.762	S	S	.	*			trans	-92.8	13	-179.3	-71.4	172.6	0	0	0	112.8	V55 E59 F60	V55-L57 HydrophobicContact CG1-CD2 4.24Å; V55-L57 HydrophobicContact CG1-CG 4.5Å; V55-L57 PolarHBondContact O-N 3.39Å; L57-E59 PolarHBondContact O-N 3.34Å; L57-F60 HydrophobicContact CD2-CB 4.48Å; L57-F60 HydrophobicContact CD2-CD2 3.87Å; L57-F60 HydrophobicContact CD2-CG 4.45Å; L57-F60 PolarHBondContact O-N 3.46Å; L57-F60 VanDerWaalsContact O-N 3.12Å
58	S	47.5	Very low	38.9	Very low	76 Å²	76	153.1 Å²	153.1	53%	0.531	76%	0.764	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-18	175.9	51.8	0	0	0	0	113.5	D56	D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 WeakPolarHBondContact OD1-CB 3.41Å; D56-S58 PolarHBondContact OD1-N 3.02Å; D56-S58 VanDerWaalsContact OD1-N 3.13Å; D56-S58 PolarHBondContact OD1-OG 3.3Å; D56-S58 PolarHBondContact OD2-OG 2.84Å
59	E	43.8	Very low	39.4	Very low	170 Å²	170	153.9 Å²	153.9	79%	0.794	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-19.4	170.9	-82	-172.7	157.1	0	0	114.7	L57	L57-E59 PolarHBondContact O-N 3.34Å
60	F	40.6	Very low	39.2	Very low	171 Å²	171	153.4 Å²	153.4	75%	0.75	76%	0.763	S	S	*	*	S	Bend	trans	-92.3	-4.6	-175.6	-87.7	-82.7	0	0	0	114.7	L57	L57-F60 HydrophobicContact CD2-CB 4.48Å; L57-F60 HydrophobicContact CD2-CD2 3.87Å; L57-F60 HydrophobicContact CD2-CG 4.45Å; L57-F60 PolarHBondContact O-N 3.46Å; L57-F60 VanDerWaalsContact O-N 3.12Å
61	L	40.4	Very low	39.4	Very low	128 Å²	128	155 Å²	155	67%	0.67	76%	0.758	S	S	*	*			trans	-124.8	44.3	-176.6	-63.7	177.2	0	0	0	112.8	F63	L61-F63 PolarHBondContact O-N 3.13Å
62	N	38.3	Very low	38.9	Very low	122 Å²	122	156.3 Å²	156.3	65%	0.652	76%	0.759	S	S	*	*			trans	-77.6	103.4	163	-78.2	-28.8	0	0	0	109.2	D64	N62-D64 PolarHBondContact O-N 3.22Å
63	F	42.2	Very low	38.9	Very low	153 Å²	153	155.9 Å²	155.9	67%	0.671	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-75.3	-2.3	-176.6	-106.6	-91.8	0	0	0	114.6	L61	L61-F63 PolarHBondContact O-N 3.13Å
64	D	38.9	Very low	38.2	Very low	144 Å²	144	152.8 Å²	152.8	77%	0.77	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-84.1	-15	-175.1	-76.7	-47.4	0	0	0	114.6	N62	N62-D64 PolarHBondContact O-N 3.22Å
65	D	37.2	Very low	38.2	Very low	150 Å²	150	153.1 Å²	153.1	80%	0.802	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-88.1	-5.3	-179.7	-102	-8.6	0	0	0	114.5
66	L	36.3	Very low	37.8	Very low	145 Å²	145	154 Å²	154	76%	0.759	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-91.6	2.9	-178	-76.8	171.7	0	0	0	114.7
67	L	38.2	Very low	37.5	Very low	155 Å²	155	151.3 Å²	151.3	81%	0.812	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-104.9	5.8	-179	-73	175.5	0	0	0	115.2
68	T	31.9	Very low	37.7	Very low	119 Å²	119	152.9 Å²	152.9	73%	0.73	78%	0.783	S	S	*	*			trans	-102.6	89.4	174.2	-41.7	0	0	0	0	111.2	Q70	T68-Q70 PolarHBondContact O-N 3.12Å
69	E	38.7	Very low	37.2	Very low	168 Å²	168	152.6 Å²	152.6	79%	0.785	79%	0.791	S	S	*	*			trans	-51.3	120.5	160	-107.5	-103.5	159.2	0	0	110.3
70	Q	29.9	Very low	36.9	Very low	184 Å²	184	156.4 Å²	156.4	86%	0.86	80%	0.798	S	S	*	*			trans	-145.4	91.1	150.3	-108.9	-175.1	3.8	0	0	111.4	T68	T68-Q70 PolarHBondContact O-N 3.12Å
71	R	38	Very low	37.2	Very low	228 Å²	228	152.3 Å²	152.3	86%	0.86	80%	0.804	S	S	*	*			trans	18.9	108.8	132.6	-109.4	-180	-178.5	-173.6	1	116
72	K	30	Very low	37.3	Very low	204 Å²	204	157.2 Å²	157.2	89%	0.887	81%	0.814	S	S	*	*			trans	-137.5	119.5	144.8	-93.8	-176.5	177.9	175.3	0	109.8
73	E	38.5	Very low	37.5	Very low	193 Å²	193	156.8 Å²	156.8	90%	0.902	82%	0.817	S	S	*	*			trans	-65.3	135.5	166.5	-71.5	177.6	131.9	0	0	109.6
74	D	31.6	Very low	37.6	Very low	165 Å²	165	154.1 Å²	154.1	88%	0.882	82%	0.818	S	S	*	*			trans	-140.2	133	159.3	-99.6	-35.9	0	0	0	111.1
75	K	34.4	Very low	38	Very low	198 Å²	198	156.3 Å²	156.3	86%	0.861	82%	0.821	S	S	*	*			trans	-75.1	158.6	-175	-75.1	-177.4	177.2	178	0	112.7
76	P	36.3	Very low	38.3	Very low	132 Å²	132	159.4 Å²	159.4	86%	0.857	82%	0.821	S	S	*	*			trans	-87.4	132.5	-173.3	33.9	-31.2	0	0	0	112.7
77	G	32.6	Very low	38.9	Very low	68 Å²	68	158 Å²	158	70%	0.701	82%	0.821	S	S	*	*			trans	-115.6	140.5	164	0	0	0	0	0	110.7
78	P	47.3	Very low	39.7	Very low	138 Å²	138	161.3 Å²	161.3	90%	0.896	82%	0.823	S	S	*	*			trans	-91	134.2	-172.1	34.6	-30.4	0	0	0	111.3
79	G	35.3	Very low	40.3	Very low	69 Å²	69	159.9 Å²	159.9	71%	0.711	82%	0.823	S	S	*	*			trans	175.6	91.9	173.2	0	0	0	0	0	117.8
80	R	37.3	Very low	40.8	Very low	251 Å²	251	161 Å²	161	95%	0.947	83%	0.825	S	S	*	*			trans	73.9	118	145.7	-61.5	-179.8	-179.7	-160.4	-1.3	117.7	R82	R80-R82 PolarHBondContact O-N 3.14Å
81	G	48.6	Very low	41.9	Very low	84 Å²	84	156.1 Å²	156.1	87%	0.866	81%	0.81	S	S	*	*			trans	-63	122	-176.5	0	0	0	0	0	113.4
82	R	41.1	Very low	42.6	Very low	231 Å²	231	150.3 Å²	150.3	87%	0.872	80%	0.802	S	S	*	*			trans	-96.1	141.7	145.9	-78	178.5	169.6	-167	-3.2	107.1	R80 S84	R80-R82 PolarHBondContact O-N 3.14Å; R82-S84 PolarHBondContact O-N 3.29Å
83	P	43.2	Very low	43.9	Very low	113 Å²	113	146.7 Å²	146.7	73%	0.734	80%	0.799	S	S	*	*			trans	-59.1	108.1	169.1	24.9	-30.5	0	0	0	107.2	F85	P83-F85 VanDerWaalsContact C-N 3.33Å; P83-F85 PolarHBondContact O-N 3.3Å
84	S	44.4	Very low	45	Very low	97 Å²	97	143 Å²	143	68%	0.678	78%	0.782	S	S	*	*			trans	-66.2	99.1	173.6	59.9	0	0	0	0	106.7	R82 R86	R82-S84 PolarHBondContact O-N 3.29Å; S84-R86 PolarHBondContact O-N 2.05Å
85	F	46.1	Very low	47	Very low	190 Å²	190	140 Å²	140	83%	0.833	77%	0.773	S	S	*	*			trans	-63.8	86	151.1	-77.2	-89	0	0	0	105.5	P83 P87	P83-F85 VanDerWaalsContact C-N 3.33Å; P83-F85 PolarHBondContact O-N 3.3Å; F85-P87 VanDerWaalsContact O-CD 3.26Å; F85-P87 WeakPolarHBondContact O-CD 3.45Å
86	R	44.9	Very low	49.5	Very low	216 Å²	216	133 Å²	133	82%	0.815	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-56.8	120.1	160	-83.4	-173.1	177	-168.1	-1.3	104.7	S84 R88	S84-R86 PolarHBondContact O-N 2.05Å; R86-R88 PolarHBondContact O-N 2.9Å
87	P	47.4	Very low	52	Low	115 Å²	115	130.8 Å²	130.8	75%	0.747	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-52.2	116.3	160.4	-15.7	28.6	0	0	0	104.3	F85 A89	F85-P87 VanDerWaalsContact O-CD 3.26Å; F85-P87 WeakPolarHBondContact O-CD 3.45Å; P87-A89 PolarHBondContact O-N 3.18Å
88	R	55.6	Low	54.9	Low	225 Å²	225	128.4 Å²	128.4	85%	0.849	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-51.8	116.7	172.1	-166.3	176.6	-70.1	-152.7	-0.9	103.9	R86 F90	R86-R88 PolarHBondContact O-N 2.9Å; R88-F90 PolarHBondContact O-N 3.1Å
89	A	45.4	Very low	57	Low	89 Å²	89	124.2 Å²	124.2	74%	0.736	67%	0.668	S	S	*	*			trans	-47	113	-179.4	0	0	0	0	0	106	P87 P91	P87-A89 PolarHBondContact O-N 3.18Å; A89-P91 VanDerWaalsContact O-CD 3.28Å; A89-P91 WeakPolarHBondContact O-CD 3.35Å
90	F	48	Very low	59.8	Low	190 Å²	190	121.5 Å²	121.5	83%	0.833	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-57.3	119.8	177.4	-87.4	-93	0	0	0	104.3	R88	R88-F90 PolarHBondContact O-N 3.1Å
91	P	53.7	Low	62.5	Low	82 Å²	82	109.8 Å²	109.8	53%	0.532	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-52	147	168.3	22.3	-29.8	0	0	0	107.1	A89	A89-P91 VanDerWaalsContact O-CD 3.28Å; A89-P91 WeakPolarHBondContact O-CD 3.35Å
92	P	53.7	Low	64.7	Low	107 Å²	107	106.6 Å²	106.6	70%	0.695	56%	0.556	S	S	*	*	S	Bend	trans	-46.9	137.2	177.7	19.6	-31.1	0	0	0	108.5	Q94	P92-Q94 PolarHBondContact O-N 2.04Å
93	P	56.9	Low	67.2	Low	127 Å²	127	95.6 Å²	95.6	83%	0.825	51%	0.514	S	S	*	.			trans	-52.6	105.8	-172.1	18.2	-29.8	0	0	0	108.9	S95	P93-S95 PolarHBondContact O-N 3.34Å
94	Q	61.5	Low	69.7	Low	117 Å²	117	94.4 Å²	94.4	55%	0.547	50%	0.495	S	S	.	.			trans	-69	107.9	178.2	-71.2	179.7	8.7	0	0	106.1	P92 Y96	P92-Q94 PolarHBondContact O-N 2.04Å; Q94-Y96 HydrophobicContact CB-CE2 3.87Å; Q94-Y96 WeakPolarHBondContact O-CD2 3.29Å; Q94-Y96 PolarHBondContact OE1-OH 2.05Å
95	S	73.6	Confident	72.1	Confident	100 Å²	100	90 Å²	90	70%	0.699	46%	0.464	S	S	*	.			trans	-79.4	124.5	175.9	62.2	0	0	0	0	108.9	P93 P97	P93-S95 PolarHBondContact O-N 3.34Å; S95-P97 WeakPolarHBondContact O-CD 3.39Å
96	Y	86.7	Confident	74.3	Confident	52 Å²	52	83.2 Å²	83.2	20%	0.204	44%	0.438	C	S	.	.			trans	-105.3	77.4	170.4	-70	-87.5	0	0	0	108.5	Q94 V98 Y127 F128 P129 F133	Q94-Y96 HydrophobicContact CB-CE2 3.87Å; Q94-Y96 WeakPolarHBondContact O-CD2 3.29Å; Q94-Y96 PolarHBondContact OE1-OH 2.05Å; Y96-V98 PolarHBondContact O-N 3.18Å; Y96-Y127 HydrophobicContact CD1-CD1 4.19Å; Y96-Y127 AromaticContact CD1-CE1 3.87Å; Y96-Y127 HydrophobicContact CD1-CE1 3.87Å; Y96-Y127 WeakPolarHBondContact CD1-O 3.12Å; Y96-Y127 WeakPolarHBondContact CE1-O 3.5Å; Y96-Y127 HydrophobicContact CG-CE1 4.36Å; Y96-F128 HydrophobicContact CD1-CD1 4.44Å; Y96-F128 HydrophobicContact CG-CD1 4.23Å; Y96-P129 HydrophobicContact CD2-CG 4.49Å; Y96-P129 HydrophobicContact CE1-CG 4.48Å; Y96-P129 HydrophobicContact CE2-CG 3.59Å; Y96-P129 VanDerWaalsContact CZ-CD 3.42Å; Y96-P129 WeakPolarHBondContact OH-CG 3.46Å; Y96-F133 HydrophobicContact CD2-CD1 4.12Å; Y96-F133 AromaticContact CD2-CE1 3.59Å; Y96-F133 HydrophobicContact CD2-CE1 3.59Å; Y96-F133 HydrophobicContact CD2-CE2 4.12Å; Y96-F133 AromaticContact CD2-CZ 3.58Å; Y96-F133 HydrophobicContact CD2-CZ 3.58Å; Y96-F133 HydrophobicContact CE2-CE1 4.3Å; Y96-F133 HydrophobicContact CE2-CE2 4.1Å; Y96-F133 AromaticContact CE2-CZ 3.82Å; Y96-F133 HydrophobicContact CE2-CZ 3.82Å; Y96-F133 HydrophobicContact CG-CE1 4.48Å
97	P	89.1	Confident	76.4	Confident	86 Å²	86	77.5 Å²	77.5	56%	0.558	43%	0.429	S	S	*	.			trans	-66.6	133.8	-176.2	28.8	-35.9	0	0	0	110.6	S95 Y127	S95-P97 WeakPolarHBondContact O-CD 3.39Å; P97-Y127 WeakPolarHBondContact CD-OH 3.21Å; P97-Y127 PolarHBondContact O-OH 2.84Å; P97-Y127 VanDerWaalsContact O-OH 3.12Å
98	V	92.1	Very high	78.3	Confident	17 Å²	17	79 Å²	79	10%	0.103	43%	0.431	C	S	.	.			trans	-115.1	127.1	173.2	-177.1	0	0	0	0	107.3	Y96 F100 Y123 F128 Q136 M139 A140 V143	Y96-V98 PolarHBondContact O-N 3.18Å; V98-F100 HydrophobicContact CG1-CB 4.04Å; V98-F100 PolarHBondContact O-N 3.13Å; V98-Y123 HydrophobicContact CB-CE1 4.34Å; V98-Y123 HydrophobicContact CG1-CD2 4.17Å; V98-Y123 HydrophobicContact CG1-CE1 4.23Å; V98-Y123 HydrophobicContact CG1-CE2 3.81Å; V98-Y123 HydrophobicContact CG2-CD1 4.35Å; V98-Y123 HydrophobicContact CG2-CE1 4.23Å; V98-F128 HydrophobicContact CG2-CE1 3.97Å; V98-F128 HydrophobicContact CG2-CZ 3.63Å; V98-Q136 HydrophobicContact CG2-CB 4.13Å; V98-M139 HydrophobicContact CB-CB 4.43Å; V98-M139 HydrophobicContact CG1-CB 4.02Å; V98-A140 HydrophobicContact CG1-CB 4.27Å; V98-A140 HydrophobicContact CG2-CB 4.37Å; V98-V143 HydrophobicContact CG1-CG2 4.27Å
99	Q	92.4	Very high	80.1	Confident	50 Å²	50	68.7 Å²	68.7	23%	0.234	39%	0.393	C	S	.	.			trans	-70.6	79.7	171.2	-71.3	-174	20.2	0	0	109.6	P121 Y123 V143 S218	Q99-P121 HydrophobicContact CG-CG 4.26Å; Q99-P121 VanDerWaalsContact NE2-CG 3.26Å; Q99-Y123 PolarHBondContact N-OH 3.13Å; Q99-V143 VanDerWaalsContact O-CG2 3.28Å; Q99-V143 WeakPolarHBondContact O-CG2 3.33Å; Q99-S218 PolarHBondContact NE2-OG 3.47Å
100	F	93.6	Very high	82.4	Confident	12 Å²	12	64.6 Å²	64.6	5%	0.053	36%	0.359	C	S	.	.			trans	-136.7	138.6	177.8	-178.4	-90.3	0	0	0	108.6	V98 M139 A142 V143 F180 Y192 F206	V98-F100 HydrophobicContact CG1-CB 4.04Å; V98-F100 PolarHBondContact O-N 3.13Å; F100-M139 HydrophobicContact CB-CB 3.94Å; F100-M139 HydrophobicContact CB-CG 4.36Å; F100-M139 HydrophobicContact CD1-CB 4.11Å; F100-M139 HydrophobicContact CD1-CE 4.42Å; F100-M139 HydrophobicContact CD1-CG 3.7Å; F100-M139 HydrophobicContact CD1-SD 4.23Å; F100-M139 HydrophobicContact CD2-CB 4.24Å; F100-M139 HydrophobicContact CE1-CG 4.09Å; F100-M139 HydrophobicContact CG-CB 3.84Å; F100-M139 HydrophobicContact CG-CG 3.97Å; F100-A142 HydrophobicContact CD2-CB 4.3Å; F100-A142 HydrophobicContact CE2-CB 3.72Å; F100-V143 HydrophobicContact CB-CG2 4.11Å; F100-V143 HydrophobicContact CD2-CG2 3.9Å; F100-F180 HydrophobicContact CE1-CD1 4.14Å; F100-F180 AromaticContact CE1-CE1 3.7Å; F100-F180 HydrophobicContact CE1-CE1 3.7Å; F100-F180 HydrophobicContact CE1-CE2 4.22Å; F100-F180 AromaticContact CE1-CZ 3.75Å; F100-F180 HydrophobicContact CE1-CZ 3.75Å; F100-F180 HydrophobicContact CE2-CD1 4.47Å; F100-F180 HydrophobicContact CE2-CD2 4.36Å; F100-F180 HydrophobicContact CE2-CG 4.26Å; F100-F180 HydrophobicContact CZ-CB 4.49Å; F100-F180 AromaticContact CZ-CD1 3.51Å; F100-F180 HydrophobicContact CZ-CD1 3.51Å; F100-F180 AromaticContact CZ-CD2 3.94Å; F100-F180 HydrophobicContact CZ-CD2 3.94Å; F100-F180 AromaticContact CZ-CE1 3.57Å; F100-F180 HydrophobicContact CZ-CE1 3.57Å; F100-F180 HydrophobicContact CZ-CE2 4.01Å; F100-F180 AromaticContact CZ-CG 3.69Å; F100-F180 HydrophobicContact CZ-CG 3.69Å; F100-F180 AromaticContact CZ-CZ 3.82Å; F100-F180 HydrophobicContact CZ-CZ 3.82Å; F100-Y192 HydrophobicContact CD1-CE2 4.26Å; F100-Y192 HydrophobicContact CE1-CD2 4.38Å; F100-Y192 HydrophobicContact CE1-CE1 4.48Å; F100-Y192 HydrophobicContact CE1-CE2 4.02Å; F100-F206 AromaticContact CE1-CE1 3.79Å; F100-F206 HydrophobicContact CE1-CE1 3.79Å; F100-F206 HydrophobicContact CZ-CD1 4.3Å; F100-F206 AromaticContact CZ-CE1 3.58Å; F100-F206 HydrophobicContact CZ-CE1 3.58Å
101	P	95.1	Very high	84.4	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.032	34%	0.343	C	S	.	.	S	Bend	cis	-84.7	165.1	0.9	33.4	-34.2	0	0	0	114.3	Y192 F206 D209 A210	P101-Y192 WeakPolarHBondContact CD-OH 3.46Å; P101-F206 HydrophobicContact CB-CD1 3.54Å; P101-F206 HydrophobicContact CB-CE1 4.23Å; P101-F206 HydrophobicContact CG-CD1 4.06Å; P101-F206 WeakPolarHBondContact CG-O 3.48Å; P101-D209 WeakPolarHBondContact CD-O 3.36Å; P101-D209 HydrophobicContact CG-CB 4.01Å; P101-A210 HydrophobicContact CG-CB 4.47Å; P101-A210 WeakPolarHBondContact O-CA 2.98Å; P101-A210 WeakPolarHBondContact O-CB 3.25Å
102	L	94.9	Very high	86.2	Confident	18 Å²	18	57.6 Å²	57.6	9%	0.094	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-81.4	144.8	171.4	-59.4	178.8	0	0	0	110.1	V143 A146 E147 F150 W173 Y215	L102-V143 HydrophobicContact CD1-CG1 4.37Å; L102-V143 HydrophobicContact CD2-CG1 4.3Å; L102-V143 HydrophobicContact CD2-CG2 4.47Å; L102-V143 HydrophobicContact CG-CG2 4.38Å; L102-A146 HydrophobicContact CD1-CB 3.64Å; L102-E147 HydrophobicContact CD1-CG 4.33Å; L102-F150 HydrophobicContact CD1-CE2 4.07Å; L102-W173 PolarHBondContact O-NE1 3.32Å; L102-Y215 HydrophobicContact CB-CE1 4.4Å; L102-Y215 HydrophobicContact CD2-CE1 4.38Å
103	G	93.3	Very high	88.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65.3	159.3	175.9	0	0	0	0	0	112.5	W173 Y215	G103-W173 PolarHBondContact O-NE1 3.16Å; G103-Y215 PolarHBondContact O-OH 3.16Å
104	R	94.6	Very high	89.8	Confident	88 Å²	88	47.9 Å²	47.9	33%	0.332	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-70.7	135.6	175.3	-173.6	175.8	-177.4	-169.4	0.5	110	T106 N109 W173 N207	R104-T106 PolarHBondContact O-N 3.04Å; R104-N109 PolarHBondContact O-ND2 3.09Å; R104-W173 HydrophobicContact CB-CD2 4.46Å; R104-W173 HydrophobicContact CB-CE3 4.41Å; R104-W173 HydrophobicContact CB-CH2 3.94Å; R104-W173 HydrophobicContact CB-CZ2 3.99Å; R104-W173 HydrophobicContact CB-CZ3 4.16Å; R104-W173 HydrophobicContact CG-CD2 4.4Å; R104-W173 HydrophobicContact CG-CE3 3.95Å; R104-W173 HydrophobicContact CG-CH2 4.03Å; R104-W173 HydrophobicContact CG-CZ2 4.48Å; R104-W173 HydrophobicContact CG-CZ3 3.75Å; R104-N207 HydrophobicContact CB-CB 4.11Å; R104-N207 WeakPolarHBondContact CB-OD1 3.3Å; R104-N207 PolarHBondContact N-OD1 2.85Å
105	P	95.6	Very high	91.3	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.026	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-60.6	131.3	170.2	-27	37.5	0	0	0	111.7	N109 I113 F150 L166 A169 W173	P105-N109 WeakPolarHBondContact CA-OD1 3.07Å; P105-I113 HydrophobicContact CB-CD1 3.89Å; P105-I113 HydrophobicContact CG-CD1 4Å; P105-F150 HydrophobicContact CG-CE1 4.05Å; P105-F150 HydrophobicContact CG-CZ 4.11Å; P105-L166 HydrophobicContact CB-CD1 4.1Å; P105-A169 HydrophobicContact CB-CB 3.93Å; P105-A169 HydrophobicContact CG-CB 3.96Å; P105-W173 HydrophobicContact CG-CB 3.96Å; P105-W173 HydrophobicContact CG-CG 4.42Å
106	T	91.3	Very high	92.1	Very high	47 Å²	47	45.6 Å²	45.6	29%	0.288	24%	0.241	S	C	.	.			trans	-135.3	162.1	-179.6	61.4	0	0	0	0	109.5	R104 D108 N109 I110 L166	R104-T106 PolarHBondContact O-N 3.04Å; T106-D108 PolarHBondContact O-N 3.42Å; T106-D108 VanDerWaalsContact O-N 3.12Å; T106-N109 PolarHBondContact N-OD1 2.83Å; T106-N109 PolarHBondContact O-N 2.87Å; T106-N109 PolarHBondContact O-OD1 2.98Å; T106-N109 PolarHBondContact OG1-N 2.86Å; T106-N109 PolarHBondContact OG1-ND2 3.04Å; T106-N109 PolarHBondContact OG1-OD1 3.14Å; T106-I110 WeakPolarHBondContact O-CB 3.41Å; T106-I110 PolarHBondContact O-N 3.21Å; T106-L166 VanDerWaalsContact C-CD1 3.48Å
107	P	88.9	Confident	92.2	Very high	96 Å²	96	43.8 Å²	43.8	62%	0.623	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.3	173.4	-24.8	33.8	0	0	0	113.6	L166	P107-L166 HydrophobicContact CB-CD2 4.43Å; P107-L166 HydrophobicContact CG-CD2 3.74Å
108	D	88.8	Confident	92.1	Very high	148 Å²	148	42.8 Å²	42.8	79%	0.791	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-33.6	-176.1	-57.7	-36.3	0	0	0	112.7	T106	T106-D108 PolarHBondContact O-N 3.42Å; T106-D108 VanDerWaalsContact O-N 3.12Å
109	N	92.9	Very high	92	Very high	7 Å²	7	44.4 Å²	44.4	4%	0.037	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-10	-177.3	71.3	18.1	0	0	0	114.3	R104 P105 T106 Q111 A112 I113 P213 Y215	R104-N109 PolarHBondContact O-ND2 3.09Å; P105-N109 WeakPolarHBondContact CA-OD1 3.07Å; T106-N109 PolarHBondContact N-OD1 2.83Å; T106-N109 PolarHBondContact O-N 2.87Å; T106-N109 PolarHBondContact O-OD1 2.98Å; T106-N109 PolarHBondContact OG1-N 2.86Å; T106-N109 PolarHBondContact OG1-ND2 3.04Å; T106-N109 PolarHBondContact OG1-OD1 3.14Å; N109-Q111 PolarHBondContact O-N 2.05Å; N109-A112 WeakPolarHBondContact O-CB 3.11Å; N109-A112 PolarHBondContact O-N 3.34Å; N109-I113 WeakPolarHBondContact O-CG1 3.04Å; N109-I113 PolarHBondContact O-N 3.4Å; N109-P213 PolarHBondContact ND2-O 3.43Å; N109-Y215 HydrophobicContact CB-CD2 4.19Å
110	I	93.1	Very high	91.9	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-34.1	-176.3	-167.5	59.1	0	0	0	113.1	T106 I113 C114 T162 T165 L166 A169	T106-I110 WeakPolarHBondContact O-CB 3.41Å; T106-I110 PolarHBondContact O-N 3.21Å; I110-I113 HydrophobicContact CD1-CD1 4.16Å; I110-I113 PolarHBondContact O-N 3.34Å; I110-C114 PolarHBondContact O-N 3.07Å; I110-T162 HydrophobicContact CG2-CG2 4.04Å; I110-T165 HydrophobicContact CD1-CG2 4.12Å; I110-T165 HydrophobicContact CG1-CG2 4.14Å; I110-L166 HydrophobicContact CB-CD1 4.26Å; I110-L166 HydrophobicContact CD1-CD1 4.36Å; I110-L166 HydrophobicContact CG1-CB 4.2Å; I110-L166 HydrophobicContact CG1-CD1 4.4Å; I110-A169 HydrophobicContact CD1-CB 3.61Å
111	Q	91.3	Very high	91.7	Very high	107 Å²	107	42.1 Å²	42.1	50%	0.5	22%	0.224	S	C	.	.	H	α-helix	trans	-69	-40.4	177.4	-168.2	64.4	4.3	0	0	111.3	N109 C114 V115	N109-Q111 PolarHBondContact O-N 2.05Å; Q111-C114 PolarHBondContact O-N 3.25Å; Q111-V115 HydrophobicContact CG-CG2 4.12Å; Q111-V115 WeakPolarHBondContact O-CB 3.46Å; Q111-V115 VanDerWaalsContact O-CG2 3.24Å; Q111-V115 WeakPolarHBondContact O-CG2 3.11Å; Q111-V115 PolarHBondContact O-N 2.97Å
112	A	91.4	Very high	91.4	Very high	17 Å²	17	42.8 Å²	42.8	14%	0.14	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-39.8	176.2	0	0	0	0	0	111.6	N109 C114 V115 Y116 N214	N109-A112 WeakPolarHBondContact O-CB 3.11Å; N109-A112 PolarHBondContact O-N 3.34Å; A112-C114 VanDerWaalsContact C-N 3.27Å; A112-C114 PolarHBondContact O-N 3.3Å; A112-V115 PolarHBondContact O-N 3.07Å; A112-Y116 HydrophobicContact CB-CD2 3.9Å; A112-Y116 HydrophobicContact CB-CE2 4.15Å; A112-Y116 WeakPolarHBondContact O-CB 3.21Å; A112-Y116 PolarHBondContact O-N 2.91Å; A112-N214 WeakPolarHBondContact CB-O 3.41Å
113	I	93.9	Very high	91.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-53.8	-45.7	174.5	-69.3	167.1	0	0	0	111	P105 N109 I110 R120 F150 Y215	P105-I113 HydrophobicContact CB-CD1 3.89Å; P105-I113 HydrophobicContact CG-CD1 4Å; N109-I113 WeakPolarHBondContact O-CG1 3.04Å; N109-I113 PolarHBondContact O-N 3.4Å; I110-I113 HydrophobicContact CD1-CD1 4.16Å; I110-I113 PolarHBondContact O-N 3.34Å; I113-R120 PolarHBondContact O-NH2 3.41Å; I113-F150 HydrophobicContact CG2-CB 3.79Å; I113-F150 HydrophobicContact CG2-CD1 4.36Å; I113-F150 HydrophobicContact CG2-CD2 3.77Å; I113-F150 HydrophobicContact CG2-CE2 4.43Å; I113-F150 HydrophobicContact CG2-CG 3.73Å; I113-Y215 HydrophobicContact CD1-CD2 3.83Å; I113-Y215 HydrophobicContact CD1-CE1 4.5Å; I113-Y215 HydrophobicContact CD1-CE2 3.52Å; I113-Y215 HydrophobicContact CD1-CG 4.41Å; I113-Y215 HydrophobicContact CG1-CD1 3.87Å; I113-Y215 HydrophobicContact CG1-CD2 3.39Å; I113-Y215 HydrophobicContact CG1-CE1 3.98Å; I113-Y215 HydrophobicContact CG1-CE2 3.54Å; I113-Y215 HydrophobicContact CG1-CG 3.51Å
114	C	92.6	Very high	91.2	Very high	31 Å²	31	45 Å²	45	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-80.5	-39.5	-177.8	-64.1	0	0	0	0	113.8	I110 Q111 A112 C154	I110-C114 PolarHBondContact O-N 3.07Å; Q111-C114 PolarHBondContact O-N 3.25Å; A112-C114 VanDerWaalsContact C-N 3.27Å; A112-C114 PolarHBondContact O-N 3.3Å; C114-C154 WeakPolarHBondContact CA-SG 3.47Å; C114-C154 HydrophobicContact CB-CB 3.72Å; C114-C154 WeakPolarHBondContact CB-SG 3.03Å; C114-C154 WeakPolarHBondContact SG-CB 3.26Å; C114-C154 CovalentContact SG-SG 2.04Å; C114-C154 PolarHBondContact SG-SG 2.67Å
115	V	91.9	Very high	90.7	Very high	75 Å²	75	46.6 Å²	46.6	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-74.7	-40.8	-175.8	171.8	0	0	0	0	111.6	Q111 A112	Q111-V115 HydrophobicContact CG-CG2 4.12Å; Q111-V115 WeakPolarHBondContact O-CB 3.46Å; Q111-V115 VanDerWaalsContact O-CG2 3.24Å; Q111-V115 WeakPolarHBondContact O-CG2 3.11Å; Q111-V115 PolarHBondContact O-N 2.97Å; A112-V115 PolarHBondContact O-N 3.07Å
116	Y	90.4	Very high	90.3	Very high	93 Å²	93	51.4 Å²	51.4	37%	0.365	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	27.8	-177.8	-53.2	-54.2	0	0	0	112.2	A112 D118 H119 R120 P217	A112-Y116 HydrophobicContact CB-CD2 3.9Å; A112-Y116 HydrophobicContact CB-CE2 4.15Å; A112-Y116 WeakPolarHBondContact O-CB 3.21Å; A112-Y116 PolarHBondContact O-N 2.91Å; Y116-D118 VanDerWaalsContact C-N 3.27Å; Y116-D118 PolarHBondContact O-N 2.84Å; Y116-H119 PolarHBondContact O-N 3.29Å; Y116-R120 VanDerWaalsContact O-CG 3.3Å; Y116-R120 WeakPolarHBondContact O-CG 3.33Å; Y116-R120 PolarHBondContact O-NE 2.94Å; Y116-P217 HydrophobicContact CD1-CB 4.23Å; Y116-P217 HydrophobicContact CD1-CG 4.16Å; Y116-P217 HydrophobicContact CE1-CG 4.29Å; Y116-P217 HydrophobicContact CG-CB 4.29Å; Y116-P217 HydrophobicContact CG-CG 4.32Å
117	A	88.1	Confident	90.2	Very high	15 Å²	15	52.7 Å²	52.7	12%	0.124	29%	0.289	C	S	.	.	S	Bend	trans	-64.2	-30.9	-176.3	0	0	0	0	0	114	R122	A117-R122 PolarHBondContact O-NH2 2.71Å
118	D	88.6	Confident	90.3	Very high	65 Å²	65	48.6 Å²	48.6	35%	0.348	26%	0.261	S	S	.	.	S	Bend	trans	-88.7	-18.4	178.4	60	-21.8	0	0	0	113.1	Y116 P222 V223	Y116-D118 VanDerWaalsContact C-N 3.27Å; Y116-D118 PolarHBondContact O-N 2.84Å; D118-P222 HydrophobicContact CB-CB 4.32Å; D118-P222 CarbonylContact O-C 3.51Å; D118-P222 WeakPolarHBondContact O-CA 3.42Å; D118-V223 PolarHBondContact O-N 3.46Å
119	H	89	Confident	90.3	Very high	50 Å²	50	43.5 Å²	43.5	23%	0.231	24%	0.236	C	C	.	.	S	Bend	trans	-99.9	22.9	-179.9	-65.8	77.1	0	0	0	113.2	Y116 P217 S218 Q219	Y116-H119 PolarHBondContact O-N 3.29Å; H119-P217 HydrophobicContact CB-CB 3.7Å; H119-S218 PolarHBondContact O-N 3.1Å; H119-Q219 PolarHBondContact CD2-O 3.11Å; H119-Q219 PolarHBondContact O-N 3.29Å
120	R	90.1	Very high	89.7	Confident	3 Å²	3	55.3 Å²	55.3	1%	0.011	28%	0.28	C	S	.	.	S	Bend	trans	-119.1	146	178.4	-71.3	-179.7	-64.2	140.8	-0.3	110.6	I113 Y116 E147	I113-R120 PolarHBondContact O-NH2 3.41Å; Y116-R120 VanDerWaalsContact O-CG 3.3Å; Y116-R120 WeakPolarHBondContact O-CG 3.33Å; Y116-R120 PolarHBondContact O-NE 2.94Å; R120-E147 VanDerWaalsContact CZ-CD 3.47Å; R120-E147 IonicContact CZ-OE1 3.76Å; R120-E147 VanDerWaalsContact CZ-OE1 3.26Å; R120-E147 IonicContact CZ-OE2 3.77Å; R120-E147 IonicContact NE-OE1 2.66Å; R120-E147 IonicContact NE-OE2 3.17Å; R120-E147 IonicContact NH1-OE1 3.07Å; R120-E147 PolarHBondContact NH1-OE1 3.23Å; R120-E147 IonicContact NH1-OE2 3.12Å; R120-E147 PolarHBondContact NH1-OE2 3.4Å; R120-E147 IonicContact NH2-OE1 2.84Å; R120-E147 IonicContact NH2-OE2 3.06Å; R120-E147 PolarHBondContact NH2-OE2 3.39Å
121	P	89.6	Confident	89.2	Confident	12 Å²	12	59.7 Å²	59.7	8%	0.078	31%	0.311	C	S	.	.			trans	-70.3	139.1	-167.7	-8.4	24.3	0	0	0	111.1	Q99 Y123 S218 Q219	Q99-P121 HydrophobicContact CG-CG 4.26Å; Q99-P121 VanDerWaalsContact NE2-CG 3.26Å; P121-Y123 HydrophobicContact CB-CE1 4.49Å; P121-Y123 HydrophobicContact CB-CE2 4.31Å; P121-S218 VanDerWaalsContact CD-OG 3.29Å; P121-S218 WeakPolarHBondContact CD-OG 3.05Å; P121-S218 WeakPolarHBondContact CG-OG 3.08Å; P121-Q219 HydrophobicContact CB-CG 4.4Å; P121-Q219 HydrophobicContact CG-CG 4.26Å
122	R	90.2	Very high	88.8	Confident	18 Å²	18	58 Å²	58	7%	0.068	32%	0.323	C	S	.	.			trans	-115.8	146.7	171.3	-54.2	-61.4	-176.6	128.7	-3.1	109.1	A117 P124 E147 V223 I226	A117-R122 PolarHBondContact O-NH2 2.71Å; R122-P124 VanDerWaalsContact O-CD 3.3Å; R122-P124 WeakPolarHBondContact O-CD 3.04Å; R122-E147 IonicContact NH2-OE2 3.27Å; R122-V223 HydrophobicContact CB-CG1 3.74Å; R122-V223 HydrophobicContact CG-CB 4.29Å; R122-V223 HydrophobicContact CG-CG1 3.59Å; R122-I226 HydrophobicContact CB-CD1 3.6Å; R122-I226 HydrophobicContact CB-CG1 3.89Å; R122-I226 HydrophobicContact CG-CG1 4.47Å
123	Y	92.1	Very high	88.7	Confident	13 Å²	13	59.4 Å²	59.4	5%	0.051	33%	0.326	C	S	.	.			trans	-118.9	84.9	-171.8	-57.1	-81.6	0	0	0	110.4	V98 Q99 P121 Y127 A140 V143 N144	V98-Y123 HydrophobicContact CB-CE1 4.34Å; V98-Y123 HydrophobicContact CG1-CD2 4.17Å; V98-Y123 HydrophobicContact CG1-CE1 4.23Å; V98-Y123 HydrophobicContact CG1-CE2 3.81Å; V98-Y123 HydrophobicContact CG2-CD1 4.35Å; V98-Y123 HydrophobicContact CG2-CE1 4.23Å; Q99-Y123 PolarHBondContact N-OH 3.13Å; P121-Y123 HydrophobicContact CB-CE1 4.49Å; P121-Y123 HydrophobicContact CB-CE2 4.31Å; Y123-Y127 AromaticContact CD1-CD1 3.82Å; Y123-Y127 HydrophobicContact CD1-CD1 3.82Å; Y123-Y127 AromaticContact CD1-CE1 3.75Å; Y123-Y127 HydrophobicContact CD1-CE1 3.75Å; Y123-Y127 HydrophobicContact CD1-CG 4.28Å; Y123-Y127 HydrophobicContact CE1-CE1 4.17Å; Y123-A140 VanDerWaalsContact CB-CB 3.43Å; Y123-A140 HydrophobicContact CD2-CB 4.08Å; Y123-A140 HydrophobicContact CG-CB 3.78Å; Y123-V143 HydrophobicContact CD2-CB 4.36Å; Y123-V143 HydrophobicContact CD2-CG1 4.27Å; Y123-V143 HydrophobicContact CE2-CB 4.3Å; Y123-V143 HydrophobicContact CE2-CG1 3.96Å; Y123-N144 PolarHBondContact N-OD1 3.49Å; Y123-N144 PolarHBondContact O-ND2 2.84Å
124	P	90.1	Very high	88.5	Confident	51 Å²	51	62.7 Å²	62.7	33%	0.331	35%	0.349	S	S	.	.			trans	-66	161.8	175.9	28.5	-34.4	0	0	0	111	R122 S126 Y127 I226	R122-P124 VanDerWaalsContact O-CD 3.3Å; R122-P124 WeakPolarHBondContact O-CD 3.04Å; P124-S126 PolarHBondContact O-N 3.24Å; P124-Y127 WeakPolarHBondContact O-CB 3.47Å; P124-Y127 PolarHBondContact O-N 2.79Å; P124-I226 HydrophobicContact CB-CD1 3.81Å; P124-I226 HydrophobicContact CG-CD1 4.3Å
125	D	84.9	Confident	88.4	Confident	122 Å²	122	63.3 Å²	63.3	65%	0.652	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.7	179.1	-85.2	-41.8	0	0	0	114.3	Y127 R137	D125-Y127 VanDerWaalsContact C-N 3.31Å; D125-R137 PolarHBondContact O-NH1 2.91Å; D125-R137 IonicContact OD1-NH1 2.96Å; D125-R137 PolarHBondContact OD1-NH1 2.86Å; D125-R137 VanDerWaalsContact OD1-NH1 3.15Å
126	S	87.5	Confident	88.4	Confident	105 Å²	105	63 Å²	63	73%	0.734	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-16.2	175.1	56.2	0	0	0	0	113.9	P124 F128	P124-S126 PolarHBondContact O-N 3.24Å; S126-F128 VanDerWaalsContact C-N 3.29Å; S126-F128 PolarHBondContact O-N 3.26Å
127	Y	89.5	Confident	88.5	Confident	74 Å²	74	61.6 Å²	61.6	29%	0.29	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-36.1	178.2	-179.8	-103.2	0	0	0	111.5	Y96 P97 Y123 P124 D125	Y96-Y127 HydrophobicContact CD1-CD1 4.19Å; Y96-Y127 AromaticContact CD1-CE1 3.87Å; Y96-Y127 HydrophobicContact CD1-CE1 3.87Å; Y96-Y127 WeakPolarHBondContact CD1-O 3.12Å; Y96-Y127 WeakPolarHBondContact CE1-O 3.5Å; Y96-Y127 HydrophobicContact CG-CE1 4.36Å; P97-Y127 WeakPolarHBondContact CD-OH 3.21Å; P97-Y127 PolarHBondContact O-OH 2.84Å; P97-Y127 VanDerWaalsContact O-OH 3.12Å; Y123-Y127 AromaticContact CD1-CD1 3.82Å; Y123-Y127 HydrophobicContact CD1-CD1 3.82Å; Y123-Y127 AromaticContact CD1-CE1 3.75Å; Y123-Y127 HydrophobicContact CD1-CE1 3.75Å; Y123-Y127 HydrophobicContact CD1-CG 4.28Å; Y123-Y127 HydrophobicContact CE1-CE1 4.17Å; P124-Y127 WeakPolarHBondContact O-CB 3.47Å; P124-Y127 PolarHBondContact O-N 2.79Å; D125-Y127 VanDerWaalsContact C-N 3.31Å
128	F	90.7	Very high	88.7	Confident	10 Å²	10	61.4 Å²	61.4	4%	0.044	33%	0.332	C	S	.	.	S	Bend	trans	-100.6	144.9	-179	-57.3	-77.9	0	0	0	112.2	Y96 V98 S126 F133 Q136 R137 A140	Y96-F128 HydrophobicContact CD1-CD1 4.44Å; Y96-F128 HydrophobicContact CG-CD1 4.23Å; V98-F128 HydrophobicContact CG2-CE1 3.97Å; V98-F128 HydrophobicContact CG2-CZ 3.63Å; S126-F128 VanDerWaalsContact C-N 3.29Å; S126-F128 PolarHBondContact O-N 3.26Å; F128-F133 HydrophobicContact CB-CB 4.44Å; F128-F133 HydrophobicContact CD1-CB 4.04Å; F128-F133 HydrophobicContact CD1-CG 4.48Å; F128-Q136 HydrophobicContact CD1-CB 4.21Å; F128-Q136 HydrophobicContact CE1-CB 3.5Å; F128-Q136 VanDerWaalsContact CE1-CB 3.5Å; F128-Q136 HydrophobicContact CZ-CB 4.03Å; F128-R137 HydrophobicContact CD2-CG 3.8Å; F128-R137 HydrophobicContact CE2-CG 4.17Å; F128-R137 HydrophobicContact CG-CG 4.42Å; F128-R137 PolarHBondContact O-NH2 3.33Å; F128-R137 VanDerWaalsContact O-NH2 3.16Å; F128-A140 HydrophobicContact CE2-CB 3.46Å; F128-A140 VanDerWaalsContact CE2-CB 3.46Å; F128-A140 HydrophobicContact CZ-CB 3.6Å
129	P	89.1	Confident	89	Confident	42 Å²	42	59.6 Å²	59.6	27%	0.273	32%	0.322	S	S	.	.			trans	-54.6	157.2	168.1	-26.6	36.5	0	0	0	112.4	Y96 S131 F133 R137	Y96-P129 HydrophobicContact CD2-CG 4.49Å; Y96-P129 HydrophobicContact CE1-CG 4.48Å; Y96-P129 HydrophobicContact CE2-CG 3.59Å; Y96-P129 VanDerWaalsContact CZ-CD 3.42Å; Y96-P129 WeakPolarHBondContact OH-CG 3.46Å; P129-S131 PolarHBondContact O-N 2.75Å; P129-F133 HydrophobicContact CB-CD2 4.19Å; P129-F133 HydrophobicContact CB-CE2 4.16Å; P129-F133 HydrophobicContact CG-CD2 3.94Å; P129-F133 HydrophobicContact CG-CE2 3.65Å; P129-R137 PolarHBondContact O-NH2 2.87Å
130	R	80.3	Confident	89.2	Confident	254 Å²	254	57.3 Å²	57.3	96%	0.958	31%	0.311	S	S	*	.	S	Bend	trans	-57.8	-22.5	-176.8	-69.6	-172.9	176.5	-175.3	-1	114
131	S	83.1	Confident	89.4	Confident	96 Å²	96	59.1 Å²	59.1	67%	0.671	32%	0.323	S	S	*	.	S	Bend	trans	-145.7	161.8	178.6	60.1	0	0	0	0	111.7	P129 F133	P129-S131 PolarHBondContact O-N 2.75Å; S131-F133 WeakPolarHBondContact O-CD2 3.38Å
132	G	81.9	Confident	89.7	Confident	72 Å²	72	58.8 Å²	58.8	74%	0.742	32%	0.321	S	S	*	.	S	Bend	trans	93.5	0.5	169.2	0	0	0	0	0	117.3
133	F	89.6	Confident	89.9	Confident	46 Å²	46	58.1 Å²	58.1	20%	0.202	32%	0.319	C	S	.	.			trans	-132.9	34.9	-174.8	-64.8	-86.5	0	0	0	113.1	Y96 F128 P129 S131 K135 Q136 R137	Y96-F133 HydrophobicContact CD2-CD1 4.12Å; Y96-F133 AromaticContact CD2-CE1 3.59Å; Y96-F133 HydrophobicContact CD2-CE1 3.59Å; Y96-F133 HydrophobicContact CD2-CE2 4.12Å; Y96-F133 AromaticContact CD2-CZ 3.58Å; Y96-F133 HydrophobicContact CD2-CZ 3.58Å; Y96-F133 HydrophobicContact CE2-CE1 4.3Å; Y96-F133 HydrophobicContact CE2-CE2 4.1Å; Y96-F133 AromaticContact CE2-CZ 3.82Å; Y96-F133 HydrophobicContact CE2-CZ 3.82Å; Y96-F133 HydrophobicContact CG-CE1 4.48Å; F128-F133 HydrophobicContact CB-CB 4.44Å; F128-F133 HydrophobicContact CD1-CB 4.04Å; F128-F133 HydrophobicContact CD1-CG 4.48Å; P129-F133 HydrophobicContact CB-CD2 4.19Å; P129-F133 HydrophobicContact CB-CE2 4.16Å; P129-F133 HydrophobicContact CG-CD2 3.94Å; P129-F133 HydrophobicContact CG-CE2 3.65Å; S131-F133 WeakPolarHBondContact O-CD2 3.38Å; F133-K135 VanDerWaalsContact C-N 3.3Å; F133-K135 PolarHBondContact O-N 2.96Å; F133-Q136 HydrophobicContact CB-CB 4.42Å; F133-Q136 HydrophobicContact CD1-CG 4.43Å; F133-Q136 PolarHBondContact O-N 3.1Å; F133-R137 WeakPolarHBondContact O-CB 3.15Å; F133-R137 PolarHBondContact O-N 2.83Å
134	S	88.6	Confident	90.1	Very high	70 Å²	70	58.1 Å²	58.1	49%	0.49	32%	0.32	S	S	.	.	H	α-helix	trans	-55.7	-44.5	-176.4	48.5	0	0	0	0	112.2	R137 R138	S134-R137 WeakPolarHBondContact O-CB 3.27Å; S134-R137 PolarHBondContact O-N 3.21Å; S134-R138 WeakPolarHBondContact O-CG 3.36Å; S134-R138 PolarHBondContact O-N 2.76Å
135	K	90.3	Very high	90.3	Very high	44 Å²	44	56 Å²	56	19%	0.191	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-47.2	179.3	-170.6	165.3	-177.7	168.2	0	112.7	F133 R137 R138 M139 R190	F133-K135 VanDerWaalsContact C-N 3.3Å; F133-K135 PolarHBondContact O-N 2.96Å; K135-R137 VanDerWaalsContact C-N 3.27Å; K135-R137 PolarHBondContact O-N 2.96Å; K135-R138 PolarHBondContact O-N 2.75Å; K135-M139 HydrophobicContact CD-CE 4.33Å; K135-M139 HydrophobicContact CG-CE 3.92Å; K135-M139 WeakPolarHBondContact O-CG 3.33Å; K135-M139 PolarHBondContact O-N 3.09Å; K135-R190 PolarHBondContact NZ-O 3.16Å
136	Q	92.3	Very high	90.7	Very high	67 Å²	67	50.2 Å²	50.2	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-35.3	176.1	-65.5	82.1	-7.6	0	0	111.2	V98 F128 F133 M139 A140	V98-Q136 HydrophobicContact CG2-CB 4.13Å; F128-Q136 HydrophobicContact CD1-CB 4.21Å; F128-Q136 HydrophobicContact CE1-CB 3.5Å; F128-Q136 VanDerWaalsContact CE1-CB 3.5Å; F128-Q136 HydrophobicContact CZ-CB 4.03Å; F133-Q136 HydrophobicContact CB-CB 4.42Å; F133-Q136 HydrophobicContact CD1-CG 4.43Å; F133-Q136 PolarHBondContact O-N 3.1Å; Q136-M139 PolarHBondContact O-N 3.27Å; Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.28Å; Q136-A140 PolarHBondContact O-N 3.39Å
137	R	92.4	Very high	91	Very high	64 Å²	64	45.4 Å²	45.4	24%	0.242	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-46	173.8	-128.6	-179.3	-107.6	-94.7	-0.7	111.4	D125 F128 P129 F133 S134 K135 M139 A140 T141	D125-R137 PolarHBondContact O-NH1 2.91Å; D125-R137 IonicContact OD1-NH1 2.96Å; D125-R137 PolarHBondContact OD1-NH1 2.86Å; D125-R137 VanDerWaalsContact OD1-NH1 3.15Å; F128-R137 HydrophobicContact CD2-CG 3.8Å; F128-R137 HydrophobicContact CE2-CG 4.17Å; F128-R137 HydrophobicContact CG-CG 4.42Å; F128-R137 PolarHBondContact O-NH2 3.33Å; F128-R137 VanDerWaalsContact O-NH2 3.16Å; P129-R137 PolarHBondContact O-NH2 2.87Å; F133-R137 WeakPolarHBondContact O-CB 3.15Å; F133-R137 PolarHBondContact O-N 2.83Å; S134-R137 WeakPolarHBondContact O-CB 3.27Å; S134-R137 PolarHBondContact O-N 3.21Å; K135-R137 VanDerWaalsContact C-N 3.27Å; K135-R137 PolarHBondContact O-N 2.96Å; R137-M139 PolarHBondContact O-N 3.49Å; R137-A140 WeakPolarHBondContact O-CB 3.23Å; R137-A140 PolarHBondContact O-N 3.36Å; R137-T141 PolarHBondContact O-N 3.4Å; R137-T141 PolarHBondContact O-OG1 2.99Å
138	R	92.8	Very high	91.2	Very high	11 Å²	11	43.1 Å²	43.1	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-44.2	174.9	-66.1	-165.7	-68.3	-93	-1.9	112.3	S134 K135 T141 A142 F180 E183 D184 D189	S134-R138 WeakPolarHBondContact O-CG 3.36Å; S134-R138 PolarHBondContact O-N 2.76Å; K135-R138 PolarHBondContact O-N 2.75Å; R138-T141 PolarHBondContact O-N 3.45Å; R138-A142 PolarHBondContact O-N 3.4Å; R138-F180 HydrophobicContact CB-CD2 4.25Å; R138-F180 HydrophobicContact CB-CE2 4Å; R138-E183 HydrophobicContact CG-CG 4.25Å; R138-E183 WeakPolarHBondContact CG-OE1 3.3Å; R138-D184 IonicContact CZ-OD1 3.01Å; R138-D184 VanDerWaalsContact CZ-OD1 3.27Å; R138-D184 IonicContact NE-OD1 3.22Å; R138-D184 PolarHBondContact NE-OD1 2.89Å; R138-D184 IonicContact NH2-OD1 2.8Å; R138-D184 PolarHBondContact NH2-OD1 3.29Å; R138-D189 IonicContact CZ-OD2 2.76Å; R138-D189 IonicContact NH2-OD2 2.99Å; R138-D189 PolarHBondContact NH2-OD2 3.18Å
139	M	94.4	Very high	91.4	Very high	28 Å²	28	43 Å²	43	14%	0.138	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-46.1	175.5	-67.4	170	174.6	0	0	111.4	V98 F100 K135 Q136 R137 A142 V143 F180 Y192	V98-M139 HydrophobicContact CB-CB 4.43Å; V98-M139 HydrophobicContact CG1-CB 4.02Å; F100-M139 HydrophobicContact CB-CB 3.94Å; F100-M139 HydrophobicContact CB-CG 4.36Å; F100-M139 HydrophobicContact CD1-CB 4.11Å; F100-M139 HydrophobicContact CD1-CE 4.42Å; F100-M139 HydrophobicContact CD1-CG 3.7Å; F100-M139 HydrophobicContact CD1-SD 4.23Å; F100-M139 HydrophobicContact CD2-CB 4.24Å; F100-M139 HydrophobicContact CE1-CG 4.09Å; F100-M139 HydrophobicContact CG-CB 3.84Å; F100-M139 HydrophobicContact CG-CG 3.97Å; K135-M139 HydrophobicContact CD-CE 4.33Å; K135-M139 HydrophobicContact CG-CE 3.92Å; K135-M139 WeakPolarHBondContact O-CG 3.33Å; K135-M139 PolarHBondContact O-N 3.09Å; Q136-M139 PolarHBondContact O-N 3.27Å; R137-M139 PolarHBondContact O-N 3.49Å; M139-A142 WeakPolarHBondContact O-CB 3.29Å; M139-A142 PolarHBondContact O-N 3.36Å; M139-V143 WeakPolarHBondContact O-CG2 3.3Å; M139-V143 PolarHBondContact O-N 3.32Å; M139-F180 HydrophobicContact CB-CE2 4.48Å; M139-F180 HydrophobicContact CE-CZ 4.45Å; M139-F180 HydrophobicContact CG-CE2 3.75Å; M139-F180 HydrophobicContact CG-CZ 4.04Å; M139-Y192 HydrophobicContact CE-CD2 3.73Å; M139-Y192 HydrophobicContact CE-CE2 3.76Å
140	A	94.3	Very high	91.6	Very high	2 Å²	2	41 Å²	41	2%	0.017	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.2	0	0	0	0	0	112.5	V98 Y123 F128 Q136 R137 A142 V143 N144	V98-A140 HydrophobicContact CG1-CB 4.27Å; V98-A140 HydrophobicContact CG2-CB 4.37Å; Y123-A140 VanDerWaalsContact CB-CB 3.43Å; Y123-A140 HydrophobicContact CD2-CB 4.08Å; Y123-A140 HydrophobicContact CG-CB 3.78Å; F128-A140 HydrophobicContact CE2-CB 3.46Å; F128-A140 VanDerWaalsContact CE2-CB 3.46Å; F128-A140 HydrophobicContact CZ-CB 3.6Å; Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.28Å; Q136-A140 PolarHBondContact O-N 3.39Å; R137-A140 WeakPolarHBondContact O-CB 3.23Å; R137-A140 PolarHBondContact O-N 3.36Å; A140-A142 VanDerWaalsContact C-N 3.33Å; A140-A142 PolarHBondContact O-N 3.04Å; A140-V143 PolarHBondContact O-N 2.87Å; A140-N144 WeakPolarHBondContact O-CB 3.5Å; A140-N144 VanDerWaalsContact O-CG 3.26Å; A140-N144 PolarHBondContact O-N 3.17Å
141	T	94.1	Very high	92.1	Very high	41 Å²	41	29.3 Å²	29.3	25%	0.252	18%	0.179	S	C	.	.	H	α-helix	trans	-59.3	-44.8	174.5	-60.6	0	0	0	0	111	R137 R138 V143 N144 N145	R137-T141 PolarHBondContact O-N 3.4Å; R137-T141 PolarHBondContact O-OG1 2.99Å; R138-T141 PolarHBondContact O-N 3.45Å; T141-V143 PolarHBondContact O-N 2.79Å; T141-N144 PolarHBondContact O-N 3.38Å; T141-N145 WeakPolarHBondContact O-CB 3.48Å; T141-N145 VanDerWaalsContact O-CG 3.26Å; T141-N145 PolarHBondContact O-N 3.24Å; T141-N145 PolarHBondContact O-ND2 3.05Å
142	A	95.3	Very high	92.5	Very high	5 Å²	5	27.5 Å²	27.5	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-42.5	177.1	0	0	0	0	0	112.4	F100 R138 M139 A140 A146 S176 F180	F100-A142 HydrophobicContact CD2-CB 4.3Å; F100-A142 HydrophobicContact CE2-CB 3.72Å; R138-A142 PolarHBondContact O-N 3.4Å; M139-A142 WeakPolarHBondContact O-CB 3.29Å; M139-A142 PolarHBondContact O-N 3.36Å; A140-A142 VanDerWaalsContact C-N 3.33Å; A140-A142 PolarHBondContact O-N 3.04Å; A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 2.88Å; A142-A146 VanDerWaalsContact O-N 3.08Å; A142-S176 PolarHBondContact O-OG 2.98Å; A142-F180 HydrophobicContact CB-CB 3.85Å; A142-F180 HydrophobicContact CB-CD2 4.03Å; A142-F180 HydrophobicContact CB-CG 4.23Å
143	V	95.1	Very high	93	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-53.6	174.4	175.2	0	0	0	0	110.7	V98 Q99 F100 L102 Y123 M139 A140 T141 N145 A146 E147	V98-V143 HydrophobicContact CG1-CG2 4.27Å; Q99-V143 VanDerWaalsContact O-CG2 3.28Å; Q99-V143 WeakPolarHBondContact O-CG2 3.33Å; F100-V143 HydrophobicContact CB-CG2 4.11Å; F100-V143 HydrophobicContact CD2-CG2 3.9Å; L102-V143 HydrophobicContact CD1-CG1 4.37Å; L102-V143 HydrophobicContact CD2-CG1 4.3Å; L102-V143 HydrophobicContact CD2-CG2 4.47Å; L102-V143 HydrophobicContact CG-CG2 4.38Å; Y123-V143 HydrophobicContact CD2-CB 4.36Å; Y123-V143 HydrophobicContact CD2-CG1 4.27Å; Y123-V143 HydrophobicContact CE2-CB 4.3Å; Y123-V143 HydrophobicContact CE2-CG1 3.96Å; M139-V143 WeakPolarHBondContact O-CG2 3.3Å; M139-V143 PolarHBondContact O-N 3.32Å; A140-V143 PolarHBondContact O-N 2.87Å; T141-V143 PolarHBondContact O-N 2.79Å; V143-N145 VanDerWaalsContact C-N 3.28Å; V143-N145 PolarHBondContact O-N 3.04Å; V143-A146 PolarHBondContact O-N 3.48Å; V143-E147 HydrophobicContact CG1-CG 3.84Å; V143-E147 VanDerWaalsContact O-CB 3.3Å; V143-E147 WeakPolarHBondContact O-CB 3.22Å; V143-E147 WeakPolarHBondContact O-CG 3.19Å; V143-E147 PolarHBondContact O-N 2.97Å
144	N	95	Very high	93	Very high	13 Å²	13	23 Å²	23	7%	0.07	13%	0.133	C	C	.	.	H	α-helix	trans	-58.1	-40.5	-178.2	-69.4	-17.2	0	0	0	111.9	Y123 A140 T141 E147 S148	Y123-N144 PolarHBondContact N-OD1 3.49Å; Y123-N144 PolarHBondContact O-ND2 2.84Å; A140-N144 WeakPolarHBondContact O-CB 3.5Å; A140-N144 VanDerWaalsContact O-CG 3.26Å; A140-N144 PolarHBondContact O-N 3.17Å; T141-N144 PolarHBondContact O-N 3.38Å; N144-E147 PolarHBondContact O-N 3.05Å; N144-S148 VanDerWaalsContact O-CB 3.27Å; N144-S148 WeakPolarHBondContact O-CB 3.44Å; N144-S148 PolarHBondContact O-N 3.38Å
145	N	94.4	Very high	92.9	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.043	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-53	175.9	-76.1	-18	0	0	0	111.6	T141 V143 E147 S148 W149 S228 S229	T141-N145 WeakPolarHBondContact O-CB 3.48Å; T141-N145 VanDerWaalsContact O-CG 3.26Å; T141-N145 PolarHBondContact O-N 3.24Å; T141-N145 PolarHBondContact O-ND2 3.05Å; V143-N145 VanDerWaalsContact C-N 3.28Å; V143-N145 PolarHBondContact O-N 3.04Å; N145-E147 VanDerWaalsContact C-N 3.3Å; N145-E147 PolarHBondContact O-N 3.02Å; N145-S148 PolarHBondContact O-N 2.99Å; N145-W149 HydrophobicContact CB-CH2 4.14Å; N145-W149 HydrophobicContact CB-CZ2 4.04Å; N145-W149 HydrophobicContact CB-CZ3 4.4Å; N145-W149 PolarHBondContact O-N 2.89Å; N145-S228 WeakPolarHBondContact OD1-CA 3.32Å; N145-S228 VanDerWaalsContact OD1-CB 3.26Å; N145-S228 WeakPolarHBondContact OD1-CB 3.4Å; N145-S229 PolarHBondContact ND2-OG 3.3Å; N145-S229 PolarHBondContact OD1-N 2.96Å; N145-S229 PolarHBondContact OD1-OG 3.21Å
146	A	94.6	Very high	92.2	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-44.7	178.3	0	0	0	0	0	111.7	L102 A142 V143 W149 F150	L102-A146 HydrophobicContact CD1-CB 3.64Å; A142-A146 WeakPolarHBondContact O-CB 3.34Å; A142-A146 PolarHBondContact O-N 2.88Å; A142-A146 VanDerWaalsContact O-N 3.08Å; V143-A146 PolarHBondContact O-N 3.48Å; A146-W149 PolarHBondContact O-N 3.29Å; A146-F150 HydrophobicContact CB-CE2 4.26Å; A146-F150 HydrophobicContact CB-CZ 4.29Å; A146-F150 WeakPolarHBondContact O-CD1 3.27Å; A146-F150 WeakPolarHBondContact O-CD2 3.39Å; A146-F150 WeakPolarHBondContact O-CG 3.33Å; A146-F150 PolarHBondContact O-N 2.92Å
147	E	94.3	Very high	91.3	Very high	3 Å²	3	24.4 Å²	24.4	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-67.8	-38.7	-177.8	-70.4	-73.1	-174.9	0	0	113.4	L102 R120 R122 V143 N144 N145 W149 S151	L102-E147 HydrophobicContact CD1-CG 4.33Å; R120-E147 VanDerWaalsContact CZ-CD 3.47Å; R120-E147 IonicContact CZ-OE1 3.76Å; R120-E147 VanDerWaalsContact CZ-OE1 3.26Å; R120-E147 IonicContact CZ-OE2 3.77Å; R120-E147 IonicContact NE-OE1 2.66Å; R120-E147 IonicContact NE-OE2 3.17Å; R120-E147 IonicContact NH1-OE1 3.07Å; R120-E147 PolarHBondContact NH1-OE1 3.23Å; R120-E147 IonicContact NH1-OE2 3.12Å; R120-E147 PolarHBondContact NH1-OE2 3.4Å; R120-E147 IonicContact NH2-OE1 2.84Å; R120-E147 IonicContact NH2-OE2 3.06Å; R120-E147 PolarHBondContact NH2-OE2 3.39Å; R122-E147 IonicContact NH2-OE2 3.27Å; V143-E147 HydrophobicContact CG1-CG 3.84Å; V143-E147 VanDerWaalsContact O-CB 3.3Å; V143-E147 WeakPolarHBondContact O-CB 3.22Å; V143-E147 WeakPolarHBondContact O-CG 3.19Å; V143-E147 PolarHBondContact O-N 2.97Å; N144-E147 PolarHBondContact O-N 3.05Å; N145-E147 VanDerWaalsContact C-N 3.3Å; N145-E147 PolarHBondContact O-N 3.02Å; E147-W149 VanDerWaalsContact C-N 3.35Å; E147-S151 PolarHBondContact O-N 2.77Å; E147-S151 VanDerWaalsContact O-N 3.11Å; E147-S151 PolarHBondContact O-OG 3.28Å
148	S	93	Very high	89.9	Confident	26 Å²	26	30.5 Å²	30.5	18%	0.182	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-45	171.2	172.9	0	0	0	0	111.1	N144 N145 S151 A152 S228	N144-S148 VanDerWaalsContact O-CB 3.27Å; N144-S148 WeakPolarHBondContact O-CB 3.44Å; N144-S148 PolarHBondContact O-N 3.38Å; N145-S148 PolarHBondContact O-N 2.99Å; S148-S151 WeakPolarHBondContact O-CB 3.41Å; S148-S151 PolarHBondContact O-N 2.78Å; S148-A152 PolarHBondContact O-N 3.32Å; S148-A152 VanDerWaalsContact O-N 3.12Å; S148-S228 PolarHBondContact OG-N 2.92Å
149	W	94.3	Very high	88.7	Confident	7 Å²	7	34.5 Å²	34.5	3%	0.027	19%	0.191	C	C	.	.	H	α-helix	trans	-69.8	-35.2	179.5	-57.8	-21.6	0	0	0	112.7	N145 A146 E147 A152 C153 A172 Q175 L179 S228 E230 F232	N145-W149 HydrophobicContact CB-CH2 4.14Å; N145-W149 HydrophobicContact CB-CZ2 4.04Å; N145-W149 HydrophobicContact CB-CZ3 4.4Å; N145-W149 PolarHBondContact O-N 2.89Å; A146-W149 PolarHBondContact O-N 3.29Å; E147-W149 VanDerWaalsContact C-N 3.35Å; W149-A152 WeakPolarHBondContact O-CB 3.46Å; W149-A152 PolarHBondContact O-N 3.09Å; W149-C153 PolarHBondContact O-N 3.27Å; W149-C153 PolarHBondContact O-SG 3.29Å; W149-A172 HydrophobicContact CB-CB 3.63Å; W149-A172 HydrophobicContact CE3-CB 4.04Å; W149-A172 WeakPolarHBondContact CZ3-O 3.13Å; W149-Q175 HydrophobicContact CH2-CB 4.41Å; W149-Q175 HydrophobicContact CH2-CG 3.84Å; W149-Q175 HydrophobicContact CZ3-CB 3.86Å; W149-Q175 HydrophobicContact CZ3-CG 3.82Å; W149-L179 HydrophobicContact CH2-CD1 3.6Å; W149-L179 HydrophobicContact CZ2-CD1 4.43Å; W149-L179 HydrophobicContact CZ3-CD1 4.49Å; W149-S228 VanDerWaalsContact NE1-CB 3.31Å; W149-S228 PolarHBondContact NE1-OG 2.92Å; W149-S228 VanDerWaalsContact NE1-OG 3.16Å; W149-E230 HydrophobicContact CH2-CB 4.44Å; W149-E230 HydrophobicContact CZ2-CB 3.84Å; W149-E230 PolarHBondContact NE1-O 2.95Å; W149-F232 HydrophobicContact CB-CB 4.47Å; W149-F232 HydrophobicContact CB-CD1 3.91Å; W149-F232 HydrophobicContact CB-CE1 4.34Å; W149-F232 HydrophobicContact CB-CG 4.21Å; W149-F232 VanDerWaalsContact CD1-CB 3.42Å; W149-F232 HydrophobicContact CD2-CB 3.52Å; W149-F232 HydrophobicContact CD2-CD1 4.4Å; W149-F232 HydrophobicContact CD2-CD2 4.16Å; W149-F232 AromaticContact CD2-CG 3.81Å; W149-F232 HydrophobicContact CD2-CG 3.81Å; W149-F232 HydrophobicContact CE3-CB 4.29Å; W149-F232 HydrophobicContact CE3-CD2 4.14Å; W149-F232 HydrophobicContact CE3-CG 4.26Å; W149-F232 HydrophobicContact CG-CB 3.57Å; W149-F232 AromaticContact CG-CD1 3.91Å; W149-F232 HydrophobicContact CG-CD1 3.91Å; W149-F232 HydrophobicContact CG-CD2 4.5Å; W149-F232 AromaticContact CG-CG 3.77Å; W149-F232 HydrophobicContact CG-CG 3.77Å; W149-F232 HydrophobicContact CZ2-CB 3.86Å; W149-F232 HydrophobicContact CZ3-CD2 4.48Å; W149-F232 VanDerWaalsContact NE1-CB 3.27Å
150	F	94.1	Very high	87.6	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-46.2	170.3	-65.7	-24	0	0	0	111.3	L102 P105 I113 A146 A152 C153 C154 A169 A172 W173 Y215	L102-F150 HydrophobicContact CD1-CE2 4.07Å; P105-F150 HydrophobicContact CG-CE1 4.05Å; P105-F150 HydrophobicContact CG-CZ 4.11Å; I113-F150 HydrophobicContact CG2-CB 3.79Å; I113-F150 HydrophobicContact CG2-CD1 4.36Å; I113-F150 HydrophobicContact CG2-CD2 3.77Å; I113-F150 HydrophobicContact CG2-CE2 4.43Å; I113-F150 HydrophobicContact CG2-CG 3.73Å; A146-F150 HydrophobicContact CB-CE2 4.26Å; A146-F150 HydrophobicContact CB-CZ 4.29Å; A146-F150 WeakPolarHBondContact O-CD1 3.27Å; A146-F150 WeakPolarHBondContact O-CD2 3.39Å; A146-F150 WeakPolarHBondContact O-CG 3.33Å; A146-F150 PolarHBondContact O-N 2.92Å; F150-A152 VanDerWaalsContact C-N 3.26Å; F150-A152 PolarHBondContact O-N 3.22Å; F150-C153 WeakPolarHBondContact O-CB 3.08Å; F150-C153 PolarHBondContact O-N 3.39Å; F150-C153 VanDerWaalsContact O-N 3.11Å; F150-C154 WeakPolarHBondContact O-CB 3.4Å; F150-C154 PolarHBondContact O-N 3.03Å; F150-C154 PolarHBondContact O-SG 3.48Å; F150-A169 HydrophobicContact CD1-CB 3.85Å; F150-A169 HydrophobicContact CE1-CB 3.96Å; F150-A169 WeakPolarHBondContact CE1-O 3.46Å; F150-A172 HydrophobicContact CD1-CB 4.15Å; F150-A172 HydrophobicContact CE1-CB 4.1Å; F150-W173 HydrophobicContact CE1-CB 4.18Å; F150-W173 HydrophobicContact CZ-CB 4.09Å; F150-Y215 AromaticContact CE2-CE1 4Å; F150-Y215 HydrophobicContact CE2-CE1 4Å; F150-Y215 WeakPolarHBondContact CE2-OH 3.38Å
151	S	91.4	Very high	86.9	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-56.2	-42	174.8	-67.1	0	0	0	0	111.7	E147 S148 C154 K155	E147-S151 PolarHBondContact O-N 2.77Å; E147-S151 VanDerWaalsContact O-N 3.11Å; E147-S151 PolarHBondContact O-OG 3.28Å; S148-S151 WeakPolarHBondContact O-CB 3.41Å; S148-S151 PolarHBondContact O-N 2.78Å; S151-C154 PolarHBondContact O-N 2.8Å; S151-K155 WeakPolarHBondContact O-CB 3.33Å; S151-K155 VanDerWaalsContact O-CG 3.23Å; S151-K155 WeakPolarHBondContact O-CG 3.46Å; S151-K155 PolarHBondContact O-N 3.17Å
152	A	90.7	Very high	86.3	Confident	58 Å²	58	39.6 Å²	39.6	48%	0.479	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-43.9	175.2	0	0	0	0	0	112.7	S148 W149 F150 C154 K155 G156	S148-A152 PolarHBondContact O-N 3.32Å; S148-A152 VanDerWaalsContact O-N 3.12Å; W149-A152 WeakPolarHBondContact O-CB 3.46Å; W149-A152 PolarHBondContact O-N 3.09Å; F150-A152 VanDerWaalsContact C-N 3.26Å; F150-A152 PolarHBondContact O-N 3.22Å; A152-C154 PolarHBondContact O-N 3.42Å; A152-K155 PolarHBondContact O-N 3.05Å; A152-G156 PolarHBondContact O-N 2.94Å
153	C	91.6	Very high	85.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-38.6	177	-67.2	0	0	0	0	113	W149 F150 G156 T165 C168	W149-C153 PolarHBondContact O-N 3.27Å; W149-C153 PolarHBondContact O-SG 3.29Å; F150-C153 WeakPolarHBondContact O-CB 3.08Å; F150-C153 PolarHBondContact O-N 3.39Å; F150-C153 VanDerWaalsContact O-N 3.11Å; C153-G156 PolarHBondContact O-N 3.4Å; C153-T165 PolarHBondContact O-OG1 3.08Å; C153-C168 VanDerWaalsContact CA-SG 3.51Å; C153-C168 HydrophobicContact CB-CB 3.61Å; C153-C168 WeakPolarHBondContact CB-SG 3.14Å; C153-C168 WeakPolarHBondContact SG-CB 2.91Å; C153-C168 CovalentContact SG-SG 2.03Å; C153-C168 PolarHBondContact SG-SG 2.94Å
154	C	90.6	Very high	85.2	Confident	24 Å²	24	44.5 Å²	44.5	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-71.9	-38	179.1	-66.1	0	0	0	0	111.9	C114 F150 S151 A152 G156 N157	C114-C154 WeakPolarHBondContact CA-SG 3.47Å; C114-C154 HydrophobicContact CB-CB 3.72Å; C114-C154 WeakPolarHBondContact CB-SG 3.03Å; C114-C154 WeakPolarHBondContact SG-CB 3.26Å; C114-C154 CovalentContact SG-SG 2.04Å; C114-C154 PolarHBondContact SG-SG 2.67Å; F150-C154 WeakPolarHBondContact O-CB 3.4Å; F150-C154 PolarHBondContact O-N 3.03Å; F150-C154 PolarHBondContact O-SG 3.48Å; S151-C154 PolarHBondContact O-N 2.8Å; A152-C154 PolarHBondContact O-N 3.42Å; C154-G156 PolarHBondContact O-N 2.98Å; C154-N157 VanDerWaalsContact O-CB 3.22Å; C154-N157 WeakPolarHBondContact O-CB 3.43Å; C154-N157 PolarHBondContact O-N 3.34Å
155	K	86.6	Confident	85	Confident	145 Å²	145	44 Å²	44	63%	0.63	24%	0.24	S	C	*	.	H	α-helix	trans	-59.2	-30.9	170.8	-72.3	167.7	-172.3	172.8	0	111.5	S151 A152 E225	S151-K155 WeakPolarHBondContact O-CB 3.33Å; S151-K155 VanDerWaalsContact O-CG 3.23Å; S151-K155 WeakPolarHBondContact O-CG 3.46Å; S151-K155 PolarHBondContact O-N 3.17Å; A152-K155 PolarHBondContact O-N 3.05Å; K155-E225 IonicContact NZ-OE1 3.15Å; K155-E225 PolarHBondContact NZ-OE1 3.42Å; K155-E225 IonicContact NZ-OE2 3.47Å; K155-E225 PolarHBondContact NZ-OE2 3.45Å
156	G	76.2	Confident	84.8	Confident	9 Å²	9	45.2 Å²	45.2	9%	0.093	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.5	174.2	0	0	0	0	0	116.2	A152 C153 C154 Q158 T159 W160	A152-G156 PolarHBondContact O-N 2.94Å; C153-G156 PolarHBondContact O-N 3.4Å; C154-G156 PolarHBondContact O-N 2.98Å; G156-Q158 PolarHBondContact O-N 3.44Å; G156-T159 PolarHBondContact O-N 3.2Å; G156-T159 PolarHBondContact O-OG1 2.81Å; G156-W160 VanDerWaalsContact C-NE1 3.32Å; G156-W160 PolarHBondContact O-N 3.15Å; G156-W160 PolarHBondContact O-NE1 2.89Å
157	N	72.3	Confident	84.7	Confident	55 Å²	55	45.8 Å²	45.8	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-53.9	-32.6	-176.5	-172	9.3	0	0	0	112.9	C154 T159 G161 T162 T165	C154-N157 VanDerWaalsContact O-CB 3.22Å; C154-N157 WeakPolarHBondContact O-CB 3.43Å; C154-N157 PolarHBondContact O-N 3.34Å; N157-T159 VanDerWaalsContact C-N 3.3Å; N157-T159 PolarHBondContact O-N 3.33Å; N157-G161 VanDerWaalsContact O-CA 3.23Å; N157-G161 WeakPolarHBondContact O-CA 3.16Å; N157-G161 PolarHBondContact O-N 3.45Å; N157-T162 PolarHBondContact OD1-N 3.5Å; N157-T165 VanDerWaalsContact CA-OG1 3.28Å; N157-T165 WeakPolarHBondContact CA-OG1 3.43Å
158	Q	63.3	Low	84.6	Confident	192 Å²	192	45.8 Å²	45.8	90%	0.897	25%	0.251	S	S	*	.	H	α-helix	trans	-72.5	-18.7	-179.8	-154.5	150	7	0	0	114.3	G156	G156-Q158 PolarHBondContact O-N 3.44Å
159	T	66.5	Low	84.7	Confident	96 Å²	96	44.6 Å²	44.6	59%	0.589	24%	0.242	S	C	*	.	H	α-helix	trans	-95	-34.4	-177.3	60.2	0	0	0	0	113.5	G156 N157	G156-T159 PolarHBondContact O-N 3.2Å; G156-T159 PolarHBondContact O-OG1 2.81Å; N157-T159 VanDerWaalsContact C-N 3.3Å; N157-T159 PolarHBondContact O-N 3.33Å
160	W	72.6	Confident	84.6	Confident	76 Å²	76	45.3 Å²	45.3	29%	0.288	25%	0.248	S	C	.	.	H	α-helix	trans	-128.1	4.1	-175.5	41.7	51.5	0	0	0	115	G156 G164 F234 L236	G156-W160 VanDerWaalsContact C-NE1 3.32Å; G156-W160 PolarHBondContact O-N 3.15Å; G156-W160 PolarHBondContact O-NE1 2.89Å; W160-G164 PolarHBondContact O-N 2.99Å; W160-F234 HydrophobicContact CD2-CE1 4.02Å; W160-F234 HydrophobicContact CE3-CD1 4.45Å; W160-F234 AromaticContact CE3-CE1 3.87Å; W160-F234 HydrophobicContact CE3-CE1 3.87Å; W160-F234 AromaticContact CH2-CD1 3.69Å; W160-F234 HydrophobicContact CH2-CD1 3.69Å; W160-F234 AromaticContact CH2-CE1 3.88Å; W160-F234 HydrophobicContact CH2-CE1 3.88Å; W160-F234 HydrophobicContact CZ2-CD1 4.03Å; W160-F234 HydrophobicContact CZ2-CE1 4.01Å; W160-F234 AromaticContact CZ3-CD1 3.92Å; W160-F234 HydrophobicContact CZ3-CD1 3.92Å; W160-F234 AromaticContact CZ3-CE1 3.8Å; W160-F234 HydrophobicContact CZ3-CE1 3.8Å; W160-L236 HydrophobicContact CB-CD1 4.02Å; W160-L236 HydrophobicContact CD2-CD1 4.27Å; W160-L236 HydrophobicContact CE3-CD1 4.04Å; W160-L236 HydrophobicContact CE3-CD2 4.32Å; W160-L236 HydrophobicContact CG-CD1 4.28Å
161	G	79	Confident	84.6	Confident	22 Å²	22	46.9 Å²	46.9	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	68.7	179.5	177.6	0	0	0	0	0	114.1	N157 E163 G164 T165	N157-G161 VanDerWaalsContact O-CA 3.23Å; N157-G161 WeakPolarHBondContact O-CA 3.16Å; N157-G161 PolarHBondContact O-N 3.45Å; G161-E163 VanDerWaalsContact C-N 3.31Å; G161-E163 PolarHBondContact O-N 3.2Å; G161-G164 PolarHBondContact O-N 2.84Å; G161-T165 PolarHBondContact O-N 3.48Å; G161-T165 PolarHBondContact O-OG1 3.47Å
162	T	81.4	Confident	84.8	Confident	79 Å²	79	46.4 Å²	46.4	49%	0.485	25%	0.252	S	S	.	.	H	α-helix	trans	-58.2	-37.6	-174.4	-45.8	0	0	0	0	113.4	I110 N157 T165 L166	I110-T162 HydrophobicContact CG2-CG2 4.04Å; N157-T162 PolarHBondContact OD1-N 3.5Å; T162-T165 PolarHBondContact O-N 2.64Å; T162-L166 WeakPolarHBondContact O-CB 3.38Å; T162-L166 PolarHBondContact O-N 2.82Å
163	E	81.9	Confident	85	Confident	106 Å²	106	43.8 Å²	43.8	50%	0.495	23%	0.23	S	C	.	.	H	α-helix	trans	-72.6	-33.9	177.5	-68.6	-170.4	-153.2	0	0	112.9	G161 L166 C167 I242	G161-E163 VanDerWaalsContact C-N 3.31Å; G161-E163 PolarHBondContact O-N 3.2Å; E163-L166 PolarHBondContact O-N 2.95Å; E163-C167 WeakPolarHBondContact O-CB 3.38Å; E163-C167 PolarHBondContact O-N 3.36Å; E163-I242 HydrophobicContact CB-CD1 3.69Å; E163-I242 HydrophobicContact CB-CG1 3.96Å; E163-I242 HydrophobicContact CG-CD1 3.52Å; E163-I242 HydrophobicContact CG-CG1 4.04Å; E163-I242 WeakPolarHBondContact OE1-CD1 3.28Å; E163-I242 VanDerWaalsContact OE2-CD1 3.27Å; E163-I242 WeakPolarHBondContact OE2-CD1 3.37Å; E163-I242 WeakPolarHBondContact OE2-CG1 3.44Å
164	G	85.7	Confident	85.2	Confident	6 Å²	6	46.9 Å²	46.9	6%	0.062	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-42.4	171.7	0	0	0	0	0	111.5	W160 G161 C167 C168	W160-G164 PolarHBondContact O-N 2.99Å; G161-G164 PolarHBondContact O-N 2.84Å; G164-C167 PolarHBondContact O-N 2.55Å; G164-C168 WeakPolarHBondContact O-CB 3.39Å; G164-C168 PolarHBondContact O-N 3.07Å
165	T	89.9	Confident	85.4	Confident	2 Å²	2	49 Å²	49	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-44.1	174.2	-65.8	0	0	0	0	112	I110 C153 N157 G161 T162 C167 C168 A169	I110-T165 HydrophobicContact CD1-CG2 4.12Å; I110-T165 HydrophobicContact CG1-CG2 4.14Å; C153-T165 PolarHBondContact O-OG1 3.08Å; N157-T165 VanDerWaalsContact CA-OG1 3.28Å; N157-T165 WeakPolarHBondContact CA-OG1 3.43Å; G161-T165 PolarHBondContact O-N 3.48Å; G161-T165 PolarHBondContact O-OG1 3.47Å; T162-T165 PolarHBondContact O-N 2.64Å; T165-C167 VanDerWaalsContact C-N 3.33Å; T165-C167 PolarHBondContact O-N 3.12Å; T165-C168 PolarHBondContact O-N 3.17Å; T165-A169 WeakPolarHBondContact O-CB 3.19Å; T165-A169 PolarHBondContact O-N 2.94Å
166	L	91.6	Very high	85.8	Confident	33 Å²	33	42.5 Å²	42.5	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-58.7	-45.7	175.6	173.5	61.8	0	0	0	111.4	P105 T106 P107 I110 T162 E163 A169 T170	P105-L166 HydrophobicContact CB-CD1 4.1Å; T106-L166 VanDerWaalsContact C-CD1 3.48Å; P107-L166 HydrophobicContact CB-CD2 4.43Å; P107-L166 HydrophobicContact CG-CD2 3.74Å; I110-L166 HydrophobicContact CB-CD1 4.26Å; I110-L166 HydrophobicContact CD1-CD1 4.36Å; I110-L166 HydrophobicContact CG1-CB 4.2Å; I110-L166 HydrophobicContact CG1-CD1 4.4Å; T162-L166 WeakPolarHBondContact O-CB 3.38Å; T162-L166 PolarHBondContact O-N 2.82Å; E163-L166 PolarHBondContact O-N 2.95Å; L166-A169 PolarHBondContact O-N 3.01Å; L166-T170 WeakPolarHBondContact O-CB 3.29Å; L166-T170 PolarHBondContact O-N 3.05Å; L166-T170 PolarHBondContact O-OG1 3.47Å
167	C	91.3	Very high	86.7	Confident	12 Å²	12	42.2 Å²	42.2	8%	0.081	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-43	177.5	175.7	0	0	0	0	112.4	E163 G164 T165 T170 Q171 C239	E163-C167 WeakPolarHBondContact O-CB 3.38Å; E163-C167 PolarHBondContact O-N 3.36Å; G164-C167 PolarHBondContact O-N 2.55Å; T165-C167 VanDerWaalsContact C-N 3.33Å; T165-C167 PolarHBondContact O-N 3.12Å; C167-T170 PolarHBondContact O-N 2.73Å; C167-Q171 WeakPolarHBondContact O-CG 3.44Å; C167-Q171 PolarHBondContact O-N 3.15Å; C167-Q171 PolarHBondContact SG-NE2 3.29Å; C167-C239 HydrophobicContact CB-CB 3.56Å; C167-C239 WeakPolarHBondContact CB-SG 3.24Å; C167-C239 WeakPolarHBondContact SG-CA 3.32Å; C167-C239 WeakPolarHBondContact SG-CB 3.39Å; C167-C239 CovalentContact SG-SG 2.01Å; C167-C239 PolarHBondContact SG-SG 3.1Å
168	C	92.9	Very high	87.7	Confident	4 Å²	4	43 Å²	43	3%	0.027	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-48.7	176.3	-175.4	0	0	0	0	111.3	C153 G164 T165 T170 Q171 A172 F234	C153-C168 VanDerWaalsContact CA-SG 3.51Å; C153-C168 HydrophobicContact CB-CB 3.61Å; C153-C168 WeakPolarHBondContact CB-SG 3.14Å; C153-C168 WeakPolarHBondContact SG-CB 2.91Å; C153-C168 CovalentContact SG-SG 2.03Å; C153-C168 PolarHBondContact SG-SG 2.94Å; G164-C168 WeakPolarHBondContact O-CB 3.39Å; G164-C168 PolarHBondContact O-N 3.07Å; T165-C168 PolarHBondContact O-N 3.17Å; C168-T170 VanDerWaalsContact C-N 3.34Å; C168-T170 PolarHBondContact O-N 2.95Å; C168-Q171 PolarHBondContact O-N 2.97Å; C168-A172 WeakPolarHBondContact O-CB 3.18Å; C168-A172 PolarHBondContact O-N 2.84Å; C168-F234 VanDerWaalsContact CA-CD2 3.49Å; C168-F234 HydrophobicContact CB-CD1 4.15Å; C168-F234 HydrophobicContact CB-CD2 3.64Å; C168-F234 HydrophobicContact CB-CE1 4.03Å; C168-F234 HydrophobicContact CB-CE2 3.52Å; C168-F234 HydrophobicContact CB-CG 3.94Å; C168-F234 HydrophobicContact CB-CZ 3.7Å; C168-F234 VanDerWaalsContact SG-CG 3.56Å
169	A	94.3	Very high	89.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.5	-42.8	176.4	0	0	0	0	0	111.3	P105 I110 F150 T165 L166 Q171 A172 W173	P105-A169 HydrophobicContact CB-CB 3.93Å; P105-A169 HydrophobicContact CG-CB 3.96Å; I110-A169 HydrophobicContact CD1-CB 3.61Å; F150-A169 HydrophobicContact CD1-CB 3.85Å; F150-A169 HydrophobicContact CE1-CB 3.96Å; F150-A169 WeakPolarHBondContact CE1-O 3.46Å; T165-A169 WeakPolarHBondContact O-CB 3.19Å; T165-A169 PolarHBondContact O-N 2.94Å; L166-A169 PolarHBondContact O-N 3.01Å; A169-Q171 VanDerWaalsContact C-N 3.35Å; A169-Q171 PolarHBondContact O-N 2.89Å; A169-A172 WeakPolarHBondContact O-CB 3.25Å; A169-A172 PolarHBondContact O-N 3.27Å; A169-W173 WeakPolarHBondContact O-CB 3.49Å; A169-W173 PolarHBondContact O-N 3.07Å
170	T	93.8	Very high	90.6	Very high	23 Å²	23	31.3 Å²	31.3	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-59.8	-45.5	177.8	-55.5	0	0	0	0	111.2	L166 C167 C168 W173 E174	L166-T170 WeakPolarHBondContact O-CB 3.29Å; L166-T170 PolarHBondContact O-N 3.05Å; L166-T170 PolarHBondContact O-OG1 3.47Å; C167-T170 PolarHBondContact O-N 2.73Å; C168-T170 VanDerWaalsContact C-N 3.34Å; C168-T170 PolarHBondContact O-N 2.95Å; T170-W173 PolarHBondContact O-N 3.33Å; T170-E174 WeakPolarHBondContact O-CG 3.04Å; T170-E174 PolarHBondContact O-N 3.2Å
171	Q	93.3	Very high	91.7	Very high	33 Å²	33	28 Å²	28	15%	0.154	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-41.5	176.3	-72.5	-179.3	49.8	0	0	112.3	C167 C168 A169 W173 E174 Q175 F232 N235	C167-Q171 WeakPolarHBondContact O-CG 3.44Å; C167-Q171 PolarHBondContact O-N 3.15Å; C167-Q171 PolarHBondContact SG-NE2 3.29Å; C168-Q171 PolarHBondContact O-N 2.97Å; A169-Q171 VanDerWaalsContact C-N 3.35Å; A169-Q171 PolarHBondContact O-N 2.89Å; Q171-W173 VanDerWaalsContact C-N 3.32Å; Q171-W173 PolarHBondContact O-N 3.39Å; Q171-E174 PolarHBondContact O-N 2.66Å; Q171-Q175 VanDerWaalsContact O-CB 3.28Å; Q171-Q175 WeakPolarHBondContact O-CB 3.34Å; Q171-Q175 PolarHBondContact O-N 3.01Å; Q171-F232 HydrophobicContact CB-CE2 4.26Å; Q171-F232 HydrophobicContact CB-CZ 4.17Å; Q171-N235 PolarHBondContact NE2-O 3.39Å
172	A	94.8	Very high	92.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.8	-43.8	176.1	0	0	0	0	0	111.7	W149 F150 C168 A169 Q175 S176 F232	W149-A172 HydrophobicContact CB-CB 3.63Å; W149-A172 HydrophobicContact CE3-CB 4.04Å; W149-A172 WeakPolarHBondContact CZ3-O 3.13Å; F150-A172 HydrophobicContact CD1-CB 4.15Å; F150-A172 HydrophobicContact CE1-CB 4.1Å; C168-A172 WeakPolarHBondContact O-CB 3.18Å; C168-A172 PolarHBondContact O-N 2.84Å; A169-A172 WeakPolarHBondContact O-CB 3.25Å; A169-A172 PolarHBondContact O-N 3.27Å; A172-Q175 PolarHBondContact O-N 2.82Å; A172-S176 WeakPolarHBondContact O-CB 3.42Å; A172-S176 PolarHBondContact O-N 3.39Å; A172-F232 HydrophobicContact CB-CE1 4.05Å; A172-F232 HydrophobicContact CB-CE2 4.02Å; A172-F232 HydrophobicContact CB-CZ 3.71Å
173	W	95.8	Very high	93	Very high	3 Å²	3	31.5 Å²	31.5	1%	0.011	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-47.6	176.8	175.9	84.5	0	0	0	112	L102 G103 R104 P105 F150 A169 T170 Q171 Q175 S176 V177 L203 F206 N207	L102-W173 PolarHBondContact O-NE1 3.32Å; G103-W173 PolarHBondContact O-NE1 3.16Å; R104-W173 HydrophobicContact CB-CD2 4.46Å; R104-W173 HydrophobicContact CB-CE3 4.41Å; R104-W173 HydrophobicContact CB-CH2 3.94Å; R104-W173 HydrophobicContact CB-CZ2 3.99Å; R104-W173 HydrophobicContact CB-CZ3 4.16Å; R104-W173 HydrophobicContact CG-CD2 4.4Å; R104-W173 HydrophobicContact CG-CE3 3.95Å; R104-W173 HydrophobicContact CG-CH2 4.03Å; R104-W173 HydrophobicContact CG-CZ2 4.48Å; R104-W173 HydrophobicContact CG-CZ3 3.75Å; P105-W173 HydrophobicContact CG-CB 3.96Å; P105-W173 HydrophobicContact CG-CG 4.42Å; F150-W173 HydrophobicContact CE1-CB 4.18Å; F150-W173 HydrophobicContact CZ-CB 4.09Å; A169-W173 WeakPolarHBondContact O-CB 3.49Å; A169-W173 PolarHBondContact O-N 3.07Å; T170-W173 PolarHBondContact O-N 3.33Å; Q171-W173 VanDerWaalsContact C-N 3.32Å; Q171-W173 PolarHBondContact O-N 3.39Å; W173-Q175 VanDerWaalsContact C-N 3.3Å; W173-Q175 PolarHBondContact O-N 3.42Å; W173-S176 PolarHBondContact O-N 2.62Å; W173-V177 HydrophobicContact CD2-CG2 4.39Å; W173-V177 HydrophobicContact CZ2-CG2 4.2Å; W173-V177 WeakPolarHBondContact O-CG2 3.21Å; W173-V177 PolarHBondContact O-N 3.26Å; W173-L203 HydrophobicContact CH2-CB 3.75Å; W173-L203 HydrophobicContact CH2-CD2 4.01Å; W173-L203 HydrophobicContact CH2-CG 4.41Å; W173-L203 WeakPolarHBondContact CH2-O 3.36Å; W173-L203 HydrophobicContact CZ3-CB 3.92Å; W173-L203 HydrophobicContact CZ3-CD1 4.35Å; W173-L203 HydrophobicContact CZ3-CD2 3.77Å; W173-L203 HydrophobicContact CZ3-CG 4.21Å; W173-F206 HydrophobicContact CZ2-CB 4.07Å; W173-N207 HydrophobicContact CZ2-CB 4.43Å
174	E	94.9	Very high	93.6	Very high	65 Å²	65	26.5 Å²	26.5	30%	0.304	13%	0.132	S	C	.	.	H	α-helix	trans	-59.5	-42	177.5	-72.3	179.2	-179.3	0	0	111.7	T170 Q171 V177 Q178 L203	T170-E174 WeakPolarHBondContact O-CG 3.04Å; T170-E174 PolarHBondContact O-N 3.2Å; Q171-E174 PolarHBondContact O-N 2.66Å; E174-V177 PolarHBondContact O-N 3.06Å; E174-Q178 WeakPolarHBondContact O-CB 3.48Å; E174-Q178 PolarHBondContact O-N 2.92Å; E174-L203 HydrophobicContact CG-CD1 3.92Å; E174-L203 HydrophobicContact CG-CD2 4.24Å
175	Q	94.5	Very high	93.8	Very high	69 Å²	69	30.1 Å²	30.1	32%	0.322	16%	0.157	S	C	.	.	H	α-helix	trans	-65.2	-40.9	177.4	-173.7	64	38.6	0	0	111.6	W149 Q171 A172 W173 Q178 L179	W149-Q175 HydrophobicContact CH2-CB 4.41Å; W149-Q175 HydrophobicContact CH2-CG 3.84Å; W149-Q175 HydrophobicContact CZ3-CB 3.86Å; W149-Q175 HydrophobicContact CZ3-CG 3.82Å; Q171-Q175 VanDerWaalsContact O-CB 3.28Å; Q171-Q175 WeakPolarHBondContact O-CB 3.34Å; Q171-Q175 PolarHBondContact O-N 3.01Å; A172-Q175 PolarHBondContact O-N 2.82Å; W173-Q175 VanDerWaalsContact C-N 3.3Å; W173-Q175 PolarHBondContact O-N 3.42Å; Q175-Q178 PolarHBondContact O-N 3.31Å; Q175-L179 HydrophobicContact CG-CD1 4.14Å; Q175-L179 WeakPolarHBondContact O-CG 3.25Å; Q175-L179 PolarHBondContact O-N 2.73Å
176	S	95.4	Very high	93.9	Very high	7 Å²	7	34.4 Å²	34.4	5%	0.049	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-45.4	177.7	170.1	0	0	0	0	111.3	A142 A172 W173 Q178 L179 F180	A142-S176 PolarHBondContact O-OG 2.98Å; A172-S176 WeakPolarHBondContact O-CB 3.42Å; A172-S176 PolarHBondContact O-N 3.39Å; W173-S176 PolarHBondContact O-N 2.62Å; S176-Q178 VanDerWaalsContact C-N 3.3Å; S176-Q178 PolarHBondContact O-N 3.44Å; S176-L179 PolarHBondContact O-N 2.98Å; S176-F180 WeakPolarHBondContact O-CB 3.42Å; S176-F180 PolarHBondContact O-N 3.23Å
177	V	95.6	Very high	93.8	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-41.3	174.9	170.7	0	0	0	0	111.3	W173 E174 C181 R202 L203 F206	W173-V177 HydrophobicContact CD2-CG2 4.39Å; W173-V177 HydrophobicContact CZ2-CG2 4.2Å; W173-V177 WeakPolarHBondContact O-CG2 3.21Å; W173-V177 PolarHBondContact O-N 3.26Å; E174-V177 PolarHBondContact O-N 3.06Å; V177-C181 PolarHBondContact O-N 3.21Å; V177-C181 VanDerWaalsContact O-N 3.1Å; V177-C181 PolarHBondContact O-SG 3.16Å; V177-R202 HydrophobicContact CG1-CG 4.37Å; V177-L203 HydrophobicContact CB-CD2 4.31Å; V177-L203 HydrophobicContact CG1-CD2 4Å; V177-F206 HydrophobicContact CG1-CD1 4.38Å; V177-F206 HydrophobicContact CG1-CD2 3.35Å; V177-F206 HydrophobicContact CG1-CE2 3.5Å; V177-F206 HydrophobicContact CG1-CG 3.85Å; V177-F206 HydrophobicContact CG1-CZ 4.11Å; V177-F206 HydrophobicContact CG2-CB 4.29Å; V177-F206 HydrophobicContact CG2-CD1 4.25Å; V177-F206 HydrophobicContact CG2-CD2 4.42Å; V177-F206 HydrophobicContact CG2-CG 4.06Å
178	Q	94.4	Very high	93.5	Very high	72 Å²	72	45.8 Å²	45.8	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-52.4	177.7	176	171.8	-10.2	0	0	111.6	E174 Q175 S176 F180 C181 E182	E174-Q178 WeakPolarHBondContact O-CB 3.48Å; E174-Q178 PolarHBondContact O-N 2.92Å; Q175-Q178 PolarHBondContact O-N 3.31Å; S176-Q178 VanDerWaalsContact C-N 3.3Å; S176-Q178 PolarHBondContact O-N 3.44Å; Q178-F180 VanDerWaalsContact C-N 3.33Å; Q178-F180 PolarHBondContact O-N 3Å; Q178-C181 PolarHBondContact O-N 3.22Å; Q178-E182 HydrophobicContact CG-CG 4.45Å; Q178-E182 WeakPolarHBondContact CG-OE1 3.24Å; Q178-E182 PolarHBondContact NE2-OE1 3Å; Q178-E182 WeakPolarHBondContact O-CG 3.36Å; Q178-E182 PolarHBondContact O-N 3.28Å
179	L	94.7	Very high	93.2	Very high	38 Å²	38	48.5 Å²	48.5	20%	0.199	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-42.4	-179.3	-71.7	167.9	0	0	0	111.9	W149 Q175 S176 C181 E182 E183 E230	W149-L179 HydrophobicContact CH2-CD1 3.6Å; W149-L179 HydrophobicContact CZ2-CD1 4.43Å; W149-L179 HydrophobicContact CZ3-CD1 4.49Å; Q175-L179 HydrophobicContact CG-CD1 4.14Å; Q175-L179 WeakPolarHBondContact O-CG 3.25Å; Q175-L179 PolarHBondContact O-N 2.73Å; S176-L179 PolarHBondContact O-N 2.98Å; L179-C181 VanDerWaalsContact C-N 3.34Å; L179-C181 PolarHBondContact O-N 2.86Å; L179-E182 PolarHBondContact O-N 2.69Å; L179-E183 WeakPolarHBondContact O-CB 3.48Å; L179-E183 PolarHBondContact O-N 3.42Å; L179-E230 HydrophobicContact CD1-CB 4.19Å; L179-E230 HydrophobicContact CD1-CG 4.08Å
180	F	95.6	Very high	92.9	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.013	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-47.6	175.3	173.1	-101.3	0	0	0	111.6	F100 R138 M139 A142 S176 Q178 E182 E183 D184 Y192 F206	F100-F180 HydrophobicContact CE1-CD1 4.14Å; F100-F180 AromaticContact CE1-CE1 3.7Å; F100-F180 HydrophobicContact CE1-CE1 3.7Å; F100-F180 HydrophobicContact CE1-CE2 4.22Å; F100-F180 AromaticContact CE1-CZ 3.75Å; F100-F180 HydrophobicContact CE1-CZ 3.75Å; F100-F180 HydrophobicContact CE2-CD1 4.47Å; F100-F180 HydrophobicContact CE2-CD2 4.36Å; F100-F180 HydrophobicContact CE2-CG 4.26Å; F100-F180 HydrophobicContact CZ-CB 4.49Å; F100-F180 AromaticContact CZ-CD1 3.51Å; F100-F180 HydrophobicContact CZ-CD1 3.51Å; F100-F180 AromaticContact CZ-CD2 3.94Å; F100-F180 HydrophobicContact CZ-CD2 3.94Å; F100-F180 AromaticContact CZ-CE1 3.57Å; F100-F180 HydrophobicContact CZ-CE1 3.57Å; F100-F180 HydrophobicContact CZ-CE2 4.01Å; F100-F180 AromaticContact CZ-CG 3.69Å; F100-F180 HydrophobicContact CZ-CG 3.69Å; F100-F180 AromaticContact CZ-CZ 3.82Å; F100-F180 HydrophobicContact CZ-CZ 3.82Å; R138-F180 HydrophobicContact CB-CD2 4.25Å; R138-F180 HydrophobicContact CB-CE2 4Å; M139-F180 HydrophobicContact CB-CE2 4.48Å; M139-F180 HydrophobicContact CE-CZ 4.45Å; M139-F180 HydrophobicContact CG-CE2 3.75Å; M139-F180 HydrophobicContact CG-CZ 4.04Å; A142-F180 HydrophobicContact CB-CB 3.85Å; A142-F180 HydrophobicContact CB-CD2 4.03Å; A142-F180 HydrophobicContact CB-CG 4.23Å; S176-F180 WeakPolarHBondContact O-CB 3.42Å; S176-F180 PolarHBondContact O-N 3.23Å; Q178-F180 VanDerWaalsContact C-N 3.33Å; Q178-F180 PolarHBondContact O-N 3Å; F180-E182 PolarHBondContact O-N 3.08Å; F180-E183 PolarHBondContact O-N 3.49Å; F180-D184 HydrophobicContact CE1-CB 4.42Å; F180-D184 HydrophobicContact CZ-CB 4.29Å; F180-D184 VanDerWaalsContact O-CB 3.23Å; F180-D184 WeakPolarHBondContact O-CB 3.48Å; F180-D184 PolarHBondContact O-N 3.48Å; F180-Y192 HydrophobicContact CE1-CD1 4.38Å; F180-Y192 HydrophobicContact CE1-CD2 4.24Å; F180-Y192 AromaticContact CE1-CG 3.86Å; F180-Y192 HydrophobicContact CE1-CG 3.86Å; F180-Y192 HydrophobicContact CZ-CD2 4.21Å; F180-Y192 HydrophobicContact CZ-CG 4.25Å; F180-F206 HydrophobicContact CD1-CE1 4.19Å; F180-F206 AromaticContact CD1-CZ 3.95Å; F180-F206 HydrophobicContact CD1-CZ 3.95Å; F180-F206 HydrophobicContact CE1-CE1 4.3Å; F180-F206 HydrophobicContact CE1-CZ 4.13Å
181	C	95.4	Very high	92.8	Very high	7 Å²	7	58.2 Å²	58.2	5%	0.047	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-34.3	179.9	-71.3	0	0	0	0	113.1	V177 Q178 L179 S185 C195	V177-C181 PolarHBondContact O-N 3.21Å; V177-C181 VanDerWaalsContact O-N 3.1Å; V177-C181 PolarHBondContact O-SG 3.16Å; Q178-C181 PolarHBondContact O-N 3.22Å; L179-C181 VanDerWaalsContact C-N 3.34Å; L179-C181 PolarHBondContact O-N 2.86Å; C181-S185 WeakPolarHBondContact O-CB 3.49Å; C181-S185 PolarHBondContact O-N 2.8Å; C181-S185 PolarHBondContact O-OG 2.96Å; C181-S185 VanDerWaalsContact O-OG 3.06Å; C181-C195 WeakPolarHBondContact CA-SG 3.33Å; C181-C195 HydrophobicContact CB-CB 3.74Å; C181-C195 WeakPolarHBondContact CB-SG 3.44Å; C181-C195 WeakPolarHBondContact SG-CA 3.47Å; C181-C195 WeakPolarHBondContact SG-CB 3.44Å; C181-C195 CovalentContact SG-SG 2.05Å; C181-C195 PolarHBondContact SG-SG 3.24Å
182	E	94.1	Very high	92.8	Very high	93 Å²	93	58.1 Å²	58.1	44%	0.435	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-49.3	173.4	-74.1	170.9	-173.9	0	0	110.3	Q178 L179 F180 S185 S186	Q178-E182 HydrophobicContact CG-CG 4.45Å; Q178-E182 WeakPolarHBondContact CG-OE1 3.24Å; Q178-E182 PolarHBondContact NE2-OE1 3Å; Q178-E182 WeakPolarHBondContact O-CG 3.36Å; Q178-E182 PolarHBondContact O-N 3.28Å; L179-E182 PolarHBondContact O-N 2.69Å; F180-E182 PolarHBondContact O-N 3.08Å; E182-S185 PolarHBondContact O-N 3.33Å; E182-S185 PolarHBondContact O-OG 3.28Å; E182-S186 PolarHBondContact O-N 2.81Å; E182-S186 VanDerWaalsContact O-N 3.16Å
183	E	93.6	Very high	92.8	Very high	82 Å²	82	62.6 Å²	62.6	38%	0.383	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-47.4	178	-164.6	-172.8	176.2	0	0	112.1	R138 L179 F180 S185 S186	R138-E183 HydrophobicContact CG-CG 4.25Å; R138-E183 WeakPolarHBondContact CG-OE1 3.3Å; L179-E183 WeakPolarHBondContact O-CB 3.48Å; L179-E183 PolarHBondContact O-N 3.42Å; F180-E183 PolarHBondContact O-N 3.49Å; E183-S185 VanDerWaalsContact C-N 3.26Å; E183-S185 PolarHBondContact O-N 3.23Å; E183-S186 WeakPolarHBondContact O-CB 3.39Å; E183-S186 PolarHBondContact O-N 2.96Å; E183-S186 PolarHBondContact O-OG 3.09Å
184	D	93.3	Very high	92.7	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-29.6	-178.6	-158.9	55.5	0	0	0	112.1	R138 F180 L191 Y192	R138-D184 IonicContact CZ-OD1 3.01Å; R138-D184 VanDerWaalsContact CZ-OD1 3.27Å; R138-D184 IonicContact NE-OD1 3.22Å; R138-D184 PolarHBondContact NE-OD1 2.89Å; R138-D184 IonicContact NH2-OD1 2.8Å; R138-D184 PolarHBondContact NH2-OD1 3.29Å; F180-D184 HydrophobicContact CE1-CB 4.42Å; F180-D184 HydrophobicContact CZ-CB 4.29Å; F180-D184 VanDerWaalsContact O-CB 3.23Å; F180-D184 WeakPolarHBondContact O-CB 3.48Å; F180-D184 PolarHBondContact O-N 3.48Å; D184-L191 HydrophobicContact CB-CD1 4.16Å; D184-L191 WeakPolarHBondContact OD2-CA 3.4Å; D184-Y192 PolarHBondContact OD2-N 2.98Å
185	S	91.7	Very high	92.7	Very high	82 Å²	82	60.2 Å²	60.2	57%	0.573	30%	0.3	S	S	*	.	H	α-helix	trans	-77.6	-19.5	173.1	74.3	0	0	0	0	114.3	C181 E182 E183 V187	C181-S185 WeakPolarHBondContact O-CB 3.49Å; C181-S185 PolarHBondContact O-N 2.8Å; C181-S185 PolarHBondContact O-OG 2.96Å; C181-S185 VanDerWaalsContact O-OG 3.06Å; E182-S185 PolarHBondContact O-N 3.33Å; E182-S185 PolarHBondContact O-OG 3.28Å; E183-S185 VanDerWaalsContact C-N 3.26Å; E183-S185 PolarHBondContact O-N 3.23Å; S185-V187 VanDerWaalsContact C-N 3.34Å
186	S	90.6	Very high	92.7	Very high	91 Å²	91	63.8 Å²	63.8	64%	0.636	31%	0.311	S	S	*	.	H	α-helix	trans	-82.5	-13.9	-178.6	76.9	0	0	0	0	113.4	E182 E183	E182-S186 PolarHBondContact O-N 2.81Å; E182-S186 VanDerWaalsContact O-N 3.16Å; E183-S186 WeakPolarHBondContact O-CB 3.39Å; E183-S186 PolarHBondContact O-N 2.96Å; E183-S186 PolarHBondContact O-OG 3.09Å
187	V	89.3	Confident	92.6	Very high	64 Å²	64	69.5 Å²	69.5	39%	0.388	33%	0.331	S	S	.	.	S	Bend	trans	-108.3	146.4	-177.6	-174.8	0	0	0	0	110	S185 D189	S185-V187 VanDerWaalsContact C-N 3.34Å; V187-D189 HydrophobicContact CG1-CB 4.35Å; V187-D189 PolarHBondContact O-N 3.36Å
188	K	86.4	Confident	92.3	Very high	221 Å²	221	79.8 Å²	79.8	96%	0.961	37%	0.37	S	S	*	.	S	Bend	trans	-75.8	64.6	173.7	-64.2	-176.3	179.2	-177.6	0	111.3
189	D	85.8	Confident	92	Very high	61 Å²	61	78.7 Å²	78.7	33%	0.326	38%	0.378	S	S	.	.	S	Bend	trans	-126.5	166.7	176.2	-163.6	-6.3	0	0	0	109.3	R138 V187 L191	R138-D189 IonicContact CZ-OD2 2.76Å; R138-D189 IonicContact NH2-OD2 2.99Å; R138-D189 PolarHBondContact NH2-OD2 3.18Å; V187-D189 HydrophobicContact CG1-CB 4.35Å; V187-D189 PolarHBondContact O-N 3.36Å; D189-L191 PolarHBondContact O-N 3.46Å
190	R	87.6	Confident	91.7	Very high	181 Å²	181	82.1 Å²	82.1	68%	0.683	39%	0.394	S	S	*	.			trans	-67	106.8	173.1	-178.4	176.7	175.8	170.2	0.5	108.8	K135	K135-R190 PolarHBondContact NZ-O 3.16Å
191	L	91.9	Very high	91.5	Very high	45 Å²	45	84.7 Å²	84.7	24%	0.236	41%	0.412	C	S	.	.			trans	-50.4	138.3	176.3	-172.2	67.4	0	0	0	111.2	D184 D189 E193 C195 R196	D184-L191 HydrophobicContact CB-CD1 4.16Å; D184-L191 WeakPolarHBondContact OD2-CA 3.4Å; D189-L191 PolarHBondContact O-N 3.46Å; L191-E193 PolarHBondContact O-N 3.49Å; L191-C195 HydrophobicContact CD1-CB 3.8Å; L191-C195 HydrophobicContact CD2-CB 4.24Å; L191-C195 HydrophobicContact CG-CB 3.93Å; L191-R196 HydrophobicContact CD2-CG 3.79Å
192	Y	93.5	Very high	91.4	Very high	31 Å²	31	86.9 Å²	86.9	12%	0.122	42%	0.42	C	S	.	.			trans	-57.9	133.6	171.8	-161.5	-94.9	0	0	0	111	F100 P101 M139 F180 D184 C194 C195 F206 D209	F100-Y192 HydrophobicContact CD1-CE2 4.26Å; F100-Y192 HydrophobicContact CE1-CD2 4.38Å; F100-Y192 HydrophobicContact CE1-CE1 4.48Å; F100-Y192 HydrophobicContact CE1-CE2 4.02Å; P101-Y192 WeakPolarHBondContact CD-OH 3.46Å; M139-Y192 HydrophobicContact CE-CD2 3.73Å; M139-Y192 HydrophobicContact CE-CE2 3.76Å; F180-Y192 HydrophobicContact CE1-CD1 4.38Å; F180-Y192 HydrophobicContact CE1-CD2 4.24Å; F180-Y192 AromaticContact CE1-CG 3.86Å; F180-Y192 HydrophobicContact CE1-CG 3.86Å; F180-Y192 HydrophobicContact CZ-CD2 4.21Å; F180-Y192 HydrophobicContact CZ-CG 4.25Å; D184-Y192 PolarHBondContact OD2-N 2.98Å; Y192-C194 VanDerWaalsContact C-N 3.28Å; Y192-C194 HydrophobicContact CD1-CB 3.77Å; Y192-C194 HydrophobicContact CE1-CB 3.83Å; Y192-C194 PolarHBondContact O-N 3.37Å; Y192-C195 WeakPolarHBondContact O-CB 3.42Å; Y192-C195 PolarHBondContact O-N 3.49Å; Y192-F206 AromaticContact CD1-CE1 3.88Å; Y192-F206 HydrophobicContact CD1-CE1 3.88Å; Y192-F206 AromaticContact CD1-CZ 3.74Å; Y192-F206 HydrophobicContact CD1-CZ 3.74Å; Y192-F206 HydrophobicContact CE1-CD1 4.41Å; Y192-F206 AromaticContact CE1-CE1 3.79Å; Y192-F206 HydrophobicContact CE1-CE1 3.79Å; Y192-F206 HydrophobicContact CE1-CZ 4.1Å; Y192-D209 PolarHBondContact OH-OD2 3.32Å
193	E	94.1	Very high	91.4	Very high	94 Å²	94	83.2 Å²	83.2	44%	0.439	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-58.1	-41.3	-170.3	-168.1	60.3	-144.3	0	0	111.8	L191 C195 R196	L191-E193 PolarHBondContact O-N 3.49Å; E193-C195 VanDerWaalsContact C-N 3.28Å; E193-C195 PolarHBondContact O-N 3.42Å; E193-R196 WeakPolarHBondContact O-CB 3.25Å; E193-R196 PolarHBondContact O-N 3.48Å; E193-R196 WeakPolarHBondContact OE1-CD 3.37Å; E193-R196 IonicContact OE1-NH1 3.8Å; E193-R196 PolarHBondContact OE1-NH1 3.44Å; E193-R196 IonicContact OE2-CZ 3.88Å; E193-R196 IonicContact OE2-NE 3.86Å; E193-R196 IonicContact OE2-NH1 2.79Å; E193-R196 PolarHBondContact OE2-NH1 3.04Å
194	C	94.6	Very high	91.4	Very high	1 Å²	1	82.2 Å²	82.2	1%	0.007	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-64.9	-28.3	177.1	-62.5	0	0	0	0	113.6	Y192 R196 R197 R202 C205 F206	Y192-C194 VanDerWaalsContact C-N 3.28Å; Y192-C194 HydrophobicContact CD1-CB 3.77Å; Y192-C194 HydrophobicContact CE1-CB 3.83Å; Y192-C194 PolarHBondContact O-N 3.37Å; C194-R196 PolarHBondContact O-N 3.27Å; C194-R197 WeakPolarHBondContact O-CB 2.89Å; C194-R197 PolarHBondContact O-N 2.75Å; C194-R197 VanDerWaalsContact O-N 3.13Å; C194-R202 WeakPolarHBondContact O-CG 3.43Å; C194-C205 WeakPolarHBondContact CA-SG 3.3Å; C194-C205 HydrophobicContact CB-CB 3.62Å; C194-C205 WeakPolarHBondContact CB-SG 3.41Å; C194-C205 WeakPolarHBondContact SG-CB 3.39Å; C194-C205 PolarHBondContact SG-O 2.96Å; C194-C205 CovalentContact SG-SG 2.04Å; C194-C205 PolarHBondContact SG-SG 3.07Å; C194-F206 HydrophobicContact CB-CD2 3.6Å; C194-F206 HydrophobicContact CB-CE1 4.39Å; C194-F206 HydrophobicContact CB-CE2 3.44Å; C194-F206 VanDerWaalsContact CB-CE2 3.44Å; C194-F206 HydrophobicContact CB-CG 4.16Å; C194-F206 HydrophobicContact CB-CZ 3.88Å
195	C	95.4	Very high	91.5	Very high	17 Å²	17	83.1 Å²	83.1	12%	0.115	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-70.3	-15.2	177.6	-66.7	0	0	0	0	113.5	C181 L191 Y192 E193 R197	C181-C195 WeakPolarHBondContact CA-SG 3.33Å; C181-C195 HydrophobicContact CB-CB 3.74Å; C181-C195 WeakPolarHBondContact CB-SG 3.44Å; C181-C195 WeakPolarHBondContact SG-CA 3.47Å; C181-C195 WeakPolarHBondContact SG-CB 3.44Å; C181-C195 CovalentContact SG-SG 2.05Å; C181-C195 PolarHBondContact SG-SG 3.24Å; L191-C195 HydrophobicContact CD1-CB 3.8Å; L191-C195 HydrophobicContact CD2-CB 4.24Å; L191-C195 HydrophobicContact CG-CB 3.93Å; Y192-C195 WeakPolarHBondContact O-CB 3.42Å; Y192-C195 PolarHBondContact O-N 3.49Å; E193-C195 VanDerWaalsContact C-N 3.28Å; E193-C195 PolarHBondContact O-N 3.42Å; C195-R197 PolarHBondContact O-N 3.24Å
196	R	92.9	Very high	91.7	Very high	144 Å²	144	79.2 Å²	79.2	54%	0.543	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-69.9	-23.5	171.8	-64.1	173	171.5	-171.8	-9.5	112.5	L191 E193 C194	L191-R196 HydrophobicContact CD2-CG 3.79Å; E193-R196 WeakPolarHBondContact O-CB 3.25Å; E193-R196 PolarHBondContact O-N 3.48Å; E193-R196 WeakPolarHBondContact OE1-CD 3.37Å; E193-R196 IonicContact OE1-NH1 3.8Å; E193-R196 PolarHBondContact OE1-NH1 3.44Å; E193-R196 IonicContact OE2-CZ 3.88Å; E193-R196 IonicContact OE2-NE 3.86Å; E193-R196 IonicContact OE2-NH1 2.79Å; E193-R196 PolarHBondContact OE2-NH1 3.04Å; C194-R196 PolarHBondContact O-N 3.27Å
197	R	93.2	Very high	91.9	Very high	128 Å²	128	77.3 Å²	77.3	48%	0.483	37%	0.366	S	S	.	.	S	Bend	trans	-82	164.6	-179.9	-59	179.2	-176.4	-95.1	0.6	110.8	C194 C195 S201 R202	C194-R197 WeakPolarHBondContact O-CB 2.89Å; C194-R197 PolarHBondContact O-N 2.75Å; C194-R197 VanDerWaalsContact O-N 3.13Å; C195-R197 PolarHBondContact O-N 3.24Å; R197-S201 WeakPolarHBondContact CD-O 3.4Å; R197-R202 HydrophobicContact CB-CB 4.11Å
198	R	89.5	Confident	92.1	Very high	220 Å²	220	79.7 Å²	79.7	83%	0.83	38%	0.377	S	S	*	.			trans	-124.7	147.5	-176.8	-65.8	-174.7	-178.8	176.1	0.6	112.8	M200 S201	R198-M200 PolarHBondContact O-N 2.84Å; R198-S201 PolarHBondContact N-OG 2.86Å; R198-S201 PolarHBondContact O-N 2.79Å; R198-S201 PolarHBondContact O-OG 3.36Å
199	G	87.9	Confident	92.5	Very high	49 Å²	49	72.9 Å²	72.9	51%	0.505	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-133.7	176.2	0	0	0	0	0	112.7	S201 R202 L203	G199-S201 VanDerWaalsContact C-N 3.26Å; G199-S201 PolarHBondContact O-N 2.91Å; G199-R202 WeakPolarHBondContact O-CB 3.36Å; G199-R202 PolarHBondContact O-N 3.15Å; G199-R202 VanDerWaalsContact O-N 3.13Å; G199-L203 PolarHBondContact O-N 3.27Å
200	M	89.6	Confident	92.8	Very high	109 Å²	109	70.6 Å²	70.6	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-31.7	-178.6	-66.8	-59.2	-63.2	0	0	113.9	R198 R202 L203 S204	R198-M200 PolarHBondContact O-N 2.84Å; M200-R202 VanDerWaalsContact C-N 3.27Å; M200-R202 PolarHBondContact O-N 3.21Å; M200-L203 PolarHBondContact O-N 3.23Å; M200-L203 HydrophobicContact SD-CD1 4.09Å; M200-S204 PolarHBondContact O-N 3.35Å
201	S	90.4	Very high	93	Very high	57 Å²	57	68.9 Å²	68.9	40%	0.399	34%	0.34	S	S	.	.	H	α-helix	trans	-67.1	-29	178.7	67.8	0	0	0	0	112.9	R197 R198 G199 C205	R197-S201 WeakPolarHBondContact CD-O 3.4Å; R198-S201 PolarHBondContact N-OG 2.86Å; R198-S201 PolarHBondContact O-N 2.79Å; R198-S201 PolarHBondContact O-OG 3.36Å; G199-S201 VanDerWaalsContact C-N 3.26Å; G199-S201 PolarHBondContact O-N 2.91Å; S201-C205 WeakPolarHBondContact O-CB 3.32Å; S201-C205 PolarHBondContact O-N 3.41Å
202	R	93.7	Very high	92.8	Very high	54 Å²	54	68.2 Å²	68.2	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-67	-52.9	170.9	179	172.9	71.5	177.1	5.6	109.8	V177 C194 R197 G199 M200 S204 C205 F206	V177-R202 HydrophobicContact CG1-CG 4.37Å; C194-R202 WeakPolarHBondContact O-CG 3.43Å; R197-R202 HydrophobicContact CB-CB 4.11Å; G199-R202 WeakPolarHBondContact O-CB 3.36Å; G199-R202 PolarHBondContact O-N 3.15Å; G199-R202 VanDerWaalsContact O-N 3.13Å; M200-R202 VanDerWaalsContact C-N 3.27Å; M200-R202 PolarHBondContact O-N 3.21Å; R202-S204 VanDerWaalsContact C-N 3.35Å; R202-S204 PolarHBondContact O-N 3.5Å; R202-C205 WeakPolarHBondContact O-CB 3.47Å; R202-C205 PolarHBondContact O-N 2.93Å; R202-C205 VanDerWaalsContact O-N 3.17Å; R202-F206 HydrophobicContact CG-CD2 3.84Å; R202-F206 HydrophobicContact CG-CE2 3.76Å; R202-F206 VanDerWaalsContact O-CD2 3.27Å; R202-F206 WeakPolarHBondContact O-CD2 3.39Å; R202-F206 PolarHBondContact O-N 3.33Å
203	L	93.8	Very high	92.7	Very high	15 Å²	15	69.2 Å²	69.2	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-43.8	-179.6	-60.5	-179.9	0	0	0	112	W173 E174 V177 G199 M200 C205 F206 N207	W173-L203 HydrophobicContact CH2-CB 3.75Å; W173-L203 HydrophobicContact CH2-CD2 4.01Å; W173-L203 HydrophobicContact CH2-CG 4.41Å; W173-L203 WeakPolarHBondContact CH2-O 3.36Å; W173-L203 HydrophobicContact CZ3-CB 3.92Å; W173-L203 HydrophobicContact CZ3-CD1 4.35Å; W173-L203 HydrophobicContact CZ3-CD2 3.77Å; W173-L203 HydrophobicContact CZ3-CG 4.21Å; E174-L203 HydrophobicContact CG-CD1 3.92Å; E174-L203 HydrophobicContact CG-CD2 4.24Å; V177-L203 HydrophobicContact CB-CD2 4.31Å; V177-L203 HydrophobicContact CG1-CD2 4Å; G199-L203 PolarHBondContact O-N 3.27Å; M200-L203 PolarHBondContact O-N 3.23Å; M200-L203 HydrophobicContact SD-CD1 4.09Å; L203-C205 PolarHBondContact O-N 3.47Å; L203-F206 PolarHBondContact O-N 2.85Å; L203-N207 PolarHBondContact O-N 2.94Å
204	S	94	Very high	92.5	Very high	61 Å²	61	69.2 Å²	69.2	43%	0.427	35%	0.35	S	S	.	.	H	α-helix	trans	-58.7	-48.5	174.8	-165.7	0	0	0	0	111.3	M200 R202 F206 N207 D208	M200-S204 PolarHBondContact O-N 3.35Å; R202-S204 VanDerWaalsContact C-N 3.35Å; R202-S204 PolarHBondContact O-N 3.5Å; S204-F206 VanDerWaalsContact C-N 3.29Å; S204-F206 PolarHBondContact O-N 2.82Å; S204-N207 WeakPolarHBondContact O-CA 3.4Å; S204-N207 WeakPolarHBondContact O-CB 3.34Å; S204-N207 PolarHBondContact O-N 3.04Å; S204-D208 WeakPolarHBondContact O-CB 3.46Å; S204-D208 PolarHBondContact O-N 3.13Å; S204-D208 PolarHBondContact OG-OD2 3.06Å; S204-D208 VanDerWaalsContact OG-OD2 3.1Å
205	C	96.3	Very high	92.4	Very high	20 Å²	20	69.2 Å²	69.2	14%	0.135	35%	0.35	C	S	.	.	H	α-helix	trans	-56.7	-43.6	178.1	-174.7	0	0	0	0	112.1	C194 S201 R202 L203 N207 D208 D209	C194-C205 WeakPolarHBondContact CA-SG 3.3Å; C194-C205 HydrophobicContact CB-CB 3.62Å; C194-C205 WeakPolarHBondContact CB-SG 3.41Å; C194-C205 WeakPolarHBondContact SG-CB 3.39Å; C194-C205 PolarHBondContact SG-O 2.96Å; C194-C205 CovalentContact SG-SG 2.04Å; C194-C205 PolarHBondContact SG-SG 3.07Å; S201-C205 WeakPolarHBondContact O-CB 3.32Å; S201-C205 PolarHBondContact O-N 3.41Å; R202-C205 WeakPolarHBondContact O-CB 3.47Å; R202-C205 PolarHBondContact O-N 2.93Å; R202-C205 VanDerWaalsContact O-N 3.17Å; L203-C205 PolarHBondContact O-N 3.47Å; C205-N207 VanDerWaalsContact C-N 3.33Å; C205-N207 PolarHBondContact O-N 3.08Å; C205-D208 PolarHBondContact O-N 3.5Å; C205-D209 WeakPolarHBondContact O-CB 3.32Å; C205-D209 PolarHBondContact O-N 2.82Å
206	F	96.1	Very high	92.1	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.7	-37.1	175.7	-86.6	-77.9	0	0	0	113.2	F100 P101 W173 V177 F180 Y192 C194 R202 L203 S204 A210	F100-F206 AromaticContact CE1-CE1 3.79Å; F100-F206 HydrophobicContact CE1-CE1 3.79Å; F100-F206 HydrophobicContact CZ-CD1 4.3Å; F100-F206 AromaticContact CZ-CE1 3.58Å; F100-F206 HydrophobicContact CZ-CE1 3.58Å; P101-F206 HydrophobicContact CB-CD1 3.54Å; P101-F206 HydrophobicContact CB-CE1 4.23Å; P101-F206 HydrophobicContact CG-CD1 4.06Å; P101-F206 WeakPolarHBondContact CG-O 3.48Å; W173-F206 HydrophobicContact CZ2-CB 4.07Å; V177-F206 HydrophobicContact CG1-CD1 4.38Å; V177-F206 HydrophobicContact CG1-CD2 3.35Å; V177-F206 HydrophobicContact CG1-CE2 3.5Å; V177-F206 HydrophobicContact CG1-CG 3.85Å; V177-F206 HydrophobicContact CG1-CZ 4.11Å; V177-F206 HydrophobicContact CG2-CB 4.29Å; V177-F206 HydrophobicContact CG2-CD1 4.25Å; V177-F206 HydrophobicContact CG2-CD2 4.42Å; V177-F206 HydrophobicContact CG2-CG 4.06Å; F180-F206 HydrophobicContact CD1-CE1 4.19Å; F180-F206 AromaticContact CD1-CZ 3.95Å; F180-F206 HydrophobicContact CD1-CZ 3.95Å; F180-F206 HydrophobicContact CE1-CE1 4.3Å; F180-F206 HydrophobicContact CE1-CZ 4.13Å; Y192-F206 AromaticContact CD1-CE1 3.88Å; Y192-F206 HydrophobicContact CD1-CE1 3.88Å; Y192-F206 AromaticContact CD1-CZ 3.74Å; Y192-F206 HydrophobicContact CD1-CZ 3.74Å; Y192-F206 HydrophobicContact CE1-CD1 4.41Å; Y192-F206 AromaticContact CE1-CE1 3.79Å; Y192-F206 HydrophobicContact CE1-CE1 3.79Å; Y192-F206 HydrophobicContact CE1-CZ 4.1Å; C194-F206 HydrophobicContact CB-CD2 3.6Å; C194-F206 HydrophobicContact CB-CE1 4.39Å; C194-F206 HydrophobicContact CB-CE2 3.44Å; C194-F206 VanDerWaalsContact CB-CE2 3.44Å; C194-F206 HydrophobicContact CB-CG 4.16Å; C194-F206 HydrophobicContact CB-CZ 3.88Å; R202-F206 HydrophobicContact CG-CD2 3.84Å; R202-F206 HydrophobicContact CG-CE2 3.76Å; R202-F206 VanDerWaalsContact O-CD2 3.27Å; R202-F206 WeakPolarHBondContact O-CD2 3.39Å; R202-F206 PolarHBondContact O-N 3.33Å; L203-F206 PolarHBondContact O-N 2.85Å; S204-F206 VanDerWaalsContact C-N 3.29Å; S204-F206 PolarHBondContact O-N 2.82Å; F206-A210 PolarHBondContact O-N 3.31Å
207	N	94.9	Very high	91.9	Very high	51 Å²	51	68.9 Å²	68.9	27%	0.273	36%	0.361	S	S	.	.	H	α-helix	trans	-69.5	-42	175.7	179.3	76.3	0	0	0	112.3	R104 W173 L203 S204 C205 D209 A210	R104-N207 HydrophobicContact CB-CB 4.11Å; R104-N207 WeakPolarHBondContact CB-OD1 3.3Å; R104-N207 PolarHBondContact N-OD1 2.85Å; W173-N207 HydrophobicContact CZ2-CB 4.43Å; L203-N207 PolarHBondContact O-N 2.94Å; S204-N207 WeakPolarHBondContact O-CA 3.4Å; S204-N207 WeakPolarHBondContact O-CB 3.34Å; S204-N207 PolarHBondContact O-N 3.04Å; C205-N207 VanDerWaalsContact C-N 3.33Å; C205-N207 PolarHBondContact O-N 3.08Å; N207-D209 VanDerWaalsContact C-N 3.31Å; N207-A210 VanDerWaalsContact O-CB 3.28Å; N207-A210 WeakPolarHBondContact O-CB 3.14Å; N207-A210 PolarHBondContact O-N 2.92Å
208	D	93.4	Very high	91.5	Very high	114 Å²	114	65.1 Å²	65.1	61%	0.61	36%	0.355	S	S	*	.	H	α-helix	trans	-71.4	-30.1	-177	-58.5	-27.9	0	0	0	111.6	S204 C205 A210	S204-D208 WeakPolarHBondContact O-CB 3.46Å; S204-D208 PolarHBondContact O-N 3.13Å; S204-D208 PolarHBondContact OG-OD2 3.06Å; S204-D208 VanDerWaalsContact OG-OD2 3.1Å; C205-D208 PolarHBondContact O-N 3.5Å; D208-A210 VanDerWaalsContact C-N 3.31Å
209	D	92.9	Very high	91.3	Very high	79 Å²	79	58.4 Å²	58.4	42%	0.422	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.2	177.8	-155.1	34.9	0	0	0	112.7	P101 Y192 C205 N207 Q211	P101-D209 WeakPolarHBondContact CD-O 3.36Å; P101-D209 HydrophobicContact CG-CB 4.01Å; Y192-D209 PolarHBondContact OH-OD2 3.32Å; C205-D209 WeakPolarHBondContact O-CB 3.32Å; C205-D209 PolarHBondContact O-N 2.82Å; N207-D209 VanDerWaalsContact C-N 3.31Å; D209-Q211 PolarHBondContact O-N 3.2Å
210	A	93.4	Very high	90.7	Very high	12 Å²	12	65.1 Å²	65.1	10%	0.099	35%	0.351	C	S	.	.			trans	-71.3	123.2	-178.4	0	0	0	0	0	111.9	P101 F206 N207 D208 N212	P101-A210 HydrophobicContact CG-CB 4.47Å; P101-A210 WeakPolarHBondContact O-CA 2.98Å; P101-A210 WeakPolarHBondContact O-CB 3.25Å; F206-A210 PolarHBondContact O-N 3.31Å; N207-A210 VanDerWaalsContact O-CB 3.28Å; N207-A210 WeakPolarHBondContact O-CB 3.14Å; N207-A210 PolarHBondContact O-N 2.92Å; D208-A210 VanDerWaalsContact C-N 3.31Å; A210-N212 PolarHBondContact O-N 3.29Å
211	Q	90.6	Very high	90.3	Very high	145 Å²	145	66.3 Å²	66.3	68%	0.678	36%	0.359	S	S	*	.	S	Bend	trans	-73.3	-27.2	-178.1	-62.4	174.2	17.8	0	0	113.1	D209	D209-Q211 PolarHBondContact O-N 3.2Å
212	N	89.2	Confident	89.8	Confident	32 Å²	32	67.7 Å²	67.7	17%	0.171	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-131.3	71.2	-179.6	-173.5	12	0	0	0	111	A210 N214 Y215 N216	A210-N212 PolarHBondContact O-N 3.29Å; N212-N214 PolarHBondContact O-N 3.06Å; N212-Y215 PolarHBondContact O-N 2.96Å; N212-Y215 PolarHBondContact OD1-N 2.92Å; N212-N216 PolarHBondContact ND2-N 3.28Å; N212-N216 PolarHBondContact ND2-O 3.5Å; N212-N216 PolarHBondContact OD1-N 3.38Å
213	P	90.8	Very high	89.4	Confident	51 Å²	51	67.2 Å²	67.2	33%	0.331	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.1	-174.7	28.2	-34.8	0	0	0	113.6	N109 Y215	N109-P213 PolarHBondContact ND2-O 3.43Å; P213-Y215 WeakPolarHBondContact O-CD2 3.37Å
214	N	89.9	Confident	88.9	Confident	94 Å²	94	74.5 Å²	74.5	50%	0.503	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	2.1	-179.5	-65.2	-37	0	0	0	113.3	A112 N212 N216	A112-N214 WeakPolarHBondContact CB-O 3.41Å; N212-N214 PolarHBondContact O-N 3.06Å; N214-N216 VanDerWaalsContact C-N 3.26Å; N214-N216 PolarHBondContact O-N 3.48Å
215	Y	92.1	Very high	88.1	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.008	41%	0.409	C	S	.	.			trans	55.5	39.4	177.3	-66.1	-88.3	0	0	0	114.1	L102 G103 N109 I113 F150 N212 P213	L102-Y215 HydrophobicContact CB-CE1 4.4Å; L102-Y215 HydrophobicContact CD2-CE1 4.38Å; G103-Y215 PolarHBondContact O-OH 3.16Å; N109-Y215 HydrophobicContact CB-CD2 4.19Å; I113-Y215 HydrophobicContact CD1-CD2 3.83Å; I113-Y215 HydrophobicContact CD1-CE1 4.5Å; I113-Y215 HydrophobicContact CD1-CE2 3.52Å; I113-Y215 HydrophobicContact CD1-CG 4.41Å; I113-Y215 HydrophobicContact CG1-CD1 3.87Å; I113-Y215 HydrophobicContact CG1-CD2 3.39Å; I113-Y215 HydrophobicContact CG1-CE1 3.98Å; I113-Y215 HydrophobicContact CG1-CE2 3.54Å; I113-Y215 HydrophobicContact CG1-CG 3.51Å; F150-Y215 AromaticContact CE2-CE1 4Å; F150-Y215 HydrophobicContact CE2-CE1 4Å; F150-Y215 WeakPolarHBondContact CE2-OH 3.38Å; N212-Y215 PolarHBondContact O-N 2.96Å; N212-Y215 PolarHBondContact OD1-N 2.92Å; P213-Y215 WeakPolarHBondContact O-CD2 3.37Å
216	N	88.5	Confident	87.4	Confident	90 Å²	90	78.7 Å²	78.7	48%	0.481	42%	0.415	S	S	.	.			trans	-62.6	145.2	174.5	-68.6	-36.7	0	0	0	110.3	N212 N214 S218	N212-N216 PolarHBondContact ND2-N 3.28Å; N212-N216 PolarHBondContact ND2-O 3.5Å; N212-N216 PolarHBondContact OD1-N 3.38Å; N214-N216 VanDerWaalsContact C-N 3.26Å; N214-N216 PolarHBondContact O-N 3.48Å; N216-S218 PolarHBondContact O-N 3.3Å
217	P	89	Confident	86.4	Confident	64 Å²	64	81.3 Å²	81.3	42%	0.416	44%	0.442	S	S	.	.			trans	-61.1	132.6	175.8	27	-33.6	0	0	0	109.3	Y116 H119	Y116-P217 HydrophobicContact CD1-CB 4.23Å; Y116-P217 HydrophobicContact CD1-CG 4.16Å; Y116-P217 HydrophobicContact CE1-CG 4.29Å; Y116-P217 HydrophobicContact CG-CB 4.29Å; Y116-P217 HydrophobicContact CG-CG 4.32Å; H119-P217 HydrophobicContact CB-CB 3.7Å
218	S	86.4	Confident	85.7	Confident	49 Å²	49	80.9 Å²	80.9	34%	0.343	44%	0.443	S	S	.	.			trans	-122.8	-2.8	179.7	56.9	0	0	0	0	113.2	Q99 H119 P121 N216	Q99-S218 PolarHBondContact NE2-OG 3.47Å; H119-S218 PolarHBondContact O-N 3.1Å; P121-S218 VanDerWaalsContact CD-OG 3.29Å; P121-S218 WeakPolarHBondContact CD-OG 3.05Å; P121-S218 WeakPolarHBondContact CG-OG 3.08Å; N216-S218 PolarHBondContact O-N 3.3Å
219	Q	84.9	Confident	84.7	Confident	78 Å²	78	79.3 Å²	79.3	36%	0.364	44%	0.441	S	S	.	.			trans	-114.1	134.7	173.2	-61.4	-65.4	-36.5	0	0	108.9	H119 P121 L221 V223	H119-Q219 PolarHBondContact CD2-O 3.11Å; H119-Q219 PolarHBondContact O-N 3.29Å; P121-Q219 HydrophobicContact CB-CG 4.4Å; P121-Q219 HydrophobicContact CG-CG 4.26Å; Q219-L221 VanDerWaalsContact C-N 3.31Å; Q219-V223 HydrophobicContact CB-CG2 3.94Å; Q219-V223 HydrophobicContact CG-CG2 3.75Å
220	E	75.6	Confident	84.2	Confident	191 Å²	191	80.1 Å²	80.1	89%	0.893	44%	0.442	S	S	*	.	S	Bend	trans	-75.7	-23.9	178.6	-64.5	-177.1	174.4	0	0	112.4
221	L	80.4	Confident	83.5	Confident	133 Å²	133	87.5 Å²	87.5	70%	0.696	48%	0.48	S	S	*	.	S	Bend	trans	-116.4	147.8	179.2	-63.3	175	0	0	0	110.2	Q219 V223	Q219-L221 VanDerWaalsContact C-N 3.31Å; L221-V223 PolarHBondContact O-N 2.88Å
222	P	80.7	Confident	83.3	Confident	86 Å²	86	83 Å²	83	56%	0.558	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-57.1	130.7	171.1	-24.3	33.8	0	0	0	111.4	D118	D118-P222 HydrophobicContact CB-CB 4.32Å; D118-P222 CarbonylContact O-C 3.51Å; D118-P222 WeakPolarHBondContact O-CA 3.42Å
223	V	85.3	Confident	82.9	Confident	44 Å²	44	89.2 Å²	89.2	27%	0.267	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-95.7	141.9	177.6	-171.9	0	0	0	0	109.6	D118 R122 Q219 L221	D118-V223 PolarHBondContact O-N 3.46Å; R122-V223 HydrophobicContact CB-CG1 3.74Å; R122-V223 HydrophobicContact CG-CB 4.29Å; R122-V223 HydrophobicContact CG-CG1 3.59Å; Q219-V223 HydrophobicContact CB-CG2 3.94Å; Q219-V223 HydrophobicContact CG-CG2 3.75Å; L221-V223 PolarHBondContact O-N 2.88Å
224	E	82.6	Confident	82.4	Confident	169 Å²	169	88 Å²	88	79%	0.79	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-64.2	138.9	178	-165.4	170.9	-170.8	0	0	112.1	I226	E224-I226 PolarHBondContact O-N 3.12Å
225	E	78.1	Confident	81.8	Confident	120 Å²	120	86.4 Å²	86.4	56%	0.561	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-66.1	119.1	177.4	-70.1	-167.7	159.8	0	0	110	K155	K155-E225 IonicContact NZ-OE1 3.15Å; K155-E225 PolarHBondContact NZ-OE1 3.42Å; K155-E225 IonicContact NZ-OE2 3.47Å; K155-E225 PolarHBondContact NZ-OE2 3.45Å
226	I	80.9	Confident	80.9	Confident	48 Å²	48	89.8 Å²	89.8	25%	0.246	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-96.1	129.4	169.4	-54.1	-173.9	0	0	0	108.3	R122 P124 E224	R122-I226 HydrophobicContact CB-CD1 3.6Å; R122-I226 HydrophobicContact CB-CG1 3.89Å; R122-I226 HydrophobicContact CG-CG1 4.47Å; P124-I226 HydrophobicContact CB-CD1 3.81Å; P124-I226 HydrophobicContact CG-CD1 4.3Å; E224-I226 PolarHBondContact O-N 3.12Å
227	G	75.5	Confident	79.9	Confident	55 Å²	55	90.5 Å²	90.5	57%	0.567	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-63.8	163.2	175.5	0	0	0	0	0	112.8
228	S	80.6	Confident	79	Confident	43 Å²	43	93 Å²	93	30%	0.301	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-81.6	146.2	172.3	54.4	0	0	0	0	110.6	N145 S148 W149 E230	N145-S228 WeakPolarHBondContact OD1-CA 3.32Å; N145-S228 VanDerWaalsContact OD1-CB 3.26Å; N145-S228 WeakPolarHBondContact OD1-CB 3.4Å; S148-S228 PolarHBondContact OG-N 2.92Å; W149-S228 VanDerWaalsContact NE1-CB 3.31Å; W149-S228 PolarHBondContact NE1-OG 2.92Å; W149-S228 VanDerWaalsContact NE1-OG 3.16Å; S228-E230 WeakPolarHBondContact CB-O 3.09Å; S228-E230 PolarHBondContact OG-O 3.19Å
229	S	71.3	Confident	78.3	Confident	81 Å²	81	91.3 Å²	91.3	57%	0.566	49%	0.486	S	S	*	.	S	Bend	trans	-74.3	-19.6	168.9	65.2	0	0	0	0	112.1	N145	N145-S229 PolarHBondContact ND2-OG 3.3Å; N145-S229 PolarHBondContact OD1-N 2.96Å; N145-S229 PolarHBondContact OD1-OG 3.21Å
230	E	83.1	Confident	77.1	Confident	95 Å²	95	92.7 Å²	92.7	44%	0.444	50%	0.502	S	S	.	.	S	Bend	trans	-119.3	148.8	-174.1	-70.4	-62.2	155.5	0	0	112.1	W149 L179 S228	W149-E230 HydrophobicContact CH2-CB 4.44Å; W149-E230 HydrophobicContact CZ2-CB 3.84Å; W149-E230 PolarHBondContact NE1-O 2.95Å; L179-E230 HydrophobicContact CD1-CB 4.19Å; L179-E230 HydrophobicContact CD1-CG 4.08Å; S228-E230 WeakPolarHBondContact CB-O 3.09Å; S228-E230 PolarHBondContact OG-O 3.19Å
231	N	79	Confident	75.7	Confident	168 Å²	168	91.3 Å²	91.3	90%	0.898	49%	0.489	S	S	*	.			trans	-83.3	123.5	177.9	-75	-27.7	0	0	0	110.5
232	F	85.3	Confident	73.8	Confident	49 Å²	49	89.3 Å²	89.3	22%	0.215	48%	0.478	C	S	.	.			trans	-108.5	122.8	174.6	173.2	-108.5	0	0	0	111.1	W149 Q171 A172 F234	W149-F232 HydrophobicContact CB-CB 4.47Å; W149-F232 HydrophobicContact CB-CD1 3.91Å; W149-F232 HydrophobicContact CB-CE1 4.34Å; W149-F232 HydrophobicContact CB-CG 4.21Å; W149-F232 VanDerWaalsContact CD1-CB 3.42Å; W149-F232 HydrophobicContact CD2-CB 3.52Å; W149-F232 HydrophobicContact CD2-CD1 4.4Å; W149-F232 HydrophobicContact CD2-CD2 4.16Å; W149-F232 AromaticContact CD2-CG 3.81Å; W149-F232 HydrophobicContact CD2-CG 3.81Å; W149-F232 HydrophobicContact CE3-CB 4.29Å; W149-F232 HydrophobicContact CE3-CD2 4.14Å; W149-F232 HydrophobicContact CE3-CG 4.26Å; W149-F232 HydrophobicContact CG-CB 3.57Å; W149-F232 AromaticContact CG-CD1 3.91Å; W149-F232 HydrophobicContact CG-CD1 3.91Å; W149-F232 HydrophobicContact CG-CD2 4.5Å; W149-F232 AromaticContact CG-CG 3.77Å; W149-F232 HydrophobicContact CG-CG 3.77Å; W149-F232 HydrophobicContact CZ2-CB 3.86Å; W149-F232 HydrophobicContact CZ3-CD2 4.48Å; W149-F232 VanDerWaalsContact NE1-CB 3.27Å; Q171-F232 HydrophobicContact CB-CE2 4.26Å; Q171-F232 HydrophobicContact CB-CZ 4.17Å; A172-F232 HydrophobicContact CB-CE1 4.05Å; A172-F232 HydrophobicContact CB-CE2 4.02Å; A172-F232 HydrophobicContact CB-CZ 3.71Å; F232-F234 HydrophobicContact CE1-CB 3.77Å; F232-F234 HydrophobicContact CZ-CB 4.02Å
233	H	80.5	Confident	71.9	Confident	164 Å²	164	93.8 Å²	93.8	76%	0.759	48%	0.484	S	S	*	.			trans	-112.4	105	172.9	-173.9	-70.5	0	0	0	109.8
234	F	81.3	Confident	69.3	Low	26 Å²	26	97.8 Å²	97.8	11%	0.114	50%	0.501	C	S	.	.			trans	-68.5	131.4	175	167.9	-123.8	0	0	0	111.6	W160 C168 F232 L236 C239	W160-F234 HydrophobicContact CD2-CE1 4.02Å; W160-F234 HydrophobicContact CE3-CD1 4.45Å; W160-F234 AromaticContact CE3-CE1 3.87Å; W160-F234 HydrophobicContact CE3-CE1 3.87Å; W160-F234 AromaticContact CH2-CD1 3.69Å; W160-F234 HydrophobicContact CH2-CD1 3.69Å; W160-F234 AromaticContact CH2-CE1 3.88Å; W160-F234 HydrophobicContact CH2-CE1 3.88Å; W160-F234 HydrophobicContact CZ2-CD1 4.03Å; W160-F234 HydrophobicContact CZ2-CE1 4.01Å; W160-F234 AromaticContact CZ3-CD1 3.92Å; W160-F234 HydrophobicContact CZ3-CD1 3.92Å; W160-F234 AromaticContact CZ3-CE1 3.8Å; W160-F234 HydrophobicContact CZ3-CE1 3.8Å; C168-F234 VanDerWaalsContact CA-CD2 3.49Å; C168-F234 HydrophobicContact CB-CD1 4.15Å; C168-F234 HydrophobicContact CB-CD2 3.64Å; C168-F234 HydrophobicContact CB-CE1 4.03Å; C168-F234 HydrophobicContact CB-CE2 3.52Å; C168-F234 HydrophobicContact CB-CG 3.94Å; C168-F234 HydrophobicContact CB-CZ 3.7Å; C168-F234 VanDerWaalsContact SG-CG 3.56Å; F232-F234 HydrophobicContact CE1-CB 3.77Å; F232-F234 HydrophobicContact CZ-CB 4.02Å; F234-L236 HydrophobicContact CE1-CB 3.96Å; F234-L236 HydrophobicContact CE1-CD1 3.6Å; F234-L236 HydrophobicContact CE1-CG 4.39Å; F234-L236 HydrophobicContact CZ-CB 4.16Å; F234-L236 HydrophobicContact CZ-CD1 3.57Å; F234-L236 HydrophobicContact CZ-CG 4.47Å; F234-C239 WeakPolarHBondContact CE2-SG 3.05Å; F234-C239 WeakPolarHBondContact CZ-SG 2.89Å
235	N	76.5	Confident	66.7	Low	59 Å²	59	94.1 Å²	94.1	32%	0.316	49%	0.494	S	S	.	.			trans	-109	105.8	173	-161.8	-31.5	0	0	0	111.2	Q171 N237 N238	Q171-N235 PolarHBondContact NE2-O 3.39Å; N235-N237 PolarHBondContact O-N 2.95Å; N235-N237 VanDerWaalsContact OD1-CB 3.29Å; N235-N237 WeakPolarHBondContact OD1-CB 3.21Å; N235-N237 PolarHBondContact OD1-N 3.49Å; N235-N237 PolarHBondContact OD1-ND2 3.35Å; N235-N238 PolarHBondContact O-N 3.18Å
236	L	73.2	Confident	64.6	Low	73 Å²	73	94.4 Å²	94.4	38%	0.382	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-62.8	-21.6	178.2	-167.5	69.5	0	0	0	112.8	W160 F234 N238 C239	W160-L236 HydrophobicContact CB-CD1 4.02Å; W160-L236 HydrophobicContact CD2-CD1 4.27Å; W160-L236 HydrophobicContact CE3-CD1 4.04Å; W160-L236 HydrophobicContact CE3-CD2 4.32Å; W160-L236 HydrophobicContact CG-CD1 4.28Å; F234-L236 HydrophobicContact CE1-CB 3.96Å; F234-L236 HydrophobicContact CE1-CD1 3.6Å; F234-L236 HydrophobicContact CE1-CG 4.39Å; F234-L236 HydrophobicContact CZ-CB 4.16Å; F234-L236 HydrophobicContact CZ-CD1 3.57Å; F234-L236 HydrophobicContact CZ-CG 4.47Å; L236-N238 VanDerWaalsContact C-N 3.3Å; L236-N238 PolarHBondContact O-N 3Å; L236-C239 VanDerWaalsContact O-CB 3.31Å; L236-C239 WeakPolarHBondContact O-CB 3.39Å; L236-C239 PolarHBondContact O-N 3.32Å
237	N	68	Low	62.3	Low	105 Å²	105	97.2 Å²	97.2	56%	0.561	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-75.8	-18.4	179.1	-62.4	-47.6	0	0	0	113.6	N235 R241	N235-N237 PolarHBondContact O-N 2.95Å; N235-N237 VanDerWaalsContact OD1-CB 3.29Å; N235-N237 WeakPolarHBondContact OD1-CB 3.21Å; N235-N237 PolarHBondContact OD1-N 3.49Å; N235-N237 PolarHBondContact OD1-ND2 3.35Å; N237-R241 PolarHBondContact OD1-NH2 3.49Å
238	N	70.2	Confident	60.4	Low	118 Å²	118	100 Å²	100	63%	0.631	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-83.3	-4.9	173.6	-68.3	-10.5	0	0	0	112	N235 L236	N235-N238 PolarHBondContact O-N 3.18Å; L236-N238 VanDerWaalsContact C-N 3.3Å; L236-N238 PolarHBondContact O-N 3Å
239	C	71.3	Confident	58.2	Low	12 Å²	12	106 Å²	106	8%	0.081	57%	0.568	C	S	.	*	S	Bend	trans	-82.4	144.4	175.6	-54.5	0	0	0	0	111.5	C167 F234 L236 R241	C167-C239 HydrophobicContact CB-CB 3.56Å; C167-C239 WeakPolarHBondContact CB-SG 3.24Å; C167-C239 WeakPolarHBondContact SG-CA 3.32Å; C167-C239 WeakPolarHBondContact SG-CB 3.39Å; C167-C239 CovalentContact SG-SG 2.01Å; C167-C239 PolarHBondContact SG-SG 3.1Å; F234-C239 WeakPolarHBondContact CE2-SG 3.05Å; F234-C239 WeakPolarHBondContact CZ-SG 2.89Å; L236-C239 VanDerWaalsContact O-CB 3.31Å; L236-C239 WeakPolarHBondContact O-CB 3.39Å; L236-C239 PolarHBondContact O-N 3.32Å; C239-R241 PolarHBondContact O-N 3.39Å
240	P	60.3	Low	56.5	Low	107 Å²	107	114.1 Å²	114.1	70%	0.695	59%	0.586	S	S	*	*			trans	-58.2	109.8	161.4	-7.2	20.1	0	0	0	107.6	I242	P240-I242 PolarHBondContact O-N 3.46Å
241	R	46.1	Very low	54	Low	163 Å²	163	113.8 Å²	113.8	62%	0.615	60%	0.599	S	S	*	*			trans	-71	116.4	-178.2	-75.1	-169.5	-178.8	-179.2	-0.1	110.5	N237 C239	N237-R241 PolarHBondContact OD1-NH2 3.49Å; C239-R241 PolarHBondContact O-N 3.39Å
242	I	41.2	Very low	51.8	Low	91 Å²	91	114.3 Å²	114.3	47%	0.467	60%	0.601	S	S	.	*			trans	-68.5	132.6	149.1	-44.6	-177.2	0	0	0	108.1	E163 P240 M244	E163-I242 HydrophobicContact CB-CD1 3.69Å; E163-I242 HydrophobicContact CB-CG1 3.96Å; E163-I242 HydrophobicContact CG-CD1 3.52Å; E163-I242 HydrophobicContact CG-CG1 4.04Å; E163-I242 WeakPolarHBondContact OE1-CD1 3.28Å; E163-I242 VanDerWaalsContact OE2-CD1 3.27Å; E163-I242 WeakPolarHBondContact OE2-CD1 3.37Å; E163-I242 WeakPolarHBondContact OE2-CG1 3.44Å; P240-I242 PolarHBondContact O-N 3.46Å; I242-M244 PolarHBondContact O-N 3.46Å
243	R	39	Very low	49.2	Very low	180 Å²	180	116 Å²	116	68%	0.679	63%	0.633	S	S	*	*			trans	-61.6	98.1	156.4	-72.3	179.1	156	-123.8	-19.9	109.7	K266	R243-K266 VanDerWaalsContact NH2-CE 3.32Å
244	M	30.7	Very low	46.7	Very low	128 Å²	128	111.7 Å²	111.7	63%	0.631	63%	0.632	S	S	*	*			trans	-67.1	135.7	161.7	-66.5	-174.3	86.4	0	0	109.5	I242	I242-M244 PolarHBondContact O-N 3.46Å
245	S	29.1	Very low	44.2	Very low	92 Å²	92	120.2 Å²	120.2	64%	0.643	67%	0.673	S	S	*	*			trans	-57.8	144.1	173	-173.8	0	0	0	0	110.9	S247	S245-S247 VanDerWaalsContact C-N 3.3Å; S245-S247 PolarHBondContact O-N 3.25Å
246	P	33.4	Very low	42.1	Very low	126 Å²	126	127.2 Å²	127.2	82%	0.818	70%	0.7	S	S	*	*	S	Bend	trans	-74.3	81.4	178.5	31.6	-33.5	0	0	0	110
247	S	32.5	Very low	40.3	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	72%	0.719	S	S	*	*			trans	-145.8	7.8	173.8	-56.2	0	0	0	0	115.8	S245	S245-S247 VanDerWaalsContact C-N 3.3Å; S245-S247 PolarHBondContact O-N 3.25Å
248	S	36.3	Very low	38.3	Very low	113 Å²	113	133 Å²	133	79%	0.79	73%	0.732	S	S	*	*			trans	-144.6	64.1	174.4	-162.1	0	0	0	0	113.1
249	I	33.7	Very low	36.5	Very low	171 Å²	171	133.6 Å²	133.6	88%	0.877	73%	0.734	S	S	*	*			trans	-135.6	82.9	152	-55.4	-178.6	0	0	0	107
250	R	35.6	Very low	34.8	Very low	251 Å²	251	140.5 Å²	140.5	95%	0.947	77%	0.77	S	S	*	*			trans	-150.5	66.5	158.9	-157.4	-178.8	-97.1	-136.4	1	109
251	A	31.9	Very low	33.3	Very low	88 Å²	88	139.7 Å²	139.7	73%	0.727	77%	0.773	S	S	*	*	S	Bend	trans	-156.9	131.6	156.9	0	0	0	0	0	109.2
252	L	32.9	Very low	32.8	Very low	179 Å²	179	138 Å²	138	94%	0.937	78%	0.783	S	S	*	*			trans	78.5	91	173.1	-53.4	173.3	0	0	0	115.3
253	G	29.3	Very low	32.3	Very low	85 Å²	85	139.9 Å²	139.9	88%	0.876	80%	0.799	S	S	*	*			trans	-82.1	170.1	164.7	0	0	0	0	0	112.4
254	G	29.5	Very low	32.3	Very low	73 Å²	73	135 Å²	135	75%	0.753	79%	0.792	S	S	*	*			trans	120.1	81.1	165.2	0	0	0	0	0	113.5
255	E	28.4	Very low	32.9	Very low	205 Å²	205	130.4 Å²	130.4	96%	0.958	77%	0.772	S	S	*	*				161.5	154	121.9	-83.3	-177.8	145.6	0	0	112
256	K	31.2	Very low	33.8	Very low	205 Å²	205	131.8 Å²	131.8	89%	0.891	77%	0.767	S	S	*	*			trans	-61.6	160.2	-154.7	-89.1	174.6	171.2	175.7	0	117.4
257	P	35.1	Very low	35.1	Very low	121 Å²	121	130 Å²	130	79%	0.786	75%	0.749	S	S	*	*			trans	-92	130.9	176.5	34.9	-27.7	0	0	0	112.6
258	E	26.4	Very low	36.7	Very low	178 Å²	178	129.8 Å²	129.8	83%	0.832	74%	0.74	S	S	*	*			trans	-132.1	110.7	153.6	-87.2	-165.8	152.2	0	0	112.1
259	I	32.7	Very low	38.7	Very low	131 Å²	131	125.5 Å²	125.5	67%	0.672	71%	0.708	S	S	*	*			trans	72.1	92.8	133.1	-53.6	176.9	0	0	0	118.1
260	N	35.7	Very low	41	Very low	157 Å²	157	118.7 Å²	118.7	84%	0.84	67%	0.673	S	S	*	*			trans	62.4	91.7	132.9	-56.9	-28.2	0	0	0	119.5
261	A	28.1	Very low	43.3	Very low	91 Å²	91	107.7 Å²	107.7	75%	0.752	63%	0.632	S	S	*	*			trans	-124.3	133.1	146.2	0	0	0	0	0	109.3	T263	A261-T263 PolarHBondContact O-N 3.27Å
262	P	36	Very low	45.9	Very low	128 Å²	128	103.8 Å²	103.8	83%	0.831	60%	0.599	S	S	*	*			trans	-70.5	126.2	-168.6	28.6	-32.7	0	0	0	110.4	S264	P262-S264 PolarHBondContact O-N 2.99Å; P262-S264 VanDerWaalsContact O-N 3.11Å
263	T	30.5	Very low	48.3	Very low	130 Å²	130	95.9 Å²	95.9	80%	0.798	56%	0.559	S	S	*	*			trans	-39	114.6	167.5	-39.5	0	0	0	0	110.1	A261 P265	A261-T263 PolarHBondContact O-N 3.27Å; T263-P265 WeakPolarHBondContact O-CD 3.37Å; T263-P265 WeakPolarHBondContact O-CG 3.49Å
264	S	39.6	Very low	51	Low	77 Å²	77	91.8 Å²	91.8	54%	0.538	52%	0.517	S	S	.	.			trans	-54.2	113.5	175.1	-179.6	0	0	0	0	109	P262 K266	P262-S264 PolarHBondContact O-N 2.99Å; P262-S264 VanDerWaalsContact O-N 3.11Å; S264-K266 PolarHBondContact O-N 2.05Å
265	P	43.5	Very low	53.9	Low	32 Å²	32	92.3 Å²	92.3	21%	0.208	50%	0.496	C	S	.	.			trans	-74.9	133.2	-173.9	-21.7	38.9	0	0	0	108.9	T263 I267 I482 P483	T263-P265 WeakPolarHBondContact O-CD 3.37Å; T263-P265 WeakPolarHBondContact O-CG 3.49Å; P265-I267 PolarHBondContact O-N 3.21Å; P265-I482 HydrophobicContact CB-CB 4.19Å; P265-I482 HydrophobicContact CB-CG2 3.24Å; P265-I482 HydrophobicContact CG-CG2 3.32Å; P265-P483 VanDerWaalsContact CB-CD 3.48Å; P265-P483 HydrophobicContact CB-CG 3.74Å
266	K	46.5	Very low	56.9	Low	121 Å²	121	82.6 Å²	82.6	53%	0.526	45%	0.451	S	S	.	.			trans	-52.3	109.3	176.3	-168.7	-163.9	-167.1	176.7	0	109.1	R243 S264 D268 P483	R243-K266 VanDerWaalsContact NH2-CE 3.32Å; S264-K266 PolarHBondContact O-N 2.05Å; K266-D268 PolarHBondContact O-N 3.08Å; K266-P483 HydrophobicContact CB-CG 4.47Å; K266-P483 WeakPolarHBondContact O-CD 3.43Å
267	I	60.8	Low	59.6	Low	88 Å²	88	74.9 Å²	74.9	45%	0.451	42%	0.421	S	S	.	.			trans	-75.6	110.2	179.6	-59.7	172.9	0	0	0	108.3	P265 I269 L307 P481	P265-I267 PolarHBondContact O-N 3.21Å; I267-I269 HydrophobicContact CG2-CG1 4.05Å; I267-I269 HydrophobicContact CG2-CG2 4.36Å; I267-L307 HydrophobicContact CD1-CD2 4.1Å; I267-L307 HydrophobicContact CG1-CD2 4.33Å; I267-L307 HydrophobicContact CG2-CD1 3.53Å; I267-L307 HydrophobicContact CG2-CD2 4.16Å; I267-P481 VanDerWaalsContact CA-O 3.29Å; I267-P481 WeakPolarHBondContact CA-O 3.41Å
268	D	67.4	Low	62	Low	101 Å²	101	72.4 Å²	72.4	54%	0.54	41%	0.41	S	S	.	.			trans	-108.3	83.1	-178.4	-174.6	21.9	0	0	0	110.3	K266 Y294 P481	K266-D268 PolarHBondContact O-N 3.08Å; D268-Y294 WeakPolarHBondContact O-CE1 3.4Å; D268-P481 PolarHBondContact N-O 2.97Å; D268-P481 VanDerWaalsContact N-O 3.15Å
269	I	77.9	Confident	64.8	Low	24 Å²	24	70.5 Å²	70.5	12%	0.123	41%	0.406	C	S	.	.			trans	-130.8	139.8	176.6	64.9	161.7	0	0	0	113.2	I267 F271 Y294 L307 Q310 V311 I314 P481	I267-I269 HydrophobicContact CG2-CG1 4.05Å; I267-I269 HydrophobicContact CG2-CG2 4.36Å; I269-F271 VanDerWaalsContact C-N 3.27Å; I269-F271 HydrophobicContact CD1-CB 3.85Å; I269-F271 HydrophobicContact CG1-CB 4.31Å; I269-F271 PolarHBondContact O-N 3.29Å; I269-Y294 HydrophobicContact CB-CE1 4.36Å; I269-Y294 HydrophobicContact CB-CE2 4.47Å; I269-Y294 HydrophobicContact CG2-CD1 3.93Å; I269-Y294 HydrophobicContact CG2-CE1 3.85Å; I269-Y294 HydrophobicContact CG2-CG 4.32Å; I269-L307 HydrophobicContact CD1-CD1 3.53Å; I269-L307 HydrophobicContact CG1-CD1 4.23Å; I269-L307 HydrophobicContact CG2-CD1 4.43Å; I269-Q310 HydrophobicContact CD1-CB 3.86Å; I269-V311 HydrophobicContact CG2-CG2 4.3Å; I269-I314 HydrophobicContact CB-CD1 4.27Å; I269-I314 HydrophobicContact CD1-CD1 4.5Å; I269-P481 HydrophobicContact CG2-CB 3.59Å; I269-P481 HydrophobicContact CG2-CG 4.1Å
270	N	82.3	Confident	67.4	Low	27 Å²	27	64.3 Å²	64.3	14%	0.144	37%	0.374	C	S	.	.			trans	-83	69.5	175.1	-62.3	-4.1	0	0	0	111	Y294 T376	N270-Y294 PolarHBondContact N-OH 3.13Å; N270-Y294 VanDerWaalsContact N-OH 3.13Å; N270-T376 VanDerWaalsContact ND2-CB 3.3Å; N270-T376 WeakPolarHBondContact ND2-CB 3.49Å; N270-T376 WeakPolarHBondContact ND2-CG2 3.27Å
271	F	84.1	Confident	69.9	Low	20 Å²	20	58 Å²	58	9%	0.088	34%	0.34	C	S	.	.			trans	-130.6	136	174.5	-169.2	-93.3	0	0	0	110.3	I269 Q310 T313 I314 Y346 F365	I269-F271 VanDerWaalsContact C-N 3.27Å; I269-F271 HydrophobicContact CD1-CB 3.85Å; I269-F271 HydrophobicContact CG1-CB 4.31Å; I269-F271 PolarHBondContact O-N 3.29Å; F271-Q310 HydrophobicContact CB-CB 4.43Å; F271-Q310 HydrophobicContact CD1-CB 4.13Å; F271-Q310 HydrophobicContact CD1-CG 3.69Å; F271-Q310 HydrophobicContact CD2-CB 4.14Å; F271-Q310 HydrophobicContact CD2-CG 4.45Å; F271-Q310 HydrophobicContact CE1-CB 4.44Å; F271-Q310 HydrophobicContact CE1-CG 3.73Å; F271-Q310 HydrophobicContact CE2-CB 4.46Å; F271-Q310 HydrophobicContact CE2-CG 4.49Å; F271-Q310 HydrophobicContact CG-CB 3.97Å; F271-Q310 HydrophobicContact CG-CG 4.06Å; F271-Q310 HydrophobicContact CZ-CG 4.15Å; F271-T313 HydrophobicContact CE2-CG2 4.07Å; F271-I314 HydrophobicContact CB-CD1 3.92Å; F271-I314 HydrophobicContact CB-CG1 4.25Å; F271-I314 HydrophobicContact CD2-CD1 4.39Å; F271-I314 HydrophobicContact CD2-CG1 3.84Å; F271-Y346 HydrophobicContact CZ-CD1 4.38Å; F271-Y346 HydrophobicContact CZ-CD2 4.39Å; F271-Y346 HydrophobicContact CZ-CE1 4.11Å; F271-Y346 HydrophobicContact CZ-CE2 4.03Å; F271-Y346 AromaticContact CZ-CZ 3.87Å; F271-F365 HydrophobicContact CE1-CE1 4.48Å; F271-F365 HydrophobicContact CZ-CE1 4.4Å
272	P	85.3	Confident	72.7	Confident	7 Å²	7	61.4 Å²	61.4	5%	0.045	34%	0.341	C	S	.	.	S	Bend	cis	-75.9	149.7	-2	28.5	-33.4	0	0	0	114.2	F365 L368 S369	P272-F365 HydrophobicContact CB-CB 4.4Å; P272-F365 HydrophobicContact CB-CD1 3.62Å; P272-F365 HydrophobicContact CB-CE1 4.41Å; P272-F365 HydrophobicContact CB-CG 4.47Å; P272-F365 HydrophobicContact CG-CD1 4.09Å; P272-F365 VanDerWaalsContact CG-O 3.32Å; P272-F365 WeakPolarHBondContact CG-O 3.29Å; P272-L368 VanDerWaalsContact CD-O 3.29Å; P272-L368 WeakPolarHBondContact CD-O 3.4Å; P272-L368 HydrophobicContact CG-CB 3.82Å; P272-S369 WeakPolarHBondContact O-CA 2.93Å; P272-S369 WeakPolarHBondContact O-CB 2.99Å; P272-S369 PolarHBondContact O-OG 3.04Å
273	P	84.8	Confident	75	Confident	12 Å²	12	57.1 Å²	57.1	8%	0.078	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-73.5	139.9	175.2	28.6	-30.7	0	0	0	111	L317 W339	P273-L317 HydrophobicContact CB-CD1 4.46Å; P273-L317 HydrophobicContact CG-CD1 3.48Å; P273-L317 VanDerWaalsContact CG-CD1 3.48Å; P273-W339 PolarHBondContact O-NE1 3.12Å
274	G	85.8	Confident	77.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-62.7	148	-178.9	0	0	0	0	0	113.7	P276 W339 S369 Y374	G274-P276 WeakPolarHBondContact O-CD 3.37Å; G274-W339 PolarHBondContact O-NE1 2.66Å; G274-S369 VanDerWaalsContact CA-OG 3.3Å; G274-S369 WeakPolarHBondContact CA-OG 3.45Å; G274-S369 PolarHBondContact N-OG 2.97Å; G274-Y374 PolarHBondContact O-OH 3.1Å
275	R	90.2	Very high	80	Confident	83 Å²	83	49 Å²	49	31%	0.313	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-63.2	127.3	173.1	-176.9	175.3	173.7	-169.9	-8.6	109.8	T277 N280 E336 W339 R340	R275-T277 PolarHBondContact O-N 2.97Å; R275-N280 PolarHBondContact O-ND2 3.22Å; R275-E336 IonicContact CZ-OE1 3.35Å; R275-E336 IonicContact NE-OE1 3.77Å; R275-E336 PolarHBondContact NE-OE1 3.2Å; R275-E336 IonicContact NH2-OE1 3.16Å; R275-E336 PolarHBondContact NH2-OE1 3.49Å; R275-W339 HydrophobicContact CB-CH2 3.96Å; R275-W339 HydrophobicContact CB-CZ2 3.89Å; R275-W339 HydrophobicContact CB-CZ3 4.31Å; R275-W339 HydrophobicContact CG-CE3 4.28Å; R275-W339 HydrophobicContact CG-CH2 4.23Å; R275-W339 HydrophobicContact CG-CZ3 4.09Å; R275-R340 VanDerWaalsContact CZ-NH2 3.3Å
276	P	90.9	Very high	81.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-62.7	125.4	172	-23.5	35.4	0	0	0	111.1	G274 N280 L284 F321 L332 A335 W339	G274-P276 WeakPolarHBondContact O-CD 3.37Å; P276-N280 WeakPolarHBondContact CA-OD1 3.4Å; P276-L284 HydrophobicContact CB-CD1 4.08Å; P276-L284 HydrophobicContact CG-CD1 3.9Å; P276-F321 HydrophobicContact CG-CE1 3.94Å; P276-F321 HydrophobicContact CG-CZ 4.02Å; P276-L332 HydrophobicContact CB-CD1 4.42Å; P276-A335 HydrophobicContact CB-CB 3.87Å; P276-A335 HydrophobicContact CG-CB 3.86Å; P276-W339 HydrophobicContact CG-CB 4.19Å; P276-W339 HydrophobicContact CG-CG 4.49Å
277	T	88.3	Confident	83.5	Confident	44 Å²	44	46.5 Å²	46.5	27%	0.27	27%	0.267	S	S	.	.			trans	-127.9	169.2	176.1	63.3	0	0	0	0	109.8	R275 D279 N280 I281 L332	R275-T277 PolarHBondContact O-N 2.97Å; T277-D279 PolarHBondContact O-N 3.2Å; T277-N280 PolarHBondContact N-OD1 3.2Å; T277-N280 PolarHBondContact O-N 3.48Å; T277-N280 PolarHBondContact O-OD1 3.2Å; T277-N280 VanDerWaalsContact O-OD1 3.14Å; T277-I281 WeakPolarHBondContact O-CB 3.47Å; T277-I281 PolarHBondContact O-N 2.97Å; T277-I281 VanDerWaalsContact O-N 3.12Å; T277-L332 WeakPolarHBondContact O-CD1 3.25Å
278	A	86	Confident	84.4	Confident	68 Å²	68	44.8 Å²	44.8	56%	0.562	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.7	175.3	0	0	0	0	0	111.9	I281 L332	A278-I281 WeakPolarHBondContact O-CG2 3.39Å; A278-L332 HydrophobicContact CB-CD2 4.47Å
279	D	84.1	Confident	84.7	Confident	138 Å²	138	48 Å²	48	74%	0.738	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-26.8	-175.6	-46.2	-46.6	0	0	0	113.3	T277	T277-D279 PolarHBondContact O-N 3.2Å
280	N	88.4	Confident	84.5	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.011	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-6.6	-174.7	72.9	18.1	0	0	0	114.5	R275 P276 T277 E282 S283 L284 P372 L373 Y374	R275-N280 PolarHBondContact O-ND2 3.22Å; P276-N280 WeakPolarHBondContact CA-OD1 3.4Å; T277-N280 PolarHBondContact N-OD1 3.2Å; T277-N280 PolarHBondContact O-N 3.48Å; T277-N280 PolarHBondContact O-OD1 3.2Å; T277-N280 VanDerWaalsContact O-OD1 3.14Å; N280-E282 VanDerWaalsContact C-N 3.27Å; N280-E282 PolarHBondContact O-N 3.19Å; N280-S283 PolarHBondContact O-N 2.99Å; N280-L284 WeakPolarHBondContact O-CB 2.92Å; N280-L284 PolarHBondContact O-N 2.03Å; N280-P372 PolarHBondContact ND2-O 3.01Å; N280-L373 HydrophobicContact CB-CD2 4.11Å; N280-Y374 HydrophobicContact CB-CD2 4.4Å
281	I	87.9	Confident	84.5	Confident	24 Å²	24	52.5 Å²	52.5	12%	0.123	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-32.8	-175.3	-168.6	58.8	0	0	0	112.6	T277 A278 L284 C285 A331 L332 A335	T277-I281 WeakPolarHBondContact O-CB 3.47Å; T277-I281 PolarHBondContact O-N 2.97Å; T277-I281 VanDerWaalsContact O-N 3.12Å; A278-I281 WeakPolarHBondContact O-CG2 3.39Å; I281-L284 HydrophobicContact CD1-CD1 4.4Å; I281-L284 HydrophobicContact CD1-CD2 4.39Å; I281-C285 WeakPolarHBondContact O-CB 3.11Å; I281-C285 PolarHBondContact O-N 3.23Å; I281-A331 HydrophobicContact CD1-CB 4.29Å; I281-A331 HydrophobicContact CG1-CB 4.23Å; I281-L332 HydrophobicContact CB-CD1 4.32Å; I281-L332 HydrophobicContact CG1-CB 4.22Å; I281-A335 HydrophobicContact CD1-CB 4.01Å
282	E	85.7	Confident	84.3	Confident	162 Å²	162	52 Å²	52	76%	0.757	28%	0.276	S	S	*	.	H	α-helix	trans	-67	-47.8	176.6	-63.1	-165.6	165.1	0	0	111.1	N280 C285 G286	N280-E282 VanDerWaalsContact C-N 3.27Å; N280-E282 PolarHBondContact O-N 3.19Å; E282-C285 PolarHBondContact O-N 3.33Å; E282-G286 WeakPolarHBondContact O-CA 3.45Å; E282-G286 PolarHBondContact O-N 3.33Å
283	S	85.4	Confident	84.2	Confident	38 Å²	38	54.1 Å²	54.1	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-44.1	174.8	-62.1	0	0	0	0	111.8	N280 C285 G286 N287 L373	N280-S283 PolarHBondContact O-N 2.99Å; S283-C285 VanDerWaalsContact C-N 3.33Å; S283-C285 PolarHBondContact O-N 3Å; S283-G286 PolarHBondContact O-N 2.79Å; S283-N287 VanDerWaalsContact O-CB 3.27Å; S283-N287 WeakPolarHBondContact O-CB 3.02Å; S283-N287 PolarHBondContact O-N 2.04Å; S283-L373 VanDerWaalsContact CB-O 3.23Å; S283-L373 WeakPolarHBondContact CB-O 3.44Å
284	L	87.1	Confident	84.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.9	-46.6	176.3	-175.3	161.8	0	0	0	111.3	P276 N280 I281 F321 C325 A335 Y374	P276-L284 HydrophobicContact CB-CD1 4.08Å; P276-L284 HydrophobicContact CG-CD1 3.9Å; N280-L284 WeakPolarHBondContact O-CB 2.92Å; N280-L284 PolarHBondContact O-N 2.03Å; I281-L284 HydrophobicContact CD1-CD1 4.4Å; I281-L284 HydrophobicContact CD1-CD2 4.39Å; L284-F321 HydrophobicContact CD1-CD1 4.34Å; L284-F321 HydrophobicContact CD1-CD2 4.39Å; L284-F321 HydrophobicContact CD1-CE1 4.28Å; L284-F321 HydrophobicContact CD1-CE2 4.3Å; L284-F321 HydrophobicContact CD1-CG 4.4Å; L284-F321 HydrophobicContact CD1-CZ 4.24Å; L284-F321 HydrophobicContact CD2-CB 3.93Å; L284-F321 HydrophobicContact CD2-CD1 4.34Å; L284-F321 HydrophobicContact CD2-CD2 4.43Å; L284-F321 HydrophobicContact CD2-CG 4.01Å; L284-C325 VanDerWaalsContact CD2-SG 3.53Å; L284-A335 HydrophobicContact CD1-CB 4.42Å; L284-Y374 HydrophobicContact CB-CD2 3.91Å; L284-Y374 HydrophobicContact CB-CE2 4.34Å; L284-Y374 HydrophobicContact CB-CG 4.11Å; L284-Y374 HydrophobicContact CD1-CD2 4.07Å; L284-Y374 HydrophobicContact CD1-CE1 4.35Å; L284-Y374 HydrophobicContact CD1-CE2 3.61Å; L284-Y374 HydrophobicContact CG-CD2 4.2Å; L284-Y374 HydrophobicContact CG-CE1 4.46Å; L284-Y374 HydrophobicContact CG-CE2 4.2Å; L284-Y374 HydrophobicContact CG-CG 4.34Å
285	C	87.6	Confident	84.2	Confident	37 Å²	37	55 Å²	55	25%	0.25	29%	0.291	C	S	.	.	H	α-helix	trans	-80.3	-36	-179.3	-70.2	0	0	0	0	113.7	I281 E282 S283 R288 C325	I281-C285 WeakPolarHBondContact O-CB 3.11Å; I281-C285 PolarHBondContact O-N 3.23Å; E282-C285 PolarHBondContact O-N 3.33Å; S283-C285 VanDerWaalsContact C-N 3.33Å; S283-C285 PolarHBondContact O-N 3Å; C285-R288 WeakPolarHBondContact O-CB 3.33Å; C285-C325 WeakPolarHBondContact CA-SG 3.34Å; C285-C325 HydrophobicContact CB-CB 3.69Å; C285-C325 WeakPolarHBondContact CB-SG 3.31Å; C285-C325 WeakPolarHBondContact SG-CB 3.49Å; C285-C325 CovalentContact SG-SG 2.05Å; C285-C325 PolarHBondContact SG-SG 3.13Å
286	G	83.7	Confident	83.9	Confident	60 Å²	60	53.3 Å²	53.3	62%	0.619	29%	0.291	S	S	*	.	H	α-helix	trans	-68.6	-44.7	179.1	0	0	0	0	0	112.6	E282 S283 R288	E282-G286 WeakPolarHBondContact O-CA 3.45Å; E282-G286 PolarHBondContact O-N 3.33Å; S283-G286 PolarHBondContact O-N 2.79Å; G286-R288 VanDerWaalsContact C-N 3.34Å; G286-R288 PolarHBondContact O-N 3.07Å
287	N	79.9	Confident	83.5	Confident	41 Å²	41	62.7 Å²	62.7	22%	0.219	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-86.9	0.1	-177.3	-65.9	-28.7	0	0	0	114	S283 K289 R290 R291 Y374 T377	S283-N287 VanDerWaalsContact O-CB 3.27Å; S283-N287 WeakPolarHBondContact O-CB 3.02Å; S283-N287 PolarHBondContact O-N 2.04Å; N287-K289 PolarHBondContact O-N 3.47Å; N287-R290 CarbonylContact O-C 3.58Å; N287-R290 WeakPolarHBondContact O-CA 3.5Å; N287-R290 PolarHBondContact O-N 3.24Å; N287-R291 HydrophobicContact CB-CG 4.31Å; N287-R291 WeakPolarHBondContact O-CG 3.29Å; N287-R291 PolarHBondContact O-N 2.79Å; N287-Y374 PolarHBondContact ND2-O 3.32Å; N287-Y374 VanDerWaalsContact ND2-O 3.15Å; N287-T377 HydrophobicContact CB-CG2 4.02Å
288	R	79.7	Confident	83.1	Confident	52 Å²	52	63.2 Å²	63.2	20%	0.196	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-47.8	-33.9	-179	-175.4	-174.5	115.7	-175.4	-9.6	115.4	C285 G286 K322	C285-R288 WeakPolarHBondContact O-CB 3.33Å; G286-R288 VanDerWaalsContact C-N 3.34Å; G286-R288 PolarHBondContact O-N 3.07Å; R288-K322 HydrophobicContact CG-CB 4.33Å; R288-K322 VanDerWaalsContact CZ-CG 3.43Å; R288-K322 PolarHBondContact NH1-O 3.35Å
289	K	74.4	Confident	82.8	Confident	169 Å²	169	61 Å²	61	74%	0.735	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-82.1	-19.4	177.5	-68.9	-177.9	-174.8	171.3	0	113	N287 K476	N287-K289 PolarHBondContact O-N 3.47Å; K289-K476 WeakPolarHBondContact O-CE 3.46Å; K289-K476 PolarHBondContact O-NZ 3.31Å
290	R	73.6	Confident	82.6	Confident	140 Å²	140	57.9 Å²	57.9	53%	0.528	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-15.5	-177.9	-61	-178.2	178.6	-96.6	7.8	113.3	N287 T377 S378	N287-R290 CarbonylContact O-C 3.58Å; N287-R290 WeakPolarHBondContact O-CA 3.5Å; N287-R290 PolarHBondContact O-N 3.24Å; R290-T377 HydrophobicContact CB-CG2 3.56Å; R290-S378 PolarHBondContact O-N 2.04Å; R290-S378 PolarHBondContact O-OG 3.29Å
291	R	81.3	Confident	81.7	Confident	5 Å²	5	70 Å²	70	2%	0.019	35%	0.348	C	S	.	.	S	Bend	trans	-66	142.9	175.8	-68.7	-173.3	-52.4	177.5	1.4	112.8	N287 E318 K476	N287-R291 HydrophobicContact CB-CG 4.31Å; N287-R291 WeakPolarHBondContact O-CG 3.29Å; N287-R291 PolarHBondContact O-N 2.79Å; R291-E318 IonicContact CZ-OE1 3.36Å; R291-E318 IonicContact CZ-OE2 3.56Å; R291-E318 IonicContact NE-OE1 2.78Å; R291-E318 PolarHBondContact NE-OE1 2.97Å; R291-E318 VanDerWaalsContact NE-OE1 3.17Å; R291-E318 IonicContact NE-OE2 3.99Å; R291-E318 PolarHBondContact NE-OE2 2.04Å; R291-E318 IonicContact NH1-OE1 3.93Å; R291-E318 PolarHBondContact NH1-OE1 3.24Å; R291-E318 VanDerWaalsContact NH1-OE1 3.12Å; R291-E318 IonicContact NH2-OE1 3.26Å; R291-E318 PolarHBondContact NH2-OE1 3.3Å; R291-E318 IonicContact NH2-OE2 2.9Å; R291-E318 PolarHBondContact NH2-OE2 3.36Å; R291-K476 PolarHBondContact O-NZ 3.19Å
292	P	80.1	Confident	80.7	Confident	10 Å²	10	73.3 Å²	73.3	7%	0.065	37%	0.372	C	S	.	.			trans	-66.4	149.4	-178.9	26.8	-33.5	0	0	0	111.9	Y294 I479	P292-Y294 HydrophobicContact CB-CE1 4.43Å; P292-Y294 HydrophobicContact CB-CE2 4.28Å; P292-Y294 HydrophobicContact CG-CE2 4.25Å; P292-I479 HydrophobicContact CB-CD1 3.69Å
293	L	83.9	Confident	80	Confident	50 Å²	50	69.1 Å²	69.1	26%	0.262	37%	0.373	S	S	.	.			trans	-124.6	140.7	168.3	-68.2	175	0	0	0	107.3	E318 K476 K478 I479	L293-E318 HydrophobicContact CD2-CB 3.74Å; L293-E318 HydrophobicContact CD2-CG 3.9Å; L293-K476 HydrophobicContact CD1-CD 4.27Å; L293-K478 HydrophobicContact CB-CG 4.29Å; L293-K478 CarbonylContact O-C 3.32Å; L293-K478 WeakPolarHBondContact O-CA 3.14Å; L293-I479 PolarHBondContact O-N 3.09Å
294	Y	85.6	Confident	79.7	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.016	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-110.6	154.8	-172.8	-58.2	-81.1	0	0	0	111.8	D268 I269 N270 P292 I314 N315 I479	D268-Y294 WeakPolarHBondContact O-CE1 3.4Å; I269-Y294 HydrophobicContact CB-CE1 4.36Å; I269-Y294 HydrophobicContact CB-CE2 4.47Å; I269-Y294 HydrophobicContact CG2-CD1 3.93Å; I269-Y294 HydrophobicContact CG2-CE1 3.85Å; I269-Y294 HydrophobicContact CG2-CG 4.32Å; N270-Y294 PolarHBondContact N-OH 3.13Å; N270-Y294 VanDerWaalsContact N-OH 3.13Å; P292-Y294 HydrophobicContact CB-CE1 4.43Å; P292-Y294 HydrophobicContact CB-CE2 4.28Å; P292-Y294 HydrophobicContact CG-CE2 4.25Å; Y294-I314 HydrophobicContact CD2-CD1 3.92Å; Y294-I314 HydrophobicContact CD2-CG2 4.19Å; Y294-I314 HydrophobicContact CE2-CD1 3.86Å; Y294-I314 HydrophobicContact CE2-CG2 4.19Å; Y294-N315 PolarHBondContact N-OD1 2.77Å; Y294-N315 VanDerWaalsContact N-OD1 3.09Å; Y294-N315 PolarHBondContact O-ND2 2.59Å; Y294-N315 PolarHBondContact O-OD1 2.85Å; Y294-I479 CarbonylContact C-O 3.41Å; Y294-I479 VanDerWaalsContact CA-O 3.22Å; Y294-I479 WeakPolarHBondContact CA-O 3.45Å; Y294-I479 HydrophobicContact CD1-CB 3.98Å; Y294-I479 HydrophobicContact CD1-CG2 4.3Å; Y294-I479 HydrophobicContact CE1-CB 4.26Å; Y294-I479 HydrophobicContact CE1-CG2 4.32Å
295	T	83.9	Confident	79.5	Confident	26 Å²	26	77 Å²	77	16%	0.16	40%	0.403	C	S	.	.			trans	-117.6	138.4	175.1	-177	0	0	0	0	111.3	K297 C298 K478 I479 P481	T295-K297 WeakPolarHBondContact OG1-CB 3.46Å; T295-K297 PolarHBondContact OG1-N 3.32Å; T295-K297 VanDerWaalsContact OG1-N 3.16Å; T295-C298 PolarHBondContact O-SG 2.67Å; T295-C298 VanDerWaalsContact O-SG 3.34Å; T295-K478 HydrophobicContact CG2-CB 3.99Å; T295-K478 WeakPolarHBondContact CG2-O 3.28Å; T295-I479 PolarHBondContact N-O 2.87Å; T295-P481 VanDerWaalsContact O-CD 3.31Å; T295-P481 WeakPolarHBondContact O-CD 3.22Å
296	T	83.8	Confident	79.3	Confident	49 Å²	49	79.3 Å²	79.3	30%	0.301	41%	0.412	S	S	.	.	S	Bend	trans	-87.6	-8.6	172	60.9	0	0	0	0	112.5	C298 L299 A308 V311 K312	T296-C298 PolarHBondContact O-N 3.19Å; T296-L299 HydrophobicContact CG2-CD1 4.25Å; T296-L299 WeakPolarHBondContact O-CB 3.49Å; T296-L299 PolarHBondContact O-N 3.07Å; T296-L299 VanDerWaalsContact O-N 3.15Å; T296-A308 HydrophobicContact CG2-CB 4.07Å; T296-V311 HydrophobicContact CG2-CB 4.13Å; T296-V311 HydrophobicContact CG2-CG1 3.57Å; T296-K312 HydrophobicContact CG2-CG 4.22Å
297	K	82.2	Confident	79.3	Confident	198 Å²	198	76.9 Å²	76.9	86%	0.861	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.9	-176	-66.5	-171.3	174.4	-168.2	0	113.9	T295	T295-K297 WeakPolarHBondContact OG1-CB 3.46Å; T295-K297 PolarHBondContact OG1-N 3.32Å; T295-K297 VanDerWaalsContact OG1-N 3.16Å
298	C	80.9	Confident	79.6	Confident	54 Å²	54	75.7 Å²	75.7	37%	0.365	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.6	178.1	61.7	0	0	0	0	112.6	T295 T296 C480	T295-C298 PolarHBondContact O-SG 2.67Å; T295-C298 VanDerWaalsContact O-SG 3.34Å; T296-C298 PolarHBondContact O-N 3.19Å; C298-C480 HydrophobicContact CB-CB 3.81Å; C298-C480 WeakPolarHBondContact CB-SG 3.26Å; C298-C480 WeakPolarHBondContact SG-CA 3.44Å; C298-C480 WeakPolarHBondContact SG-CB 3.35Å; C298-C480 CovalentContact SG-SG 2.01Å; C298-C480 PolarHBondContact SG-SG 2.91Å
299	L	80.3	Confident	79.9	Confident	22 Å²	22	77.3 Å²	77.3	12%	0.115	39%	0.387	C	S	.	.	S	Bend	trans	-80.4	137.3	179.4	-59.4	178.3	0	0	0	109.3	T296 L307 A308 P481 I482	T296-L299 HydrophobicContact CG2-CD1 4.25Å; T296-L299 WeakPolarHBondContact O-CB 3.49Å; T296-L299 PolarHBondContact O-N 3.07Å; T296-L299 VanDerWaalsContact O-N 3.15Å; L299-L307 HydrophobicContact CD1-CG 4.47Å; L299-L307 HydrophobicContact CD2-CD2 3.9Å; L299-A308 HydrophobicContact CD1-CB 3.75Å; L299-P481 HydrophobicContact CD2-CB 4.36Å; L299-P481 HydrophobicContact CD2-CG 4.2Å; L299-I482 HydrophobicContact CD2-CD1 3.35Å; L299-I482 HydrophobicContact CD2-CG1 3.73Å
300	P	78.4	Confident	80.5	Confident	73 Å²	73	70.8 Å²	70.8	47%	0.474	36%	0.359	S	S	.	.			trans	-54.3	153.2	171.6	-26.9	35.4	0	0	0	112.8	S302 Y304	P300-S302 VanDerWaalsContact C-N 3.25Å; P300-S302 PolarHBondContact O-N 3.1Å; P300-Y304 HydrophobicContact CB-CD2 3.98Å; P300-Y304 HydrophobicContact CB-CE2 4.13Å; P300-Y304 HydrophobicContact CG-CD2 3.84Å; P300-Y304 HydrophobicContact CG-CE2 3.66Å
301	R	69.4	Low	81.2	Confident	257 Å²	257	64.1 Å²	64.1	97%	0.97	33%	0.334	S	S	*	.	S	Bend	trans	-65.6	-24.2	-173	-167.7	173.2	-179.6	172	-1.3	113.6
302	S	67.9	Low	81.6	Confident	92 Å²	92	68.8 Å²	68.8	64%	0.643	35%	0.354	S	S	*	.	S	Bend	trans	-129.9	155.5	178.1	55.5	0	0	0	0	111.4	P300 Y304	P300-S302 VanDerWaalsContact C-N 3.25Å; P300-S302 PolarHBondContact O-N 3.1Å; S302-Y304 PolarHBondContact O-N 2.92Å
303	G	70.7	Confident	82	Confident	75 Å²	75	68.5 Å²	68.5	77%	0.773	35%	0.353	S	S	*	.	S	Bend	trans	86.8	-17.1	174.9	0	0	0	0	0	116.7
304	Y	79.6	Confident	82.3	Confident	73 Å²	73	66.5 Å²	66.5	29%	0.286	34%	0.342	S	S	.	.			trans	-112.8	26.3	-176.3	-67.8	-85.6	0	0	0	114.3	P300 S302 L306 L307 A308 I482	P300-Y304 HydrophobicContact CB-CD2 3.98Å; P300-Y304 HydrophobicContact CB-CE2 4.13Å; P300-Y304 HydrophobicContact CG-CD2 3.84Å; P300-Y304 HydrophobicContact CG-CE2 3.66Å; S302-Y304 PolarHBondContact O-N 2.92Å; Y304-L306 PolarHBondContact O-N 3.05Å; Y304-L307 HydrophobicContact CD1-CB 4.44Å; Y304-L307 HydrophobicContact CD1-CD2 3.75Å; Y304-L307 HydrophobicContact CE1-CD2 4.38Å; Y304-L307 PolarHBondContact O-N 2.92Å; Y304-A308 VanDerWaalsContact O-CB 3.29Å; Y304-A308 WeakPolarHBondContact O-CB 2.93Å; Y304-A308 PolarHBondContact O-N 2.75Å; Y304-I482 HydrophobicContact CD1-CD1 3.61Å; Y304-I482 HydrophobicContact CE1-CD1 3.31Å; Y304-I482 HydrophobicContact CE1-CG1 4.38Å; Y304-I482 HydrophobicContact CE2-CD1 4.31Å; Y304-I482 HydrophobicContact CG-CD1 4.2Å
305	E	82.8	Confident	82.6	Confident	129 Å²	129	67.8 Å²	67.8	60%	0.603	35%	0.349	S	S	*	.	H	α-helix	trans	-62.4	-43.1	-175.5	-64.2	-174.4	-174.3	0	0	113	A308 R309	E305-A308 PolarHBondContact O-N 3.37Å; E305-R309 VanDerWaalsContact O-CG 3.27Å; E305-R309 WeakPolarHBondContact O-CG 3.5Å; E305-R309 PolarHBondContact O-N 3.06Å
306	L	82.5	Confident	82.9	Confident	86 Å²	86	71.1 Å²	71.1	45%	0.45	36%	0.359	S	S	.	.	H	α-helix	trans	-64.7	-46.4	178.3	-175	66.9	0	0	0	111.1	Y304 A308 R309 Q310 Y346	Y304-L306 PolarHBondContact O-N 3.05Å; L306-A308 VanDerWaalsContact C-N 3.34Å; L306-A308 PolarHBondContact O-N 3.36Å; L306-R309 WeakPolarHBondContact O-CB 3.44Å; L306-R309 PolarHBondContact O-N 2.95Å; L306-R309 VanDerWaalsContact O-N 3.1Å; L306-Q310 WeakPolarHBondContact O-CG 3.33Å; L306-Q310 PolarHBondContact O-N 3.48Å; L306-Y346 WeakPolarHBondContact CD1-OH 3.19Å
307	L	84.9	Confident	83.3	Confident	9 Å²	9	68.8 Å²	68.8	5%	0.047	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-43.3	177.6	-176.6	60.8	0	0	0	111.5	I267 I269 L299 Y304 R309 Q310 V311 P481 I482	I267-L307 HydrophobicContact CD1-CD2 4.1Å; I267-L307 HydrophobicContact CG1-CD2 4.33Å; I267-L307 HydrophobicContact CG2-CD1 3.53Å; I267-L307 HydrophobicContact CG2-CD2 4.16Å; I269-L307 HydrophobicContact CD1-CD1 3.53Å; I269-L307 HydrophobicContact CG1-CD1 4.23Å; I269-L307 HydrophobicContact CG2-CD1 4.43Å; L299-L307 HydrophobicContact CD1-CG 4.47Å; L299-L307 HydrophobicContact CD2-CD2 3.9Å; Y304-L307 HydrophobicContact CD1-CB 4.44Å; Y304-L307 HydrophobicContact CD1-CD2 3.75Å; Y304-L307 HydrophobicContact CE1-CD2 4.38Å; Y304-L307 PolarHBondContact O-N 2.92Å; L307-R309 VanDerWaalsContact C-N 3.27Å; L307-R309 PolarHBondContact O-N 3.03Å; L307-Q310 PolarHBondContact O-N 3.43Å; L307-V311 WeakPolarHBondContact O-CB 3.41Å; L307-V311 VanDerWaalsContact O-CG2 3.25Å; L307-V311 WeakPolarHBondContact O-CG2 3.22Å; L307-V311 PolarHBondContact O-N 2.99Å; L307-P481 HydrophobicContact CD1-CB 4.22Å; L307-P481 HydrophobicContact CD2-CB 3.94Å; L307-P481 HydrophobicContact CG-CB 4.21Å; L307-I482 HydrophobicContact CD2-CD1 4.09Å; L307-I482 HydrophobicContact CD2-CG1 3.97Å
308	A	86	Confident	83.7	Confident	16 Å²	16	60.4 Å²	60.4	13%	0.132	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-36	175.1	0	0	0	0	0	112	T296 L299 Y304 E305 L306 K312	T296-A308 HydrophobicContact CG2-CB 4.07Å; L299-A308 HydrophobicContact CD1-CB 3.75Å; Y304-A308 VanDerWaalsContact O-CB 3.29Å; Y304-A308 WeakPolarHBondContact O-CB 2.93Å; Y304-A308 PolarHBondContact O-N 2.75Å; E305-A308 PolarHBondContact O-N 3.37Å; L306-A308 VanDerWaalsContact C-N 3.34Å; L306-A308 PolarHBondContact O-N 3.36Å; A308-K312 WeakPolarHBondContact O-CB 2.99Å; A308-K312 WeakPolarHBondContact O-CD 3.12Å; A308-K312 WeakPolarHBondContact O-CG 3.33Å; A308-K312 PolarHBondContact O-N 3.03Å
309	R	85.2	Confident	84.1	Confident	87 Å²	87	64.7 Å²	64.7	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-66.9	-50.1	174.1	-71.7	171.9	-168.1	-158.6	6.6	111.2	E305 L306 L307 V311 K312 T313 Y346 V349	E305-R309 VanDerWaalsContact O-CG 3.27Å; E305-R309 WeakPolarHBondContact O-CG 3.5Å; E305-R309 PolarHBondContact O-N 3.06Å; L306-R309 WeakPolarHBondContact O-CB 3.44Å; L306-R309 PolarHBondContact O-N 2.95Å; L306-R309 VanDerWaalsContact O-N 3.1Å; L307-R309 VanDerWaalsContact C-N 3.27Å; L307-R309 PolarHBondContact O-N 3.03Å; R309-V311 VanDerWaalsContact C-N 3.31Å; R309-V311 PolarHBondContact O-N 2.97Å; R309-K312 WeakPolarHBondContact O-CB 3.03Å; R309-K312 PolarHBondContact O-N 3.17Å; R309-T313 PolarHBondContact O-N 3.37Å; R309-T313 PolarHBondContact O-OG1 3.32Å; R309-T313 VanDerWaalsContact O-OG1 3.07Å; R309-Y346 HydrophobicContact CB-CE2 4.15Å; R309-V349 PolarHBondContact NH1-O 3.32Å
310	Q	87.5	Confident	84.6	Confident	32 Å²	32	65.4 Å²	65.4	15%	0.15	32%	0.322	C	S	.	.	H	α-helix	trans	-54.4	-48.9	177.5	-68.6	170.7	-31.8	0	0	111	I269 F271 L306 L307 K312 T313 I314 Y346	I269-Q310 HydrophobicContact CD1-CB 3.86Å; F271-Q310 HydrophobicContact CB-CB 4.43Å; F271-Q310 HydrophobicContact CD1-CB 4.13Å; F271-Q310 HydrophobicContact CD1-CG 3.69Å; F271-Q310 HydrophobicContact CD2-CB 4.14Å; F271-Q310 HydrophobicContact CD2-CG 4.45Å; F271-Q310 HydrophobicContact CE1-CB 4.44Å; F271-Q310 HydrophobicContact CE1-CG 3.73Å; F271-Q310 HydrophobicContact CE2-CB 4.46Å; F271-Q310 HydrophobicContact CE2-CG 4.49Å; F271-Q310 HydrophobicContact CG-CB 3.97Å; F271-Q310 HydrophobicContact CG-CG 4.06Å; F271-Q310 HydrophobicContact CZ-CG 4.15Å; L306-Q310 WeakPolarHBondContact O-CG 3.33Å; L306-Q310 PolarHBondContact O-N 3.48Å; L307-Q310 PolarHBondContact O-N 3.43Å; Q310-K312 VanDerWaalsContact C-N 3.34Å; Q310-K312 PolarHBondContact O-N 2.73Å; Q310-T313 WeakPolarHBondContact O-CB 3.47Å; Q310-T313 PolarHBondContact O-N 3.1Å; Q310-T313 VanDerWaalsContact O-N 3.1Å; Q310-I314 WeakPolarHBondContact O-CG1 3.05Å; Q310-I314 PolarHBondContact O-N 3.05Å; Q310-Y346 HydrophobicContact CG-CE2 4.21Å
311	V	88.1	Confident	85.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-43	175.5	163.6	0	0	0	0	112.7	I269 T296 L307 R309 T313 N315 P481	I269-V311 HydrophobicContact CG2-CG2 4.3Å; T296-V311 HydrophobicContact CG2-CB 4.13Å; T296-V311 HydrophobicContact CG2-CG1 3.57Å; L307-V311 WeakPolarHBondContact O-CB 3.41Å; L307-V311 VanDerWaalsContact O-CG2 3.25Å; L307-V311 WeakPolarHBondContact O-CG2 3.22Å; L307-V311 PolarHBondContact O-N 2.99Å; R309-V311 VanDerWaalsContact C-N 3.31Å; R309-V311 PolarHBondContact O-N 2.97Å; V311-T313 VanDerWaalsContact C-N 3.33Å; V311-N315 WeakPolarHBondContact O-CB 3.38Å; V311-N315 VanDerWaalsContact O-CG 3.26Å; V311-N315 PolarHBondContact O-N 2.94Å; V311-N315 VanDerWaalsContact O-N 3.1Å; V311-N315 PolarHBondContact O-ND2 3.2Å; V311-P481 HydrophobicContact CG2-CB 4.29Å; V311-P481 HydrophobicContact CG2-CG 3.41Å; V311-P481 VanDerWaalsContact CG2-CG 3.41Å
312	K	89.4	Confident	86.1	Confident	102 Å²	102	54.6 Å²	54.6	44%	0.443	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-41.2	176.5	-76.1	167.7	-175.9	176	0	110.7	T296 A308 R309 Q310 N315 R316	T296-K312 HydrophobicContact CG2-CG 4.22Å; A308-K312 WeakPolarHBondContact O-CB 2.99Å; A308-K312 WeakPolarHBondContact O-CD 3.12Å; A308-K312 WeakPolarHBondContact O-CG 3.33Å; A308-K312 PolarHBondContact O-N 3.03Å; R309-K312 WeakPolarHBondContact O-CB 3.03Å; R309-K312 PolarHBondContact O-N 3.17Å; Q310-K312 VanDerWaalsContact C-N 3.34Å; Q310-K312 PolarHBondContact O-N 2.73Å; K312-N315 PolarHBondContact O-N 3.35Å; K312-R316 WeakPolarHBondContact O-CB 3.04Å; K312-R316 VanDerWaalsContact O-CG 3.25Å; K312-R316 WeakPolarHBondContact O-CG 3.49Å; K312-R316 PolarHBondContact O-N 3.38Å
313	T	89.8	Confident	87.2	Confident	5 Å²	5	55 Å²	55	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-51.3	177.7	-54.5	0	0	0	0	111.7	F271 R309 Q310 V311 N315 R316 L317 Y346	F271-T313 HydrophobicContact CE2-CG2 4.07Å; R309-T313 PolarHBondContact O-N 3.37Å; R309-T313 PolarHBondContact O-OG1 3.32Å; R309-T313 VanDerWaalsContact O-OG1 3.07Å; Q310-T313 WeakPolarHBondContact O-CB 3.47Å; Q310-T313 PolarHBondContact O-N 3.1Å; Q310-T313 VanDerWaalsContact O-N 3.1Å; V311-T313 VanDerWaalsContact C-N 3.33Å; T313-N315 VanDerWaalsContact C-N 3.33Å; T313-N315 PolarHBondContact O-N 3.22Å; T313-R316 PolarHBondContact O-N 3.15Å; T313-L317 HydrophobicContact CG2-CD1 4.18Å; T313-L317 PolarHBondContact O-N 3.45Å; T313-Y346 HydrophobicContact CG2-CD2 4.44Å; T313-Y346 VanDerWaalsContact OG1-CD2 3.25Å; T313-Y346 WeakPolarHBondContact OG1-CD2 3.36Å
314	I	89.9	Confident	88.1	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.036	23%	0.23	C	C	.	.	H	α-helix	trans	-54.4	-51.3	176.8	-59.4	166.8	0	0	0	110.1	I269 F271 Y294 Q310 R316 L317 E318	I269-I314 HydrophobicContact CB-CD1 4.27Å; I269-I314 HydrophobicContact CD1-CD1 4.5Å; F271-I314 HydrophobicContact CB-CD1 3.92Å; F271-I314 HydrophobicContact CB-CG1 4.25Å; F271-I314 HydrophobicContact CD2-CD1 4.39Å; F271-I314 HydrophobicContact CD2-CG1 3.84Å; Y294-I314 HydrophobicContact CD2-CD1 3.92Å; Y294-I314 HydrophobicContact CD2-CG2 4.19Å; Y294-I314 HydrophobicContact CE2-CD1 3.86Å; Y294-I314 HydrophobicContact CE2-CG2 4.19Å; Q310-I314 WeakPolarHBondContact O-CG1 3.05Å; Q310-I314 PolarHBondContact O-N 3.05Å; I314-R316 VanDerWaalsContact C-N 3.31Å; I314-R316 PolarHBondContact O-N 3.39Å; I314-L317 PolarHBondContact O-N 3Å; I314-E318 HydrophobicContact CG2-CG 4.24Å; I314-E318 WeakPolarHBondContact O-CB 3.22Å; I314-E318 WeakPolarHBondContact O-CG 3.19Å; I314-E318 PolarHBondContact O-N 3.45Å
315	N	90.6	Very high	88.5	Confident	31 Å²	31	48.9 Å²	48.9	17%	0.166	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-35	-177.1	-75.2	-43.9	0	0	0	113.3	Y294 V311 K312 T313 K319	Y294-N315 PolarHBondContact N-OD1 2.77Å; Y294-N315 VanDerWaalsContact N-OD1 3.09Å; Y294-N315 PolarHBondContact O-ND2 2.59Å; Y294-N315 PolarHBondContact O-OD1 2.85Å; V311-N315 WeakPolarHBondContact O-CB 3.38Å; V311-N315 VanDerWaalsContact O-CG 3.26Å; V311-N315 PolarHBondContact O-N 2.94Å; V311-N315 VanDerWaalsContact O-N 3.1Å; V311-N315 PolarHBondContact O-ND2 3.2Å; K312-N315 PolarHBondContact O-N 3.35Å; T313-N315 VanDerWaalsContact C-N 3.33Å; T313-N315 PolarHBondContact O-N 3.22Å; N315-K319 PolarHBondContact O-N 2.88Å
316	R	91	Very high	88.7	Confident	96 Å²	96	49.6 Å²	49.6	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-67.6	-45	174.7	-76	173	-177	172	1.6	110.9	K312 T313 I314 K319 R320 E342	K312-R316 WeakPolarHBondContact O-CB 3.04Å; K312-R316 VanDerWaalsContact O-CG 3.25Å; K312-R316 WeakPolarHBondContact O-CG 3.49Å; K312-R316 PolarHBondContact O-N 3.38Å; T313-R316 PolarHBondContact O-N 3.15Å; I314-R316 VanDerWaalsContact C-N 3.31Å; I314-R316 PolarHBondContact O-N 3.39Å; R316-K319 WeakPolarHBondContact O-CB 3.38Å; R316-K319 PolarHBondContact O-N 2.93Å; R316-R320 WeakPolarHBondContact O-CG 3.35Å; R316-R320 PolarHBondContact O-N 3.1Å; R316-E342 WeakPolarHBondContact CD-OE2 2.85Å
317	L	91.3	Very high	88.4	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-47.6	176.1	-81.5	171.7	0	0	0	112.1	P273 T313 I314 K319 R320 F321 R338 W339 E342	P273-L317 HydrophobicContact CB-CD1 4.46Å; P273-L317 HydrophobicContact CG-CD1 3.48Å; P273-L317 VanDerWaalsContact CG-CD1 3.48Å; T313-L317 HydrophobicContact CG2-CD1 4.18Å; T313-L317 PolarHBondContact O-N 3.45Å; I314-L317 PolarHBondContact O-N 3Å; L317-K319 PolarHBondContact O-N 3.34Å; L317-R320 CarbonylContact O-C 3.56Å; L317-R320 PolarHBondContact O-N 3.16Å; L317-F321 HydrophobicContact CB-CD2 4.43Å; L317-F321 HydrophobicContact CB-CE2 4.12Å; L317-F321 HydrophobicContact CD2-CE1 4.43Å; L317-F321 HydrophobicContact CD2-CZ 4.14Å; L317-F321 WeakPolarHBondContact O-CB 3.25Å; L317-F321 WeakPolarHBondContact O-CD2 3.44Å; L317-F321 WeakPolarHBondContact O-CG 3.4Å; L317-F321 PolarHBondContact O-N 3.31Å; L317-R338 WeakPolarHBondContact CD2-O 3.45Å; L317-W339 HydrophobicContact CD2-CB 4.48Å; L317-E342 HydrophobicContact CD1-CB 4.2Å; L317-E342 HydrophobicContact CD2-CB 3.69Å; L317-E342 HydrophobicContact CD2-CG 3.75Å; L317-E342 HydrophobicContact CG-CB 3.78Å; L317-E342 HydrophobicContact CG-CG 3.92Å
318	E	90.6	Very high	87.6	Confident	21 Å²	21	62.1 Å²	62.1	10%	0.098	27%	0.274	C	S	.	.	H	α-helix	trans	-54.3	-40.2	174.7	-76.6	-59.4	129.9	0	0	112.6	R291 L293 I314 K322	R291-E318 IonicContact CZ-OE1 3.36Å; R291-E318 IonicContact CZ-OE2 3.56Å; R291-E318 IonicContact NE-OE1 2.78Å; R291-E318 PolarHBondContact NE-OE1 2.97Å; R291-E318 VanDerWaalsContact NE-OE1 3.17Å; R291-E318 IonicContact NE-OE2 3.99Å; R291-E318 PolarHBondContact NE-OE2 2.04Å; R291-E318 IonicContact NH1-OE1 3.93Å; R291-E318 PolarHBondContact NH1-OE1 3.24Å; R291-E318 VanDerWaalsContact NH1-OE1 3.12Å; R291-E318 IonicContact NH2-OE1 3.26Å; R291-E318 PolarHBondContact NH2-OE1 3.3Å; R291-E318 IonicContact NH2-OE2 2.9Å; R291-E318 PolarHBondContact NH2-OE2 3.36Å; L293-E318 HydrophobicContact CD2-CB 3.74Å; L293-E318 HydrophobicContact CD2-CG 3.9Å; I314-E318 HydrophobicContact CG2-CG 4.24Å; I314-E318 WeakPolarHBondContact O-CB 3.22Å; I314-E318 WeakPolarHBondContact O-CG 3.19Å; I314-E318 PolarHBondContact O-N 3.45Å; E318-K322 VanDerWaalsContact O-CB 3.29Å; E318-K322 WeakPolarHBondContact O-CB 3.44Å; E318-K322 PolarHBondContact O-N 3.12Å
319	K	90.3	Very high	87.1	Confident	144 Å²	144	70.5 Å²	70.5	63%	0.626	31%	0.308	S	S	*	.	H	α-helix	trans	-66.6	-42.8	175.7	-173.3	-176.8	177.3	-174.3	0	111.8	N315 R316 L317 K322 Q323	N315-K319 PolarHBondContact O-N 2.88Å; R316-K319 WeakPolarHBondContact O-CB 3.38Å; R316-K319 PolarHBondContact O-N 2.93Å; L317-K319 PolarHBondContact O-N 3.34Å; K319-K322 WeakPolarHBondContact O-CB 3.38Å; K319-K322 PolarHBondContact O-N 2.98Å; K319-Q323 PolarHBondContact O-N 3.48Å
320	R	90.8	Very high	87	Confident	37 Å²	37	68.8 Å²	68.8	14%	0.14	32%	0.317	C	S	.	.	H	α-helix	trans	-69.2	-45.5	179.3	-71.2	169	170.6	-123.7	-8	111.8	R316 L317 K322 Q323 C324 R338 E341 E342	R316-R320 WeakPolarHBondContact O-CG 3.35Å; R316-R320 PolarHBondContact O-N 3.1Å; L317-R320 CarbonylContact O-C 3.56Å; L317-R320 PolarHBondContact O-N 3.16Å; R320-K322 PolarHBondContact O-N 3.14Å; R320-Q323 WeakPolarHBondContact O-CA 3.44Å; R320-Q323 WeakPolarHBondContact O-CB 3.44Å; R320-Q323 PolarHBondContact O-N 2.93Å; R320-C324 PolarHBondContact O-N 3.23Å; R320-R338 HydrophobicContact CB-CB 4.05Å; R320-R338 HydrophobicContact CB-CG 4.18Å; R320-E341 IonicContact CZ-OE1 2.75Å; R320-E341 IonicContact CZ-OE2 2.91Å; R320-E341 IonicContact NH1-OE1 3.89Å; R320-E341 PolarHBondContact NH1-OE1 3.46Å; R320-E341 IonicContact NH1-OE2 3.66Å; R320-E341 PolarHBondContact NH1-OE2 2.01Å; R320-E341 IonicContact NH2-OE1 2.7Å; R320-E341 PolarHBondContact NH2-OE1 3.1Å; R320-E341 IonicContact NH2-OE2 3.39Å; R320-E342 IonicContact CZ-OE1 2.6Å; R320-E342 IonicContact NE-OE1 3.85Å; R320-E342 PolarHBondContact NE-OE1 3.22Å; R320-E342 IonicContact NH1-OE1 2.8Å; R320-E342 IonicContact NH2-OE1 3.95Å; R320-E342 PolarHBondContact NH2-OE1 2.92Å; R320-E342 VanDerWaalsContact NH2-OE1 3.16Å
321	F	91.3	Very high	87	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-56.1	-39.6	171.1	-68.3	-28	0	0	0	111.7	P276 L284 L317 Q323 C324 C325 A335 W339 Y374	P276-F321 HydrophobicContact CG-CE1 3.94Å; P276-F321 HydrophobicContact CG-CZ 4.02Å; L284-F321 HydrophobicContact CD1-CD1 4.34Å; L284-F321 HydrophobicContact CD1-CD2 4.39Å; L284-F321 HydrophobicContact CD1-CE1 4.28Å; L284-F321 HydrophobicContact CD1-CE2 4.3Å; L284-F321 HydrophobicContact CD1-CG 4.4Å; L284-F321 HydrophobicContact CD1-CZ 4.24Å; L284-F321 HydrophobicContact CD2-CB 3.93Å; L284-F321 HydrophobicContact CD2-CD1 4.34Å; L284-F321 HydrophobicContact CD2-CD2 4.43Å; L284-F321 HydrophobicContact CD2-CG 4.01Å; L317-F321 HydrophobicContact CB-CD2 4.43Å; L317-F321 HydrophobicContact CB-CE2 4.12Å; L317-F321 HydrophobicContact CD2-CE1 4.43Å; L317-F321 HydrophobicContact CD2-CZ 4.14Å; L317-F321 WeakPolarHBondContact O-CB 3.25Å; L317-F321 WeakPolarHBondContact O-CD2 3.44Å; L317-F321 WeakPolarHBondContact O-CG 3.4Å; L317-F321 PolarHBondContact O-N 3.31Å; F321-Q323 VanDerWaalsContact C-N 3.26Å; F321-Q323 PolarHBondContact O-N 3.27Å; F321-C324 PolarHBondContact O-N 3.31Å; F321-C325 WeakPolarHBondContact O-CB 2.99Å; F321-C325 PolarHBondContact O-N 2.75Å; F321-C325 PolarHBondContact O-SG 3.34Å; F321-A335 HydrophobicContact CD1-CB 3.83Å; F321-A335 HydrophobicContact CE1-CB 3.86Å; F321-A335 WeakPolarHBondContact CE1-O 3.37Å; F321-W339 HydrophobicContact CE1-CB 4.31Å; F321-W339 HydrophobicContact CZ-CB 4.24Å; F321-Y374 HydrophobicContact CE2-CE1 4.18Å; F321-Y374 WeakPolarHBondContact CE2-OH 3.24Å; F321-Y374 WeakPolarHBondContact CZ-OH 3.35Å
322	K	88.9	Confident	87.1	Confident	103 Å²	103	70 Å²	70	45%	0.448	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-30.2	172.1	164.6	165.4	-173.7	-168.5	0	114.6	R288 E318 K319 R320 K326	R288-K322 HydrophobicContact CG-CB 4.33Å; R288-K322 VanDerWaalsContact CZ-CG 3.43Å; R288-K322 PolarHBondContact NH1-O 3.35Å; E318-K322 VanDerWaalsContact O-CB 3.29Å; E318-K322 WeakPolarHBondContact O-CB 3.44Å; E318-K322 PolarHBondContact O-N 3.12Å; K319-K322 WeakPolarHBondContact O-CB 3.38Å; K319-K322 PolarHBondContact O-N 2.98Å; R320-K322 PolarHBondContact O-N 3.14Å; K322-K326 WeakPolarHBondContact O-CG 3.18Å
323	Q	89.4	Confident	87.1	Confident	100 Å²	100	70.6 Å²	70.6	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-76.9	-43.7	173.1	-66.2	169.8	-17.3	0	0	111	K319 R320 F321 K326	K319-Q323 PolarHBondContact O-N 3.48Å; R320-Q323 WeakPolarHBondContact O-CA 3.44Å; R320-Q323 WeakPolarHBondContact O-CB 3.44Å; R320-Q323 PolarHBondContact O-N 2.93Å; F321-Q323 VanDerWaalsContact C-N 3.26Å; F321-Q323 PolarHBondContact O-N 3.27Å; Q323-K326 WeakPolarHBondContact O-CB 3.47Å; Q323-K326 PolarHBondContact O-N 2.89Å
324	C	90.1	Very high	87.2	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-48.9	178	-65.7	0	0	0	0	112.4	R320 F321 K326 K327 C334	R320-C324 PolarHBondContact O-N 3.23Å; F321-C324 PolarHBondContact O-N 3.31Å; C324-K326 PolarHBondContact O-N 3.4Å; C324-K327 PolarHBondContact O-N 3.23Å; C324-K327 VanDerWaalsContact O-N 3.09Å; C324-C334 WeakPolarHBondContact CA-SG 3.25Å; C324-C334 HydrophobicContact CB-CB 3.64Å; C324-C334 WeakPolarHBondContact CB-SG 3.41Å; C324-C334 WeakPolarHBondContact SG-CB 3.49Å; C324-C334 PolarHBondContact SG-O 3.27Å; C324-C334 VanDerWaalsContact SG-O 3.38Å; C324-C334 CovalentContact SG-SG 2.05Å; C324-C334 PolarHBondContact SG-SG 2.04Å
325	C	88.8	Confident	87.3	Confident	19 Å²	19	71.9 Å²	71.9	13%	0.128	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-7.6	-179.9	-64.3	0	0	0	0	114.7	L284 C285 F321	L284-C325 VanDerWaalsContact CD2-SG 3.53Å; C285-C325 WeakPolarHBondContact CA-SG 3.34Å; C285-C325 HydrophobicContact CB-CB 3.69Å; C285-C325 WeakPolarHBondContact CB-SG 3.31Å; C285-C325 WeakPolarHBondContact SG-CB 3.49Å; C285-C325 CovalentContact SG-SG 2.05Å; C285-C325 PolarHBondContact SG-SG 3.13Å; F321-C325 WeakPolarHBondContact O-CB 2.99Å; F321-C325 PolarHBondContact O-N 2.75Å; F321-C325 PolarHBondContact O-SG 3.34Å
326	K	86.4	Confident	87.3	Confident	143 Å²	143	72.4 Å²	72.4	62%	0.622	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-27.2	172.3	-76.6	175.8	178.7	-169.2	0	112.5	K322 Q323 C324 K328	K322-K326 WeakPolarHBondContact O-CG 3.18Å; Q323-K326 WeakPolarHBondContact O-CB 3.47Å; Q323-K326 PolarHBondContact O-N 2.89Å; C324-K326 PolarHBondContact O-N 3.4Å; K326-K328 VanDerWaalsContact C-N 3.32Å; K326-K328 PolarHBondContact O-N 3.32Å
327	K	75.2	Confident	87.4	Confident	163 Å²	163	73.2 Å²	73.2	71%	0.709	35%	0.352	S	S	*	.	S	Bend	trans	-81.4	-8.5	-171.4	-65.6	-173	174.9	-172.6	0	113.8	C324 K329	C324-K327 PolarHBondContact O-N 3.23Å; C324-K327 VanDerWaalsContact O-N 3.09Å; K327-K329 PolarHBondContact O-N 3.39Å
328	K	68.4	Low	87.5	Confident	195 Å²	195	77.4 Å²	77.4	85%	0.848	37%	0.368	S	S	*	.	S	Bend	trans	54.2	-55.9	-175.7	-68.8	-170.4	178.1	-174.5	0	114.9	K326	K326-K328 VanDerWaalsContact C-N 3.32Å; K326-K328 PolarHBondContact O-N 3.32Å
329	K	75.8	Confident	87.6	Confident	193 Å²	193	76.4 Å²	76.4	84%	0.839	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	138	172.1	-65.6	-174.7	177.5	-175.3	0	110.7	K327 A331	K327-K329 PolarHBondContact O-N 3.39Å; K329-A331 VanDerWaalsContact C-N 3.3Å; K329-A331 PolarHBondContact O-N 3.3Å
330	G	82.9	Confident	87.6	Confident	51 Å²	51	72.8 Å²	72.8	53%	0.526	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	20.3	178.2	0	0	0	0	0	114.9	L332 C334	G330-L332 VanDerWaalsContact C-N 3.29Å; G330-L332 PolarHBondContact O-N 3.36Å; G330-C334 WeakPolarHBondContact O-CB 3.43Å; G330-C334 PolarHBondContact O-N 2.87Å; G330-C334 VanDerWaalsContact O-N 3.14Å
331	A	88.3	Confident	87.6	Confident	12 Å²	12	74.2 Å²	74.2	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-38.3	179.8	0	0	0	0	0	112.1	I281 K329 A335	I281-A331 HydrophobicContact CD1-CB 4.29Å; I281-A331 HydrophobicContact CG1-CB 4.23Å; K329-A331 VanDerWaalsContact C-N 3.3Å; K329-A331 PolarHBondContact O-N 3.3Å; A331-A335 WeakPolarHBondContact O-CB 3.4Å; A331-A335 PolarHBondContact O-N 2.99Å
332	L	89.2	Confident	87.6	Confident	46 Å²	46	74.4 Å²	74.4	24%	0.241	36%	0.355	C	S	.	.	H	α-helix	trans	-59	-63	177.3	178.5	64.4	0	0	0	111.6	P276 T277 A278 I281 G330 C334 A335 E336	P276-L332 HydrophobicContact CB-CD1 4.42Å; T277-L332 WeakPolarHBondContact O-CD1 3.25Å; A278-L332 HydrophobicContact CB-CD2 4.47Å; I281-L332 HydrophobicContact CB-CD1 4.32Å; I281-L332 HydrophobicContact CG1-CB 4.22Å; G330-L332 VanDerWaalsContact C-N 3.29Å; G330-L332 PolarHBondContact O-N 3.36Å; L332-C334 PolarHBondContact O-N 2.83Å; L332-A335 PolarHBondContact O-N 3.46Å; L332-E336 PolarHBondContact O-N 3.02Å
333	N	89.8	Confident	87.6	Confident	114 Å²	114	69.5 Å²	69.5	61%	0.61	33%	0.334	S	S	*	.	H	α-helix	trans	-58.4	-38.1	-177.6	-60.3	0.4	0	0	0	111.6	H337	N333-H337 VanDerWaalsContact O-CB 3.26Å; N333-H337 WeakPolarHBondContact O-CB 3.31Å; N333-H337 PolarHBondContact O-N 2.99Å
334	C	92.1	Very high	87.6	Confident	39 Å²	39	67.8 Å²	67.8	26%	0.264	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-46.9	174	-177	0	0	0	0	111.9	C324 G330 L332 R338	C324-C334 WeakPolarHBondContact CA-SG 3.25Å; C324-C334 HydrophobicContact CB-CB 3.64Å; C324-C334 WeakPolarHBondContact CB-SG 3.41Å; C324-C334 WeakPolarHBondContact SG-CB 3.49Å; C324-C334 PolarHBondContact SG-O 3.27Å; C324-C334 VanDerWaalsContact SG-O 3.38Å; C324-C334 CovalentContact SG-SG 2.05Å; C324-C334 PolarHBondContact SG-SG 2.04Å; G330-C334 WeakPolarHBondContact O-CB 3.43Å; G330-C334 PolarHBondContact O-N 2.87Å; G330-C334 VanDerWaalsContact O-N 3.14Å; L332-C334 PolarHBondContact O-N 2.83Å; C334-R338 WeakPolarHBondContact O-CB 3.18Å; C334-R338 WeakPolarHBondContact O-CG 3.29Å; C334-R338 PolarHBondContact O-N 3.4Å
335	A	92.3	Very high	87.5	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.7	-47.5	-179.2	0	0	0	0	0	111.1	P276 I281 L284 F321 A331 L332 H337 R338 W339	P276-A335 HydrophobicContact CB-CB 3.87Å; P276-A335 HydrophobicContact CG-CB 3.86Å; I281-A335 HydrophobicContact CD1-CB 4.01Å; L284-A335 HydrophobicContact CD1-CB 4.42Å; F321-A335 HydrophobicContact CD1-CB 3.83Å; F321-A335 HydrophobicContact CE1-CB 3.86Å; F321-A335 WeakPolarHBondContact CE1-O 3.37Å; A331-A335 WeakPolarHBondContact O-CB 3.4Å; A331-A335 PolarHBondContact O-N 2.99Å; L332-A335 PolarHBondContact O-N 3.46Å; A335-H337 PolarHBondContact O-N 2.85Å; A335-R338 PolarHBondContact O-N 3.44Å; A335-W339 WeakPolarHBondContact O-CB 3.27Å; A335-W339 PolarHBondContact O-N 3.3Å
336	E	91.8	Very high	87.4	Confident	41 Å²	41	73.9 Å²	73.9	19%	0.192	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-48.3	178.4	-174	-178.6	-174.1	0	0	111.4	R275 L332 R338 W339 R340	R275-E336 IonicContact CZ-OE1 3.35Å; R275-E336 IonicContact NE-OE1 3.77Å; R275-E336 PolarHBondContact NE-OE1 3.2Å; R275-E336 IonicContact NH2-OE1 3.16Å; R275-E336 PolarHBondContact NH2-OE1 3.49Å; L332-E336 PolarHBondContact O-N 3.02Å; E336-R338 VanDerWaalsContact C-N 3.33Å; E336-R338 PolarHBondContact O-N 3.03Å; E336-W339 WeakPolarHBondContact O-CB 3.4Å; E336-W339 PolarHBondContact O-N 3.28Å; E336-R340 WeakPolarHBondContact O-CG 3.43Å; E336-R340 PolarHBondContact O-N 3.17Å; E336-R340 IonicContact OE1-CZ 2.96Å; E336-R340 IonicContact OE1-NE 2.69Å; E336-R340 PolarHBondContact OE1-NE 3.41Å; E336-R340 IonicContact OE1-NH2 2.86Å; E336-R340 PolarHBondContact OE1-NH2 3.26Å
337	H	92.1	Very high	87.3	Confident	114 Å²	114	68.3 Å²	68.3	53%	0.528	33%	0.327	S	S	.	.	H	α-helix	trans	-59	-45.1	177	-179.8	-73.5	0	0	0	111.7	N333 A335 W339 R340 E341	N333-H337 VanDerWaalsContact O-CB 3.26Å; N333-H337 WeakPolarHBondContact O-CB 3.31Å; N333-H337 PolarHBondContact O-N 2.99Å; A335-H337 PolarHBondContact O-N 2.85Å; H337-W339 VanDerWaalsContact C-N 3.29Å; H337-W339 PolarHBondContact O-N 2.96Å; H337-R340 PolarHBondContact O-N 3.38Å; H337-E341 IonicContact CE1-OE2 3.42Å; H337-E341 IonicContact ND1-OE2 2.76Å; H337-E341 WeakPolarHBondContact O-CB 3.45Å; H337-E341 PolarHBondContact O-N 3.25Å
338	R	92.7	Very high	87.5	Confident	88 Å²	88	65.2 Å²	65.2	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-30.4	179.3	-69.4	-62.1	-179.3	-170.1	1.5	112.9	L317 R320 C334 A335 E336 E341 E342	L317-R338 WeakPolarHBondContact CD2-O 3.45Å; R320-R338 HydrophobicContact CB-CB 4.05Å; R320-R338 HydrophobicContact CB-CG 4.18Å; C334-R338 WeakPolarHBondContact O-CB 3.18Å; C334-R338 WeakPolarHBondContact O-CG 3.29Å; C334-R338 PolarHBondContact O-N 3.4Å; A335-R338 PolarHBondContact O-N 3.44Å; E336-R338 VanDerWaalsContact C-N 3.33Å; E336-R338 PolarHBondContact O-N 3.03Å; R338-E341 IonicContact CZ-OE2 3.22Å; R338-E341 IonicContact NH1-OE1 3.29Å; R338-E341 IonicContact NH1-OE2 2.66Å; R338-E341 PolarHBondContact NH1-OE2 3.13Å; R338-E342 PolarHBondContact O-N 3.31Å
339	W	92.8	Very high	87.4	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-51.7	173.3	-178.8	90.2	0	0	0	110.9	P273 G274 R275 P276 L317 F321 A335 E336 H337 E341 E342 L343 Y362 F365	P273-W339 PolarHBondContact O-NE1 3.12Å; G274-W339 PolarHBondContact O-NE1 2.66Å; R275-W339 HydrophobicContact CB-CH2 3.96Å; R275-W339 HydrophobicContact CB-CZ2 3.89Å; R275-W339 HydrophobicContact CB-CZ3 4.31Å; R275-W339 HydrophobicContact CG-CE3 4.28Å; R275-W339 HydrophobicContact CG-CH2 4.23Å; R275-W339 HydrophobicContact CG-CZ3 4.09Å; P276-W339 HydrophobicContact CG-CB 4.19Å; P276-W339 HydrophobicContact CG-CG 4.49Å; L317-W339 HydrophobicContact CD2-CB 4.48Å; F321-W339 HydrophobicContact CE1-CB 4.31Å; F321-W339 HydrophobicContact CZ-CB 4.24Å; A335-W339 WeakPolarHBondContact O-CB 3.27Å; A335-W339 PolarHBondContact O-N 3.3Å; E336-W339 WeakPolarHBondContact O-CB 3.4Å; E336-W339 PolarHBondContact O-N 3.28Å; H337-W339 VanDerWaalsContact C-N 3.29Å; H337-W339 PolarHBondContact O-N 2.96Å; W339-E341 PolarHBondContact O-N 3.12Å; W339-E342 PolarHBondContact O-N 3.26Å; W339-L343 HydrophobicContact CD2-CD1 3.71Å; W339-L343 HydrophobicContact CD2-CG 4.43Å; W339-L343 HydrophobicContact CE3-CD1 3.87Å; W339-L343 HydrophobicContact CH2-CD1 3.37Å; W339-L343 HydrophobicContact CZ2-CD1 3.2Å; W339-L343 HydrophobicContact CZ2-CG 4.48Å; W339-L343 HydrophobicContact CZ3-CD1 3.71Å; W339-L343 PolarHBondContact O-N 2.91Å; W339-Y362 HydrophobicContact CE3-CD1 4.21Å; W339-Y362 AromaticContact CH2-CD1 3.92Å; W339-Y362 HydrophobicContact CH2-CD1 3.92Å; W339-Y362 HydrophobicContact CH2-CG 4.35Å; W339-Y362 AromaticContact CZ3-CD1 3.38Å; W339-Y362 HydrophobicContact CZ3-CD1 3.38Å; W339-Y362 HydrophobicContact CZ3-CE1 4.26Å; W339-Y362 AromaticContact CZ3-CG 3.91Å; W339-Y362 HydrophobicContact CZ3-CG 3.91Å; W339-F365 HydrophobicContact CH2-CB 4.42Å; W339-F365 HydrophobicContact CZ2-CB 4.18Å
340	R	91.1	Very high	86.4	Confident	69 Å²	69	57.7 Å²	57.7	26%	0.26	31%	0.307	S	S	.	.	H	α-helix	trans	-58.6	-45.3	177.4	-67.4	179.5	-177.2	-92.2	5.3	112.5	R275 E336 H337 E342 L343 N344 Y362	R275-R340 VanDerWaalsContact CZ-NH2 3.3Å; E336-R340 WeakPolarHBondContact O-CG 3.43Å; E336-R340 PolarHBondContact O-N 3.17Å; E336-R340 IonicContact OE1-CZ 2.96Å; E336-R340 IonicContact OE1-NE 2.69Å; E336-R340 PolarHBondContact OE1-NE 3.41Å; E336-R340 IonicContact OE1-NH2 2.86Å; E336-R340 PolarHBondContact OE1-NH2 3.26Å; H337-R340 PolarHBondContact O-N 3.38Å; R340-E342 PolarHBondContact O-N 3.13Å; R340-L343 PolarHBondContact O-N 2.65Å; R340-N344 PolarHBondContact O-N 3.31Å; R340-N344 PolarHBondContact O-OD1 3.39Å; R340-Y362 HydrophobicContact CB-CE1 3.77Å; R340-Y362 HydrophobicContact CG-CD1 4.18Å; R340-Y362 HydrophobicContact CG-CE1 3.75Å
341	E	91.1	Very high	84.9	Confident	67 Å²	67	56.4 Å²	56.4	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-41.8	-178.9	-165.9	-162.2	134.3	0	0	112.6	R320 H337 R338 W339 R345	R320-E341 IonicContact CZ-OE1 2.75Å; R320-E341 IonicContact CZ-OE2 2.91Å; R320-E341 IonicContact NH1-OE1 3.89Å; R320-E341 PolarHBondContact NH1-OE1 3.46Å; R320-E341 IonicContact NH1-OE2 3.66Å; R320-E341 PolarHBondContact NH1-OE2 2.01Å; R320-E341 IonicContact NH2-OE1 2.7Å; R320-E341 PolarHBondContact NH2-OE1 3.1Å; R320-E341 IonicContact NH2-OE2 3.39Å; H337-E341 IonicContact CE1-OE2 3.42Å; H337-E341 IonicContact ND1-OE2 2.76Å; H337-E341 WeakPolarHBondContact O-CB 3.45Å; H337-E341 PolarHBondContact O-N 3.25Å; R338-E341 IonicContact CZ-OE2 3.22Å; R338-E341 IonicContact NH1-OE1 3.29Å; R338-E341 IonicContact NH1-OE2 2.66Å; R338-E341 PolarHBondContact NH1-OE2 3.13Å; W339-E341 PolarHBondContact O-N 3.12Å; E341-R345 WeakPolarHBondContact O-CB 3.5Å; E341-R345 PolarHBondContact O-N 3.29Å
342	E	91.1	Very high	83.3	Confident	3 Å²	3	67 Å²	67	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-75.3	-31.8	178.1	-75	-73.4	164.5	0	0	112.7	R316 L317 R320 R338 W339 R340 R345 Y346	R316-E342 WeakPolarHBondContact CD-OE2 2.85Å; L317-E342 HydrophobicContact CD1-CB 4.2Å; L317-E342 HydrophobicContact CD2-CB 3.69Å; L317-E342 HydrophobicContact CD2-CG 3.75Å; L317-E342 HydrophobicContact CG-CB 3.78Å; L317-E342 HydrophobicContact CG-CG 3.92Å; R320-E342 IonicContact CZ-OE1 2.6Å; R320-E342 IonicContact NE-OE1 3.85Å; R320-E342 PolarHBondContact NE-OE1 3.22Å; R320-E342 IonicContact NH1-OE1 2.8Å; R320-E342 IonicContact NH2-OE1 3.95Å; R320-E342 PolarHBondContact NH2-OE1 2.92Å; R320-E342 VanDerWaalsContact NH2-OE1 3.16Å; R338-E342 PolarHBondContact O-N 3.31Å; W339-E342 PolarHBondContact O-N 3.26Å; R340-E342 PolarHBondContact O-N 3.13Å; E342-R345 PolarHBondContact O-N 3.03Å; E342-Y346 WeakPolarHBondContact O-CB 3.35Å; E342-Y346 PolarHBondContact O-N 3.31Å
343	L	88.9	Confident	82.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.1	-42.3	173.1	-72.2	-176.6	0	0	0	112	W339 R340 R345 Y346 C347 Y362 F365	W339-L343 HydrophobicContact CD2-CD1 3.71Å; W339-L343 HydrophobicContact CD2-CG 4.43Å; W339-L343 HydrophobicContact CE3-CD1 3.87Å; W339-L343 HydrophobicContact CH2-CD1 3.37Å; W339-L343 HydrophobicContact CZ2-CD1 3.2Å; W339-L343 HydrophobicContact CZ2-CG 4.48Å; W339-L343 HydrophobicContact CZ3-CD1 3.71Å; W339-L343 PolarHBondContact O-N 2.91Å; R340-L343 PolarHBondContact O-N 2.65Å; L343-R345 VanDerWaalsContact C-N 3.3Å; L343-R345 PolarHBondContact O-N 2.89Å; L343-Y346 WeakPolarHBondContact O-CB 3.44Å; L343-Y346 PolarHBondContact O-N 3Å; L343-Y346 VanDerWaalsContact O-N 3.11Å; L343-C347 PolarHBondContact O-N 3.44Å; L343-C347 PolarHBondContact O-SG 3.18Å; L343-Y362 HydrophobicContact CB-CE1 4.37Å; L343-Y362 HydrophobicContact CD1-CD1 4.13Å; L343-F365 HydrophobicContact CD1-CB 3.91Å; L343-F365 HydrophobicContact CD1-CD2 3.75Å; L343-F365 HydrophobicContact CD1-CG 3.9Å; L343-F365 HydrophobicContact CD2-CD1 4.16Å; L343-F365 HydrophobicContact CD2-CD2 4.09Å; L343-F365 HydrophobicContact CD2-CE1 4.26Å; L343-F365 HydrophobicContact CD2-CE2 4.23Å; L343-F365 HydrophobicContact CD2-CG 4.07Å; L343-F365 HydrophobicContact CD2-CZ 4.3Å; L343-F365 HydrophobicContact CG-CD2 4.36Å
344	N	89	Confident	81.3	Confident	65 Å²	65	68.6 Å²	68.6	35%	0.348	33%	0.333	S	S	.	.	H	α-helix	trans	-58	-48	172.8	-68.8	0.7	0	0	0	110.3	R340 Y346 C347 S348 H361 Y362	R340-N344 PolarHBondContact O-N 3.31Å; R340-N344 PolarHBondContact O-OD1 3.39Å; N344-Y346 PolarHBondContact O-N 3.4Å; N344-C347 PolarHBondContact O-N 3.15Å; N344-C347 VanDerWaalsContact O-N 3.12Å; N344-S348 PolarHBondContact O-N 3.29Å; N344-S348 PolarHBondContact O-OG 2.96Å; N344-H361 PolarHBondContact OD1-NE2 3.46Å; N344-Y362 PolarHBondContact ND2-OH 3.05Å; N344-Y362 WeakPolarHBondContact OD1-CE1 3.41Å; N344-Y362 VanDerWaalsContact OD1-CZ 3.31Å; N344-Y362 PolarHBondContact OD1-OH 3.26Å
345	R	87.9	Confident	80.8	Confident	126 Å²	126	66.7 Å²	66.7	48%	0.475	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-36.3	176.6	-174.7	-179.9	-173.7	164.5	10	112.8	E341 E342 L343	E341-R345 WeakPolarHBondContact O-CB 3.5Å; E341-R345 PolarHBondContact O-N 3.29Å; E342-R345 PolarHBondContact O-N 3.03Å; L343-R345 VanDerWaalsContact C-N 3.3Å; L343-R345 PolarHBondContact O-N 2.89Å
346	Y	87	Confident	80.3	Confident	22 Å²	22	68 Å²	68	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-42.7	176.5	179.5	-92.4	0	0	0	111.2	F271 L306 R309 Q310 T313 E342 L343 N344 Q353 F365	F271-Y346 HydrophobicContact CZ-CD1 4.38Å; F271-Y346 HydrophobicContact CZ-CD2 4.39Å; F271-Y346 HydrophobicContact CZ-CE1 4.11Å; F271-Y346 HydrophobicContact CZ-CE2 4.03Å; F271-Y346 AromaticContact CZ-CZ 3.87Å; L306-Y346 WeakPolarHBondContact CD1-OH 3.19Å; R309-Y346 HydrophobicContact CB-CE2 4.15Å; Q310-Y346 HydrophobicContact CG-CE2 4.21Å; T313-Y346 HydrophobicContact CG2-CD2 4.44Å; T313-Y346 VanDerWaalsContact OG1-CD2 3.25Å; T313-Y346 WeakPolarHBondContact OG1-CD2 3.36Å; E342-Y346 WeakPolarHBondContact O-CB 3.35Å; E342-Y346 PolarHBondContact O-N 3.31Å; L343-Y346 WeakPolarHBondContact O-CB 3.44Å; L343-Y346 PolarHBondContact O-N 3Å; L343-Y346 VanDerWaalsContact O-N 3.11Å; N344-Y346 PolarHBondContact O-N 3.4Å; Y346-Q353 HydrophobicContact CE1-CB 4.2Å; Y346-Q353 PolarHBondContact OH-OE1 3.2Å; Y346-F365 HydrophobicContact CD1-CZ 4.27Å
347	C	83.8	Confident	79.6	Confident	26 Å²	26	73 Å²	73	18%	0.176	35%	0.353	C	S	.	.	H	α-helix	trans	-72.5	-30	178.9	-66.2	0	0	0	0	114.1	L343 N344 V349 C356	L343-C347 PolarHBondContact O-N 3.44Å; L343-C347 PolarHBondContact O-SG 3.18Å; N344-C347 PolarHBondContact O-N 3.15Å; N344-C347 VanDerWaalsContact O-N 3.12Å; C347-V349 PolarHBondContact O-N 3.28Å; C347-C356 WeakPolarHBondContact CA-SG 3.18Å; C347-C356 HydrophobicContact CB-CB 3.58Å; C347-C356 WeakPolarHBondContact CB-SG 3.43Å; C347-C356 VanDerWaalsContact SG-CA 3.57Å; C347-C356 WeakPolarHBondContact SG-CB 3.28Å; C347-C356 CovalentContact SG-SG 2.04Å; C347-C356 PolarHBondContact SG-SG 3.4Å
348	S	79.4	Confident	78.6	Confident	99 Å²	99	70.8 Å²	70.8	69%	0.692	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.7	-179.2	-55	0	0	0	0	115	N344	N344-S348 PolarHBondContact O-N 3.29Å; N344-S348 PolarHBondContact O-OG 2.96Å
349	V	65.7	Low	77.4	Confident	86 Å²	86	74.5 Å²	74.5	52%	0.521	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	80.1	-174.3	-171.1	0	0	0	0	109.5	R309 C347	R309-V349 PolarHBondContact NH1-O 3.32Å; C347-V349 PolarHBondContact O-N 3.28Å
350	N	55	Low	76.7	Confident	143 Å²	143	80 Å²	80	77%	0.765	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	71.9	-178.3	-74.4	-7.7	0	0	0	113.1	R352	N350-R352 VanDerWaalsContact C-N 3.3Å; N350-R352 PolarHBondContact O-N 3.46Å
351	G	51.8	Low	76.2	Confident	24 Å²	24	78.2 Å²	78.2	25%	0.247	40%	0.398	C	S	.	.			trans	-64	76	178.3	0	0	0	0	0	114.1	Q353	G351-Q353 PolarHBondContact O-N 3Å
352	R	54.9	Low	76	Confident	236 Å²	236	76.9 Å²	76.9	89%	0.891	39%	0.39	S	S	*	.			trans	-75.7	8.5	165.4	-87.1	-173.6	174.1	-171	-1.7	113.4	N350	N350-R352 VanDerWaalsContact C-N 3.3Å; N350-R352 PolarHBondContact O-N 3.46Å
353	Q	67.3	Low	75.7	Confident	32 Å²	32	80 Å²	80	15%	0.15	41%	0.412	C	S	.	.	S	Bend	trans	-97	132.8	174.5	-164.9	174	9.4	0	0	109.8	Y346 G351 C355 C356	Y346-Q353 HydrophobicContact CE1-CB 4.2Å; Y346-Q353 PolarHBondContact OH-OE1 3.2Å; G351-Q353 PolarHBondContact O-N 3Å; Q353-C355 VanDerWaalsContact C-N 3.29Å; Q353-C355 PolarHBondContact O-N 3.29Å; Q353-C356 WeakPolarHBondContact O-CB 3.5Å; Q353-C356 PolarHBondContact O-N 3.43Å
354	E	70.1	Confident	75.5	Confident	160 Å²	160	81.4 Å²	81.4	75%	0.748	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-50.4	-43.1	-175.2	-165.2	163.7	-158.5	0	0	113.3	C356 Q357	E354-C356 VanDerWaalsContact C-N 3.26Å; E354-C356 PolarHBondContact O-N 3.25Å; E354-Q357 PolarHBondContact O-N 3.39Å
355	C	80.9	Confident	75.4	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-65.9	-18.9	178.4	-65.5	0	0	0	0	115.5	Q353 Q357 T358 H361 C364 F365 L368	Q353-C355 VanDerWaalsContact C-N 3.29Å; Q353-C355 PolarHBondContact O-N 3.29Å; C355-Q357 PolarHBondContact O-N 2.86Å; C355-T358 PolarHBondContact O-OG1 3.23Å; C355-T358 VanDerWaalsContact O-OG1 3.07Å; C355-H361 VanDerWaalsContact O-CA 3.28Å; C355-H361 WeakPolarHBondContact O-CA 3.04Å; C355-H361 WeakPolarHBondContact O-CB 3.09Å; C355-C364 WeakPolarHBondContact CA-SG 3.36Å; C355-C364 HydrophobicContact CB-CB 3.58Å; C355-C364 WeakPolarHBondContact CB-SG 3.09Å; C355-C364 WeakPolarHBondContact SG-CB 3.27Å; C355-C364 CovalentContact SG-SG 2.04Å; C355-C364 PolarHBondContact SG-SG 3.48Å; C355-F365 HydrophobicContact CB-CD1 4.22Å; C355-F365 HydrophobicContact CB-CD2 4.08Å; C355-F365 HydrophobicContact CB-CE1 4.06Å; C355-F365 HydrophobicContact CB-CE2 3.86Å; C355-F365 HydrophobicContact CB-CG 4.25Å; C355-F365 HydrophobicContact CB-CZ 3.86Å; C355-L368 WeakPolarHBondContact SG-CD1 3.22Å
356	C	82.3	Confident	75.3	Confident	28 Å²	28	75.2 Å²	75.2	19%	0.189	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-80.5	-5.4	-179.3	-68.8	0	0	0	0	113.4	C347 Q353 E354	C347-C356 WeakPolarHBondContact CA-SG 3.18Å; C347-C356 HydrophobicContact CB-CB 3.58Å; C347-C356 WeakPolarHBondContact CB-SG 3.43Å; C347-C356 VanDerWaalsContact SG-CA 3.57Å; C347-C356 WeakPolarHBondContact SG-CB 3.28Å; C347-C356 CovalentContact SG-SG 2.04Å; C347-C356 PolarHBondContact SG-SG 3.4Å; Q353-C356 WeakPolarHBondContact O-CB 3.5Å; Q353-C356 PolarHBondContact O-N 3.43Å; E354-C356 VanDerWaalsContact C-N 3.26Å; E354-C356 PolarHBondContact O-N 3.25Å
357	Q	76.7	Confident	75.1	Confident	145 Å²	145	78.6 Å²	78.6	68%	0.678	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-99.5	-11.3	-177.5	-62.4	-179.2	5.1	0	0	113.3	E354 C355	E354-Q357 PolarHBondContact O-N 3.39Å; C355-Q357 PolarHBondContact O-N 2.86Å
358	T	70.9	Confident	75.1	Confident	67 Å²	67	81.8 Å²	81.8	41%	0.411	44%	0.438	S	S	.	.	S	Bend	trans	-92	144.3	-179.6	56.3	0	0	0	0	111.5	C355 D360 H361	C355-T358 PolarHBondContact O-OG1 3.23Å; C355-T358 VanDerWaalsContact O-OG1 3.07Å; T358-D360 PolarHBondContact O-N 3.41Å; T358-H361 PolarHBondContact O-N 2.75Å; T358-H361 WeakPolarHBondContact OG1-CA 3.37Å; T358-H361 PolarHBondContact OG1-N 3.43Å
359	D	67.5	Low	75.3	Confident	167 Å²	167	77.7 Å²	77.7	89%	0.893	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.7	177.9	-71.9	-29.9	0	0	0	113
360	D	79.3	Confident	75.9	Confident	115 Å²	115	77 Å²	77	62%	0.615	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	54.3	174.8	-81.9	-28.5	0	0	0	112.3	T358 Y362 S363 C364	T358-D360 PolarHBondContact O-N 3.41Å; D360-Y362 PolarHBondContact O-N 2.84Å; D360-S363 PolarHBondContact O-N 2.85Å; D360-C364 PolarHBondContact O-N 2.52Å
361	H	80.3	Confident	77.1	Confident	31 Å²	31	70.9 Å²	70.9	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-52	-32.1	-179.7	63.7	-74	0	0	0	113.4	N344 C355 T358 S363 C364 F365	N344-H361 PolarHBondContact OD1-NE2 3.46Å; C355-H361 VanDerWaalsContact O-CA 3.28Å; C355-H361 WeakPolarHBondContact O-CA 3.04Å; C355-H361 WeakPolarHBondContact O-CB 3.09Å; T358-H361 PolarHBondContact O-N 2.75Å; T358-H361 WeakPolarHBondContact OG1-CA 3.37Å; T358-H361 PolarHBondContact OG1-N 3.43Å; H361-S363 PolarHBondContact O-N 3.27Å; H361-C364 PolarHBondContact O-N 3.5Å; H361-F365 HydrophobicContact CB-CD2 4.38Å; H361-F365 HydrophobicContact CB-CE2 4.29Å; H361-F365 WeakPolarHBondContact O-CD2 3.41Å; H361-F365 PolarHBondContact O-N 2.98Å
362	Y	85.7	Confident	78.6	Confident	39 Å²	39	72.2 Å²	72.2	15%	0.153	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-38.9	177	-57.9	-56.9	0	0	0	113.8	W339 R340 L343 N344 D360 F365 Q366	W339-Y362 HydrophobicContact CE3-CD1 4.21Å; W339-Y362 AromaticContact CH2-CD1 3.92Å; W339-Y362 HydrophobicContact CH2-CD1 3.92Å; W339-Y362 HydrophobicContact CH2-CG 4.35Å; W339-Y362 AromaticContact CZ3-CD1 3.38Å; W339-Y362 HydrophobicContact CZ3-CD1 3.38Å; W339-Y362 HydrophobicContact CZ3-CE1 4.26Å; W339-Y362 AromaticContact CZ3-CG 3.91Å; W339-Y362 HydrophobicContact CZ3-CG 3.91Å; R340-Y362 HydrophobicContact CB-CE1 3.77Å; R340-Y362 HydrophobicContact CG-CD1 4.18Å; R340-Y362 HydrophobicContact CG-CE1 3.75Å; L343-Y362 HydrophobicContact CB-CE1 4.37Å; L343-Y362 HydrophobicContact CD1-CD1 4.13Å; N344-Y362 PolarHBondContact ND2-OH 3.05Å; N344-Y362 WeakPolarHBondContact OD1-CE1 3.41Å; N344-Y362 VanDerWaalsContact OD1-CZ 3.31Å; N344-Y362 PolarHBondContact OD1-OH 3.26Å; D360-Y362 PolarHBondContact O-N 2.84Å; Y362-F365 PolarHBondContact O-N 2.73Å; Y362-Q366 WeakPolarHBondContact O-CB 3.35Å; Y362-Q366 PolarHBondContact O-N 3.45Å
363	S	84.8	Confident	79.9	Confident	68 Å²	68	65 Å²	65	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-69.3	-38.7	178.5	-62.3	0	0	0	0	110.4	D360 H361 Q366 S367	D360-S363 PolarHBondContact O-N 2.85Å; H361-S363 PolarHBondContact O-N 3.27Å; S363-Q366 WeakPolarHBondContact O-CB 3.35Å; S363-Q366 PolarHBondContact O-N 2.98Å; S363-S367 PolarHBondContact O-N 2.9Å; S363-S367 PolarHBondContact O-OG 3.13Å
364	C	86	Confident	80.6	Confident	30 Å²	30	63.8 Å²	63.8	20%	0.203	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-44.3	173.1	-174.9	0	0	0	0	112.4	C355 D360 H361 Q366 S367 L368	C355-C364 WeakPolarHBondContact CA-SG 3.36Å; C355-C364 HydrophobicContact CB-CB 3.58Å; C355-C364 WeakPolarHBondContact CB-SG 3.09Å; C355-C364 WeakPolarHBondContact SG-CB 3.27Å; C355-C364 CovalentContact SG-SG 2.04Å; C355-C364 PolarHBondContact SG-SG 3.48Å; D360-C364 PolarHBondContact O-N 2.52Å; H361-C364 PolarHBondContact O-N 3.5Å; C364-Q366 PolarHBondContact O-N 3.31Å; C364-S367 PolarHBondContact O-N 3.2Å; C364-S367 PolarHBondContact O-OG 3.28Å; C364-L368 WeakPolarHBondContact O-CG 3.35Å; C364-L368 PolarHBondContact O-N 3.46Å; C364-L368 VanDerWaalsContact O-N 3.16Å
365	F	86.5	Confident	80.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-30.1	175.4	-79.3	-62.7	0	0	0	113.2	F271 P272 W339 L343 Y346 C355 H361 Y362 S369	F271-F365 HydrophobicContact CE1-CE1 4.48Å; F271-F365 HydrophobicContact CZ-CE1 4.4Å; P272-F365 HydrophobicContact CB-CB 4.4Å; P272-F365 HydrophobicContact CB-CD1 3.62Å; P272-F365 HydrophobicContact CB-CE1 4.41Å; P272-F365 HydrophobicContact CB-CG 4.47Å; P272-F365 HydrophobicContact CG-CD1 4.09Å; P272-F365 VanDerWaalsContact CG-O 3.32Å; P272-F365 WeakPolarHBondContact CG-O 3.29Å; W339-F365 HydrophobicContact CH2-CB 4.42Å; W339-F365 HydrophobicContact CZ2-CB 4.18Å; L343-F365 HydrophobicContact CD1-CB 3.91Å; L343-F365 HydrophobicContact CD1-CD2 3.75Å; L343-F365 HydrophobicContact CD1-CG 3.9Å; L343-F365 HydrophobicContact CD2-CD1 4.16Å; L343-F365 HydrophobicContact CD2-CD2 4.09Å; L343-F365 HydrophobicContact CD2-CE1 4.26Å; L343-F365 HydrophobicContact CD2-CE2 4.23Å; L343-F365 HydrophobicContact CD2-CG 4.07Å; L343-F365 HydrophobicContact CD2-CZ 4.3Å; L343-F365 HydrophobicContact CG-CD2 4.36Å; Y346-F365 HydrophobicContact CD1-CZ 4.27Å; C355-F365 HydrophobicContact CB-CD1 4.22Å; C355-F365 HydrophobicContact CB-CD2 4.08Å; C355-F365 HydrophobicContact CB-CE1 4.06Å; C355-F365 HydrophobicContact CB-CE2 3.86Å; C355-F365 HydrophobicContact CB-CG 4.25Å; C355-F365 HydrophobicContact CB-CZ 3.86Å; H361-F365 HydrophobicContact CB-CD2 4.38Å; H361-F365 HydrophobicContact CB-CE2 4.29Å; H361-F365 WeakPolarHBondContact O-CD2 3.41Å; H361-F365 PolarHBondContact O-N 2.98Å; Y362-F365 PolarHBondContact O-N 2.73Å; F365-S369 PolarHBondContact O-N 3.26Å
366	Q	85.2	Confident	80.1	Confident	61 Å²	61	63.2 Å²	63.2	29%	0.285	36%	0.357	S	S	.	.	H	α-helix	trans	-70.8	-45.7	176	176.5	61.4	12	0	0	111.9	Y362 S363 C364 L368 S369	Y362-Q366 WeakPolarHBondContact O-CB 3.35Å; Y362-Q366 PolarHBondContact O-N 3.45Å; S363-Q366 WeakPolarHBondContact O-CB 3.35Å; S363-Q366 PolarHBondContact O-N 2.98Å; C364-Q366 PolarHBondContact O-N 3.31Å; Q366-L368 VanDerWaalsContact C-N 3.31Å; Q366-L368 PolarHBondContact O-N 3.37Å; Q366-S369 WeakPolarHBondContact O-CB 3.45Å; Q366-S369 PolarHBondContact O-N 3.2Å
367	S	83.1	Confident	79.2	Confident	94 Å²	94	64.2 Å²	64.2	66%	0.657	36%	0.362	S	S	*	.	H	α-helix	trans	-66.9	-33.3	-178.7	61.1	0	0	0	0	112.6	S363 C364 S369	S363-S367 PolarHBondContact O-N 2.9Å; S363-S367 PolarHBondContact O-OG 3.13Å; C364-S367 PolarHBondContact O-N 3.2Å; C364-S367 PolarHBondContact O-OG 3.28Å; S367-S369 VanDerWaalsContact C-N 3.3Å; S367-S369 PolarHBondContact O-N 3.17Å
368	L	83	Confident	78.1	Confident	92 Å²	92	59.9 Å²	59.9	48%	0.482	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.4	177.5	-64.6	-176.5	0	0	0	114	P272 C355 C364 Q366 S370	P272-L368 VanDerWaalsContact CD-O 3.29Å; P272-L368 WeakPolarHBondContact CD-O 3.4Å; P272-L368 HydrophobicContact CG-CB 3.82Å; C355-L368 WeakPolarHBondContact SG-CD1 3.22Å; C364-L368 WeakPolarHBondContact O-CG 3.35Å; C364-L368 PolarHBondContact O-N 3.46Å; C364-L368 VanDerWaalsContact O-N 3.16Å; Q366-L368 VanDerWaalsContact C-N 3.31Å; Q366-L368 PolarHBondContact O-N 3.37Å; L368-S370 PolarHBondContact O-N 3.3Å
369	S	83.6	Confident	76.8	Confident	14 Å²	14	60.3 Å²	60.3	10%	0.098	36%	0.358	C	S	.	.			trans	-67.1	124.9	-175.2	-170.7	0	0	0	0	112	P272 G274 F365 Q366 S367 D371	P272-S369 WeakPolarHBondContact O-CA 2.93Å; P272-S369 WeakPolarHBondContact O-CB 2.99Å; P272-S369 PolarHBondContact O-OG 3.04Å; G274-S369 VanDerWaalsContact CA-OG 3.3Å; G274-S369 WeakPolarHBondContact CA-OG 3.45Å; G274-S369 PolarHBondContact N-OG 2.97Å; F365-S369 PolarHBondContact O-N 3.26Å; Q366-S369 WeakPolarHBondContact O-CB 3.45Å; Q366-S369 PolarHBondContact O-N 3.2Å; S367-S369 VanDerWaalsContact C-N 3.3Å; S367-S369 PolarHBondContact O-N 3.17Å; S369-D371 VanDerWaalsContact C-N 3.26Å; S369-D371 PolarHBondContact O-N 3.48Å; S369-D371 PolarHBondContact OG-N 3.35Å
370	S	80.1	Confident	75.7	Confident	71 Å²	71	55 Å²	55	50%	0.497	34%	0.337	S	S	.	.	S	Bend	trans	-74.2	-15.4	176.1	53	0	0	0	0	113.9	L368	L368-S370 PolarHBondContact O-N 3.3Å
371	D	78.7	Confident	74	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.08	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-146.5	74.6	177.5	-176.5	19.3	0	0	0	110.9	S369 L373 Y374 N375 T376	S369-D371 VanDerWaalsContact C-N 3.26Å; S369-D371 PolarHBondContact O-N 3.48Å; S369-D371 PolarHBondContact OG-N 3.35Å; D371-L373 PolarHBondContact O-N 3.05Å; D371-Y374 PolarHBondContact O-N 3.29Å; D371-Y374 WeakPolarHBondContact OD1-CA 3.35Å; D371-Y374 PolarHBondContact OD1-N 2.94Å; D371-Y374 WeakPolarHBondContact OD2-CA 3.43Å; D371-N375 PolarHBondContact OD1-N 3.43Å; D371-N375 PolarHBondContact OD2-N 2.86Å; D371-T376 VanDerWaalsContact CG-OG1 3.28Å; D371-T376 WeakPolarHBondContact OD2-CA 3.49Å; D371-T376 WeakPolarHBondContact OD2-CB 3.41Å; D371-T376 PolarHBondContact OD2-N 2.9Å; D371-T376 PolarHBondContact OD2-OG1 2.7Å
372	P	82.9	Confident	72.3	Confident	52 Å²	52	62.4 Å²	62.4	34%	0.338	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.1	-176.2	26	-33	0	0	0	113.3	N280	N280-P372 PolarHBondContact ND2-O 3.01Å
373	L	83.4	Confident	70.8	Confident	85 Å²	85	62 Å²	62	45%	0.445	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	0.6	-177.9	-65.6	179	0	0	0	114	N280 S283 D371 N375	N280-L373 HydrophobicContact CB-CD2 4.11Å; S283-L373 VanDerWaalsContact CB-O 3.23Å; S283-L373 WeakPolarHBondContact CB-O 3.44Å; D371-L373 PolarHBondContact O-N 3.05Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 2.99Å
374	Y	80.8	Confident	69.6	Low	6 Å²	6	62 Å²	62	2%	0.024	37%	0.368	C	S	.	.	S	Bend	trans	59.7	37.5	-178.1	-63.1	-81.7	0	0	0	114.1	G274 N280 L284 N287 F321 D371	G274-Y374 PolarHBondContact O-OH 3.1Å; N280-Y374 HydrophobicContact CB-CD2 4.4Å; L284-Y374 HydrophobicContact CB-CD2 3.91Å; L284-Y374 HydrophobicContact CB-CE2 4.34Å; L284-Y374 HydrophobicContact CB-CG 4.11Å; L284-Y374 HydrophobicContact CD1-CD2 4.07Å; L284-Y374 HydrophobicContact CD1-CE1 4.35Å; L284-Y374 HydrophobicContact CD1-CE2 3.61Å; L284-Y374 HydrophobicContact CG-CD2 4.2Å; L284-Y374 HydrophobicContact CG-CE1 4.46Å; L284-Y374 HydrophobicContact CG-CE2 4.2Å; L284-Y374 HydrophobicContact CG-CG 4.34Å; N287-Y374 PolarHBondContact ND2-O 3.32Å; N287-Y374 VanDerWaalsContact ND2-O 3.15Å; F321-Y374 HydrophobicContact CE2-CE1 4.18Å; F321-Y374 WeakPolarHBondContact CE2-OH 3.24Å; F321-Y374 WeakPolarHBondContact CZ-OH 3.35Å; D371-Y374 PolarHBondContact O-N 3.29Å; D371-Y374 WeakPolarHBondContact OD1-CA 3.35Å; D371-Y374 PolarHBondContact OD1-N 2.94Å; D371-Y374 WeakPolarHBondContact OD2-CA 3.43Å
375	N	74.2	Confident	68.4	Low	92 Å²	92	62.1 Å²	62.1	49%	0.492	37%	0.366	S	S	.	.			trans	-86.4	-21.5	178.9	-70.1	-21.2	0	0	0	112.3	D371 L373 T377	D371-N375 PolarHBondContact OD1-N 3.43Å; D371-N375 PolarHBondContact OD2-N 2.86Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 2.99Å; N375-T377 PolarHBondContact O-N 2.75Å
376	T	66.9	Low	67.2	Low	55 Å²	55	63.5 Å²	63.5	34%	0.337	37%	0.374	S	S	.	.			trans	-70.1	101.5	-179	-57	0	0	0	0	109.7	N270 D371	N270-T376 VanDerWaalsContact ND2-CB 3.3Å; N270-T376 WeakPolarHBondContact ND2-CB 3.49Å; N270-T376 WeakPolarHBondContact ND2-CG2 3.27Å; D371-T376 VanDerWaalsContact CG-OG1 3.28Å; D371-T376 WeakPolarHBondContact OD2-CA 3.49Å; D371-T376 WeakPolarHBondContact OD2-CB 3.41Å; D371-T376 PolarHBondContact OD2-N 2.9Å; D371-T376 PolarHBondContact OD2-OG1 2.7Å
377	T	63.3	Low	66.3	Low	50 Å²	50	63.1 Å²	63.1	31%	0.307	37%	0.371	S	S	.	.			trans	-104.4	135.7	174.4	53.8	0	0	0	0	108.4	N287 R290 N375 A379	N287-T377 HydrophobicContact CB-CG2 4.02Å; R290-T377 HydrophobicContact CB-CG2 3.56Å; N375-T377 PolarHBondContact O-N 2.75Å; T377-A379 PolarHBondContact O-N 2.6Å
378	S	54.1	Low	65.5	Low	53 Å²	53	58.6 Å²	58.6	37%	0.371	34%	0.34	S	S	.	.			trans	-68.7	84.7	162.3	64.3	0	0	0	0	105.5	R290 A380	R290-S378 PolarHBondContact O-N 2.04Å; R290-S378 PolarHBondContact O-OG 3.29Å; S378-A380 PolarHBondContact O-N 3.31Å
379	A	42.6	Very low	64.8	Low	76 Å²	76	55.3 Å²	55.3	63%	0.628	32%	0.324	S	S	*	.			trans	-59.2	103.5	180	0	0	0	0	0	107.3	T377 E381	T377-A379 PolarHBondContact O-N 2.6Å; A379-E381 PolarHBondContact O-N 3.17Å; A379-E381 VanDerWaalsContact O-N 3.12Å
380	A	44.2	Very low	63.9	Low	55 Å²	55	60.9 Å²	60.9	46%	0.455	35%	0.353	S	S	.	.			trans	-65.2	104.4	142.4	0	0	0	0	0	103.1	S378 E382	S378-A380 PolarHBondContact O-N 3.31Å; A380-E382 PolarHBondContact O-N 2.97Å
381	E	44.4	Very low	63	Low	134 Å²	134	58.4 Å²	58.4	63%	0.626	34%	0.335	S	S	*	.			trans	-26	132.2	159.6	-101.1	176.5	138	0	0	108.9	A379 P383 K387	A379-E381 PolarHBondContact O-N 3.17Å; A379-E381 VanDerWaalsContact O-N 3.12Å; E381-P383 VanDerWaalsContact O-N 3.08Å; E381-K387 WeakPolarHBondContact OE2-CE 3.17Å; E381-K387 IonicContact OE2-NZ 3.83Å; E381-K387 PolarHBondContact OE2-NZ 3.45Å
382	E	44.9	Very low	62	Low	169 Å²	169	65.7 Å²	65.7	79%	0.79	37%	0.368	S	S	*	.			trans	-47.5	126	169.2	-65.7	-156.8	143.2	0	0	107.8	A380 T384	A380-E382 PolarHBondContact O-N 2.97Å; E382-T384 VanDerWaalsContact C-N 3.35Å; E382-T384 PolarHBondContact O-N 3.07Å
383	P	54	Low	60.6	Low	29 Å²	29	67.1 Å²	67.1	19%	0.188	37%	0.372	C	S	.	.			trans	-65.6	101.5	-174.8	22.3	-28.2	0	0	0	107.5	E381 M463 I466 T467	E381-P383 VanDerWaalsContact O-N 3.08Å; P383-M463 WeakPolarHBondContact O-CE 3.35Å; P383-I466 HydrophobicContact CB-CG2 3.99Å; P383-T467 VanDerWaalsContact CG-OG1 3.32Å; P383-T467 WeakPolarHBondContact CG-OG1 3.47Å
384	T	59.1	Low	59.3	Low	70 Å²	70	63.3 Å²	63.3	43%	0.429	35%	0.352	S	S	.	.			trans	-68.3	150.6	171.6	47.3	0	0	0	0	109.1	E382 N386 K387	E382-T384 VanDerWaalsContact C-N 3.35Å; E382-T384 PolarHBondContact O-N 3.07Å; T384-N386 PolarHBondContact O-N 2.94Å; T384-N386 VanDerWaalsContact O-N 3.08Å; T384-K387 WeakPolarHBondContact O-CB 3.19Å; T384-K387 PolarHBondContact O-N 3.36Å
385	L	60.7	Low	57.9	Low	32 Å²	32	65.6 Å²	65.6	17%	0.168	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-56	-26.6	177.5	-94.2	93.6	0	0	0	112.1	K387 M388 F420 L424 M463	L385-K387 PolarHBondContact O-N 3.49Å; L385-M388 WeakPolarHBondContact O-CB 3.41Å; L385-M388 PolarHBondContact O-N 3.48Å; L385-F420 HydrophobicContact CB-CD2 3.7Å; L385-F420 HydrophobicContact CB-CE2 3.98Å; L385-F420 HydrophobicContact CB-CG 4.17Å; L385-F420 HydrophobicContact CD2-CB 3.43Å; L385-F420 VanDerWaalsContact CD2-CB 3.43Å; L385-F420 HydrophobicContact CD2-CD1 3.9Å; L385-F420 HydrophobicContact CD2-CD2 3.95Å; L385-F420 HydrophobicContact CD2-CG 3.51Å; L385-F420 HydrophobicContact CG-CD2 4.48Å; L385-F420 HydrophobicContact CG-CG 4.48Å; L385-L424 HydrophobicContact CD2-CD1 4.32Å; L385-M463 HydrophobicContact CD1-CE 4.25Å; L385-M463 HydrophobicContact CD1-SD 3.47Å; L385-M463 WeakPolarHBondContact CD1-SD 3.38Å; L385-M463 HydrophobicContact CG-SD 4.04Å
386	N	62.4	Low	56.8	Low	28 Å²	28	68.9 Å²	68.9	15%	0.15	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-54.5	-35.1	173.3	-73.7	-7.2	0	0	0	113.6	T384 M388 C389 R416 N417	T384-N386 PolarHBondContact O-N 2.94Å; T384-N386 VanDerWaalsContact O-N 3.08Å; N386-M388 PolarHBondContact O-N 2.86Å; N386-M388 VanDerWaalsContact O-N 3.1Å; N386-C389 WeakPolarHBondContact O-CB 3.42Å; N386-C389 PolarHBondContact O-N 3.44Å; N386-R416 VanDerWaalsContact OD1-CB 3.31Å; N386-R416 WeakPolarHBondContact OD1-CB 3.49Å; N386-N417 PolarHBondContact OD1-OD1 3.43Å
387	K	65.5	Low	56.2	Low	53 Å²	53	72.7 Å²	72.7	23%	0.23	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-68.8	-9.4	178.2	-63.4	-171.3	-179.7	-178.3	0	113.8	E381 T384 L385 C389 D390 T391	E381-K387 WeakPolarHBondContact OE2-CE 3.17Å; E381-K387 IonicContact OE2-NZ 3.83Å; E381-K387 PolarHBondContact OE2-NZ 3.45Å; T384-K387 WeakPolarHBondContact O-CB 3.19Å; T384-K387 PolarHBondContact O-N 3.36Å; L385-K387 PolarHBondContact O-N 3.49Å; K387-C389 VanDerWaalsContact C-N 3.3Å; K387-D390 PolarHBondContact O-N 2.85Å; K387-T391 WeakPolarHBondContact O-CG2 3.49Å
388	M	66.2	Low	56.1	Low	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-63.2	-37.9	172.7	-172.7	137.6	174	0	0	111.7	L385 N386 D390 T391 I394 G401 L404 V462 I466	L385-M388 WeakPolarHBondContact O-CB 3.41Å; L385-M388 PolarHBondContact O-N 3.48Å; N386-M388 PolarHBondContact O-N 2.86Å; N386-M388 VanDerWaalsContact O-N 3.1Å; M388-D390 PolarHBondContact O-N 2.85Å; M388-T391 PolarHBondContact O-N 3.25Å; M388-T391 PolarHBondContact O-OG1 3.49Å; M388-T391 VanDerWaalsContact O-OG1 3.07Å; M388-I394 HydrophobicContact CB-CD1 4.38Å; M388-I394 HydrophobicContact CE-CD1 4.25Å; M388-I394 HydrophobicContact CE-CG2 3.89Å; M388-I394 HydrophobicContact CG-CD1 3.68Å; M388-I394 HydrophobicContact SD-CD1 4.11Å; M388-G401 VanDerWaalsContact CE-C 3.44Å; M388-G401 WeakPolarHBondContact CE-O 2.93Å; M388-L404 HydrophobicContact CE-CB 4.19Å; M388-L404 HydrophobicContact CE-CD1 4.4Å; M388-V462 HydrophobicContact CE-CG1 4.07Å; M388-V462 HydrophobicContact SD-CG1 3.76Å; M388-I466 HydrophobicContact CB-CD1 4.07Å; M388-I466 HydrophobicContact CB-CG1 4.34Å; M388-I466 HydrophobicContact CG-CD1 4.35Å; M388-I466 HydrophobicContact CG-CG1 4.41Å; M388-I466 HydrophobicContact SD-CD1 3.53Å; M388-I466 VanDerWaalsContact SD-CD1 3.53Å; M388-I466 HydrophobicContact SD-CG1 3.83Å
389	C	68.8	Low	56.5	Low	23 Å²	23	71 Å²	71	16%	0.155	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.1	-179.6	-60.3	0	0	0	0	112.6	N386 K387 T391 K405 C409	N386-C389 WeakPolarHBondContact O-CB 3.42Å; N386-C389 PolarHBondContact O-N 3.44Å; K387-C389 VanDerWaalsContact C-N 3.3Å; C389-T391 VanDerWaalsContact C-N 3.35Å; C389-T391 PolarHBondContact O-N 2.93Å; C389-K405 WeakPolarHBondContact O-CE 3.3Å; C389-C409 WeakPolarHBondContact CA-SG 3.45Å; C389-C409 HydrophobicContact CB-CB 3.69Å; C389-C409 WeakPolarHBondContact CB-SG 3.07Å; C389-C409 WeakPolarHBondContact SG-CA 3.29Å; C389-C409 WeakPolarHBondContact SG-CB 2.92Å; C389-C409 CovalentContact SG-SG 2.03Å; C389-C409 PolarHBondContact SG-SG 3.02Å
390	D	64.5	Low	57.5	Low	130 Å²	130	67.5 Å²	67.5	70%	0.695	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.6	-177.3	-52.5	-37.1	0	0	0	113.6	K387 M388	K387-D390 PolarHBondContact O-N 2.85Å; M388-D390 PolarHBondContact O-N 2.85Å
391	T	62	Low	58.4	Low	20 Å²	20	64.9 Å²	64.9	12%	0.123	33%	0.328	C	S	.	.			trans	-108	114.9	-172	58.8	0	0	0	0	112.9	K387 M388 C389 I393 I394 K405 T470	K387-T391 WeakPolarHBondContact O-CG2 3.49Å; M388-T391 PolarHBondContact O-N 3.25Å; M388-T391 PolarHBondContact O-OG1 3.49Å; M388-T391 VanDerWaalsContact O-OG1 3.07Å; C389-T391 VanDerWaalsContact C-N 3.35Å; C389-T391 PolarHBondContact O-N 2.93Å; T391-I393 VanDerWaalsContact C-N 3.25Å; T391-I393 PolarHBondContact O-N 2.98Å; T391-I394 WeakPolarHBondContact OG1-CD1 3.31Å; T391-K405 PolarHBondContact O-NZ 3.19Å; T391-T470 HydrophobicContact CG2-CG2 4.23Å
392	Q	57.5	Low	59.4	Low	168 Å²	168	63.1 Å²	63.1	79%	0.785	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-9.6	177	-71.4	171.2	-5.6	0	0	114.2
393	I	52.7	Low	60.4	Low	81 Å²	81	58.9 Å²	58.9	42%	0.415	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-11.8	-167.6	-60.1	172.8	0	0	0	112.9	T391 D395 A469	T391-I393 VanDerWaalsContact C-N 3.25Å; T391-I393 PolarHBondContact O-N 2.98Å; I393-D395 VanDerWaalsContact C-N 3.32Å; I393-D395 PolarHBondContact O-N 3.36Å; I393-A469 HydrophobicContact CB-CB 4.19Å; I393-A469 HydrophobicContact CG2-CB 4.38Å
394	I	56.3	Low	61.2	Low	6 Å²	6	57.5 Å²	57.5	3%	0.031	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-76	-24.7	-173.5	-63	174.4	0	0	0	112	M388 T391 N396 R397 I466 A469	M388-I394 HydrophobicContact CB-CD1 4.38Å; M388-I394 HydrophobicContact CE-CD1 4.25Å; M388-I394 HydrophobicContact CE-CG2 3.89Å; M388-I394 HydrophobicContact CG-CD1 3.68Å; M388-I394 HydrophobicContact SD-CD1 4.11Å; T391-I394 WeakPolarHBondContact OG1-CD1 3.31Å; I394-N396 PolarHBondContact O-N 2.88Å; I394-N396 VanDerWaalsContact O-N 3.1Å; I394-R397 PolarHBondContact O-N 3.46Å; I394-I466 HydrophobicContact CD1-CG1 3.77Å; I394-A469 HydrophobicContact CG1-CB 4.49Å
395	D	52	Low	61.7	Low	54 Å²	54	56 Å²	56	29%	0.289	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60.3	-28.4	-170.4	-55.8	-16.3	0	0	0	113.3	I393 F402	I393-D395 VanDerWaalsContact C-N 3.32Å; I393-D395 PolarHBondContact O-N 3.36Å; D395-F402 HydrophobicContact CB-CD2 3.77Å; D395-F402 HydrophobicContact CB-CE2 4.35Å; D395-F402 WeakPolarHBondContact OD1-CD2 3.21Å
396	N	51.4	Low	62.2	Low	160 Å²	160	58.2 Å²	58.2	86%	0.856	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-102.9	-3	-173.3	-68.2	-13.4	0	0	0	115.3	I394	I394-N396 PolarHBondContact O-N 2.88Å; I394-N396 VanDerWaalsContact O-N 3.1Å
397	R	54	Low	62.8	Low	135 Å²	135	60.8 Å²	60.8	51%	0.509	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-21.9	-175	-79.5	-172.6	175.4	172.8	0.3	114.9	I394	I394-R397 PolarHBondContact O-N 3.46Å
398	L	61.5	Low	63.3	Low	8 Å²	8	58.3 Å²	58.3	4%	0.042	29%	0.292	C	S	.	.			trans	-145.6	109.7	-178.2	-144.8	81.5	0	0	0	109.8	V400 G401 F402 V441 V462	L398-V400 HydrophobicContact CD2-CB 4.07Å; L398-V400 HydrophobicContact CG-CB 4.34Å; L398-V400 PolarHBondContact O-N 3.22Å; L398-G401 PolarHBondContact O-N 3.4Å; L398-F402 PolarHBondContact O-N 2.95Å; L398-V441 HydrophobicContact CD1-CB 4.27Å; L398-V441 HydrophobicContact CD1-CG1 4.22Å; L398-V462 HydrophobicContact CD2-CB 4.36Å; L398-V462 HydrophobicContact CD2-CG2 3.41Å; L398-V462 VanDerWaalsContact CD2-CG2 3.41Å
399	P	62	Low	63.9	Low	61 Å²	61	59.4 Å²	59.4	40%	0.396	30%	0.3	S	S	.	.	H	α-helix	trans	-56.2	-38.3	177.2	-25.9	34.2	0	0	0	112.8	G401 F402 Q403	P399-G401 PolarHBondContact O-N 3.3Å; P399-F402 PolarHBondContact O-N 3.45Å; P399-Q403 PolarHBondContact O-N 3.03Å
400	V	63.5	Low	64.4	Low	2 Å²	2	63.4 Å²	63.4	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-53.6	-42.3	172.9	-178	0	0	0	0	111	L398 Q403 L404 L424 L431 V442 L458 V462	L398-V400 HydrophobicContact CD2-CB 4.07Å; L398-V400 HydrophobicContact CG-CB 4.34Å; L398-V400 PolarHBondContact O-N 3.22Å; V400-Q403 PolarHBondContact O-N 2.91Å; V400-L404 HydrophobicContact CG1-CD1 3.86Å; V400-L404 HydrophobicContact CG1-CG 4.41Å; V400-L404 VanDerWaalsContact O-CG 3.25Å; V400-L404 WeakPolarHBondContact O-CG 3.38Å; V400-L404 PolarHBondContact O-N 3.26Å; V400-L404 VanDerWaalsContact O-N 3.15Å; V400-L424 HydrophobicContact CG1-CD2 4.2Å; V400-L431 HydrophobicContact CB-CD1 4.35Å; V400-L431 HydrophobicContact CG2-CD1 3.19Å; V400-V442 HydrophobicContact CG2-CG2 4.35Å; V400-L458 HydrophobicContact CG2-CD2 4.46Å; V400-V462 HydrophobicContact CG1-CG2 4.14Å
401	G	62.7	Low	65	Low	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-75.1	-31.6	-173.7	0	0	0	0	0	113.8	M388 L398 P399 K405	M388-G401 VanDerWaalsContact CE-C 3.44Å; M388-G401 WeakPolarHBondContact CE-O 2.93Å; L398-G401 PolarHBondContact O-N 3.4Å; P399-G401 PolarHBondContact O-N 3.3Å; G401-K405 WeakPolarHBondContact O-CB 3.06Å; G401-K405 PolarHBondContact O-N 2.98Å
402	F	65.1	Low	65.5	Low	97 Å²	97	63 Å²	63	43%	0.425	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-46.5	173	-179	-101.5	0	0	0	111.3	D395 L398 P399 K405 T406	D395-F402 HydrophobicContact CB-CD2 3.77Å; D395-F402 HydrophobicContact CB-CE2 4.35Å; D395-F402 WeakPolarHBondContact OD1-CD2 3.21Å; L398-F402 PolarHBondContact O-N 2.95Å; P399-F402 PolarHBondContact O-N 3.45Å; F402-K405 WeakPolarHBondContact O-CB 3.44Å; F402-K405 PolarHBondContact O-N 2.01Å; F402-T406 HydrophobicContact CD1-CG2 4.47Å; F402-T406 HydrophobicContact CE1-CG2 4.07Å; F402-T406 HydrophobicContact CE2-CG2 4.47Å; F402-T406 HydrophobicContact CZ-CG2 4.08Å; F402-T406 PolarHBondContact O-N 2.99Å; F402-T406 PolarHBondContact O-OG1 3.31Å
403	Q	66.4	Low	65.8	Low	80 Å²	80	61.4 Å²	61.4	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-66.9	-42.1	-177.6	-65.5	-157.1	8.6	0	0	113	P399 V400 K405 T406 Q407 M427	P399-Q403 PolarHBondContact O-N 3.03Å; V400-Q403 PolarHBondContact O-N 2.91Å; Q403-K405 PolarHBondContact O-N 3.17Å; Q403-T406 WeakPolarHBondContact CA-OG1 3.35Å; Q403-T406 PolarHBondContact O-N 3.47Å; Q403-T406 PolarHBondContact O-OG1 2.82Å; Q403-Q407 WeakPolarHBondContact O-CB 3.47Å; Q403-Q407 WeakPolarHBondContact O-CG 3.05Å; Q403-Q407 PolarHBondContact O-N 2.95Å; Q403-M427 HydrophobicContact CB-SD 4.41Å; Q403-M427 PolarHBondContact OE1-SD 3.49Å
404	L	70.8	Confident	66.4	Low	0 Å²	0	66 Å²	66	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-38	173.2	-70.6	172.7	0	0	0	111.9	M388 V400 C408 F420 N423 L424	M388-L404 HydrophobicContact CE-CB 4.19Å; M388-L404 HydrophobicContact CE-CD1 4.4Å; V400-L404 HydrophobicContact CG1-CD1 3.86Å; V400-L404 HydrophobicContact CG1-CG 4.41Å; V400-L404 VanDerWaalsContact O-CG 3.25Å; V400-L404 WeakPolarHBondContact O-CG 3.38Å; V400-L404 PolarHBondContact O-N 3.26Å; V400-L404 VanDerWaalsContact O-N 3.15Å; L404-C408 WeakPolarHBondContact O-CB 3.34Å; L404-C408 PolarHBondContact O-N 3.41Å; L404-F420 HydrophobicContact CB-CD1 4.06Å; L404-F420 HydrophobicContact CB-CE1 4.09Å; L404-F420 HydrophobicContact CD2-CD1 4.25Å; L404-N423 HydrophobicContact CD2-CB 3.49Å; L404-N423 VanDerWaalsContact CD2-CB 3.49Å; L404-L424 HydrophobicContact CD1-CD2 3.72Å; L404-L424 HydrophobicContact CD1-CG 3.97Å; L404-L424 HydrophobicContact CD2-CG 4.27Å
405	K	69.8	Low	67.2	Low	39 Å²	39	69.8 Å²	69.8	17%	0.17	36%	0.359	C	S	.	.	H	α-helix	trans	-68.4	-40.6	178.1	-165.7	-178.6	176.4	-172.1	0	111.7	C389 T391 G401 F402 Q403 C409	C389-K405 WeakPolarHBondContact O-CE 3.3Å; T391-K405 PolarHBondContact O-NZ 3.19Å; G401-K405 WeakPolarHBondContact O-CB 3.06Å; G401-K405 PolarHBondContact O-N 2.98Å; F402-K405 WeakPolarHBondContact O-CB 3.44Å; F402-K405 PolarHBondContact O-N 2.01Å; Q403-K405 PolarHBondContact O-N 3.17Å; K405-C409 VanDerWaalsContact CG-SG 3.55Å; K405-C409 WeakPolarHBondContact O-CB 3.5Å; K405-C409 PolarHBondContact O-N 3.29Å; K405-C409 PolarHBondContact O-SG 3.2Å
406	T	71.4	Confident	68.2	Low	77 Å²	77	69.3 Å²	69.3	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-69.5	-36.1	178.2	49.8	0	0	0	0	113.4	F402 Q403	F402-T406 HydrophobicContact CD1-CG2 4.47Å; F402-T406 HydrophobicContact CE1-CG2 4.07Å; F402-T406 HydrophobicContact CE2-CG2 4.47Å; F402-T406 HydrophobicContact CZ-CG2 4.08Å; F402-T406 PolarHBondContact O-N 2.99Å; F402-T406 PolarHBondContact O-OG1 3.31Å; Q403-T406 WeakPolarHBondContact CA-OG1 3.35Å; Q403-T406 PolarHBondContact O-N 3.47Å; Q403-T406 PolarHBondContact O-OG1 2.82Å
407	Q	74.4	Confident	69.1	Low	83 Å²	83	65.6 Å²	65.6	39%	0.388	33%	0.333	S	S	.	.	H	α-helix	trans	-88.6	-37.9	-174.3	-69.8	172.5	-13.6	0	0	113	Q403 N423	Q403-Q407 WeakPolarHBondContact O-CB 3.47Å; Q403-Q407 WeakPolarHBondContact O-CG 3.05Å; Q403-Q407 PolarHBondContact O-N 2.95Å; Q407-N423 PolarHBondContact OE1-OD1 3.2Å
408	C	76.8	Confident	70.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-102.6	-22.7	-171.6	-62.3	0	0	0	0	115.3	L404 P410 L411 C419 F420 N423	L404-C408 WeakPolarHBondContact O-CB 3.34Å; L404-C408 PolarHBondContact O-N 3.41Å; C408-P410 VanDerWaalsContact C-CD 3.43Å; C408-L411 PolarHBondContact O-N 3.38Å; C408-C419 WeakPolarHBondContact CA-SG 3.38Å; C408-C419 HydrophobicContact CB-CB 3.77Å; C408-C419 WeakPolarHBondContact CB-SG 3.35Å; C408-C419 WeakPolarHBondContact SG-CB 3.38Å; C408-C419 PolarHBondContact SG-O 3.01Å; C408-C419 VanDerWaalsContact SG-O 3.33Å; C408-C419 CovalentContact SG-SG 2.05Å; C408-C419 PolarHBondContact SG-SG 3.12Å; C408-F420 HydrophobicContact CB-CD1 3.8Å; C408-F420 HydrophobicContact CB-CE1 3.59Å; C408-F420 HydrophobicContact CB-CE2 4.38Å; C408-F420 HydrophobicContact CB-CG 4.27Å; C408-F420 HydrophobicContact CB-CZ 3.9Å; C408-N423 PolarHBondContact SG-ND2 3.12Å
409	C	78.1	Confident	70.9	Confident	24 Å²	24	62.7 Å²	62.7	16%	0.162	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-25.6	-179.9	-62.9	0	0	0	0	116.5	C389 K405 L411 R416	C389-C409 WeakPolarHBondContact CA-SG 3.45Å; C389-C409 HydrophobicContact CB-CB 3.69Å; C389-C409 WeakPolarHBondContact CB-SG 3.07Å; C389-C409 WeakPolarHBondContact SG-CA 3.29Å; C389-C409 WeakPolarHBondContact SG-CB 2.92Å; C389-C409 CovalentContact SG-SG 2.03Å; C389-C409 PolarHBondContact SG-SG 3.02Å; K405-C409 VanDerWaalsContact CG-SG 3.55Å; K405-C409 WeakPolarHBondContact O-CB 3.5Å; K405-C409 PolarHBondContact O-N 3.29Å; K405-C409 PolarHBondContact O-SG 3.2Å; C409-L411 PolarHBondContact O-N 3.47Å; C409-R416 PolarHBondContact O-NH2 2.05Å; C409-R416 VanDerWaalsContact O-NH2 3.17Å
410	P	80.1	Confident	71.5	Confident	106 Å²	106	59.9 Å²	59.9	69%	0.688	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.1	173.8	-22	34.2	0	0	0	114.4	C408	C408-P410 VanDerWaalsContact C-CD 3.43Å
411	L	76.9	Confident	72	Confident	67 Å²	67	66.4 Å²	66.4	35%	0.351	35%	0.346	S	S	.	.	S	Bend	trans	-78.7	157.6	-176.7	-66.1	172.6	0	0	0	112.4	C408 C409 R416 C419	C408-L411 PolarHBondContact O-N 3.38Å; C409-L411 PolarHBondContact O-N 3.47Å; L411-R416 HydrophobicContact CB-CG 4.37Å; L411-R416 VanDerWaalsContact O-CZ 3.29Å; L411-R416 PolarHBondContact O-NE 2.78Å; L411-R416 PolarHBondContact O-NH2 3.43Å; L411-C419 HydrophobicContact CD1-CB 3.71Å
412	P	73	Confident	72.7	Confident	76 Å²	76	72.2 Å²	72.2	49%	0.494	38%	0.377	S	S	.	.			trans	-65.2	150.1	173.2	26.7	-33.8	0	0	0	111.9	Q414 D415 R416	P412-Q414 PolarHBondContact O-N 2.91Å; P412-D415 HydrophobicContact CG-CB 4.39Å; P412-D415 WeakPolarHBondContact CG-OD2 3.23Å; P412-D415 PolarHBondContact O-N 3.4Å; P412-R416 WeakPolarHBondContact O-CG 3.28Å; P412-R416 PolarHBondContact O-N 3.34Å
413	E	63.7	Low	73.2	Confident	134 Å²	134	68.7 Å²	68.7	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-54.1	-28.7	-169.7	-69.9	-168.6	159.6	0	0	115.3
414	Q	64.8	Low	73.5	Confident	176 Å²	176	65.8 Å²	65.8	82%	0.822	35%	0.349	S	S	*	.	H	α-helix	trans	-72.1	-31.1	-179.4	-156.5	163.4	1.9	0	0	112.6	P412	P412-Q414 PolarHBondContact O-N 2.91Å
415	D	71.9	Confident	73.7	Confident	86 Å²	86	68.3 Å²	68.3	46%	0.46	36%	0.364	S	S	.	.	H	α-helix	trans	-97.3	-12.1	-177.6	-60.7	-32.3	0	0	0	112.9	P412 N417 S418 C419	P412-D415 HydrophobicContact CG-CB 4.39Å; P412-D415 WeakPolarHBondContact CG-OD2 3.23Å; P412-D415 PolarHBondContact O-N 3.4Å; D415-N417 PolarHBondContact O-N 3.06Å; D415-S418 PolarHBondContact O-N 3.2Å; D415-C419 WeakPolarHBondContact O-CB 3.22Å; D415-C419 PolarHBondContact O-N 3.11Å
416	R	73.6	Confident	74	Confident	45 Å²	45	71.2 Å²	71.2	17%	0.17	38%	0.378	C	S	.	.	H	α-helix	trans	-60.2	-45.2	-179.5	-74	-175.2	-174.3	165.6	2.1	112.3	N386 C409 L411 P412 S418 C419 F420	N386-R416 VanDerWaalsContact OD1-CB 3.31Å; N386-R416 WeakPolarHBondContact OD1-CB 3.49Å; C409-R416 PolarHBondContact O-NH2 2.05Å; C409-R416 VanDerWaalsContact O-NH2 3.17Å; L411-R416 HydrophobicContact CB-CG 4.37Å; L411-R416 VanDerWaalsContact O-CZ 3.29Å; L411-R416 PolarHBondContact O-NE 2.78Å; L411-R416 PolarHBondContact O-NH2 3.43Å; P412-R416 WeakPolarHBondContact O-CG 3.28Å; P412-R416 PolarHBondContact O-N 3.34Å; R416-S418 PolarHBondContact O-N 2.95Å; R416-C419 WeakPolarHBondContact O-CB 3.04Å; R416-C419 PolarHBondContact O-N 2.75Å; R416-F420 HydrophobicContact CB-CD2 4.3Å; R416-F420 HydrophobicContact CB-CE2 3.95Å; R416-F420 WeakPolarHBondContact O-CD2 3.28Å; R416-F420 WeakPolarHBondContact O-CG 3.46Å; R416-F420 PolarHBondContact O-N 3.32Å
417	N	69.6	Low	74	Confident	81 Å²	81	68 Å²	68	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-45.2	-177.5	-70.1	-18.2	0	0	0	111.4	N386 D415 C419 F420 E421	N386-N417 PolarHBondContact OD1-OD1 3.43Å; D415-N417 PolarHBondContact O-N 3.06Å; N417-C419 PolarHBondContact O-N 3.02Å; N417-F420 PolarHBondContact O-N 3.1Å; N417-E421 PolarHBondContact O-N 3.38Å; N417-E421 VanDerWaalsContact O-N 3.08Å
418	S	75.2	Confident	73.8	Confident	66 Å²	66	64.2 Å²	64.2	46%	0.462	34%	0.341	S	S	.	.	H	α-helix	trans	-63	-40.9	175.6	-50.4	0	0	0	0	111.8	D415 R416 F420 E421 L422	D415-S418 PolarHBondContact O-N 3.2Å; R416-S418 PolarHBondContact O-N 2.95Å; S418-F420 PolarHBondContact O-N 3.48Å; S418-E421 PolarHBondContact O-N 2.76Å; S418-L422 WeakPolarHBondContact O-CG 3.47Å; S418-L422 PolarHBondContact O-N 3.33Å; S418-L422 VanDerWaalsContact O-N 3.09Å
419	C	79.9	Confident	73.6	Confident	16 Å²	16	69.1 Å²	69.1	11%	0.108	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-42.2	174.5	-179.6	0	0	0	0	112.2	C408 L411 D415 R416 N417 N423	C408-C419 WeakPolarHBondContact CA-SG 3.38Å; C408-C419 HydrophobicContact CB-CB 3.77Å; C408-C419 WeakPolarHBondContact CB-SG 3.35Å; C408-C419 WeakPolarHBondContact SG-CB 3.38Å; C408-C419 PolarHBondContact SG-O 3.01Å; C408-C419 VanDerWaalsContact SG-O 3.33Å; C408-C419 CovalentContact SG-SG 2.05Å; C408-C419 PolarHBondContact SG-SG 3.12Å; L411-C419 HydrophobicContact CD1-CB 3.71Å; D415-C419 WeakPolarHBondContact O-CB 3.22Å; D415-C419 PolarHBondContact O-N 3.11Å; R416-C419 WeakPolarHBondContact O-CB 3.04Å; R416-C419 PolarHBondContact O-N 2.75Å; N417-C419 PolarHBondContact O-N 3.02Å; C419-N423 VanDerWaalsContact O-CB 3.32Å; C419-N423 WeakPolarHBondContact O-CB 3.14Å; C419-N423 PolarHBondContact O-N 3.31Å; C419-N423 PolarHBondContact O-ND2 2.87Å; C419-N423 PolarHBondContact SG-ND2 3.1Å
420	F	74.6	Confident	73.4	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.009	38%	0.377	C	S	.	.	H	α-helix	trans	-66.4	-39.3	179.8	-72.8	-60.1	0	0	0	112.3	L385 L404 C408 R416 N417 S418 L424	L385-F420 HydrophobicContact CB-CD2 3.7Å; L385-F420 HydrophobicContact CB-CE2 3.98Å; L385-F420 HydrophobicContact CB-CG 4.17Å; L385-F420 HydrophobicContact CD2-CB 3.43Å; L385-F420 VanDerWaalsContact CD2-CB 3.43Å; L385-F420 HydrophobicContact CD2-CD1 3.9Å; L385-F420 HydrophobicContact CD2-CD2 3.95Å; L385-F420 HydrophobicContact CD2-CG 3.51Å; L385-F420 HydrophobicContact CG-CD2 4.48Å; L385-F420 HydrophobicContact CG-CG 4.48Å; L404-F420 HydrophobicContact CB-CD1 4.06Å; L404-F420 HydrophobicContact CB-CE1 4.09Å; L404-F420 HydrophobicContact CD2-CD1 4.25Å; C408-F420 HydrophobicContact CB-CD1 3.8Å; C408-F420 HydrophobicContact CB-CE1 3.59Å; C408-F420 HydrophobicContact CB-CE2 4.38Å; C408-F420 HydrophobicContact CB-CG 4.27Å; C408-F420 HydrophobicContact CB-CZ 3.9Å; R416-F420 HydrophobicContact CB-CD2 4.3Å; R416-F420 HydrophobicContact CB-CE2 3.95Å; R416-F420 WeakPolarHBondContact O-CD2 3.28Å; R416-F420 WeakPolarHBondContact O-CG 3.46Å; R416-F420 PolarHBondContact O-N 3.32Å; N417-F420 PolarHBondContact O-N 3.1Å; S418-F420 PolarHBondContact O-N 3.48Å; F420-L424 WeakPolarHBondContact O-CB 3.06Å; F420-L424 WeakPolarHBondContact O-CD1 3.4Å; F420-L424 WeakPolarHBondContact O-CG 3.36Å; F420-L424 PolarHBondContact O-N 3.02Å
421	E	73.1	Confident	72.9	Confident	139 Å²	139	68 Å²	68	65%	0.65	35%	0.349	S	S	*	.	H	α-helix	trans	-65.2	-48	176.7	-73.6	-175.9	171.1	0	0	111.8	N417 S418 L424 V425	N417-E421 PolarHBondContact O-N 3.38Å; N417-E421 VanDerWaalsContact O-N 3.08Å; S418-E421 PolarHBondContact O-N 2.76Å; E421-L424 PolarHBondContact O-N 3.01Å; E421-V425 VanDerWaalsContact O-CG2 3.24Å; E421-V425 WeakPolarHBondContact O-CG2 3.48Å; E421-V425 PolarHBondContact O-N 3.27Å; E421-V425 VanDerWaalsContact O-N 3.17Å
422	L	77.3	Confident	72.7	Confident	123 Å²	123	67.1 Å²	67.1	64%	0.644	35%	0.348	S	S	*	.	H	α-helix	trans	-63.1	-46	179.2	-69.9	171.7	0	0	0	112.1	S418 L424 V425 E426	S418-L422 WeakPolarHBondContact O-CG 3.47Å; S418-L422 PolarHBondContact O-N 3.33Å; S418-L422 VanDerWaalsContact O-N 3.09Å; L422-L424 PolarHBondContact O-N 3.26Å; L422-V425 WeakPolarHBondContact O-CB 3.43Å; L422-V425 PolarHBondContact O-N 3.11Å; L422-E426 PolarHBondContact O-N 3.27Å; L422-E426 VanDerWaalsContact O-N 3.09Å
423	N	75.3	Confident	72.7	Confident	22 Å²	22	68.5 Å²	68.5	12%	0.118	36%	0.359	C	S	.	.	H	α-helix	trans	-72.4	-27.4	178.9	-76.9	-42.6	0	0	0	112.7	L404 Q407 C408 C419 V425 M427	L404-N423 HydrophobicContact CD2-CB 3.49Å; L404-N423 VanDerWaalsContact CD2-CB 3.49Å; Q407-N423 PolarHBondContact OE1-OD1 3.2Å; C408-N423 PolarHBondContact SG-ND2 3.12Å; C419-N423 VanDerWaalsContact O-CB 3.32Å; C419-N423 WeakPolarHBondContact O-CB 3.14Å; C419-N423 PolarHBondContact O-N 3.31Å; C419-N423 PolarHBondContact O-ND2 2.87Å; C419-N423 PolarHBondContact SG-ND2 3.1Å; N423-V425 VanDerWaalsContact C-N 3.32Å; N423-M427 WeakPolarHBondContact O-CB 3.49Å; N423-M427 WeakPolarHBondContact O-CG 3.44Å; N423-M427 PolarHBondContact O-N 3.46Å
424	L	74	Confident	72.8	Confident	19 Å²	19	64 Å²	64	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-64.8	-38.9	172.2	-85.8	168	0	0	0	111.5	L385 V400 L404 F420 E421 L422 S428	L385-L424 HydrophobicContact CD2-CD1 4.32Å; V400-L424 HydrophobicContact CG1-CD2 4.2Å; L404-L424 HydrophobicContact CD1-CD2 3.72Å; L404-L424 HydrophobicContact CD1-CG 3.97Å; L404-L424 HydrophobicContact CD2-CG 4.27Å; F420-L424 WeakPolarHBondContact O-CB 3.06Å; F420-L424 WeakPolarHBondContact O-CD1 3.4Å; F420-L424 WeakPolarHBondContact O-CG 3.36Å; F420-L424 PolarHBondContact O-N 3.02Å; E421-L424 PolarHBondContact O-N 3.01Å; L422-L424 PolarHBondContact O-N 3.26Å; L424-S428 VanDerWaalsContact O-CB 3.3Å; L424-S428 WeakPolarHBondContact O-CB 3.43Å; L424-S428 PolarHBondContact O-N 3.48Å; L424-S428 PolarHBondContact O-OG 2.78Å
425	V	74.9	Confident	72.4	Confident	53 Å²	53	64.1 Å²	64.1	32%	0.321	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-54.9	175.2	173.4	0	0	0	0	109.9	E421 L422 N423 M427 S428 Q429	E421-V425 VanDerWaalsContact O-CG2 3.24Å; E421-V425 WeakPolarHBondContact O-CG2 3.48Å; E421-V425 PolarHBondContact O-N 3.27Å; E421-V425 VanDerWaalsContact O-N 3.17Å; L422-V425 WeakPolarHBondContact O-CB 3.43Å; L422-V425 PolarHBondContact O-N 3.11Å; N423-V425 VanDerWaalsContact C-N 3.32Å; V425-M427 PolarHBondContact O-N 3.11Å; V425-S428 PolarHBondContact O-N 2.83Å; V425-S428 PolarHBondContact O-OG 3.27Å; V425-Q429 PolarHBondContact O-N 3.29Å
426	E	76.1	Confident	71.7	Confident	100 Å²	100	67.8 Å²	67.8	47%	0.467	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-44.9	-178.3	-171.4	176.2	174.9	0	0	112.2	L422 S428 Q429 I430	L422-E426 PolarHBondContact O-N 3.27Å; L422-E426 VanDerWaalsContact O-N 3.09Å; E426-S428 VanDerWaalsContact C-N 3.34Å; E426-S428 PolarHBondContact O-N 2.83Å; E426-Q429 PolarHBondContact O-N 3.03Å; E426-I430 HydrophobicContact CG-CD1 3.95Å; E426-I430 WeakPolarHBondContact O-CG1 3.43Å; E426-I430 PolarHBondContact O-N 2.86Å; E426-I430 VanDerWaalsContact O-N 3.13Å
427	M	69.8	Low	70.7	Confident	11 Å²	11	70.9 Å²	70.9	5%	0.054	39%	0.39	C	S	.	.	H	α-helix	trans	-67.2	-32.8	179	-69.8	-66.2	128.9	0	0	112.9	Q403 N423 V425 Q429 I430 L431	Q403-M427 HydrophobicContact CB-SD 4.41Å; Q403-M427 PolarHBondContact OE1-SD 3.49Å; N423-M427 WeakPolarHBondContact O-CB 3.49Å; N423-M427 WeakPolarHBondContact O-CG 3.44Å; N423-M427 PolarHBondContact O-N 3.46Å; V425-M427 PolarHBondContact O-N 3.11Å; M427-Q429 VanDerWaalsContact C-N 3.29Å; M427-Q429 PolarHBondContact O-N 3.12Å; M427-I430 HydrophobicContact CE-CD1 4.06Å; M427-I430 PolarHBondContact O-N 3.27Å; M427-L431 HydrophobicContact CB-CD1 4.36Å; M427-L431 VanDerWaalsContact O-CB 3.25Å; M427-L431 WeakPolarHBondContact O-CB 3.42Å; M427-L431 WeakPolarHBondContact O-CD1 3.49Å; M427-L431 WeakPolarHBondContact O-CG 3.34Å; M427-L431 PolarHBondContact O-N 3.04Å
428	S	71.5	Confident	70.3	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.014	38%	0.376	C	S	.	.	H	α-helix	trans	-64.8	-34.8	176.2	73.1	0	0	0	0	112.2	L424 V425 E426 C432 H451	L424-S428 VanDerWaalsContact O-CB 3.3Å; L424-S428 WeakPolarHBondContact O-CB 3.43Å; L424-S428 PolarHBondContact O-N 3.48Å; L424-S428 PolarHBondContact O-OG 2.78Å; V425-S428 PolarHBondContact O-N 2.83Å; V425-S428 PolarHBondContact O-OG 3.27Å; E426-S428 VanDerWaalsContact C-N 3.34Å; E426-S428 PolarHBondContact O-N 2.83Å; S428-C432 PolarHBondContact O-N 2.93Å; S428-C432 PolarHBondContact O-SG 2.99Å; S428-C432 VanDerWaalsContact O-SG 3.39Å; S428-H451 PolarHBondContact OG-CE1 3.45Å
429	Q	73.3	Confident	69.9	Low	103 Å²	103	66.5 Å²	66.5	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-72.6	-45.4	176.9	-63.2	-178.4	-3	0	0	111.4	V425 E426 M427 S433 H451	V425-Q429 PolarHBondContact O-N 3.29Å; E426-Q429 PolarHBondContact O-N 3.03Å; M427-Q429 VanDerWaalsContact C-N 3.29Å; M427-Q429 PolarHBondContact O-N 3.12Å; Q429-S433 VanDerWaalsContact O-CB 3.29Å; Q429-S433 WeakPolarHBondContact O-CB 3.41Å; Q429-S433 PolarHBondContact O-N 3.37Å; Q429-S433 PolarHBondContact O-OG 2.91Å; Q429-H451 WeakPolarHBondContact CG-CE1 3.36Å; Q429-H451 PolarHBondContact NE2-NE2 2.75Å
430	I	73.2	Confident	69.5	Low	87 Å²	87	71 Å²	71	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-67.5	-40.4	-178.2	-65	168.7	0	0	0	111.6	E426 M427 S434	E426-I430 HydrophobicContact CG-CD1 3.95Å; E426-I430 WeakPolarHBondContact O-CG1 3.43Å; E426-I430 PolarHBondContact O-N 2.86Å; E426-I430 VanDerWaalsContact O-N 3.13Å; M427-I430 HydrophobicContact CE-CD1 4.06Å; M427-I430 PolarHBondContact O-N 3.27Å; I430-S434 WeakPolarHBondContact O-CB 3.4Å; I430-S434 PolarHBondContact O-N 3.36Å
431	L	69.4	Low	69.3	Low	20 Å²	20	73.1 Å²	73.1	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-74.5	-35.5	-175.3	-71.9	167.3	0	0	0	113.5	V400 M427 H438 V442	V400-L431 HydrophobicContact CB-CD1 4.35Å; V400-L431 HydrophobicContact CG2-CD1 3.19Å; M427-L431 HydrophobicContact CB-CD1 4.36Å; M427-L431 VanDerWaalsContact O-CB 3.25Å; M427-L431 WeakPolarHBondContact O-CB 3.42Å; M427-L431 WeakPolarHBondContact O-CD1 3.49Å; M427-L431 WeakPolarHBondContact O-CG 3.34Å; M427-L431 PolarHBondContact O-N 3.04Å; L431-H438 PolarHBondContact O-CD2 3.2Å; L431-H438 PolarHBondContact O-NE2 2.88Å; L431-V442 HydrophobicContact CB-CG1 4.23Å
432	C	73.4	Confident	69.2	Low	48 Å²	48	66.6 Å²	66.6	32%	0.324	37%	0.374	S	S	.	.	H	α-helix	trans	-82.4	-18.9	178.4	-58.8	0	0	0	0	113	S428 C446	S428-C432 PolarHBondContact O-N 2.93Å; S428-C432 PolarHBondContact O-SG 2.99Å; S428-C432 VanDerWaalsContact O-SG 3.39Å; C432-C446 WeakPolarHBondContact CA-SG 3.28Å; C432-C446 HydrophobicContact CB-CB 3.7Å; C432-C446 WeakPolarHBondContact CB-SG 3.29Å; C432-C446 VanDerWaalsContact SG-CA 3.52Å; C432-C446 WeakPolarHBondContact SG-CB 3.46Å; C432-C446 CovalentContact SG-SG 2.04Å; C432-C446 PolarHBondContact SG-SG 3.27Å
433	S	72.6	Confident	69.1	Low	105 Å²	105	67.6 Å²	67.6	73%	0.734	37%	0.369	S	S	*	.	H	α-helix	trans	-87.2	-17.4	174.8	-53.2	0	0	0	0	113.4	Q429	Q429-S433 VanDerWaalsContact O-CB 3.29Å; Q429-S433 WeakPolarHBondContact O-CB 3.41Å; Q429-S433 PolarHBondContact O-N 3.37Å; Q429-S433 PolarHBondContact O-OG 2.91Å
434	S	65.5	Low	69.2	Low	40 Å²	40	76 Å²	76	28%	0.28	40%	0.399	S	S	.	.			trans	-89.1	124.1	-177.5	162.8	0	0	0	0	112	I430 K436 H438	I430-S434 WeakPolarHBondContact O-CB 3.4Å; I430-S434 PolarHBondContact O-N 3.36Å; S434-K436 PolarHBondContact O-N 3.5Å; S434-H438 PolarHBondContact O-NE2 3.27Å
435	N	56	Low	69.4	Low	178 Å²	178	75.2 Å²	75.2	95%	0.952	40%	0.395	S	S	*	.			trans	-74.5	14.9	179	-115.8	-9.8	0	0	0	114.7
436	K	58.2	Low	69.6	Low	163 Å²	163	74.5 Å²	74.5	71%	0.709	39%	0.392	S	S	*	.	S	Bend	trans	-80.4	160.8	-176.3	-67.7	-176.1	179.8	178.9	0	112.3	S434 H438	S434-K436 PolarHBondContact O-N 3.5Å; K436-H438 VanDerWaalsContact C-N 3.29Å; K436-H438 PolarHBondContact O-CD2 2.83Å; K436-H438 PolarHBondContact O-N 3.36Å; K436-H438 PolarHBondContact O-NE2 3.22Å
437	S	51.5	Low	69.6	Low	111 Å²	111	78.1 Å²	78.1	78%	0.776	41%	0.406	S	S	*	.			trans	-70.1	79.5	-177.2	61.7	0	0	0	0	112.4
438	H	62.2	Low	70	Confident	29 Å²	29	81.2 Å²	81.2	13%	0.134	42%	0.421	C	S	.	.			trans	-73.2	157	179.4	-59.1	-65.1	0	0	0	112.5	L431 S434 K436 V442 R443	L431-H438 PolarHBondContact O-CD2 3.2Å; L431-H438 PolarHBondContact O-NE2 2.88Å; S434-H438 PolarHBondContact O-NE2 3.27Å; K436-H438 VanDerWaalsContact C-N 3.29Å; K436-H438 PolarHBondContact O-CD2 2.83Å; K436-H438 PolarHBondContact O-N 3.36Å; K436-H438 PolarHBondContact O-NE2 3.22Å; H438-V442 HydrophobicContact CB-CB 3.9Å; H438-V442 HydrophobicContact CB-CG1 3.78Å; H438-R443 HydrophobicContact CB-CG 4.36Å; H438-R443 PolarHBondContact O-NE 3.26Å
439	S	65.8	Low	69.7	Low	26 Å²	26	87.6 Å²	87.6	18%	0.182	46%	0.46	C	S	.	.			trans	-57.1	153	175	81.9	0	0	0	0	111.2	V441 V442 R443	S439-V441 PolarHBondContact O-N 2.89Å; S439-V442 PolarHBondContact O-N 3.04Å; S439-R443 PolarHBondContact O-N 2.03Å; S439-R443 VanDerWaalsContact O-N 3.16Å
440	P	72	Confident	69.9	Low	109 Å²	109	87.5 Å²	87.5	71%	0.708	46%	0.462	S	S	*	.	H	α-helix	trans	-56.5	-24.5	-178.3	-25.1	33.1	0	0	0	114.3	R444	P440-R444 PolarHBondContact O-N 2.89Å
441	V	69.9	Low	69.7	Low	48 Å²	48	86.6 Å²	86.6	29%	0.291	46%	0.456	S	S	.	.	H	α-helix	trans	-73.1	-46.2	178.6	178.7	0	0	0	0	110.9	L398 S439 R444 C445 N461	L398-V441 HydrophobicContact CD1-CB 4.27Å; L398-V441 HydrophobicContact CD1-CG1 4.22Å; S439-V441 PolarHBondContact O-N 2.89Å; V441-R444 PolarHBondContact O-N 3.42Å; V441-R444 VanDerWaalsContact O-N 3.13Å; V441-C445 PolarHBondContact O-N 2.85Å; V441-C445 VanDerWaalsContact O-N 3.1Å; V441-N461 HydrophobicContact CG1-CB 3.62Å
442	V	71.7	Confident	69.9	Low	1 Å²	1	92.4 Å²	92.4	1%	0.006	48%	0.483	C	S	.	.	H	α-helix	trans	-65	-42.6	178.8	175.6	0	0	0	0	110.1	V400 L431 H438 S439 R444 C445 C446 L458	V400-V442 HydrophobicContact CG2-CG2 4.35Å; L431-V442 HydrophobicContact CB-CG1 4.23Å; H438-V442 HydrophobicContact CB-CB 3.9Å; H438-V442 HydrophobicContact CB-CG1 3.78Å; S439-V442 PolarHBondContact O-N 3.04Å; V442-R444 PolarHBondContact O-N 3.34Å; V442-C445 PolarHBondContact O-N 2.85Å; V442-C446 WeakPolarHBondContact O-CB 3.41Å; V442-C446 PolarHBondContact O-N 3.38Å; V442-C446 PolarHBondContact O-SG 3.47Å; V442-C446 VanDerWaalsContact O-SG 3.34Å; V442-L458 HydrophobicContact CG2-CD2 4.3Å
443	R	75.3	Confident	70	Confident	145 Å²	145	94 Å²	94	55%	0.547	49%	0.486	S	S	.	.	H	α-helix	trans	-60.4	-27	174	-65.9	-174.1	-167.4	179.9	-0.5	113.9	H438 S439 K447	H438-R443 HydrophobicContact CB-CG 4.36Å; H438-R443 PolarHBondContact O-NE 3.26Å; S439-R443 PolarHBondContact O-N 2.03Å; S439-R443 VanDerWaalsContact O-N 3.16Å; R443-K447 WeakPolarHBondContact O-CG 3.35Å
444	R	77.9	Confident	70.2	Confident	199 Å²	199	89.9 Å²	89.9	75%	0.751	46%	0.455	S	S	*	.	H	α-helix	trans	-80.6	-38.4	177.6	-172	-179.9	-72.8	-166.1	-4.9	111.4	P440 V441 V442	P440-R444 PolarHBondContact O-N 2.89Å; V441-R444 PolarHBondContact O-N 3.42Å; V441-R444 VanDerWaalsContact O-N 3.13Å; V442-R444 PolarHBondContact O-N 3.34Å
445	C	77.3	Confident	70.5	Confident	1 Å²	1	90.2 Å²	90.2	1%	0.007	45%	0.452	C	S	.	.	H	α-helix	trans	-73.2	-39.2	177.5	-64.3	0	0	0	0	112.2	V441 V442 K447 M448 C457 L458	V441-C445 PolarHBondContact O-N 2.85Å; V441-C445 VanDerWaalsContact O-N 3.1Å; V442-C445 PolarHBondContact O-N 2.85Å; C445-K447 PolarHBondContact O-N 3.24Å; C445-K447 VanDerWaalsContact O-N 3.09Å; C445-M448 WeakPolarHBondContact O-CB 3.4Å; C445-M448 PolarHBondContact O-N 3.01Å; C445-M448 VanDerWaalsContact O-N 3.13Å; C445-C457 WeakPolarHBondContact CA-SG 3.45Å; C445-C457 HydrophobicContact CB-CB 3.67Å; C445-C457 WeakPolarHBondContact CB-SG 3.14Å; C445-C457 WeakPolarHBondContact SG-CB 3.44Å; C445-C457 CovalentContact SG-SG 2.05Å; C445-C457 PolarHBondContact SG-SG 2.81Å; C445-L458 HydrophobicContact CB-CD2 3.99Å; C445-L458 HydrophobicContact CB-CG 4.06Å
446	C	78.7	Confident	71.6	Confident	38 Å²	38	88.1 Å²	88.1	26%	0.257	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.6	178	-63.7	0	0	0	0	114.8	C432 V442 M448	C432-C446 WeakPolarHBondContact CA-SG 3.28Å; C432-C446 HydrophobicContact CB-CB 3.7Å; C432-C446 WeakPolarHBondContact CB-SG 3.29Å; C432-C446 VanDerWaalsContact SG-CA 3.52Å; C432-C446 WeakPolarHBondContact SG-CB 3.46Å; C432-C446 CovalentContact SG-SG 2.04Å; C432-C446 PolarHBondContact SG-SG 3.27Å; V442-C446 WeakPolarHBondContact O-CB 3.41Å; V442-C446 PolarHBondContact O-N 3.38Å; V442-C446 PolarHBondContact O-SG 3.47Å; V442-C446 VanDerWaalsContact O-SG 3.34Å; C446-M448 VanDerWaalsContact C-N 3.32Å
447	K	77.5	Confident	72.6	Confident	176 Å²	176	81.3 Å²	81.3	77%	0.765	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.8	170.7	-76.9	177.4	-179.7	-161.6	0	112.9	R443 C445	R443-K447 WeakPolarHBondContact O-CG 3.35Å; C445-K447 PolarHBondContact O-N 3.24Å; C445-K447 VanDerWaalsContact O-N 3.09Å
448	M	76.3	Confident	73.8	Confident	77 Å²	77	76.1 Å²	76.1	38%	0.379	37%	0.373	S	S	.	.			trans	-75.9	147	176.1	-67.2	166.9	153.3	0	0	109.6	C445 C446 E453 I454 C457	C445-M448 WeakPolarHBondContact O-CB 3.4Å; C445-M448 PolarHBondContact O-N 3.01Å; C445-M448 VanDerWaalsContact O-N 3.13Å; C446-M448 VanDerWaalsContact C-N 3.32Å; M448-E453 HydrophobicContact CB-CB 4.28Å; M448-E453 HydrophobicContact SD-CB 4.04Å; M448-I454 HydrophobicContact CB-CG1 3.79Å; M448-I454 WeakPolarHBondContact O-CD1 3.07Å; M448-C457 HydrophobicContact CE-CB 4.36Å; M448-C457 HydrophobicContact SD-CB 3.72Å
449	T	66.3	Low	74.5	Confident	136 Å²	136	76.6 Å²	76.6	83%	0.834	38%	0.38	S	S	*	.	S	Bend	trans	-91.8	-24.4	-173.5	48.6	0	0	0	0	112.9
450	L	77.1	Confident	75.1	Confident	100 Å²	100	83 Å²	83	52%	0.524	40%	0.404	S	S	.	.	S	Bend	trans	-98.1	132.5	-179	-75.3	161.6	0	0	0	111.3	E452 E453 I454	L450-E452 VanDerWaalsContact C-N 3.31Å; L450-E452 PolarHBondContact O-N 3.08Å; L450-E453 HydrophobicContact CB-CB 4.24Å; L450-E453 HydrophobicContact CB-CG 3.9Å; L450-E453 HydrophobicContact CD1-CG 4.36Å; L450-E453 PolarHBondContact O-N 3.31Å; L450-I454 WeakPolarHBondContact O-CG1 3.38Å; L450-I454 PolarHBondContact O-N 3Å; L450-I454 VanDerWaalsContact O-N 3.13Å
451	H	68.5	Low	75.3	Confident	69 Å²	69	79.9 Å²	79.9	32%	0.319	38%	0.381	S	S	.	.	H	α-helix	trans	-59.8	-40.5	-177.9	-167.5	55.2	0	0	0	112.6	S428 Q429 E453 I454 Q455	S428-H451 PolarHBondContact OG-CE1 3.45Å; Q429-H451 WeakPolarHBondContact CG-CE1 3.36Å; Q429-H451 PolarHBondContact NE2-NE2 2.75Å; H451-E453 VanDerWaalsContact C-N 3.35Å; H451-E453 PolarHBondContact O-N 3.06Å; H451-I454 PolarHBondContact O-N 3.27Å; H451-Q455 PolarHBondContact CD2-NE2 2.94Å; H451-Q455 VanDerWaalsContact CD2-NE2 3.34Å; H451-Q455 PolarHBondContact NE2-NE2 3.45Å; H451-Q455 WeakPolarHBondContact O-CG 3.06Å; H451-Q455 PolarHBondContact O-N 2.92Å
452	E	73.5	Confident	75.5	Confident	141 Å²	141	77.7 Å²	77.7	66%	0.659	37%	0.368	S	S	*	.	H	α-helix	trans	-63	-38.6	177.5	-67.1	179.6	175.9	0	0	112.5	L450 Q455 Q456	L450-E452 VanDerWaalsContact C-N 3.31Å; L450-E452 PolarHBondContact O-N 3.08Å; E452-Q455 PolarHBondContact O-N 2.99Å; E452-Q456 WeakPolarHBondContact O-CB 3.2Å; E452-Q456 VanDerWaalsContact O-CG 3.29Å; E452-Q456 WeakPolarHBondContact O-CG 3.21Å; E452-Q456 PolarHBondContact O-N 3.43Å
453	E	76.8	Confident	75.5	Confident	83 Å²	83	80.2 Å²	80.2	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-70	-37.2	178	-65	-174.7	160	0	0	111.8	M448 L450 H451 Q456 C457	M448-E453 HydrophobicContact CB-CB 4.28Å; M448-E453 HydrophobicContact SD-CB 4.04Å; L450-E453 HydrophobicContact CB-CB 4.24Å; L450-E453 HydrophobicContact CB-CG 3.9Å; L450-E453 HydrophobicContact CD1-CG 4.36Å; L450-E453 PolarHBondContact O-N 3.31Å; H451-E453 VanDerWaalsContact C-N 3.35Å; H451-E453 PolarHBondContact O-N 3.06Å; E453-Q456 PolarHBondContact O-N 3.24Å; E453-C457 WeakPolarHBondContact O-CB 3.39Å; E453-C457 PolarHBondContact O-N 3.33Å
454	I	75.8	Confident	75.4	Confident	17 Å²	17	80.1 Å²	80.1	9%	0.087	38%	0.384	C	S	.	.	H	α-helix	trans	-61.6	-46.8	174.3	-61.9	167.9	0	0	0	109.6	M448 L450 H451 C457 L458	M448-I454 HydrophobicContact CB-CG1 3.79Å; M448-I454 WeakPolarHBondContact O-CD1 3.07Å; L450-I454 WeakPolarHBondContact O-CG1 3.38Å; L450-I454 PolarHBondContact O-N 3Å; L450-I454 VanDerWaalsContact O-N 3.13Å; H451-I454 PolarHBondContact O-N 3.27Å; I454-C457 PolarHBondContact O-N 2.76Å; I454-L458 HydrophobicContact CG2-CD1 4.06Å; I454-L458 WeakPolarHBondContact O-CG 3.44Å; I454-L458 PolarHBondContact O-N 3.44Å
455	Q	73.1	Confident	75.1	Confident	47 Å²	47	72 Å²	72	22%	0.22	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-48.3	177.3	-72.6	-178.6	-4	0	0	112	H451 E452 C457 L458 S459	H451-Q455 PolarHBondContact CD2-NE2 2.94Å; H451-Q455 VanDerWaalsContact CD2-NE2 3.34Å; H451-Q455 PolarHBondContact NE2-NE2 3.45Å; H451-Q455 WeakPolarHBondContact O-CG 3.06Å; H451-Q455 PolarHBondContact O-N 2.92Å; E452-Q455 PolarHBondContact O-N 2.99Å; Q455-C457 VanDerWaalsContact C-N 3.32Å; Q455-C457 PolarHBondContact O-N 2.99Å; Q455-L458 PolarHBondContact O-N 2.95Å; Q455-S459 VanDerWaalsContact O-CB 3.27Å; Q455-S459 WeakPolarHBondContact O-CB 3.23Å; Q455-S459 PolarHBondContact O-N 3.38Å
456	Q	77.5	Confident	74.7	Confident	134 Å²	134	71.9 Å²	71.9	63%	0.626	36%	0.359	S	S	*	.	H	α-helix	trans	-62.3	-38.8	177.2	-72.6	178.2	11.7	0	0	111.9	E452 E453 K460	E452-Q456 WeakPolarHBondContact O-CB 3.2Å; E452-Q456 VanDerWaalsContact O-CG 3.29Å; E452-Q456 WeakPolarHBondContact O-CG 3.21Å; E452-Q456 PolarHBondContact O-N 3.43Å; E453-Q456 PolarHBondContact O-N 3.24Å; Q456-K460 WeakPolarHBondContact O-CB 3.49Å; Q456-K460 PolarHBondContact O-N 2.79Å
457	C	80.6	Confident	74.2	Confident	20 Å²	20	71.6 Å²	71.6	14%	0.135	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-46.3	176.2	-176.3	0	0	0	0	111.7	C445 M448 E453 I454 Q455 N461	C445-C457 WeakPolarHBondContact CA-SG 3.45Å; C445-C457 HydrophobicContact CB-CB 3.67Å; C445-C457 WeakPolarHBondContact CB-SG 3.14Å; C445-C457 WeakPolarHBondContact SG-CB 3.44Å; C445-C457 CovalentContact SG-SG 2.05Å; C445-C457 PolarHBondContact SG-SG 2.81Å; M448-C457 HydrophobicContact CE-CB 4.36Å; M448-C457 HydrophobicContact SD-CB 3.72Å; E453-C457 WeakPolarHBondContact O-CB 3.39Å; E453-C457 PolarHBondContact O-N 3.33Å; I454-C457 PolarHBondContact O-N 2.76Å; Q455-C457 VanDerWaalsContact C-N 3.32Å; Q455-C457 PolarHBondContact O-N 2.99Å; C457-N461 WeakPolarHBondContact O-CB 3.5Å; C457-N461 PolarHBondContact O-N 3.39Å; C457-N461 VanDerWaalsContact O-N 3.1Å; C457-N461 PolarHBondContact O-ND2 3.28Å
458	L	76.3	Confident	73.7	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-49.1	178.2	-71.7	172.4	0	0	0	111	V400 V442 C445 I454 Q455 K460 N461 V462	V400-L458 HydrophobicContact CG2-CD2 4.46Å; V442-L458 HydrophobicContact CG2-CD2 4.3Å; C445-L458 HydrophobicContact CB-CD2 3.99Å; C445-L458 HydrophobicContact CB-CG 4.06Å; I454-L458 HydrophobicContact CG2-CD1 4.06Å; I454-L458 WeakPolarHBondContact O-CG 3.44Å; I454-L458 PolarHBondContact O-N 3.44Å; Q455-L458 PolarHBondContact O-N 2.95Å; L458-K460 PolarHBondContact O-N 3.03Å; L458-N461 PolarHBondContact O-N 2.9Å; L458-N461 VanDerWaalsContact O-N 3.09Å; L458-V462 VanDerWaalsContact O-CG2 3.3Å; L458-V462 WeakPolarHBondContact O-CG2 3.3Å; L458-V462 PolarHBondContact O-N 2.66Å
459	S	76.3	Confident	73.1	Confident	39 Å²	39	65.9 Å²	65.9	27%	0.273	33%	0.331	S	S	.	.	H	α-helix	trans	-54.9	-48.8	176.2	175.9	0	0	0	0	111.5	Q455 N461 V462 M463	Q455-S459 VanDerWaalsContact O-CB 3.27Å; Q455-S459 WeakPolarHBondContact O-CB 3.23Å; Q455-S459 PolarHBondContact O-N 3.38Å; S459-N461 VanDerWaalsContact C-N 3.29Å; S459-N461 PolarHBondContact O-N 3.5Å; S459-V462 WeakPolarHBondContact O-CB 3.03Å; S459-V462 PolarHBondContact O-N 2.8Å; S459-M463 WeakPolarHBondContact O-CB 3.47Å; S459-M463 VanDerWaalsContact O-CG 3.24Å; S459-M463 WeakPolarHBondContact O-CG 3.49Å; S459-M463 PolarHBondContact O-N 3.16Å
460	K	78.9	Confident	72.8	Confident	159 Å²	159	61 Å²	61	69%	0.691	30%	0.301	S	S	*	.	H	α-helix	trans	-60.2	-36.9	177.3	-172.6	173.7	-173.5	169.7	0	113	Q456 L458 K464	Q456-K460 WeakPolarHBondContact O-CB 3.49Å; Q456-K460 PolarHBondContact O-N 2.79Å; L458-K460 PolarHBondContact O-N 3.03Å; K460-K464 VanDerWaalsContact O-CB 3.22Å; K460-K464 WeakPolarHBondContact O-CB 3.47Å; K460-K464 PolarHBondContact O-N 3.32Å
461	N	76.4	Confident	71.8	Confident	44 Å²	44	62.3 Å²	62.3	24%	0.235	30%	0.302	C	S	.	.	H	α-helix	trans	-75.9	-36.7	177.7	-79.8	-69.6	0	0	0	112.7	V441 C457 L458 S459 K464 A465	V441-N461 HydrophobicContact CG1-CB 3.62Å; C457-N461 WeakPolarHBondContact O-CB 3.5Å; C457-N461 PolarHBondContact O-N 3.39Å; C457-N461 VanDerWaalsContact O-N 3.1Å; C457-N461 PolarHBondContact O-ND2 3.28Å; L458-N461 PolarHBondContact O-N 2.9Å; L458-N461 VanDerWaalsContact O-N 3.09Å; S459-N461 VanDerWaalsContact C-N 3.29Å; S459-N461 PolarHBondContact O-N 3.5Å; N461-K464 PolarHBondContact O-N 3.22Å; N461-A465 WeakPolarHBondContact O-CB 3.36Å; N461-A465 PolarHBondContact O-N 3.19Å
462	V	74.7	Confident	70.8	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-52.4	170	171.3	0	0	0	0	109.3	M388 L398 V400 L458 S459 K464 A465 I466	M388-V462 HydrophobicContact CE-CG1 4.07Å; M388-V462 HydrophobicContact SD-CG1 3.76Å; L398-V462 HydrophobicContact CD2-CB 4.36Å; L398-V462 HydrophobicContact CD2-CG2 3.41Å; L398-V462 VanDerWaalsContact CD2-CG2 3.41Å; V400-V462 HydrophobicContact CG1-CG2 4.14Å; L458-V462 VanDerWaalsContact O-CG2 3.3Å; L458-V462 WeakPolarHBondContact O-CG2 3.3Å; L458-V462 PolarHBondContact O-N 2.66Å; S459-V462 WeakPolarHBondContact O-CB 3.03Å; S459-V462 PolarHBondContact O-N 2.8Å; V462-K464 VanDerWaalsContact C-N 3.3Å; V462-K464 PolarHBondContact O-N 3.47Å; V462-A465 CarbonylContact O-C 3.53Å; V462-A465 WeakPolarHBondContact O-CA 3.47Å; V462-A465 WeakPolarHBondContact O-CB 3.31Å; V462-A465 PolarHBondContact O-N 3.45Å; V462-I466 HydrophobicContact CG1-CD1 3.89Å; V462-I466 HydrophobicContact CG1-CG1 4.38Å; V462-I466 WeakPolarHBondContact O-CG1 3.44Å; V462-I466 PolarHBondContact O-N 2.85Å
463	M	71.1	Confident	69.4	Low	53 Å²	53	61.8 Å²	61.8	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-39.6	177.6	-68	-61.8	-81.9	0	0	112.4	P383 L385 S459 A465 I466 T467	P383-M463 WeakPolarHBondContact O-CE 3.35Å; L385-M463 HydrophobicContact CD1-CE 4.25Å; L385-M463 HydrophobicContact CD1-SD 3.47Å; L385-M463 WeakPolarHBondContact CD1-SD 3.38Å; L385-M463 HydrophobicContact CG-SD 4.04Å; S459-M463 WeakPolarHBondContact O-CB 3.47Å; S459-M463 VanDerWaalsContact O-CG 3.24Å; S459-M463 WeakPolarHBondContact O-CG 3.49Å; S459-M463 PolarHBondContact O-N 3.16Å; M463-A465 VanDerWaalsContact C-N 3.34Å; M463-A465 PolarHBondContact O-N 3.42Å; M463-I466 PolarHBondContact O-N 2.84Å; M463-I466 HydrophobicContact SD-CD1 3.94Å; M463-T467 VanDerWaalsContact O-CB 3.25Å; M463-T467 WeakPolarHBondContact O-CB 3.47Å; M463-T467 PolarHBondContact O-N 3.5Å; M463-T467 PolarHBondContact O-OG1 3.25Å
464	K	73.4	Confident	68	Low	144 Å²	144	63.2 Å²	63.2	63%	0.626	32%	0.32	S	S	*	.	H	α-helix	trans	-66.2	-35.6	174.2	-171.3	176.5	-177.5	178.6	0	112.4	K460 N461 V462 K468	K460-K464 VanDerWaalsContact O-CB 3.22Å; K460-K464 WeakPolarHBondContact O-CB 3.47Å; K460-K464 PolarHBondContact O-N 3.32Å; N461-K464 PolarHBondContact O-N 3.22Å; V462-K464 VanDerWaalsContact C-N 3.3Å; V462-K464 PolarHBondContact O-N 3.47Å; K464-K468 VanDerWaalsContact O-CB 3.25Å; K464-K468 WeakPolarHBondContact O-CB 3.43Å; K464-K468 PolarHBondContact O-N 3.29Å
465	A	70.5	Confident	66.6	Low	27 Å²	27	71.4 Å²	71.4	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-69.7	-46.1	175.5	0	0	0	0	0	111.5	N461 V462 M463 T467 K468 A469	N461-A465 WeakPolarHBondContact O-CB 3.36Å; N461-A465 PolarHBondContact O-N 3.19Å; V462-A465 CarbonylContact O-C 3.53Å; V462-A465 WeakPolarHBondContact O-CA 3.47Å; V462-A465 WeakPolarHBondContact O-CB 3.31Å; V462-A465 PolarHBondContact O-N 3.45Å; M463-A465 VanDerWaalsContact C-N 3.34Å; M463-A465 PolarHBondContact O-N 3.42Å; A465-T467 PolarHBondContact O-N 2.78Å; A465-K468 PolarHBondContact O-N 2.93Å; A465-K468 VanDerWaalsContact O-N 3.15Å; A465-A469 WeakPolarHBondContact O-CB 3.23Å; A465-A469 PolarHBondContact O-N 2.87Å
466	I	69.4	Low	65.7	Low	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-55.6	-52.9	172	-62.4	166.3	0	0	0	109.2	P383 M388 I394 V462 M463 K468 A469 T470	P383-I466 HydrophobicContact CB-CG2 3.99Å; M388-I466 HydrophobicContact CB-CD1 4.07Å; M388-I466 HydrophobicContact CB-CG1 4.34Å; M388-I466 HydrophobicContact CG-CD1 4.35Å; M388-I466 HydrophobicContact CG-CG1 4.41Å; M388-I466 HydrophobicContact SD-CD1 3.53Å; M388-I466 VanDerWaalsContact SD-CD1 3.53Å; M388-I466 HydrophobicContact SD-CG1 3.83Å; I394-I466 HydrophobicContact CD1-CG1 3.77Å; V462-I466 HydrophobicContact CG1-CD1 3.89Å; V462-I466 HydrophobicContact CG1-CG1 4.38Å; V462-I466 WeakPolarHBondContact O-CG1 3.44Å; V462-I466 PolarHBondContact O-N 2.85Å; M463-I466 PolarHBondContact O-N 2.84Å; M463-I466 HydrophobicContact SD-CD1 3.94Å; I466-K468 PolarHBondContact O-N 2.92Å; I466-A469 PolarHBondContact O-N 3.04Å; I466-T470 HydrophobicContact CG2-CG2 4.24Å; I466-T470 WeakPolarHBondContact O-CG2 3.46Å; I466-T470 PolarHBondContact O-N 3.01Å; I466-T470 PolarHBondContact O-OG1 3.45Å; I466-T470 VanDerWaalsContact O-OG1 3.08Å
467	T	68.2	Low	64.9	Low	32 Å²	32	76.4 Å²	76.4	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-57.4	-36.5	178.5	-54.9	0	0	0	0	112.3	P383 M463 A465 T470 K471	P383-T467 VanDerWaalsContact CG-OG1 3.32Å; P383-T467 WeakPolarHBondContact CG-OG1 3.47Å; M463-T467 VanDerWaalsContact O-CB 3.25Å; M463-T467 WeakPolarHBondContact O-CB 3.47Å; M463-T467 PolarHBondContact O-N 3.5Å; M463-T467 PolarHBondContact O-OG1 3.25Å; A465-T467 PolarHBondContact O-N 2.78Å; T467-T470 WeakPolarHBondContact CA-OG1 3.16Å; T467-T470 PolarHBondContact O-OG1 3.19Å; T467-K471 HydrophobicContact CG2-CD 3.92Å; T467-K471 VanDerWaalsContact CG2-CE 3.45Å; T467-K471 WeakPolarHBondContact O-CB 3.3Å; T467-K471 WeakPolarHBondContact O-CD 2.99Å; T467-K471 WeakPolarHBondContact O-CG 3.35Å; T467-K471 PolarHBondContact O-N 3Å; T467-K471 VanDerWaalsContact O-N 3.13Å
468	K	67.8	Low	64.5	Low	123 Å²	123	81 Å²	81	54%	0.535	39%	0.392	S	S	.	.	H	α-helix	trans	-75.8	-36.5	178.4	-169.7	176.5	-175.7	-180	0	111.3	K464 A465 I466 K472	K464-K468 VanDerWaalsContact O-CB 3.25Å; K464-K468 WeakPolarHBondContact O-CB 3.43Å; K464-K468 PolarHBondContact O-N 3.29Å; A465-K468 PolarHBondContact O-N 2.93Å; A465-K468 VanDerWaalsContact O-N 3.15Å; I466-K468 PolarHBondContact O-N 2.92Å; K468-K472 WeakPolarHBondContact O-CB 3.17Å; K468-K472 PolarHBondContact O-N 2.85Å
469	A	63.5	Low	64.6	Low	10 Å²	10	83.9 Å²	83.9	8%	0.083	41%	0.407	C	S	.	.	H	α-helix	trans	-67.7	-47.7	177	0	0	0	0	0	111.1	I393 I394 A465 I466 K471 K472 G473	I393-A469 HydrophobicContact CB-CB 4.19Å; I393-A469 HydrophobicContact CG2-CB 4.38Å; I394-A469 HydrophobicContact CG1-CB 4.49Å; A465-A469 WeakPolarHBondContact O-CB 3.23Å; A465-A469 PolarHBondContact O-N 2.87Å; I466-A469 PolarHBondContact O-N 3.04Å; A469-K471 VanDerWaalsContact C-N 3.3Å; A469-K471 PolarHBondContact O-N 2.79Å; A469-K472 PolarHBondContact O-N 3.16Å; A469-K472 VanDerWaalsContact O-N 3.16Å; A469-G473 PolarHBondContact O-N 2.84Å
470	T	59.9	Low	64.7	Low	32 Å²	32	83.8 Å²	83.8	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-59.7	-40.5	173.8	57	0	0	0	0	111.4	T391 I466 T467 Q474	T391-T470 HydrophobicContact CG2-CG2 4.23Å; I466-T470 HydrophobicContact CG2-CG2 4.24Å; I466-T470 WeakPolarHBondContact O-CG2 3.46Å; I466-T470 PolarHBondContact O-N 3.01Å; I466-T470 PolarHBondContact O-OG1 3.45Å; I466-T470 VanDerWaalsContact O-OG1 3.08Å; T467-T470 WeakPolarHBondContact CA-OG1 3.16Å; T467-T470 PolarHBondContact O-OG1 3.19Å; T470-Q474 WeakPolarHBondContact O-CG 3.47Å; T470-Q474 PolarHBondContact O-N 3.32Å
471	K	55.3	Low	64.5	Low	128 Å²	128	76.3 Å²	76.3	56%	0.557	37%	0.373	S	S	*	.	H	α-helix	trans	-72.2	-26.2	175.7	-73	173.5	-174.9	171	0	114.9	T467 A469 Q474	T467-K471 HydrophobicContact CG2-CD 3.92Å; T467-K471 VanDerWaalsContact CG2-CE 3.45Å; T467-K471 WeakPolarHBondContact O-CB 3.3Å; T467-K471 WeakPolarHBondContact O-CD 2.99Å; T467-K471 WeakPolarHBondContact O-CG 3.35Å; T467-K471 PolarHBondContact O-N 3Å; T467-K471 VanDerWaalsContact O-N 3.13Å; A469-K471 VanDerWaalsContact C-N 3.3Å; A469-K471 PolarHBondContact O-N 2.79Å; K471-Q474 CarbonylContact O-C 3.57Å; K471-Q474 VanDerWaalsContact O-C 3.32Å; K471-Q474 PolarHBondContact O-N 3.35Å
472	K	48.4	Very low	64.4	Low	141 Å²	141	75 Å²	75	61%	0.613	37%	0.366	S	S	*	.	H	α-helix	trans	-72.8	-30.9	-178.8	-149.5	-176.5	-177.9	-160.7	0	111.7	K468 A469	K468-K472 WeakPolarHBondContact O-CB 3.17Å; K468-K472 PolarHBondContact O-N 2.85Å; A469-K472 PolarHBondContact O-N 3.16Å; A469-K472 VanDerWaalsContact O-N 3.16Å
473	G	43.7	Very low	63.6	Low	59 Å²	59	81.9 Å²	81.9	61%	0.608	41%	0.411	S	S	*	.	H	α-helix	trans	-79.3	-25	168.9	0	0	0	0	0	113.7	A469 K475	A469-G473 PolarHBondContact O-N 2.84Å; G473-K475 PolarHBondContact O-N 3.02Å
474	Q	47.4	Very low	63.3	Low	113 Å²	113	83.4 Å²	83.4	53%	0.528	42%	0.418	S	S	.	.			trans	-95.9	70.4	175.9	-65	179.4	-6.1	0	0	111.8	T470 K471 K476	T470-Q474 WeakPolarHBondContact O-CG 3.47Å; T470-Q474 PolarHBondContact O-N 3.32Å; K471-Q474 CarbonylContact O-C 3.57Å; K471-Q474 VanDerWaalsContact O-C 3.32Å; K471-Q474 PolarHBondContact O-N 3.35Å; Q474-K476 PolarHBondContact O-N 3.01Å
475	K	47.2	Very low	62.7	Low	189 Å²	189	80.2 Å²	80.2	82%	0.822	41%	0.408	S	S	*	.	S	Bend	trans	-54.2	112.2	147.3	-76.6	-178.5	-178.5	174.5	0	104.4	G473 K477	G473-K475 PolarHBondContact O-N 3.02Å; K475-K477 VanDerWaalsContact C-N 3.32Å; K475-K477 WeakPolarHBondContact O-CA 3.27Å; K475-K477 PolarHBondContact O-N 2.83Å
476	K	54.5	Low	62.3	Low	105 Å²	105	83.1 Å²	83.1	46%	0.457	42%	0.418	S	S	.	.			trans	-32	96.1	-176.1	-86.4	-165	169.8	-153.8	0	109.5	K289 R291 L293 Q474 K478	K289-K476 WeakPolarHBondContact O-CE 3.46Å; K289-K476 PolarHBondContact O-NZ 3.31Å; R291-K476 PolarHBondContact O-NZ 3.19Å; L293-K476 HydrophobicContact CD1-CD 4.27Å; Q474-K476 PolarHBondContact O-N 3.01Å; K476-K478 PolarHBondContact O-N 3.15Å
477	K	60.7	Low	61.9	Low	180 Å²	180	88 Å²	88	78%	0.783	44%	0.442	S	S	*	.			trans	-70.1	114.2	-177.7	-73.2	-172.1	-179.3	179.3	0	102.8	K475 I479	K475-K477 VanDerWaalsContact C-N 3.32Å; K475-K477 WeakPolarHBondContact O-CA 3.27Å; K475-K477 PolarHBondContact O-N 2.83Å; K477-I479 PolarHBondContact O-N 3.16Å; K477-I479 VanDerWaalsContact O-N 3.13Å
478	K	70.8	Confident	61.5	Low	116 Å²	116	91.5 Å²	91.5	50%	0.504	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-56.5	123.1	175	-74	-179.2	174.1	-169.5	0	106.3	L293 T295 K476	L293-K478 HydrophobicContact CB-CG 4.29Å; L293-K478 CarbonylContact O-C 3.32Å; L293-K478 WeakPolarHBondContact O-CA 3.14Å; T295-K478 HydrophobicContact CG2-CB 3.99Å; T295-K478 WeakPolarHBondContact CG2-O 3.28Å; K476-K478 PolarHBondContact O-N 3.15Å
479	I	78.8	Confident	61.1	Low	64 Å²	64	89.4 Å²	89.4	33%	0.328	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-66.6	136.3	-175.8	-58.6	174.8	0	0	0	107.4	P292 L293 Y294 T295 K477 P481	P292-I479 HydrophobicContact CB-CD1 3.69Å; L293-I479 PolarHBondContact O-N 3.09Å; Y294-I479 CarbonylContact C-O 3.41Å; Y294-I479 VanDerWaalsContact CA-O 3.22Å; Y294-I479 WeakPolarHBondContact CA-O 3.45Å; Y294-I479 HydrophobicContact CD1-CB 3.98Å; Y294-I479 HydrophobicContact CD1-CG2 4.3Å; Y294-I479 HydrophobicContact CE1-CB 4.26Å; Y294-I479 HydrophobicContact CE1-CG2 4.32Å; T295-I479 PolarHBondContact N-O 2.87Å; K477-I479 PolarHBondContact O-N 3.16Å; K477-I479 VanDerWaalsContact O-N 3.13Å; I479-P481 WeakPolarHBondContact O-CD 3.26Å
480	C	78.1	Confident	60.9	Low	38 Å²	38	95.1 Å²	95.1	26%	0.257	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-74.8	127.8	168.2	-167.9	0	0	0	0	107.8	C298 I482	C298-C480 HydrophobicContact CB-CB 3.81Å; C298-C480 WeakPolarHBondContact CB-SG 3.26Å; C298-C480 WeakPolarHBondContact SG-CA 3.44Å; C298-C480 WeakPolarHBondContact SG-CB 3.35Å; C298-C480 CovalentContact SG-SG 2.01Å; C298-C480 PolarHBondContact SG-SG 2.91Å; C480-I482 VanDerWaalsContact CB-O 3.22Å; C480-I482 WeakPolarHBondContact CB-O 3.4Å; C480-I482 PolarHBondContact O-N 2.83Å; C480-I482 PolarHBondContact SG-O 3.38Å
481	P	75.6	Confident	61	Low	1 Å²	1	99.9 Å²	99.9	1%	0.006	50%	0.501	C	S	.	.	S	Bend	trans	-56.4	-19.5	174.4	-25.8	34.9	0	0	0	113.9	I267 D268 I269 T295 L299 L307 V311 I479	I267-P481 VanDerWaalsContact CA-O 3.29Å; I267-P481 WeakPolarHBondContact CA-O 3.41Å; D268-P481 PolarHBondContact N-O 2.97Å; D268-P481 VanDerWaalsContact N-O 3.15Å; I269-P481 HydrophobicContact CG2-CB 3.59Å; I269-P481 HydrophobicContact CG2-CG 4.1Å; T295-P481 VanDerWaalsContact O-CD 3.31Å; T295-P481 WeakPolarHBondContact O-CD 3.22Å; L299-P481 HydrophobicContact CD2-CB 4.36Å; L299-P481 HydrophobicContact CD2-CG 4.2Å; L307-P481 HydrophobicContact CD1-CB 4.22Å; L307-P481 HydrophobicContact CD2-CB 3.94Å; L307-P481 HydrophobicContact CG-CB 4.21Å; V311-P481 HydrophobicContact CG2-CB 4.29Å; V311-P481 HydrophobicContact CG2-CG 3.41Å; V311-P481 VanDerWaalsContact CG2-CG 3.41Å; I479-P481 WeakPolarHBondContact O-CD 3.26Å
482	I	72.9	Confident	61.4	Low	18 Å²	18	97.6 Å²	97.6	9%	0.092	50%	0.496	C	S	.	.			trans	-116.7	122.6	-175.2	-63.7	-176.4	0	0	0	105.6	P265 L299 Y304 L307 C480	P265-I482 HydrophobicContact CB-CB 4.19Å; P265-I482 HydrophobicContact CB-CG2 3.24Å; P265-I482 HydrophobicContact CG-CG2 3.32Å; L299-I482 HydrophobicContact CD2-CD1 3.35Å; L299-I482 HydrophobicContact CD2-CG1 3.73Å; Y304-I482 HydrophobicContact CD1-CD1 3.61Å; Y304-I482 HydrophobicContact CE1-CD1 3.31Å; Y304-I482 HydrophobicContact CE1-CG1 4.38Å; Y304-I482 HydrophobicContact CE2-CD1 4.31Å; Y304-I482 HydrophobicContact CG-CD1 4.2Å; L307-I482 HydrophobicContact CD2-CD1 4.09Å; L307-I482 HydrophobicContact CD2-CG1 3.97Å; C480-I482 VanDerWaalsContact CB-O 3.22Å; C480-I482 WeakPolarHBondContact CB-O 3.4Å; C480-I482 PolarHBondContact O-N 2.83Å; C480-I482 PolarHBondContact SG-O 3.38Å
483	P	59.2	Low	62.6	Low	147 Å²	147	93.6 Å²	93.6	96%	0.955	49%	0.485	S	S	*	.			trans	-60.7	0	177.9	17.4	-28.9	0	0	0	113.8	P265 K266	P265-P483 VanDerWaalsContact CB-CD 3.48Å; P265-P483 HydrophobicContact CB-CG 3.74Å; K266-P483 HydrophobicContact CB-CG 4.47Å; K266-P483 WeakPolarHBondContact O-CD 3.43Å

Retrieved 483 of 483 residues in 1950.8 ms (Link to these results)

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