A0A096N1E7_PAPAN Loading...

VPS50 subunit of EARP/GARPII complex

AlphaFold DB (A0A2I3M7E5), UniProt , Accession A0A096N1E7, Species PAPAN (Papio anubis, Olive baboon), Gene VPS50, Length 964 aa.

						>A0A096N1E7_PAPAN|A0A096N1E7|VPS50
MQKIKSLMTRQGLKSPQESLSDLGAIESLRVPGKEEFRELREQPSDPQAEQELINSIEQVYFSADSFDVVKYELEKLPPVLNLQELEAYRDKLKQQQAAVSKKVADLILEKQPAYVKELERVTSLQTGLQLAAVICTNGRRHLNIAKEGFTQASLGLLANQRKRQLLIGLLKSLRTIKTLQRTDVRLSEMLEEEDYPGAIQLCLECQKAASTFKHYSCISELNSKLQDTLEQIEEQLDVALSKICKNFDINHYTKVQQAYRLLGKTQTAMDQLHMHFTQAIHNTVFQVVLGYVELCAGNTDTKFQKLQYKDLCTHVTPDSYIPCLADLCKALWEVMLSYYRTMEWHEKHDNEDTASASEGNNMIGTEETNFDRGYIKKKLEHGLTRIWQDVQLKVKTYLLGTDLSIFKYDDFIFVLDIISRLMQVGEEFCGSKSEVLQESIRKQSVNYFKNYHRTRLDELRMFLENETWELCPVKSNFSILQLHEFKFMEQSRSPSVSPSKQPVSTSSKTVTLFEQYCSGGNPFEIQANHKDEETEDVLASNGYESDEQEKSAYQEYDSDSDVPEELKRDYVDEQTGDVPVKSVSRETLKSRKKSDYSLNKVNAPILTNTTLNVIRLVGKYMQMMNILKPIAFDVIHFMSQLFDYYLYAIYTFFGRNDSLESTGLGLSSSRLRTTLNRIQESLIDLEVSADPTATLTAAEERKEKVPSPHLSHLVVLTSGDTLYGLAERVVATESLVFLAEQFEFLQPHLDAVMPAVKKPFLQQFYSQTVSTASELRKPIYWIVAGKALDYEQMLLLMANVKWDVKEIMSQHNIYVDALLKEFEQFNRRLNEVSKRVRIPLPVSNILWEHCIRLANRTIVEGYANVKKCSNEGRALMQLDFQQFLMKLEKLTDIRPIPDKEFVETYIKAYYLTENDMERWIKEHREYSTKQLTNLVNVCLGSHINKKARQKLLAAIDDIDRPKR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	30.6	Very low	229 Å²	229	176.6 Å²	176.6	100%	1.128	86%	0.858	S	S	*	*				0	73.6	0	-69.7	-83.1	-120.6	0	0	108.1
2	Q	30.4	Very low	30.3	Very low	182 Å²	182	168.3 Å²	168.3	85%	0.85	85%	0.852	S	S	*	*				70.1	82.9	100	-79.3	-171.8	-10.9	0	0	114.1
3	K	29.8	Very low	30.1	Very low	204 Å²	204	167.8 Å²	167.8	89%	0.887	85%	0.852	S	S	*	*				-174.2	55	129.7	-100.2	174.3	-178.6	-179.7	0	109.7	K5	K3-K5 VanDerWaalsContact C-N 3.29Å
4	I	37.7	Very low	29.8	Very low	177 Å²	177	170.6 Å²	170.6	91%	0.908	86%	0.855	S	S	*	*			trans	-98.7	56.4	163.4	-61.6	172.6	0	0	0	107.1
5	K	28.6	Very low	29.6	Very low	195 Å²	195	166.6 Å²	166.6	85%	0.848	85%	0.85	S	S	*	*			trans	-156.4	125	-175.8	-129.8	176.9	-177.4	-178.7	0	108.3	K3	K3-K5 VanDerWaalsContact C-N 3.29Å
6	S	29.2	Very low	29.8	Very low	99 Å²	99	163.3 Å²	163.3	69%	0.692	84%	0.842	S	S	*	*	S	Bend	trans	89.2	81.4	175.6	-174.4	0	0	0	0	116.2
7	L	31.1	Very low	29.6	Very low	160 Å²	160	165.1 Å²	165.1	84%	0.838	85%	0.846	S	S	*	*	S	Bend	trans	-178.9	22.8	131.2	-97.2	157.3	0	0	0	117.4
8	M	28.6	Very low	29.3	Very low	202 Å²	202	166.3 Å²	166.3	100%	0.995	85%	0.848	S	S	*	*			trans	-127.4	68.8	154.8	-70.7	-159.5	95	0	0	110.2
9	T	27.8	Very low	29	Very low	116 Å²	116	163.2 Å²	163.2	71%	0.712	84%	0.842	S	S	*	*			trans	-103.5	145	160.8	-19.4	0	0	0	0	107.6
10	R	32	Very low	28.9	Very low	211 Å²	211	163.7 Å²	163.7	80%	0.796	85%	0.846	S	S	*	*			trans	85.5	131.9	170	-63.4	-177.5	159.5	178.9	-6.6	115.5
11	Q	29.5	Very low	28.7	Very low	168 Å²	168	160.3 Å²	160.3	79%	0.785	84%	0.837	S	S	*	*			cis	-172.9	147.3	-2.8	-117.8	162.6	-30.8	0	0	103.2
12	G	26.3	Very low	28.4	Very low	76 Å²	76	156.9 Å²	156.9	78%	0.784	82%	0.823	S	S	*	*			cis	-163.7	166.2	16.5	0	0	0	0	0	114.7
13	L	27.6	Very low	28.2	Very low	162 Å²	162	157.3 Å²	157.3	85%	0.848	83%	0.83	S	S	*	*			trans	-68.2	144.2	177.9	-68.6	132.5	0	0	0	114
14	K	26.9	Very low	27.9	Very low	208 Å²	208	151.2 Å²	151.2	90%	0.904	83%	0.825	S	S	*	*				-153.5	120.7	125	-77.9	-175.8	-179.5	177.1	0	103.5
15	S	26.5	Very low	27.4	Very low	110 Å²	110	147.5 Å²	147.5	77%	0.769	82%	0.82	S	S	*	*			cis	-158.5	152.9	34.1	42	0	0	0	0	107.3
16	P	33.3	Very low	27.4	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	82%	0.819	S	S	*	*				-150.5	158.7	91.7	34.6	-15	0	0	0	114.1
17	Q	25.5	Very low	27.4	Very low	195 Å²	195	149.5 Å²	149.5	91%	0.911	83%	0.825	S	S	*	*			trans	-128.4	102.2	156.4	-90	-177.7	-43.1	0	0	107.9
18	E	24.6	Very low	27.1	Very low	186 Å²	186	146.8 Å²	146.8	87%	0.869	82%	0.82	S	S	*	*			trans	-80.4	127.4	145.1	-76.3	179.6	156.4	0	0	106.7
19	S	24.4	Very low	27.1	Very low	107 Å²	107	144.8 Å²	144.8	75%	0.748	81%	0.812	S	S	*	*			trans	-120.7	92.5	161.8	55	0	0	0	0	107.5
20	L	26.3	Very low	27.4	Very low	173 Å²	173	150 Å²	150	91%	0.906	82%	0.819	S	S	*	*			trans	-80.8	106.1	153.5	-97	155.6	0	0	0	106.6
21	S	24.4	Very low	27.4	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	82%	0.819	S	S	*	*			trans	-145.7	135.9	165.4	-45.8	0	0	0	0	106.8
22	D	25.1	Very low	27.5	Very low	157 Å²	157	141.7 Å²	141.7	84%	0.84	80%	0.804	S	S	*	*			trans	84.3	76.8	167.3	-55.5	-18.5	0	0	0	118.6
23	L	26.3	Very low	27.8	Very low	191 Å²	191	140 Å²	140	100%	1	79%	0.787	S	S	*	*			trans	-110.4	101.8	132.3	-88.5	163.9	0	0	0	107.5
24	G	24.2	Very low	28.4	Very low	75 Å²	75	141 Å²	141	77%	0.773	78%	0.784	S	S	*	*			trans	-169.2	51.6	-175.9	0	0	0	0	0	113.4
25	A	27.8	Very low	29	Very low	99 Å²	99	139 Å²	139	82%	0.818	78%	0.778	S	S	*	*			trans	-147.8	76.6	159.8	0	0	0	0	0	108.9	E27	A25-E27 VanDerWaalsContact C-N 3.29Å; A25-E27 PolarHBondContact O-N 3.37Å
26	I	28.6	Very low	29.6	Very low	160 Å²	160	139.7 Å²	139.7	82%	0.821	77%	0.769	S	S	*	*			trans	-72.8	93.9	155.7	-66.5	171	0	0	0	105	S28	I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 3.42Å; I26-S28 VanDerWaalsContact O-N 3.14Å
27	E	28.8	Very low	29.7	Very low	176 Å²	176	140 Å²	140	82%	0.822	76%	0.759	S	S	*	*			trans	-72.7	95.8	152.1	-101.4	-177.3	167.4	0	0	107	A25 L29	A25-E27 VanDerWaalsContact C-N 3.29Å; A25-E27 PolarHBondContact O-N 3.37Å; E27-L29 PolarHBondContact O-N 3.1Å
28	S	25.3	Very low	30.5	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	75%	0.752	S	S	*	*			trans	-62.4	83.1	163.1	54.3	0	0	0	0	109.5	I26 R30	I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 3.42Å; I26-S28 VanDerWaalsContact O-N 3.14Å; S28-R30 PolarHBondContact O-N 3.39Å
29	L	28.5	Very low	31.1	Very low	160 Å²	160	139.8 Å²	139.8	84%	0.838	75%	0.75	S	S	*	*			trans	-75.2	83.3	156.6	-87.9	157.6	0	0	0	107.9	E27	E27-L29 PolarHBondContact O-N 3.1Å
30	R	34	Very low	31.7	Very low	226 Å²	226	140.9 Å²	140.9	85%	0.853	75%	0.746	S	S	*	*			trans	9.3	109.2	149	-144.3	175.1	-163.5	164.1	1	114.3	S28 P32	S28-R30 PolarHBondContact O-N 3.39Å; R30-P32 WeakPolarHBondContact O-CD 3.44Å
31	V	31.1	Very low	32.3	Very low	131 Å²	131	143 Å²	143	79%	0.794	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57.9	122.7	158.2	177.3	0	0	0	0	107.2	G33	V31-G33 PolarHBondContact O-N 3.47Å
32	P	32.6	Very low	32.7	Very low	74 Å²	74	147.4 Å²	147.4	48%	0.481	75%	0.752	S	S	.	*	P	Polyproline II helix	trans	-54.9	124.1	175.1	-25.9	36.2	0	0	0	109.8	R30 E36	R30-P32 WeakPolarHBondContact O-CD 3.44Å; P32-E36 WeakPolarHBondContact CB-OE2 3.49Å
33	G	32	Very low	33	Very low	40 Å²	40	148.5 Å²	148.5	41%	0.412	75%	0.752	S	S	.	*	P	Polyproline II helix	trans	-67.3	153.4	177.8	0	0	0	0	0	111.1	V31 E35 E36	V31-G33 PolarHBondContact O-N 3.47Å; G33-E35 PolarHBondContact O-N 3.24Å; G33-E36 PolarHBondContact O-N 3.16Å
34	K	41	Very low	33.5	Very low	184 Å²	184	145.3 Å²	145.3	80%	0.8	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-9.9	172	-83.5	-179.4	171.7	178.8	0	114.7
35	E	39.1	Very low	34	Very low	164 Å²	164	146.6 Å²	146.6	77%	0.766	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-33.4	176	-70.2	177.5	157.5	0	0	112.9	G33 F37 R38	G33-E35 PolarHBondContact O-N 3.24Å; E35-F37 VanDerWaalsContact C-N 3.35Å; E35-F37 PolarHBondContact O-N 3Å; E35-R38 WeakPolarHBondContact O-CB 3.37Å; E35-R38 PolarHBondContact O-N 2.82Å; E35-R38 VanDerWaalsContact O-N 3.1Å
36	E	38.9	Very low	34.7	Very low	126 Å²	126	147.3 Å²	147.3	59%	0.589	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-26.1	179.3	-78.2	-179.8	172.3	0	0	113	P32 G33 R38	P32-E36 WeakPolarHBondContact CB-OE2 3.49Å; G33-E36 PolarHBondContact O-N 3.16Å; E36-R38 VanDerWaalsContact C-N 3.29Å
37	F	34.9	Very low	36	Very low	120 Å²	120	143.6 Å²	143.6	53%	0.526	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	-16.3	171.7	-85.3	-79.2	0	0	0	113.4	E35 A105	E35-F37 VanDerWaalsContact C-N 3.35Å; E35-F37 PolarHBondContact O-N 3Å; F37-A105 HydrophobicContact CD1-CB 4.25Å; F37-A105 HydrophobicContact CE1-CB 3.36Å; F37-A105 HydrophobicContact CZ-CB 3.9Å
38	R	41.7	Very low	37.2	Very low	201 Å²	201	142.2 Å²	142.2	76%	0.758	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-25.7	-176.5	-136.5	177	-168.4	177.9	2	112.5	E35 E36 L40	E35-R38 WeakPolarHBondContact O-CB 3.37Å; E35-R38 PolarHBondContact O-N 2.82Å; E35-R38 VanDerWaalsContact O-N 3.1Å; E36-R38 VanDerWaalsContact C-N 3.29Å; R38-L40 VanDerWaalsContact C-N 3.28Å; R38-L40 PolarHBondContact O-N 3.49Å
39	E	37.6	Very low	38.5	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-73.5	-13.4	179.5	-72	-172.3	158.5	0	0	114.1	R41	E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.18Å
40	L	37.7	Very low	39.7	Very low	129 Å²	129	136 Å²	136	68%	0.675	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-84.7	8.7	177.4	-72.7	164.8	0	0	0	114.3	R38	R38-L40 VanDerWaalsContact C-N 3.28Å; R38-L40 PolarHBondContact O-N 3.49Å
41	R	38.7	Very low	40.8	Very low	219 Å²	219	130 Å²	130	83%	0.826	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-100.8	8.7	-168.7	-144.7	-177	-175.9	173.2	3.6	117	E39	E39-R41 VanDerWaalsContact C-N 3.28Å; E39-R41 PolarHBondContact O-N 3.18Å
42	E	32.8	Very low	42.1	Very low	186 Å²	186	130.7 Å²	130.7	87%	0.869	65%	0.651	S	S	*	*			trans	-123.2	82.1	171.5	-75.2	-170.1	171.9	0	0	112.4
43	Q	32.3	Very low	43.3	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	64%	0.641	S	S	*	*				-156.9	125.6	126.4	-103.5	173.7	26.5	0	0	107.8	S45	Q43-S45 PolarHBondContact O-N 3.47Å
44	P	35.8	Very low	44.6	Very low	124 Å²	124	129 Å²	129	81%	0.805	63%	0.628	S	S	*	*			trans	-77.8	123.3	-178	30.7	-29.7	0	0	0	108.9
45	S	34.7	Very low	45.7	Very low	101 Å²	101	126.7 Å²	126.7	71%	0.706	62%	0.624	S	S	*	*			trans	-151.4	140.7	164.8	-71.9	0	0	0	0	109.8	Q43	Q43-S45 PolarHBondContact O-N 3.47Å
46	D	42.7	Very low	46.5	Very low	114 Å²	114	122 Å²	122	61%	0.61	61%	0.61	S	S	*	*			trans	-56.5	134.2	-156.8	-104.8	-42.5	0	0	0	116	Q48 A49 E50	D46-Q48 PolarHBondContact O-N 3.13Å; D46-A49 PolarHBondContact O-N 3.11Å; D46-A49 VanDerWaalsContact O-N 3.16Å; D46-E50 PolarHBondContact O-N 3.31Å
47	P	54.8	Low	47.6	Very low	83 Å²	83	117.1 Å²	117.1	54%	0.539	59%	0.587	S	S	.	*	H	α-helix	trans	-63.4	-22.7	179.2	24	-32.6	0	0	0	114	Q51	P47-Q51 PolarHBondContact O-N 3.49Å; P47-Q51 PolarHBondContact O-OE1 3.43Å
48	Q	54	Low	48.8	Very low	146 Å²	146	115.5 Å²	115.5	68%	0.682	58%	0.582	S	S	*	*	H	α-helix	trans	-72.9	-36.3	176.1	-80.5	174.5	-36.2	0	0	112.6	D46 Q51 E52	D46-Q48 PolarHBondContact O-N 3.13Å; Q48-Q51 PolarHBondContact O-N 3.21Å; Q48-E52 PolarHBondContact O-N 2.99Å
49	A	54	Low	49.6	Very low	55 Å²	55	114.4 Å²	114.4	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-68.2	-39.5	177.4	0	0	0	0	0	111.5	D46 Q51 E52 L53	D46-A49 PolarHBondContact O-N 3.11Å; D46-A49 VanDerWaalsContact O-N 3.16Å; A49-Q51 VanDerWaalsContact C-N 3.31Å; A49-Q51 PolarHBondContact O-N 3.33Å; A49-E52 PolarHBondContact O-N 2.99Å; A49-L53 WeakPolarHBondContact O-CB 3.43Å; A49-L53 PolarHBondContact O-N 3.09Å
50	E	53.4	Low	50.5	Low	78 Å²	78	108.7 Å²	108.7	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-64.6	-34.3	175.7	-70.3	-173.9	164.6	0	0	112.1	D46 I54	D46-E50 PolarHBondContact O-N 3.31Å; E50-I54 WeakPolarHBondContact O-CG1 3.43Å; E50-I54 PolarHBondContact O-N 3.35Å; E50-I54 VanDerWaalsContact O-N 3.14Å
51	Q	57.2	Low	51.5	Low	100 Å²	100	105.7 Å²	105.7	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-74.5	-37.5	176.8	-109.7	150.3	-18.3	0	0	113.5	P47 Q48 A49 L53 I54 N55	P47-Q51 PolarHBondContact O-N 3.49Å; P47-Q51 PolarHBondContact O-OE1 3.43Å; Q48-Q51 PolarHBondContact O-N 3.21Å; A49-Q51 VanDerWaalsContact C-N 3.31Å; A49-Q51 PolarHBondContact O-N 3.33Å; Q51-L53 VanDerWaalsContact C-N 3.33Å; Q51-I54 PolarHBondContact O-N 3.07Å; Q51-N55 WeakPolarHBondContact O-CB 3.41Å; Q51-N55 VanDerWaalsContact O-CG 3.27Å; Q51-N55 PolarHBondContact O-N 3.46Å; Q51-N55 PolarHBondContact O-ND2 3.5Å
52	E	59.2	Low	52.4	Low	146 Å²	146	101.9 Å²	101.9	68%	0.682	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-36.4	171.6	-74.5	-176	172.1	0	0	111.9	Q48 A49 N55 S56	Q48-E52 PolarHBondContact O-N 2.99Å; A49-E52 PolarHBondContact O-N 2.99Å; E52-N55 PolarHBondContact O-N 3.34Å; E52-S56 WeakPolarHBondContact O-CB 3.42Å; E52-S56 PolarHBondContact O-N 3.32Å
53	L	57.2	Low	53.6	Low	52 Å²	52	96.2 Å²	96.2	27%	0.272	51%	0.513	S	S	.	.	H	α-helix	trans	-65.6	-39.5	176.4	-127	154.5	0	0	0	112	A49 Q51 S56 Q96	A49-L53 WeakPolarHBondContact O-CB 3.43Å; A49-L53 PolarHBondContact O-N 3.09Å; Q51-L53 VanDerWaalsContact C-N 3.33Å; L53-S56 PolarHBondContact O-N 3.4Å; L53-S56 PolarHBondContact O-OG 3.07Å; L53-Q96 HydrophobicContact CD2-CG 3.34Å
54	I	59.7	Low	54.7	Low	26 Å²	26	92.4 Å²	92.4	13%	0.133	51%	0.512	C	S	.	.	H	α-helix	trans	-68.7	-39.4	173.8	-67.2	167.3	0	0	0	111.2	E50 Q51 S56 I57 A99 V100 K103	E50-I54 WeakPolarHBondContact O-CG1 3.43Å; E50-I54 PolarHBondContact O-N 3.35Å; E50-I54 VanDerWaalsContact O-N 3.14Å; Q51-I54 PolarHBondContact O-N 3.07Å; I54-S56 PolarHBondContact O-N 3.4Å; I54-I57 WeakPolarHBondContact O-CB 3.34Å; I54-I57 PolarHBondContact O-N 3.48Å; I54-A99 HydrophobicContact CD1-CB 4.12Å; I54-A99 HydrophobicContact CG1-CB 4.08Å; I54-V100 HydrophobicContact CG1-CG2 4.43Å; I54-K103 HydrophobicContact CD1-CD 4.19Å
55	N	62.5	Low	55.3	Low	135 Å²	135	93.3 Å²	93.3	72%	0.722	51%	0.51	S	S	*	.	H	α-helix	trans	-67.8	-21.5	175.5	-71.9	-15	0	0	0	112.9	Q51 E52 I57	Q51-N55 WeakPolarHBondContact O-CB 3.41Å; Q51-N55 VanDerWaalsContact O-CG 3.27Å; Q51-N55 PolarHBondContact O-N 3.46Å; Q51-N55 PolarHBondContact O-ND2 3.5Å; E52-N55 PolarHBondContact O-N 3.34Å; N55-I57 VanDerWaalsContact C-N 3.27Å; N55-I57 PolarHBondContact O-N 3.08Å
56	S	57.2	Low	56	Low	66 Å²	66	94.8 Å²	94.8	46%	0.462	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.3	174.3	79.8	0	0	0	0	114.3	E52 L53 I54 Q96	E52-S56 WeakPolarHBondContact O-CB 3.42Å; E52-S56 PolarHBondContact O-N 3.32Å; L53-S56 PolarHBondContact O-N 3.4Å; L53-S56 PolarHBondContact O-OG 3.07Å; I54-S56 PolarHBondContact O-N 3.4Å; S56-Q96 PolarHBondContact OG-NE2 2.95Å
57	I	61.7	Low	56.5	Low	23 Å²	23	93.4 Å²	93.4	12%	0.118	51%	0.509	C	S	.	.	S	Bend	trans	-78.8	127.6	176.5	-60	170	0	0	0	109	I54 N55 Q59 Y61 F62 Q96 V100	I54-I57 WeakPolarHBondContact O-CB 3.34Å; I54-I57 PolarHBondContact O-N 3.48Å; N55-I57 VanDerWaalsContact C-N 3.27Å; N55-I57 PolarHBondContact O-N 3.08Å; I57-Q59 PolarHBondContact O-N 3.29Å; I57-Y61 HydrophobicContact CG2-CD2 3.79Å; I57-F62 HydrophobicContact CG2-CE2 4.32Å; I57-Q96 HydrophobicContact CD1-CB 3.8Å; I57-Q96 HydrophobicContact CD1-CG 3.93Å; I57-Q96 HydrophobicContact CG1-CB 4.18Å; I57-Q96 VanDerWaalsContact CG1-CD 3.44Å; I57-Q96 HydrophobicContact CG1-CG 3.83Å; I57-V100 HydrophobicContact CD1-CG2 4.14Å
58	E	60.2	Low	56.8	Low	87 Å²	87	94 Å²	94	41%	0.407	51%	0.508	S	S	.	.			trans	-57.3	132.9	-179.3	-80.1	-179.7	168.8	0	0	111.5	V60 Y61 K76	E58-V60 PolarHBondContact O-N 2.97Å; E58-Y61 HydrophobicContact CB-CD2 4.23Å; E58-Y61 HydrophobicContact CB-CE2 4.21Å; E58-Y61 WeakPolarHBondContact O-CD2 3.42Å; E58-Y61 PolarHBondContact O-N 3.24Å; E58-K76 VanDerWaalsContact CD-NZ 3.28Å; E58-K76 IonicContact OE1-NZ 2.92Å; E58-K76 PolarHBondContact OE1-NZ 3.34Å; E58-K76 IonicContact OE2-NZ 2.83Å; E58-K76 PolarHBondContact OE2-NZ 3.47Å
59	Q	58.2	Low	57.1	Low	177 Å²	177	90.5 Å²	90.5	83%	0.827	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-60.1	-18.7	-175	-74.4	-179.2	-11.9	0	0	114.4	I57 Y61 F62	I57-Q59 PolarHBondContact O-N 3.29Å; Q59-Y61 PolarHBondContact O-N 3.41Å; Q59-F62 PolarHBondContact O-N 3.41Å
60	V	57.3	Low	57.4	Low	56 Å²	56	92.6 Å²	92.6	34%	0.339	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-61.1	-30.4	179.9	-171.5	0	0	0	0	111.3	E58 F62 S63 F67	E58-V60 PolarHBondContact O-N 2.97Å; V60-F62 PolarHBondContact O-N 3.25Å; V60-S63 PolarHBondContact O-N 3.44Å; V60-S63 PolarHBondContact O-OG 3.49Å; V60-F67 HydrophobicContact CG1-CD1 4.12Å; V60-F67 HydrophobicContact CG1-CE1 3.57Å; V60-F67 HydrophobicContact CG1-CE2 4.1Å; V60-F67 HydrophobicContact CG1-CZ 3.56Å
61	Y	58.4	Low	57.8	Low	65 Å²	65	95.6 Å²	95.6	26%	0.255	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-68.4	-13.2	178.3	-66.8	-57.7	0	0	0	115.2	I57 E58 Q59 V69 E73	I57-Y61 HydrophobicContact CG2-CD2 3.79Å; E58-Y61 HydrophobicContact CB-CD2 4.23Å; E58-Y61 HydrophobicContact CB-CE2 4.21Å; E58-Y61 WeakPolarHBondContact O-CD2 3.42Å; E58-Y61 PolarHBondContact O-N 3.24Å; Q59-Y61 PolarHBondContact O-N 3.41Å; Y61-V69 HydrophobicContact CD1-CG1 4.17Å; Y61-V69 HydrophobicContact CD1-CG2 4.32Å; Y61-V69 HydrophobicContact CE1-CG1 3.82Å; Y61-E73 VanDerWaalsContact OH-CD 3.24Å; Y61-E73 VanDerWaalsContact OH-CG 3.27Å; Y61-E73 WeakPolarHBondContact OH-CG 3.41Å; Y61-E73 PolarHBondContact OH-OE1 3.24Å
62	F	58	Low	58.2	Low	139 Å²	139	94.2 Å²	94.2	61%	0.61	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-98.1	4.6	-179.4	-66.9	-80	0	0	0	113.9	I57 Q59 V60	I57-F62 HydrophobicContact CG2-CE2 4.32Å; Q59-F62 PolarHBondContact O-N 3.41Å; V60-F62 PolarHBondContact O-N 3.25Å
63	S	57.5	Low	58.4	Low	68 Å²	68	89 Å²	89	48%	0.476	48%	0.481	S	S	.	.			trans	-80.9	124.2	178.2	56.3	0	0	0	0	111.3	V60 D65	V60-S63 PolarHBondContact O-N 3.44Å; V60-S63 PolarHBondContact O-OG 3.49Å; S63-D65 PolarHBondContact O-N 3.01Å
64	A	54.3	Low	58.7	Low	100 Å²	100	92 Å²	92	83%	0.826	50%	0.497	S	S	*	.			trans	-83.6	-2.5	-165.2	0	0	0	0	0	115.4
65	D	48.7	Very low	58.8	Low	143 Å²	143	98.5 Å²	98.5	77%	0.765	53%	0.527	S	S	*	.	S	Bend	trans	-117.4	106.6	-174.8	-80.5	-30	0	0	0	111.8	S63 F67	S63-D65 PolarHBondContact O-N 3.01Å; D65-F67 PolarHBondContact O-N 3.32Å; D65-F67 VanDerWaalsContact O-N 3.11Å
66	S	49.6	Very low	58.7	Low	132 Å²	132	96.7 Å²	96.7	92%	0.923	51%	0.513	S	S	*	.			trans	38	51.4	165.2	64.9	0	0	0	0	117.2
67	F	53.7	Low	58.9	Low	84 Å²	84	97.1 Å²	97.1	37%	0.368	51%	0.51	S	S	.	.			trans	-98.1	120.5	171.8	-169.1	-103.7	0	0	0	110.8	V60 D65 V69 Y72	V60-F67 HydrophobicContact CG1-CD1 4.12Å; V60-F67 HydrophobicContact CG1-CE1 3.57Å; V60-F67 HydrophobicContact CG1-CE2 4.1Å; V60-F67 HydrophobicContact CG1-CZ 3.56Å; D65-F67 PolarHBondContact O-N 3.32Å; D65-F67 VanDerWaalsContact O-N 3.11Å; F67-V69 PolarHBondContact O-N 3.16Å; F67-V69 VanDerWaalsContact O-N 3.1Å; F67-Y72 HydrophobicContact CE1-CD1 4.4Å; F67-Y72 HydrophobicContact CE1-CD2 4.5Å; F67-Y72 HydrophobicContact CE1-CG 4.05Å; F67-Y72 HydrophobicContact CZ-CD1 4.42Å; F67-Y72 AromaticContact CZ-CD2 3.8Å; F67-Y72 HydrophobicContact CZ-CD2 3.8Å; F67-Y72 HydrophobicContact CZ-CE2 4.41Å; F67-Y72 AromaticContact CZ-CG 3.81Å; F67-Y72 HydrophobicContact CZ-CG 3.81Å
68	D	60.1	Low	58.9	Low	97 Å²	97	99.7 Å²	99.7	52%	0.519	53%	0.528	S	S	.	.			trans	-84.1	85.5	-175.7	-167.1	-2.9	0	0	0	111.1	V70 K71	D68-V70 PolarHBondContact O-N 3.35Å; D68-V70 VanDerWaalsContact O-N 3.09Å; D68-K71 PolarHBondContact O-N 3.31Å; D68-K71 VanDerWaalsContact O-N 3.16Å
69	V	61.2	Low	58.7	Low	72 Å²	72	101.8 Å²	101.8	44%	0.436	55%	0.549	S	S	.	.	H	α-helix	trans	-47.6	-35.4	-177.6	175.2	0	0	0	0	113	Y61 F67	Y61-V69 HydrophobicContact CD1-CG1 4.17Å; Y61-V69 HydrophobicContact CD1-CG2 4.32Å; Y61-V69 HydrophobicContact CE1-CG1 3.82Å; F67-V69 PolarHBondContact O-N 3.16Å; F67-V69 VanDerWaalsContact O-N 3.1Å
70	V	60.8	Low	58.5	Low	98 Å²	98	99.2 Å²	99.2	59%	0.594	55%	0.545	S	S	*	.	H	α-helix	trans	-74.4	-37.6	-174	-177.6	0	0	0	0	111.7	D68 L74	D68-V70 PolarHBondContact O-N 3.35Å; D68-V70 VanDerWaalsContact O-N 3.09Å; V70-L74 HydrophobicContact CG1-CD1 4.04Å; V70-L74 WeakPolarHBondContact O-CD1 3.39Å; V70-L74 WeakPolarHBondContact O-CG 3.49Å; V70-L74 PolarHBondContact O-N 3.11Å
71	K	61.7	Low	58.5	Low	141 Å²	141	101.9 Å²	101.9	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-68	-40.1	178.6	-108.3	178	176.8	175.7	0	112.2	D68 L74 E75	D68-K71 PolarHBondContact O-N 3.31Å; D68-K71 VanDerWaalsContact O-N 3.16Å; K71-L74 PolarHBondContact O-N 3.44Å; K71-E75 PolarHBondContact O-N 3.35Å
72	Y	65.9	Low	58.5	Low	72 Å²	72	103.9 Å²	103.9	28%	0.282	57%	0.572	S	S	.	*	H	α-helix	trans	-66.2	-39.1	-176.2	-172.4	-105.9	0	0	0	112.7	F67	F67-Y72 HydrophobicContact CE1-CD1 4.4Å; F67-Y72 HydrophobicContact CE1-CD2 4.5Å; F67-Y72 HydrophobicContact CE1-CG 4.05Å; F67-Y72 HydrophobicContact CZ-CD1 4.42Å; F67-Y72 AromaticContact CZ-CD2 3.8Å; F67-Y72 HydrophobicContact CZ-CD2 3.8Å; F67-Y72 HydrophobicContact CZ-CE2 4.41Å; F67-Y72 AromaticContact CZ-CG 3.81Å; F67-Y72 HydrophobicContact CZ-CG 3.81Å
73	E	62.8	Low	58.7	Low	35 Å²	35	103.9 Å²	103.9	16%	0.164	58%	0.578	C	S	.	*	H	α-helix	trans	-73.8	-30.7	176.4	-78.2	-69.5	176.2	0	0	112.8	Y61 E75 K76 Y89	Y61-E73 VanDerWaalsContact OH-CD 3.24Å; Y61-E73 VanDerWaalsContact OH-CG 3.27Å; Y61-E73 WeakPolarHBondContact OH-CG 3.41Å; Y61-E73 PolarHBondContact OH-OE1 3.24Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.29Å; E73-K76 PolarHBondContact O-N 3Å; E73-Y89 PolarHBondContact OE1-OH 3.44Å; E73-Y89 WeakPolarHBondContact OE2-CE1 3.24Å; E73-Y89 PolarHBondContact OE2-OH 3.05Å
74	L	63	Low	58.9	Low	116 Å²	116	108.4 Å²	108.4	61%	0.607	59%	0.591	S	S	*	*	H	α-helix	trans	-69.2	-28.8	176.4	-79	165.2	0	0	0	113.3	V70 K71	V70-L74 HydrophobicContact CG1-CD1 4.04Å; V70-L74 WeakPolarHBondContact O-CD1 3.39Å; V70-L74 WeakPolarHBondContact O-CG 3.49Å; V70-L74 PolarHBondContact O-N 3.11Å; K71-L74 PolarHBondContact O-N 3.44Å
75	E	61.9	Low	59.4	Low	163 Å²	163	110.1 Å²	110.1	76%	0.762	58%	0.582	S	S	*	*	H	α-helix	trans	-76.1	-20.6	177.4	-76.7	-177.7	171.6	0	0	113.8	K71 E73 L77	K71-E75 PolarHBondContact O-N 3.35Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.29Å; E75-L77 VanDerWaalsContact C-N 3.35Å
76	K	60.7	Low	60.1	Low	96 Å²	96	106.6 Å²	106.6	42%	0.417	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.6	-5.1	179.8	-77.5	-168.8	-179.9	175.4	0	114.1	E58 E73	E58-K76 VanDerWaalsContact CD-NZ 3.28Å; E58-K76 IonicContact OE1-NZ 2.92Å; E58-K76 PolarHBondContact OE1-NZ 3.34Å; E58-K76 IonicContact OE2-NZ 2.83Å; E58-K76 PolarHBondContact OE2-NZ 3.47Å; E73-K76 PolarHBondContact O-N 3Å
77	L	61.7	Low	61	Low	75 Å²	75	106 Å²	106	39%	0.393	55%	0.545	S	S	.	.	S	Bend	trans	-86.5	124.3	-177.1	-71.8	166	0	0	0	112.3	E75 L86	E75-L77 VanDerWaalsContact C-N 3.35Å; L77-L86 HydrophobicContact CD1-CD2 4.28Å; L77-L86 HydrophobicContact CD2-CD2 3.91Å; L77-L86 HydrophobicContact CD2-CG 4.33Å
78	P	60.8	Low	61.8	Low	77 Å²	77	105 Å²	105	50%	0.5	55%	0.553	S	S	.	*			trans	-71.4	153.7	-178.2	24.9	-30.5	0	0	0	113.3	V80	P78-V80 PolarHBondContact O-N 3.48Å
79	P	56.6	Low	62.1	Low	131 Å²	131	105.1 Å²	105.1	85%	0.851	55%	0.547	S	S	*	.	S	Bend	trans	-71.2	-1.4	-166.4	25.6	-34.1	0	0	0	116.6
80	V	53.4	Low	62.6	Low	124 Å²	124	108.1 Å²	108.1	75%	0.752	55%	0.55	S	S	*	*	S	Bend	trans	-124.3	104.9	170.2	-172.4	0	0	0	0	108.1	P78	P78-V80 PolarHBondContact O-N 3.48Å
81	L	57.4	Low	63.2	Low	112 Å²	112	107 Å²	107	59%	0.586	54%	0.541	S	S	*	.			trans	-85.5	117.1	-170.6	-72.5	136.2	0	0	0	111.8	L86	L81-L86 HydrophobicContact CD2-CD1 3.43Å; L81-L86 VanDerWaalsContact CD2-CD1 3.43Å; L81-L86 HydrophobicContact CD2-CG 4.42Å
82	N	58.6	Low	63.7	Low	107 Å²	107	105.5 Å²	105.5	57%	0.572	54%	0.535	S	S	*	.			trans	-94.5	124.3	164.2	-84.3	-34.3	0	0	0	109.9	Q84 E85	N82-Q84 VanDerWaalsContact C-N 3.26Å; N82-Q84 PolarHBondContact O-N 3.3Å; N82-E85 PolarHBondContact O-N 2.99Å
83	L	62.3	Low	63.8	Low	139 Å²	139	105.4 Å²	105.4	73%	0.728	54%	0.538	S	S	*	.	H	α-helix	trans	-57.8	-33.1	-176.1	-83.1	159.2	0	0	0	114	L86 E87	L83-L86 PolarHBondContact O-N 3.33Å; L83-E87 PolarHBondContact O-N 2.96Å; L83-E87 VanDerWaalsContact O-N 3.13Å
84	Q	62.8	Low	64.4	Low	163 Å²	163	109 Å²	109	76%	0.762	55%	0.554	S	S	*	*	H	α-helix	trans	-68.8	-35.5	-177.6	-75	-179.4	-17.4	0	0	113.6	N82 E87 A88	N82-Q84 VanDerWaalsContact C-N 3.26Å; N82-Q84 PolarHBondContact O-N 3.3Å; Q84-E87 PolarHBondContact O-N 2.93Å; Q84-A88 PolarHBondContact O-N 3.37Å; Q84-A88 VanDerWaalsContact O-N 3.11Å
85	E	63.4	Low	64.7	Low	136 Å²	136	109.4 Å²	109.4	64%	0.636	55%	0.552	S	S	*	*	H	α-helix	trans	-72.1	-34.8	179.4	-71.9	-179	169.7	0	0	111.4	N82 Y89	N82-E85 PolarHBondContact O-N 2.99Å; E85-Y89 WeakPolarHBondContact O-CB 3.47Å; E85-Y89 PolarHBondContact O-N 3.14Å
86	L	64.3	Low	65.1	Low	68 Å²	68	102.7 Å²	102.7	36%	0.356	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-41	173.7	-96.2	164.4	0	0	0	112.5	L77 L81 L83 Y89 R90	L77-L86 HydrophobicContact CD1-CD2 4.28Å; L77-L86 HydrophobicContact CD2-CD2 3.91Å; L77-L86 HydrophobicContact CD2-CG 4.33Å; L81-L86 HydrophobicContact CD2-CD1 3.43Å; L81-L86 VanDerWaalsContact CD2-CD1 3.43Å; L81-L86 HydrophobicContact CD2-CG 4.42Å; L83-L86 PolarHBondContact O-N 3.33Å; L86-Y89 PolarHBondContact O-N 3.19Å; L86-R90 WeakPolarHBondContact O-CB 3.42Å; L86-R90 PolarHBondContact O-N 2.92Å
87	E	68.8	Low	65.6	Low	119 Å²	119	104.3 Å²	104.3	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-63.4	-44.4	175.7	-77.2	-177.1	160.5	0	0	111.5	L83 Q84 Y89 R90 D91	L83-E87 PolarHBondContact O-N 2.96Å; L83-E87 VanDerWaalsContact O-N 3.13Å; Q84-E87 PolarHBondContact O-N 2.93Å; E87-Y89 VanDerWaalsContact C-N 3.34Å; E87-Y89 PolarHBondContact O-N 3.09Å; E87-R90 PolarHBondContact O-N 2.91Å; E87-D91 PolarHBondContact O-N 3.39Å
88	A	68.8	Low	66.2	Low	64 Å²	64	103.8 Å²	103.8	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-39.7	175.7	0	0	0	0	0	112.4	Q84 D91 K92	Q84-A88 PolarHBondContact O-N 3.37Å; Q84-A88 VanDerWaalsContact O-N 3.11Å; A88-D91 PolarHBondContact O-N 3.29Å; A88-K92 PolarHBondContact O-N 3.14Å; A88-K92 VanDerWaalsContact O-N 3.09Å
89	Y	67.7	Low	66.6	Low	99 Å²	99	100.7 Å²	100.7	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-66.9	-42.4	177.3	-158.7	-97.9	0	0	0	112	E73 E85 L86 E87 D91 K92 L93	E73-Y89 PolarHBondContact OE1-OH 3.44Å; E73-Y89 WeakPolarHBondContact OE2-CE1 3.24Å; E73-Y89 PolarHBondContact OE2-OH 3.05Å; E85-Y89 WeakPolarHBondContact O-CB 3.47Å; E85-Y89 PolarHBondContact O-N 3.14Å; L86-Y89 PolarHBondContact O-N 3.19Å; E87-Y89 VanDerWaalsContact C-N 3.34Å; E87-Y89 PolarHBondContact O-N 3.09Å; Y89-D91 VanDerWaalsContact C-N 3.35Å; Y89-D91 PolarHBondContact O-N 3.16Å; Y89-K92 PolarHBondContact O-N 3.47Å; Y89-L93 HydrophobicContact CD1-CD1 3.88Å; Y89-L93 HydrophobicContact CD1-CG 4.42Å; Y89-L93 HydrophobicContact CE1-CD1 3.78Å; Y89-L93 HydrophobicContact CE1-CG 4.27Å; Y89-L93 PolarHBondContact O-N 2.64Å; Y89-L93 VanDerWaalsContact O-N 3.09Å
90	R	71.3	Confident	67.4	Low	135 Å²	135	96.9 Å²	96.9	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-43.6	175.6	-167.9	-157.3	78.1	167.4	-1.6	111.8	L86 E87 K92 L93 K94	L86-R90 WeakPolarHBondContact O-CB 3.42Å; L86-R90 PolarHBondContact O-N 2.92Å; E87-R90 PolarHBondContact O-N 2.91Å; R90-K92 VanDerWaalsContact C-N 3.34Å; R90-L93 PolarHBondContact O-N 3.22Å; R90-K94 PolarHBondContact O-N 2.97Å
91	D	73.8	Confident	68.2	Low	75 Å²	75	94.3 Å²	94.3	40%	0.401	48%	0.479	S	S	.	.	H	α-helix	trans	-71.1	-32.2	-177.9	-71.8	-11.6	0	0	0	111.7	E87 A88 Y89 K94 Q95	E87-D91 PolarHBondContact O-N 3.39Å; A88-D91 PolarHBondContact O-N 3.29Å; Y89-D91 VanDerWaalsContact C-N 3.35Å; Y89-D91 PolarHBondContact O-N 3.16Å; D91-K94 PolarHBondContact O-N 3.18Å; D91-Q95 PolarHBondContact O-N 3.33Å
92	K	72.3	Confident	68.9	Low	110 Å²	110	93.9 Å²	93.9	48%	0.478	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-44.6	169.8	-167	177.6	-178.2	-177.9	0	112.3	A88 Y89 R90 Q95 Q96	A88-K92 PolarHBondContact O-N 3.14Å; A88-K92 VanDerWaalsContact O-N 3.09Å; Y89-K92 PolarHBondContact O-N 3.47Å; R90-K92 VanDerWaalsContact C-N 3.34Å; K92-Q95 PolarHBondContact O-N 3.29Å; K92-Q96 WeakPolarHBondContact O-CG 3.5Å; K92-Q96 PolarHBondContact O-N 3.47Å; K92-Q96 VanDerWaalsContact O-N 3.08Å
93	L	68.7	Low	69.4	Low	69 Å²	69	93.5 Å²	93.5	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-64.4	-38.8	176.3	-75.5	170.8	0	0	0	112.3	Y89 R90 Q95 Q96 Q97	Y89-L93 HydrophobicContact CD1-CD1 3.88Å; Y89-L93 HydrophobicContact CD1-CG 4.42Å; Y89-L93 HydrophobicContact CE1-CD1 3.78Å; Y89-L93 HydrophobicContact CE1-CG 4.27Å; Y89-L93 PolarHBondContact O-N 2.64Å; Y89-L93 VanDerWaalsContact O-N 3.09Å; R90-L93 PolarHBondContact O-N 3.22Å; L93-Q95 PolarHBondContact O-N 2.98Å; L93-Q96 PolarHBondContact O-N 3.01Å; L93-Q97 PolarHBondContact O-N 3.47Å
94	K	73.5	Confident	69.8	Low	111 Å²	111	90.2 Å²	90.2	48%	0.483	45%	0.452	S	S	.	.	H	α-helix	trans	-62.5	-41	174.5	-86.2	-174.3	174.5	-178.6	0	112.6	R90 D91 Q96 Q97 A98	R90-K94 PolarHBondContact O-N 2.97Å; D91-K94 PolarHBondContact O-N 3.18Å; K94-Q96 VanDerWaalsContact C-N 3.35Å; K94-Q97 PolarHBondContact O-N 3.31Å; K94-A98 PolarHBondContact O-N 2.92Å
95	Q	70.5	Confident	70.1	Confident	124 Å²	124	83.1 Å²	83.1	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-64.1	-40.8	175.5	-76.2	-179.4	-10.1	0	0	111.7	D91 K92 L93 A98 A99	D91-Q95 PolarHBondContact O-N 3.33Å; K92-Q95 PolarHBondContact O-N 3.29Å; L93-Q95 PolarHBondContact O-N 2.98Å; Q95-A98 PolarHBondContact O-N 3.32Å; Q95-A99 PolarHBondContact O-N 3.39Å
96	Q	69.9	Low	70.5	Confident	23 Å²	23	81.2 Å²	81.2	11%	0.107	42%	0.415	C	S	.	.	H	α-helix	trans	-63.2	-43.3	175	-74.9	176.8	-14.9	0	0	112.4	L53 S56 I57 K92 L93 K94 A98 A99 V100	L53-Q96 HydrophobicContact CD2-CG 3.34Å; S56-Q96 PolarHBondContact OG-NE2 2.95Å; I57-Q96 HydrophobicContact CD1-CB 3.8Å; I57-Q96 HydrophobicContact CD1-CG 3.93Å; I57-Q96 HydrophobicContact CG1-CB 4.18Å; I57-Q96 VanDerWaalsContact CG1-CD 3.44Å; I57-Q96 HydrophobicContact CG1-CG 3.83Å; K92-Q96 WeakPolarHBondContact O-CG 3.5Å; K92-Q96 PolarHBondContact O-N 3.47Å; K92-Q96 VanDerWaalsContact O-N 3.08Å; L93-Q96 PolarHBondContact O-N 3.01Å; K94-Q96 VanDerWaalsContact C-N 3.35Å; Q96-A98 PolarHBondContact O-N 3.08Å; Q96-A99 PolarHBondContact O-N 3.11Å; Q96-V100 WeakPolarHBondContact O-CG2 3.43Å; Q96-V100 PolarHBondContact O-N 3.44Å; Q96-V100 VanDerWaalsContact O-N 3.16Å
97	Q	71.8	Confident	70.8	Confident	129 Å²	129	82 Å²	82	60%	0.603	42%	0.419	S	S	*	.	H	α-helix	trans	-61.2	-44.9	176.8	-174.1	-177	6.7	0	0	111.9	L93 K94 A99 V100 S101	L93-Q97 PolarHBondContact O-N 3.47Å; K94-Q97 PolarHBondContact O-N 3.31Å; Q97-A99 VanDerWaalsContact C-N 3.34Å; Q97-A99 PolarHBondContact O-N 3.29Å; Q97-V100 PolarHBondContact O-N 3.05Å; Q97-S101 PolarHBondContact O-N 3.25Å; Q97-S101 PolarHBondContact O-OG 3.22Å
98	A	73.7	Confident	70.6	Confident	64 Å²	64	81.7 Å²	81.7	53%	0.529	42%	0.42	S	S	.	.	H	α-helix	trans	-60.6	-42	-179.7	0	0	0	0	0	112.2	K94 Q95 Q96 K102	K94-A98 PolarHBondContact O-N 2.92Å; Q95-A98 PolarHBondContact O-N 3.32Å; Q96-A98 PolarHBondContact O-N 3.08Å; A98-K102 PolarHBondContact O-N 3.1Å
99	A	70.1	Confident	70.7	Confident	12 Å²	12	83.1 Å²	83.1	10%	0.099	42%	0.418	C	S	.	.	H	α-helix	trans	-65.6	-41	177.4	0	0	0	0	0	112.5	I54 Q95 Q96 Q97 K103	I54-A99 HydrophobicContact CD1-CB 4.12Å; I54-A99 HydrophobicContact CG1-CB 4.08Å; Q95-A99 PolarHBondContact O-N 3.39Å; Q96-A99 PolarHBondContact O-N 3.11Å; Q97-A99 VanDerWaalsContact C-N 3.34Å; Q97-A99 PolarHBondContact O-N 3.29Å; A99-K103 PolarHBondContact O-N 3.38Å
100	V	72	Confident	70.8	Confident	51 Å²	51	85.7 Å²	85.7	31%	0.309	43%	0.434	S	S	.	.	H	α-helix	trans	-68.3	-44.4	178.5	174.8	0	0	0	0	111.5	I54 I57 Q96 Q97 K102 K103 V104	I54-V100 HydrophobicContact CG1-CG2 4.43Å; I57-V100 HydrophobicContact CD1-CG2 4.14Å; Q96-V100 WeakPolarHBondContact O-CG2 3.43Å; Q96-V100 PolarHBondContact O-N 3.44Å; Q96-V100 VanDerWaalsContact O-N 3.16Å; Q97-V100 PolarHBondContact O-N 3.05Å; V100-K102 VanDerWaalsContact C-N 3.29Å; V100-K102 PolarHBondContact O-N 3.43Å; V100-K103 PolarHBondContact O-N 2.97Å; V100-V104 HydrophobicContact CG1-CG2 4.23Å; V100-V104 WeakPolarHBondContact O-CG2 3.4Å; V100-V104 PolarHBondContact O-N 3.39Å
101	S	71	Confident	70.8	Confident	71 Å²	71	86.1 Å²	86.1	50%	0.497	44%	0.44	S	S	.	.	H	α-helix	trans	-60.1	-39.1	179.4	-67.2	0	0	0	0	112.5	Q97 A105	Q97-S101 PolarHBondContact O-N 3.25Å; Q97-S101 PolarHBondContact O-OG 3.22Å; S101-A105 PolarHBondContact O-N 2.54Å; S101-A105 VanDerWaalsContact O-N 3.11Å
102	K	72.8	Confident	70.4	Confident	103 Å²	103	87.7 Å²	87.7	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-64.7	-44.2	177.5	-162	175.7	179.1	-176.7	0	111.8	A98 V100 A105 D106	A98-K102 PolarHBondContact O-N 3.1Å; V100-K102 VanDerWaalsContact C-N 3.29Å; V100-K102 PolarHBondContact O-N 3.43Å; K102-A105 PolarHBondContact O-N 3.48Å; K102-D106 PolarHBondContact O-N 3.31Å; K102-D106 VanDerWaalsContact O-N 3.16Å
103	K	68.4	Low	70.5	Confident	98 Å²	98	87.1 Å²	87.1	43%	0.426	45%	0.452	S	S	.	.	H	α-helix	trans	-69.5	-33.9	179.2	-161.5	173.1	-175.8	176.7	0	113.5	I54 A99 V100 D106 L107	I54-K103 HydrophobicContact CD1-CD 4.19Å; A99-K103 PolarHBondContact O-N 3.38Å; V100-K103 PolarHBondContact O-N 2.97Å; K103-D106 PolarHBondContact O-N 2.94Å; K103-L107 PolarHBondContact O-N 3.35Å; K103-L107 VanDerWaalsContact O-N 3.08Å
104	V	70.8	Confident	70.7	Confident	71 Å²	71	86.8 Å²	86.8	43%	0.43	46%	0.459	S	S	.	.	H	α-helix	trans	-67.5	-40.1	174.2	170.8	0	0	0	0	110.8	V100 D106 L107 I108	V100-V104 HydrophobicContact CG1-CG2 4.23Å; V100-V104 WeakPolarHBondContact O-CG2 3.4Å; V100-V104 PolarHBondContact O-N 3.39Å; V104-D106 VanDerWaalsContact C-N 3.34Å; V104-D106 PolarHBondContact O-N 3.42Å; V104-L107 PolarHBondContact O-N 3.43Å; V104-I108 HydrophobicContact CG1-CD1 3.64Å; V104-I108 HydrophobicContact CG1-CG1 4.28Å; V104-I108 VanDerWaalsContact O-CG1 3.24Å; V104-I108 WeakPolarHBondContact O-CG1 3.27Å; V104-I108 PolarHBondContact O-N 3.48Å
105	A	69.1	Low	70.5	Confident	14 Å²	14	89.2 Å²	89.2	12%	0.116	47%	0.466	C	S	.	.	H	α-helix	trans	-61.2	-42.4	175.5	0	0	0	0	0	112.2	F37 S101 K102 I108 L109	F37-A105 HydrophobicContact CD1-CB 4.25Å; F37-A105 HydrophobicContact CE1-CB 3.36Å; F37-A105 HydrophobicContact CZ-CB 3.9Å; S101-A105 PolarHBondContact O-N 2.54Å; S101-A105 VanDerWaalsContact O-N 3.11Å; K102-A105 PolarHBondContact O-N 3.48Å; A105-I108 PolarHBondContact O-N 3.41Å; A105-L109 PolarHBondContact O-N 3.1Å
106	D	71.4	Confident	70.9	Confident	96 Å²	96	87 Å²	87	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-64.4	-41.5	176.4	-70.4	-25.2	0	0	0	112.2	K102 K103 V104 I108 L109 E110	K102-D106 PolarHBondContact O-N 3.31Å; K102-D106 VanDerWaalsContact O-N 3.16Å; K103-D106 PolarHBondContact O-N 2.94Å; V104-D106 VanDerWaalsContact C-N 3.34Å; V104-D106 PolarHBondContact O-N 3.42Å; D106-I108 PolarHBondContact O-N 3.27Å; D106-L109 PolarHBondContact O-N 3.33Å; D106-E110 PolarHBondContact O-N 3.17Å
107	L	70.2	Confident	71.3	Confident	83 Å²	83	93.1 Å²	93.1	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-65.9	-34.6	175.8	-88.3	160.8	0	0	0	113.5	K103 V104 K111	K103-L107 PolarHBondContact O-N 3.35Å; K103-L107 VanDerWaalsContact O-N 3.08Å; V104-L107 PolarHBondContact O-N 3.43Å; L107-K111 PolarHBondContact O-N 3.33Å; L107-K111 VanDerWaalsContact O-N 3.11Å
108	I	65.9	Low	71.6	Confident	113 Å²	113	91.6 Å²	91.6	58%	0.579	48%	0.48	S	S	*	.	H	α-helix	trans	-70.8	-38.5	175.9	-69.4	168.4	0	0	0	110.3	V104 A105 D106 K111 Q112	V104-I108 HydrophobicContact CG1-CD1 3.64Å; V104-I108 HydrophobicContact CG1-CG1 4.28Å; V104-I108 VanDerWaalsContact O-CG1 3.24Å; V104-I108 WeakPolarHBondContact O-CG1 3.27Å; V104-I108 PolarHBondContact O-N 3.48Å; A105-I108 PolarHBondContact O-N 3.41Å; D106-I108 PolarHBondContact O-N 3.27Å; I108-K111 PolarHBondContact O-N 3.16Å; I108-Q112 PolarHBondContact O-N 3.1Å; I108-Q112 VanDerWaalsContact O-N 3.1Å
109	L	69.7	Low	71.8	Confident	94 Å²	94	93 Å²	93	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-40.7	173.6	-93.5	152.4	0	0	0	112.1	A105 D106	A105-L109 PolarHBondContact O-N 3.1Å; D106-L109 PolarHBondContact O-N 3.33Å
110	E	70.9	Confident	72.3	Confident	154 Å²	154	98.5 Å²	98.5	72%	0.72	50%	0.502	S	S	*	.	H	α-helix	trans	-65.8	-36.5	174.9	-85	-170.1	149.3	0	0	113.3	D106	D106-E110 PolarHBondContact O-N 3.17Å
111	K	69.6	Low	72.7	Confident	144 Å²	144	103.2 Å²	103.2	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-95.9	6.2	-175.9	-70.6	-172	179	179.2	0	115.5	L107 I108 A114 Y115	L107-K111 PolarHBondContact O-N 3.33Å; L107-K111 VanDerWaalsContact O-N 3.11Å; I108-K111 PolarHBondContact O-N 3.16Å; K111-A114 PolarHBondContact O-N 3.09Å; K111-A114 VanDerWaalsContact O-N 3.1Å; K111-Y115 PolarHBondContact O-N 3.17Å
112	Q	67.3	Low	73.3	Confident	108 Å²	108	104.1 Å²	104.1	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-49.2	-40.7	178.9	-156.6	176.8	6.3	0	0	115.4	I108 A114 Y115 V116	I108-Q112 PolarHBondContact O-N 3.1Å; I108-Q112 VanDerWaalsContact O-N 3.1Å; Q112-A114 PolarHBondContact O-N 2.83Å; Q112-Y115 PolarHBondContact O-N 3.26Å; Q112-V116 PolarHBondContact O-N 2.92Å
113	P	72.6	Confident	73.7	Confident	97 Å²	97	102.4 Å²	102.4	63%	0.63	52%	0.515	S	S	*	.	H	α-helix	trans	-69.5	-29.1	179.6	24.1	-32.5	0	0	0	114.2	K117	P113-K117 PolarHBondContact O-N 2.96Å
114	A	72.9	Confident	74.3	Confident	62 Å²	62	101 Å²	101	51%	0.512	52%	0.517	S	S	.	.	H	α-helix	trans	-71.6	-35.9	176.7	0	0	0	0	0	111.7	K111 Q112 K117 E118	K111-A114 PolarHBondContact O-N 3.09Å; K111-A114 VanDerWaalsContact O-N 3.1Å; Q112-A114 PolarHBondContact O-N 2.83Å; A114-K117 PolarHBondContact O-N 3.32Å; A114-E118 PolarHBondContact O-N 3.23Å; A114-E118 VanDerWaalsContact O-N 3.17Å
115	Y	70.9	Confident	74.9	Confident	162 Å²	162	102.8 Å²	102.8	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-44.8	176.8	-178.8	-101.3	0	0	0	112.2	K111 Q112 K117 E118 L119	K111-Y115 PolarHBondContact O-N 3.17Å; Q112-Y115 PolarHBondContact O-N 3.26Å; Y115-K117 VanDerWaalsContact C-N 3.29Å; Y115-K117 PolarHBondContact O-N 3.22Å; Y115-E118 PolarHBondContact O-N 3.01Å; Y115-L119 HydrophobicContact CE1-CD1 3.87Å; Y115-L119 PolarHBondContact O-N 3.28Å
116	V	77.6	Confident	75.5	Confident	78 Å²	78	107.8 Å²	107.8	47%	0.473	55%	0.545	S	S	.	.	H	α-helix	trans	-61.4	-39.4	177.6	176.1	0	0	0	0	111.2	Q112 L119 E120	Q112-V116 PolarHBondContact O-N 2.92Å; V116-L119 WeakPolarHBondContact O-CB 3.37Å; V116-L119 PolarHBondContact O-N 3.47Å; V116-E120 PolarHBondContact O-N 3.31Å
117	K	79.4	Confident	76	Confident	151 Å²	151	106.9 Å²	106.9	66%	0.657	54%	0.543	S	S	*	.	H	α-helix	trans	-66.5	-38.6	179.1	-164.4	175.8	-176.5	178.6	0	113	P113 A114 Y115 R121	P113-K117 PolarHBondContact O-N 2.96Å; A114-K117 PolarHBondContact O-N 3.32Å; Y115-K117 VanDerWaalsContact C-N 3.29Å; Y115-K117 PolarHBondContact O-N 3.22Å; K117-R121 WeakPolarHBondContact O-CB 3.3Å; K117-R121 PolarHBondContact O-N 3.32Å
118	E	77	Confident	76.8	Confident	98 Å²	98	104.7 Å²	104.7	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-71	-33.8	173.7	-73.7	-60	145.6	0	0	111.7	A114 Y115 R121 V122	A114-E118 PolarHBondContact O-N 3.23Å; A114-E118 VanDerWaalsContact O-N 3.17Å; Y115-E118 PolarHBondContact O-N 3.01Å; E118-R121 PolarHBondContact O-N 3.43Å; E118-R121 IonicContact OE1-NH1 3.69Å; E118-R121 IonicContact OE2-NH1 2.71Å; E118-V122 VanDerWaalsContact O-CG2 3.3Å; E118-V122 WeakPolarHBondContact O-CG2 3.38Å; E118-V122 PolarHBondContact O-N 3.17Å
119	L	77.8	Confident	77.6	Confident	92 Å²	92	105.2 Å²	105.2	48%	0.482	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-44.1	174.8	-149.7	115.9	0	0	0	111.7	Y115 V116 R121 V122 T123	Y115-L119 HydrophobicContact CE1-CD1 3.87Å; Y115-L119 PolarHBondContact O-N 3.28Å; V116-L119 WeakPolarHBondContact O-CB 3.37Å; V116-L119 PolarHBondContact O-N 3.47Å; L119-R121 VanDerWaalsContact C-N 3.33Å; L119-R121 PolarHBondContact O-N 3.03Å; L119-V122 PolarHBondContact O-N 3.25Å; L119-T123 PolarHBondContact O-N 3.3Å; L119-T123 PolarHBondContact O-OG1 2.84Å
120	E	80.8	Confident	78.2	Confident	128 Å²	128	106.5 Å²	106.5	60%	0.598	55%	0.547	S	S	*	.	H	α-helix	trans	-59.1	-44.5	172.6	-84.1	-172.9	159.8	0	0	111.6	V116 V122 T123 S124	V116-E120 PolarHBondContact O-N 3.31Å; E120-V122 PolarHBondContact O-N 2.78Å; E120-T123 VanDerWaalsContact CA-OG1 3.28Å; E120-T123 WeakPolarHBondContact CA-OG1 3.46Å; E120-T123 PolarHBondContact O-N 3.07Å; E120-T123 PolarHBondContact O-OG1 3.05Å; E120-S124 WeakPolarHBondContact O-CB 3.28Å; E120-S124 PolarHBondContact O-N 3.38Å
121	R	80.8	Confident	78.8	Confident	151 Å²	151	104.4 Å²	104.4	57%	0.57	54%	0.54	S	S	*	.	H	α-helix	trans	-61.2	-44.4	178	-171	177.6	160.9	-173.1	-4.5	111.5	K117 E118 L119 S124 L125	K117-R121 WeakPolarHBondContact O-CB 3.3Å; K117-R121 PolarHBondContact O-N 3.32Å; E118-R121 PolarHBondContact O-N 3.43Å; E118-R121 IonicContact OE1-NH1 3.69Å; E118-R121 IonicContact OE2-NH1 2.71Å; L119-R121 VanDerWaalsContact C-N 3.33Å; L119-R121 PolarHBondContact O-N 3.03Å; R121-S124 PolarHBondContact O-N 2.92Å; R121-S124 PolarHBondContact O-OG 3.24Å; R121-L125 WeakPolarHBondContact O-CB 3.43Å; R121-L125 PolarHBondContact O-N 3.47Å
122	V	83	Confident	79.5	Confident	90 Å²	90	100 Å²	100	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-62.2	-44.8	175.8	171.4	0	0	0	0	111.3	E118 L119 E120 S124 L125 Q126	E118-V122 VanDerWaalsContact O-CG2 3.3Å; E118-V122 WeakPolarHBondContact O-CG2 3.38Å; E118-V122 PolarHBondContact O-N 3.17Å; L119-V122 PolarHBondContact O-N 3.25Å; E120-V122 PolarHBondContact O-N 2.78Å; V122-S124 PolarHBondContact O-N 2.94Å; V122-L125 PolarHBondContact O-N 3.46Å; V122-Q126 WeakPolarHBondContact O-CB 3.45Å; V122-Q126 PolarHBondContact O-N 2.89Å
123	T	81.6	Confident	80.3	Confident	67 Å²	67	97.4 Å²	97.4	41%	0.411	53%	0.528	S	S	.	.	H	α-helix	trans	-63.8	-39.6	175.5	43.9	0	0	0	0	112.7	L119 E120 L125 Q126 T127	L119-T123 PolarHBondContact O-N 3.3Å; L119-T123 PolarHBondContact O-OG1 2.84Å; E120-T123 VanDerWaalsContact CA-OG1 3.28Å; E120-T123 WeakPolarHBondContact CA-OG1 3.46Å; E120-T123 PolarHBondContact O-N 3.07Å; E120-T123 PolarHBondContact O-OG1 3.05Å; T123-L125 VanDerWaalsContact C-N 3.31Å; T123-L125 PolarHBondContact O-N 3.11Å; T123-Q126 PolarHBondContact O-N 3.42Å; T123-T127 WeakPolarHBondContact O-CG2 3.45Å; T123-T127 PolarHBondContact O-N 2.82Å; T123-T127 PolarHBondContact O-OG1 3.4Å
124	S	82.1	Confident	80.9	Confident	68 Å²	68	96.4 Å²	96.4	48%	0.476	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-37	175.6	77.6	0	0	0	0	111.9	E120 R121 V122 T127 G128	E120-S124 WeakPolarHBondContact O-CB 3.28Å; E120-S124 PolarHBondContact O-N 3.38Å; R121-S124 PolarHBondContact O-N 2.92Å; R121-S124 PolarHBondContact O-OG 3.24Å; V122-S124 PolarHBondContact O-N 2.94Å; S124-T127 WeakPolarHBondContact CA-OG1 3.45Å; S124-T127 PolarHBondContact O-OG1 2.89Å; S124-G128 PolarHBondContact O-N 2.93Å
125	L	83.3	Confident	81.4	Confident	109 Å²	109	98.7 Å²	98.7	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-69.7	-40.2	177.6	-145.1	115.8	0	0	0	111	R121 V122 T123 G128 L129	R121-L125 WeakPolarHBondContact O-CB 3.43Å; R121-L125 PolarHBondContact O-N 3.47Å; V122-L125 PolarHBondContact O-N 3.46Å; T123-L125 VanDerWaalsContact C-N 3.31Å; T123-L125 PolarHBondContact O-N 3.11Å; L125-G128 PolarHBondContact O-N 2.74Å; L125-L129 WeakPolarHBondContact O-CB 3.42Å; L125-L129 PolarHBondContact O-N 3.41Å
126	Q	79.8	Confident	82	Confident	118 Å²	118	94.7 Å²	94.7	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-44.3	176.4	-171.7	174.8	-2.4	0	0	111.9	V122 T123 L129 Q130	V122-Q126 WeakPolarHBondContact O-CB 3.45Å; V122-Q126 PolarHBondContact O-N 2.89Å; T123-Q126 PolarHBondContact O-N 3.42Å; Q126-L129 PolarHBondContact O-N 2.94Å; Q126-Q130 PolarHBondContact O-N 2.9Å
127	T	83.2	Confident	82.3	Confident	78 Å²	78	95 Å²	95	48%	0.479	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-40.6	175.3	56.4	0	0	0	0	112.2	T123 S124 L129 Q130 L131	T123-T127 WeakPolarHBondContact O-CG2 3.45Å; T123-T127 PolarHBondContact O-N 2.82Å; T123-T127 PolarHBondContact O-OG1 3.4Å; S124-T127 WeakPolarHBondContact CA-OG1 3.45Å; S124-T127 PolarHBondContact O-OG1 2.89Å; T127-L129 PolarHBondContact O-N 3.36Å; T127-Q130 PolarHBondContact O-N 3.49Å; T127-L131 PolarHBondContact O-N 2.96Å
128	G	86.8	Confident	82.5	Confident	37 Å²	37	91.6 Å²	91.6	38%	0.381	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-40.3	174	0	0	0	0	0	112.9	S124 L125 L131 A132	S124-G128 PolarHBondContact O-N 2.93Å; L125-G128 PolarHBondContact O-N 2.74Å; G128-L131 PolarHBondContact O-N 3.41Å; G128-A132 WeakPolarHBondContact O-CB 3.44Å; G128-A132 PolarHBondContact O-N 2.96Å
129	L	83.1	Confident	82.8	Confident	123 Å²	123	88.7 Å²	88.7	64%	0.644	50%	0.504	S	S	*	.	H	α-helix	trans	-66.1	-40.8	177.1	-135.5	104	0	0	0	111.8	L125 Q126 T127 A132 A133	L125-L129 WeakPolarHBondContact O-CB 3.42Å; L125-L129 PolarHBondContact O-N 3.41Å; Q126-L129 PolarHBondContact O-N 2.94Å; T127-L129 PolarHBondContact O-N 3.36Å; L129-A132 PolarHBondContact O-N 3.48Å; L129-A133 WeakPolarHBondContact O-CB 3.47Å; L129-A133 PolarHBondContact O-N 3.29Å
130	Q	81.2	Confident	83.1	Confident	122 Å²	122	93.7 Å²	93.7	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-44.8	174.7	-84.3	179.8	-23.8	0	0	111.9	Q126 T127 A132 A133 V134	Q126-Q130 PolarHBondContact O-N 2.9Å; T127-Q130 PolarHBondContact O-N 3.49Å; Q130-A132 PolarHBondContact O-N 3.47Å; Q130-A133 PolarHBondContact O-N 2.95Å; Q130-V134 WeakPolarHBondContact O-CG2 3.4Å; Q130-V134 PolarHBondContact O-N 3.45Å
131	L	84.3	Confident	83.1	Confident	109 Å²	109	95.9 Å²	95.9	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-60.4	-44.7	175.4	-100.5	159.4	0	0	0	111.8	T127 G128 A133 V134 I135	T127-L131 PolarHBondContact O-N 2.96Å; G128-L131 PolarHBondContact O-N 3.41Å; L131-A133 PolarHBondContact O-N 3.48Å; L131-V134 PolarHBondContact O-N 2.92Å; L131-I135 HydrophobicContact CD2-CD1 4.46Å; L131-I135 WeakPolarHBondContact O-CB 3.33Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.3Å; L131-I135 PolarHBondContact O-N 3.27Å
132	A	84.2	Confident	83.1	Confident	51 Å²	51	94.8 Å²	94.8	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-62	-42.1	176.7	0	0	0	0	0	111.9	G128 L129 Q130 V134 I135 C136	G128-A132 WeakPolarHBondContact O-CB 3.44Å; G128-A132 PolarHBondContact O-N 2.96Å; L129-A132 PolarHBondContact O-N 3.48Å; Q130-A132 PolarHBondContact O-N 3.47Å; A132-V134 PolarHBondContact O-N 2.87Å; A132-I135 PolarHBondContact O-N 3.41Å; A132-C136 WeakPolarHBondContact O-CB 3.32Å; A132-C136 PolarHBondContact O-N 2.83Å; A132-C136 PolarHBondContact O-SG 3.17Å
133	A	83.6	Confident	83	Confident	54 Å²	54	96.6 Å²	96.6	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-41.6	175.9	0	0	0	0	0	112.1	L129 Q130 L131 T137	L129-A133 WeakPolarHBondContact O-CB 3.47Å; L129-A133 PolarHBondContact O-N 3.29Å; Q130-A133 PolarHBondContact O-N 2.95Å; L131-A133 PolarHBondContact O-N 3.48Å; A133-T137 WeakPolarHBondContact O-CB 3.39Å; A133-T137 WeakPolarHBondContact O-CG2 3.26Å; A133-T137 PolarHBondContact O-N 3.08Å; A133-T137 PolarHBondContact O-OG1 2.96Å
134	V	86.3	Confident	82.8	Confident	77 Å²	77	98 Å²	98	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-42	175.8	173.3	0	0	0	0	111.3	Q130 L131 A132 T137 N138	Q130-V134 WeakPolarHBondContact O-CG2 3.4Å; Q130-V134 PolarHBondContact O-N 3.45Å; L131-V134 PolarHBondContact O-N 2.92Å; A132-V134 PolarHBondContact O-N 2.87Å; V134-T137 VanDerWaalsContact CA-OG1 3.3Å; V134-T137 WeakPolarHBondContact CA-OG1 3.25Å; V134-T137 PolarHBondContact O-N 3.48Å; V134-T137 PolarHBondContact O-OG1 2.73Å; V134-N138 VanDerWaalsContact O-CB 3.26Å; V134-N138 WeakPolarHBondContact O-CB 3.38Å; V134-N138 VanDerWaalsContact O-CG 3.3Å; V134-N138 PolarHBondContact O-N 3.42Å; V134-N138 PolarHBondContact O-ND2 2.85Å
135	I	83.4	Confident	82.6	Confident	109 Å²	109	99.1 Å²	99.1	56%	0.559	53%	0.532	S	S	*	.	H	α-helix	trans	-66.5	-42.8	177.8	-68.6	165.9	0	0	0	110.8	L131 A132 G139	L131-I135 HydrophobicContact CD2-CD1 4.46Å; L131-I135 WeakPolarHBondContact O-CB 3.33Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.3Å; L131-I135 PolarHBondContact O-N 3.27Å; A132-I135 PolarHBondContact O-N 3.41Å; I135-G139 PolarHBondContact O-N 3.33Å
136	C	83.4	Confident	82.2	Confident	78 Å²	78	96.9 Å²	96.9	53%	0.527	53%	0.528	S	S	.	.	H	α-helix	trans	-66.9	-39.3	177.4	-72.2	0	0	0	0	112.5	A132 R140	A132-C136 WeakPolarHBondContact O-CB 3.32Å; A132-C136 PolarHBondContact O-N 2.83Å; A132-C136 PolarHBondContact O-SG 3.17Å; C136-R140 WeakPolarHBondContact O-CB 3.48Å; C136-R140 WeakPolarHBondContact O-CG 3.44Å; C136-R140 PolarHBondContact O-N 3.36Å
137	T	83.1	Confident	82	Confident	84 Å²	84	97.6 Å²	97.6	52%	0.515	53%	0.53	S	S	.	.	H	α-helix	trans	-68.6	-43.7	176.6	46.2	0	0	0	0	111.5	A133 V134 R140 R141	A133-T137 WeakPolarHBondContact O-CB 3.39Å; A133-T137 WeakPolarHBondContact O-CG2 3.26Å; A133-T137 PolarHBondContact O-N 3.08Å; A133-T137 PolarHBondContact O-OG1 2.96Å; V134-T137 VanDerWaalsContact CA-OG1 3.3Å; V134-T137 WeakPolarHBondContact CA-OG1 3.25Å; V134-T137 PolarHBondContact O-N 3.48Å; V134-T137 PolarHBondContact O-OG1 2.73Å; T137-R140 PolarHBondContact O-N 2.78Å; T137-R141 WeakPolarHBondContact O-CB 3.49Å; T137-R141 PolarHBondContact O-N 2.89Å
138	N	84	Confident	81.4	Confident	80 Å²	80	99.4 Å²	99.4	43%	0.428	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-43	173.7	-75.3	-20.3	0	0	0	111.9	V134 R140 R141 H142	V134-N138 VanDerWaalsContact O-CB 3.26Å; V134-N138 WeakPolarHBondContact O-CB 3.38Å; V134-N138 VanDerWaalsContact O-CG 3.3Å; V134-N138 PolarHBondContact O-N 3.42Å; V134-N138 PolarHBondContact O-ND2 2.85Å; N138-R140 PolarHBondContact O-N 2.93Å; N138-R141 WeakPolarHBondContact O-CB 3.37Å; N138-R141 PolarHBondContact O-N 3.47Å; N138-H142 PolarHBondContact O-CD2 3.32Å; N138-H142 PolarHBondContact O-N 2.93Å
139	G	83.7	Confident	80.7	Confident	37 Å²	37	99.4 Å²	99.4	38%	0.381	53%	0.532	S	S	.	.	H	α-helix	trans	-58.1	-47.6	175.1	0	0	0	0	0	112.1	I135 R141 H142 L143	I135-G139 PolarHBondContact O-N 3.33Å; G139-R141 VanDerWaalsContact C-N 3.33Å; G139-R141 PolarHBondContact O-N 2.91Å; G139-H142 PolarHBondContact O-N 2.95Å; G139-L143 WeakPolarHBondContact O-CB 3.25Å; G139-L143 PolarHBondContact O-N 2.85Å
140	R	83.1	Confident	80	Confident	197 Å²	197	101 Å²	101	74%	0.743	54%	0.535	S	S	*	.	H	α-helix	trans	-61.6	-39.8	174.4	-76.1	179	-179.5	-177	1.4	112.3	C136 T137 N138 L143 N144	C136-R140 WeakPolarHBondContact O-CB 3.48Å; C136-R140 WeakPolarHBondContact O-CG 3.44Å; C136-R140 PolarHBondContact O-N 3.36Å; T137-R140 PolarHBondContact O-N 2.78Å; N138-R140 PolarHBondContact O-N 2.93Å; R140-L143 PolarHBondContact O-N 3.34Å; R140-N144 WeakPolarHBondContact O-CB 3.34Å; R140-N144 PolarHBondContact O-N 3.47Å
141	R	81.8	Confident	79.3	Confident	175 Å²	175	98.7 Å²	98.7	66%	0.66	53%	0.529	S	S	*	.	H	α-helix	trans	-64.6	-46.4	176.9	-171.9	177.9	176	138.6	0.9	111.6	T137 N138 G139 L143 N144 I145	T137-R141 WeakPolarHBondContact O-CB 3.49Å; T137-R141 PolarHBondContact O-N 2.89Å; N138-R141 WeakPolarHBondContact O-CB 3.37Å; N138-R141 PolarHBondContact O-N 3.47Å; G139-R141 VanDerWaalsContact C-N 3.33Å; G139-R141 PolarHBondContact O-N 2.91Å; R141-L143 VanDerWaalsContact C-N 3.33Å; R141-L143 PolarHBondContact O-N 3.44Å; R141-N144 PolarHBondContact O-N 2.94Å; R141-I145 HydrophobicContact CG-CD1 3.95Å; R141-I145 VanDerWaalsContact O-CG1 3.25Å; R141-I145 WeakPolarHBondContact O-CG1 3.37Å; R141-I145 PolarHBondContact O-N 3.44Å
142	H	81.5	Confident	78.4	Confident	128 Å²	128	100.5 Å²	100.5	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-39	176.4	-76.2	-63	0	0	0	112.3	N138 G139 I145 A146	N138-H142 PolarHBondContact O-CD2 3.32Å; N138-H142 PolarHBondContact O-N 2.93Å; G139-H142 PolarHBondContact O-N 2.95Å; H142-I145 PolarHBondContact O-N 3.23Å; H142-A146 WeakPolarHBondContact O-CB 3.34Å; H142-A146 PolarHBondContact O-N 2.93Å
143	L	79.6	Confident	77.6	Confident	128 Å²	128	100.8 Å²	100.8	67%	0.67	54%	0.537	S	S	*	.	H	α-helix	trans	-69.2	-36.6	178.1	-139.9	142.3	0	0	0	111.8	G139 R140 R141 K147	G139-L143 WeakPolarHBondContact O-CB 3.25Å; G139-L143 PolarHBondContact O-N 2.85Å; R140-L143 PolarHBondContact O-N 3.34Å; R141-L143 VanDerWaalsContact C-N 3.33Å; R141-L143 PolarHBondContact O-N 3.44Å; L143-K147 VanDerWaalsContact O-CB 3.31Å; L143-K147 WeakPolarHBondContact O-CB 3.25Å; L143-K147 PolarHBondContact O-N 2.86Å
144	N	78.3	Confident	76.9	Confident	97 Å²	97	100.5 Å²	100.5	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-44	170.4	-98.7	-4	0	0	0	112.4	R140 R141 A146 K147 E148	R140-N144 WeakPolarHBondContact O-CB 3.34Å; R140-N144 PolarHBondContact O-N 3.47Å; R141-N144 PolarHBondContact O-N 2.94Å; N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 2.86Å; N144-K147 PolarHBondContact O-N 3.36Å; N144-E148 WeakPolarHBondContact O-CG 3.37Å; N144-E148 PolarHBondContact O-N 2.9Å
145	I	77.3	Confident	76.3	Confident	91 Å²	91	102.3 Å²	102.3	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-41.2	176.5	-68.5	164.5	0	0	0	110.7	R141 H142 G149	R141-I145 HydrophobicContact CG-CD1 3.95Å; R141-I145 VanDerWaalsContact O-CG1 3.25Å; R141-I145 WeakPolarHBondContact O-CG1 3.37Å; R141-I145 PolarHBondContact O-N 3.44Å; H142-I145 PolarHBondContact O-N 3.23Å; I145-G149 PolarHBondContact O-N 2.88Å
146	A	73.9	Confident	75.8	Confident	61 Å²	61	98.4 Å²	98.4	50%	0.504	52%	0.524	S	S	.	.	H	α-helix	trans	-66.5	-39.7	176	0	0	0	0	0	112	H142 N144 F150	H142-A146 WeakPolarHBondContact O-CB 3.34Å; H142-A146 PolarHBondContact O-N 2.93Å; N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 2.86Å; A146-F150 VanDerWaalsContact O-CB 3.25Å; A146-F150 WeakPolarHBondContact O-CB 3.48Å; A146-F150 PolarHBondContact O-N 3.43Å
147	K	75.8	Confident	75.4	Confident	133 Å²	133	100.1 Å²	100.1	58%	0.578	53%	0.528	S	S	*	.	H	α-helix	trans	-63.2	-48.5	174.8	-175.3	-178.8	176.1	-175.4	0	111.4	L143 N144 F150 T151	L143-K147 VanDerWaalsContact O-CB 3.31Å; L143-K147 WeakPolarHBondContact O-CB 3.25Å; L143-K147 PolarHBondContact O-N 2.86Å; N144-K147 PolarHBondContact O-N 3.36Å; K147-F150 PolarHBondContact O-N 3.2Å; K147-T151 WeakPolarHBondContact O-CB 3.47Å; K147-T151 PolarHBondContact O-N 2.6Å; K147-T151 PolarHBondContact O-OG1 2.78Å
148	E	72.4	Confident	75.1	Confident	117 Å²	117	101.7 Å²	101.7	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-43.9	177.3	-73.8	178.9	172	0	0	111.4	N144 Q152	N144-E148 WeakPolarHBondContact O-CG 3.37Å; N144-E148 PolarHBondContact O-N 2.9Å; E148-Q152 WeakPolarHBondContact O-CA 3.31Å; E148-Q152 WeakPolarHBondContact O-CB 3.29Å; E148-Q152 PolarHBondContact O-N 3.48Å
149	G	70.4	Confident	74.7	Confident	36 Å²	36	100.7 Å²	100.7	37%	0.371	54%	0.536	S	S	.	.	I	π-helix	trans	-61.3	-45.7	175.9	0	0	0	0	0	113.1	I145 A153 S154	I145-G149 PolarHBondContact O-N 2.88Å; G149-A153 WeakPolarHBondContact O-CB 3.26Å; G149-A153 PolarHBondContact O-N 3.25Å; G149-S154 PolarHBondContact O-N 3.47Å
150	F	68	Low	74.5	Confident	157 Å²	157	104.1 Å²	104.1	69%	0.689	55%	0.545	S	S	*	.	I	π-helix	trans	-80.1	-32.6	-175.9	-162.1	-92.1	0	0	0	113.3	A146 K147 S154	A146-F150 VanDerWaalsContact O-CB 3.25Å; A146-F150 WeakPolarHBondContact O-CB 3.48Å; A146-F150 PolarHBondContact O-N 3.43Å; K147-F150 PolarHBondContact O-N 3.2Å; F150-S154 VanDerWaalsContact CA-OG 3.26Å; F150-S154 WeakPolarHBondContact CA-OG 3.16Å; F150-S154 PolarHBondContact O-OG 2.9Å
151	T	67.5	Low	74.2	Confident	73 Å²	73	100.5 Å²	100.5	45%	0.448	54%	0.537	S	S	.	.	I	π-helix	trans	-91.3	-36.2	-178.4	58.7	0	0	0	0	113	K147 L155	K147-T151 WeakPolarHBondContact O-CB 3.47Å; K147-T151 PolarHBondContact O-N 2.6Å; K147-T151 PolarHBondContact O-OG1 2.78Å; T151-L155 WeakPolarHBondContact O-CB 3.37Å
152	Q	66.1	Low	74.1	Confident	148 Å²	148	100.7 Å²	100.7	69%	0.692	54%	0.537	S	S	*	.	I	π-helix	trans	-94.4	-42.7	-176.3	-152	172.5	9.9	0	0	111.5	E148 G156	E148-Q152 WeakPolarHBondContact O-CA 3.31Å; E148-Q152 WeakPolarHBondContact O-CB 3.29Å; E148-Q152 PolarHBondContact O-N 3.48Å; Q152-G156 WeakPolarHBondContact O-CA 3.17Å; Q152-G156 PolarHBondContact O-N 3.27Å
153	A	66.9	Low	74.1	Confident	57 Å²	57	100.8 Å²	100.8	47%	0.471	54%	0.536	S	S	.	.	I	π-helix	trans	-79.9	-50.8	-178.8	0	0	0	0	0	112	G149 G156 L157	G149-A153 WeakPolarHBondContact O-CB 3.26Å; G149-A153 PolarHBondContact O-N 3.25Å; A153-G156 PolarHBondContact O-N 2.56Å; A153-L157 VanDerWaalsContact O-CB 3.29Å; A153-L157 WeakPolarHBondContact O-CB 3.22Å; A153-L157 PolarHBondContact O-N 2.91Å
154	S	68.2	Low	74.3	Confident	48 Å²	48	103 Å²	103	34%	0.336	54%	0.535	S	S	.	.	I	π-helix	trans	-74.2	-41.1	-177.3	31.9	0	0	0	0	115	G149 F150 G156 L157 L158	G149-S154 PolarHBondContact O-N 3.47Å; F150-S154 VanDerWaalsContact CA-OG 3.26Å; F150-S154 WeakPolarHBondContact CA-OG 3.16Å; F150-S154 PolarHBondContact O-OG 2.9Å; S154-G156 VanDerWaalsContact C-N 3.31Å; S154-L157 PolarHBondContact O-N 2.76Å; S154-L158 WeakPolarHBondContact O-CB 3.36Å; S154-L158 PolarHBondContact O-N 3.38Å
155	L	73.3	Confident	74.5	Confident	114 Å²	114	105.1 Å²	105.1	60%	0.597	54%	0.542	S	S	*	.	H	α-helix	trans	-69.2	-33.2	171.9	-68.4	166.4	0	0	0	111.4	T151 L158 A159	T151-L155 WeakPolarHBondContact O-CB 3.37Å; L155-L158 PolarHBondContact O-N 3.24Å; L155-A159 WeakPolarHBondContact O-CB 3.22Å; L155-A159 PolarHBondContact O-N 3.48Å
156	G	73.8	Confident	74.7	Confident	27 Å²	27	106.6 Å²	106.6	28%	0.278	55%	0.55	S	S	.	*	H	α-helix	trans	-63.6	-42.1	171.6	0	0	0	0	0	112.7	Q152 A153 S154 N160	Q152-G156 WeakPolarHBondContact O-CA 3.17Å; Q152-G156 PolarHBondContact O-N 3.27Å; A153-G156 PolarHBondContact O-N 2.56Å; S154-G156 VanDerWaalsContact C-N 3.31Å; G156-N160 WeakPolarHBondContact O-CB 3.2Å; G156-N160 VanDerWaalsContact O-CG 3.25Å; G156-N160 PolarHBondContact O-N 3.35Å; G156-N160 PolarHBondContact O-ND2 2.93Å
157	L	75.5	Confident	75	Confident	114 Å²	114	108.1 Å²	108.1	60%	0.597	55%	0.55	S	S	*	.	H	α-helix	trans	-65.7	-41.8	175	-127.7	136.1	0	0	0	111.2	A153 S154 N160 Q161	A153-L157 VanDerWaalsContact O-CB 3.29Å; A153-L157 WeakPolarHBondContact O-CB 3.22Å; A153-L157 PolarHBondContact O-N 2.91Å; S154-L157 PolarHBondContact O-N 2.76Å; L157-N160 CarbonylContact O-C 3.5Å; L157-N160 PolarHBondContact O-N 2.86Å; L157-Q161 WeakPolarHBondContact O-CB 3.2Å; L157-Q161 PolarHBondContact O-N 3.37Å
158	L	77.1	Confident	75.4	Confident	117 Å²	117	105.3 Å²	105.3	61%	0.613	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-40.1	-180	-140.9	146.1	0	0	0	111.5	S154 L155 Q161 R162	S154-L158 WeakPolarHBondContact O-CB 3.36Å; S154-L158 PolarHBondContact O-N 3.38Å; L155-L158 PolarHBondContact O-N 3.24Å; L158-Q161 PolarHBondContact O-N 2.82Å; L158-R162 WeakPolarHBondContact O-CB 3.1Å; L158-R162 PolarHBondContact O-N 2.8Å
159	A	75.5	Confident	75.8	Confident	60 Å²	60	101.3 Å²	101.3	50%	0.496	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-42.6	171.2	0	0	0	0	0	111.6	L155 R162 K163	L155-A159 WeakPolarHBondContact O-CB 3.22Å; L155-A159 PolarHBondContact O-N 3.48Å; A159-R162 PolarHBondContact O-N 2.77Å; A159-K163 WeakPolarHBondContact O-CB 3.26Å; A159-K163 PolarHBondContact O-N 3.32Å
160	N	78.5	Confident	76.3	Confident	108 Å²	108	104.1 Å²	104.1	58%	0.578	54%	0.537	S	S	*	.	H	α-helix	trans	-67.4	-35.2	175.3	-79.9	-28.1	0	0	0	112.5	G156 L157 K163 R164	G156-N160 WeakPolarHBondContact O-CB 3.2Å; G156-N160 VanDerWaalsContact O-CG 3.25Å; G156-N160 PolarHBondContact O-N 3.35Å; G156-N160 PolarHBondContact O-ND2 2.93Å; L157-N160 CarbonylContact O-C 3.5Å; L157-N160 PolarHBondContact O-N 2.86Å; N160-K163 PolarHBondContact O-N 2.82Å; N160-R164 VanDerWaalsContact O-CB 3.22Å; N160-R164 WeakPolarHBondContact O-CB 3.34Å; N160-R164 PolarHBondContact O-N 3.42Å
161	Q	76.8	Confident	76.8	Confident	121 Å²	121	100.5 Å²	100.5	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-72.2	-39.7	177.2	-167.8	160.9	-10.3	0	0	111	L157 L158 R164 Q165	L157-Q161 WeakPolarHBondContact O-CB 3.2Å; L157-Q161 PolarHBondContact O-N 3.37Å; L158-Q161 PolarHBondContact O-N 2.82Å; Q161-R164 PolarHBondContact O-N 2.81Å; Q161-Q165 WeakPolarHBondContact O-CB 3.18Å; Q161-Q165 PolarHBondContact O-N 3.47Å
162	R	80.1	Confident	77.4	Confident	179 Å²	179	103.7 Å²	103.7	68%	0.675	53%	0.532	S	S	*	.	H	α-helix	trans	-64.7	-42.8	171.1	-166	173.4	-175.5	173.1	0.9	111.6	L158 A159 R164 Q165 L166	L158-R162 WeakPolarHBondContact O-CB 3.1Å; L158-R162 PolarHBondContact O-N 2.8Å; A159-R162 PolarHBondContact O-N 2.77Å; R162-R164 VanDerWaalsContact C-N 3.35Å; R162-Q165 PolarHBondContact O-N 3.37Å; R162-L166 WeakPolarHBondContact O-CB 3.22Å; R162-L166 WeakPolarHBondContact O-CG 3.18Å; R162-L166 PolarHBondContact O-N 3.35Å
163	K	80.8	Confident	77.7	Confident	130 Å²	130	97.9 Å²	97.9	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-41.8	173.4	-171.6	175.3	-178.7	177.3	0	111.1	A159 N160 L166 L167	A159-K163 WeakPolarHBondContact O-CB 3.26Å; A159-K163 PolarHBondContact O-N 3.32Å; N160-K163 PolarHBondContact O-N 2.82Å; K163-L166 PolarHBondContact O-N 3.44Å; K163-L167 HydrophobicContact CG-CD1 3.97Å; K163-L167 HydrophobicContact CG-CG 4.4Å; K163-L167 VanDerWaalsContact O-CB 3.26Å; K163-L167 WeakPolarHBondContact O-CB 3.38Å; K163-L167 WeakPolarHBondContact O-CG 3.47Å; K163-L167 PolarHBondContact O-N 2.91Å
164	R	84.6	Confident	78	Confident	174 Å²	174	100 Å²	100	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-42.7	174.1	180	179	174.5	-172.9	-1.1	111.4	N160 Q161 R162 L167 I168	N160-R164 VanDerWaalsContact O-CB 3.22Å; N160-R164 WeakPolarHBondContact O-CB 3.34Å; N160-R164 PolarHBondContact O-N 3.42Å; Q161-R164 PolarHBondContact O-N 2.81Å; R162-R164 VanDerWaalsContact C-N 3.35Å; R164-L167 PolarHBondContact O-N 2.87Å; R164-I168 HydrophobicContact CG-CD1 3.76Å; R164-I168 HydrophobicContact CG-CG1 4.36Å; R164-I168 WeakPolarHBondContact O-CB 3.32Å; R164-I168 WeakPolarHBondContact O-CG1 3.22Å; R164-I168 PolarHBondContact O-N 2.88Å
165	Q	83.1	Confident	78.4	Confident	143 Å²	143	105.6 Å²	105.6	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-65.5	-42.6	178.4	-132	169.4	-1	0	0	111.6	Q161 R162 I168 G169	Q161-Q165 WeakPolarHBondContact O-CB 3.18Å; Q161-Q165 PolarHBondContact O-N 3.47Å; R162-Q165 PolarHBondContact O-N 3.37Å; Q165-I168 PolarHBondContact O-N 2.77Å; Q165-G169 PolarHBondContact O-N 3.47Å
166	L	79.9	Confident	78.2	Confident	121 Å²	121	102.4 Å²	102.4	63%	0.634	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-43.8	172.6	-74.5	167.4	0	0	0	111.8	R162 K163 I168 G169 L170	R162-L166 WeakPolarHBondContact O-CB 3.22Å; R162-L166 WeakPolarHBondContact O-CG 3.18Å; R162-L166 PolarHBondContact O-N 3.35Å; K163-L166 PolarHBondContact O-N 3.44Å; L166-I168 VanDerWaalsContact C-N 3.34Å; L166-I168 PolarHBondContact O-N 2.8Å; L166-G169 PolarHBondContact O-N 3.25Å; L166-L170 WeakPolarHBondContact O-CB 3.3Å; L166-L170 PolarHBondContact O-N 2.86Å
167	L	80	Confident	78.2	Confident	94 Å²	94	104.5 Å²	104.5	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-35.7	176.3	-75.3	169.9	0	0	0	112.1	K163 R164 L171	K163-L167 HydrophobicContact CG-CD1 3.97Å; K163-L167 HydrophobicContact CG-CG 4.4Å; K163-L167 VanDerWaalsContact O-CB 3.26Å; K163-L167 WeakPolarHBondContact O-CB 3.38Å; K163-L167 WeakPolarHBondContact O-CG 3.47Å; K163-L167 PolarHBondContact O-N 2.91Å; R164-L167 PolarHBondContact O-N 2.87Å; L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 PolarHBondContact O-N 3.14Å
168	I	84.4	Confident	78.2	Confident	73 Å²	73	104.4 Å²	104.4	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-68.8	-41.1	174.2	-71.7	166.4	0	0	0	110.6	R164 Q165 L166 L171 K172	R164-I168 HydrophobicContact CG-CD1 3.76Å; R164-I168 HydrophobicContact CG-CG1 4.36Å; R164-I168 WeakPolarHBondContact O-CB 3.32Å; R164-I168 WeakPolarHBondContact O-CG1 3.22Å; R164-I168 PolarHBondContact O-N 2.88Å; Q165-I168 PolarHBondContact O-N 2.77Å; L166-I168 VanDerWaalsContact C-N 3.34Å; L166-I168 PolarHBondContact O-N 2.8Å; I168-L171 PolarHBondContact O-N 3.35Å; I168-K172 WeakPolarHBondContact O-CG 3.39Å; I168-K172 PolarHBondContact O-N 3.27Å
169	G	81.3	Confident	77.9	Confident	34 Å²	34	102.5 Å²	102.5	35%	0.351	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-50.3	172.9	0	0	0	0	0	111.4	Q165 L166 L171 K172 S173	Q165-G169 PolarHBondContact O-N 3.47Å; L166-G169 PolarHBondContact O-N 3.25Å; G169-L171 VanDerWaalsContact C-N 3.3Å; G169-L171 PolarHBondContact O-N 2.82Å; G169-K172 WeakPolarHBondContact O-CB 3.37Å; G169-K172 PolarHBondContact O-N 3.48Å; G169-S173 PolarHBondContact O-N 3.24Å; G169-S173 PolarHBondContact O-OG 3.28Å
170	L	80.3	Confident	77.6	Confident	95 Å²	95	100.8 Å²	100.8	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-58.3	-41.7	175.4	-166.9	86.3	0	0	0	111.6	L166 S173 L174	L166-L170 WeakPolarHBondContact O-CB 3.3Å; L166-L170 PolarHBondContact O-N 2.86Å; L170-S173 PolarHBondContact O-N 3.36Å; L170-L174 HydrophobicContact CD2-CD1 3.95Å; L170-L174 HydrophobicContact CG-CD1 3.94Å; L170-L174 HydrophobicContact CG-CG 4.43Å; L170-L174 WeakPolarHBondContact O-CB 3.49Å; L170-L174 VanDerWaalsContact O-CG 3.3Å; L170-L174 WeakPolarHBondContact O-CG 3.42Å; L170-L174 PolarHBondContact O-N 2.87Å
171	L	79.9	Confident	77.2	Confident	81 Å²	81	101.9 Å²	101.9	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-69.3	-33.5	179.6	-173.6	148.4	0	0	0	112.1	L167 I168 G169 R175	L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 PolarHBondContact O-N 3.14Å; I168-L171 PolarHBondContact O-N 3.35Å; G169-L171 VanDerWaalsContact C-N 3.3Å; G169-L171 PolarHBondContact O-N 2.82Å; L171-R175 HydrophobicContact CD2-CG 4.24Å; L171-R175 VanDerWaalsContact CD2-CZ 3.43Å; L171-R175 VanDerWaalsContact CD2-NE 3.33Å; L171-R175 VanDerWaalsContact O-CB 3.31Å; L171-R175 WeakPolarHBondContact O-CB 3.29Å; L171-R175 VanDerWaalsContact O-CG 3.29Å; L171-R175 WeakPolarHBondContact O-CG 3.31Å; L171-R175 PolarHBondContact O-N 2.94Å
172	K	79.7	Confident	77	Confident	139 Å²	139	103.9 Å²	103.9	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-64.1	-47.5	169.7	-75.1	-179.5	-179.9	-174.6	0	110.7	I168 G169 L174 R175 T176	I168-K172 WeakPolarHBondContact O-CG 3.39Å; I168-K172 PolarHBondContact O-N 3.27Å; G169-K172 WeakPolarHBondContact O-CB 3.37Å; G169-K172 PolarHBondContact O-N 3.48Å; K172-L174 PolarHBondContact O-N 3.01Å; K172-R175 PolarHBondContact O-N 3.17Å; K172-T176 WeakPolarHBondContact O-CG2 3.43Å; K172-T176 PolarHBondContact O-N 3.23Å; K172-T176 PolarHBondContact O-OG1 2.86Å
173	S	72.5	Confident	76.4	Confident	27 Å²	27	97.2 Å²	97.2	19%	0.189	47%	0.467	C	S	.	.	H	α-helix	trans	-62.3	-40.1	176.2	-51.8	0	0	0	0	112.7	G169 L170 T176 I177	G169-S173 PolarHBondContact O-N 3.24Å; G169-S173 PolarHBondContact O-OG 3.28Å; L170-S173 PolarHBondContact O-N 3.36Å; S173-T176 WeakPolarHBondContact CA-OG1 3.49Å; S173-T176 PolarHBondContact O-N 2.92Å; S173-T176 PolarHBondContact O-OG1 3.27Å; S173-I177 WeakPolarHBondContact O-CB 3.43Å; S173-I177 WeakPolarHBondContact O-CD1 3.42Å; S173-I177 WeakPolarHBondContact O-CG1 3.4Å; S173-I177 PolarHBondContact O-N 3.44Å
174	L	73.5	Confident	75.8	Confident	100 Å²	100	93.3 Å²	93.3	52%	0.524	45%	0.452	S	S	.	.	H	α-helix	trans	-70.1	-34.3	176.5	-75.3	168	0	0	0	112	L170 K172 K178	L170-L174 HydrophobicContact CD2-CD1 3.95Å; L170-L174 HydrophobicContact CG-CD1 3.94Å; L170-L174 HydrophobicContact CG-CG 4.43Å; L170-L174 WeakPolarHBondContact O-CB 3.49Å; L170-L174 VanDerWaalsContact O-CG 3.3Å; L170-L174 WeakPolarHBondContact O-CG 3.42Å; L170-L174 PolarHBondContact O-N 2.87Å; K172-L174 PolarHBondContact O-N 3.01Å; L174-K178 WeakPolarHBondContact O-CB 3.5Å; L174-K178 PolarHBondContact O-N 3.27Å
175	R	75.3	Confident	75.3	Confident	166 Å²	166	88.8 Å²	88.8	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-66.6	-41.6	172.6	-81.7	-178.2	-177.6	171.3	2.6	111.4	L171 K172 K178 T179	L171-R175 HydrophobicContact CD2-CG 4.24Å; L171-R175 VanDerWaalsContact CD2-CZ 3.43Å; L171-R175 VanDerWaalsContact CD2-NE 3.33Å; L171-R175 VanDerWaalsContact O-CB 3.31Å; L171-R175 WeakPolarHBondContact O-CB 3.29Å; L171-R175 VanDerWaalsContact O-CG 3.29Å; L171-R175 WeakPolarHBondContact O-CG 3.31Å; L171-R175 PolarHBondContact O-N 2.94Å; K172-R175 PolarHBondContact O-N 3.17Å; R175-K178 PolarHBondContact O-N 3.45Å; R175-T179 WeakPolarHBondContact O-CG2 3.44Å; R175-T179 PolarHBondContact O-N 2.91Å; R175-T179 PolarHBondContact O-OG1 3.18Å
176	T	69.7	Low	74.7	Confident	48 Å²	48	89.4 Å²	89.4	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-68	-39.2	177	53.3	0	0	0	0	112	K172 S173 T179 L180	K172-T176 WeakPolarHBondContact O-CG2 3.43Å; K172-T176 PolarHBondContact O-N 3.23Å; K172-T176 PolarHBondContact O-OG1 2.86Å; S173-T176 WeakPolarHBondContact CA-OG1 3.49Å; S173-T176 PolarHBondContact O-N 2.92Å; S173-T176 PolarHBondContact O-OG1 3.27Å; T176-T179 VanDerWaalsContact CA-OG1 3.25Å; T176-T179 WeakPolarHBondContact CA-OG1 3.21Å; T176-T179 PolarHBondContact O-N 2.91Å; T176-T179 PolarHBondContact O-OG1 3.22Å; T176-L180 VanDerWaalsContact O-CD1 3.23Å; T176-L180 WeakPolarHBondContact O-CD1 3.49Å; T176-L180 PolarHBondContact O-N 3.44Å
177	I	73.2	Confident	74.2	Confident	70 Å²	70	83.8 Å²	83.8	36%	0.359	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-42.7	172.6	-67.6	164.4	0	0	0	110.7	S173 T179 L180 Q181	S173-I177 WeakPolarHBondContact O-CB 3.43Å; S173-I177 WeakPolarHBondContact O-CD1 3.42Å; S173-I177 WeakPolarHBondContact O-CG1 3.4Å; S173-I177 PolarHBondContact O-N 3.44Å; I177-T179 VanDerWaalsContact C-N 3.32Å; I177-T179 PolarHBondContact O-N 3.13Å; I177-L180 PolarHBondContact O-N 3.17Å; I177-Q181 PolarHBondContact O-N 3.39Å
178	K	75.6	Confident	73.6	Confident	113 Å²	113	81.9 Å²	81.9	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-64.2	-35.2	175.5	-176.6	174.8	-179	173.7	0	112.5	L174 R175 R182	L174-K178 WeakPolarHBondContact O-CB 3.5Å; L174-K178 PolarHBondContact O-N 3.27Å; R175-K178 PolarHBondContact O-N 3.45Å; K178-R182 WeakPolarHBondContact O-CB 3.47Å; K178-R182 WeakPolarHBondContact O-CG 3.29Å; K178-R182 PolarHBondContact O-N 2.91Å; K178-R182 VanDerWaalsContact O-N 3.13Å
179	T	72.3	Confident	73.1	Confident	77 Å²	77	83.2 Å²	83.2	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-68.6	-41.8	172.8	50.1	0	0	0	0	111	R175 T176 I177 Q181 R182 T183	R175-T179 WeakPolarHBondContact O-CG2 3.44Å; R175-T179 PolarHBondContact O-N 2.91Å; R175-T179 PolarHBondContact O-OG1 3.18Å; T176-T179 VanDerWaalsContact CA-OG1 3.25Å; T176-T179 WeakPolarHBondContact CA-OG1 3.21Å; T176-T179 PolarHBondContact O-N 2.91Å; T176-T179 PolarHBondContact O-OG1 3.22Å; I177-T179 VanDerWaalsContact C-N 3.32Å; I177-T179 PolarHBondContact O-N 3.13Å; T179-Q181 PolarHBondContact O-N 3.02Å; T179-R182 PolarHBondContact O-N 3.29Å; T179-T183 WeakPolarHBondContact O-CG2 3.26Å; T179-T183 PolarHBondContact O-N 3.28Å; T179-T183 PolarHBondContact O-OG1 3.35Å
180	L	68.1	Low	72.5	Confident	23 Å²	23	82.9 Å²	82.9	12%	0.12	40%	0.4	C	S	.	.	H	α-helix	trans	-62.7	-38.7	175.9	-96.1	97	0	0	0	113	T176 I177 R182 T183 D184 A210 L222	T176-L180 VanDerWaalsContact O-CD1 3.23Å; T176-L180 WeakPolarHBondContact O-CD1 3.49Å; T176-L180 PolarHBondContact O-N 3.44Å; I177-L180 PolarHBondContact O-N 3.17Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-T183 VanDerWaalsContact CA-OG1 3.26Å; L180-T183 WeakPolarHBondContact CA-OG1 3.37Å; L180-T183 PolarHBondContact O-N 2.75Å; L180-T183 PolarHBondContact O-OG1 2.93Å; L180-D184 PolarHBondContact O-N 2.86Å; L180-D184 VanDerWaalsContact O-N 3.1Å; L180-A210 HydrophobicContact CD2-CB 4.48Å; L180-L222 HydrophobicContact CB-CD2 4.15Å; L180-L222 HydrophobicContact CD2-CD2 3.51Å; L180-L222 HydrophobicContact CG-CD2 4.46Å
181	Q	70.1	Confident	71.9	Confident	131 Å²	131	80.2 Å²	80.2	61%	0.612	39%	0.386	S	S	*	.	H	α-helix	trans	-67.8	-35.9	175.1	-170.5	-177	19	0	0	112	I177 T179 D184 V185	I177-Q181 PolarHBondContact O-N 3.39Å; T179-Q181 PolarHBondContact O-N 3.02Å; Q181-D184 PolarHBondContact O-N 3.37Å; Q181-V185 PolarHBondContact O-N 2.87Å
182	R	72.4	Confident	71.5	Confident	164 Å²	164	84.2 Å²	84.2	62%	0.619	40%	0.402	S	S	*	.	H	α-helix	trans	-71.6	-31.7	175.3	-78.1	178.3	172.8	-173.5	-8	112.4	K178 T179 L180 D184 R186	K178-R182 WeakPolarHBondContact O-CB 3.47Å; K178-R182 WeakPolarHBondContact O-CG 3.29Å; K178-R182 PolarHBondContact O-N 2.91Å; K178-R182 VanDerWaalsContact O-N 3.13Å; T179-R182 PolarHBondContact O-N 3.29Å; L180-R182 VanDerWaalsContact C-N 3.34Å; R182-D184 VanDerWaalsContact C-N 3.34Å; R182-R186 VanDerWaalsContact O-CB 3.29Å; R182-R186 WeakPolarHBondContact O-CB 3.23Å; R182-R186 PolarHBondContact O-N 3Å
183	T	67.2	Low	71.1	Confident	38 Å²	38	84.3 Å²	84.3	23%	0.233	41%	0.405	C	S	.	.	H	α-helix	trans	-70.5	-30.9	173.6	51.8	0	0	0	0	111.9	T179 L180 R186 L187 L202 C206	T179-T183 WeakPolarHBondContact O-CG2 3.26Å; T179-T183 PolarHBondContact O-N 3.28Å; T179-T183 PolarHBondContact O-OG1 3.35Å; L180-T183 VanDerWaalsContact CA-OG1 3.26Å; L180-T183 WeakPolarHBondContact CA-OG1 3.37Å; L180-T183 PolarHBondContact O-N 2.75Å; L180-T183 PolarHBondContact O-OG1 2.93Å; T183-R186 CarbonylContact O-C 3.6Å; T183-R186 PolarHBondContact O-N 3.27Å; T183-L187 WeakPolarHBondContact O-CB 3.48Å; T183-L187 PolarHBondContact O-N 2.92Å; T183-L202 WeakPolarHBondContact O-CD2 3.42Å; T183-C206 PolarHBondContact OG1-SG 3.4Å
184	D	68.2	Low	70.6	Confident	48 Å²	48	86.9 Å²	86.9	26%	0.257	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-45.3	174.1	-171	42.7	0	0	0	112.6	L180 Q181 R182 R186 L187 S188	L180-D184 PolarHBondContact O-N 2.86Å; L180-D184 VanDerWaalsContact O-N 3.1Å; Q181-D184 PolarHBondContact O-N 3.37Å; R182-D184 VanDerWaalsContact C-N 3.34Å; D184-R186 VanDerWaalsContact C-N 3.31Å; D184-R186 PolarHBondContact O-N 3.28Å; D184-L187 WeakPolarHBondContact O-CB 3.25Å; D184-L187 PolarHBondContact O-N 3.01Å; D184-S188 PolarHBondContact O-N 3.48Å; D184-S188 PolarHBondContact O-OG 3.44Å
185	V	73.9	Confident	70.6	Confident	79 Å²	79	84.4 Å²	84.4	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-42.5	172.1	176.5	0	0	0	0	110.6	Q181 L187 S188 E189	Q181-V185 PolarHBondContact O-N 2.87Å; V185-L187 VanDerWaalsContact C-N 3.31Å; V185-L187 PolarHBondContact O-N 3.24Å; V185-S188 WeakPolarHBondContact O-CB 3.49Å; V185-S188 PolarHBondContact O-N 3.23Å; V185-E189 WeakPolarHBondContact O-CG 3.35Å; V185-E189 PolarHBondContact O-N 3.19Å
186	R	70.8	Confident	70.3	Confident	157 Å²	157	76.9 Å²	76.9	59%	0.592	37%	0.373	S	S	*	.	H	α-helix	trans	-67.4	-30.4	176.8	-169.1	159.2	178.3	151.7	-1.2	112.9	R182 T183 D184 E189 M190	R182-R186 VanDerWaalsContact O-CB 3.29Å; R182-R186 WeakPolarHBondContact O-CB 3.23Å; R182-R186 PolarHBondContact O-N 3Å; T183-R186 CarbonylContact O-C 3.6Å; T183-R186 PolarHBondContact O-N 3.27Å; D184-R186 VanDerWaalsContact C-N 3.31Å; D184-R186 PolarHBondContact O-N 3.28Å; R186-E189 PolarHBondContact O-N 3.44Å; R186-M190 HydrophobicContact CG-CG 4.47Å; R186-M190 WeakPolarHBondContact O-CB 3.47Å; R186-M190 VanDerWaalsContact O-CG 3.24Å; R186-M190 WeakPolarHBondContact O-CG 3.4Å; R186-M190 PolarHBondContact O-N 3.43Å
187	L	69.4	Low	70.2	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-43.7	172.6	-166.3	96.4	0	0	0	110.5	T183 D184 V185 M190 L191 A199 L202 C203 T229 I233	T183-L187 WeakPolarHBondContact O-CB 3.48Å; T183-L187 PolarHBondContact O-N 2.92Å; D184-L187 WeakPolarHBondContact O-CB 3.25Å; D184-L187 PolarHBondContact O-N 3.01Å; V185-L187 VanDerWaalsContact C-N 3.31Å; V185-L187 PolarHBondContact O-N 3.24Å; L187-M190 PolarHBondContact O-N 3.36Å; L187-L191 HydrophobicContact CD2-CD1 4.3Å; L187-L191 HydrophobicContact CG-CD1 4.47Å; L187-L191 WeakPolarHBondContact O-CB 3.46Å; L187-L191 WeakPolarHBondContact O-CG 3.49Å; L187-L191 PolarHBondContact O-N 3.22Å; L187-A199 HydrophobicContact CD1-CB 4.4Å; L187-A199 VanDerWaalsContact CD1-O 3.27Å; L187-A199 WeakPolarHBondContact CD1-O 3.33Å; L187-L202 HydrophobicContact CB-CD2 4.34Å; L187-L202 HydrophobicContact CD1-CB 4.32Å; L187-L202 HydrophobicContact CD1-CD2 4.05Å; L187-C203 HydrophobicContact CD1-CB 4.17Å; L187-C203 WeakPolarHBondContact CD1-SG 3.44Å; L187-T229 HydrophobicContact CD2-CG2 4.21Å; L187-I233 HydrophobicContact CD2-CD1 4.47Å
188	S	67.8	Low	70.1	Confident	55 Å²	55	72.9 Å²	72.9	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-42.1	176.2	-56.6	0	0	0	0	111.5	D184 V185 L191 E192	D184-S188 PolarHBondContact O-N 3.48Å; D184-S188 PolarHBondContact O-OG 3.44Å; V185-S188 WeakPolarHBondContact O-CB 3.49Å; V185-S188 PolarHBondContact O-N 3.23Å; S188-L191 WeakPolarHBondContact O-CB 3.41Å; S188-L191 PolarHBondContact O-N 3.22Å; S188-E192 WeakPolarHBondContact O-CG 3.24Å; S188-E192 PolarHBondContact O-N 3.05Å
189	E	74.9	Confident	69.9	Low	100 Å²	100	67.5 Å²	67.5	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-43.5	173.2	-71.1	170.4	174.5	0	0	111.6	V185 R186 L191 E192 E193	V185-E189 WeakPolarHBondContact O-CG 3.35Å; V185-E189 PolarHBondContact O-N 3.19Å; R186-E189 PolarHBondContact O-N 3.44Å; E189-L191 VanDerWaalsContact C-N 3.29Å; E189-L191 PolarHBondContact O-N 2.91Å; E189-E192 PolarHBondContact O-N 3.22Å; E189-E193 WeakPolarHBondContact O-CB 3.37Å; E189-E193 WeakPolarHBondContact O-CG 3.47Å; E189-E193 PolarHBondContact O-N 3.4Å
190	M	67.5	Low	69.8	Low	28 Å²	28	63.9 Å²	63.9	14%	0.138	31%	0.31	C	S	.	.	H	α-helix	trans	-69.4	-25.9	177.9	-70.9	-166.1	78.6	0	0	113.4	R186 L187 E194 D195 A199	R186-M190 HydrophobicContact CG-CG 4.47Å; R186-M190 WeakPolarHBondContact O-CB 3.47Å; R186-M190 VanDerWaalsContact O-CG 3.24Å; R186-M190 WeakPolarHBondContact O-CG 3.4Å; R186-M190 PolarHBondContact O-N 3.43Å; L187-M190 PolarHBondContact O-N 3.36Å; M190-E194 PolarHBondContact O-N 3.06Å; M190-D195 HydrophobicContact CE-CB 3.91Å; M190-D195 WeakPolarHBondContact CE-OD2 3.14Å; M190-D195 PolarHBondContact O-N 3.37Å; M190-A199 HydrophobicContact CB-CB 4.27Å
191	L	68	Low	70	Confident	39 Å²	39	67.7 Å²	67.7	20%	0.204	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-39.2	170.9	-80.8	166.7	0	0	0	112	L187 S188 E189 E193 E194 Y196 A199 I233	L187-L191 HydrophobicContact CD2-CD1 4.3Å; L187-L191 HydrophobicContact CG-CD1 4.47Å; L187-L191 WeakPolarHBondContact O-CB 3.46Å; L187-L191 WeakPolarHBondContact O-CG 3.49Å; L187-L191 PolarHBondContact O-N 3.22Å; S188-L191 WeakPolarHBondContact O-CB 3.41Å; S188-L191 PolarHBondContact O-N 3.22Å; E189-L191 VanDerWaalsContact C-N 3.29Å; E189-L191 PolarHBondContact O-N 2.91Å; L191-E193 VanDerWaalsContact C-N 3.32Å; L191-E194 PolarHBondContact O-N 3.35Å; L191-Y196 HydrophobicContact CD2-CD1 4.22Å; L191-Y196 HydrophobicContact CD2-CE1 4.27Å; L191-A199 HydrophobicContact CG-CB 4.47Å; L191-I233 HydrophobicContact CD1-CD1 4.39Å; L191-I233 HydrophobicContact CD1-CG1 3.99Å; L191-I233 HydrophobicContact CD2-CD1 4.37Å; L191-I233 HydrophobicContact CD2-CG1 3.51Å; L191-I233 HydrophobicContact CG-CG1 4.24Å
192	E	70.6	Confident	70.2	Confident	165 Å²	165	63.1 Å²	63.1	77%	0.771	31%	0.307	S	S	*	.	H	α-helix	trans	-68	-31.7	172.6	-71	179.6	-179.8	0	0	112	S188 E189 E194	S188-E192 WeakPolarHBondContact O-CG 3.24Å; S188-E192 PolarHBondContact O-N 3.05Å; E189-E192 PolarHBondContact O-N 3.22Å; E192-E194 VanDerWaalsContact C-N 3.28Å; E192-E194 PolarHBondContact O-N 2.89Å
193	E	71.2	Confident	70.1	Confident	141 Å²	141	55.4 Å²	55.4	66%	0.659	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	2	175.8	-70.7	-176.6	168.8	0	0	114.4	E189 L191 D195	E189-E193 WeakPolarHBondContact O-CB 3.37Å; E189-E193 WeakPolarHBondContact O-CG 3.47Å; E189-E193 PolarHBondContact O-N 3.4Å; L191-E193 VanDerWaalsContact C-N 3.32Å; E193-D195 PolarHBondContact O-N 2.95Å
194	E	63.8	Low	70.3	Confident	81 Å²	81	56.6 Å²	56.6	38%	0.379	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	25.8	-177.9	-56.4	-175.8	160.4	0	0	114.4	M190 L191 E192 Y196 H252	M190-E194 PolarHBondContact O-N 3.06Å; L191-E194 PolarHBondContact O-N 3.35Å; E192-E194 VanDerWaalsContact C-N 3.28Å; E192-E194 PolarHBondContact O-N 2.89Å; E194-Y196 HydrophobicContact CB-CE2 4.16Å; E194-Y196 PolarHBondContact O-N 2.77Å; E194-H252 IonicContact OE2-CE1 3.86Å; E194-H252 PolarHBondContact OE2-CE1 2.79Å; E194-H252 IonicContact OE2-ND1 2.79Å; E194-H252 PolarHBondContact OE2-ND1 3.1Å
195	D	72.8	Confident	70.5	Confident	48 Å²	48	59.4 Å²	59.4	26%	0.257	29%	0.294	S	S	.	.			trans	-94.4	69.8	175.2	-167.8	11.8	0	0	0	111.4	M190 E193 P197 G198 A199	M190-D195 HydrophobicContact CE-CB 3.91Å; M190-D195 WeakPolarHBondContact CE-OD2 3.14Å; M190-D195 PolarHBondContact O-N 3.37Å; E193-D195 PolarHBondContact O-N 2.95Å; D195-P197 WeakPolarHBondContact OD1-CD 3.46Å; D195-G198 PolarHBondContact O-N 3.49Å; D195-A199 PolarHBondContact O-N 3.34Å
196	Y	69	Low	70.2	Confident	8 Å²	8	56.2 Å²	56.2	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-40.1	-177.8	-54	-71.9	0	0	0	114.6	L191 E194 G198 A199 I200 Q236 L237 A240 H252 V256	L191-Y196 HydrophobicContact CD2-CD1 4.22Å; L191-Y196 HydrophobicContact CD2-CE1 4.27Å; E194-Y196 HydrophobicContact CB-CE2 4.16Å; E194-Y196 PolarHBondContact O-N 2.77Å; Y196-G198 PolarHBondContact O-N 3.03Å; Y196-A199 PolarHBondContact O-N 2.95Å; Y196-I200 WeakPolarHBondContact O-CB 3.35Å; Y196-I200 WeakPolarHBondContact O-CD1 3.27Å; Y196-I200 VanDerWaalsContact O-CG1 3.24Å; Y196-I200 WeakPolarHBondContact O-CG1 3.42Å; Y196-I200 PolarHBondContact O-N 3.08Å; Y196-Q236 HydrophobicContact CE1-CB 4.14Å; Y196-L237 HydrophobicContact CD1-CD2 4.19Å; Y196-L237 HydrophobicContact CD1-CG 4.42Å; Y196-L237 HydrophobicContact CD2-CD2 4.08Å; Y196-L237 HydrophobicContact CG-CD2 3.77Å; Y196-L237 HydrophobicContact CG-CG 4.48Å; Y196-A240 HydrophobicContact CE2-CB 4.13Å; Y196-H252 AromaticContact CE2-CE1 3.92Å; Y196-V256 HydrophobicContact CD2-CG2 4.14Å; Y196-V256 HydrophobicContact CE2-CG2 4.3Å
197	P	66.9	Low	70.1	Confident	13 Å²	13	51.8 Å²	51.8	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-44.9	176.5	-24.9	34.7	0	0	0	112.9	D195 I200 Q201 K255 Q258 A259 L262	D195-P197 WeakPolarHBondContact OD1-CD 3.46Å; P197-I200 PolarHBondContact O-N 2.81Å; P197-Q201 WeakPolarHBondContact O-CB 3.39Å; P197-Q201 PolarHBondContact O-N 3.42Å; P197-K255 HydrophobicContact CG-CB 4.12Å; P197-K255 HydrophobicContact CG-CG 4.49Å; P197-K255 WeakPolarHBondContact CG-O 3.45Å; P197-Q258 HydrophobicContact CB-CB 4.37Å; P197-Q258 HydrophobicContact CG-CB 3.89Å; P197-A259 HydrophobicContact CG-CB 4.4Å; P197-L262 HydrophobicContact CB-CD1 4.14Å
198	G	71.3	Confident	70.1	Confident	20 Å²	20	58.8 Å²	58.8	21%	0.206	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-42.4	177.7	0	0	0	0	0	112	D195 Y196 Q201 L202	D195-G198 PolarHBondContact O-N 3.49Å; Y196-G198 PolarHBondContact O-N 3.03Å; G198-Q201 PolarHBondContact O-N 3.38Å; G198-L202 VanDerWaalsContact O-CB 3.27Å; G198-L202 WeakPolarHBondContact O-CB 3.25Å; G198-L202 PolarHBondContact O-N 3.5Å
199	A	71.4	Confident	70.1	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-45	175.6	0	0	0	0	0	112.2	L187 M190 L191 D195 Y196 L202 C203	L187-A199 HydrophobicContact CD1-CB 4.4Å; L187-A199 VanDerWaalsContact CD1-O 3.27Å; L187-A199 WeakPolarHBondContact CD1-O 3.33Å; M190-A199 HydrophobicContact CB-CB 4.27Å; L191-A199 HydrophobicContact CG-CB 4.47Å; D195-A199 PolarHBondContact O-N 3.34Å; Y196-A199 PolarHBondContact O-N 2.95Å; A199-L202 PolarHBondContact O-N 3.4Å; A199-C203 WeakPolarHBondContact O-CB 3.31Å; A199-C203 PolarHBondContact O-N 3.45Å
200	I	70.4	Confident	69.6	Low	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-42	179.9	-68	162.4	0	0	0	111.4	Y196 P197 C203 L204 I233 L237 A259 L262 L263	Y196-I200 WeakPolarHBondContact O-CB 3.35Å; Y196-I200 WeakPolarHBondContact O-CD1 3.27Å; Y196-I200 VanDerWaalsContact O-CG1 3.24Å; Y196-I200 WeakPolarHBondContact O-CG1 3.42Å; Y196-I200 PolarHBondContact O-N 3.08Å; P197-I200 PolarHBondContact O-N 2.81Å; I200-C203 WeakPolarHBondContact O-CB 3.31Å; I200-C203 PolarHBondContact O-N 3.4Å; I200-L204 HydrophobicContact CG2-CD1 4.11Å; I200-L204 HydrophobicContact CG2-CG 4.48Å; I200-L204 WeakPolarHBondContact O-CG 3.5Å; I200-L204 PolarHBondContact O-N 3.44Å; I200-I233 HydrophobicContact CD1-CG2 3.98Å; I200-I233 HydrophobicContact CG1-CG2 3.79Å; I200-L237 HydrophobicContact CD1-CD1 4.14Å; I200-A259 HydrophobicContact CD1-CB 3.41Å; I200-A259 VanDerWaalsContact CD1-CB 3.41Å; I200-L262 HydrophobicContact CG2-CB 4.09Å; I200-L263 HydrophobicContact CD1-CD1 3.88Å; I200-L263 HydrophobicContact CD1-CG 4.13Å; I200-L263 HydrophobicContact CG2-CD2 4.37Å; I200-L263 HydrophobicContact CG2-CG 4.36Å
201	Q	72.6	Confident	69.6	Low	103 Å²	103	55 Å²	55	48%	0.481	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-43.2	176.7	-172.1	174.5	-9.6	0	0	111.4	P197 G198 C203 L204 E205	P197-Q201 WeakPolarHBondContact O-CB 3.39Å; P197-Q201 PolarHBondContact O-N 3.42Å; G198-Q201 PolarHBondContact O-N 3.38Å; Q201-C203 VanDerWaalsContact C-N 3.33Å; Q201-C203 PolarHBondContact O-N 3.14Å; Q201-L204 PolarHBondContact O-N 3.16Å; Q201-E205 PolarHBondContact NE2-OE1 3.27Å; Q201-E205 WeakPolarHBondContact O-CB 3.44Å; Q201-E205 WeakPolarHBondContact O-CG 3.36Å; Q201-E205 PolarHBondContact O-N 3.25Å
202	L	73.8	Confident	69.6	Low	36 Å²	36	57.8 Å²	57.8	19%	0.188	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-40.1	174.4	-161.6	90	0	0	0	111.3	T183 L187 G198 A199 E205 C206	T183-L202 WeakPolarHBondContact O-CD2 3.42Å; L187-L202 HydrophobicContact CB-CD2 4.34Å; L187-L202 HydrophobicContact CD1-CB 4.32Å; L187-L202 HydrophobicContact CD1-CD2 4.05Å; G198-L202 VanDerWaalsContact O-CB 3.27Å; G198-L202 WeakPolarHBondContact O-CB 3.25Å; G198-L202 PolarHBondContact O-N 3.5Å; A199-L202 PolarHBondContact O-N 3.4Å; L202-E205 PolarHBondContact O-N 2.87Å; L202-C206 VanDerWaalsContact O-CB 3.25Å; L202-C206 WeakPolarHBondContact O-CB 3.46Å; L202-C206 PolarHBondContact O-N 3.5Å; L202-C206 PolarHBondContact O-SG 2.89Å
203	C	70.4	Confident	69.1	Low	2 Å²	2	54 Å²	54	1%	0.014	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-47.2	174.2	-103.5	0	0	0	0	112.1	L187 A199 I200 Q201 C206 Q207 L230	L187-C203 HydrophobicContact CD1-CB 4.17Å; L187-C203 WeakPolarHBondContact CD1-SG 3.44Å; A199-C203 WeakPolarHBondContact O-CB 3.31Å; A199-C203 PolarHBondContact O-N 3.45Å; I200-C203 WeakPolarHBondContact O-CB 3.31Å; I200-C203 PolarHBondContact O-N 3.4Å; Q201-C203 VanDerWaalsContact C-N 3.33Å; Q201-C203 PolarHBondContact O-N 3.14Å; C203-C206 CarbonylContact O-C 3.58Å; C203-C206 PolarHBondContact O-N 2.91Å; C203-Q207 WeakPolarHBondContact O-CB 3.32Å; C203-Q207 PolarHBondContact O-N 3.14Å; C203-L230 HydrophobicContact CB-CD2 3.99Å; C203-L230 HydrophobicContact CB-CG 4.36Å
204	L	71.2	Confident	68.6	Low	62 Å²	62	54.9 Å²	54.9	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-38.8	178.6	-71.7	171.9	0	0	0	112.1	I200 Q201 Q207 K208	I200-L204 HydrophobicContact CG2-CD1 4.11Å; I200-L204 HydrophobicContact CG2-CG 4.48Å; I200-L204 WeakPolarHBondContact O-CG 3.5Å; I200-L204 PolarHBondContact O-N 3.44Å; Q201-L204 PolarHBondContact O-N 3.16Å; L204-Q207 PolarHBondContact O-N 3.03Å; L204-K208 WeakPolarHBondContact O-CG 3.41Å; L204-K208 PolarHBondContact O-N 3.17Å
205	E	72.8	Confident	68.5	Low	107 Å²	107	59.7 Å²	59.7	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-66.7	-40	172.9	-73.5	-179.4	-170.6	0	0	111.7	Q201 L202 K208 A209	Q201-E205 PolarHBondContact NE2-OE1 3.27Å; Q201-E205 WeakPolarHBondContact O-CB 3.44Å; Q201-E205 WeakPolarHBondContact O-CG 3.36Å; Q201-E205 PolarHBondContact O-N 3.25Å; L202-E205 PolarHBondContact O-N 2.87Å; E205-K208 PolarHBondContact O-N 2.97Å; E205-A209 VanDerWaalsContact O-CB 3.31Å; E205-A209 WeakPolarHBondContact O-CB 3.47Å; E205-A209 PolarHBondContact O-N 2.82Å
206	C	67	Low	68	Low	12 Å²	12	62.6 Å²	62.6	8%	0.081	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-38.1	174	-73	0	0	0	0	111.9	T183 L202 C203 A209 A210 L226	T183-C206 PolarHBondContact OG1-SG 3.4Å; L202-C206 VanDerWaalsContact O-CB 3.25Å; L202-C206 WeakPolarHBondContact O-CB 3.46Å; L202-C206 PolarHBondContact O-N 3.5Å; L202-C206 PolarHBondContact O-SG 2.89Å; C203-C206 CarbonylContact O-C 3.58Å; C203-C206 PolarHBondContact O-N 2.91Å; C206-A209 PolarHBondContact O-N 3.29Å; C206-A210 WeakPolarHBondContact O-CB 3.35Å; C206-A210 PolarHBondContact O-N 3.29Å; C206-L226 HydrophobicContact CB-CD1 4.22Å; C206-L226 HydrophobicContact CB-CD2 4.15Å
207	Q	68.6	Low	67.7	Low	64 Å²	64	66.6 Å²	66.6	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-68.1	-42.3	176.6	-161.1	-179.6	30.7	0	0	111.3	C203 L204 A210 S211	C203-Q207 WeakPolarHBondContact O-CB 3.32Å; C203-Q207 PolarHBondContact O-N 3.14Å; L204-Q207 PolarHBondContact O-N 3.03Å; Q207-A210 PolarHBondContact O-N 3.4Å; Q207-S211 WeakPolarHBondContact O-CB 3.26Å; Q207-S211 PolarHBondContact O-N 3.2Å
208	K	70.5	Confident	67.4	Low	149 Å²	149	70.2 Å²	70.2	65%	0.648	37%	0.367	S	S	*	.	H	α-helix	trans	-62.1	-43.4	172.5	-73	173	-176.1	172.8	0	111.5	L204 E205 S211 T212	L204-K208 WeakPolarHBondContact O-CG 3.41Å; L204-K208 PolarHBondContact O-N 3.17Å; E205-K208 PolarHBondContact O-N 2.97Å; K208-S211 PolarHBondContact O-N 3.12Å; K208-S211 PolarHBondContact O-OG 2.74Å; K208-T212 PolarHBondContact O-N 3.01Å; K208-T212 PolarHBondContact O-OG1 3.31Å; K208-T212 VanDerWaalsContact O-OG1 3.14Å
209	A	67.5	Low	67.1	Low	38 Å²	38	70 Å²	70	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-69	-36.2	176.3	0	0	0	0	0	112.9	E205 C206 T212 F213	E205-A209 VanDerWaalsContact O-CB 3.31Å; E205-A209 WeakPolarHBondContact O-CB 3.47Å; E205-A209 PolarHBondContact O-N 2.82Å; C206-A209 PolarHBondContact O-N 3.29Å; A209-T212 PolarHBondContact O-N 3.25Å; A209-T212 PolarHBondContact O-OG1 3.38Å; A209-F213 WeakPolarHBondContact O-CD2 3.49Å
210	A	65.4	Low	66.8	Low	3 Å²	3	74 Å²	74	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-37.3	175.7	0	0	0	0	0	111.3	L180 C206 Q207 T212 F213 I219	L180-A210 HydrophobicContact CD2-CB 4.48Å; C206-A210 WeakPolarHBondContact O-CB 3.35Å; C206-A210 PolarHBondContact O-N 3.29Å; Q207-A210 PolarHBondContact O-N 3.4Å; A210-T212 PolarHBondContact O-N 2.87Å; A210-F213 PolarHBondContact O-N 2.92Å; A210-F213 VanDerWaalsContact O-N 3.09Å; A210-I219 HydrophobicContact CB-CG2 3.97Å
211	S	66	Low	66.7	Low	62 Å²	62	80.3 Å²	80.3	43%	0.434	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-29.6	178.3	79.4	0	0	0	0	113.5	Q207 K208 F213 K214	Q207-S211 WeakPolarHBondContact O-CB 3.26Å; Q207-S211 PolarHBondContact O-N 3.2Å; K208-S211 PolarHBondContact O-N 3.12Å; K208-S211 PolarHBondContact O-OG 2.74Å; S211-F213 VanDerWaalsContact C-N 3.29Å; S211-F213 PolarHBondContact O-N 3.44Å; S211-K214 WeakPolarHBondContact O-CG 3.3Å
212	T	67.7	Low	66.4	Low	98 Å²	98	77 Å²	77	60%	0.601	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.6	177.8	23.4	0	0	0	0	113.2	K208 A209 A210	K208-T212 PolarHBondContact O-N 3.01Å; K208-T212 PolarHBondContact O-OG1 3.31Å; K208-T212 VanDerWaalsContact O-OG1 3.14Å; A209-T212 PolarHBondContact O-N 3.25Å; A209-T212 PolarHBondContact O-OG1 3.38Å; A210-T212 PolarHBondContact O-N 2.87Å
213	F	61	Low	66.2	Low	85 Å²	85	77.9 Å²	77.9	37%	0.373	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	32.3	-177.7	-65.2	-74.9	0	0	0	114.2	A209 A210 S211 H215 Y216 I219	A209-F213 WeakPolarHBondContact O-CD2 3.49Å; A210-F213 PolarHBondContact O-N 2.92Å; A210-F213 VanDerWaalsContact O-N 3.09Å; S211-F213 VanDerWaalsContact C-N 3.29Å; S211-F213 PolarHBondContact O-N 3.44Å; F213-H215 PolarHBondContact O-N 2.85Å; F213-Y216 PolarHBondContact O-N 3.49Å; F213-I219 HydrophobicContact CB-CD1 3.56Å; F213-I219 WeakPolarHBondContact O-CD1 3.46Å
214	K	60.8	Low	66.5	Low	160 Å²	160	80.6 Å²	80.6	70%	0.696	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-9.4	177.1	-75	-177.8	-179.9	-175.1	0	116.3	S211 Y216	S211-K214 WeakPolarHBondContact O-CG 3.3Å; K214-Y216 VanDerWaalsContact C-N 3.28Å; K214-Y216 PolarHBondContact O-N 2.9Å
215	H	60.5	Low	66.4	Low	183 Å²	183	83.8 Å²	83.8	85%	0.847	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.7	-179	-62.6	-61.3	0	0	0	114.7	F213	F213-H215 PolarHBondContact O-N 2.85Å
216	Y	63.8	Low	66.3	Low	108 Å²	108	79.3 Å²	79.3	42%	0.424	42%	0.418	S	S	.	.	S	Bend	trans	-106.3	127.3	176.7	-63.7	-74.7	0	0	0	110.8	F213 K214 C218 I219	F213-Y216 PolarHBondContact O-N 3.49Å; K214-Y216 VanDerWaalsContact C-N 3.28Å; K214-Y216 PolarHBondContact O-N 2.9Å; Y216-C218 VanDerWaalsContact C-N 3.28Å; Y216-C218 PolarHBondContact O-N 3.27Å; Y216-I219 HydrophobicContact CD2-CD1 3.96Å; Y216-I219 HydrophobicContact CG-CD1 4.4Å; Y216-I219 WeakPolarHBondContact O-CB 3.27Å; Y216-I219 PolarHBondContact O-N 3.47Å
217	S	61.5	Low	66.6	Low	92 Å²	92	82.6 Å²	82.6	64%	0.643	43%	0.433	S	S	*	.	H	α-helix	trans	-58.6	-37.3	-179.3	56.6	0	0	0	0	113	I219 S220 E221	S217-I219 PolarHBondContact O-N 3.02Å; S217-S220 WeakPolarHBondContact O-CB 3.17Å; S217-S220 PolarHBondContact O-N 2.82Å; S217-E221 PolarHBondContact O-N 3.32Å
218	C	61	Low	67	Low	90 Å²	90	83.5 Å²	83.5	61%	0.608	44%	0.44	S	S	*	.	H	α-helix	trans	-60.5	-26	176.6	-56.2	0	0	0	0	113.2	Y216 L222	Y216-C218 VanDerWaalsContact C-N 3.28Å; Y216-C218 PolarHBondContact O-N 3.27Å; C218-L222 WeakPolarHBondContact O-CB 3.35Å; C218-L222 PolarHBondContact O-N 3.44Å; C218-L222 VanDerWaalsContact O-N 3.14Å
219	I	64.3	Low	67	Low	15 Å²	15	77.3 Å²	77.3	8%	0.077	41%	0.414	C	S	.	.	H	α-helix	trans	-81.8	-26.5	178.4	-62.3	177.8	0	0	0	110.6	A210 F213 Y216 S217 N223	A210-I219 HydrophobicContact CB-CG2 3.97Å; F213-I219 HydrophobicContact CB-CD1 3.56Å; F213-I219 WeakPolarHBondContact O-CD1 3.46Å; Y216-I219 HydrophobicContact CD2-CD1 3.96Å; Y216-I219 HydrophobicContact CG-CD1 4.4Å; Y216-I219 WeakPolarHBondContact O-CB 3.27Å; Y216-I219 PolarHBondContact O-N 3.47Å; S217-I219 PolarHBondContact O-N 3.02Å; I219-N223 WeakPolarHBondContact O-CB 3.24Å; I219-N223 PolarHBondContact O-N 3.46Å
220	S	66.9	Low	67.3	Low	84 Å²	84	76.3 Å²	76.3	59%	0.587	40%	0.404	S	S	*	.	H	α-helix	trans	-70	-43.2	172.7	-169.2	0	0	0	0	112	S217 L222 N223 S224	S217-S220 WeakPolarHBondContact O-CB 3.17Å; S217-S220 PolarHBondContact O-N 2.82Å; S220-L222 VanDerWaalsContact C-N 3.31Å; S220-N223 PolarHBondContact O-N 2.89Å; S220-S224 PolarHBondContact O-N 3.39Å; S220-S224 VanDerWaalsContact O-N 3.11Å
221	E	66.8	Low	67.8	Low	133 Å²	133	81.3 Å²	81.3	62%	0.621	43%	0.426	S	S	*	.	H	α-helix	trans	-68	-31.2	173.9	-71.5	175.7	-176.2	0	0	112.1	S217 S224 K225	S217-E221 PolarHBondContact O-N 3.32Å; E221-S224 PolarHBondContact O-OG 3.46Å; E221-K225 WeakPolarHBondContact O-CG 3.33Å; E221-K225 PolarHBondContact O-N 3.09Å
222	L	68.1	Low	68.2	Low	35 Å²	35	83.6 Å²	83.6	18%	0.183	43%	0.43	C	S	.	.	H	α-helix	trans	-70.7	-36.7	172.1	-172.3	68.8	0	0	0	111.7	L180 C218 S220 S224 K225 L226	L180-L222 HydrophobicContact CB-CD2 4.15Å; L180-L222 HydrophobicContact CD2-CD2 3.51Å; L180-L222 HydrophobicContact CG-CD2 4.46Å; C218-L222 WeakPolarHBondContact O-CB 3.35Å; C218-L222 PolarHBondContact O-N 3.44Å; C218-L222 VanDerWaalsContact O-N 3.14Å; S220-L222 VanDerWaalsContact C-N 3.31Å; L222-S224 VanDerWaalsContact C-N 3.34Å; L222-K225 PolarHBondContact O-N 2.74Å; L222-L226 HydrophobicContact CG-CD1 4.18Å; L222-L226 WeakPolarHBondContact O-CB 3.4Å; L222-L226 WeakPolarHBondContact O-CG 3.41Å; L222-L226 PolarHBondContact O-N 2.71Å
223	N	68.8	Low	68.5	Low	54 Å²	54	79 Å²	79	29%	0.289	40%	0.402	S	S	.	.	H	α-helix	trans	-68.9	-31.3	177.6	-167	59.1	0	0	0	112.5	I219 S220 Q227	I219-N223 WeakPolarHBondContact O-CB 3.24Å; I219-N223 PolarHBondContact O-N 3.46Å; S220-N223 PolarHBondContact O-N 2.89Å; N223-Q227 PolarHBondContact O-N 2.97Å; N223-Q227 VanDerWaalsContact O-N 3.13Å
224	S	75.5	Confident	69	Low	59 Å²	59	78 Å²	78	41%	0.413	40%	0.398	S	S	.	.	H	α-helix	trans	-68.3	-43.8	169.6	65.3	0	0	0	0	111.1	S220 E221 L222 L226 Q227 D228	S220-S224 PolarHBondContact O-N 3.39Å; S220-S224 VanDerWaalsContact O-N 3.11Å; E221-S224 PolarHBondContact O-OG 3.46Å; L222-S224 VanDerWaalsContact C-N 3.34Å; S224-L226 VanDerWaalsContact C-N 3.32Å; S224-L226 PolarHBondContact O-N 3.27Å; S224-Q227 WeakPolarHBondContact O-CA 3.36Å; S224-Q227 WeakPolarHBondContact O-CB 3.42Å; S224-Q227 PolarHBondContact O-N 3.46Å; S224-Q227 VanDerWaalsContact O-N 3.08Å; S224-D228 VanDerWaalsContact O-CG 3.26Å; S224-D228 PolarHBondContact O-N 2.77Å
225	K	70.7	Confident	69.7	Low	129 Å²	129	76.7 Å²	76.7	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-61	-39.4	174.6	-72.8	-177.5	178.6	-172.4	0	112.9	E221 L222 Q227 D228 T229	E221-K225 WeakPolarHBondContact O-CG 3.33Å; E221-K225 PolarHBondContact O-N 3.09Å; L222-K225 PolarHBondContact O-N 2.74Å; K225-Q227 VanDerWaalsContact C-N 3.28Å; K225-Q227 PolarHBondContact O-N 3.28Å; K225-D228 CarbonylContact O-C 3.59Å; K225-D228 WeakPolarHBondContact O-CB 3.34Å; K225-D228 PolarHBondContact O-N 3.36Å; K225-T229 VanDerWaalsContact O-CG2 3.31Å; K225-T229 WeakPolarHBondContact O-CG2 3.33Å; K225-T229 PolarHBondContact O-N 2.94Å; K225-T229 PolarHBondContact O-OG1 2.97Å
226	L	70.7	Confident	70	Confident	12 Å²	12	72.5 Å²	72.5	6%	0.063	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-35.2	174.8	-80.6	160.5	0	0	0	111.9	C206 L222 S224 T229 L230	C206-L226 HydrophobicContact CB-CD1 4.22Å; C206-L226 HydrophobicContact CB-CD2 4.15Å; L222-L226 HydrophobicContact CG-CD1 4.18Å; L222-L226 WeakPolarHBondContact O-CB 3.4Å; L222-L226 WeakPolarHBondContact O-CG 3.41Å; L222-L226 PolarHBondContact O-N 2.71Å; S224-L226 VanDerWaalsContact C-N 3.32Å; S224-L226 PolarHBondContact O-N 3.27Å; L226-T229 VanDerWaalsContact C-OG1 3.3Å; L226-T229 VanDerWaalsContact CA-OG1 3.26Å; L226-T229 WeakPolarHBondContact CA-OG1 3.27Å; L226-T229 PolarHBondContact O-N 3.32Å; L226-T229 PolarHBondContact O-OG1 3.37Å; L226-L230 PolarHBondContact O-N 3.5Å
227	Q	72.6	Confident	70.4	Confident	82 Å²	82	67.4 Å²	67.4	38%	0.383	36%	0.356	S	S	.	.	H	α-helix	trans	-68.1	-43.8	172.7	-167.7	66	26.3	0	0	111.2	N223 S224 K225 T229 L230 E231	N223-Q227 PolarHBondContact O-N 2.97Å; N223-Q227 VanDerWaalsContact O-N 3.13Å; S224-Q227 WeakPolarHBondContact O-CA 3.36Å; S224-Q227 WeakPolarHBondContact O-CB 3.42Å; S224-Q227 PolarHBondContact O-N 3.46Å; S224-Q227 VanDerWaalsContact O-N 3.08Å; K225-Q227 VanDerWaalsContact C-N 3.28Å; K225-Q227 PolarHBondContact O-N 3.28Å; Q227-T229 VanDerWaalsContact C-N 3.29Å; Q227-T229 PolarHBondContact O-N 3.23Å; Q227-L230 WeakPolarHBondContact O-CB 3.15Å; Q227-L230 PolarHBondContact O-N 2.92Å; Q227-L230 VanDerWaalsContact O-N 3.08Å; Q227-E231 PolarHBondContact O-N 3.19Å
228	D	78	Confident	70.8	Confident	83 Å²	83	65 Å²	65	44%	0.444	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-38.1	174.1	-57.1	-23.1	0	0	0	111	S224 K225 L230 E231 Q232	S224-D228 VanDerWaalsContact O-CG 3.26Å; S224-D228 PolarHBondContact O-N 2.77Å; K225-D228 CarbonylContact O-C 3.59Å; K225-D228 WeakPolarHBondContact O-CB 3.34Å; K225-D228 PolarHBondContact O-N 3.36Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.24Å; D228-E231 PolarHBondContact O-N 3.3Å; D228-Q232 WeakPolarHBondContact O-CG 3.35Å; D228-Q232 PolarHBondContact O-N 3Å
229	T	70.4	Confident	71.4	Confident	18 Å²	18	63.7 Å²	63.7	11%	0.11	33%	0.325	C	S	.	.	H	α-helix	trans	-68.1	-31	174.6	60.1	0	0	0	0	112.5	L187 K225 L226 Q227 Q232 I233	L187-T229 HydrophobicContact CD2-CG2 4.21Å; K225-T229 VanDerWaalsContact O-CG2 3.31Å; K225-T229 WeakPolarHBondContact O-CG2 3.33Å; K225-T229 PolarHBondContact O-N 2.94Å; K225-T229 PolarHBondContact O-OG1 2.97Å; L226-T229 VanDerWaalsContact C-OG1 3.3Å; L226-T229 VanDerWaalsContact CA-OG1 3.26Å; L226-T229 WeakPolarHBondContact CA-OG1 3.27Å; L226-T229 PolarHBondContact O-N 3.32Å; L226-T229 PolarHBondContact O-OG1 3.37Å; Q227-T229 VanDerWaalsContact C-N 3.29Å; Q227-T229 PolarHBondContact O-N 3.23Å; T229-Q232 PolarHBondContact O-N 3.42Å; T229-I233 WeakPolarHBondContact O-CB 3.18Å; T229-I233 WeakPolarHBondContact O-CD1 3.36Å; T229-I233 WeakPolarHBondContact O-CG1 3.38Å; T229-I233 PolarHBondContact O-N 2.93Å
230	L	72.7	Confident	71.4	Confident	18 Å²	18	63 Å²	63	9%	0.094	32%	0.322	C	S	.	.	H	α-helix	trans	-68.2	-40.5	172.7	-83.3	168.7	0	0	0	111.3	C203 L226 Q227 D228 I233 E234	C203-L230 HydrophobicContact CB-CD2 3.99Å; C203-L230 HydrophobicContact CB-CG 4.36Å; L226-L230 PolarHBondContact O-N 3.5Å; Q227-L230 WeakPolarHBondContact O-CB 3.15Å; Q227-L230 PolarHBondContact O-N 2.92Å; Q227-L230 VanDerWaalsContact O-N 3.08Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.24Å; L230-I233 HydrophobicContact CD2-CD1 4.43Å; L230-I233 WeakPolarHBondContact O-CB 3.3Å; L230-I233 PolarHBondContact O-N 3.11Å; L230-E234 WeakPolarHBondContact O-CG 3.36Å; L230-E234 PolarHBondContact O-N 2.65Å
231	E	76.3	Confident	71.5	Confident	108 Å²	108	59.4 Å²	59.4	51%	0.505	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-41.4	173.3	-69.9	-179.5	-175.4	0	0	111.3	Q227 D228 I233 E234 E235	Q227-E231 PolarHBondContact O-N 3.19Å; D228-E231 PolarHBondContact O-N 3.3Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 2.89Å; E231-E234 PolarHBondContact O-N 3Å; E231-E234 VanDerWaalsContact O-N 3.17Å; E231-E235 PolarHBondContact O-N 3.18Å
232	Q	75.3	Confident	71.4	Confident	110 Å²	110	55.1 Å²	55.1	51%	0.514	28%	0.28	S	S	.	.	H	α-helix	trans	-62.7	-37.7	172.4	-72	174.3	4	0	0	112.5	D228 T229 E234 E235 Q236	D228-Q232 WeakPolarHBondContact O-CG 3.35Å; D228-Q232 PolarHBondContact O-N 3Å; T229-Q232 PolarHBondContact O-N 3.42Å; Q232-E234 VanDerWaalsContact C-N 3.35Å; Q232-E235 PolarHBondContact O-N 2.98Å; Q232-Q236 WeakPolarHBondContact O-CB 3.5Å; Q232-Q236 WeakPolarHBondContact O-CG 3.48Å; Q232-Q236 PolarHBondContact O-N 3.41Å
233	I	73.7	Confident	71.4	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-40.6	173.8	-70.4	159.9	0	0	0	110.5	L187 L191 I200 T229 L230 E231 Q236 L237	L187-I233 HydrophobicContact CD2-CD1 4.47Å; L191-I233 HydrophobicContact CD1-CD1 4.39Å; L191-I233 HydrophobicContact CD1-CG1 3.99Å; L191-I233 HydrophobicContact CD2-CD1 4.37Å; L191-I233 HydrophobicContact CD2-CG1 3.51Å; L191-I233 HydrophobicContact CG-CG1 4.24Å; I200-I233 HydrophobicContact CD1-CG2 3.98Å; I200-I233 HydrophobicContact CG1-CG2 3.79Å; T229-I233 WeakPolarHBondContact O-CB 3.18Å; T229-I233 WeakPolarHBondContact O-CD1 3.36Å; T229-I233 WeakPolarHBondContact O-CG1 3.38Å; T229-I233 PolarHBondContact O-N 2.93Å; L230-I233 HydrophobicContact CD2-CD1 4.43Å; L230-I233 WeakPolarHBondContact O-CB 3.3Å; L230-I233 PolarHBondContact O-N 3.11Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 2.89Å; I233-Q236 PolarHBondContact O-N 3.02Å; I233-L237 HydrophobicContact CG2-CD1 4.03Å; I233-L237 HydrophobicContact CG2-CG 4.35Å; I233-L237 WeakPolarHBondContact O-CB 3.33Å; I233-L237 VanDerWaalsContact O-CG 3.25Å; I233-L237 WeakPolarHBondContact O-CG 3.26Å; I233-L237 PolarHBondContact O-N 3Å
234	E	70.6	Confident	71.1	Confident	64 Å²	64	56.9 Å²	56.9	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-44	175.6	-71.2	-172.1	178.2	0	0	111.8	L230 E231 Q232 Q236 L237 D238 L263 K265	L230-E234 WeakPolarHBondContact O-CG 3.36Å; L230-E234 PolarHBondContact O-N 2.65Å; E231-E234 PolarHBondContact O-N 3Å; E231-E234 VanDerWaalsContact O-N 3.17Å; Q232-E234 VanDerWaalsContact C-N 3.35Å; E234-Q236 PolarHBondContact O-N 3.23Å; E234-L237 PolarHBondContact O-N 3.16Å; E234-D238 PolarHBondContact O-N 3.26Å; E234-L263 HydrophobicContact CG-CD1 4.45Å; E234-K265 VanDerWaalsContact CD-NZ 3.26Å; E234-K265 IonicContact OE1-NZ 3.86Å; E234-K265 PolarHBondContact OE1-NZ 3.42Å; E234-K265 IonicContact OE2-NZ 2.87Å; E234-K265 PolarHBondContact OE2-NZ 3.46Å
235	E	76.1	Confident	70.2	Confident	133 Å²	133	54.2 Å²	54.2	62%	0.621	27%	0.265	S	S	*	.	H	α-helix	trans	-63.1	-40.9	174.7	-70.1	-177.3	170.9	0	0	112.2	E231 Q232 D238 V239	E231-E235 PolarHBondContact O-N 3.18Å; Q232-E235 PolarHBondContact O-N 2.98Å; E235-D238 PolarHBondContact O-N 3.47Å; E235-V239 WeakPolarHBondContact O-CG2 3.2Å; E235-V239 PolarHBondContact O-N 3.46Å
236	Q	66.6	Low	69.6	Low	95 Å²	95	53.8 Å²	53.8	44%	0.444	26%	0.263	S	S	.	.	H	α-helix	trans	-69.5	-32.7	177.1	-69.9	-67.1	-20.6	0	0	112.4	Y196 Q232 I233 E234 V239 A240	Y196-Q236 HydrophobicContact CE1-CB 4.14Å; Q232-Q236 WeakPolarHBondContact O-CB 3.5Å; Q232-Q236 WeakPolarHBondContact O-CG 3.48Å; Q232-Q236 PolarHBondContact O-N 3.41Å; I233-Q236 PolarHBondContact O-N 3.02Å; E234-Q236 PolarHBondContact O-N 3.23Å; Q236-V239 PolarHBondContact O-N 3.02Å; Q236-A240 VanDerWaalsContact O-CB 3.29Å; Q236-A240 WeakPolarHBondContact O-CB 3.35Å; Q236-A240 PolarHBondContact O-N 3.49Å
237	L	72.9	Confident	68.9	Low	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-41.3	171.8	-78.4	168.1	0	0	0	111.5	Y196 I200 I233 E234 A240 L241 V256 A259 Y260 L263	Y196-L237 HydrophobicContact CD1-CD2 4.19Å; Y196-L237 HydrophobicContact CD1-CG 4.42Å; Y196-L237 HydrophobicContact CD2-CD2 4.08Å; Y196-L237 HydrophobicContact CG-CD2 3.77Å; Y196-L237 HydrophobicContact CG-CG 4.48Å; I200-L237 HydrophobicContact CD1-CD1 4.14Å; I233-L237 HydrophobicContact CG2-CD1 4.03Å; I233-L237 HydrophobicContact CG2-CG 4.35Å; I233-L237 WeakPolarHBondContact O-CB 3.33Å; I233-L237 VanDerWaalsContact O-CG 3.25Å; I233-L237 WeakPolarHBondContact O-CG 3.26Å; I233-L237 PolarHBondContact O-N 3Å; E234-L237 PolarHBondContact O-N 3.16Å; L237-A240 WeakPolarHBondContact O-CB 3.39Å; L237-A240 PolarHBondContact O-N 2.93Å; L237-L241 WeakPolarHBondContact O-CG 3.25Å; L237-L241 PolarHBondContact O-N 2.89Å; L237-V256 HydrophobicContact CD2-CB 4.47Å; L237-V256 HydrophobicContact CD2-CG1 4.1Å; L237-V256 HydrophobicContact CD2-CG2 4.35Å; L237-A259 HydrophobicContact CD1-CB 4.23Å; L237-A259 HydrophobicContact CD2-CB 3.72Å; L237-Y260 HydrophobicContact CB-CE2 4.03Å; L237-Y260 WeakPolarHBondContact CB-OH 3.29Å; L237-Y260 HydrophobicContact CD2-CE2 4.29Å; L237-L263 HydrophobicContact CD1-CD1 3.65Å
238	D	69.6	Low	68	Low	42 Å²	42	56 Å²	56	23%	0.225	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-39.8	175.1	-79	0.3	0	0	0	111.6	E234 E235 L241 S242 Y260 Q272	E234-D238 PolarHBondContact O-N 3.26Å; E235-D238 PolarHBondContact O-N 3.47Å; D238-L241 PolarHBondContact O-N 3.25Å; D238-S242 PolarHBondContact O-N 3.4Å; D238-Y260 PolarHBondContact OD1-OH 3.4Å; D238-Q272 VanDerWaalsContact CG-NE2 3.3Å; D238-Q272 VanDerWaalsContact OD1-CD 3.26Å; D238-Q272 PolarHBondContact OD1-NE2 3.01Å; D238-Q272 PolarHBondContact OD1-OE1 2.79Å; D238-Q272 PolarHBondContact OD2-NE2 3.4Å
239	V	72.1	Confident	67	Low	63 Å²	63	57.1 Å²	57.1	38%	0.382	28%	0.283	S	S	.	.	H	α-helix	trans	-64.5	-41.9	173.3	172.6	0	0	0	0	111	E235 Q236 S242 K243	E235-V239 WeakPolarHBondContact O-CG2 3.2Å; E235-V239 PolarHBondContact O-N 3.46Å; Q236-V239 PolarHBondContact O-N 3.02Å; V239-S242 PolarHBondContact O-N 3.32Å; V239-S242 PolarHBondContact O-OG 3.42Å; V239-K243 PolarHBondContact O-N 3.44Å; V239-K243 VanDerWaalsContact O-N 3.08Å
240	A	65.3	Low	66.7	Low	1 Å²	1	61.1 Å²	61.1	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-45	175.3	0	0	0	0	0	111.5	Y196 Q236 L237 S242 K243 I244 V256	Y196-A240 HydrophobicContact CE2-CB 4.13Å; Q236-A240 VanDerWaalsContact O-CB 3.29Å; Q236-A240 WeakPolarHBondContact O-CB 3.35Å; Q236-A240 PolarHBondContact O-N 3.49Å; L237-A240 WeakPolarHBondContact O-CB 3.39Å; L237-A240 PolarHBondContact O-N 2.93Å; A240-S242 VanDerWaalsContact C-N 3.28Å; A240-S242 PolarHBondContact O-N 3.23Å; A240-K243 PolarHBondContact O-N 3.39Å; A240-K243 VanDerWaalsContact O-N 3.1Å; A240-I244 WeakPolarHBondContact O-CD1 3.49Å; A240-I244 VanDerWaalsContact O-CG1 3.26Å; A240-I244 WeakPolarHBondContact O-CG1 3.12Å; A240-I244 PolarHBondContact O-N 3.11Å; A240-I244 VanDerWaalsContact O-N 3.07Å; A240-V256 HydrophobicContact CB-CG2 4.06Å
241	L	68.7	Low	66.2	Low	8 Å²	8	66.1 Å²	66.1	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-56	-42.3	172.7	-77.6	-179.3	0	0	0	111.9	L237 D238 K243 I244 C245 Y253 V256 Y260 L273	L237-L241 WeakPolarHBondContact O-CG 3.25Å; L237-L241 PolarHBondContact O-N 2.89Å; D238-L241 PolarHBondContact O-N 3.25Å; L241-K243 VanDerWaalsContact C-N 3.33Å; L241-K243 PolarHBondContact O-N 3.2Å; L241-I244 HydrophobicContact CD2-CD1 4.5Å; L241-I244 PolarHBondContact O-N 2.83Å; L241-C245 PolarHBondContact O-N 3.42Å; L241-C245 PolarHBondContact O-SG 3.3Å; L241-Y253 HydrophobicContact CD2-CE2 4.35Å; L241-V256 HydrophobicContact CD2-CG1 3.64Å; L241-V256 HydrophobicContact CG-CG1 3.96Å; L241-Y260 HydrophobicContact CD1-CE2 3.56Å; L241-Y260 WeakPolarHBondContact CD1-OH 3.4Å; L241-Y260 HydrophobicContact CD2-CE2 4.26Å; L241-Y260 HydrophobicContact CG-CE2 3.88Å; L241-L273 HydrophobicContact CD2-CD1 4.41Å
242	S	65.8	Low	65.8	Low	42 Å²	42	62.4 Å²	62.4	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-31.5	178	82	0	0	0	0	113.7	D238 V239 A240	D238-S242 PolarHBondContact O-N 3.4Å; V239-S242 PolarHBondContact O-N 3.32Å; V239-S242 PolarHBondContact O-OG 3.42Å; A240-S242 VanDerWaalsContact C-N 3.28Å; A240-S242 PolarHBondContact O-N 3.23Å
243	K	67.4	Low	65.6	Low	121 Å²	121	57.4 Å²	57.4	53%	0.526	29%	0.289	S	S	.	.	H	α-helix	trans	-73	-34.9	176.1	-73.1	176.7	-178.9	173.8	0	111.7	V239 A240 L241 C245 K246 N247	V239-K243 PolarHBondContact O-N 3.44Å; V239-K243 VanDerWaalsContact O-N 3.08Å; A240-K243 PolarHBondContact O-N 3.39Å; A240-K243 VanDerWaalsContact O-N 3.1Å; L241-K243 VanDerWaalsContact C-N 3.33Å; L241-K243 PolarHBondContact O-N 3.2Å; K243-C245 PolarHBondContact O-N 2.88Å; K243-K246 PolarHBondContact O-N 3.08Å; K243-N247 PolarHBondContact O-N 3.37Å
244	I	61.5	Low	65.4	Low	6 Å²	6	58.6 Å²	58.6	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-28.1	177.6	-65	162.5	0	0	0	111.7	A240 L241 K246 N247 F248 Y253 V256	A240-I244 WeakPolarHBondContact O-CD1 3.49Å; A240-I244 VanDerWaalsContact O-CG1 3.26Å; A240-I244 WeakPolarHBondContact O-CG1 3.12Å; A240-I244 PolarHBondContact O-N 3.11Å; A240-I244 VanDerWaalsContact O-N 3.07Å; L241-I244 HydrophobicContact CD2-CD1 4.5Å; L241-I244 PolarHBondContact O-N 2.83Å; I244-K246 PolarHBondContact O-N 3.29Å; I244-N247 CarbonylContact O-C 3.57Å; I244-F248 HydrophobicContact CG2-CD2 3.59Å; I244-F248 HydrophobicContact CG2-CE2 4.06Å; I244-Y253 HydrophobicContact CD1-CD2 3.85Å; I244-Y253 HydrophobicContact CG2-CD2 3.93Å; I244-V256 HydrophobicContact CD1-CB 4.42Å; I244-V256 HydrophobicContact CD1-CG2 4.14Å
245	C	57.8	Low	65.3	Low	2 Å²	2	59.1 Å²	59.1	1%	0.014	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.8	174.1	-61.1	0	0	0	0	114.5	L241 K243 F277 A280 S338	L241-C245 PolarHBondContact O-N 3.42Å; L241-C245 PolarHBondContact O-SG 3.3Å; K243-C245 PolarHBondContact O-N 2.88Å; C245-F277 HydrophobicContact CB-CD1 3.99Å; C245-F277 HydrophobicContact CB-CE1 3.88Å; C245-F277 HydrophobicContact CB-CZ 4.39Å; C245-A280 HydrophobicContact CB-CB 3.7Å; C245-S338 PolarHBondContact O-OG 2.85Å
246	K	56.8	Low	65.2	Low	120 Å²	120	52.8 Å²	52.8	52%	0.522	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-43.7	177.6	-67.9	-178.3	179.3	-179.1	0	112.4	K243 I244	K243-K246 PolarHBondContact O-N 3.08Å; I244-K246 PolarHBondContact O-N 3.29Å
247	N	55.9	Low	65.2	Low	124 Å²	124	50.6 Å²	50.6	66%	0.663	26%	0.257	S	S	*	.	S	Bend	trans	-132.5	110	175	-73.6	-11.3	0	0	0	108.8	K243 I244 D249	K243-N247 PolarHBondContact O-N 3.37Å; I244-N247 CarbonylContact O-C 3.57Å; N247-D249 PolarHBondContact O-N 2.92Å
248	F	54.2	Low	64.9	Low	16 Å²	16	55.5 Å²	55.5	7%	0.07	28%	0.28	C	S	.	.			trans	-80.5	105.8	179.6	-172.1	-94.6	0	0	0	110.9	I244 I250 Y253 R341 T342 W345	I244-F248 HydrophobicContact CG2-CD2 3.59Å; I244-F248 HydrophobicContact CG2-CE2 4.06Å; F248-I250 HydrophobicContact CD1-CG1 4.25Å; F248-I250 HydrophobicContact CE1-CG1 3.81Å; F248-Y253 AromaticContact CE2-CD1 3.92Å; F248-Y253 HydrophobicContact CE2-CD1 3.92Å; F248-Y253 HydrophobicContact CE2-CD2 4.1Å; F248-Y253 HydrophobicContact CE2-CE1 4.46Å; F248-Y253 AromaticContact CE2-CG 3.71Å; F248-Y253 HydrophobicContact CE2-CG 3.71Å; F248-Y253 AromaticContact CZ-CD1 3.87Å; F248-Y253 HydrophobicContact CZ-CD1 3.87Å; F248-Y253 AromaticContact CZ-CG 3.98Å; F248-Y253 HydrophobicContact CZ-CG 3.98Å; F248-R341 HydrophobicContact CB-CB 4.37Å; F248-R341 HydrophobicContact CD1-CB 3.53Å; F248-R341 HydrophobicContact CD1-CG 4.49Å; F248-R341 HydrophobicContact CE1-CB 3.91Å; F248-R341 HydrophobicContact CG-CB 3.92Å; F248-T342 WeakPolarHBondContact CD2-OG1 3.47Å; F248-T342 HydrophobicContact CE2-CG2 4.27Å; F248-T342 WeakPolarHBondContact CE2-OG1 3.49Å; F248-W345 HydrophobicContact CE1-CB 4.42Å; F248-W345 HydrophobicContact CZ-CB 3.94Å; F248-W345 HydrophobicContact CZ-CG 4.25Å
249	D	58.1	Low	64.9	Low	107 Å²	107	53.5 Å²	53.5	57%	0.572	27%	0.269	S	S	*	.			trans	-100.3	116.4	168.2	-79.5	-34.1	0	0	0	110.7	N247 N251 H252 Y253	N247-D249 PolarHBondContact O-N 2.92Å; D249-N251 VanDerWaalsContact C-N 3.26Å; D249-N251 PolarHBondContact O-N 2.94Å; D249-H252 HydrophobicContact CB-CB 4.01Å; D249-H252 PolarHBondContact O-N 2.88Å; D249-Y253 PolarHBondContact O-N 3.44Å
250	I	64.3	Low	64.8	Low	102 Å²	102	51 Å²	51	52%	0.523	25%	0.253	S	S	.	.	H	α-helix	trans	-52.3	-44.5	-179.6	-66.6	166.1	0	0	0	111.1	F248 T254	F248-I250 HydrophobicContact CD1-CG1 4.25Å; F248-I250 HydrophobicContact CE1-CG1 3.81Å; I250-T254 VanDerWaalsContact O-CG2 3.27Å; I250-T254 WeakPolarHBondContact O-CG2 3.41Å; I250-T254 PolarHBondContact O-N 3.48Å; I250-T254 PolarHBondContact O-OG1 3.44Å
251	N	62.1	Low	65	Low	123 Å²	123	58.6 Å²	58.6	66%	0.658	28%	0.282	S	S	*	.	H	α-helix	trans	-75	-31.2	-175.6	-65.4	-25.6	0	0	0	113.5	D249 T254 K255	D249-N251 VanDerWaalsContact C-N 3.26Å; D249-N251 PolarHBondContact O-N 2.94Å; N251-T254 VanDerWaalsContact C-OG1 3.27Å; N251-T254 WeakPolarHBondContact CA-OG1 3.5Å; N251-T254 PolarHBondContact O-OG1 3.17Å; N251-K255 WeakPolarHBondContact O-CG 3.48Å; N251-K255 PolarHBondContact O-N 3.23Å
252	H	67.1	Low	65	Low	30 Å²	30	62.1 Å²	62.1	14%	0.139	30%	0.3	C	S	.	.	H	α-helix	trans	-76.8	-39.7	177.1	-167.8	89.3	0	0	0	109.6	E194 Y196 D249 T254 K255 V256	E194-H252 IonicContact OE2-CE1 3.86Å; E194-H252 PolarHBondContact OE2-CE1 2.79Å; E194-H252 IonicContact OE2-ND1 2.79Å; E194-H252 PolarHBondContact OE2-ND1 3.1Å; Y196-H252 AromaticContact CE2-CE1 3.92Å; D249-H252 HydrophobicContact CB-CB 4.01Å; D249-H252 PolarHBondContact O-N 2.88Å; H252-T254 PolarHBondContact O-N 3.46Å; H252-K255 PolarHBondContact O-N 3.01Å; H252-V256 VanDerWaalsContact O-CG2 3.32Å; H252-V256 WeakPolarHBondContact O-CG2 3.38Å; H252-V256 PolarHBondContact O-N 3.02Å
253	Y	70.3	Confident	64.9	Low	6 Å²	6	62.2 Å²	62.2	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-41	174.3	-167.5	-109.5	0	0	0	112.9	L241 I244 F248 D249 K255 V256 Q257 L273 T342 W345 H346	L241-Y253 HydrophobicContact CD2-CE2 4.35Å; I244-Y253 HydrophobicContact CD1-CD2 3.85Å; I244-Y253 HydrophobicContact CG2-CD2 3.93Å; F248-Y253 AromaticContact CE2-CD1 3.92Å; F248-Y253 HydrophobicContact CE2-CD1 3.92Å; F248-Y253 HydrophobicContact CE2-CD2 4.1Å; F248-Y253 HydrophobicContact CE2-CE1 4.46Å; F248-Y253 AromaticContact CE2-CG 3.71Å; F248-Y253 HydrophobicContact CE2-CG 3.71Å; F248-Y253 AromaticContact CZ-CD1 3.87Å; F248-Y253 HydrophobicContact CZ-CD1 3.87Å; F248-Y253 AromaticContact CZ-CG 3.98Å; F248-Y253 HydrophobicContact CZ-CG 3.98Å; D249-Y253 PolarHBondContact O-N 3.44Å; Y253-K255 VanDerWaalsContact C-N 3.3Å; Y253-K255 PolarHBondContact O-N 3.03Å; Y253-V256 PolarHBondContact O-N 3.04Å; Y253-Q257 WeakPolarHBondContact O-CB 3.26Å; Y253-Q257 PolarHBondContact O-N 3.26Å; Y253-Q257 PolarHBondContact OH-OE1 3.4Å; Y253-L273 HydrophobicContact CE2-CD1 3.88Å; Y253-L273 WeakPolarHBondContact OH-CD1 3.27Å; Y253-T342 HydrophobicContact CE1-CG2 3.98Å; Y253-T342 HydrophobicContact CE2-CG2 4.23Å; Y253-T342 WeakPolarHBondContact OH-CG2 3.44Å; Y253-W345 AromaticContact CD1-CD2 3.55Å; Y253-W345 HydrophobicContact CD1-CD2 3.55Å; Y253-W345 AromaticContact CD1-CE2 3.82Å; Y253-W345 AromaticContact CD1-CE3 3.77Å; Y253-W345 HydrophobicContact CD1-CE3 3.77Å; Y253-W345 AromaticContact CD1-CG 3.97Å; Y253-W345 HydrophobicContact CD1-CG 3.97Å; Y253-W345 HydrophobicContact CD1-CH2 4.49Å; Y253-W345 HydrophobicContact CD1-CZ2 4.26Å; Y253-W345 HydrophobicContact CD1-CZ3 4.28Å; Y253-W345 AromaticContact CE1-CD2 3.74Å; Y253-W345 HydrophobicContact CE1-CD2 3.74Å; Y253-W345 AromaticContact CE1-CE3 3.44Å; Y253-W345 HydrophobicContact CE1-CE3 3.44Å; Y253-W345 VanDerWaalsContact CE1-CE3 3.44Å; Y253-W345 HydrophobicContact CE1-CG 4.37Å; Y253-W345 HydrophobicContact CE1-CH2 4.41Å; Y253-W345 AromaticContact CE1-CZ3 3.85Å; Y253-W345 HydrophobicContact CE1-CZ3 3.85Å; Y253-H346 AromaticContact CE1-NE2 3.74Å; Y253-H346 AromaticContact CZ-NE2 3.72Å; Y253-H346 PolarHBondContact OH-NE2 3.1Å
254	T	70.4	Confident	64.6	Low	25 Å²	25	59.4 Å²	59.4	15%	0.153	30%	0.303	C	S	.	.	H	α-helix	trans	-58.3	-42.4	173.5	49.6	0	0	0	0	112.1	I250 N251 H252 Q258 W345	I250-T254 VanDerWaalsContact O-CG2 3.27Å; I250-T254 WeakPolarHBondContact O-CG2 3.41Å; I250-T254 PolarHBondContact O-N 3.48Å; I250-T254 PolarHBondContact O-OG1 3.44Å; N251-T254 VanDerWaalsContact C-OG1 3.27Å; N251-T254 WeakPolarHBondContact CA-OG1 3.5Å; N251-T254 PolarHBondContact O-OG1 3.17Å; H252-T254 PolarHBondContact O-N 3.46Å; T254-Q258 VanDerWaalsContact O-CB 3.3Å; T254-Q258 WeakPolarHBondContact O-CB 3.32Å; T254-Q258 WeakPolarHBondContact O-CG 3.49Å; T254-Q258 PolarHBondContact O-N 3.08Å; T254-W345 HydrophobicContact CG2-CZ2 3.59Å
255	K	69.1	Low	64.9	Low	75 Å²	75	63.5 Å²	63.5	33%	0.326	32%	0.32	S	S	.	.	H	α-helix	trans	-68.6	-42.7	-180	-74.2	177.6	177.1	-170.3	0	111.2	P197 N251 H252 Y253 Q258 A259	P197-K255 HydrophobicContact CG-CB 4.12Å; P197-K255 HydrophobicContact CG-CG 4.49Å; P197-K255 WeakPolarHBondContact CG-O 3.45Å; N251-K255 WeakPolarHBondContact O-CG 3.48Å; N251-K255 PolarHBondContact O-N 3.23Å; H252-K255 PolarHBondContact O-N 3.01Å; Y253-K255 VanDerWaalsContact C-N 3.3Å; Y253-K255 PolarHBondContact O-N 3.03Å; K255-Q258 PolarHBondContact O-N 3.13Å; K255-A259 WeakPolarHBondContact O-CB 3.13Å; K255-A259 PolarHBondContact O-N 3.24Å
256	V	72.6	Confident	65.1	Low	1 Å²	1	65.4 Å²	65.4	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-43.8	176.3	171.9	0	0	0	0	110.8	Y196 L237 A240 L241 I244 H252 Y253 A259 Y260	Y196-V256 HydrophobicContact CD2-CG2 4.14Å; Y196-V256 HydrophobicContact CE2-CG2 4.3Å; L237-V256 HydrophobicContact CD2-CB 4.47Å; L237-V256 HydrophobicContact CD2-CG1 4.1Å; L237-V256 HydrophobicContact CD2-CG2 4.35Å; A240-V256 HydrophobicContact CB-CG2 4.06Å; L241-V256 HydrophobicContact CD2-CG1 3.64Å; L241-V256 HydrophobicContact CG-CG1 3.96Å; I244-V256 HydrophobicContact CD1-CB 4.42Å; I244-V256 HydrophobicContact CD1-CG2 4.14Å; H252-V256 VanDerWaalsContact O-CG2 3.32Å; H252-V256 WeakPolarHBondContact O-CG2 3.38Å; H252-V256 PolarHBondContact O-N 3.02Å; Y253-V256 PolarHBondContact O-N 3.04Å; V256-A259 WeakPolarHBondContact O-CB 3.4Å; V256-A259 PolarHBondContact O-N 3.07Å; V256-Y260 HydrophobicContact CG1-CD2 3.76Å; V256-Y260 HydrophobicContact CG1-CE2 3.54Å; V256-Y260 WeakPolarHBondContact O-CD2 3.21Å; V256-Y260 PolarHBondContact O-N 3.03Å
257	Q	68.1	Low	65.5	Low	49 Å²	49	64.1 Å²	64.1	23%	0.229	33%	0.328	C	S	.	.	H	α-helix	trans	-70.7	-34.9	178.5	-169.4	155.9	-23.2	0	0	113	Y253 A259 Y260 R261 W345 H346	Y253-Q257 WeakPolarHBondContact O-CB 3.26Å; Y253-Q257 PolarHBondContact O-N 3.26Å; Y253-Q257 PolarHBondContact OH-OE1 3.4Å; Q257-A259 VanDerWaalsContact C-N 3.34Å; Q257-Y260 PolarHBondContact O-N 2.86Å; Q257-R261 WeakPolarHBondContact O-CB 3.36Å; Q257-R261 PolarHBondContact O-N 3.25Å; Q257-W345 HydrophobicContact CB-CH2 3.99Å; Q257-W345 HydrophobicContact CG-CH2 3.93Å; Q257-W345 HydrophobicContact CG-CZ3 4.31Å; Q257-W345 VanDerWaalsContact NE2-CZ3 3.31Å; Q257-W345 VanDerWaalsContact OE1-CH2 3.27Å; Q257-H346 PolarHBondContact NE2-CE1 2.99Å; Q257-H346 PolarHBondContact OE1-CE1 3.17Å; Q257-H346 PolarHBondContact OE1-NE2 3.06Å
258	Q	66.6	Low	66.1	Low	102 Å²	102	61.5 Å²	61.5	48%	0.477	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-40.3	170.3	-77.1	173.2	1.9	0	0	111.6	P197 T254 K255 R261 L262	P197-Q258 HydrophobicContact CB-CB 4.37Å; P197-Q258 HydrophobicContact CG-CB 3.89Å; T254-Q258 VanDerWaalsContact O-CB 3.3Å; T254-Q258 WeakPolarHBondContact O-CB 3.32Å; T254-Q258 WeakPolarHBondContact O-CG 3.49Å; T254-Q258 PolarHBondContact O-N 3.08Å; K255-Q258 PolarHBondContact O-N 3.13Å; Q258-R261 PolarHBondContact O-N 3.05Å; Q258-L262 WeakPolarHBondContact O-CG 3.17Å; Q258-L262 PolarHBondContact O-N 3.3Å
259	A	68.9	Low	66.6	Low	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-47	173.2	0	0	0	0	0	112.3	P197 I200 L237 K255 V256 Q257 R261 L262 L263	P197-A259 HydrophobicContact CG-CB 4.4Å; I200-A259 HydrophobicContact CD1-CB 3.41Å; I200-A259 VanDerWaalsContact CD1-CB 3.41Å; L237-A259 HydrophobicContact CD1-CB 4.23Å; L237-A259 HydrophobicContact CD2-CB 3.72Å; K255-A259 WeakPolarHBondContact O-CB 3.13Å; K255-A259 PolarHBondContact O-N 3.24Å; V256-A259 WeakPolarHBondContact O-CB 3.4Å; V256-A259 PolarHBondContact O-N 3.07Å; Q257-A259 VanDerWaalsContact C-N 3.34Å; A259-R261 VanDerWaalsContact C-N 3.32Å; A259-R261 PolarHBondContact O-N 3.32Å; A259-L262 PolarHBondContact O-N 3.32Å; A259-L263 WeakPolarHBondContact O-CG 3.46Å; A259-L263 PolarHBondContact O-N 3.48Å
260	Y	70.1	Confident	67	Low	12 Å²	12	56.6 Å²	56.6	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-32.4	174.9	-79.3	-71	0	0	0	113.4	L237 D238 L241 V256 Q257 L263 G264 K265 A269	L237-Y260 HydrophobicContact CB-CE2 4.03Å; L237-Y260 WeakPolarHBondContact CB-OH 3.29Å; L237-Y260 HydrophobicContact CD2-CE2 4.29Å; D238-Y260 PolarHBondContact OD1-OH 3.4Å; L241-Y260 HydrophobicContact CD1-CE2 3.56Å; L241-Y260 WeakPolarHBondContact CD1-OH 3.4Å; L241-Y260 HydrophobicContact CD2-CE2 4.26Å; L241-Y260 HydrophobicContact CG-CE2 3.88Å; V256-Y260 HydrophobicContact CG1-CD2 3.76Å; V256-Y260 HydrophobicContact CG1-CE2 3.54Å; V256-Y260 WeakPolarHBondContact O-CD2 3.21Å; V256-Y260 PolarHBondContact O-N 3.03Å; Q257-Y260 PolarHBondContact O-N 2.86Å; Y260-L263 PolarHBondContact O-N 3.26Å; Y260-G264 PolarHBondContact O-N 2.96Å; Y260-G264 VanDerWaalsContact O-N 3.15Å; Y260-K265 PolarHBondContact O-N 3.05Å; Y260-A269 HydrophobicContact CD1-CB 3.66Å; Y260-A269 HydrophobicContact CD2-CB 3.98Å; Y260-A269 HydrophobicContact CE1-CB 3.94Å; Y260-A269 HydrophobicContact CE2-CB 4.26Å; Y260-A269 HydrophobicContact CG-CB 3.68Å
261	R	69.9	Low	67.2	Low	159 Å²	159	55.2 Å²	55.2	60%	0.6	29%	0.286	S	S	*	.	H	α-helix	trans	-66.8	-40.9	174.2	-158.8	178.7	-136.1	169.3	3.8	111.2	Q257 Q258 A259 L263 G264 D353	Q257-R261 WeakPolarHBondContact O-CB 3.36Å; Q257-R261 PolarHBondContact O-N 3.25Å; Q258-R261 PolarHBondContact O-N 3.05Å; A259-R261 VanDerWaalsContact C-N 3.32Å; A259-R261 PolarHBondContact O-N 3.32Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.42Å; R261-G264 PolarHBondContact O-N 3.37Å; R261-D353 IonicContact CZ-OD2 2.65Å; R261-D353 IonicContact NH1-OD2 3.8Å; R261-D353 PolarHBondContact NH1-OD2 3.28Å; R261-D353 IonicContact NH2-OD2 3.59Å; R261-D353 PolarHBondContact NH2-OD2 2.76Å
262	L	67.2	Low	67.6	Low	83 Å²	83	51.6 Å²	51.6	44%	0.435	27%	0.265	S	S	.	.	H	α-helix	trans	-67.2	-29.6	175	-71	170.6	0	0	0	112.8	P197 I200 Q258 A259	P197-L262 HydrophobicContact CB-CD1 4.14Å; I200-L262 HydrophobicContact CG2-CB 4.09Å; Q258-L262 WeakPolarHBondContact O-CG 3.17Å; Q258-L262 PolarHBondContact O-N 3.3Å; A259-L262 PolarHBondContact O-N 3.32Å
263	L	64.4	Low	67.8	Low	44 Å²	44	50.4 Å²	50.4	23%	0.23	26%	0.26	C	S	.	.	H	α-helix	trans	-79.6	-13.3	174.3	-72.8	163.4	0	0	0	113.7	I200 E234 L237 A259 Y260 R261 K265	I200-L263 HydrophobicContact CD1-CD1 3.88Å; I200-L263 HydrophobicContact CD1-CG 4.13Å; I200-L263 HydrophobicContact CG2-CD2 4.37Å; I200-L263 HydrophobicContact CG2-CG 4.36Å; E234-L263 HydrophobicContact CG-CD1 4.45Å; L237-L263 HydrophobicContact CD1-CD1 3.65Å; A259-L263 WeakPolarHBondContact O-CG 3.46Å; A259-L263 PolarHBondContact O-N 3.48Å; Y260-L263 PolarHBondContact O-N 3.26Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.42Å; L263-K265 PolarHBondContact O-N 3.1Å
264	G	61.7	Low	67.8	Low	62 Å²	62	51.1 Å²	51.1	64%	0.639	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	16.9	-178.2	0	0	0	0	0	114.4	Y260 R261	Y260-G264 PolarHBondContact O-N 2.96Å; Y260-G264 VanDerWaalsContact O-N 3.15Å; R261-G264 PolarHBondContact O-N 3.37Å
265	K	67.4	Low	68.2	Low	91 Å²	91	55.2 Å²	55.2	40%	0.396	28%	0.282	S	S	.	.			trans	-114.2	47.8	-174.3	-77.7	-175.8	-175.9	169.6	0	111.7	E234 Y260 L263 T268 A269	E234-K265 VanDerWaalsContact CD-NZ 3.26Å; E234-K265 IonicContact OE1-NZ 3.86Å; E234-K265 PolarHBondContact OE1-NZ 3.42Å; E234-K265 IonicContact OE2-NZ 2.87Å; E234-K265 PolarHBondContact OE2-NZ 3.46Å; Y260-K265 PolarHBondContact O-N 3.05Å; L263-K265 PolarHBondContact O-N 3.1Å; K265-T268 WeakPolarHBondContact CB-OG1 3.2Å; K265-T268 PolarHBondContact O-OG1 3.01Å; K265-T268 VanDerWaalsContact O-OG1 3.08Å; K265-A269 PolarHBondContact O-N 3.42Å
266	T	62.5	Low	68.3	Low	42 Å²	42	53.1 Å²	53.1	26%	0.258	27%	0.273	S	S	.	.	H	α-helix	trans	-69.3	-32.9	-177.5	46.9	0	0	0	0	113.1	M270	T266-M270 WeakPolarHBondContact O-CG 3.35Å; T266-M270 PolarHBondContact O-N 2.95Å
267	Q	64.2	Low	68.2	Low	94 Å²	94	53.1 Å²	53.1	44%	0.439	27%	0.273	S	S	.	.	H	α-helix	trans	-70.5	-42.1	179	-65.8	-179	-4.6	0	0	112.7	A269 M270 D271 D372	Q267-A269 VanDerWaalsContact C-N 3.32Å; Q267-A269 PolarHBondContact O-N 3.45Å; Q267-M270 PolarHBondContact O-N 3.26Å; Q267-D271 PolarHBondContact O-N 3.19Å; Q267-D372 PolarHBondContact NE2-OD1 3.5Å
268	T	68.3	Low	68.4	Low	69 Å²	69	52.6 Å²	52.6	42%	0.423	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-35.3	177.7	53.6	0	0	0	0	111.5	K265 M270 D271 Q272	K265-T268 WeakPolarHBondContact CB-OG1 3.2Å; K265-T268 PolarHBondContact O-OG1 3.01Å; K265-T268 VanDerWaalsContact O-OG1 3.08Å; T268-M270 VanDerWaalsContact C-N 3.27Å; T268-M270 PolarHBondContact O-N 3.19Å; T268-D271 PolarHBondContact O-N 3.29Å; T268-Q272 VanDerWaalsContact O-CB 3.31Å; T268-Q272 WeakPolarHBondContact O-CB 3.44Å; T268-Q272 VanDerWaalsContact O-CG 3.29Å; T268-Q272 WeakPolarHBondContact O-CG 3.21Å; T268-Q272 PolarHBondContact O-N 3.3Å; T268-Q272 PolarHBondContact O-OE1 3.23Å
269	A	65.9	Low	68.9	Low	12 Å²	12	52.3 Å²	52.3	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-38	174.5	0	0	0	0	0	112.1	Y260 K265 Q267 L273	Y260-A269 HydrophobicContact CD1-CB 3.66Å; Y260-A269 HydrophobicContact CD2-CB 3.98Å; Y260-A269 HydrophobicContact CE1-CB 3.94Å; Y260-A269 HydrophobicContact CE2-CB 4.26Å; Y260-A269 HydrophobicContact CG-CB 3.68Å; K265-A269 PolarHBondContact O-N 3.42Å; Q267-A269 VanDerWaalsContact C-N 3.32Å; Q267-A269 PolarHBondContact O-N 3.45Å; A269-L273 WeakPolarHBondContact O-CB 3.38Å; A269-L273 PolarHBondContact O-N 3.04Å
270	M	65.2	Low	68.9	Low	8 Å²	8	52.7 Å²	52.7	4%	0.039	28%	0.275	C	S	.	.	H	α-helix	trans	-71.6	-40.1	177.8	-68.5	-59.9	-60	0	0	113.1	T266 Q267 T268 L273 H274 I376 L380	T266-M270 WeakPolarHBondContact O-CG 3.35Å; T266-M270 PolarHBondContact O-N 2.95Å; Q267-M270 PolarHBondContact O-N 3.26Å; T268-M270 VanDerWaalsContact C-N 3.27Å; T268-M270 PolarHBondContact O-N 3.19Å; M270-L273 PolarHBondContact O-N 3.22Å; M270-H274 PolarHBondContact O-N 3.27Å; M270-I376 HydrophobicContact CE-CG2 3.98Å; M270-I376 HydrophobicContact CG-CG1 4.1Å; M270-I376 HydrophobicContact SD-CG2 4.3Å; M270-L380 HydrophobicContact CE-CD1 3.92Å; M270-L380 HydrophobicContact CE-CD2 3.78Å; M270-L380 HydrophobicContact CE-CG 3.61Å
271	D	69.6	Low	68.9	Low	72 Å²	72	52.1 Å²	52.1	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-69.5	-38	175.7	-77.9	-22.8	0	0	0	111.3	Q267 T268 H274 M275 K379	Q267-D271 PolarHBondContact O-N 3.19Å; T268-D271 PolarHBondContact O-N 3.29Å; D271-H274 PolarHBondContact O-N 2.97Å; D271-M275 WeakPolarHBondContact O-CB 3.28Å; D271-M275 PolarHBondContact O-N 2.89Å; D271-K379 IonicContact OD1-NZ 3.42Å; D271-K379 PolarHBondContact OD1-NZ 3.4Å; D271-K379 IonicContact OD2-NZ 3.14Å
272	Q	70.6	Confident	69	Low	47 Å²	47	48 Å²	48	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-42.4	170.2	-75.8	168.6	-44	0	0	111.2	D238 T268 H274 M275 H276	D238-Q272 VanDerWaalsContact CG-NE2 3.3Å; D238-Q272 VanDerWaalsContact OD1-CD 3.26Å; D238-Q272 PolarHBondContact OD1-NE2 3.01Å; D238-Q272 PolarHBondContact OD1-OE1 2.79Å; D238-Q272 PolarHBondContact OD2-NE2 3.4Å; T268-Q272 VanDerWaalsContact O-CB 3.31Å; T268-Q272 WeakPolarHBondContact O-CB 3.44Å; T268-Q272 VanDerWaalsContact O-CG 3.29Å; T268-Q272 WeakPolarHBondContact O-CG 3.21Å; T268-Q272 PolarHBondContact O-N 3.3Å; T268-Q272 PolarHBondContact O-OE1 3.23Å; Q272-H274 PolarHBondContact O-N 2.9Å; Q272-M275 CarbonylContact O-C 3.57Å; Q272-M275 WeakPolarHBondContact O-CB 3.11Å; Q272-M275 PolarHBondContact O-N 2.96Å; Q272-M275 VanDerWaalsContact O-N 3.16Å; Q272-H276 WeakPolarHBondContact O-CB 3.4Å; Q272-H276 PolarHBondContact O-CD2 3.43Å; Q272-H276 PolarHBondContact O-N 3.27Å
273	L	70.5	Confident	69.4	Low	6 Å²	6	47.3 Å²	47.3	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-46.2	177.1	-177.3	140.7	0	0	0	111.4	L241 Y253 A269 M270 M275 H276 F277 Y339 T342	L241-L273 HydrophobicContact CD2-CD1 4.41Å; Y253-L273 HydrophobicContact CE2-CD1 3.88Å; Y253-L273 WeakPolarHBondContact OH-CD1 3.27Å; A269-L273 WeakPolarHBondContact O-CB 3.38Å; A269-L273 PolarHBondContact O-N 3.04Å; M270-L273 PolarHBondContact O-N 3.22Å; L273-M275 VanDerWaalsContact C-N 3.34Å; L273-M275 PolarHBondContact O-N 3.03Å; L273-H276 PolarHBondContact O-N 3.11Å; L273-F277 HydrophobicContact CD1-CE2 4.14Å; L273-F277 HydrophobicContact CD2-CD2 3.52Å; L273-F277 HydrophobicContact CD2-CE2 3.51Å; L273-F277 HydrophobicContact CG-CD2 3.71Å; L273-F277 HydrophobicContact CG-CE2 3.58Å; L273-F277 WeakPolarHBondContact O-CD2 3.2Å; L273-F277 PolarHBondContact O-N 2.81Å; L273-Y339 HydrophobicContact CD2-CE2 4.35Å; L273-T342 HydrophobicContact CD1-CG2 4.32Å
274	H	70.1	Confident	69.6	Low	21 Å²	21	46.2 Å²	46.2	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-38.4	174	-71.8	153.3	0	0	0	113.4	M270 D271 Q272 T278 Y339 K379	M270-H274 PolarHBondContact O-N 3.27Å; D271-H274 PolarHBondContact O-N 2.97Å; Q272-H274 PolarHBondContact O-N 2.9Å; H274-T278 WeakPolarHBondContact O-CB 3.28Å; H274-T278 PolarHBondContact O-N 3.24Å; H274-T278 PolarHBondContact O-OG1 3.19Å; H274-Y339 PolarHBondContact NE2-OH 3.33Å; H274-K379 PolarHBondContact CE1-O 3.29Å; H274-K379 PolarHBondContact NE2-O 3.09Å
275	M	80.2	Confident	70	Confident	111 Å²	111	43.3 Å²	43.3	55%	0.547	22%	0.222	S	C	.	.	H	α-helix	trans	-63.3	-45.4	174.3	-172.8	-177.9	72.4	0	0	111	D271 Q272 L273 T278 Q279	D271-M275 WeakPolarHBondContact O-CB 3.28Å; D271-M275 PolarHBondContact O-N 2.89Å; Q272-M275 CarbonylContact O-C 3.57Å; Q272-M275 WeakPolarHBondContact O-CB 3.11Å; Q272-M275 PolarHBondContact O-N 2.96Å; Q272-M275 VanDerWaalsContact O-N 3.16Å; L273-M275 VanDerWaalsContact C-N 3.34Å; L273-M275 PolarHBondContact O-N 3.03Å; M275-T278 PolarHBondContact O-N 3.12Å; M275-Q279 VanDerWaalsContact O-CB 3.3Å; M275-Q279 WeakPolarHBondContact O-CB 3.48Å; M275-Q279 PolarHBondContact O-N 3.31Å
276	H	70.9	Confident	70.2	Confident	30 Å²	30	40.7 Å²	40.7	14%	0.139	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-38.1	178.5	-71.4	-56.9	0	0	0	112.4	Q272 L273 Q279 A280	Q272-H276 WeakPolarHBondContact O-CB 3.4Å; Q272-H276 PolarHBondContact O-CD2 3.43Å; Q272-H276 PolarHBondContact O-N 3.27Å; L273-H276 PolarHBondContact O-N 3.11Å; H276-Q279 PolarHBondContact O-N 3.41Å; H276-A280 WeakPolarHBondContact O-CA 3.45Å; H276-A280 WeakPolarHBondContact O-CB 3.35Å; H276-A280 PolarHBondContact O-N 3.46Å
277	F	69.6	Low	70.5	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-43.4	172.4	-86.4	-70.2	0	0	0	111.9	C245 L273 Q279 A280 I281 V335 S338 Y339 I387	C245-F277 HydrophobicContact CB-CD1 3.99Å; C245-F277 HydrophobicContact CB-CE1 3.88Å; C245-F277 HydrophobicContact CB-CZ 4.39Å; L273-F277 HydrophobicContact CD1-CE2 4.14Å; L273-F277 HydrophobicContact CD2-CD2 3.52Å; L273-F277 HydrophobicContact CD2-CE2 3.51Å; L273-F277 HydrophobicContact CG-CD2 3.71Å; L273-F277 HydrophobicContact CG-CE2 3.58Å; L273-F277 WeakPolarHBondContact O-CD2 3.2Å; L273-F277 PolarHBondContact O-N 2.81Å; F277-Q279 PolarHBondContact O-N 3.02Å; F277-A280 PolarHBondContact O-N 3.22Å; F277-I281 WeakPolarHBondContact O-CD1 3.47Å; F277-I281 VanDerWaalsContact O-CG1 3.24Å; F277-I281 WeakPolarHBondContact O-CG1 3.41Å; F277-I281 PolarHBondContact O-N 3.21Å; F277-V335 HydrophobicContact CD1-CG1 4.19Å; F277-S338 WeakPolarHBondContact CE1-OG 3.46Å; F277-Y339 HydrophobicContact CD1-CD2 4.09Å; F277-Y339 AromaticContact CD2-CD2 3.73Å; F277-Y339 HydrophobicContact CD2-CD2 3.73Å; F277-Y339 HydrophobicContact CD2-CE2 4.11Å; F277-Y339 HydrophobicContact CE1-CD2 4.11Å; F277-Y339 AromaticContact CE2-CD2 3.77Å; F277-Y339 HydrophobicContact CE2-CD2 3.77Å; F277-Y339 HydrophobicContact CE2-CE2 4.35Å; F277-Y339 AromaticContact CG-CD2 3.92Å; F277-Y339 HydrophobicContact CG-CD2 3.92Å; F277-Y339 AromaticContact CZ-CD2 3.96Å; F277-Y339 HydrophobicContact CZ-CD2 3.96Å; F277-I387 HydrophobicContact CB-CD1 4.13Å; F277-I387 HydrophobicContact CG-CD1 4.44Å
278	T	73.2	Confident	70.7	Confident	38 Å²	38	41.3 Å²	41.3	23%	0.233	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-44	175.2	-51.2	0	0	0	0	111	H274 M275 I281 H282	H274-T278 WeakPolarHBondContact O-CB 3.28Å; H274-T278 PolarHBondContact O-N 3.24Å; H274-T278 PolarHBondContact O-OG1 3.19Å; M275-T278 PolarHBondContact O-N 3.12Å; T278-I281 PolarHBondContact O-N 2.98Å; T278-H282 PolarHBondContact O-N 3.1Å
279	Q	76.4	Confident	70.5	Confident	97 Å²	97	38 Å²	38	45%	0.453	19%	0.193	S	C	.	.	H	α-helix	trans	-68.2	-35.8	177.2	-170.5	66.1	40.2	0	0	112	M275 H276 F277 H282 N283	M275-Q279 VanDerWaalsContact O-CB 3.3Å; M275-Q279 WeakPolarHBondContact O-CB 3.48Å; M275-Q279 PolarHBondContact O-N 3.31Å; H276-Q279 PolarHBondContact O-N 3.41Å; F277-Q279 PolarHBondContact O-N 3.02Å; Q279-H282 PolarHBondContact O-N 2.92Å; Q279-N283 PolarHBondContact NE2-OD1 3.42Å; Q279-N283 VanDerWaalsContact O-CB 3.24Å; Q279-N283 WeakPolarHBondContact O-CB 3.17Å; Q279-N283 PolarHBondContact O-N 2.75Å; Q279-N283 PolarHBondContact O-ND2 2.52Å; Q279-N283 PolarHBondContact O-OD1 2.87Å
280	A	69.1	Low	70.5	Confident	7 Å²	7	37.8 Å²	37.8	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-45.3	176.7	0	0	0	0	0	110.4	C245 H276 F277 H282 N283 T284	C245-A280 HydrophobicContact CB-CB 3.7Å; H276-A280 WeakPolarHBondContact O-CA 3.45Å; H276-A280 WeakPolarHBondContact O-CB 3.35Å; H276-A280 PolarHBondContact O-N 3.46Å; F277-A280 PolarHBondContact O-N 3.22Å; A280-H282 VanDerWaalsContact C-N 3.35Å; A280-H282 PolarHBondContact O-N 2.9Å; A280-N283 PolarHBondContact O-N 3.36Å; A280-T284 WeakPolarHBondContact O-CB 3.44Å; A280-T284 VanDerWaalsContact O-CG2 3.3Å; A280-T284 WeakPolarHBondContact O-CG2 3.35Å; A280-T284 PolarHBondContact O-N 2.89Å; A280-T284 PolarHBondContact O-OG1 3.1Å
281	I	69.8	Low	70.3	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-48.1	173.2	-65.4	161.3	0	0	0	110.1	F277 T278 N283 T284 V285 L332 V335 I387 V391	F277-I281 WeakPolarHBondContact O-CD1 3.47Å; F277-I281 VanDerWaalsContact O-CG1 3.24Å; F277-I281 WeakPolarHBondContact O-CG1 3.41Å; F277-I281 PolarHBondContact O-N 3.21Å; T278-I281 PolarHBondContact O-N 2.98Å; I281-N283 VanDerWaalsContact C-N 3.34Å; I281-N283 PolarHBondContact O-N 3.49Å; I281-T284 PolarHBondContact O-N 3.08Å; I281-T284 PolarHBondContact O-OG1 2.68Å; I281-T284 VanDerWaalsContact O-OG1 3.1Å; I281-V285 HydrophobicContact CG2-CG2 4.2Å; I281-V285 WeakPolarHBondContact O-CB 3.39Å; I281-V285 WeakPolarHBondContact O-CG2 3.45Å; I281-V285 PolarHBondContact O-N 3.23Å; I281-L332 HydrophobicContact CG2-CD2 3.95Å; I281-V335 HydrophobicContact CD1-CG1 4.45Å; I281-V335 HydrophobicContact CG1-CG1 3.71Å; I281-I387 HydrophobicContact CD1-CB 4.23Å; I281-I387 HydrophobicContact CD1-CG1 4.12Å; I281-I387 HydrophobicContact CD1-CG2 3.65Å; I281-V391 HydrophobicContact CD1-CG2 4.33Å; I281-V391 HydrophobicContact CG2-CG2 4.19Å
282	H	72	Confident	69.9	Low	72 Å²	72	37.4 Å²	37.4	33%	0.333	19%	0.19	S	C	.	.	H	α-helix	trans	-59.7	-45.1	177.9	-168.4	101.7	0	0	0	112.1	T278 Q279 A280 F286 K394	T278-H282 PolarHBondContact O-N 3.1Å; Q279-H282 PolarHBondContact O-N 2.92Å; A280-H282 VanDerWaalsContact C-N 3.35Å; A280-H282 PolarHBondContact O-N 2.9Å; H282-F286 WeakPolarHBondContact O-CB 3.15Å; H282-F286 PolarHBondContact O-N 2.98Å; H282-K394 PolarHBondContact CE1-NZ 3.08Å; H282-K394 PolarHBondContact ND1-NZ 3.41Å
283	N	76.6	Confident	69.3	Low	68 Å²	68	35.3 Å²	35.3	36%	0.364	18%	0.181	S	C	.	.	H	α-helix	trans	-69.9	-41.9	-178.2	-72.3	-10.1	0	0	0	111.9	Q279 A280 I281 Q287	Q279-N283 PolarHBondContact NE2-OD1 3.42Å; Q279-N283 VanDerWaalsContact O-CB 3.24Å; Q279-N283 WeakPolarHBondContact O-CB 3.17Å; Q279-N283 PolarHBondContact O-N 2.75Å; Q279-N283 PolarHBondContact O-ND2 2.52Å; Q279-N283 PolarHBondContact O-OD1 2.87Å; A280-N283 PolarHBondContact O-N 3.36Å; I281-N283 VanDerWaalsContact C-N 3.34Å; I281-N283 PolarHBondContact O-N 3.49Å; N283-Q287 VanDerWaalsContact O-CB 3.23Å; N283-Q287 WeakPolarHBondContact O-CB 3.44Å; N283-Q287 WeakPolarHBondContact O-CG 3.14Å; N283-Q287 PolarHBondContact O-N 3.41Å
284	T	68.6	Low	68.8	Low	21 Å²	21	39.2 Å²	39.2	13%	0.129	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-46.7	178.3	53.7	0	0	0	0	110.8	A280 I281 F286 Q287 V288 V335	A280-T284 WeakPolarHBondContact O-CB 3.44Å; A280-T284 VanDerWaalsContact O-CG2 3.3Å; A280-T284 WeakPolarHBondContact O-CG2 3.35Å; A280-T284 PolarHBondContact O-N 2.89Å; A280-T284 PolarHBondContact O-OG1 3.1Å; I281-T284 PolarHBondContact O-N 3.08Å; I281-T284 PolarHBondContact O-OG1 2.68Å; I281-T284 VanDerWaalsContact O-OG1 3.1Å; T284-F286 VanDerWaalsContact C-N 3.33Å; T284-F286 PolarHBondContact O-N 3.43Å; T284-Q287 PolarHBondContact O-N 3.01Å; T284-V288 VanDerWaalsContact O-CG2 3.31Å; T284-V288 WeakPolarHBondContact O-CG2 3.26Å; T284-V288 PolarHBondContact O-N 3.34Å; T284-V335 HydrophobicContact CG2-CG2 4.14Å
285	V	69.6	Low	68.3	Low	1 Å²	1	44.9 Å²	44.9	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-43.6	176.8	167.1	0	0	0	0	111.3	I281 V289 Y309 L328 L332 K394	I281-V285 HydrophobicContact CG2-CG2 4.2Å; I281-V285 WeakPolarHBondContact O-CB 3.39Å; I281-V285 WeakPolarHBondContact O-CG2 3.45Å; I281-V285 PolarHBondContact O-N 3.23Å; V285-V289 WeakPolarHBondContact O-CB 3.34Å; V285-V289 WeakPolarHBondContact O-CG2 3.46Å; V285-V289 PolarHBondContact O-N 3.04Å; V285-Y309 HydrophobicContact CB-CE2 4.49Å; V285-Y309 HydrophobicContact CG1-CD2 3.97Å; V285-Y309 HydrophobicContact CG1-CE1 4.35Å; V285-Y309 HydrophobicContact CG1-CE2 3.09Å; V285-Y309 WeakPolarHBondContact CG1-OH 3.38Å; V285-L328 HydrophobicContact CB-CD1 4Å; V285-L328 HydrophobicContact CG1-CD1 3.91Å; V285-L328 HydrophobicContact CG2-CD1 3.82Å; V285-L332 HydrophobicContact CG2-CD1 4.47Å; V285-L332 HydrophobicContact CG2-CD2 3.6Å; V285-L332 HydrophobicContact CG2-CG 4.18Å; V285-K394 HydrophobicContact CG1-CB 4.24Å; V285-K394 HydrophobicContact CG1-CD 4.31Å; V285-K394 HydrophobicContact CG1-CG 4.42Å
286	F	70.9	Confident	66.9	Low	36 Å²	36	41.8 Å²	41.8	16%	0.158	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-43.2	176.5	-175	-94	0	0	0	112.3	H282 T284 L290 L312	H282-F286 WeakPolarHBondContact O-CB 3.15Å; H282-F286 PolarHBondContact O-N 2.98Å; T284-F286 VanDerWaalsContact C-N 3.33Å; T284-F286 PolarHBondContact O-N 3.43Å; F286-L290 HydrophobicContact CE1-CD2 3.96Å; F286-L290 WeakPolarHBondContact O-CB 3.45Å; F286-L290 PolarHBondContact O-N 2.97Å; F286-L312 HydrophobicContact CD2-CD1 3.97Å; F286-L312 HydrophobicContact CE2-CD1 3.39Å; F286-L312 HydrophobicContact CZ-CD1 4.01Å
287	Q	70.4	Confident	66	Low	120 Å²	120	42 Å²	42	56%	0.561	23%	0.225	S	C	*	.	H	α-helix	trans	-68.7	-38.8	-179.1	-72.6	-70.3	-25.8	0	0	112.8	N283 T284 G291	N283-Q287 VanDerWaalsContact O-CB 3.23Å; N283-Q287 WeakPolarHBondContact O-CB 3.44Å; N283-Q287 WeakPolarHBondContact O-CG 3.14Å; N283-Q287 PolarHBondContact O-N 3.41Å; T284-Q287 PolarHBondContact O-N 3.01Å; Q287-G291 PolarHBondContact O-N 3.25Å
288	V	66.7	Low	64.8	Low	30 Å²	30	44.2 Å²	44.2	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-48.4	176.2	172.8	0	0	0	0	110.4	T284 L290 G291 Y292 D327 L328 A331	T284-V288 VanDerWaalsContact O-CG2 3.31Å; T284-V288 WeakPolarHBondContact O-CG2 3.26Å; T284-V288 PolarHBondContact O-N 3.34Å; V288-L290 PolarHBondContact O-N 2.91Å; V288-G291 PolarHBondContact O-N 3.3Å; V288-Y292 HydrophobicContact CG1-CD2 4.11Å; V288-Y292 HydrophobicContact CG1-CE2 4.31Å; V288-Y292 WeakPolarHBondContact O-CD2 3.46Å; V288-Y292 PolarHBondContact O-N 3.06Å; V288-Y292 VanDerWaalsContact O-N 3.08Å; V288-D327 HydrophobicContact CG1-CB 4.31Å; V288-L328 HydrophobicContact CB-CD1 4.47Å; V288-L328 HydrophobicContact CG1-CB 4.31Å; V288-A331 HydrophobicContact CG2-CB 4.11Å
289	V	64.1	Low	63.5	Low	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-40.7	178.1	175	0	0	0	0	111.2	V285 Y292 V293 Y309 L312 L328 Y398	V285-V289 WeakPolarHBondContact O-CB 3.34Å; V285-V289 WeakPolarHBondContact O-CG2 3.46Å; V285-V289 PolarHBondContact O-N 3.04Å; V289-Y292 PolarHBondContact O-N 3.02Å; V289-V293 HydrophobicContact CG1-CG2 4.24Å; V289-V293 WeakPolarHBondContact O-CB 3.47Å; V289-V293 WeakPolarHBondContact O-CG2 3.35Å; V289-V293 PolarHBondContact O-N 3.13Å; V289-Y309 HydrophobicContact CB-CE2 4.38Å; V289-Y309 HydrophobicContact CG2-CE2 3.87Å; V289-L312 HydrophobicContact CG1-CB 3.99Å; V289-L328 HydrophobicContact CG2-CD1 4.46Å; V289-Y398 HydrophobicContact CG2-CD2 4.07Å; V289-Y398 HydrophobicContact CG2-CE2 3.96Å
290	L	65.8	Low	62.1	Low	6 Å²	6	51.3 Å²	51.3	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-44.3	175.2	-178	68.6	0	0	0	111.5	F286 V288 Y292 V293 E294 F304 Q305	F286-L290 HydrophobicContact CE1-CD2 3.96Å; F286-L290 WeakPolarHBondContact O-CB 3.45Å; F286-L290 PolarHBondContact O-N 2.97Å; V288-L290 PolarHBondContact O-N 2.91Å; L290-Y292 VanDerWaalsContact C-N 3.33Å; L290-Y292 PolarHBondContact O-N 2.91Å; L290-V293 PolarHBondContact O-N 2.97Å; L290-E294 HydrophobicContact CD1-CG 4.09Å; L290-E294 HydrophobicContact CG-CG 4.22Å; L290-E294 WeakPolarHBondContact O-CB 3.44Å; L290-E294 WeakPolarHBondContact O-CG 3.24Å; L290-E294 PolarHBondContact O-N 3.41Å; L290-F304 HydrophobicContact CD1-CB 3.87Å; L290-Q305 HydrophobicContact CD1-CG 4.49Å; L290-Q305 HydrophobicContact CD2-CG 4.02Å
291	G	62.6	Low	60.7	Low	26 Å²	26	55.6 Å²	55.6	27%	0.268	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-43.1	178.3	0	0	0	0	0	112.2	Q287 V288 L295	Q287-G291 PolarHBondContact O-N 3.25Å; V288-G291 PolarHBondContact O-N 3.3Å; G291-L295 WeakPolarHBondContact O-CB 3.31Å; G291-L295 WeakPolarHBondContact O-CD1 3.36Å; G291-L295 WeakPolarHBondContact O-CG 3.32Å; G291-L295 PolarHBondContact O-N 3.41Å
292	Y	60.8	Low	59.8	Low	46 Å²	46	62.3 Å²	62.3	18%	0.18	36%	0.355	C	S	.	.	H	α-helix	trans	-71.2	-37.1	175.6	-84.9	-76.1	0	0	0	113.1	V288 V289 L290 L295 C296 P323 C324 D327	V288-Y292 HydrophobicContact CG1-CD2 4.11Å; V288-Y292 HydrophobicContact CG1-CE2 4.31Å; V288-Y292 WeakPolarHBondContact O-CD2 3.46Å; V288-Y292 PolarHBondContact O-N 3.06Å; V288-Y292 VanDerWaalsContact O-N 3.08Å; V289-Y292 PolarHBondContact O-N 3.02Å; L290-Y292 VanDerWaalsContact C-N 3.33Å; L290-Y292 PolarHBondContact O-N 2.91Å; Y292-L295 PolarHBondContact O-N 3.17Å; Y292-C296 WeakPolarHBondContact O-CB 3.4Å; Y292-C296 PolarHBondContact O-N 3.43Å; Y292-C296 PolarHBondContact O-SG 3.38Å; Y292-P323 HydrophobicContact CE1-CB 3.86Å; Y292-C324 HydrophobicContact CD1-CB 4.09Å; Y292-C324 HydrophobicContact CD2-CB 3.66Å; Y292-C324 HydrophobicContact CE2-CB 4.15Å; Y292-C324 HydrophobicContact CG-CB 3.63Å; Y292-D327 HydrophobicContact CE2-CB 4.06Å; Y292-D327 PolarHBondContact OH-OD2 3.09Å
293	V	57.6	Low	58.5	Low	3 Å²	3	66.5 Å²	66.5	2%	0.018	37%	0.372	C	S	.	.	H	α-helix	trans	-66.1	-39.9	174.6	170.1	0	0	0	0	111.4	V289 L290 C296 A297 F304 L312 V316	V289-V293 HydrophobicContact CG1-CG2 4.24Å; V289-V293 WeakPolarHBondContact O-CB 3.47Å; V289-V293 WeakPolarHBondContact O-CG2 3.35Å; V289-V293 PolarHBondContact O-N 3.13Å; L290-V293 PolarHBondContact O-N 2.97Å; V293-C296 PolarHBondContact O-N 2.87Å; V293-A297 WeakPolarHBondContact O-CB 3.28Å; V293-A297 PolarHBondContact O-N 3.47Å; V293-F304 HydrophobicContact CG1-CB 4.5Å; V293-F304 HydrophobicContact CG1-CD1 4.03Å; V293-F304 HydrophobicContact CG1-CD2 4.34Å; V293-F304 HydrophobicContact CG1-CE1 4.39Å; V293-F304 HydrophobicContact CG1-CG 4.03Å; V293-L312 HydrophobicContact CG1-CD2 4.21Å; V293-V316 HydrophobicContact CG2-CG2 3.95Å
294	E	59	Low	57.3	Low	88 Å²	88	64.6 Å²	64.6	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-68.6	-36.8	176.5	-73.7	179.8	170.8	0	0	112.1	L290 G298	L290-E294 HydrophobicContact CD1-CG 4.09Å; L290-E294 HydrophobicContact CG-CG 4.22Å; L290-E294 WeakPolarHBondContact O-CB 3.44Å; L290-E294 WeakPolarHBondContact O-CG 3.24Å; L290-E294 PolarHBondContact O-N 3.41Å; E294-G298 PolarHBondContact O-N 3.45Å
295	L	59.8	Low	56.4	Low	140 Å²	140	70 Å²	70	73%	0.733	38%	0.384	S	S	*	.	H	α-helix	trans	-66.8	-36.1	172.9	-74	168.3	0	0	0	112.4	G291 Y292	G291-L295 WeakPolarHBondContact O-CB 3.31Å; G291-L295 WeakPolarHBondContact O-CD1 3.36Å; G291-L295 WeakPolarHBondContact O-CG 3.32Å; G291-L295 PolarHBondContact O-N 3.41Å; Y292-L295 PolarHBondContact O-N 3.17Å
296	C	51.2	Low	55.4	Low	47 Å²	47	79.5 Å²	79.5	32%	0.318	43%	0.426	S	S	.	.	H	α-helix	trans	-82.8	-28.7	-179.7	-62.1	0	0	0	0	113.5	Y292 V293 G298 T317 S320	Y292-C296 WeakPolarHBondContact O-CB 3.4Å; Y292-C296 PolarHBondContact O-N 3.43Å; Y292-C296 PolarHBondContact O-SG 3.38Å; V293-C296 PolarHBondContact O-N 2.87Å; C296-G298 VanDerWaalsContact C-N 3.33Å; C296-T317 HydrophobicContact CB-CG2 4.27Å; C296-T317 PolarHBondContact SG-OG1 3.48Å; C296-S320 WeakPolarHBondContact SG-CB 3.39Å; C296-S320 PolarHBondContact SG-OG 3.33Å
297	A	52	Low	54.6	Low	34 Å²	34	80.6 Å²	80.6	28%	0.281	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-4	-179.5	0	0	0	0	0	114	V293 T300 F304	V293-A297 WeakPolarHBondContact O-CB 3.28Å; V293-A297 PolarHBondContact O-N 3.47Å; A297-T300 PolarHBondContact O-OG1 2.8Å; A297-F304 HydrophobicContact CB-CE2 3.9Å; A297-F304 HydrophobicContact CB-CZ 4.41Å
298	G	44.6	Very low	53.8	Low	47 Å²	47	81.8 Å²	81.8	49%	0.485	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	75.2	174.2	0	0	0	0	0	113.9	E294 C296 T300	E294-G298 PolarHBondContact O-N 3.45Å; C296-G298 VanDerWaalsContact C-N 3.33Å; G298-T300 PolarHBondContact O-N 2.85Å; G298-T300 PolarHBondContact O-OG1 3.33Å
299	N	46.4	Very low	53.3	Low	173 Å²	173	81.2 Å²	81.2	93%	0.925	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	4.7	168.4	-106	11.9	0	0	0	119.1
300	T	46.1	Very low	52.9	Low	112 Å²	112	87.8 Å²	87.8	69%	0.687	46%	0.462	S	S	*	.			trans	-103.3	0.4	-170.4	46.8	0	0	0	0	117.4	A297 G298	A297-T300 PolarHBondContact O-OG1 2.8Å; G298-T300 PolarHBondContact O-N 2.85Å; G298-T300 PolarHBondContact O-OG1 3.33Å
301	D	40.3	Very low	52.6	Low	97 Å²	97	90.7 Å²	90.7	52%	0.519	48%	0.477	S	S	.	.			trans	-147.1	102.9	174.3	-92.3	-45.6	0	0	0	114.3	K303 F304	D301-K303 PolarHBondContact O-N 3.01Å; D301-F304 HydrophobicContact CB-CD2 4.17Å; D301-F304 HydrophobicContact CB-CE2 3.49Å; D301-F304 VanDerWaalsContact CB-CE2 3.49Å; D301-F304 HydrophobicContact CB-CZ 4.07Å; D301-F304 WeakPolarHBondContact O-CD2 3.19Å; D301-F304 WeakPolarHBondContact O-CE2 3.48Å
302	T	50.8	Low	52.4	Low	141 Å²	141	89.4 Å²	89.4	87%	0.865	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	20.9	175.2	56.4	0	0	0	0	113.7
303	K	45	Very low	52.1	Low	160 Å²	160	87.2 Å²	87.2	70%	0.696	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	2.1	-177.8	-72	-177.4	-176.2	171.1	0	114.4	D301	D301-K303 PolarHBondContact O-N 3.01Å
304	F	50.2	Low	52.1	Low	28 Å²	28	91.3 Å²	91.3	12%	0.123	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-74.3	-21.9	179.3	-64.6	-67.4	0	0	0	114.4	L290 V293 A297 D301 K306 L307 L312	L290-F304 HydrophobicContact CD1-CB 3.87Å; V293-F304 HydrophobicContact CG1-CB 4.5Å; V293-F304 HydrophobicContact CG1-CD1 4.03Å; V293-F304 HydrophobicContact CG1-CD2 4.34Å; V293-F304 HydrophobicContact CG1-CE1 4.39Å; V293-F304 HydrophobicContact CG1-CG 4.03Å; A297-F304 HydrophobicContact CB-CE2 3.9Å; A297-F304 HydrophobicContact CB-CZ 4.41Å; D301-F304 HydrophobicContact CB-CD2 4.17Å; D301-F304 HydrophobicContact CB-CE2 3.49Å; D301-F304 VanDerWaalsContact CB-CE2 3.49Å; D301-F304 HydrophobicContact CB-CZ 4.07Å; D301-F304 WeakPolarHBondContact O-CD2 3.19Å; D301-F304 WeakPolarHBondContact O-CE2 3.48Å; F304-K306 PolarHBondContact O-N 3.02Å; F304-K306 VanDerWaalsContact O-N 3.14Å; F304-L307 HydrophobicContact CD1-CD1 3.66Å; F304-L307 HydrophobicContact CE1-CD1 4.14Å; F304-L307 PolarHBondContact O-N 2.72Å; F304-L312 HydrophobicContact CB-CD2 3.9Å; F304-L312 HydrophobicContact CD1-CD2 4.05Å; F304-L312 HydrophobicContact CG-CD2 4.39Å
305	Q	50.8	Low	51.8	Low	134 Å²	134	92.3 Å²	92.3	63%	0.626	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-65.6	-15.8	177.5	-69.4	178.3	0.6	0	0	114.6	L290	L290-Q305 HydrophobicContact CD1-CG 4.49Å; L290-Q305 HydrophobicContact CD2-CG 4.02Å
306	K	49.4	Very low	51.8	Low	201 Å²	201	86.2 Å²	86.2	87%	0.874	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-105.1	-4.3	179.5	-72.9	-172.5	178.8	-178.4	0	114.2	F304	F304-K306 PolarHBondContact O-N 3.02Å; F304-K306 VanDerWaalsContact O-N 3.14Å
307	L	52.9	Low	52.1	Low	60 Å²	60	86.8 Å²	86.8	31%	0.314	46%	0.456	S	S	.	.	S	Bend	trans	-82.3	143.3	-178.1	-77.7	164.1	0	0	0	110.4	F304 D311 L312	F304-L307 HydrophobicContact CD1-CD1 3.66Å; F304-L307 HydrophobicContact CE1-CD1 4.14Å; F304-L307 PolarHBondContact O-N 2.72Å; L307-D311 HydrophobicContact CB-CB 4.38Å; L307-D311 HydrophobicContact CD2-CB 4.23Å; L307-L312 HydrophobicContact CB-CD2 4.26Å; L307-L312 HydrophobicContact CB-CG 4.14Å
308	Q	54.5	Low	52.5	Low	145 Å²	145	88 Å²	88	68%	0.678	46%	0.461	S	S	*	.			trans	-66.7	148.7	179.5	-64.7	-175.7	4	0	0	109.3	K310 D311 L312	Q308-K310 PolarHBondContact O-N 2.65Å; Q308-D311 PolarHBondContact O-N 3.16Å; Q308-L312 PolarHBondContact O-N 2.84Å; Q308-L312 VanDerWaalsContact O-N 3.15Å
309	Y	55.9	Low	53.1	Low	18 Å²	18	92.8 Å²	92.8	7%	0.071	48%	0.476	C	S	.	.	H	α-helix	trans	-46.9	-36.5	-179.5	179.5	-106.4	0	0	0	113.4	V285 V289 L312 C313 K394 T397	V285-Y309 HydrophobicContact CB-CE2 4.49Å; V285-Y309 HydrophobicContact CG1-CD2 3.97Å; V285-Y309 HydrophobicContact CG1-CE1 4.35Å; V285-Y309 HydrophobicContact CG1-CE2 3.09Å; V285-Y309 WeakPolarHBondContact CG1-OH 3.38Å; V289-Y309 HydrophobicContact CB-CE2 4.38Å; V289-Y309 HydrophobicContact CG2-CE2 3.87Å; Y309-L312 PolarHBondContact O-N 3.1Å; Y309-C313 PolarHBondContact O-N 3.22Å; Y309-C313 VanDerWaalsContact O-N 3.16Å; Y309-C313 PolarHBondContact O-SG 2.75Å; Y309-K394 HydrophobicContact CD1-CD 4.04Å; Y309-K394 HydrophobicContact CE1-CB 4.35Å; Y309-K394 HydrophobicContact CE1-CD 3.91Å; Y309-K394 WeakPolarHBondContact CE1-O 3.16Å; Y309-K394 PolarHBondContact OH-O 3.04Å; Y309-T397 HydrophobicContact CD1-CG2 3.88Å; Y309-T397 HydrophobicContact CE1-CG2 4.11Å
310	K	55.7	Low	53.8	Low	137 Å²	137	85.3 Å²	85.3	60%	0.596	44%	0.437	S	S	*	.	H	α-helix	trans	-66	-37.3	177.9	-166.8	179.8	178.6	-172.7	0	113.6	Q308 T314 T397	Q308-K310 PolarHBondContact O-N 2.65Å; K310-T314 PolarHBondContact O-OG1 3.24Å; K310-T397 HydrophobicContact CB-CG2 4.01Å; K310-T397 HydrophobicContact CG-CG2 4.02Å
311	D	59.1	Low	54.8	Low	67 Å²	67	80 Å²	80	36%	0.358	40%	0.404	S	S	.	.	H	α-helix	trans	-77.7	-31.5	180	-56.7	-30.4	0	0	0	111.1	L307 Q308 T314 H315	L307-D311 HydrophobicContact CB-CB 4.38Å; L307-D311 HydrophobicContact CD2-CB 4.23Å; Q308-D311 PolarHBondContact O-N 3.16Å; D311-T314 VanDerWaalsContact C-OG1 3.31Å; D311-T314 WeakPolarHBondContact CA-OG1 3.37Å; D311-T314 PolarHBondContact O-N 3.35Å; D311-T314 PolarHBondContact O-OG1 2.91Å; D311-H315 PolarHBondContact O-CD2 3.07Å
312	L	58.4	Low	56.1	Low	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-66.6	-37	172.5	-72	168.9	0	0	0	112.1	F286 V289 V293 F304 L307 Q308 Y309 T314 H315	F286-L312 HydrophobicContact CD2-CD1 3.97Å; F286-L312 HydrophobicContact CE2-CD1 3.39Å; F286-L312 HydrophobicContact CZ-CD1 4.01Å; V289-L312 HydrophobicContact CG1-CB 3.99Å; V293-L312 HydrophobicContact CG1-CD2 4.21Å; F304-L312 HydrophobicContact CB-CD2 3.9Å; F304-L312 HydrophobicContact CD1-CD2 4.05Å; F304-L312 HydrophobicContact CG-CD2 4.39Å; L307-L312 HydrophobicContact CB-CD2 4.26Å; L307-L312 HydrophobicContact CB-CG 4.14Å; Q308-L312 PolarHBondContact O-N 2.84Å; Q308-L312 VanDerWaalsContact O-N 3.15Å; Y309-L312 PolarHBondContact O-N 3.1Å; L312-T314 VanDerWaalsContact C-N 3.3Å; L312-T314 PolarHBondContact O-N 2.82Å; L312-H315 PolarHBondContact O-N 3.45Å
313	C	54	Low	56.9	Low	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-34.5	177.2	-63.2	0	0	0	0	112.5	Y309 H315 Y398	Y309-C313 PolarHBondContact O-N 3.22Å; Y309-C313 VanDerWaalsContact O-N 3.16Å; Y309-C313 PolarHBondContact O-SG 2.75Å; C313-H315 VanDerWaalsContact C-N 3.26Å; C313-H315 PolarHBondContact O-N 2.89Å; C313-Y398 HydrophobicContact CB-CD2 4.31Å; C313-Y398 VanDerWaalsContact SG-CD2 3.56Å
314	T	57.4	Low	57.9	Low	89 Å²	89	64.8 Å²	64.8	55%	0.546	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.8	176.8	29.8	0	0	0	0	114.5	K310 D311 L312 G401	K310-T314 PolarHBondContact O-OG1 3.24Å; D311-T314 VanDerWaalsContact C-OG1 3.31Å; D311-T314 WeakPolarHBondContact CA-OG1 3.37Å; D311-T314 PolarHBondContact O-N 3.35Å; D311-T314 PolarHBondContact O-OG1 2.91Å; L312-T314 VanDerWaalsContact C-N 3.3Å; L312-T314 PolarHBondContact O-N 2.82Å; T314-G401 WeakPolarHBondContact CG2-O 3.17Å
315	H	52.9	Low	58.7	Low	109 Å²	109	63.5 Å²	63.5	51%	0.505	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	1.1	-179.2	-75.9	-65.6	0	0	0	113.9	D311 L312 C313 T317	D311-H315 PolarHBondContact O-CD2 3.07Å; L312-H315 PolarHBondContact O-N 3.45Å; C313-H315 VanDerWaalsContact C-N 3.26Å; C313-H315 PolarHBondContact O-N 2.89Å; H315-T317 PolarHBondContact O-N 3.3Å
316	V	59.7	Low	59.6	Low	11 Å²	11	57.6 Å²	57.6	7%	0.067	30%	0.297	C	S	.	.			trans	-74.4	122.4	177.3	-176.6	0	0	0	0	109.5	V293 Y321 Y398	V293-V316 HydrophobicContact CG2-CG2 3.95Å; V316-Y321 HydrophobicContact CG1-CD2 4.06Å; V316-Y398 HydrophobicContact CG2-CE2 4.37Å
317	T	58.7	Low	60.5	Low	59 Å²	59	50.4 Å²	50.4	36%	0.362	27%	0.267	S	S	.	.			trans	-68.8	148.4	176	49.1	0	0	0	0	111.5	C296 H315 D319 S320 Y321	C296-T317 HydrophobicContact CB-CG2 4.27Å; C296-T317 PolarHBondContact SG-OG1 3.48Å; H315-T317 PolarHBondContact O-N 3.3Å; T317-D319 VanDerWaalsContact C-N 3.25Å; T317-D319 PolarHBondContact O-N 2.94Å; T317-S320 PolarHBondContact O-N 3.31Å; T317-S320 VanDerWaalsContact O-N 3.17Å; T317-S320 PolarHBondContact O-OG 3.36Å; T317-S320 VanDerWaalsContact O-OG 3.14Å; T317-S320 PolarHBondContact OG1-OG 3.31Å; T317-Y321 PolarHBondContact O-N 2.69Å; T317-Y321 VanDerWaalsContact O-N 3.16Å
318	P	58.8	Low	61.3	Low	59 Å²	59	47.6 Å²	47.6	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-34.9	-177.4	22.2	-32.8	0	0	0	113.1	S320 Y321 F407	P318-S320 VanDerWaalsContact C-N 3.33Å; P318-S320 PolarHBondContact O-N 3.08Å; P318-Y321 PolarHBondContact O-N 2.69Å; P318-F407 HydrophobicContact CB-CE1 3.95Å; P318-F407 HydrophobicContact CB-CE2 4.5Å; P318-F407 HydrophobicContact CB-CZ 3.94Å; P318-F407 WeakPolarHBondContact O-CE1 3.33Å
319	D	58.2	Low	62	Low	149 Å²	149	40.7 Å²	40.7	80%	0.797	22%	0.22	S	C	*	.	H	α-helix	trans	-72.7	-22	-177.5	-62.1	-27.3	0	0	0	114	T317	T317-D319 VanDerWaalsContact C-N 3.25Å; T317-D319 PolarHBondContact O-N 2.94Å
320	S	61.4	Low	62.7	Low	15 Å²	15	42.1 Å²	42.1	11%	0.105	23%	0.227	C	C	.	.	H	α-helix	trans	-105	-5.9	179.1	62.5	0	0	0	0	113.6	C296 T317 P318 P323 C324	C296-S320 WeakPolarHBondContact SG-CB 3.39Å; C296-S320 PolarHBondContact SG-OG 3.33Å; T317-S320 PolarHBondContact O-N 3.31Å; T317-S320 VanDerWaalsContact O-N 3.17Å; T317-S320 PolarHBondContact O-OG 3.36Å; T317-S320 VanDerWaalsContact O-OG 3.14Å; T317-S320 PolarHBondContact OG1-OG 3.31Å; P318-S320 VanDerWaalsContact C-N 3.33Å; P318-S320 PolarHBondContact O-N 3.08Å; S320-P323 WeakPolarHBondContact O-CD 3.09Å; S320-C324 WeakPolarHBondContact O-CB 3.33Å; S320-C324 PolarHBondContact O-N 3.5Å
321	Y	66.3	Low	63.3	Low	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-42	-178.7	-177.4	-98.4	0	0	0	112.4	V316 T317 P318 C324 L325 Y398 T402 L404 F407 V415	V316-Y321 HydrophobicContact CG1-CD2 4.06Å; T317-Y321 PolarHBondContact O-N 2.69Å; T317-Y321 VanDerWaalsContact O-N 3.16Å; P318-Y321 PolarHBondContact O-N 2.69Å; Y321-C324 PolarHBondContact O-N 3.27Å; Y321-L325 WeakPolarHBondContact O-CB 3.37Å; Y321-L325 PolarHBondContact O-N 3.15Å; Y321-Y398 AromaticContact CD2-CE1 3.85Å; Y321-Y398 HydrophobicContact CD2-CE1 3.85Å; Y321-Y398 AromaticContact CD2-CZ 3.75Å; Y321-Y398 VanDerWaalsContact CD2-OH 3.31Å; Y321-Y398 WeakPolarHBondContact CD2-OH 3.29Å; Y321-Y398 HydrophobicContact CE1-CE1 4.42Å; Y321-Y398 AromaticContact CE2-CD1 3.9Å; Y321-Y398 HydrophobicContact CE2-CD1 3.9Å; Y321-Y398 AromaticContact CE2-CE1 3.16Å; Y321-Y398 HydrophobicContact CE2-CE1 3.16Å; Y321-Y398 HydrophobicContact CE2-CE2 4.43Å; Y321-Y398 AromaticContact CE2-CZ 3.48Å; Y321-Y398 VanDerWaalsContact CE2-CZ 3.48Å; Y321-Y398 AromaticContact CZ-CE1 3.51Å; Y321-Y398 PolarHBondContact O-OH 3.16Å; Y321-T402 HydrophobicContact CD2-CG2 3.88Å; Y321-T402 HydrophobicContact CE2-CG2 3.78Å; Y321-T402 WeakPolarHBondContact CE2-OG1 3.42Å; Y321-L404 HydrophobicContact CE1-CD2 3.7Å; Y321-F407 AromaticContact CD1-CE1 3.9Å; Y321-F407 HydrophobicContact CD1-CE1 3.9Å; Y321-F407 HydrophobicContact CD1-CE2 4.25Å; Y321-F407 AromaticContact CD1-CZ 3.49Å; Y321-F407 HydrophobicContact CD1-CZ 3.49Å; Y321-F407 VanDerWaalsContact CD1-CZ 3.49Å; Y321-F407 HydrophobicContact CD2-CZ 4.48Å; Y321-F407 HydrophobicContact CE1-CZ 4.3Å; Y321-F407 HydrophobicContact CG-CE1 4.21Å; Y321-F407 AromaticContact CG-CZ 3.6Å; Y321-F407 HydrophobicContact CG-CZ 3.6Å; Y321-V415 HydrophobicContact CD1-CG2 4.21Å; Y321-V415 HydrophobicContact CE1-CG1 4.25Å; Y321-V415 HydrophobicContact CE1-CG2 4.03Å
322	I	68	Low	63.7	Low	27 Å²	27	33.2 Å²	33.2	14%	0.138	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-51.7	-179.7	-66.6	174.3	0	0	0	111.7	C324 L325 A326 D411 F414 V415	I322-C324 VanDerWaalsContact C-N 3.31Å; I322-C324 PolarHBondContact O-N 2.9Å; I322-L325 PolarHBondContact O-N 3.34Å; I322-A326 WeakPolarHBondContact O-CB 3.16Å; I322-A326 PolarHBondContact O-N 3.28Å; I322-D411 HydrophobicContact CD1-CB 3.7Å; I322-F414 HydrophobicContact CG2-CD1 3.3Å; I322-F414 HydrophobicContact CG2-CE1 3.28Å; I322-V415 HydrophobicContact CG1-CG2 3.86Å
323	P	67.9	Low	64.3	Low	53 Å²	53	33.6 Å²	33.6	34%	0.344	19%	0.19	S	C	.	.	H	α-helix	trans	-57.3	-41.4	172.2	-26.4	34	0	0	0	113.2	Y292 S320 A326 D327	Y292-P323 HydrophobicContact CE1-CB 3.86Å; S320-P323 WeakPolarHBondContact O-CD 3.09Å; P323-A326 PolarHBondContact O-N 3.2Å; P323-D327 WeakPolarHBondContact O-CB 3.35Å; P323-D327 PolarHBondContact O-N 2.96Å
324	C	65.8	Low	65	Low	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-42	178.6	-176.1	0	0	0	0	112.2	Y292 S320 Y321 I322 L328 Y398	Y292-C324 HydrophobicContact CD1-CB 4.09Å; Y292-C324 HydrophobicContact CD2-CB 3.66Å; Y292-C324 HydrophobicContact CE2-CB 4.15Å; Y292-C324 HydrophobicContact CG-CB 3.63Å; S320-C324 WeakPolarHBondContact O-CB 3.33Å; S320-C324 PolarHBondContact O-N 3.5Å; Y321-C324 PolarHBondContact O-N 3.27Å; I322-C324 VanDerWaalsContact C-N 3.31Å; I322-C324 PolarHBondContact O-N 2.9Å; C324-L328 WeakPolarHBondContact O-CB 3.07Å; C324-L328 PolarHBondContact O-N 3.04Å; C324-Y398 WeakPolarHBondContact CB-OH 3.48Å; C324-Y398 PolarHBondContact SG-OH 2.79Å
325	L	67.4	Low	65.6	Low	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-43.2	175.8	-178.2	65.6	0	0	0	111.2	Y321 I322 L328 C329 Y398 V415 I418 I419	Y321-L325 WeakPolarHBondContact O-CB 3.37Å; Y321-L325 PolarHBondContact O-N 3.15Å; I322-L325 PolarHBondContact O-N 3.34Å; L325-L328 PolarHBondContact O-N 3.39Å; L325-C329 WeakPolarHBondContact O-CB 3.43Å; L325-C329 PolarHBondContact O-N 2.89Å; L325-C329 PolarHBondContact O-SG 2.85Å; L325-Y398 HydrophobicContact CB-CE1 4.09Å; L325-Y398 HydrophobicContact CD1-CD1 3.94Å; L325-Y398 HydrophobicContact CD1-CE1 3.88Å; L325-V415 HydrophobicContact CD2-CB 4.43Å; L325-V415 HydrophobicContact CD2-CG1 3.87Å; L325-V415 HydrophobicContact CD2-CG2 4.38Å; L325-I418 HydrophobicContact CD2-CB 4.41Å; L325-I418 HydrophobicContact CD2-CG2 4.12Å; L325-I418 HydrophobicContact CG-CG2 4.05Å; L325-I419 HydrophobicContact CD2-CG1 4.23Å
326	A	69.9	Low	66.3	Low	11 Å²	11	29.3 Å²	29.3	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-47.7	178.1	0	0	0	0	0	111.2	I322 P323 C329 K330 I418	I322-A326 WeakPolarHBondContact O-CB 3.16Å; I322-A326 PolarHBondContact O-N 3.28Å; P323-A326 PolarHBondContact O-N 3.2Å; A326-C329 WeakPolarHBondContact O-CB 3.35Å; A326-C329 PolarHBondContact O-N 3.37Å; A326-K330 VanDerWaalsContact O-CG 3.3Å; A326-K330 WeakPolarHBondContact O-CG 3.38Å; A326-K330 PolarHBondContact O-N 3.08Å; A326-I418 HydrophobicContact CB-CD1 4.22Å
327	D	67.1	Low	66.5	Low	49 Å²	49	29.6 Å²	29.6	26%	0.262	17%	0.165	S	C	.	.	H	α-helix	trans	-72	-31.2	179.8	-69.9	-15.2	0	0	0	112.8	V288 Y292 P323 K330 A331	V288-D327 HydrophobicContact CG1-CB 4.31Å; Y292-D327 HydrophobicContact CE2-CB 4.06Å; Y292-D327 PolarHBondContact OH-OD2 3.09Å; P323-D327 WeakPolarHBondContact O-CB 3.35Å; P323-D327 PolarHBondContact O-N 2.96Å; D327-K330 PolarHBondContact O-N 3.35Å; D327-K330 IonicContact OD1-NZ 3.5Å; D327-K330 PolarHBondContact OD1-NZ 3.48Å; D327-A331 WeakPolarHBondContact O-CB 3.31Å; D327-A331 PolarHBondContact O-N 3.28Å
328	L	70.9	Confident	67	Low	1 Å²	1	27 Å²	27	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-47.8	168.7	-175.5	73.1	0	0	0	110.2	V285 V288 V289 C324 L325 K330 A331 L332 Y398	V285-L328 HydrophobicContact CB-CD1 4Å; V285-L328 HydrophobicContact CG1-CD1 3.91Å; V285-L328 HydrophobicContact CG2-CD1 3.82Å; V288-L328 HydrophobicContact CB-CD1 4.47Å; V288-L328 HydrophobicContact CG1-CB 4.31Å; V289-L328 HydrophobicContact CG2-CD1 4.46Å; C324-L328 WeakPolarHBondContact O-CB 3.07Å; C324-L328 PolarHBondContact O-N 3.04Å; L325-L328 PolarHBondContact O-N 3.39Å; L328-K330 PolarHBondContact O-N 2.86Å; L328-A331 PolarHBondContact O-N 3.08Å; L328-L332 HydrophobicContact CG-CD1 3.98Å; L328-L332 VanDerWaalsContact O-CB 3.29Å; L328-L332 WeakPolarHBondContact O-CB 3.23Å; L328-L332 WeakPolarHBondContact O-CD1 3.46Å; L328-L332 WeakPolarHBondContact O-CG 3.24Å; L328-L332 PolarHBondContact O-N 2.93Å; L328-Y398 HydrophobicContact CD2-CD1 4.44Å; L328-Y398 HydrophobicContact CD2-CG 4.28Å
329	C	67.9	Low	67.4	Low	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-37.4	177.3	-74.7	0	0	0	0	112.6	L325 A326 W333 I418 F524	L325-C329 WeakPolarHBondContact O-CB 3.43Å; L325-C329 PolarHBondContact O-N 2.89Å; L325-C329 PolarHBondContact O-SG 2.85Å; A326-C329 WeakPolarHBondContact O-CB 3.35Å; A326-C329 PolarHBondContact O-N 3.37Å; C329-W333 VanDerWaalsContact O-CB 3.31Å; C329-W333 WeakPolarHBondContact O-CB 3.1Å; C329-W333 PolarHBondContact O-N 2.83Å; C329-I418 HydrophobicContact CB-CG2 4.3Å; C329-F524 HydrophobicContact CB-CD1 3.77Å; C329-F524 HydrophobicContact CB-CD2 3.9Å; C329-F524 HydrophobicContact CB-CE1 3.65Å; C329-F524 HydrophobicContact CB-CE2 3.79Å; C329-F524 HydrophobicContact CB-CG 3.89Å; C329-F524 HydrophobicContact CB-CZ 3.67Å; C329-F524 WeakPolarHBondContact O-CE2 3.46Å
330	K	71.1	Confident	67.7	Low	48 Å²	48	21.1 Å²	21.1	21%	0.209	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-48.5	173.5	-68.4	174.7	-165.1	157.5	0	112.2	A326 D327 L328 L332 W333 E334 N522 F524	A326-K330 VanDerWaalsContact O-CG 3.3Å; A326-K330 WeakPolarHBondContact O-CG 3.38Å; A326-K330 PolarHBondContact O-N 3.08Å; D327-K330 PolarHBondContact O-N 3.35Å; D327-K330 IonicContact OD1-NZ 3.5Å; D327-K330 PolarHBondContact OD1-NZ 3.48Å; L328-K330 PolarHBondContact O-N 2.86Å; K330-L332 VanDerWaalsContact C-N 3.3Å; K330-L332 PolarHBondContact O-N 2.79Å; K330-W333 WeakPolarHBondContact O-CB 3.36Å; K330-W333 PolarHBondContact O-N 3.39Å; K330-W333 VanDerWaalsContact O-N 3.13Å; K330-E334 PolarHBondContact O-N 2.97Å; K330-N522 WeakPolarHBondContact CG-ND2 3.49Å; K330-F524 HydrophobicContact CG-CB 3.78Å; K330-F524 HydrophobicContact CG-CD2 4.37Å; K330-F524 HydrophobicContact CG-CG 4.47Å
331	A	67.6	Low	67.8	Low	17 Å²	17	24.3 Å²	24.3	14%	0.14	12%	0.119	C	C	.	.	H	α-helix	trans	-64.1	-37.6	179.1	0	0	0	0	0	111.7	V288 D327 L328 V335	V288-A331 HydrophobicContact CG2-CB 4.11Å; D327-A331 WeakPolarHBondContact O-CB 3.31Å; D327-A331 PolarHBondContact O-N 3.28Å; L328-A331 PolarHBondContact O-N 3.08Å; A331-V335 WeakPolarHBondContact O-CG2 3.5Å; A331-V335 PolarHBondContact O-N 2.93Å; A331-V335 VanDerWaalsContact O-N 3.17Å
332	L	68.9	Low	67.8	Low	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-40.5	172.6	-73.3	171.5	0	0	0	111.8	I281 V285 L328 K330 V335 M336 V391 V395	I281-L332 HydrophobicContact CG2-CD2 3.95Å; V285-L332 HydrophobicContact CG2-CD1 4.47Å; V285-L332 HydrophobicContact CG2-CD2 3.6Å; V285-L332 HydrophobicContact CG2-CG 4.18Å; L328-L332 HydrophobicContact CG-CD1 3.98Å; L328-L332 VanDerWaalsContact O-CB 3.29Å; L328-L332 WeakPolarHBondContact O-CB 3.23Å; L328-L332 WeakPolarHBondContact O-CD1 3.46Å; L328-L332 WeakPolarHBondContact O-CG 3.24Å; L328-L332 PolarHBondContact O-N 2.93Å; K330-L332 VanDerWaalsContact C-N 3.3Å; K330-L332 PolarHBondContact O-N 2.79Å; L332-V335 PolarHBondContact O-N 3.32Å; L332-M336 WeakPolarHBondContact O-CB 3.3Å; L332-M336 VanDerWaalsContact O-CG 3.25Å; L332-M336 WeakPolarHBondContact O-CG 3.36Å; L332-M336 PolarHBondContact O-N 2.75Å; L332-V391 HydrophobicContact CD1-CG1 4.02Å; L332-V391 HydrophobicContact CD2-CG1 4.35Å; L332-V391 HydrophobicContact CD2-CG2 3.91Å; L332-V395 HydrophobicContact CD1-CG2 3.86Å
333	W	70.1	Confident	67.7	Low	8 Å²	8	25 Å²	25	3%	0.03	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-45	174.4	172.3	-101.9	0	0	0	112.2	C329 K330 V335 M336 L337 V425 F514 P523 F524	C329-W333 VanDerWaalsContact O-CB 3.31Å; C329-W333 WeakPolarHBondContact O-CB 3.1Å; C329-W333 PolarHBondContact O-N 2.83Å; K330-W333 WeakPolarHBondContact O-CB 3.36Å; K330-W333 PolarHBondContact O-N 3.39Å; K330-W333 VanDerWaalsContact O-N 3.13Å; W333-V335 VanDerWaalsContact C-N 3.34Å; W333-V335 PolarHBondContact O-N 3.02Å; W333-M336 CarbonylContact O-C 3.6Å; W333-M336 PolarHBondContact O-N 3.49Å; W333-L337 HydrophobicContact CZ2-CD1 4.19Å; W333-L337 VanDerWaalsContact O-CB 3.26Å; W333-L337 WeakPolarHBondContact O-CB 3.48Å; W333-L337 PolarHBondContact O-N 3.35Å; W333-V425 HydrophobicContact CE3-CB 4.49Å; W333-V425 HydrophobicContact CE3-CG1 3.66Å; W333-V425 HydrophobicContact CE3-CG2 3.99Å; W333-V425 HydrophobicContact CZ3-CB 4.27Å; W333-V425 HydrophobicContact CZ3-CG1 3.61Å; W333-V425 HydrophobicContact CZ3-CG2 3.71Å; W333-F514 HydrophobicContact CE3-CZ 4.36Å; W333-F514 HydrophobicContact CH2-CD1 4.05Å; W333-F514 HydrophobicContact CH2-CD2 4.07Å; W333-F514 AromaticContact CH2-CE1 3.83Å; W333-F514 HydrophobicContact CH2-CE1 3.83Å; W333-F514 AromaticContact CH2-CE2 3.85Å; W333-F514 HydrophobicContact CH2-CE2 3.85Å; W333-F514 HydrophobicContact CH2-CG 4.16Å; W333-F514 AromaticContact CH2-CZ 3.71Å; W333-F514 HydrophobicContact CH2-CZ 3.71Å; W333-F514 HydrophobicContact CZ2-CE1 4.44Å; W333-F514 HydrophobicContact CZ3-CD2 4.4Å; W333-F514 HydrophobicContact CZ3-CE1 4.02Å; W333-F514 AromaticContact CZ3-CE2 3.74Å; W333-F514 HydrophobicContact CZ3-CE2 3.74Å; W333-F514 AromaticContact CZ3-CZ 3.51Å; W333-F514 HydrophobicContact CZ3-CZ 3.51Å; W333-P523 HydrophobicContact CD2-CG 3.93Å; W333-P523 HydrophobicContact CE3-CG 4.22Å; W333-P523 HydrophobicContact CG-CG 4.49Å; W333-P523 HydrophobicContact CH2-CG 4.13Å; W333-P523 HydrophobicContact CZ2-CG 3.84Å; W333-P523 HydrophobicContact CZ3-CG 4.31Å; W333-F524 HydrophobicContact CB-CE2 4.13Å
334	E	68.4	Low	67.5	Low	101 Å²	101	25.7 Å²	25.7	47%	0.472	12%	0.12	S	C	.	.	H	α-helix	trans	-60.9	-42	177.2	-73	173.8	179.7	0	0	112.1	K330 L337 S338	K330-E334 PolarHBondContact O-N 2.97Å; E334-L337 PolarHBondContact O-N 3.44Å; E334-S338 WeakPolarHBondContact O-CB 3.14Å; E334-S338 PolarHBondContact O-N 3.01Å; E334-S338 PolarHBondContact O-OG 2.8Å
335	V	69.9	Low	67.7	Low	5 Å²	5	26.6 Å²	26.6	3%	0.03	12%	0.124	C	C	.	.	H	α-helix	trans	-66.3	-42.1	175.3	177.4	0	0	0	0	111	F277 I281 T284 A331 L332 W333 S338 Y339	F277-V335 HydrophobicContact CD1-CG1 4.19Å; I281-V335 HydrophobicContact CD1-CG1 4.45Å; I281-V335 HydrophobicContact CG1-CG1 3.71Å; T284-V335 HydrophobicContact CG2-CG2 4.14Å; A331-V335 WeakPolarHBondContact O-CG2 3.5Å; A331-V335 PolarHBondContact O-N 2.93Å; A331-V335 VanDerWaalsContact O-N 3.17Å; L332-V335 PolarHBondContact O-N 3.32Å; W333-V335 VanDerWaalsContact C-N 3.34Å; W333-V335 PolarHBondContact O-N 3.02Å; V335-S338 PolarHBondContact O-N 3.42Å; V335-S338 PolarHBondContact O-OG 3.44Å; V335-Y339 PolarHBondContact O-N 3.08Å; V335-Y339 VanDerWaalsContact O-N 3.07Å
336	M	67.1	Low	67.7	Low	1 Å²	1	27.3 Å²	27.3	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-64.9	-39.1	175.2	-71.5	175.5	70.4	0	0	112.2	L332 W333 Y339 Y340 W388 V425 F429	L332-M336 WeakPolarHBondContact O-CB 3.3Å; L332-M336 VanDerWaalsContact O-CG 3.25Å; L332-M336 WeakPolarHBondContact O-CG 3.36Å; L332-M336 PolarHBondContact O-N 2.75Å; W333-M336 CarbonylContact O-C 3.6Å; W333-M336 PolarHBondContact O-N 3.49Å; M336-Y339 PolarHBondContact O-N 3.41Å; M336-Y340 PolarHBondContact O-N 2.83Å; M336-W388 HydrophobicContact CE-CE3 3.67Å; M336-W388 HydrophobicContact CE-CZ3 3.84Å; M336-W388 HydrophobicContact SD-CE3 4.15Å; M336-W388 HydrophobicContact SD-CZ3 4.04Å; M336-V425 HydrophobicContact CE-CG1 3.95Å; M336-V425 HydrophobicContact SD-CG1 4.41Å; M336-F429 HydrophobicContact CB-CD2 4.5Å; M336-F429 HydrophobicContact CB-CE2 4.09Å; M336-F429 HydrophobicContact CB-CZ 4.29Å; M336-F429 HydrophobicContact CE-CB 3.61Å; M336-F429 HydrophobicContact CE-CD1 3.45Å; M336-F429 VanDerWaalsContact CE-CD1 3.45Å; M336-F429 HydrophobicContact CE-CD2 3.82Å; M336-F429 HydrophobicContact CE-CE1 3.95Å; M336-F429 HydrophobicContact CE-CE2 4.28Å; M336-F429 HydrophobicContact CE-CG 3.35Å; M336-F429 HydrophobicContact CE-CZ 4.32Å; M336-F429 HydrophobicContact CG-CZ 4.4Å; M336-F429 WeakPolarHBondContact O-CE2 3.29Å
337	L	65.8	Low	67.3	Low	17 Å²	17	32.8 Å²	32.8	9%	0.089	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-41.2	175.5	-170.1	80.8	0	0	0	111.1	W333 E334 Y339 Y340 R341 F514	W333-L337 HydrophobicContact CZ2-CD1 4.19Å; W333-L337 VanDerWaalsContact O-CB 3.26Å; W333-L337 WeakPolarHBondContact O-CB 3.48Å; W333-L337 PolarHBondContact O-N 3.35Å; E334-L337 PolarHBondContact O-N 3.44Å; L337-Y339 VanDerWaalsContact C-N 3.3Å; L337-Y339 PolarHBondContact O-N 3.33Å; L337-Y340 PolarHBondContact O-N 3.23Å; L337-R341 WeakPolarHBondContact O-CB 3.3Å; L337-R341 WeakPolarHBondContact O-CG 3.46Å; L337-R341 PolarHBondContact O-N 2.98Å; L337-F514 HydrophobicContact CD1-CD1 4Å; L337-F514 HydrophobicContact CD1-CE1 4.14Å
338	S	68.2	Low	67.1	Low	4 Å²	4	35.8 Å²	35.8	3%	0.028	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-36.6	175.4	72.7	0	0	0	0	112	C245 F277 E334 V335 T342	C245-S338 PolarHBondContact O-OG 2.85Å; F277-S338 WeakPolarHBondContact CE1-OG 3.46Å; E334-S338 WeakPolarHBondContact O-CB 3.14Å; E334-S338 PolarHBondContact O-N 3.01Å; E334-S338 PolarHBondContact O-OG 2.8Å; V335-S338 PolarHBondContact O-N 3.42Å; V335-S338 PolarHBondContact O-OG 3.44Å; S338-T342 WeakPolarHBondContact O-CB 3.1Å; S338-T342 PolarHBondContact O-N 3.42Å; S338-T342 PolarHBondContact O-OG1 3.36Å
339	Y	67.6	Low	66.5	Low	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.9	-40.6	173.1	-168	-94.1	0	0	0	112.1	L273 H274 F277 V335 M336 L337 T342 M343 L380 G383 L384 I387 F429	L273-Y339 HydrophobicContact CD2-CE2 4.35Å; H274-Y339 PolarHBondContact NE2-OH 3.33Å; F277-Y339 HydrophobicContact CD1-CD2 4.09Å; F277-Y339 AromaticContact CD2-CD2 3.73Å; F277-Y339 HydrophobicContact CD2-CD2 3.73Å; F277-Y339 HydrophobicContact CD2-CE2 4.11Å; F277-Y339 HydrophobicContact CE1-CD2 4.11Å; F277-Y339 AromaticContact CE2-CD2 3.77Å; F277-Y339 HydrophobicContact CE2-CD2 3.77Å; F277-Y339 HydrophobicContact CE2-CE2 4.35Å; F277-Y339 AromaticContact CG-CD2 3.92Å; F277-Y339 HydrophobicContact CG-CD2 3.92Å; F277-Y339 AromaticContact CZ-CD2 3.96Å; F277-Y339 HydrophobicContact CZ-CD2 3.96Å; V335-Y339 PolarHBondContact O-N 3.08Å; V335-Y339 VanDerWaalsContact O-N 3.07Å; M336-Y339 PolarHBondContact O-N 3.41Å; L337-Y339 VanDerWaalsContact C-N 3.3Å; L337-Y339 PolarHBondContact O-N 3.33Å; Y339-T342 WeakPolarHBondContact O-CB 3.25Å; Y339-T342 PolarHBondContact O-N 3.43Å; Y339-M343 HydrophobicContact CD1-CG 4.44Å; Y339-M343 HydrophobicContact CE1-CG 4.17Å; Y339-M343 PolarHBondContact O-N 2.97Å; Y339-L380 HydrophobicContact CE2-CD2 4.44Å; Y339-L380 WeakPolarHBondContact OH-CA 3.43Å; Y339-L380 PolarHBondContact OH-O 2.88Å; Y339-G383 WeakPolarHBondContact OH-CA 3.49Å; Y339-L384 HydrophobicContact CD1-CD2 3.55Å; Y339-L384 HydrophobicContact CD1-CG 4.41Å; Y339-L384 HydrophobicContact CE1-CD2 3.39Å; Y339-L384 HydrophobicContact CE1-CG 3.75Å; Y339-I387 HydrophobicContact CD1-CD1 4.01Å; Y339-I387 HydrophobicContact CD2-CD1 3.3Å; Y339-I387 HydrophobicContact CE1-CD1 4.05Å; Y339-I387 HydrophobicContact CE2-CD1 3.36Å; Y339-I387 HydrophobicContact CG-CD1 3.62Å; Y339-F429 HydrophobicContact CD1-CE2 4.44Å; Y339-F429 AromaticContact CD1-CZ 3.77Å; Y339-F429 HydrophobicContact CD1-CZ 3.77Å; Y339-F429 HydrophobicContact CG-CZ 4.43Å
340	Y	63.7	Low	65.8	Low	86 Å²	86	40 Å²	40	34%	0.337	18%	0.183	S	C	.	.	H	α-helix	trans	-63.9	-42.1	175	-174.4	-97.4	0	0	0	112.3	M336 L337 T342 M343 E344 F514	M336-Y340 PolarHBondContact O-N 2.83Å; L337-Y340 PolarHBondContact O-N 3.23Å; Y340-T342 VanDerWaalsContact C-N 3.34Å; Y340-T342 PolarHBondContact O-N 3.48Å; Y340-M343 WeakPolarHBondContact O-CB 3.34Å; Y340-M343 PolarHBondContact O-N 3.33Å; Y340-E344 PolarHBondContact O-N 3.18Å; Y340-F514 AromaticContact CD1-CD1 3.71Å; Y340-F514 HydrophobicContact CD1-CD1 3.71Å; Y340-F514 HydrophobicContact CD1-CE1 4.37Å; Y340-F514 HydrophobicContact CD1-CG 4.43Å; Y340-F514 HydrophobicContact CD2-CD1 4.14Å; Y340-F514 HydrophobicContact CD2-CE1 4.37Å; Y340-F514 HydrophobicContact CE1-CB 4.14Å; Y340-F514 HydrophobicContact CE1-CD1 4.15Å; Y340-F514 HydrophobicContact CE1-CG 4.44Å; Y340-F514 AromaticContact CG-CD1 3.71Å; Y340-F514 HydrophobicContact CG-CD1 3.71Å; Y340-F514 AromaticContact CG-CE1 3.96Å; Y340-F514 HydrophobicContact CG-CE1 3.96Å; Y340-F514 HydrophobicContact CG-CG 4.48Å
341	R	63.4	Low	64.8	Low	81 Å²	81	42.7 Å²	42.7	31%	0.306	20%	0.199	S	C	.	.	H	α-helix	trans	-65.8	-35.2	173.5	-71.7	175.7	175	177.8	-0.3	112.4	F248 L337 M343 E344 W345 C518	F248-R341 HydrophobicContact CB-CB 4.37Å; F248-R341 HydrophobicContact CD1-CB 3.53Å; F248-R341 HydrophobicContact CD1-CG 4.49Å; F248-R341 HydrophobicContact CE1-CB 3.91Å; F248-R341 HydrophobicContact CG-CB 3.92Å; L337-R341 WeakPolarHBondContact O-CB 3.3Å; L337-R341 WeakPolarHBondContact O-CG 3.46Å; L337-R341 PolarHBondContact O-N 2.98Å; R341-M343 VanDerWaalsContact C-N 3.33Å; R341-E344 PolarHBondContact O-N 2.91Å; R341-W345 WeakPolarHBondContact O-CB 3.31Å; R341-W345 PolarHBondContact O-N 3.28Å; R341-C518 PolarHBondContact NH2-O 2.87Å
342	T	67.4	Low	63.9	Low	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-44	171.1	-53.9	0	0	0	0	110.7	F248 Y253 L273 S338 Y339 Y340 W345 H346	F248-T342 WeakPolarHBondContact CD2-OG1 3.47Å; F248-T342 HydrophobicContact CE2-CG2 4.27Å; F248-T342 WeakPolarHBondContact CE2-OG1 3.49Å; Y253-T342 HydrophobicContact CE1-CG2 3.98Å; Y253-T342 HydrophobicContact CE2-CG2 4.23Å; Y253-T342 WeakPolarHBondContact OH-CG2 3.44Å; L273-T342 HydrophobicContact CD1-CG2 4.32Å; S338-T342 WeakPolarHBondContact O-CB 3.1Å; S338-T342 PolarHBondContact O-N 3.42Å; S338-T342 PolarHBondContact O-OG1 3.36Å; Y339-T342 WeakPolarHBondContact O-CB 3.25Å; Y339-T342 PolarHBondContact O-N 3.43Å; Y340-T342 VanDerWaalsContact C-N 3.34Å; Y340-T342 PolarHBondContact O-N 3.48Å; T342-W345 WeakPolarHBondContact O-CB 3.45Å; T342-W345 PolarHBondContact O-N 3Å; T342-H346 PolarHBondContact O-CD2 3.49Å; T342-H346 VanDerWaalsContact O-CD2 3.28Å; T342-H346 PolarHBondContact O-N 3.45Å; T342-H346 VanDerWaalsContact O-N 3.08Å
343	M	65.2	Low	62.8	Low	42 Å²	42	50.2 Å²	50.2	21%	0.207	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-49.1	175.4	-84.4	-70.1	-85.2	0	0	112.7	Y339 Y340 R341 W345 H346 E347 L380 L384	Y339-M343 HydrophobicContact CD1-CG 4.44Å; Y339-M343 HydrophobicContact CE1-CG 4.17Å; Y339-M343 PolarHBondContact O-N 2.97Å; Y340-M343 WeakPolarHBondContact O-CB 3.34Å; Y340-M343 PolarHBondContact O-N 3.33Å; R341-M343 VanDerWaalsContact C-N 3.33Å; M343-W345 PolarHBondContact O-N 3.42Å; M343-H346 PolarHBondContact O-N 3.3Å; M343-H346 VanDerWaalsContact O-N 3.11Å; M343-E347 PolarHBondContact O-N 3.24Å; M343-L380 HydrophobicContact CE-CB 4.12Å; M343-L380 HydrophobicContact CG-CD2 4.23Å; M343-L380 HydrophobicContact SD-CB 3.35Å; M343-L380 WeakPolarHBondContact SD-CB 3.06Å; M343-L380 HydrophobicContact SD-CD1 3.66Å; M343-L380 HydrophobicContact SD-CD2 3.65Å; M343-L380 HydrophobicContact SD-CG 3.72Å; M343-L384 HydrophobicContact CE-CD1 4.45Å
344	E	64.9	Low	61.6	Low	67 Å²	67	53 Å²	53	31%	0.313	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-34.8	177.9	-165.5	-170.6	174.8	0	0	111.3	Y340 R341 K348	Y340-E344 PolarHBondContact O-N 3.18Å; R341-E344 PolarHBondContact O-N 2.91Å; E344-K348 VanDerWaalsContact CD-NZ 3.33Å; E344-K348 HydrophobicContact CG-CD 4.4Å; E344-K348 WeakPolarHBondContact O-CB 3.24Å; E344-K348 VanDerWaalsContact O-CG 3.28Å; E344-K348 WeakPolarHBondContact O-CG 3.31Å; E344-K348 PolarHBondContact O-N 2.89Å; E344-K348 VanDerWaalsContact OE1-CE 3.26Å; E344-K348 WeakPolarHBondContact OE1-CE 3.29Å; E344-K348 IonicContact OE1-NZ 3.91Å; E344-K348 PolarHBondContact OE1-NZ 3.48Å
345	W	69.4	Low	60.2	Low	19 Å²	19	51.5 Å²	51.5	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-46.7	173.9	-175.6	92.9	0	0	0	112.4	F248 Y253 T254 Q257 R341 T342 M343 E347 K348 H349	F248-W345 HydrophobicContact CE1-CB 4.42Å; F248-W345 HydrophobicContact CZ-CB 3.94Å; F248-W345 HydrophobicContact CZ-CG 4.25Å; Y253-W345 AromaticContact CD1-CD2 3.55Å; Y253-W345 HydrophobicContact CD1-CD2 3.55Å; Y253-W345 AromaticContact CD1-CE2 3.82Å; Y253-W345 AromaticContact CD1-CE3 3.77Å; Y253-W345 HydrophobicContact CD1-CE3 3.77Å; Y253-W345 AromaticContact CD1-CG 3.97Å; Y253-W345 HydrophobicContact CD1-CG 3.97Å; Y253-W345 HydrophobicContact CD1-CH2 4.49Å; Y253-W345 HydrophobicContact CD1-CZ2 4.26Å; Y253-W345 HydrophobicContact CD1-CZ3 4.28Å; Y253-W345 AromaticContact CE1-CD2 3.74Å; Y253-W345 HydrophobicContact CE1-CD2 3.74Å; Y253-W345 AromaticContact CE1-CE3 3.44Å; Y253-W345 HydrophobicContact CE1-CE3 3.44Å; Y253-W345 VanDerWaalsContact CE1-CE3 3.44Å; Y253-W345 HydrophobicContact CE1-CG 4.37Å; Y253-W345 HydrophobicContact CE1-CH2 4.41Å; Y253-W345 AromaticContact CE1-CZ3 3.85Å; Y253-W345 HydrophobicContact CE1-CZ3 3.85Å; T254-W345 HydrophobicContact CG2-CZ2 3.59Å; Q257-W345 HydrophobicContact CB-CH2 3.99Å; Q257-W345 HydrophobicContact CG-CH2 3.93Å; Q257-W345 HydrophobicContact CG-CZ3 4.31Å; Q257-W345 VanDerWaalsContact NE2-CZ3 3.31Å; Q257-W345 VanDerWaalsContact OE1-CH2 3.27Å; R341-W345 WeakPolarHBondContact O-CB 3.31Å; R341-W345 PolarHBondContact O-N 3.28Å; T342-W345 WeakPolarHBondContact O-CB 3.45Å; T342-W345 PolarHBondContact O-N 3Å; M343-W345 PolarHBondContact O-N 3.42Å; W345-E347 VanDerWaalsContact C-N 3.3Å; W345-E347 PolarHBondContact O-N 2.87Å; W345-K348 PolarHBondContact O-N 3Å; W345-H349 AromaticContact CD1-CD2 3.88Å; W345-H349 AromaticContact CD2-CD2 3.47Å; W345-H349 VanDerWaalsContact CD2-CD2 3.47Å; W345-H349 AromaticContact CE2-CD2 2.99Å; W345-H349 AromaticContact CE2-CG 3.98Å; W345-H349 AromaticContact CE2-NE2 3.24Å; W345-H349 HydrophobicContact CE3-CB 4.49Å; W345-H349 AromaticContact CE3-CD2 3.93Å; W345-H349 HydrophobicContact CH2-CB 4.23Å; W345-H349 AromaticContact CH2-CD2 3.59Å; W345-H349 AromaticContact CH2-CG 3.76Å; W345-H349 AromaticContact CZ2-CD2 3.11Å; W345-H349 WeakPolarHBondContact CZ2-CD2 3.4Å; W345-H349 AromaticContact CZ2-CE1 3.89Å; W345-H349 AromaticContact CZ2-CG 3.72Å; W345-H349 AromaticContact CZ2-NE2 3.21Å; W345-H349 WeakPolarHBondContact CZ2-NE2 3.19Å; W345-H349 HydrophobicContact CZ3-CB 4.14Å; W345-H349 AromaticContact CZ3-CD2 3.94Å; W345-H349 AromaticContact NE1-CD2 3.26Å; W345-H349 PolarHBondContact NE1-CD2 3.38Å; W345-H349 VanDerWaalsContact NE1-CD2 3.26Å; W345-H349 AromaticContact NE1-NE2 3.19Å; W345-H349 PolarHBondContact NE1-NE2 2.88Å; W345-H349 VanDerWaalsContact NE1-NE2 3.19Å; W345-H349 PolarHBondContact O-N 2.78Å
346	H	66.9	Low	59.1	Low	16 Å²	16	55 Å²	55	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-35.7	177.6	-83.6	-87.2	0	0	0	111.3	Y253 Q257 T342 M343 D350 L380	Y253-H346 AromaticContact CE1-NE2 3.74Å; Y253-H346 AromaticContact CZ-NE2 3.72Å; Y253-H346 PolarHBondContact OH-NE2 3.1Å; Q257-H346 PolarHBondContact NE2-CE1 2.99Å; Q257-H346 PolarHBondContact OE1-CE1 3.17Å; Q257-H346 PolarHBondContact OE1-NE2 3.06Å; T342-H346 PolarHBondContact O-CD2 3.49Å; T342-H346 VanDerWaalsContact O-CD2 3.28Å; T342-H346 PolarHBondContact O-N 3.45Å; T342-H346 VanDerWaalsContact O-N 3.08Å; M343-H346 PolarHBondContact O-N 3.3Å; M343-H346 VanDerWaalsContact O-N 3.11Å; H346-D350 VanDerWaalsContact O-CB 3.28Å; H346-D350 WeakPolarHBondContact O-CB 3.44Å; H346-D350 PolarHBondContact O-N 2.91Å; H346-L380 HydrophobicContact CB-CD1 4.4Å
347	E	62.2	Low	57.7	Low	126 Å²	126	58.3 Å²	58.3	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-68.3	-37.7	175.5	-165.7	172.3	-163.3	0	0	112.4	M343 W345 N351	M343-E347 PolarHBondContact O-N 3.24Å; W345-E347 VanDerWaalsContact C-N 3.3Å; W345-E347 PolarHBondContact O-N 2.87Å; E347-N351 PolarHBondContact O-N 3.48Å; E347-N351 PolarHBondContact O-ND2 3.37Å; E347-N351 VanDerWaalsContact O-ND2 3.12Å
348	K	61.8	Low	56.7	Low	111 Å²	111	62.2 Å²	62.2	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-69.8	-42.5	174	-75.7	174.2	-175.7	168.3	0	112.6	E344 W345 N351 E352	E344-K348 VanDerWaalsContact CD-NZ 3.33Å; E344-K348 HydrophobicContact CG-CD 4.4Å; E344-K348 WeakPolarHBondContact O-CB 3.24Å; E344-K348 VanDerWaalsContact O-CG 3.28Å; E344-K348 WeakPolarHBondContact O-CG 3.31Å; E344-K348 PolarHBondContact O-N 2.89Å; E344-K348 VanDerWaalsContact OE1-CE 3.26Å; E344-K348 WeakPolarHBondContact OE1-CE 3.29Å; E344-K348 IonicContact OE1-NZ 3.91Å; E344-K348 PolarHBondContact OE1-NZ 3.48Å; W345-K348 PolarHBondContact O-N 3Å; K348-N351 WeakPolarHBondContact O-CB 3.38Å; K348-N351 PolarHBondContact O-N 3.3Å; K348-E352 PolarHBondContact O-N 2.84Å
349	H	58.5	Low	55.4	Low	46 Å²	46	71 Å²	71	21%	0.213	38%	0.378	C	S	.	.	H	α-helix	trans	-70.8	-29.4	176.2	-88.5	-79.1	0	0	0	113.1	W345 N351 E352 D353	W345-H349 AromaticContact CD1-CD2 3.88Å; W345-H349 AromaticContact CD2-CD2 3.47Å; W345-H349 VanDerWaalsContact CD2-CD2 3.47Å; W345-H349 AromaticContact CE2-CD2 2.99Å; W345-H349 AromaticContact CE2-CG 3.98Å; W345-H349 AromaticContact CE2-NE2 3.24Å; W345-H349 HydrophobicContact CE3-CB 4.49Å; W345-H349 AromaticContact CE3-CD2 3.93Å; W345-H349 HydrophobicContact CH2-CB 4.23Å; W345-H349 AromaticContact CH2-CD2 3.59Å; W345-H349 AromaticContact CH2-CG 3.76Å; W345-H349 AromaticContact CZ2-CD2 3.11Å; W345-H349 WeakPolarHBondContact CZ2-CD2 3.4Å; W345-H349 AromaticContact CZ2-CE1 3.89Å; W345-H349 AromaticContact CZ2-CG 3.72Å; W345-H349 AromaticContact CZ2-NE2 3.21Å; W345-H349 WeakPolarHBondContact CZ2-NE2 3.19Å; W345-H349 HydrophobicContact CZ3-CB 4.14Å; W345-H349 AromaticContact CZ3-CD2 3.94Å; W345-H349 AromaticContact NE1-CD2 3.26Å; W345-H349 PolarHBondContact NE1-CD2 3.38Å; W345-H349 VanDerWaalsContact NE1-CD2 3.26Å; W345-H349 AromaticContact NE1-NE2 3.19Å; W345-H349 PolarHBondContact NE1-NE2 2.88Å; W345-H349 VanDerWaalsContact NE1-NE2 3.19Å; W345-H349 PolarHBondContact O-N 2.78Å; H349-N351 PolarHBondContact O-N 2.72Å; H349-E352 IonicContact CE1-OE2 2.74Å; H349-E352 IonicContact ND1-OE2 3.91Å; H349-E352 PolarHBondContact O-N 3.08Å; H349-D353 WeakPolarHBondContact O-CB 3.48Å; H349-D353 PolarHBondContact O-N 2.84Å
350	D	53.9	Low	53.8	Low	45 Å²	45	73.7 Å²	73.7	24%	0.241	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-30.1	170.5	-96.2	-14.7	0	0	0	112.7	H346 T354 R373	H346-D350 VanDerWaalsContact O-CB 3.28Å; H346-D350 WeakPolarHBondContact O-CB 3.44Å; H346-D350 PolarHBondContact O-N 2.91Å; D350-T354 WeakPolarHBondContact O-CG2 3.47Å; D350-T354 PolarHBondContact O-N 3.47Å; D350-T354 PolarHBondContact O-OG1 2.95Å; D350-R373 VanDerWaalsContact CG-NH1 3.31Å; D350-R373 PolarHBondContact O-NH1 3.25Å; D350-R373 WeakPolarHBondContact OD1-CD 3.35Å; D350-R373 WeakPolarHBondContact OD1-CG 3.48Å; D350-R373 IonicContact OD1-CZ 3.2Å; D350-R373 VanDerWaalsContact OD1-CZ 3.3Å; D350-R373 IonicContact OD1-NE 2.65Å; D350-R373 PolarHBondContact OD1-NE 2.95Å; D350-R373 IonicContact OD1-NH1 3.12Å; D350-R373 PolarHBondContact OD1-NH1 3.21Å; D350-R373 IonicContact OD2-NE 2.87Å
351	N	49.7	Very low	52.7	Low	103 Å²	103	76.8 Å²	76.8	55%	0.551	43%	0.428	S	S	*	.	H	α-helix	trans	-80.9	-35.6	175.8	-73	-30.7	0	0	0	112.8	E347 K348 H349 T354 A355	E347-N351 PolarHBondContact O-N 3.48Å; E347-N351 PolarHBondContact O-ND2 3.37Å; E347-N351 VanDerWaalsContact O-ND2 3.12Å; K348-N351 WeakPolarHBondContact O-CB 3.38Å; K348-N351 PolarHBondContact O-N 3.3Å; H349-N351 PolarHBondContact O-N 2.72Å; N351-T354 VanDerWaalsContact CA-OG1 3.28Å; N351-T354 WeakPolarHBondContact CA-OG1 3.37Å; N351-T354 PolarHBondContact O-OG1 2.82Å; N351-A355 PolarHBondContact O-N 3.45Å; N351-A355 VanDerWaalsContact O-N 3.16Å
352	E	48.4	Very low	51.2	Low	119 Å²	119	80.1 Å²	80.1	56%	0.556	45%	0.452	S	S	*	.	H	α-helix	trans	-72.9	-38.5	176.1	-72.9	-175.1	167	0	0	113	K348 H349 T354 A355 S356	K348-E352 PolarHBondContact O-N 2.84Å; H349-E352 IonicContact CE1-OE2 2.74Å; H349-E352 IonicContact ND1-OE2 3.91Å; H349-E352 PolarHBondContact O-N 3.08Å; E352-T354 VanDerWaalsContact C-N 3.3Å; E352-T354 PolarHBondContact O-N 3.04Å; E352-A355 PolarHBondContact O-N 2.71Å; E352-S356 PolarHBondContact O-N 2.89Å; E352-S356 PolarHBondContact O-OG 2.9Å
353	D	46.5	Very low	49.9	Very low	58 Å²	58	88.4 Å²	88.4	31%	0.31	49%	0.492	S	S	.	.	H	α-helix	trans	-72	-23.1	175.6	-80.2	-8.7	0	0	0	111.9	R261 H349 S356 A357	R261-D353 IonicContact CZ-OD2 2.65Å; R261-D353 IonicContact NH1-OD2 3.8Å; R261-D353 PolarHBondContact NH1-OD2 3.28Å; R261-D353 IonicContact NH2-OD2 3.59Å; R261-D353 PolarHBondContact NH2-OD2 2.76Å; H349-D353 WeakPolarHBondContact O-CB 3.48Å; H349-D353 PolarHBondContact O-N 2.84Å; D353-S356 WeakPolarHBondContact CA-OG 3.14Å; D353-S356 PolarHBondContact O-OG 3.46Å; D353-A357 WeakPolarHBondContact O-CB 3.25Å; D353-A357 PolarHBondContact O-N 3.27Å
354	T	44.6	Very low	48.6	Very low	65 Å²	65	94.7 Å²	94.7	40%	0.399	53%	0.525	S	S	.	.	H	α-helix	trans	-80.5	-32.2	172.6	38.1	0	0	0	0	113.3	D350 N351 E352 R373	D350-T354 WeakPolarHBondContact O-CG2 3.47Å; D350-T354 PolarHBondContact O-N 3.47Å; D350-T354 PolarHBondContact O-OG1 2.95Å; N351-T354 VanDerWaalsContact CA-OG1 3.28Å; N351-T354 WeakPolarHBondContact CA-OG1 3.37Å; N351-T354 PolarHBondContact O-OG1 2.82Å; E352-T354 VanDerWaalsContact C-N 3.3Å; E352-T354 PolarHBondContact O-N 3.04Å; T354-R373 VanDerWaalsContact CG2-NH2 3.32Å
355	A	40.2	Very low	47.3	Very low	70 Å²	70	94 Å²	94	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-71	-29.7	173.3	0	0	0	0	0	112.8	N351 E352 S358	N351-A355 PolarHBondContact O-N 3.45Å; N351-A355 VanDerWaalsContact O-N 3.16Å; E352-A355 PolarHBondContact O-N 2.71Å; A355-S358 PolarHBondContact O-OG 2.95Å
356	S	45.2	Very low	46	Very low	78 Å²	78	96.3 Å²	96.3	55%	0.545	55%	0.552	S	S	.	*	H	α-helix	trans	-84.1	-22.4	176.4	53.2	0	0	0	0	113.9	E352 D353 S358	E352-S356 PolarHBondContact O-N 2.89Å; E352-S356 PolarHBondContact O-OG 2.9Å; D353-S356 WeakPolarHBondContact CA-OG 3.14Å; D353-S356 PolarHBondContact O-OG 3.46Å; S356-S358 VanDerWaalsContact C-N 3.32Å; S356-S358 PolarHBondContact O-N 3.16Å
357	A	38.7	Very low	44.7	Very low	71 Å²	71	103.7 Å²	103.7	59%	0.587	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-74.5	-14.7	174.9	0	0	0	0	0	114.3	D353 E359	D353-A357 WeakPolarHBondContact O-CB 3.25Å; D353-A357 PolarHBondContact O-N 3.27Å; A357-E359 VanDerWaalsContact C-N 3.31Å; A357-E359 PolarHBondContact O-N 2.82Å
358	S	44.9	Very low	43.8	Very low	99 Å²	99	105.2 Å²	105.2	69%	0.692	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-77.8	-5	-179.8	52.3	0	0	0	0	115.4	A355 S356	A355-S358 PolarHBondContact O-OG 2.95Å; S356-S358 VanDerWaalsContact C-N 3.32Å; S356-S358 PolarHBondContact O-N 3.16Å
359	E	39.6	Very low	43.2	Very low	190 Å²	190	103.9 Å²	103.9	89%	0.888	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-115.8	4.7	-179.8	-71.6	-161.8	154.1	0	0	115.9	A357	A357-E359 VanDerWaalsContact C-N 3.31Å; A357-E359 PolarHBondContact O-N 2.82Å
360	G	34.6	Very low	42.8	Very low	56 Å²	56	106.1 Å²	106.1	58%	0.577	61%	0.609	S	S	*	*			trans	-141.2	101.9	-174.6	0	0	0	0	0	115.3	N362	G360-N362 PolarHBondContact O-N 2.99Å
361	N	40.3	Very low	42.7	Very low	151 Å²	151	112.4 Å²	112.4	81%	0.807	63%	0.634	S	S	*	*			trans	-61.2	109.7	176.8	-166.5	32.6	0	0	0	112.8
362	N	32.8	Very low	43.1	Very low	150 Å²	150	109.7 Å²	109.7	80%	0.802	62%	0.62	S	S	*	*			trans	-157.7	105.8	159.6	-88.9	-33	0	0	0	111.3	G360 I364	G360-N362 PolarHBondContact O-N 2.99Å; N362-I364 PolarHBondContact O-N 3.32Å
363	M	39.4	Very low	43.6	Very low	174 Å²	174	107.7 Å²	107.7	86%	0.857	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	27.2	-165.6	-163.3	165.7	172.9	0	0	114.9
364	I	38.5	Very low	44.1	Very low	174 Å²	174	106.7 Å²	106.7	89%	0.892	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	-11.5	-175.4	-63.4	175.9	0	0	0	114	N362	N362-I364 PolarHBondContact O-N 3.32Å
365	G	37.1	Very low	45.1	Very low	52 Å²	52	107.5 Å²	107.5	54%	0.536	61%	0.607	S	S	.	*	S	Bend	trans	-105.2	-1.2	176.9	0	0	0	0	0	115.4	T369	G365-T369 PolarHBondContact O-OG1 3.46Å
366	T	41.3	Very low	46.2	Very low	68 Å²	68	105.7 Å²	105.7	42%	0.417	59%	0.587	S	S	.	*	H	α-helix	trans	-85.3	-15.6	-162	-20.1	0	0	0	0	114.2	T369 N370	T366-T369 PolarHBondContact O-OG1 3.04Å; T366-N370 WeakPolarHBondContact O-CB 3.33Å; T366-N370 VanDerWaalsContact O-CG 3.3Å; T366-N370 PolarHBondContact O-N 3.38Å; T366-N370 PolarHBondContact O-ND2 3.29Å; T366-N370 VanDerWaalsContact O-ND2 3.08Å
367	E	40.4	Very low	47.2	Very low	171 Å²	171	107.6 Å²	107.6	80%	0.799	59%	0.586	S	S	*	*	H	α-helix	trans	-83.1	-40.8	-177	-66.4	-170	167.7	0	0	112.8	N370 F371	E367-N370 PolarHBondContact O-N 2.82Å; E367-F371 PolarHBondContact O-N 3.25Å; E367-F371 VanDerWaalsContact O-N 3.09Å
368	E	43.9	Very low	48.6	Very low	159 Å²	159	111.7 Å²	111.7	74%	0.743	59%	0.59	S	S	*	*	H	α-helix	trans	-66.8	-42.2	177.1	-69.4	-173.7	160.7	0	0	111.5	N370 F371 D372	E368-N370 VanDerWaalsContact C-N 3.33Å; E368-N370 PolarHBondContact O-N 2.84Å; E368-F371 PolarHBondContact O-N 3.38Å; E368-D372 PolarHBondContact O-N 3.35Å
369	T	49	Very low	49.5	Very low	83 Å²	83	109.5 Å²	109.5	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-33	178.2	56.6	0	0	0	0	112.9	G365 T366 R373	G365-T369 PolarHBondContact O-OG1 3.46Å; T366-T369 PolarHBondContact O-OG1 3.04Å; T369-R373 WeakPolarHBondContact O-CB 3.44Å; T369-R373 PolarHBondContact O-N 2.88Å; T369-R373 VanDerWaalsContact O-N 3.09Å
370	N	49.8	Very low	50.8	Low	93 Å²	93	100.6 Å²	100.6	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-75.6	-34	176.4	-84.1	-24.8	0	0	0	112.5	T366 E367 E368 R373 G374	T366-N370 WeakPolarHBondContact O-CB 3.33Å; T366-N370 VanDerWaalsContact O-CG 3.3Å; T366-N370 PolarHBondContact O-N 3.38Å; T366-N370 PolarHBondContact O-ND2 3.29Å; T366-N370 VanDerWaalsContact O-ND2 3.08Å; E367-N370 PolarHBondContact O-N 2.82Å; E368-N370 VanDerWaalsContact C-N 3.33Å; E368-N370 PolarHBondContact O-N 2.84Å; N370-R373 PolarHBondContact O-N 3.49Å; N370-G374 PolarHBondContact O-N 3.27Å
371	F	52.6	Low	52.3	Low	176 Å²	176	102.7 Å²	102.7	77%	0.772	52%	0.521	S	S	*	.	H	α-helix	trans	-70.2	-42.8	175.8	-138.2	-90	0	0	0	111.4	E367 E368 R373 G374 Y375	E367-F371 PolarHBondContact O-N 3.25Å; E367-F371 VanDerWaalsContact O-N 3.09Å; E368-F371 PolarHBondContact O-N 3.38Å; F371-R373 VanDerWaalsContact C-N 3.31Å; F371-R373 PolarHBondContact O-N 3.41Å; F371-G374 PolarHBondContact O-N 3.48Å; F371-Y375 WeakPolarHBondContact O-CB 3.49Å; F371-Y375 PolarHBondContact O-N 3.09Å
372	D	57.3	Low	53.7	Low	47 Å²	47	100.7 Å²	100.7	25%	0.251	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-39.9	172.4	-78.2	-21.5	0	0	0	111.8	Q267 E368 Y375 I376	Q267-D372 PolarHBondContact NE2-OD1 3.5Å; E368-D372 PolarHBondContact O-N 3.35Å; D372-Y375 WeakPolarHBondContact O-CB 3.39Å; D372-Y375 PolarHBondContact O-N 3.27Å; D372-I376 WeakPolarHBondContact O-CB 3.43Å; D372-I376 WeakPolarHBondContact O-CD1 3.15Å; D372-I376 WeakPolarHBondContact O-CG1 3.38Å; D372-I376 PolarHBondContact O-N 2.87Å
373	R	58.7	Low	55.2	Low	76 Å²	76	93.6 Å²	93.6	29%	0.287	47%	0.469	S	S	.	.	H	α-helix	trans	-67.7	-43.2	177.8	-178.6	168.8	140.8	137.5	-8.1	113.3	D350 T354 T369 N370 F371 Y375 I376 K377	D350-R373 VanDerWaalsContact CG-NH1 3.31Å; D350-R373 PolarHBondContact O-NH1 3.25Å; D350-R373 WeakPolarHBondContact OD1-CD 3.35Å; D350-R373 WeakPolarHBondContact OD1-CG 3.48Å; D350-R373 IonicContact OD1-CZ 3.2Å; D350-R373 VanDerWaalsContact OD1-CZ 3.3Å; D350-R373 IonicContact OD1-NE 2.65Å; D350-R373 PolarHBondContact OD1-NE 2.95Å; D350-R373 IonicContact OD1-NH1 3.12Å; D350-R373 PolarHBondContact OD1-NH1 3.21Å; D350-R373 IonicContact OD2-NE 2.87Å; T354-R373 VanDerWaalsContact CG2-NH2 3.32Å; T369-R373 WeakPolarHBondContact O-CB 3.44Å; T369-R373 PolarHBondContact O-N 2.88Å; T369-R373 VanDerWaalsContact O-N 3.09Å; N370-R373 PolarHBondContact O-N 3.49Å; F371-R373 VanDerWaalsContact C-N 3.31Å; F371-R373 PolarHBondContact O-N 3.41Å; R373-Y375 VanDerWaalsContact C-N 3.28Å; R373-Y375 PolarHBondContact O-N 3.39Å; R373-I376 PolarHBondContact O-N 3.46Å; R373-K377 PolarHBondContact O-N 3.09Å; R373-K377 VanDerWaalsContact O-N 3.09Å
374	G	57.3	Low	56.6	Low	37 Å²	37	86.8 Å²	86.8	38%	0.381	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-31.7	172.7	0	0	0	0	0	113.2	N370 F371 K378	N370-G374 PolarHBondContact O-N 3.27Å; F371-G374 PolarHBondContact O-N 3.48Å; G374-K378 WeakPolarHBondContact O-CG 3.43Å; G374-K378 PolarHBondContact O-N 3.31Å
375	Y	65.1	Low	58.1	Low	83 Å²	83	81 Å²	81	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-69.4	-46.1	173.5	-179.3	-96	0	0	0	111.8	F371 D372 R373 K377 K378 K379	F371-Y375 WeakPolarHBondContact O-CB 3.49Å; F371-Y375 PolarHBondContact O-N 3.09Å; D372-Y375 WeakPolarHBondContact O-CB 3.39Å; D372-Y375 PolarHBondContact O-N 3.27Å; R373-Y375 VanDerWaalsContact C-N 3.28Å; R373-Y375 PolarHBondContact O-N 3.39Å; Y375-K377 PolarHBondContact O-N 2.73Å; Y375-K378 PolarHBondContact O-N 2.98Å; Y375-K379 HydrophobicContact CD1-CG 4.18Å; Y375-K379 HydrophobicContact CE1-CG 3.85Å; Y375-K379 HydrophobicContact CE2-CG 4.31Å; Y375-K379 VanDerWaalsContact O-CB 3.25Å; Y375-K379 WeakPolarHBondContact O-CB 3.45Å; Y375-K379 WeakPolarHBondContact O-CG 3.18Å; Y375-K379 PolarHBondContact O-N 3.43Å; Y375-K379 WeakPolarHBondContact OH-CE 3.46Å; Y375-K379 PolarHBondContact OH-NZ 3.39Å
376	I	64.4	Low	59.7	Low	31 Å²	31	85.1 Å²	85.1	16%	0.159	41%	0.408	C	S	.	.	H	α-helix	trans	-57.4	-49	176.9	-71.5	162.1	0	0	0	110.7	M270 D372 R373 K379 L380	M270-I376 HydrophobicContact CE-CG2 3.98Å; M270-I376 HydrophobicContact CG-CG1 4.1Å; M270-I376 HydrophobicContact SD-CG2 4.3Å; D372-I376 WeakPolarHBondContact O-CB 3.43Å; D372-I376 WeakPolarHBondContact O-CD1 3.15Å; D372-I376 WeakPolarHBondContact O-CG1 3.38Å; D372-I376 PolarHBondContact O-N 2.87Å; R373-I376 PolarHBondContact O-N 3.46Å; I376-K379 PolarHBondContact O-N 3.49Å; I376-L380 HydrophobicContact CG2-CD1 3.6Å; I376-L380 WeakPolarHBondContact O-CB 3.39Å; I376-L380 WeakPolarHBondContact O-CD1 3.39Å; I376-L380 WeakPolarHBondContact O-CG 3.19Å; I376-L380 PolarHBondContact O-N 3.44Å
377	K	65.5	Low	61.2	Low	119 Å²	119	82 Å²	82	52%	0.517	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-47.2	179.9	-172.7	171.6	-178.6	168.7	0	113.1	R373 Y375 K379 L380 E381	R373-K377 PolarHBondContact O-N 3.09Å; R373-K377 VanDerWaalsContact O-N 3.09Å; Y375-K377 PolarHBondContact O-N 2.73Å; K377-K379 VanDerWaalsContact C-N 3.31Å; K377-K379 PolarHBondContact O-N 2.98Å; K377-L380 PolarHBondContact O-N 3.44Å; K377-E381 WeakPolarHBondContact CE-OE1 3.47Å; K377-E381 WeakPolarHBondContact O-CG 3.35Å; K377-E381 PolarHBondContact O-N 3.25Å
378	K	67.1	Low	62.9	Low	156 Å²	156	74 Å²	74	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-64.7	-35.8	176.7	-76.4	-178.9	178.4	177	0	112.5	G374 Y375 H382	G374-K378 WeakPolarHBondContact O-CG 3.43Å; G374-K378 PolarHBondContact O-N 3.31Å; Y375-K378 PolarHBondContact O-N 2.98Å; K378-H382 WeakPolarHBondContact O-CB 3.17Å; K378-H382 PolarHBondContact O-N 3.35Å
379	K	65.2	Low	64.3	Low	53 Å²	53	71.6 Å²	71.6	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-68.1	-40.1	176.5	-86.8	-77.7	-171.5	135.5	0	111.4	D271 H274 Y375 I376 K377 H382 G383	D271-K379 IonicContact OD1-NZ 3.42Å; D271-K379 PolarHBondContact OD1-NZ 3.4Å; D271-K379 IonicContact OD2-NZ 3.14Å; H274-K379 PolarHBondContact CE1-O 3.29Å; H274-K379 PolarHBondContact NE2-O 3.09Å; Y375-K379 HydrophobicContact CD1-CG 4.18Å; Y375-K379 HydrophobicContact CE1-CG 3.85Å; Y375-K379 HydrophobicContact CE2-CG 4.31Å; Y375-K379 VanDerWaalsContact O-CB 3.25Å; Y375-K379 WeakPolarHBondContact O-CB 3.45Å; Y375-K379 WeakPolarHBondContact O-CG 3.18Å; Y375-K379 PolarHBondContact O-N 3.43Å; Y375-K379 WeakPolarHBondContact OH-CE 3.46Å; Y375-K379 PolarHBondContact OH-NZ 3.39Å; I376-K379 PolarHBondContact O-N 3.49Å; K377-K379 VanDerWaalsContact C-N 3.31Å; K377-K379 PolarHBondContact O-N 2.98Å; K379-H382 CarbonylContact O-C 3.59Å; K379-H382 PolarHBondContact O-N 3.44Å; K379-G383 PolarHBondContact O-N 2.99Å
380	L	66.1	Low	65.4	Low	4 Å²	4	69.4 Å²	69.4	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-41.7	175.3	-76.5	155.4	0	0	0	112.4	M270 Y339 M343 H346 I376 K377 H382 G383 L384	M270-L380 HydrophobicContact CE-CD1 3.92Å; M270-L380 HydrophobicContact CE-CD2 3.78Å; M270-L380 HydrophobicContact CE-CG 3.61Å; Y339-L380 HydrophobicContact CE2-CD2 4.44Å; Y339-L380 WeakPolarHBondContact OH-CA 3.43Å; Y339-L380 PolarHBondContact OH-O 2.88Å; M343-L380 HydrophobicContact CE-CB 4.12Å; M343-L380 HydrophobicContact CG-CD2 4.23Å; M343-L380 HydrophobicContact SD-CB 3.35Å; M343-L380 WeakPolarHBondContact SD-CB 3.06Å; M343-L380 HydrophobicContact SD-CD1 3.66Å; M343-L380 HydrophobicContact SD-CD2 3.65Å; M343-L380 HydrophobicContact SD-CG 3.72Å; H346-L380 HydrophobicContact CB-CD1 4.4Å; I376-L380 HydrophobicContact CG2-CD1 3.6Å; I376-L380 WeakPolarHBondContact O-CB 3.39Å; I376-L380 WeakPolarHBondContact O-CD1 3.39Å; I376-L380 WeakPolarHBondContact O-CG 3.19Å; I376-L380 PolarHBondContact O-N 3.44Å; K377-L380 PolarHBondContact O-N 3.44Å; L380-H382 VanDerWaalsContact C-N 3.3Å; L380-H382 PolarHBondContact O-N 3.15Å; L380-G383 CarbonylContact O-C 3.23Å; L380-G383 WeakPolarHBondContact O-CA 3.37Å; L380-G383 PolarHBondContact O-N 2.87Å; L380-L384 PolarHBondContact O-N 3.2Å
381	E	65.7	Low	66.4	Low	99 Å²	99	65 Å²	65	46%	0.463	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-38.9	172.9	-72.5	171	-175.9	0	0	111.8	K377 G383 T385	K377-E381 WeakPolarHBondContact CE-OE1 3.47Å; K377-E381 WeakPolarHBondContact O-CG 3.35Å; K377-E381 PolarHBondContact O-N 3.25Å; E381-G383 VanDerWaalsContact C-N 3.35Å; E381-T385 PolarHBondContact O-OG1 3.14Å; E381-T385 VanDerWaalsContact O-OG1 3.11Å
382	H	69.7	Low	67.3	Low	109 Å²	109	57.5 Å²	57.5	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-70	-31	172	-172.6	64.6	0	0	0	112.8	K378 K379 L380 T385 R386	K378-H382 WeakPolarHBondContact O-CB 3.17Å; K378-H382 PolarHBondContact O-N 3.35Å; K379-H382 CarbonylContact O-C 3.59Å; K379-H382 PolarHBondContact O-N 3.44Å; L380-H382 VanDerWaalsContact C-N 3.3Å; L380-H382 PolarHBondContact O-N 3.15Å; H382-T385 WeakPolarHBondContact CA-OG1 3.48Å; H382-T385 PolarHBondContact O-N 2.83Å; H382-T385 PolarHBondContact O-OG1 3.17Å; H382-T385 VanDerWaalsContact O-OG1 3.08Å; H382-R386 WeakPolarHBondContact O-CB 3.31Å; H382-R386 PolarHBondContact O-N 3.37Å
383	G	65.5	Low	68.1	Low	1 Å²	1	59.7 Å²	59.7	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-38.6	175.1	0	0	0	0	0	112.3	Y339 K379 L380 E381 T385 R386 I387	Y339-G383 WeakPolarHBondContact OH-CA 3.49Å; K379-G383 PolarHBondContact O-N 2.99Å; L380-G383 CarbonylContact O-C 3.23Å; L380-G383 WeakPolarHBondContact O-CA 3.37Å; L380-G383 PolarHBondContact O-N 2.87Å; E381-G383 VanDerWaalsContact C-N 3.35Å; G383-T385 PolarHBondContact O-N 3.27Å; G383-R386 PolarHBondContact O-N 3.14Å; G383-I387 VanDerWaalsContact O-CB 3.29Å; G383-I387 WeakPolarHBondContact O-CB 3.33Å; G383-I387 VanDerWaalsContact O-CG1 3.26Å; G383-I387 WeakPolarHBondContact O-CG1 3.48Å; G383-I387 PolarHBondContact O-N 3.16Å
384	L	67.9	Low	68.7	Low	32 Å²	32	57.5 Å²	57.5	17%	0.168	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-49.2	172.1	-70.8	172.3	0	0	0	111.7	Y339 M343 L380 W388 F429	Y339-L384 HydrophobicContact CD1-CD2 3.55Å; Y339-L384 HydrophobicContact CD1-CG 4.41Å; Y339-L384 HydrophobicContact CE1-CD2 3.39Å; Y339-L384 HydrophobicContact CE1-CG 3.75Å; M343-L384 HydrophobicContact CE-CD1 4.45Å; L380-L384 PolarHBondContact O-N 3.2Å; L384-W388 WeakPolarHBondContact O-CB 3.14Å; L384-W388 PolarHBondContact O-N 2.82Å; L384-F429 HydrophobicContact CB-CE1 4.34Å; L384-F429 HydrophobicContact CD2-CD1 4.04Å; L384-F429 HydrophobicContact CD2-CD2 4.29Å; L384-F429 HydrophobicContact CD2-CE1 3.45Å; L384-F429 VanDerWaalsContact CD2-CE1 3.45Å; L384-F429 HydrophobicContact CD2-CE2 3.74Å; L384-F429 HydrophobicContact CD2-CG 4.45Å; L384-F429 HydrophobicContact CD2-CZ 3.3Å
385	T	70.3	Confident	69.4	Low	51 Å²	51	55.7 Å²	55.7	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-65.7	-41.3	179.6	16.4	0	0	0	0	111.7	E381 H382 G383 Q389 C430	E381-T385 PolarHBondContact O-OG1 3.14Å; E381-T385 VanDerWaalsContact O-OG1 3.11Å; H382-T385 WeakPolarHBondContact CA-OG1 3.48Å; H382-T385 PolarHBondContact O-N 2.83Å; H382-T385 PolarHBondContact O-OG1 3.17Å; H382-T385 VanDerWaalsContact O-OG1 3.08Å; G383-T385 PolarHBondContact O-N 3.27Å; T385-Q389 WeakPolarHBondContact O-CB 3.33Å; T385-Q389 VanDerWaalsContact O-CG 3.23Å; T385-Q389 WeakPolarHBondContact O-CG 3.18Å; T385-Q389 PolarHBondContact O-N 2.83Å; T385-C430 WeakPolarHBondContact CG2-SG 3.38Å
386	R	71.8	Confident	69.8	Low	139 Å²	139	54.6 Å²	54.6	53%	0.525	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-43.3	179.7	-174.5	175.2	177.5	136	-1.6	112.9	H382 G383 Q389 D390	H382-R386 WeakPolarHBondContact O-CB 3.31Å; H382-R386 PolarHBondContact O-N 3.37Å; G383-R386 PolarHBondContact O-N 3.14Å; R386-Q389 PolarHBondContact O-N 3.45Å; R386-D390 PolarHBondContact O-N 3.31Å
387	I	73.1	Confident	70.2	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-48.1	175.2	-75.3	166.9	0	0	0	109.5	F277 I281 Y339 G383 Q389 D390 V391 F429	F277-I387 HydrophobicContact CB-CD1 4.13Å; F277-I387 HydrophobicContact CG-CD1 4.44Å; I281-I387 HydrophobicContact CD1-CB 4.23Å; I281-I387 HydrophobicContact CD1-CG1 4.12Å; I281-I387 HydrophobicContact CD1-CG2 3.65Å; Y339-I387 HydrophobicContact CD1-CD1 4.01Å; Y339-I387 HydrophobicContact CD2-CD1 3.3Å; Y339-I387 HydrophobicContact CE1-CD1 4.05Å; Y339-I387 HydrophobicContact CE2-CD1 3.36Å; Y339-I387 HydrophobicContact CG-CD1 3.62Å; G383-I387 VanDerWaalsContact O-CB 3.29Å; G383-I387 WeakPolarHBondContact O-CB 3.33Å; G383-I387 VanDerWaalsContact O-CG1 3.26Å; G383-I387 WeakPolarHBondContact O-CG1 3.48Å; G383-I387 PolarHBondContact O-N 3.16Å; I387-Q389 VanDerWaalsContact C-N 3.34Å; I387-Q389 PolarHBondContact O-N 2.91Å; I387-D390 PolarHBondContact O-N 3.49Å; I387-V391 HydrophobicContact CG2-CG2 4.46Å; I387-V391 WeakPolarHBondContact O-CG2 3.3Å; I387-V391 PolarHBondContact O-N 2.86Å; I387-F429 HydrophobicContact CG2-CE1 4.26Å
388	W	76.3	Confident	70.3	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-39.7	178.6	-174.2	-123.1	0	0	0	112.8	M336 L384 D390 V391 Q392 L422 G426 C430 S434	M336-W388 HydrophobicContact CE-CE3 3.67Å; M336-W388 HydrophobicContact CE-CZ3 3.84Å; M336-W388 HydrophobicContact SD-CE3 4.15Å; M336-W388 HydrophobicContact SD-CZ3 4.04Å; L384-W388 WeakPolarHBondContact O-CB 3.14Å; L384-W388 PolarHBondContact O-N 2.82Å; W388-D390 PolarHBondContact O-N 3.46Å; W388-V391 HydrophobicContact CE3-CB 4.26Å; W388-V391 HydrophobicContact CE3-CG1 4.18Å; W388-V391 HydrophobicContact CZ3-CB 4.48Å; W388-V391 HydrophobicContact CZ3-CG1 3.9Å; W388-V391 PolarHBondContact O-N 3.48Å; W388-Q392 HydrophobicContact CD2-CG 4.25Å; W388-Q392 HydrophobicContact CZ2-CG 3.93Å; W388-Q392 WeakPolarHBondContact O-CB 3.03Å; W388-Q392 VanDerWaalsContact O-CG 3.27Å; W388-Q392 WeakPolarHBondContact O-CG 3.46Å; W388-Q392 PolarHBondContact O-N 3.27Å; W388-L422 HydrophobicContact CH2-CD1 4.46Å; W388-L422 HydrophobicContact CH2-CG 4.21Å; W388-L422 WeakPolarHBondContact CH2-O 3.27Å; W388-L422 HydrophobicContact CZ3-CD1 4.49Å; W388-G426 VanDerWaalsContact CE2-CA 3.48Å; W388-C430 HydrophobicContact CB-CB 4.27Å; W388-C430 HydrophobicContact CG-CB 4.17Å; W388-S434 WeakPolarHBondContact CZ2-OG 3.44Å; W388-S434 PolarHBondContact NE1-OG 3.4Å; W388-S434 VanDerWaalsContact NE1-OG 3.16Å
389	Q	72.9	Confident	70.3	Confident	109 Å²	109	42 Å²	42	51%	0.509	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-40.8	174.2	-77.1	173	3.9	0	0	112.8	T385 R386 I387 Q392 L393	T385-Q389 WeakPolarHBondContact O-CB 3.33Å; T385-Q389 VanDerWaalsContact O-CG 3.23Å; T385-Q389 WeakPolarHBondContact O-CG 3.18Å; T385-Q389 PolarHBondContact O-N 2.83Å; R386-Q389 PolarHBondContact O-N 3.45Å; I387-Q389 VanDerWaalsContact C-N 3.34Å; I387-Q389 PolarHBondContact O-N 2.91Å; Q389-Q392 PolarHBondContact O-N 2.94Å; Q389-L393 WeakPolarHBondContact O-CB 3.21Å; Q389-L393 VanDerWaalsContact O-CG 3.31Å; Q389-L393 WeakPolarHBondContact O-CG 3.1Å; Q389-L393 PolarHBondContact O-N 3.46Å
390	D	70.7	Confident	70.4	Confident	36 Å²	36	43.6 Å²	43.6	19%	0.193	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-42.3	177.6	-162.5	42.5	0	0	0	111.2	R386 I387 W388 Q392 L393 K394	R386-D390 PolarHBondContact O-N 3.31Å; I387-D390 PolarHBondContact O-N 3.49Å; W388-D390 PolarHBondContact O-N 3.46Å; D390-Q392 PolarHBondContact O-N 3.09Å; D390-L393 PolarHBondContact O-N 3.36Å; D390-K394 VanDerWaalsContact O-CG 3.27Å; D390-K394 WeakPolarHBondContact O-CG 3.37Å; D390-K394 PolarHBondContact O-N 2.93Å
391	V	72.4	Confident	70.1	Confident	1 Å²	1	44 Å²	44	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-48.6	172.2	172.9	0	0	0	0	111.2	I281 L332 I387 W388 L393 K394 V395	I281-V391 HydrophobicContact CD1-CG2 4.33Å; I281-V391 HydrophobicContact CG2-CG2 4.19Å; L332-V391 HydrophobicContact CD1-CG1 4.02Å; L332-V391 HydrophobicContact CD2-CG1 4.35Å; L332-V391 HydrophobicContact CD2-CG2 3.91Å; I387-V391 HydrophobicContact CG2-CG2 4.46Å; I387-V391 WeakPolarHBondContact O-CG2 3.3Å; I387-V391 PolarHBondContact O-N 2.86Å; W388-V391 HydrophobicContact CE3-CB 4.26Å; W388-V391 HydrophobicContact CE3-CG1 4.18Å; W388-V391 HydrophobicContact CZ3-CB 4.48Å; W388-V391 HydrophobicContact CZ3-CG1 3.9Å; W388-V391 PolarHBondContact O-N 3.48Å; V391-L393 PolarHBondContact O-N 2.97Å; V391-K394 PolarHBondContact O-N 3.43Å; V391-V395 HydrophobicContact CG1-CG2 4.38Å; V391-V395 WeakPolarHBondContact O-CG2 3.33Å; V391-V395 PolarHBondContact O-N 3.03Å
392	Q	71	Confident	69.9	Low	18 Å²	18	40 Å²	40	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-44	177	-77.8	-179.9	-17.3	0	0	112.4	W388 Q389 D390 K396 S434	W388-Q392 HydrophobicContact CD2-CG 4.25Å; W388-Q392 HydrophobicContact CZ2-CG 3.93Å; W388-Q392 WeakPolarHBondContact O-CB 3.03Å; W388-Q392 VanDerWaalsContact O-CG 3.27Å; W388-Q392 WeakPolarHBondContact O-CG 3.46Å; W388-Q392 PolarHBondContact O-N 3.27Å; Q389-Q392 PolarHBondContact O-N 2.94Å; D390-Q392 PolarHBondContact O-N 3.09Å; Q392-K396 WeakPolarHBondContact O-CB 3.38Å; Q392-K396 PolarHBondContact O-N 3.43Å; Q392-S434 PolarHBondContact NE2-OG 2.82Å
393	L	74.6	Confident	69.4	Low	94 Å²	94	39.9 Å²	39.9	49%	0.492	20%	0.2	S	C	.	.	H	α-helix	trans	-66.2	-37.9	179.6	-76.4	169.2	0	0	0	112	Q389 D390 V391 T397	Q389-L393 WeakPolarHBondContact O-CB 3.21Å; Q389-L393 VanDerWaalsContact O-CG 3.31Å; Q389-L393 WeakPolarHBondContact O-CG 3.1Å; Q389-L393 PolarHBondContact O-N 3.46Å; D390-L393 PolarHBondContact O-N 3.36Å; V391-L393 PolarHBondContact O-N 2.97Å; L393-T397 WeakPolarHBondContact O-CB 3.27Å; L393-T397 PolarHBondContact O-N 3.39Å; L393-T397 PolarHBondContact O-OG1 3.32Å
394	K	70.9	Confident	69.3	Low	29 Å²	29	40.1 Å²	40.1	13%	0.126	20%	0.202	C	C	.	.	H	α-helix	trans	-70.8	-45	177.8	-68.5	-65.2	178.6	-178.2	0	112.5	H282 V285 Y309 D390 V391 T397 Y398	H282-K394 PolarHBondContact CE1-NZ 3.08Å; H282-K394 PolarHBondContact ND1-NZ 3.41Å; V285-K394 HydrophobicContact CG1-CB 4.24Å; V285-K394 HydrophobicContact CG1-CD 4.31Å; V285-K394 HydrophobicContact CG1-CG 4.42Å; Y309-K394 HydrophobicContact CD1-CD 4.04Å; Y309-K394 HydrophobicContact CE1-CB 4.35Å; Y309-K394 HydrophobicContact CE1-CD 3.91Å; Y309-K394 WeakPolarHBondContact CE1-O 3.16Å; Y309-K394 PolarHBondContact OH-O 3.04Å; D390-K394 VanDerWaalsContact O-CG 3.27Å; D390-K394 WeakPolarHBondContact O-CG 3.37Å; D390-K394 PolarHBondContact O-N 2.93Å; V391-K394 PolarHBondContact O-N 3.43Å; K394-T397 PolarHBondContact O-N 3.41Å; K394-Y398 WeakPolarHBondContact O-CB 3.44Å; K394-Y398 PolarHBondContact O-N 3.37Å
395	V	71.5	Confident	68.8	Low	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-39.3	175.8	177.9	0	0	0	0	110.6	L332 V391 T397 Y398 L399 L422 L437	L332-V395 HydrophobicContact CD1-CG2 3.86Å; V391-V395 HydrophobicContact CG1-CG2 4.38Å; V391-V395 WeakPolarHBondContact O-CG2 3.33Å; V391-V395 PolarHBondContact O-N 3.03Å; V395-T397 VanDerWaalsContact C-N 3.33Å; V395-T397 PolarHBondContact O-N 3.49Å; V395-Y398 WeakPolarHBondContact O-CB 3.47Å; V395-Y398 PolarHBondContact O-N 2.84Å; V395-L399 HydrophobicContact CG1-CD1 3.92Å; V395-L399 HydrophobicContact CG1-CG 4.31Å; V395-L399 WeakPolarHBondContact O-CB 3.23Å; V395-L399 VanDerWaalsContact O-CG 3.27Å; V395-L399 WeakPolarHBondContact O-CG 3.32Å; V395-L399 PolarHBondContact O-N 2.87Å; V395-L422 HydrophobicContact CB-CD2 4.39Å; V395-L422 HydrophobicContact CG1-CD2 3.97Å; V395-L422 HydrophobicContact CG2-CD2 3.91Å; V395-L437 HydrophobicContact CB-CD1 4.07Å; V395-L437 HydrophobicContact CG1-CD1 3.85Å
396	K	73.6	Confident	68.4	Low	60 Å²	60	44.1 Å²	44.1	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-58.1	-43.8	171.5	170.1	171.7	178.4	177.5	0	112.3	Q392 Y398 L400 V436 S440	Q392-K396 WeakPolarHBondContact O-CB 3.38Å; Q392-K396 PolarHBondContact O-N 3.43Å; K396-Y398 VanDerWaalsContact C-N 3.34Å; K396-L400 HydrophobicContact CD-CD1 4.31Å; K396-L400 HydrophobicContact CG-CD1 3.65Å; K396-L400 HydrophobicContact CG-CG 4.34Å; K396-L400 VanDerWaalsContact O-CB 3.3Å; K396-L400 WeakPolarHBondContact O-CB 3.22Å; K396-L400 VanDerWaalsContact O-CG 3.29Å; K396-L400 WeakPolarHBondContact O-CG 3.47Å; K396-L400 PolarHBondContact O-N 3.26Å; K396-V436 HydrophobicContact CD-CG1 3.6Å; K396-S440 WeakPolarHBondContact CD-OG 3.35Å; K396-S440 WeakPolarHBondContact CE-OG 3.48Å; K396-S440 WeakPolarHBondContact CG-OG 3.47Å
397	T	72.1	Confident	68.1	Low	42 Å²	42	38.2 Å²	38.2	26%	0.258	20%	0.201	S	C	.	.	H	α-helix	trans	-69.1	-36	-179.9	-56.1	0	0	0	0	111.3	Y309 K310 L393 K394 V395 G401	Y309-T397 HydrophobicContact CD1-CG2 3.88Å; Y309-T397 HydrophobicContact CE1-CG2 4.11Å; K310-T397 HydrophobicContact CB-CG2 4.01Å; K310-T397 HydrophobicContact CG-CG2 4.02Å; L393-T397 WeakPolarHBondContact O-CB 3.27Å; L393-T397 PolarHBondContact O-N 3.39Å; L393-T397 PolarHBondContact O-OG1 3.32Å; K394-T397 PolarHBondContact O-N 3.41Å; V395-T397 VanDerWaalsContact C-N 3.33Å; V395-T397 PolarHBondContact O-N 3.49Å; T397-G401 PolarHBondContact O-N 2.87Å
398	Y	69.2	Low	67.9	Low	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-48.1	174.2	-173.8	-99.9	0	0	0	112	V289 C313 V316 Y321 C324 L325 L328 K394 V395 K396 G401 T402	V289-Y398 HydrophobicContact CG2-CD2 4.07Å; V289-Y398 HydrophobicContact CG2-CE2 3.96Å; C313-Y398 HydrophobicContact CB-CD2 4.31Å; C313-Y398 VanDerWaalsContact SG-CD2 3.56Å; V316-Y398 HydrophobicContact CG2-CE2 4.37Å; Y321-Y398 AromaticContact CD2-CE1 3.85Å; Y321-Y398 HydrophobicContact CD2-CE1 3.85Å; Y321-Y398 AromaticContact CD2-CZ 3.75Å; Y321-Y398 VanDerWaalsContact CD2-OH 3.31Å; Y321-Y398 WeakPolarHBondContact CD2-OH 3.29Å; Y321-Y398 HydrophobicContact CE1-CE1 4.42Å; Y321-Y398 AromaticContact CE2-CD1 3.9Å; Y321-Y398 HydrophobicContact CE2-CD1 3.9Å; Y321-Y398 AromaticContact CE2-CE1 3.16Å; Y321-Y398 HydrophobicContact CE2-CE1 3.16Å; Y321-Y398 HydrophobicContact CE2-CE2 4.43Å; Y321-Y398 AromaticContact CE2-CZ 3.48Å; Y321-Y398 VanDerWaalsContact CE2-CZ 3.48Å; Y321-Y398 AromaticContact CZ-CE1 3.51Å; Y321-Y398 PolarHBondContact O-OH 3.16Å; C324-Y398 WeakPolarHBondContact CB-OH 3.48Å; C324-Y398 PolarHBondContact SG-OH 2.79Å; L325-Y398 HydrophobicContact CB-CE1 4.09Å; L325-Y398 HydrophobicContact CD1-CD1 3.94Å; L325-Y398 HydrophobicContact CD1-CE1 3.88Å; L328-Y398 HydrophobicContact CD2-CD1 4.44Å; L328-Y398 HydrophobicContact CD2-CG 4.28Å; K394-Y398 WeakPolarHBondContact O-CB 3.44Å; K394-Y398 PolarHBondContact O-N 3.37Å; V395-Y398 WeakPolarHBondContact O-CB 3.47Å; V395-Y398 PolarHBondContact O-N 2.84Å; K396-Y398 VanDerWaalsContact C-N 3.34Å; Y398-G401 PolarHBondContact O-N 2.96Å; Y398-T402 PolarHBondContact O-OG1 3.49Å
399	L	66.1	Low	67.5	Low	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-60.2	174.5	-75.5	170.6	0	0	0	110	V395 G401 T402 I419 Q444	V395-L399 HydrophobicContact CG1-CD1 3.92Å; V395-L399 HydrophobicContact CG1-CG 4.31Å; V395-L399 WeakPolarHBondContact O-CB 3.23Å; V395-L399 VanDerWaalsContact O-CG 3.27Å; V395-L399 WeakPolarHBondContact O-CG 3.32Å; V395-L399 PolarHBondContact O-N 2.87Å; L399-G401 PolarHBondContact O-N 3.42Å; L399-T402 PolarHBondContact O-N 3.14Å; L399-I419 HydrophobicContact CD1-CD1 4.07Å; L399-I419 HydrophobicContact CD2-CD1 3.41Å; L399-I419 VanDerWaalsContact CD2-CD1 3.41Å; L399-I419 HydrophobicContact CD2-CG1 4.33Å; L399-I419 HydrophobicContact CG-CD1 4.36Å; L399-Q444 PolarHBondContact O-NE2 3.14Å
400	L	67.3	Low	67.2	Low	85 Å²	85	46.7 Å²	46.7	45%	0.445	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-19.5	-179.4	-71.7	170.6	0	0	0	114.3	K396 T402	K396-L400 HydrophobicContact CD-CD1 4.31Å; K396-L400 HydrophobicContact CG-CD1 3.65Å; K396-L400 HydrophobicContact CG-CG 4.34Å; K396-L400 VanDerWaalsContact O-CB 3.3Å; K396-L400 WeakPolarHBondContact O-CB 3.22Å; K396-L400 VanDerWaalsContact O-CG 3.29Å; K396-L400 WeakPolarHBondContact O-CG 3.47Å; K396-L400 PolarHBondContact O-N 3.26Å; L400-T402 VanDerWaalsContact C-N 3.31Å
401	G	59.8	Low	67.2	Low	13 Å²	13	47.7 Å²	47.7	13%	0.134	25%	0.247	C	C	.	.	H	α-helix	trans	-75.5	-17	175.8	0	0	0	0	0	113.8	T314 T397 Y398 L399	T314-G401 WeakPolarHBondContact CG2-O 3.17Å; T397-G401 PolarHBondContact O-N 2.87Å; Y398-G401 PolarHBondContact O-N 2.96Å; L399-G401 PolarHBondContact O-N 3.42Å
402	T	61.9	Low	67.2	Low	15 Å²	15	47.7 Å²	47.7	9%	0.092	25%	0.247	C	C	.	.	S	Bend	trans	-120.9	129.5	-175.2	-45.9	0	0	0	0	111.4	Y321 Y398 L399 L400 L404 F407 Q444	Y321-T402 HydrophobicContact CD2-CG2 3.88Å; Y321-T402 HydrophobicContact CE2-CG2 3.78Å; Y321-T402 WeakPolarHBondContact CE2-OG1 3.42Å; Y398-T402 PolarHBondContact O-OG1 3.49Å; L399-T402 PolarHBondContact O-N 3.14Å; L400-T402 VanDerWaalsContact C-N 3.31Å; T402-L404 PolarHBondContact O-N 3.38Å; T402-F407 HydrophobicContact CG2-CE2 4.12Å; T402-F407 HydrophobicContact CG2-CZ 4.49Å; T402-Q444 PolarHBondContact O-NE2 3.02Å
403	D	58.8	Low	67.4	Low	106 Å²	106	48.6 Å²	48.6	57%	0.567	25%	0.252	S	S	*	.			trans	-76.4	94.6	171	-82.7	-30.5	0	0	0	109.7	S405	D403-S405 PolarHBondContact O-N 3.03Å
404	L	62.8	Low	67.2	Low	7 Å²	7	47.5 Å²	47.5	4%	0.037	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-57.7	-14.6	176.4	-68.6	170.7	0	0	0	113.2	Y321 T402 I406 F407 F412 V415 Q444 Y448	Y321-L404 HydrophobicContact CE1-CD2 3.7Å; T402-L404 PolarHBondContact O-N 3.38Å; L404-I406 PolarHBondContact O-N 3.11Å; L404-I406 VanDerWaalsContact O-N 3.09Å; L404-F407 HydrophobicContact CD2-CD2 4.16Å; L404-F407 HydrophobicContact CD2-CE2 4.08Å; L404-F407 WeakPolarHBondContact O-CD2 3.2Å; L404-F407 PolarHBondContact O-N 3.38Å; L404-F412 HydrophobicContact CB-CD2 4.13Å; L404-F412 HydrophobicContact CB-CE2 4.07Å; L404-F412 HydrophobicContact CD1-CD2 4.5Å; L404-F412 HydrophobicContact CD1-CE2 4.01Å; L404-V415 HydrophobicContact CD2-CG1 4.1Å; L404-Q444 HydrophobicContact CD1-CB 4.03Å; L404-Q444 VanDerWaalsContact CD1-OE1 3.28Å; L404-Y448 HydrophobicContact CB-CD2 4.49Å; L404-Y448 WeakPolarHBondContact O-CD2 3.39Å; L404-Y448 WeakPolarHBondContact O-CE2 3.44Å
405	S	58	Low	67.2	Low	37 Å²	37	46.1 Å²	46.1	26%	0.259	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-61.7	-15.2	-176.5	68.6	0	0	0	0	116.3	D403 N451	D403-S405 PolarHBondContact O-N 3.03Å; S405-N451 VanDerWaalsContact CB-ND2 3.28Å; S405-N451 WeakPolarHBondContact CB-ND2 3.46Å; S405-N451 PolarHBondContact OG-ND2 3.49Å
406	I	62.1	Low	67.2	Low	130 Å²	130	46.6 Å²	46.6	67%	0.667	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-90.4	-16.5	-178.4	-56.1	170.1	0	0	0	111.5	L404	L404-I406 PolarHBondContact O-N 3.11Å; L404-I406 VanDerWaalsContact O-N 3.09Å
407	F	64.3	Low	67	Low	15 Å²	15	48 Å²	48	7%	0.066	25%	0.249	C	C	.	.	S	Bend	trans	-74.7	148.4	-174.5	-70.2	-94.6	0	0	0	112.9	P318 Y321 T402 L404 D411 Y448	P318-F407 HydrophobicContact CB-CE1 3.95Å; P318-F407 HydrophobicContact CB-CE2 4.5Å; P318-F407 HydrophobicContact CB-CZ 3.94Å; P318-F407 WeakPolarHBondContact O-CE1 3.33Å; Y321-F407 AromaticContact CD1-CE1 3.9Å; Y321-F407 HydrophobicContact CD1-CE1 3.9Å; Y321-F407 HydrophobicContact CD1-CE2 4.25Å; Y321-F407 AromaticContact CD1-CZ 3.49Å; Y321-F407 HydrophobicContact CD1-CZ 3.49Å; Y321-F407 VanDerWaalsContact CD1-CZ 3.49Å; Y321-F407 HydrophobicContact CD2-CZ 4.48Å; Y321-F407 HydrophobicContact CE1-CZ 4.3Å; Y321-F407 HydrophobicContact CG-CE1 4.21Å; Y321-F407 AromaticContact CG-CZ 3.6Å; Y321-F407 HydrophobicContact CG-CZ 3.6Å; T402-F407 HydrophobicContact CG2-CE2 4.12Å; T402-F407 HydrophobicContact CG2-CZ 4.49Å; L404-F407 HydrophobicContact CD2-CD2 4.16Å; L404-F407 HydrophobicContact CD2-CE2 4.08Å; L404-F407 WeakPolarHBondContact O-CD2 3.2Å; L404-F407 PolarHBondContact O-N 3.38Å; F407-D411 HydrophobicContact CB-CB 4.24Å; F407-D411 HydrophobicContact CD1-CB 4.2Å; F407-Y448 WeakPolarHBondContact O-CE2 3.37Å; F407-Y448 PolarHBondContact O-OH 3.39Å
408	K	69.7	Low	66.9	Low	157 Å²	157	46.4 Å²	46.4	68%	0.683	24%	0.24	S	C	*	.			trans	-65.3	163.1	171.8	-63.3	176.2	-178.9	170	0	110.5	D410 D411 F412 Y448	K408-D410 PolarHBondContact O-N 2.76Å; K408-D411 HydrophobicContact CB-CB 4.37Å; K408-D411 WeakPolarHBondContact CB-OD2 3.33Å; K408-D411 PolarHBondContact O-N 3.03Å; K408-F412 WeakPolarHBondContact O-CB 3.45Å; K408-F412 PolarHBondContact O-N 3.08Å; K408-Y448 PolarHBondContact O-OH 3.48Å
409	Y	67.5	Low	67	Low	20 Å²	20	46.5 Å²	46.5	8%	0.078	24%	0.24	C	C	.	.	H	α-helix	trans	-55	-50.4	-178.2	176.7	-96.4	0	0	0	112.5	F412 I413 K620 Q623 M624	Y409-F412 PolarHBondContact O-N 3.08Å; Y409-I413 HydrophobicContact CD1-CD1 3.97Å; Y409-I413 HydrophobicContact CE1-CD1 3.31Å; Y409-I413 HydrophobicContact CE1-CG1 4.49Å; Y409-I413 HydrophobicContact CE2-CD1 3.92Å; Y409-I413 PolarHBondContact O-N 3.48Å; Y409-I413 WeakPolarHBondContact OH-CD1 3.44Å; Y409-K620 HydrophobicContact CE2-CB 3.87Å; Y409-K620 HydrophobicContact CE2-CG 4.49Å; Y409-K620 PolarHBondContact OH-O 3.35Å; Y409-K620 VanDerWaalsContact OH-O 3.1Å; Y409-Q623 WeakPolarHBondContact OH-CB 3.26Å; Y409-Q623 PolarHBondContact OH-OE1 2.99Å; Y409-M624 HydrophobicContact CD2-CE 3.14Å; Y409-M624 HydrophobicContact CE2-CE 3.16Å; Y409-M624 HydrophobicContact CE2-CG 3.73Å; Y409-M624 HydrophobicContact CE2-SD 4.19Å; Y409-M624 HydrophobicContact CG-CE 4.42Å
410	D	68.1	Low	67.2	Low	115 Å²	115	48.4 Å²	48.4	62%	0.615	25%	0.253	S	S	*	.	H	α-helix	trans	-67	-41.5	-176.6	-54	-53.3	0	0	0	111.4	K408 F412 I413 F414	K408-D410 PolarHBondContact O-N 2.76Å; D410-F412 PolarHBondContact O-N 2.82Å; D410-I413 PolarHBondContact O-N 3.01Å; D410-F414 WeakPolarHBondContact O-CB 3.29Å; D410-F414 PolarHBondContact O-N 3.14Å
411	D	70.6	Confident	67.2	Low	58 Å²	58	47.2 Å²	47.2	31%	0.31	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-43.8	176	-67.8	-19.4	0	0	0	111.9	I322 F407 K408 F414 V415	I322-D411 HydrophobicContact CD1-CB 3.7Å; F407-D411 HydrophobicContact CB-CB 4.24Å; F407-D411 HydrophobicContact CD1-CB 4.2Å; K408-D411 HydrophobicContact CB-CB 4.37Å; K408-D411 WeakPolarHBondContact CB-OD2 3.33Å; K408-D411 PolarHBondContact O-N 3.03Å; D411-F414 PolarHBondContact O-N 3.08Å; D411-V415 WeakPolarHBondContact O-CG2 3.41Å; D411-V415 PolarHBondContact O-N 2.95Å
412	F	72.3	Confident	67.7	Low	1 Å²	1	46.8 Å²	46.8	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-40.5	177.9	178.6	-105.7	0	0	0	112.4	L404 K408 Y409 D410 F414 V415 L416 Y448 L628	L404-F412 HydrophobicContact CB-CD2 4.13Å; L404-F412 HydrophobicContact CB-CE2 4.07Å; L404-F412 HydrophobicContact CD1-CD2 4.5Å; L404-F412 HydrophobicContact CD1-CE2 4.01Å; K408-F412 WeakPolarHBondContact O-CB 3.45Å; K408-F412 PolarHBondContact O-N 3.08Å; Y409-F412 PolarHBondContact O-N 3.08Å; D410-F412 PolarHBondContact O-N 2.82Å; F412-F414 VanDerWaalsContact C-N 3.31Å; F412-F414 PolarHBondContact O-N 3.26Å; F412-V415 PolarHBondContact O-N 2.81Å; F412-L416 HydrophobicContact CD1-CD1 3.88Å; F412-L416 HydrophobicContact CE1-CD1 3.35Å; F412-L416 HydrophobicContact CE1-CG 4.13Å; F412-L416 HydrophobicContact CE2-CD1 4.49Å; F412-L416 HydrophobicContact CE2-CG 4.45Å; F412-L416 HydrophobicContact CZ-CD1 3.69Å; F412-L416 HydrophobicContact CZ-CD2 4.28Å; F412-L416 HydrophobicContact CZ-CG 4.07Å; F412-L416 WeakPolarHBondContact O-CG 3.17Å; F412-L416 PolarHBondContact O-N 2.85Å; F412-Y448 HydrophobicContact CB-CE1 4.12Å; F412-Y448 HydrophobicContact CB-CE2 3.96Å; F412-Y448 AromaticContact CD1-CD1 3.54Å; F412-Y448 HydrophobicContact CD1-CD1 3.54Å; F412-Y448 HydrophobicContact CD1-CD2 4.5Å; F412-Y448 AromaticContact CD1-CE1 3.44Å; F412-Y448 HydrophobicContact CD1-CE1 3.44Å; F412-Y448 VanDerWaalsContact CD1-CE1 3.44Å; F412-Y448 HydrophobicContact CD1-CE2 4.45Å; F412-Y448 HydrophobicContact CD1-CG 4.11Å; F412-Y448 AromaticContact CD1-CZ 3.94Å; F412-Y448 HydrophobicContact CD2-CD1 4.13Å; F412-Y448 AromaticContact CD2-CD2 3.72Å; F412-Y448 HydrophobicContact CD2-CD2 3.72Å; F412-Y448 HydrophobicContact CD2-CE1 4.32Å; F412-Y448 AromaticContact CD2-CE2 3.96Å; F412-Y448 HydrophobicContact CD2-CE2 3.96Å; F412-Y448 AromaticContact CD2-CG 3.83Å; F412-Y448 HydrophobicContact CD2-CG 3.83Å; F412-Y448 AromaticContact CE1-CD1 3.46Å; F412-Y448 HydrophobicContact CE1-CD1 3.46Å; F412-Y448 VanDerWaalsContact CE1-CD1 3.46Å; F412-Y448 AromaticContact CE1-CE1 3.87Å; F412-Y448 HydrophobicContact CE1-CE1 3.87Å; F412-Y448 AromaticContact CE1-CG 3.95Å; F412-Y448 HydrophobicContact CE1-CG 3.95Å; F412-Y448 HydrophobicContact CE2-CD1 4.08Å; F412-Y448 AromaticContact CE2-CD2 3.97Å; F412-Y448 HydrophobicContact CE2-CD2 3.97Å; F412-Y448 AromaticContact CE2-CG 3.68Å; F412-Y448 HydrophobicContact CE2-CG 3.68Å; F412-Y448 AromaticContact CG-CD1 3.89Å; F412-Y448 HydrophobicContact CG-CD1 3.89Å; F412-Y448 HydrophobicContact CG-CD2 4.01Å; F412-Y448 AromaticContact CG-CE1 3.7Å; F412-Y448 HydrophobicContact CG-CE1 3.7Å; F412-Y448 AromaticContact CG-CE2 3.87Å; F412-Y448 HydrophobicContact CG-CE2 3.87Å; F412-Y448 HydrophobicContact CG-CG 4.04Å; F412-Y448 AromaticContact CG-CZ 3.7Å; F412-Y448 AromaticContact CZ-CD1 3.76Å; F412-Y448 HydrophobicContact CZ-CD1 3.76Å; F412-Y448 HydrophobicContact CZ-CD2 4.46Å; F412-Y448 HydrophobicContact CZ-CE1 4.49Å; F412-Y448 AromaticContact CZ-CG 3.75Å; F412-Y448 HydrophobicContact CZ-CG 3.75Å; F412-L628 HydrophobicContact CE1-CD1 4.43Å
413	I	73.9	Confident	67.9	Low	37 Å²	37	47.8 Å²	47.8	19%	0.19	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-42.1	174.3	-74.3	179.7	0	0	0	110.8	Y409 D410 V415 L416 D417 I627	Y409-I413 HydrophobicContact CD1-CD1 3.97Å; Y409-I413 HydrophobicContact CE1-CD1 3.31Å; Y409-I413 HydrophobicContact CE1-CG1 4.49Å; Y409-I413 HydrophobicContact CE2-CD1 3.92Å; Y409-I413 PolarHBondContact O-N 3.48Å; Y409-I413 WeakPolarHBondContact OH-CD1 3.44Å; D410-I413 PolarHBondContact O-N 3.01Å; I413-V415 PolarHBondContact O-N 3.38Å; I413-L416 WeakPolarHBondContact O-CB 3.4Å; I413-L416 PolarHBondContact O-N 2.99Å; I413-L416 VanDerWaalsContact O-N 3.14Å; I413-D417 PolarHBondContact O-N 3.26Å; I413-I627 HydrophobicContact CD1-CD1 4.03Å; I413-I627 HydrophobicContact CG1-CD1 4.15Å; I413-I627 HydrophobicContact CG2-CD1 3.87Å
414	F	70.3	Confident	68.2	Low	71 Å²	71	47.4 Å²	47.4	31%	0.311	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-41.8	178.5	-172.5	-103.4	0	0	0	112.1	I322 D410 D411 F412 L416 D417 I418 I526	I322-F414 HydrophobicContact CG2-CD1 3.3Å; I322-F414 HydrophobicContact CG2-CE1 3.28Å; D410-F414 WeakPolarHBondContact O-CB 3.29Å; D410-F414 PolarHBondContact O-N 3.14Å; D411-F414 PolarHBondContact O-N 3.08Å; F412-F414 VanDerWaalsContact C-N 3.31Å; F412-F414 PolarHBondContact O-N 3.26Å; F414-L416 VanDerWaalsContact C-N 3.31Å; F414-L416 PolarHBondContact O-N 3.16Å; F414-D417 PolarHBondContact O-N 2.86Å; F414-I418 HydrophobicContact CD1-CD1 3.65Å; F414-I418 HydrophobicContact CD1-CG1 4.46Å; F414-I418 HydrophobicContact CE1-CD1 3.29Å; F414-I418 HydrophobicContact CE1-CG1 4.17Å; F414-I418 HydrophobicContact CZ-CD1 3.9Å; F414-I418 HydrophobicContact CZ-CG1 4.37Å; F414-I418 WeakPolarHBondContact O-CG1 3.32Å; F414-I418 PolarHBondContact O-N 3.45Å; F414-I526 HydrophobicContact CZ-CG1 4.19Å
415	V	72	Confident	68.3	Low	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-44.4	171.7	168.3	0	0	0	0	111	Y321 I322 L325 L404 D411 F412 I413 I418 I419	Y321-V415 HydrophobicContact CD1-CG2 4.21Å; Y321-V415 HydrophobicContact CE1-CG1 4.25Å; Y321-V415 HydrophobicContact CE1-CG2 4.03Å; I322-V415 HydrophobicContact CG1-CG2 3.86Å; L325-V415 HydrophobicContact CD2-CB 4.43Å; L325-V415 HydrophobicContact CD2-CG1 3.87Å; L325-V415 HydrophobicContact CD2-CG2 4.38Å; L404-V415 HydrophobicContact CD2-CG1 4.1Å; D411-V415 WeakPolarHBondContact O-CG2 3.41Å; D411-V415 PolarHBondContact O-N 2.95Å; F412-V415 PolarHBondContact O-N 2.81Å; I413-V415 PolarHBondContact O-N 3.38Å; V415-I418 PolarHBondContact O-N 3.25Å; V415-I419 HydrophobicContact CG1-CD1 3.67Å; V415-I419 VanDerWaalsContact O-CD1 3.27Å; V415-I419 WeakPolarHBondContact O-CD1 3.17Å; V415-I419 WeakPolarHBondContact O-CG1 3.45Å; V415-I419 PolarHBondContact O-N 3.41Å; V415-I419 VanDerWaalsContact O-N 3.11Å
416	L	70.4	Confident	68.4	Low	10 Å²	10	45.4 Å²	45.4	5%	0.052	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-37.3	177.8	-71.8	175.4	0	0	0	113.4	F412 I413 F414 I419 S420 I441 I627 L628	F412-L416 HydrophobicContact CD1-CD1 3.88Å; F412-L416 HydrophobicContact CE1-CD1 3.35Å; F412-L416 HydrophobicContact CE1-CG 4.13Å; F412-L416 HydrophobicContact CE2-CD1 4.49Å; F412-L416 HydrophobicContact CE2-CG 4.45Å; F412-L416 HydrophobicContact CZ-CD1 3.69Å; F412-L416 HydrophobicContact CZ-CD2 4.28Å; F412-L416 HydrophobicContact CZ-CG 4.07Å; F412-L416 WeakPolarHBondContact O-CG 3.17Å; F412-L416 PolarHBondContact O-N 2.85Å; I413-L416 WeakPolarHBondContact O-CB 3.4Å; I413-L416 PolarHBondContact O-N 2.99Å; I413-L416 VanDerWaalsContact O-N 3.14Å; F414-L416 VanDerWaalsContact C-N 3.31Å; F414-L416 PolarHBondContact O-N 3.16Å; L416-I419 PolarHBondContact O-N 2.92Å; L416-S420 VanDerWaalsContact O-CB 3.22Å; L416-S420 WeakPolarHBondContact O-CB 3.25Å; L416-S420 PolarHBondContact O-N 3.49Å; L416-I441 HydrophobicContact CD2-CG2 3.67Å; L416-I627 HydrophobicContact CB-CG2 4.41Å; L416-L628 HydrophobicContact CD1-CD1 3.57Å; L416-L628 HydrophobicContact CD1-CD2 3.87Å; L416-L628 HydrophobicContact CD1-CG 3.83Å; L416-L628 HydrophobicContact CD2-CD2 3.95Å
417	D	69.4	Low	68.6	Low	88 Å²	88	44 Å²	44	47%	0.471	21%	0.213	S	C	.	.	H	α-helix	trans	-66	-43.8	177.4	-169.7	47	0	0	0	111.3	I413 F414 I419 S420 R421	I413-D417 PolarHBondContact O-N 3.26Å; F414-D417 PolarHBondContact O-N 2.86Å; D417-I419 VanDerWaalsContact C-N 3.32Å; D417-I419 PolarHBondContact O-N 3.02Å; D417-S420 PolarHBondContact O-N 2.82Å; D417-R421 WeakPolarHBondContact O-CB 3.46Å; D417-R421 PolarHBondContact O-N 3.42Å
418	I	70.6	Confident	68.3	Low	10 Å²	10	47.8 Å²	47.8	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-57.2	-46.8	173.7	-69.7	167.3	0	0	0	110.8	L325 A326 C329 F414 V415 R421 L422 F524	L325-I418 HydrophobicContact CD2-CB 4.41Å; L325-I418 HydrophobicContact CD2-CG2 4.12Å; L325-I418 HydrophobicContact CG-CG2 4.05Å; A326-I418 HydrophobicContact CB-CD1 4.22Å; C329-I418 HydrophobicContact CB-CG2 4.3Å; F414-I418 HydrophobicContact CD1-CD1 3.65Å; F414-I418 HydrophobicContact CD1-CG1 4.46Å; F414-I418 HydrophobicContact CE1-CD1 3.29Å; F414-I418 HydrophobicContact CE1-CG1 4.17Å; F414-I418 HydrophobicContact CZ-CD1 3.9Å; F414-I418 HydrophobicContact CZ-CG1 4.37Å; F414-I418 WeakPolarHBondContact O-CG1 3.32Å; F414-I418 PolarHBondContact O-N 3.45Å; V415-I418 PolarHBondContact O-N 3.25Å; I418-R421 PolarHBondContact O-N 3.3Å; I418-L422 WeakPolarHBondContact O-CB 3.4Å; I418-L422 PolarHBondContact O-N 2.91Å; I418-F524 HydrophobicContact CG2-CD1 3.99Å; I418-F524 HydrophobicContact CG2-CE1 4.03Å
419	I	71.3	Confident	67.7	Low	2 Å²	2	40.9 Å²	40.9	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-70.1	-38.3	-178.5	-59.1	159.2	0	0	0	111	L325 L399 V415 L416 D417 R421 L422 M423 L437 I441	L325-I419 HydrophobicContact CD2-CG1 4.23Å; L399-I419 HydrophobicContact CD1-CD1 4.07Å; L399-I419 HydrophobicContact CD2-CD1 3.41Å; L399-I419 VanDerWaalsContact CD2-CD1 3.41Å; L399-I419 HydrophobicContact CD2-CG1 4.33Å; L399-I419 HydrophobicContact CG-CD1 4.36Å; V415-I419 HydrophobicContact CG1-CD1 3.67Å; V415-I419 VanDerWaalsContact O-CD1 3.27Å; V415-I419 WeakPolarHBondContact O-CD1 3.17Å; V415-I419 WeakPolarHBondContact O-CG1 3.45Å; V415-I419 PolarHBondContact O-N 3.41Å; V415-I419 VanDerWaalsContact O-N 3.11Å; L416-I419 PolarHBondContact O-N 2.92Å; D417-I419 VanDerWaalsContact C-N 3.32Å; D417-I419 PolarHBondContact O-N 3.02Å; I419-R421 VanDerWaalsContact C-N 3.34Å; I419-L422 WeakPolarHBondContact O-CB 3.47Å; I419-L422 PolarHBondContact O-N 3.19Å; I419-M423 WeakPolarHBondContact O-CG 3.38Å; I419-M423 PolarHBondContact O-N 3.4Å; I419-L437 HydrophobicContact CG2-CD2 3.55Å; I419-L437 HydrophobicContact CG2-CG 4.33Å; I419-I441 HydrophobicContact CB-CD1 4.34Å; I419-I441 HydrophobicContact CG2-CD1 3.27Å; I419-I441 HydrophobicContact CG2-CG1 3.83Å
420	S	69.4	Low	66.9	Low	39 Å²	39	41.3 Å²	41.3	27%	0.273	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-44.3	173.9	177.8	0	0	0	0	111.3	L416 D417 L422 M423 Q424	L416-S420 VanDerWaalsContact O-CB 3.22Å; L416-S420 WeakPolarHBondContact O-CB 3.25Å; L416-S420 PolarHBondContact O-N 3.49Å; D417-S420 PolarHBondContact O-N 2.82Å; S420-L422 VanDerWaalsContact C-N 3.34Å; S420-L422 PolarHBondContact O-N 3.29Å; S420-M423 WeakPolarHBondContact O-CB 3.34Å; S420-M423 PolarHBondContact O-N 3.45Å; S420-M423 VanDerWaalsContact O-N 3.16Å; S420-Q424 WeakPolarHBondContact O-CG 3.15Å; S420-Q424 PolarHBondContact O-N 2.74Å
421	R	68.6	Low	66.2	Low	61 Å²	61	39 Å²	39	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-37.6	175.3	-163	159.2	-173	-178.5	-9.7	112	D417 I418 I419 Q424 V425 Y517 P523 F524	D417-R421 WeakPolarHBondContact O-CB 3.46Å; D417-R421 PolarHBondContact O-N 3.42Å; I418-R421 PolarHBondContact O-N 3.3Å; I419-R421 VanDerWaalsContact C-N 3.34Å; R421-Q424 PolarHBondContact O-N 2.94Å; R421-V425 WeakPolarHBondContact O-CG2 3.49Å; R421-V425 PolarHBondContact O-N 3.17Å; R421-Y517 PolarHBondContact NH2-OH 3.03Å; R421-Y517 VanDerWaalsContact NH2-OH 3.1Å; R421-P523 WeakPolarHBondContact CD-O 3.32Å; R421-P523 PolarHBondContact NE-O 3.43Å; R421-P523 PolarHBondContact NH1-O 3.43Å; R421-P523 PolarHBondContact NH2-O 2.89Å; R421-P523 VanDerWaalsContact NH2-O 3.16Å; R421-F524 HydrophobicContact CB-CE1 4.3Å; R421-F524 HydrophobicContact CG-CE1 4.49Å
422	L	68.8	Low	65.3	Low	3 Å²	3	38 Å²	38	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-38.2	171.6	-175.9	69.7	0	0	0	112.2	W388 V395 I418 I419 S420 V425 G426 F524	W388-L422 HydrophobicContact CH2-CD1 4.46Å; W388-L422 HydrophobicContact CH2-CG 4.21Å; W388-L422 WeakPolarHBondContact CH2-O 3.27Å; W388-L422 HydrophobicContact CZ3-CD1 4.49Å; V395-L422 HydrophobicContact CB-CD2 4.39Å; V395-L422 HydrophobicContact CG1-CD2 3.97Å; V395-L422 HydrophobicContact CG2-CD2 3.91Å; I418-L422 WeakPolarHBondContact O-CB 3.4Å; I418-L422 PolarHBondContact O-N 2.91Å; I419-L422 WeakPolarHBondContact O-CB 3.47Å; I419-L422 PolarHBondContact O-N 3.19Å; S420-L422 VanDerWaalsContact C-N 3.34Å; S420-L422 PolarHBondContact O-N 3.29Å; L422-V425 WeakPolarHBondContact O-CB 3.5Å; L422-V425 PolarHBondContact O-N 3.27Å; L422-G426 PolarHBondContact O-N 2.91Å; L422-F524 HydrophobicContact CB-CE1 4.42Å; L422-F524 HydrophobicContact CB-CZ 4.25Å; L422-F524 HydrophobicContact CD1-CZ 4.13Å
423	M	66.5	Low	64.4	Low	36 Å²	36	45 Å²	45	18%	0.177	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-40.4	174.2	-70.5	-166.4	-50.2	0	0	112.4	I419 S420 V425 G426 E427 L437 Q438 I441	I419-M423 WeakPolarHBondContact O-CG 3.38Å; I419-M423 PolarHBondContact O-N 3.4Å; S420-M423 WeakPolarHBondContact O-CB 3.34Å; S420-M423 PolarHBondContact O-N 3.45Å; S420-M423 VanDerWaalsContact O-N 3.16Å; M423-V425 VanDerWaalsContact C-N 3.35Å; M423-G426 PolarHBondContact O-N 3.03Å; M423-E427 PolarHBondContact O-N 3.25Å; M423-L437 HydrophobicContact CG-CD2 3.32Å; M423-L437 HydrophobicContact SD-CD2 4Å; M423-Q438 HydrophobicContact CE-CG 4.28Å; M423-Q438 HydrophobicContact SD-CG 3.43Å; M423-Q438 WeakPolarHBondContact SD-CG 3.35Å; M423-I441 HydrophobicContact CE-CD1 4.42Å; M423-I441 HydrophobicContact SD-CD1 3.89Å
424	Q	65.3	Low	63.5	Low	98 Å²	98	43.4 Å²	43.4	46%	0.458	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-44.4	175.3	-70.1	173.5	5.3	0	0	110.8	S420 R421 G426 E427 E428	S420-Q424 WeakPolarHBondContact O-CG 3.15Å; S420-Q424 PolarHBondContact O-N 2.74Å; R421-Q424 PolarHBondContact O-N 2.94Å; Q424-G426 VanDerWaalsContact C-N 3.28Å; Q424-G426 PolarHBondContact O-N 2.96Å; Q424-E427 PolarHBondContact O-N 3.21Å; Q424-E428 PolarHBondContact O-N 3.38Å
425	V	64.3	Low	63.2	Low	2 Å²	2	46.9 Å²	46.9	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-42.1	172	162.3	0	0	0	0	111.6	W333 M336 R421 L422 M423 E428 F429	W333-V425 HydrophobicContact CE3-CB 4.49Å; W333-V425 HydrophobicContact CE3-CG1 3.66Å; W333-V425 HydrophobicContact CE3-CG2 3.99Å; W333-V425 HydrophobicContact CZ3-CB 4.27Å; W333-V425 HydrophobicContact CZ3-CG1 3.61Å; W333-V425 HydrophobicContact CZ3-CG2 3.71Å; M336-V425 HydrophobicContact CE-CG1 3.95Å; M336-V425 HydrophobicContact SD-CG1 4.41Å; R421-V425 WeakPolarHBondContact O-CG2 3.49Å; R421-V425 PolarHBondContact O-N 3.17Å; L422-V425 WeakPolarHBondContact O-CB 3.5Å; L422-V425 PolarHBondContact O-N 3.27Å; M423-V425 VanDerWaalsContact C-N 3.35Å; V425-E428 PolarHBondContact O-N 2.87Å; V425-F429 VanDerWaalsContact O-CB 3.25Å; V425-F429 WeakPolarHBondContact O-CB 3.34Å; V425-F429 PolarHBondContact O-N 3.18Å
426	G	61.5	Low	62.9	Low	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-38.7	175.8	0	0	0	0	0	115	W388 L422 M423 Q424 F429 C430	W388-G426 VanDerWaalsContact CE2-CA 3.48Å; L422-G426 PolarHBondContact O-N 2.91Å; M423-G426 PolarHBondContact O-N 3.03Å; Q424-G426 VanDerWaalsContact C-N 3.28Å; Q424-G426 PolarHBondContact O-N 2.96Å; G426-F429 PolarHBondContact O-N 3.08Å; G426-C430 PolarHBondContact O-N 3.48Å; G426-C430 VanDerWaalsContact O-N 3.08Å
427	E	65.9	Low	62.8	Low	101 Å²	101	49.1 Å²	49.1	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-67.7	-37.5	176.2	-169.9	165.8	-163.4	0	0	110.7	M423 Q424 G431	M423-E427 PolarHBondContact O-N 3.25Å; Q424-E427 PolarHBondContact O-N 3.21Å; E427-G431 WeakPolarHBondContact O-CA 3.27Å; E427-G431 PolarHBondContact O-N 3.05Å
428	E	58.3	Low	62.7	Low	94 Å²	94	49 Å²	49	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-73.7	-35.3	173.8	-68.3	-155.9	178.1	0	0	113.6	Q424 V425 L513	Q424-E428 PolarHBondContact O-N 3.38Å; V425-E428 PolarHBondContact O-N 2.87Å; E428-L513 VanDerWaalsContact OE2-CB 3.31Å; E428-L513 WeakPolarHBondContact OE2-CB 3.5Å; E428-L513 PolarHBondContact OE2-N 2.83Å
429	F	57.1	Low	62.7	Low	13 Å²	13	55 Å²	55	6%	0.057	29%	0.286	C	S	.	.	H	α-helix	trans	-77.5	-29.5	-177.5	-172	-103.5	0	0	0	113.8	M336 Y339 L384 I387 V425 G426 F514	M336-F429 HydrophobicContact CB-CD2 4.5Å; M336-F429 HydrophobicContact CB-CE2 4.09Å; M336-F429 HydrophobicContact CB-CZ 4.29Å; M336-F429 HydrophobicContact CE-CB 3.61Å; M336-F429 HydrophobicContact CE-CD1 3.45Å; M336-F429 VanDerWaalsContact CE-CD1 3.45Å; M336-F429 HydrophobicContact CE-CD2 3.82Å; M336-F429 HydrophobicContact CE-CE1 3.95Å; M336-F429 HydrophobicContact CE-CE2 4.28Å; M336-F429 HydrophobicContact CE-CG 3.35Å; M336-F429 HydrophobicContact CE-CZ 4.32Å; M336-F429 HydrophobicContact CG-CZ 4.4Å; M336-F429 WeakPolarHBondContact O-CE2 3.29Å; Y339-F429 HydrophobicContact CD1-CE2 4.44Å; Y339-F429 AromaticContact CD1-CZ 3.77Å; Y339-F429 HydrophobicContact CD1-CZ 3.77Å; Y339-F429 HydrophobicContact CG-CZ 4.43Å; L384-F429 HydrophobicContact CB-CE1 4.34Å; L384-F429 HydrophobicContact CD2-CD1 4.04Å; L384-F429 HydrophobicContact CD2-CD2 4.29Å; L384-F429 HydrophobicContact CD2-CE1 3.45Å; L384-F429 VanDerWaalsContact CD2-CE1 3.45Å; L384-F429 HydrophobicContact CD2-CE2 3.74Å; L384-F429 HydrophobicContact CD2-CG 4.45Å; L384-F429 HydrophobicContact CD2-CZ 3.3Å; I387-F429 HydrophobicContact CG2-CE1 4.26Å; V425-F429 VanDerWaalsContact O-CB 3.25Å; V425-F429 WeakPolarHBondContact O-CB 3.34Å; V425-F429 PolarHBondContact O-N 3.18Å; G426-F429 PolarHBondContact O-N 3.08Å; F429-F514 HydrophobicContact CB-CE2 4.37Å; F429-F514 HydrophobicContact CB-CZ 4.47Å; F429-F514 HydrophobicContact CD2-CE1 4.35Å; F429-F514 HydrophobicContact CD2-CE2 4.26Å; F429-F514 AromaticContact CD2-CZ 3.67Å; F429-F514 HydrophobicContact CD2-CZ 3.67Å; F429-F514 HydrophobicContact CE2-CZ 4.43Å
430	C	50	Low	62.5	Low	29 Å²	29	55.2 Å²	55.2	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-132.3	-9.7	-169.5	-164.8	0	0	0	0	113.8	T385 W388 G426 S432	T385-C430 WeakPolarHBondContact CG2-SG 3.38Å; W388-C430 HydrophobicContact CB-CB 4.27Å; W388-C430 HydrophobicContact CG-CB 4.17Å; G426-C430 PolarHBondContact O-N 3.48Å; G426-C430 VanDerWaalsContact O-N 3.08Å; C430-S432 PolarHBondContact O-N 2.93Å
431	G	53.2	Low	62.8	Low	65 Å²	65	54.1 Å²	54.1	67%	0.67	28%	0.278	S	S	*	.	S	Bend	trans	62.7	7.2	-172.7	0	0	0	0	0	113.8	E427	E427-G431 WeakPolarHBondContact O-CA 3.27Å; E427-G431 PolarHBondContact O-N 3.05Å
432	S	52.3	Low	63	Low	38 Å²	38	56.6 Å²	56.6	27%	0.266	29%	0.287	S	S	.	.			trans	-97.5	126.5	-177.4	72.9	0	0	0	0	110.5	C430 S434	C430-S432 PolarHBondContact O-N 2.93Å; S432-S434 PolarHBondContact O-N 2.77Å
433	K	52.2	Low	63.3	Low	148 Å²	148	63.6 Å²	63.6	64%	0.643	32%	0.318	S	S	*	.			trans	-70.3	118.1	173	-64.1	-177.5	-179.5	-179.1	0	107.1	E435	K433-E435 PolarHBondContact O-N 3.31Å
434	S	57.1	Low	63.5	Low	3 Å²	3	62.9 Å²	62.9	2%	0.021	31%	0.314	C	S	.	.			trans	-73.4	64.5	-170.2	-65.4	0	0	0	0	112.9	W388 Q392 S432 V436 L437 Q438	W388-S434 WeakPolarHBondContact CZ2-OG 3.44Å; W388-S434 PolarHBondContact NE1-OG 3.4Å; W388-S434 VanDerWaalsContact NE1-OG 3.16Å; Q392-S434 PolarHBondContact NE2-OG 2.82Å; S432-S434 PolarHBondContact O-N 2.77Å; S434-V436 VanDerWaalsContact C-N 3.31Å; S434-V436 PolarHBondContact O-N 2.89Å; S434-L437 PolarHBondContact O-N 3.48Å; S434-L437 VanDerWaalsContact O-N 3.15Å; S434-Q438 WeakPolarHBondContact O-CG 3.5Å; S434-Q438 PolarHBondContact O-N 3.38Å
435	E	63.8	Low	64	Low	144 Å²	144	58.3 Å²	58.3	67%	0.673	29%	0.293	S	S	*	.	H	α-helix	trans	-58.1	-40.7	-172.5	-68.1	-174.9	172.7	0	0	112.5	K433 L437 Q438 E439	K433-E435 PolarHBondContact O-N 3.31Å; E435-L437 VanDerWaalsContact C-N 3.31Å; E435-L437 PolarHBondContact O-N 3.05Å; E435-Q438 PolarHBondContact O-N 3.31Å; E435-E439 WeakPolarHBondContact O-CB 3.42Å; E435-E439 PolarHBondContact O-N 3.19Å
436	V	64.9	Low	64.6	Low	56 Å²	56	59.4 Å²	59.4	34%	0.339	30%	0.3	S	S	.	.	H	α-helix	trans	-65.2	-35.9	-179.2	178.6	0	0	0	0	112	K396 S434 S440	K396-V436 HydrophobicContact CD-CG1 3.6Å; S434-V436 VanDerWaalsContact C-N 3.31Å; S434-V436 PolarHBondContact O-N 2.89Å; V436-S440 PolarHBondContact O-N 3.3Å; V436-S440 PolarHBondContact O-OG 2.97Å
437	L	68.1	Low	65.4	Low	1 Å²	1	62.9 Å²	62.9	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-75.9	-44	176.6	-157.2	94.9	0	0	0	110.2	V395 I419 M423 S434 E435 E439 S440 I441	V395-L437 HydrophobicContact CB-CD1 4.07Å; V395-L437 HydrophobicContact CG1-CD1 3.85Å; I419-L437 HydrophobicContact CG2-CD2 3.55Å; I419-L437 HydrophobicContact CG2-CG 4.33Å; M423-L437 HydrophobicContact CG-CD2 3.32Å; M423-L437 HydrophobicContact SD-CD2 4Å; S434-L437 PolarHBondContact O-N 3.48Å; S434-L437 VanDerWaalsContact O-N 3.15Å; E435-L437 VanDerWaalsContact C-N 3.31Å; E435-L437 PolarHBondContact O-N 3.05Å; L437-E439 VanDerWaalsContact C-N 3.34Å; L437-E439 PolarHBondContact O-N 3.33Å; L437-S440 PolarHBondContact O-N 3.12Å; L437-S440 VanDerWaalsContact O-N 3.15Å; L437-I441 HydrophobicContact CD2-CD1 4.04Å; L437-I441 HydrophobicContact CG-CD1 4.21Å; L437-I441 VanDerWaalsContact O-CG1 3.25Å; L437-I441 WeakPolarHBondContact O-CG1 3.39Å; L437-I441 PolarHBondContact O-N 3.43Å
438	Q	66.9	Low	66	Low	86 Å²	86	58.3 Å²	58.3	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-58.4	-42.9	176.4	-74.4	-176.3	-5.4	0	0	112.4	M423 S434 E435 S440 R442	M423-Q438 HydrophobicContact CE-CG 4.28Å; M423-Q438 HydrophobicContact SD-CG 3.43Å; M423-Q438 WeakPolarHBondContact SD-CG 3.35Å; S434-Q438 WeakPolarHBondContact O-CG 3.5Å; S434-Q438 PolarHBondContact O-N 3.38Å; E435-Q438 PolarHBondContact O-N 3.31Å; Q438-S440 VanDerWaalsContact C-N 3.34Å; Q438-R442 VanDerWaalsContact O-CB 3.27Å; Q438-R442 WeakPolarHBondContact O-CB 3.45Å; Q438-R442 PolarHBondContact O-N 3.43Å
439	E	70.5	Confident	66.9	Low	136 Å²	136	54 Å²	54	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-67	-37	177.3	-169.3	177	-162.6	0	0	111.9	E435 L437 R442 K443	E435-E439 WeakPolarHBondContact O-CB 3.42Å; E435-E439 PolarHBondContact O-N 3.19Å; L437-E439 VanDerWaalsContact C-N 3.34Å; L437-E439 PolarHBondContact O-N 3.33Å; E439-R442 PolarHBondContact O-N 3.17Å; E439-K443 WeakPolarHBondContact O-CB 3.25Å; E439-K443 PolarHBondContact O-N 3.45Å
440	S	68.3	Low	67.8	Low	7 Å²	7	57.4 Å²	57.4	5%	0.049	29%	0.291	C	S	.	.	H	α-helix	trans	-67.6	-46.3	177	-56.1	0	0	0	0	111.2	K396 V436 L437 Q438 R442 K443 Q444	K396-S440 WeakPolarHBondContact CD-OG 3.35Å; K396-S440 WeakPolarHBondContact CE-OG 3.48Å; K396-S440 WeakPolarHBondContact CG-OG 3.47Å; V436-S440 PolarHBondContact O-N 3.3Å; V436-S440 PolarHBondContact O-OG 2.97Å; L437-S440 PolarHBondContact O-N 3.12Å; L437-S440 VanDerWaalsContact O-N 3.15Å; Q438-S440 VanDerWaalsContact C-N 3.34Å; S440-R442 VanDerWaalsContact C-N 3.31Å; S440-R442 PolarHBondContact O-N 2.92Å; S440-K443 PolarHBondContact O-N 3.03Å; S440-Q444 WeakPolarHBondContact O-CG 3.07Å; S440-Q444 PolarHBondContact O-N 2.99Å
441	I	74.4	Confident	69.1	Low	15 Å²	15	59.1 Å²	59.1	8%	0.077	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-44.3	172.3	-64.2	160.9	0	0	0	110.1	L416 I419 M423 L437 K443 Q444 S445 L628	L416-I441 HydrophobicContact CD2-CG2 3.67Å; I419-I441 HydrophobicContact CB-CD1 4.34Å; I419-I441 HydrophobicContact CG2-CD1 3.27Å; I419-I441 HydrophobicContact CG2-CG1 3.83Å; M423-I441 HydrophobicContact CE-CD1 4.42Å; M423-I441 HydrophobicContact SD-CD1 3.89Å; L437-I441 HydrophobicContact CD2-CD1 4.04Å; L437-I441 HydrophobicContact CG-CD1 4.21Å; L437-I441 VanDerWaalsContact O-CG1 3.25Å; L437-I441 WeakPolarHBondContact O-CG1 3.39Å; L437-I441 PolarHBondContact O-N 3.43Å; I441-K443 PolarHBondContact O-N 2.91Å; I441-Q444 PolarHBondContact O-N 3.27Å; I441-S445 WeakPolarHBondContact O-CB 3.31Å; I441-S445 PolarHBondContact O-N 3.36Å; I441-S445 PolarHBondContact O-OG 3.41Å; I441-L628 HydrophobicContact CG2-CD2 4.06Å
442	R	73.2	Confident	70.3	Confident	113 Å²	113	57.1 Å²	57.1	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-48.8	178.8	-161.7	-173.1	95	80.4	0.6	110.9	Q438 E439 S440 S445 V446 P630 I631 D634	Q438-R442 VanDerWaalsContact O-CB 3.27Å; Q438-R442 WeakPolarHBondContact O-CB 3.45Å; Q438-R442 PolarHBondContact O-N 3.43Å; E439-R442 PolarHBondContact O-N 3.17Å; S440-R442 VanDerWaalsContact C-N 3.31Å; S440-R442 PolarHBondContact O-N 2.92Å; R442-S445 PolarHBondContact O-N 3.21Å; R442-V446 WeakPolarHBondContact O-CB 3.43Å; R442-V446 WeakPolarHBondContact O-CG2 3Å; R442-V446 PolarHBondContact O-N 3.44Å; R442-P630 HydrophobicContact CG-CB 4.38Å; R442-I631 HydrophobicContact CG-CD1 4.19Å; R442-I631 HydrophobicContact CG-CG1 3.73Å; R442-D634 IonicContact NH1-OD2 3.52Å
443	K	75.5	Confident	71.7	Confident	150 Å²	150	55.5 Å²	55.5	65%	0.652	26%	0.259	S	S	*	.	H	α-helix	trans	-62.7	-45	-179.3	-171.8	176.4	-179.6	-179.5	0	111.9	E439 S440 I441 N447	E439-K443 WeakPolarHBondContact O-CB 3.25Å; E439-K443 PolarHBondContact O-N 3.45Å; S440-K443 PolarHBondContact O-N 3.03Å; I441-K443 PolarHBondContact O-N 2.91Å; K443-N447 PolarHBondContact O-N 3.16Å; K443-N447 VanDerWaalsContact O-N 3.15Å
444	Q	71.1	Confident	73	Confident	21 Å²	21	53.6 Å²	53.6	10%	0.098	25%	0.248	C	C	.	.	H	α-helix	trans	-71.8	-38.7	179.8	-66.5	-162.1	-49.7	0	0	113.2	L399 T402 L404 S440 I441 N447 Y448	L399-Q444 PolarHBondContact O-NE2 3.14Å; T402-Q444 PolarHBondContact O-NE2 3.02Å; L404-Q444 HydrophobicContact CD1-CB 4.03Å; L404-Q444 VanDerWaalsContact CD1-OE1 3.28Å; S440-Q444 WeakPolarHBondContact O-CG 3.07Å; S440-Q444 PolarHBondContact O-N 2.99Å; I441-Q444 PolarHBondContact O-N 3.27Å; Q444-N447 PolarHBondContact O-N 2.96Å; Q444-Y448 WeakPolarHBondContact O-CB 3.06Å; Q444-Y448 PolarHBondContact O-N 3.43Å
445	S	75.4	Confident	74.1	Confident	2 Å²	2	57 Å²	57	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-67.8	-36.4	177.7	-62.4	0	0	0	0	111.5	I441 R442 N447 F449	I441-S445 WeakPolarHBondContact O-CB 3.31Å; I441-S445 PolarHBondContact O-N 3.36Å; I441-S445 PolarHBondContact O-OG 3.41Å; R442-S445 PolarHBondContact O-N 3.21Å; S445-N447 VanDerWaalsContact C-N 3.34Å; S445-F449 WeakPolarHBondContact O-CB 3.46Å; S445-F449 PolarHBondContact O-N 3.15Å
446	V	77	Confident	75	Confident	26 Å²	26	53.5 Å²	53.5	16%	0.158	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-42.1	170.2	170.1	0	0	0	0	110.8	R442 F449 K450 I631	R442-V446 WeakPolarHBondContact O-CB 3.43Å; R442-V446 WeakPolarHBondContact O-CG2 3Å; R442-V446 PolarHBondContact O-N 3.44Å; V446-F449 PolarHBondContact O-N 2.7Å; V446-K450 HydrophobicContact CG1-CD 4.44Å; V446-K450 WeakPolarHBondContact O-CB 3.4Å; V446-K450 WeakPolarHBondContact O-CG 3.42Å; V446-K450 PolarHBondContact O-N 2.97Å; V446-I631 HydrophobicContact CG2-CD1 4.25Å; V446-I631 HydrophobicContact CG2-CG1 4.28Å; V446-I631 HydrophobicContact CG2-CG2 3.77Å
447	N	77.8	Confident	75.6	Confident	73 Å²	73	51.2 Å²	51.2	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-67.8	-43.7	179.1	-160.9	24.5	0	0	0	112.2	K443 Q444 S445 F449 K450 N451	K443-N447 PolarHBondContact O-N 3.16Å; K443-N447 VanDerWaalsContact O-N 3.15Å; Q444-N447 PolarHBondContact O-N 2.96Å; S445-N447 VanDerWaalsContact C-N 3.34Å; N447-F449 VanDerWaalsContact C-N 3.32Å; N447-F449 PolarHBondContact O-N 2.84Å; N447-K450 PolarHBondContact O-N 2.89Å; N447-N451 PolarHBondContact O-N 3.48Å; N447-N451 VanDerWaalsContact O-N 3.11Å
448	Y	78.2	Confident	76.2	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-54.6	-51.3	171.4	-180	-95.9	0	0	0	110.4	L404 F407 K408 F412 Q444 K450 N451 Y452 M624	L404-Y448 HydrophobicContact CB-CD2 4.49Å; L404-Y448 WeakPolarHBondContact O-CD2 3.39Å; L404-Y448 WeakPolarHBondContact O-CE2 3.44Å; F407-Y448 WeakPolarHBondContact O-CE2 3.37Å; F407-Y448 PolarHBondContact O-OH 3.39Å; K408-Y448 PolarHBondContact O-OH 3.48Å; F412-Y448 HydrophobicContact CB-CE1 4.12Å; F412-Y448 HydrophobicContact CB-CE2 3.96Å; F412-Y448 AromaticContact CD1-CD1 3.54Å; F412-Y448 HydrophobicContact CD1-CD1 3.54Å; F412-Y448 HydrophobicContact CD1-CD2 4.5Å; F412-Y448 AromaticContact CD1-CE1 3.44Å; F412-Y448 HydrophobicContact CD1-CE1 3.44Å; F412-Y448 VanDerWaalsContact CD1-CE1 3.44Å; F412-Y448 HydrophobicContact CD1-CE2 4.45Å; F412-Y448 HydrophobicContact CD1-CG 4.11Å; F412-Y448 AromaticContact CD1-CZ 3.94Å; F412-Y448 HydrophobicContact CD2-CD1 4.13Å; F412-Y448 AromaticContact CD2-CD2 3.72Å; F412-Y448 HydrophobicContact CD2-CD2 3.72Å; F412-Y448 HydrophobicContact CD2-CE1 4.32Å; F412-Y448 AromaticContact CD2-CE2 3.96Å; F412-Y448 HydrophobicContact CD2-CE2 3.96Å; F412-Y448 AromaticContact CD2-CG 3.83Å; F412-Y448 HydrophobicContact CD2-CG 3.83Å; F412-Y448 AromaticContact CE1-CD1 3.46Å; F412-Y448 HydrophobicContact CE1-CD1 3.46Å; F412-Y448 VanDerWaalsContact CE1-CD1 3.46Å; F412-Y448 AromaticContact CE1-CE1 3.87Å; F412-Y448 HydrophobicContact CE1-CE1 3.87Å; F412-Y448 AromaticContact CE1-CG 3.95Å; F412-Y448 HydrophobicContact CE1-CG 3.95Å; F412-Y448 HydrophobicContact CE2-CD1 4.08Å; F412-Y448 AromaticContact CE2-CD2 3.97Å; F412-Y448 HydrophobicContact CE2-CD2 3.97Å; F412-Y448 AromaticContact CE2-CG 3.68Å; F412-Y448 HydrophobicContact CE2-CG 3.68Å; F412-Y448 AromaticContact CG-CD1 3.89Å; F412-Y448 HydrophobicContact CG-CD1 3.89Å; F412-Y448 HydrophobicContact CG-CD2 4.01Å; F412-Y448 AromaticContact CG-CE1 3.7Å; F412-Y448 HydrophobicContact CG-CE1 3.7Å; F412-Y448 AromaticContact CG-CE2 3.87Å; F412-Y448 HydrophobicContact CG-CE2 3.87Å; F412-Y448 HydrophobicContact CG-CG 4.04Å; F412-Y448 AromaticContact CG-CZ 3.7Å; F412-Y448 AromaticContact CZ-CD1 3.76Å; F412-Y448 HydrophobicContact CZ-CD1 3.76Å; F412-Y448 HydrophobicContact CZ-CD2 4.46Å; F412-Y448 HydrophobicContact CZ-CE1 4.49Å; F412-Y448 AromaticContact CZ-CG 3.75Å; F412-Y448 HydrophobicContact CZ-CG 3.75Å; Q444-Y448 WeakPolarHBondContact O-CB 3.06Å; Q444-Y448 PolarHBondContact O-N 3.43Å; Y448-K450 PolarHBondContact O-N 3.19Å; Y448-N451 PolarHBondContact O-N 3.26Å; Y448-Y452 HydrophobicContact CE1-CD2 4.46Å; Y448-Y452 HydrophobicContact CE1-CG 4.25Å; Y448-Y452 VanDerWaalsContact O-CB 3.26Å; Y448-Y452 WeakPolarHBondContact O-CB 3.43Å; Y448-Y452 PolarHBondContact O-N 3.09Å; Y448-M624 HydrophobicContact CE1-CE 3.92Å
449	F	76.7	Confident	76.9	Confident	5 Å²	5	53 Å²	53	2%	0.022	25%	0.246	C	C	.	.	H	α-helix	trans	-65.6	-39.3	-176.4	-159	-75.2	0	0	0	111.8	S445 V446 N447 N451 Y452 H453 Y621 M624 V635 F638	S445-F449 WeakPolarHBondContact O-CB 3.46Å; S445-F449 PolarHBondContact O-N 3.15Å; V446-F449 PolarHBondContact O-N 2.7Å; N447-F449 VanDerWaalsContact C-N 3.32Å; N447-F449 PolarHBondContact O-N 2.84Å; F449-N451 PolarHBondContact O-N 3.01Å; F449-Y452 PolarHBondContact O-N 3.46Å; F449-H453 HydrophobicContact CD1-CB 4.17Å; F449-H453 HydrophobicContact CE1-CB 4.13Å; F449-H453 WeakPolarHBondContact O-CA 3.27Å; F449-H453 WeakPolarHBondContact O-CB 3.23Å; F449-H453 PolarHBondContact O-N 2.86Å; F449-Y621 HydrophobicContact CE1-CD1 4.49Å; F449-Y621 HydrophobicContact CE1-CD2 4.38Å; F449-Y621 HydrophobicContact CE1-CE1 4.22Å; F449-Y621 HydrophobicContact CE1-CE2 4.14Å; F449-Y621 AromaticContact CE2-CD1 3.75Å; F449-Y621 HydrophobicContact CE2-CD1 3.75Å; F449-Y621 HydrophobicContact CE2-CE1 4.03Å; F449-Y621 HydrophobicContact CE2-CG 4.1Å; F449-Y621 AromaticContact CZ-CD1 3.46Å; F449-Y621 HydrophobicContact CZ-CD1 3.46Å; F449-Y621 VanDerWaalsContact CZ-CD1 3.46Å; F449-Y621 AromaticContact CZ-CD2 3.69Å; F449-Y621 HydrophobicContact CZ-CD2 3.69Å; F449-Y621 AromaticContact CZ-CE1 3.57Å; F449-Y621 HydrophobicContact CZ-CE1 3.57Å; F449-Y621 AromaticContact CZ-CE2 3.83Å; F449-Y621 HydrophobicContact CZ-CE2 3.83Å; F449-Y621 AromaticContact CZ-CG 3.54Å; F449-Y621 HydrophobicContact CZ-CG 3.54Å; F449-Y621 AromaticContact CZ-CZ 3.8Å; F449-M624 HydrophobicContact CD2-SD 3.63Å; F449-M624 HydrophobicContact CE2-SD 3.59Å; F449-M624 VanDerWaalsContact CE2-SD 3.59Å; F449-V635 HydrophobicContact CD2-CG2 4.08Å; F449-V635 HydrophobicContact CE2-CB 4.37Å; F449-V635 HydrophobicContact CE2-CG1 4.03Å; F449-V635 HydrophobicContact CE2-CG2 3.75Å; F449-V635 HydrophobicContact CZ-CB 4.21Å; F449-V635 HydrophobicContact CZ-CG1 3.82Å; F449-V635 HydrophobicContact CZ-CG2 4.04Å; F449-F638 HydrophobicContact CD1-CB 4.28Å; F449-F638 AromaticContact CD1-CD2 3.04Å; F449-F638 HydrophobicContact CD1-CD2 3.04Å; F449-F638 AromaticContact CD1-CE2 3.42Å; F449-F638 HydrophobicContact CD1-CE2 3.42Å; F449-F638 VanDerWaalsContact CD1-CE2 3.42Å; F449-F638 AromaticContact CD1-CG 3.81Å; F449-F638 HydrophobicContact CD1-CG 3.81Å; F449-F638 HydrophobicContact CD1-CZ 4.41Å; F449-F638 HydrophobicContact CE1-CB 3.47Å; F449-F638 VanDerWaalsContact CE1-CB 3.47Å; F449-F638 AromaticContact CE1-CD2 3.09Å; F449-F638 HydrophobicContact CE1-CD2 3.09Å; F449-F638 AromaticContact CE1-CE2 3.97Å; F449-F638 HydrophobicContact CE1-CE2 3.97Å; F449-F638 AromaticContact CE1-CG 3.5Å; F449-F638 HydrophobicContact CE1-CG 3.5Å; F449-F638 HydrophobicContact CG-CD2 4.22Å; F449-F638 HydrophobicContact CG-CE2 4.37Å; F449-F638 HydrophobicContact CZ-CB 4.31Å; F449-F638 HydrophobicContact CZ-CD2 4.25Å
450	K	77.1	Confident	77.5	Confident	83 Å²	83	47 Å²	47	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-58	-48	173.7	-81.2	-174.4	175.2	-141.6	0	112	V446 N447 Y448 R454 F638 E704	V446-K450 HydrophobicContact CG1-CD 4.44Å; V446-K450 WeakPolarHBondContact O-CB 3.4Å; V446-K450 WeakPolarHBondContact O-CG 3.42Å; V446-K450 PolarHBondContact O-N 2.97Å; N447-K450 PolarHBondContact O-N 2.89Å; Y448-K450 PolarHBondContact O-N 3.19Å; K450-R454 WeakPolarHBondContact O-CB 2.98Å; K450-R454 PolarHBondContact O-N 2.94Å; K450-F638 HydrophobicContact CG-CE1 4.42Å; K450-F638 HydrophobicContact CG-CE2 4.44Å; K450-F638 HydrophobicContact CG-CZ 3.66Å; K450-E704 IonicContact NZ-OE1 3.57Å; K450-E704 PolarHBondContact NZ-OE1 3.41Å
451	N	78.3	Confident	78.1	Confident	66 Å²	66	49.3 Å²	49.3	35%	0.353	23%	0.225	S	C	.	.	H	α-helix	trans	-68.9	-44.4	179.2	-74.7	-5.5	0	0	0	111.8	S405 N447 Y448 F449 H453 R454 T455	S405-N451 VanDerWaalsContact CB-ND2 3.28Å; S405-N451 WeakPolarHBondContact CB-ND2 3.46Å; S405-N451 PolarHBondContact OG-ND2 3.49Å; N447-N451 PolarHBondContact O-N 3.48Å; N447-N451 VanDerWaalsContact O-N 3.11Å; Y448-N451 PolarHBondContact O-N 3.26Å; F449-N451 PolarHBondContact O-N 3.01Å; N451-H453 PolarHBondContact O-N 3.38Å; N451-R454 WeakPolarHBondContact O-CB 3.33Å; N451-R454 PolarHBondContact O-N 3.21Å; N451-T455 PolarHBondContact O-N 2.95Å; N451-T455 PolarHBondContact O-OG1 2.98Å
452	Y	77.6	Confident	78.4	Confident	22 Å²	22	53.3 Å²	53.3	9%	0.086	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-45.8	176.8	-174.6	-106.9	0	0	0	111.5	Y448 F449 R454 T455 R456 L617 Y621 M624	Y448-Y452 HydrophobicContact CE1-CD2 4.46Å; Y448-Y452 HydrophobicContact CE1-CG 4.25Å; Y448-Y452 VanDerWaalsContact O-CB 3.26Å; Y448-Y452 WeakPolarHBondContact O-CB 3.43Å; Y448-Y452 PolarHBondContact O-N 3.09Å; F449-Y452 PolarHBondContact O-N 3.46Å; Y452-R454 VanDerWaalsContact C-N 3.34Å; Y452-R454 PolarHBondContact O-N 3.18Å; Y452-T455 PolarHBondContact O-N 3.21Å; Y452-R456 HydrophobicContact CD1-CG 4.34Å; Y452-R456 HydrophobicContact CE1-CG 4.02Å; Y452-R456 HydrophobicContact CE2-CG 4.39Å; Y452-R456 VanDerWaalsContact O-CG 3.3Å; Y452-R456 WeakPolarHBondContact O-CG 2.97Å; Y452-R456 PolarHBondContact O-N 3.49Å; Y452-R456 PolarHBondContact OH-NE 3.05Å; Y452-R456 VanDerWaalsContact OH-NE 3.09Å; Y452-R456 PolarHBondContact OH-NH2 3.1Å; Y452-L617 HydrophobicContact CE1-CD1 4.23Å; Y452-Y621 AromaticContact CD1-CE1 3.77Å; Y452-Y621 HydrophobicContact CD1-CE1 3.77Å; Y452-Y621 HydrophobicContact CE1-CD1 4.39Å; Y452-Y621 AromaticContact CE1-CE1 3.66Å; Y452-Y621 HydrophobicContact CE1-CE1 3.66Å; Y452-M624 HydrophobicContact CD1-CE 4.12Å; Y452-M624 HydrophobicContact CE1-CE 4.05Å
453	H	81.3	Confident	78.8	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.023	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-42.7	177.1	-177.2	66.2	0	0	0	111.9	F449 N451 R456 L457 Y621 F638 Q641	F449-H453 HydrophobicContact CD1-CB 4.17Å; F449-H453 HydrophobicContact CE1-CB 4.13Å; F449-H453 WeakPolarHBondContact O-CA 3.27Å; F449-H453 WeakPolarHBondContact O-CB 3.23Å; F449-H453 PolarHBondContact O-N 2.86Å; N451-H453 PolarHBondContact O-N 3.38Å; H453-R456 PolarHBondContact O-N 3.13Å; H453-L457 VanDerWaalsContact CD2-CD1 3.47Å; H453-L457 WeakPolarHBondContact CD2-CD1 3.41Å; H453-L457 WeakPolarHBondContact NE2-CD1 3.33Å; H453-L457 WeakPolarHBondContact O-CB 3.44Å; H453-L457 PolarHBondContact O-N 3.03Å; H453-Y621 WeakPolarHBondContact CA-OH 3.39Å; H453-Y621 AromaticContact ND1-CE2 3.61Å; H453-Y621 AromaticContact ND1-CZ 3.62Å; H453-Y621 PolarHBondContact ND1-OH 3.26Å; H453-F638 HydrophobicContact CB-CD1 4.25Å; H453-F638 HydrophobicContact CB-CG 4.36Å; H453-F638 AromaticContact CD2-CD1 3.25Å; H453-F638 WeakPolarHBondContact CD2-CD1 3.36Å; H453-F638 AromaticContact CD2-CE1 3.94Å; H453-F638 AromaticContact CD2-CG 3.93Å; H453-F638 PolarHBondContact CE1-O 3.26Å; H453-F638 AromaticContact CG-CD1 3.68Å; H453-F638 AromaticContact CG-CG 3.91Å; H453-F638 AromaticContact NE2-CD1 3.63Å; H453-Q641 PolarHBondContact CD2-OE1 3.41Å; H453-Q641 PolarHBondContact NE2-OE1 3.17Å
454	R	79.6	Confident	79	Confident	108 Å²	108	45.3 Å²	45.3	41%	0.408	21%	0.213	S	C	.	.	H	α-helix	trans	-59.4	-50.5	175.2	-179.7	-179.7	175.4	145.2	0.3	111.9	K450 N451 Y452 R456 L457 D458 K703	K450-R454 WeakPolarHBondContact O-CB 2.98Å; K450-R454 PolarHBondContact O-N 2.94Å; N451-R454 WeakPolarHBondContact O-CB 3.33Å; N451-R454 PolarHBondContact O-N 3.21Å; Y452-R454 VanDerWaalsContact C-N 3.34Å; Y452-R454 PolarHBondContact O-N 3.18Å; R454-R456 PolarHBondContact O-N 2.96Å; R454-L457 PolarHBondContact O-N 3.26Å; R454-D458 PolarHBondContact O-N 2.85Å; R454-K703 VanDerWaalsContact NH1-CA 3.31Å; R454-K703 VanDerWaalsContact NH1-CB 3.34Å; R454-K703 PolarHBondContact NH1-O 2.72Å
455	T	81.3	Confident	79.5	Confident	75 Å²	75	45.9 Å²	45.9	46%	0.46	22%	0.216	S	C	.	.	H	α-helix	trans	-58.2	-40.5	177.4	-56.6	0	0	0	0	111.3	N451 Y452 D458 E459	N451-T455 PolarHBondContact O-N 2.95Å; N451-T455 PolarHBondContact O-OG1 2.98Å; Y452-T455 PolarHBondContact O-N 3.21Å; T455-D458 PolarHBondContact O-N 2.93Å; T455-E459 WeakPolarHBondContact O-CG 3.19Å; T455-E459 PolarHBondContact O-N 3.28Å
456	R	80.9	Confident	79.6	Confident	70 Å²	70	50.9 Å²	50.9	26%	0.264	24%	0.242	S	C	.	.	H	α-helix	trans	-72.5	-31.9	177.8	-66.1	-61.8	-176	-150	-8.7	113.8	Y452 H453 R454 E459 L460 L617	Y452-R456 HydrophobicContact CD1-CG 4.34Å; Y452-R456 HydrophobicContact CE1-CG 4.02Å; Y452-R456 HydrophobicContact CE2-CG 4.39Å; Y452-R456 VanDerWaalsContact O-CG 3.3Å; Y452-R456 WeakPolarHBondContact O-CG 2.97Å; Y452-R456 PolarHBondContact O-N 3.49Å; Y452-R456 PolarHBondContact OH-NE 3.05Å; Y452-R456 VanDerWaalsContact OH-NE 3.09Å; Y452-R456 PolarHBondContact OH-NH2 3.1Å; H453-R456 PolarHBondContact O-N 3.13Å; R454-R456 PolarHBondContact O-N 2.96Å; R456-E459 WeakPolarHBondContact CD-OE2 3.36Å; R456-E459 IonicContact CZ-OE1 3.1Å; R456-E459 IonicContact CZ-OE2 2.88Å; R456-E459 IonicContact NE-OE2 3.86Å; R456-E459 IonicContact NH1-OE1 3.39Å; R456-E459 PolarHBondContact NH1-OE1 2.97Å; R456-E459 IonicContact NH1-OE2 2.72Å; R456-E459 PolarHBondContact NH1-OE2 3.42Å; R456-L460 WeakPolarHBondContact O-CB 3.11Å; R456-L460 PolarHBondContact O-N 3.26Å; R456-L617 HydrophobicContact CB-CD1 4.25Å; R456-L617 HydrophobicContact CB-CD2 3.76Å; R456-L617 HydrophobicContact CG-CD1 3.84Å; R456-L617 HydrophobicContact CG-CD2 4.26Å
457	L	79	Confident	79.8	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-41.6	171	-84	174.8	0	0	0	111.3	H453 R454 L460 R461 L642 Y645 V706	H453-L457 VanDerWaalsContact CD2-CD1 3.47Å; H453-L457 WeakPolarHBondContact CD2-CD1 3.41Å; H453-L457 WeakPolarHBondContact NE2-CD1 3.33Å; H453-L457 WeakPolarHBondContact O-CB 3.44Å; H453-L457 PolarHBondContact O-N 3.03Å; R454-L457 PolarHBondContact O-N 3.26Å; L457-L460 PolarHBondContact O-N 2.96Å; L457-R461 PolarHBondContact O-N 2.85Å; L457-L642 HydrophobicContact CD2-CD2 3.73Å; L457-L642 HydrophobicContact CG-CD2 4.24Å; L457-Y645 HydrophobicContact CD2-CG 4.41Å; L457-V706 HydrophobicContact CB-CG2 4.19Å; L457-V706 HydrophobicContact CD1-CG2 3.92Å
458	D	79.9	Confident	79.5	Confident	62 Å²	62	49.8 Å²	49.8	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-41.5	175	-73.3	-31.3	0	0	0	111.2	R454 T455 R461 M462	R454-D458 PolarHBondContact O-N 2.85Å; T455-D458 PolarHBondContact O-N 2.93Å; D458-R461 WeakPolarHBondContact O-CB 3.38Å; D458-R461 PolarHBondContact O-N 3.46Å; D458-M462 WeakPolarHBondContact O-CG 3.2Å; D458-M462 PolarHBondContact O-N 3.4Å
459	E	82.8	Confident	79.6	Confident	64 Å²	64	49.8 Å²	49.8	30%	0.299	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-42.2	171.9	-74.9	175.5	-171.3	0	0	112.5	T455 R456 R461 M462 F463	T455-E459 WeakPolarHBondContact O-CG 3.19Å; T455-E459 PolarHBondContact O-N 3.28Å; R456-E459 WeakPolarHBondContact CD-OE2 3.36Å; R456-E459 IonicContact CZ-OE1 3.1Å; R456-E459 IonicContact CZ-OE2 2.88Å; R456-E459 IonicContact NE-OE2 3.86Å; R456-E459 IonicContact NH1-OE1 3.39Å; R456-E459 PolarHBondContact NH1-OE1 2.97Å; R456-E459 IonicContact NH1-OE2 2.72Å; R456-E459 PolarHBondContact NH1-OE2 3.42Å; E459-R461 VanDerWaalsContact C-N 3.3Å; E459-R461 PolarHBondContact O-N 3.45Å; E459-M462 CarbonylContact O-C 3.58Å; E459-M462 WeakPolarHBondContact O-CB 3.28Å; E459-M462 PolarHBondContact O-N 2.95Å; E459-M462 VanDerWaalsContact O-N 3.16Å; E459-F463 HydrophobicContact CB-CD2 4.47Å; E459-F463 HydrophobicContact CB-CE2 4.13Å; E459-F463 WeakPolarHBondContact O-CD2 2.91Å; E459-F463 WeakPolarHBondContact O-CG 3.04Å; E459-F463 PolarHBondContact O-N 3.15Å
460	L	82.6	Confident	79.3	Confident	8 Å²	8	56.6 Å²	56.6	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-43.1	175.8	177.7	60	0	0	0	110.8	R456 L457 F463 L464 V614 L642 Y645	R456-L460 WeakPolarHBondContact O-CB 3.11Å; R456-L460 PolarHBondContact O-N 3.26Å; L457-L460 PolarHBondContact O-N 2.96Å; L460-F463 PolarHBondContact O-N 3.4Å; L460-L464 HydrophobicContact CD1-CD1 4.15Å; L460-L464 HydrophobicContact CD1-CG 4.21Å; L460-L464 HydrophobicContact CG-CD1 3.96Å; L460-L464 HydrophobicContact CG-CG 4.47Å; L460-L464 WeakPolarHBondContact O-CB 3.2Å; L460-L464 VanDerWaalsContact O-CG 3.28Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.33Å; L460-V614 HydrophobicContact CD1-CG2 3.45Å; L460-V614 VanDerWaalsContact CD1-CG2 3.45Å; L460-V614 HydrophobicContact CD2-CG2 4.22Å; L460-V614 HydrophobicContact CG-CG2 4.48Å; L460-L642 HydrophobicContact CD2-CD2 4.2Å; L460-Y645 HydrophobicContact CD2-CD1 3.97Å; L460-Y645 HydrophobicContact CG-CD1 4.31Å
461	R	81	Confident	79	Confident	57 Å²	57	55.8 Å²	55.8	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-57.4	-50.3	172.1	177.7	178.9	167.9	-112.2	-15	111	L457 D458 E459 F463 L464 E465 Y645	L457-R461 PolarHBondContact O-N 2.85Å; D458-R461 WeakPolarHBondContact O-CB 3.38Å; D458-R461 PolarHBondContact O-N 3.46Å; E459-R461 VanDerWaalsContact C-N 3.3Å; E459-R461 PolarHBondContact O-N 3.45Å; R461-F463 VanDerWaalsContact C-N 3.29Å; R461-F463 PolarHBondContact O-N 2.94Å; R461-L464 PolarHBondContact O-N 3.41Å; R461-E465 HydrophobicContact CG-CG 4.35Å; R461-E465 IonicContact CZ-OE1 3.81Å; R461-E465 IonicContact CZ-OE2 3.53Å; R461-E465 IonicContact NE-OE1 3.36Å; R461-E465 PolarHBondContact NE-OE1 3.23Å; R461-E465 IonicContact NH2-OE1 3.04Å; R461-E465 PolarHBondContact NH2-OE1 3.43Å; R461-E465 IonicContact NH2-OE2 2.91Å; R461-E465 PolarHBondContact NH2-OE2 2.81Å; R461-E465 WeakPolarHBondContact O-CB 3.34Å; R461-E465 WeakPolarHBondContact O-CG 3.3Å; R461-E465 PolarHBondContact O-N 3.23Å; R461-Y645 HydrophobicContact CB-CE1 4.16Å; R461-Y645 WeakPolarHBondContact CB-OH 3.45Å; R461-Y645 WeakPolarHBondContact CG-OH 3.34Å
462	M	79.4	Confident	78.4	Confident	98 Å²	98	53.6 Å²	53.6	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-38.1	177.7	-72.5	-63.1	-60.2	0	0	112.6	D458 E459 N466	D458-M462 WeakPolarHBondContact O-CG 3.2Å; D458-M462 PolarHBondContact O-N 3.4Å; E459-M462 CarbonylContact O-C 3.58Å; E459-M462 WeakPolarHBondContact O-CB 3.28Å; E459-M462 PolarHBondContact O-N 2.95Å; E459-M462 VanDerWaalsContact O-N 3.16Å; M462-N466 WeakPolarHBondContact O-CB 3.43Å; M462-N466 PolarHBondContact O-N 3.4Å; M462-N466 PolarHBondContact O-ND2 2.95Å
463	F	82.7	Confident	77.5	Confident	96 Å²	96	56.8 Å²	56.8	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-69.4	-43	176.4	-66.5	-50.6	0	0	0	111.9	E459 L460 R461 E465 N466 E467 T610	E459-F463 HydrophobicContact CB-CD2 4.47Å; E459-F463 HydrophobicContact CB-CE2 4.13Å; E459-F463 WeakPolarHBondContact O-CD2 2.91Å; E459-F463 WeakPolarHBondContact O-CG 3.04Å; E459-F463 PolarHBondContact O-N 3.15Å; L460-F463 PolarHBondContact O-N 3.4Å; R461-F463 VanDerWaalsContact C-N 3.29Å; R461-F463 PolarHBondContact O-N 2.94Å; F463-E465 PolarHBondContact O-N 3.12Å; F463-N466 PolarHBondContact O-N 3.28Å; F463-E467 WeakPolarHBondContact O-CB 3.41Å; F463-E467 PolarHBondContact O-N 3.49Å; F463-E467 VanDerWaalsContact O-N 3.11Å; F463-T610 HydrophobicContact CB-CG2 3.46Å; F463-T610 VanDerWaalsContact CB-CG2 3.46Å; F463-T610 HydrophobicContact CG-CG2 4.5Å
464	L	80.2	Confident	76.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.7	-38	177	-74.2	168.2	0	0	0	112.5	L460 R461 N466 E467 W469 Y645 Y646 A649 F653	L460-L464 HydrophobicContact CD1-CD1 4.15Å; L460-L464 HydrophobicContact CD1-CG 4.21Å; L460-L464 HydrophobicContact CG-CD1 3.96Å; L460-L464 HydrophobicContact CG-CG 4.47Å; L460-L464 WeakPolarHBondContact O-CB 3.2Å; L460-L464 VanDerWaalsContact O-CG 3.28Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.33Å; R461-L464 PolarHBondContact O-N 3.41Å; L464-N466 VanDerWaalsContact C-N 3.3Å; L464-N466 PolarHBondContact O-N 3.41Å; L464-E467 PolarHBondContact O-N 3.04Å; L464-W469 HydrophobicContact CD2-CH2 4.04Å; L464-W469 HydrophobicContact CD2-CZ2 4.24Å; L464-Y645 HydrophobicContact CD1-CD1 4.14Å; L464-Y645 HydrophobicContact CD1-CE1 3.87Å; L464-Y646 HydrophobicContact CD1-CD2 4.49Å; L464-Y646 HydrophobicContact CD2-CD2 3.96Å; L464-Y646 HydrophobicContact CD2-CE2 3.76Å; L464-A649 HydrophobicContact CD1-CB 3.8Å; L464-F653 HydrophobicContact CB-CE2 4.29Å; L464-F653 HydrophobicContact CB-CZ 4.45Å
465	E	80.3	Confident	75.4	Confident	33 Å²	33	55.2 Å²	55.2	15%	0.154	28%	0.279	C	S	.	.	H	α-helix	trans	-69.9	-26.2	177.8	-72.1	-178.3	170.5	0	0	112.9	R461 F463 H710 S712	R461-E465 HydrophobicContact CG-CG 4.35Å; R461-E465 IonicContact CZ-OE1 3.81Å; R461-E465 IonicContact CZ-OE2 3.53Å; R461-E465 IonicContact NE-OE1 3.36Å; R461-E465 PolarHBondContact NE-OE1 3.23Å; R461-E465 IonicContact NH2-OE1 3.04Å; R461-E465 PolarHBondContact NH2-OE1 3.43Å; R461-E465 IonicContact NH2-OE2 2.91Å; R461-E465 PolarHBondContact NH2-OE2 2.81Å; R461-E465 WeakPolarHBondContact O-CB 3.34Å; R461-E465 WeakPolarHBondContact O-CG 3.3Å; R461-E465 PolarHBondContact O-N 3.23Å; F463-E465 PolarHBondContact O-N 3.12Å; E465-H710 WeakPolarHBondContact CG-O 3.26Å; E465-S712 WeakPolarHBondContact O-CA 3.25Å; E465-S712 WeakPolarHBondContact O-CB 3.38Å; E465-S712 PolarHBondContact O-OG 3.07Å
466	N	78.8	Confident	74	Confident	106 Å²	106	54.1 Å²	54.1	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	4.5	179.5	-68.8	-52.5	0	0	0	113.5	M462 F463 L464	M462-N466 WeakPolarHBondContact O-CB 3.43Å; M462-N466 PolarHBondContact O-N 3.4Å; M462-N466 PolarHBondContact O-ND2 2.95Å; F463-N466 PolarHBondContact O-N 3.28Å; L464-N466 VanDerWaalsContact C-N 3.3Å; L464-N466 PolarHBondContact O-N 3.41Å
467	E	79.9	Confident	72.7	Confident	16 Å²	16	55.7 Å²	55.7	8%	0.075	29%	0.288	C	S	.	.			trans	-78.8	133.4	-173.4	-170.2	159.1	-167.1	0	0	112.7	F463 L464 W469 T608 T610	F463-E467 WeakPolarHBondContact O-CB 3.41Å; F463-E467 PolarHBondContact O-N 3.49Å; F463-E467 VanDerWaalsContact O-N 3.11Å; L464-E467 PolarHBondContact O-N 3.04Å; E467-W469 HydrophobicContact CG-CD2 4.03Å; E467-W469 HydrophobicContact CG-CE3 4.49Å; E467-W469 HydrophobicContact CG-CG 4.14Å; E467-T608 WeakPolarHBondContact OE1-CB 3.48Å; E467-T608 WeakPolarHBondContact OE1-CG2 3.36Å; E467-T608 PolarHBondContact OE1-OG1 3.11Å; E467-T608 VanDerWaalsContact OE1-OG1 3.09Å; E467-T610 PolarHBondContact OE1-OG1 2.97Å; E467-T610 WeakPolarHBondContact OE2-CB 3.29Å; E467-T610 WeakPolarHBondContact OE2-CG2 3.3Å; E467-T610 PolarHBondContact OE2-OG1 3.36Å
468	T	72.1	Confident	71.8	Confident	60 Å²	60	56.4 Å²	56.4	37%	0.368	29%	0.291	S	S	.	.			trans	-94.8	-3.1	175.5	55.3	0	0	0	0	113.3	E470 L714	T468-E470 VanDerWaalsContact C-N 3.3Å; T468-E470 PolarHBondContact O-N 3.41Å; T468-L714 HydrophobicContact CG2-CD1 4.27Å
469	W	79.6	Confident	70.8	Confident	5 Å²	5	55.8 Å²	55.8	2%	0.019	29%	0.291	C	S	.	.			trans	56.4	39.8	178.8	-57.3	90.8	0	0	0	113.7	L464 E467 T608 I650 F653 F654 E728 V731 A732	L464-W469 HydrophobicContact CD2-CH2 4.04Å; L464-W469 HydrophobicContact CD2-CZ2 4.24Å; E467-W469 HydrophobicContact CG-CD2 4.03Å; E467-W469 HydrophobicContact CG-CE3 4.49Å; E467-W469 HydrophobicContact CG-CG 4.14Å; W469-T608 HydrophobicContact CE3-CG2 3.86Å; W469-T608 HydrophobicContact CZ3-CG2 4.29Å; W469-I650 HydrophobicContact CH2-CD1 4.45Å; W469-I650 HydrophobicContact CH2-CG1 3.97Å; W469-I650 HydrophobicContact CZ3-CG1 4.49Å; W469-F653 AromaticContact CZ2-CD2 3.76Å; W469-F653 HydrophobicContact CZ2-CD2 3.76Å; W469-F653 AromaticContact CZ2-CE2 3.95Å; W469-F653 HydrophobicContact CZ2-CE2 3.95Å; W469-F654 AromaticContact CD1-CZ 3.96Å; W469-F654 HydrophobicContact CD2-CE2 4.16Å; W469-F654 HydrophobicContact CD2-CZ 4.21Å; W469-F654 AromaticContact CE2-CE2 3.84Å; W469-F654 HydrophobicContact CG-CZ 4.18Å; W469-F654 HydrophobicContact CZ2-CE2 4.06Å; W469-F654 AromaticContact NE1-CZ 3.84Å; W469-E728 HydrophobicContact CB-CB 3.91Å; W469-E728 HydrophobicContact CB-CG 4.23Å; W469-V731 WeakPolarHBondContact O-CG1 3.45Å; W469-A732 HydrophobicContact CD2-CB 3.97Å; W469-A732 VanDerWaalsContact CE3-CA 3.46Å; W469-A732 HydrophobicContact CE3-CB 3.32Å; W469-A732 HydrophobicContact CH2-CB 4.05Å; W469-A732 VanDerWaalsContact CZ3-CA 3.49Å; W469-A732 HydrophobicContact CZ3-CB 3.37Å
470	E	71.9	Confident	69.8	Low	147 Å²	147	52.8 Å²	52.8	69%	0.687	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-88	153.7	173.1	-66.1	-173.1	166.5	0	0	112.1	T468 C472	T468-E470 VanDerWaalsContact C-N 3.3Å; T468-E470 PolarHBondContact O-N 3.41Å; E470-C472 PolarHBondContact O-N 2.91Å
471	L	69.4	Low	68.7	Low	66 Å²	66	53.3 Å²	53.3	35%	0.346	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-68.6	124.4	178.1	-78.1	158.4	0	0	0	111.2	I606 V731 V837	L471-I606 HydrophobicContact CD2-CB 4.16Å; L471-I606 HydrophobicContact CD2-CG1 4.16Å; L471-I606 HydrophobicContact CD2-CG2 3.71Å; L471-V731 HydrophobicContact CD2-CG2 4.27Å; L471-V731 HydrophobicContact CG-CG2 4.03Å; L471-V837 HydrophobicContact CD1-CB 4.38Å; L471-V837 HydrophobicContact CD1-CG1 4.27Å; L471-V837 HydrophobicContact CD1-CG2 4.07Å
472	C	66.4	Low	67.5	Low	21 Å²	21	55 Å²	55	14%	0.142	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-75.9	126.1	168.6	-170.5	0	0	0	0	110	E470 V474 L607	E470-C472 PolarHBondContact O-N 2.91Å; C472-V474 HydrophobicContact CB-CG2 4.27Å; C472-V474 PolarHBondContact O-N 3.33Å; C472-L607 HydrophobicContact CB-CB 4.47Å; C472-L607 WeakPolarHBondContact CB-O 3.49Å; C472-L607 PolarHBondContact N-O 2.76Å
473	P	58	Low	66.6	Low	88 Å²	88	50.3 Å²	50.3	57%	0.571	27%	0.267	S	S	*	.			trans	-77.1	90.6	-178.8	30.9	-33.6	0	0	0	110.8
474	V	60.7	Low	65.3	Low	15 Å²	15	49.7 Å²	49.7	9%	0.091	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-104.5	144.6	179.2	-179.8	0	0	0	0	110.4	C472 F478 L607	C472-V474 HydrophobicContact CB-CG2 4.27Å; C472-V474 PolarHBondContact O-N 3.33Å; V474-F478 HydrophobicContact CG1-CB 3.24Å; V474-F478 HydrophobicContact CG1-CD1 3.77Å; V474-F478 HydrophobicContact CG1-CD2 3.53Å; V474-F478 HydrophobicContact CG1-CE1 4.47Å; V474-F478 HydrophobicContact CG1-CE2 4.27Å; V474-F478 HydrophobicContact CG1-CG 3.23Å; V474-L607 HydrophobicContact CB-CD1 4.3Å; V474-L607 HydrophobicContact CG1-CD1 4.35Å; V474-L607 HydrophobicContact CG2-CD1 3.98Å
475	K	56.6	Low	64.6	Low	65 Å²	65	50.5 Å²	50.5	28%	0.283	27%	0.269	S	S	.	.			trans	-58.8	145.2	177.9	-65.7	177.1	176.9	166	0	110.8	N477 F478 D537	K475-N477 VanDerWaalsContact CB-OD1 3.23Å; K475-N477 WeakPolarHBondContact CB-OD1 3.28Å; K475-N477 PolarHBondContact O-N 3.03Å; K475-F478 VanDerWaalsContact O-CB 3.29Å; K475-F478 WeakPolarHBondContact O-CB 3.37Å; K475-F478 PolarHBondContact O-N 3.25Å; K475-F478 VanDerWaalsContact O-N 3.08Å; K475-D537 WeakPolarHBondContact CE-O 3.47Å; K475-D537 PolarHBondContact NZ-O 2.85Å; K475-D537 IonicContact NZ-OD2 3.71Å; K475-D537 PolarHBondContact NZ-OD2 3.01Å
476	S	50.7	Low	63.6	Low	52 Å²	52	49 Å²	49	36%	0.364	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-5.7	-177	53.2	0	0	0	0	115.2
477	N	53.8	Low	62.6	Low	104 Å²	104	46.9 Å²	46.9	56%	0.556	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.5	18	176.9	64	-21.1	0	0	0	112.4	K475 S479 Q482	K475-N477 VanDerWaalsContact CB-OD1 3.23Å; K475-N477 WeakPolarHBondContact CB-OD1 3.28Å; K475-N477 PolarHBondContact O-N 3.03Å; N477-S479 PolarHBondContact O-N 3.16Å; N477-Q482 PolarHBondContact O-NE2 3.44Å
478	F	60.2	Low	61.4	Low	22 Å²	22	47.9 Å²	47.9	10%	0.096	25%	0.252	C	S	.	.			trans	-61.9	125.4	-178.6	176.4	-103.4	0	0	0	111.7	V474 K475 L483 V538 P605 L607 L612 F738	V474-F478 HydrophobicContact CG1-CB 3.24Å; V474-F478 HydrophobicContact CG1-CD1 3.77Å; V474-F478 HydrophobicContact CG1-CD2 3.53Å; V474-F478 HydrophobicContact CG1-CE1 4.47Å; V474-F478 HydrophobicContact CG1-CE2 4.27Å; V474-F478 HydrophobicContact CG1-CG 3.23Å; K475-F478 VanDerWaalsContact O-CB 3.29Å; K475-F478 WeakPolarHBondContact O-CB 3.37Å; K475-F478 PolarHBondContact O-N 3.25Å; K475-F478 VanDerWaalsContact O-N 3.08Å; F478-L483 HydrophobicContact CE2-CD2 4.26Å; F478-L483 HydrophobicContact CE2-CG 4.39Å; F478-L483 HydrophobicContact CZ-CD1 4.34Å; F478-L483 HydrophobicContact CZ-CD2 4.45Å; F478-L483 HydrophobicContact CZ-CG 4.38Å; F478-V538 HydrophobicContact CD2-CG1 4.18Å; F478-V538 HydrophobicContact CE2-CG1 3.81Å; F478-P605 HydrophobicContact CD1-CG 4.45Å; F478-L607 HydrophobicContact CD1-CD1 4.12Å; F478-L607 HydrophobicContact CE1-CD1 4.07Å; F478-L612 HydrophobicContact CE1-CD1 4.48Å; F478-L612 HydrophobicContact CE2-CD1 4.34Å; F478-L612 HydrophobicContact CZ-CD1 3.69Å; F478-F738 HydrophobicContact CD1-CZ 4.37Å; F478-F738 HydrophobicContact CE1-CZ 4.3Å
479	S	60.1	Low	60.6	Low	48 Å²	48	46.1 Å²	46.1	34%	0.336	24%	0.24	S	C	.	.			trans	-126.7	140.2	172.4	175.5	0	0	0	0	107.8	N477 L481 Q482	N477-S479 PolarHBondContact O-N 3.16Å; S479-L481 PolarHBondContact O-N 3.01Å; S479-Q482 WeakPolarHBondContact O-CB 3.5Å; S479-Q482 PolarHBondContact O-N 3.08Å
480	I	62.2	Low	59	Low	2 Å²	2	51 Å²	51	1%	0.01	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-52	-31.4	177.8	-75.4	-169	0	0	0	112.6	Q482 L483 F486 I615 Q742	I480-Q482 PolarHBondContact O-N 3.11Å; I480-L483 WeakPolarHBondContact O-CB 3.36Å; I480-L483 PolarHBondContact O-N 2.65Å; I480-L483 VanDerWaalsContact O-N 3.08Å; I480-F486 HydrophobicContact CG2-CB 4.26Å; I480-F486 HydrophobicContact CG2-CD1 3.6Å; I480-F486 HydrophobicContact CG2-CD2 3.37Å; I480-F486 HydrophobicContact CG2-CE1 3.61Å; I480-F486 HydrophobicContact CG2-CE2 3.38Å; I480-F486 HydrophobicContact CG2-CG 3.46Å; I480-F486 VanDerWaalsContact CG2-CG 3.46Å; I480-F486 HydrophobicContact CG2-CZ 3.48Å; I480-F486 VanDerWaalsContact CG2-CZ 3.48Å; I480-I615 HydrophobicContact CD1-CD1 4.31Å; I480-I615 HydrophobicContact CD1-CG1 4.44Å; I480-I615 HydrophobicContact CD1-CG2 3.59Å; I480-I615 HydrophobicContact CG1-CG2 3.88Å; I480-I615 HydrophobicContact CG2-CG2 4.33Å; I480-Q742 HydrophobicContact CD1-CB 3.41Å; I480-Q742 VanDerWaalsContact CD1-CB 3.41Å; I480-Q742 HydrophobicContact CD1-CG 3.37Å; I480-Q742 HydrophobicContact CG1-CG 4.16Å; I480-Q742 VanDerWaalsContact CG1-OE1 3.23Å
481	L	59.2	Low	57.6	Low	18 Å²	18	51.3 Å²	51.3	9%	0.094	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-63.5	-19.5	180	-61.3	174.1	0	0	0	113.5	S479 L483 F486 M489 E490 F745	S479-L481 PolarHBondContact O-N 3.01Å; L481-L483 VanDerWaalsContact C-N 3.28Å; L481-F486 HydrophobicContact CD2-CB 4.48Å; L481-M489 HydrophobicContact CD2-CB 4.06Å; L481-E490 HydrophobicContact CB-CG 4.44Å; L481-F745 HydrophobicContact CD1-CZ 4.27Å; L481-F745 HydrophobicContact CD2-CE1 4.48Å; L481-F745 HydrophobicContact CG-CE1 4.46Å
482	Q	56.2	Low	55.8	Low	92 Å²	92	52.1 Å²	52.1	43%	0.43	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-76.8	-14.3	176.7	-66.3	169.7	-20	0	0	113	N477 S479 I480	N477-Q482 PolarHBondContact O-NE2 3.44Å; S479-Q482 WeakPolarHBondContact O-CB 3.5Å; S479-Q482 PolarHBondContact O-N 3.08Å; I480-Q482 PolarHBondContact O-N 3.11Å
483	L	60.6	Low	54	Low	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-73.2	139.2	174.4	-66.3	172.6	0	0	0	109.6	F478 I480 L481 E485 F486 V538 L612 I615 R616	F478-L483 HydrophobicContact CE2-CD2 4.26Å; F478-L483 HydrophobicContact CE2-CG 4.39Å; F478-L483 HydrophobicContact CZ-CD1 4.34Å; F478-L483 HydrophobicContact CZ-CD2 4.45Å; F478-L483 HydrophobicContact CZ-CG 4.38Å; I480-L483 WeakPolarHBondContact O-CB 3.36Å; I480-L483 PolarHBondContact O-N 2.65Å; I480-L483 VanDerWaalsContact O-N 3.08Å; L481-L483 VanDerWaalsContact C-N 3.28Å; L483-E485 PolarHBondContact O-N 2.87Å; L483-E485 VanDerWaalsContact O-N 3.08Å; L483-F486 HydrophobicContact CB-CD2 3.98Å; L483-F486 HydrophobicContact CD1-CD2 4.16Å; L483-F486 HydrophobicContact CD1-CE2 4.1Å; L483-F486 PolarHBondContact O-N 3.09Å; L483-V538 HydrophobicContact CD2-CG2 4.16Å; L483-L612 HydrophobicContact CD2-CD1 4.42Å; L483-I615 HydrophobicContact CD1-CG2 3.7Å; L483-R616 HydrophobicContact CD1-CG 4.23Å; L483-R616 HydrophobicContact CD2-CG 4.33Å
484	H	54.8	Low	52.5	Low	83 Å²	83	60.2 Å²	60.2	38%	0.384	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-55.3	-32.8	179.6	-173.4	-90	0	0	0	111.4	F486 K487 E536	H484-F486 PolarHBondContact O-N 2.95Å; H484-K487 PolarHBondContact O-N 3.38Å; H484-E536 HydrophobicContact CB-CG 4.35Å; H484-E536 WeakPolarHBondContact CB-OE1 3.29Å; H484-E536 PolarHBondContact N-OE1 3.45Å
485	E	64.3	Low	51	Low	18 Å²	18	65.8 Å²	65.8	8%	0.084	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-65.5	-23.8	179.5	-60.7	91.6	165.9	0	0	113.8	L483 F488 K620 Q623	L483-E485 PolarHBondContact O-N 2.87Å; L483-E485 VanDerWaalsContact O-N 3.08Å; E485-F488 WeakPolarHBondContact O-CD1 3.19Å; E485-F488 WeakPolarHBondContact O-CE1 3.08Å; E485-K620 HydrophobicContact CG-CG 3.76Å; E485-Q623 VanDerWaalsContact CA-NE2 3.32Å; E485-Q623 WeakPolarHBondContact O-CG 3.43Å; E485-Q623 PolarHBondContact O-NE2 2.85Å
486	F	59.2	Low	49.5	Very low	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-104.6	0.7	-176.9	-67.6	-92.7	0	0	0	114.3	I480 L481 L483 H484 F488 M489 I615 V618 G619 M622 L746	I480-F486 HydrophobicContact CG2-CB 4.26Å; I480-F486 HydrophobicContact CG2-CD1 3.6Å; I480-F486 HydrophobicContact CG2-CD2 3.37Å; I480-F486 HydrophobicContact CG2-CE1 3.61Å; I480-F486 HydrophobicContact CG2-CE2 3.38Å; I480-F486 HydrophobicContact CG2-CG 3.46Å; I480-F486 VanDerWaalsContact CG2-CG 3.46Å; I480-F486 HydrophobicContact CG2-CZ 3.48Å; I480-F486 VanDerWaalsContact CG2-CZ 3.48Å; L481-F486 HydrophobicContact CD2-CB 4.48Å; L483-F486 HydrophobicContact CB-CD2 3.98Å; L483-F486 HydrophobicContact CD1-CD2 4.16Å; L483-F486 HydrophobicContact CD1-CE2 4.1Å; L483-F486 PolarHBondContact O-N 3.09Å; H484-F486 PolarHBondContact O-N 2.95Å; F486-F488 PolarHBondContact O-N 3.33Å; F486-M489 HydrophobicContact CD1-SD 3.98Å; F486-M489 WeakPolarHBondContact O-CB 3.34Å; F486-M489 PolarHBondContact O-N 2.99Å; F486-I615 HydrophobicContact CE2-CG2 4.02Å; F486-I615 WeakPolarHBondContact CE2-O 3.43Å; F486-I615 HydrophobicContact CZ-CG2 4.31Å; F486-V618 HydrophobicContact CZ-CG1 4.31Å; F486-G619 VanDerWaalsContact CE2-CA 3.45Å; F486-M622 HydrophobicContact CD1-SD 4.43Å; F486-M622 HydrophobicContact CE1-SD 3.75Å; F486-L746 HydrophobicContact CD1-CD2 4.35Å; F486-L746 HydrophobicContact CE1-CD1 4.09Å; F486-L746 HydrophobicContact CE1-CD2 3.95Å
487	K	57.8	Low	48.4	Very low	62 Å²	62	71.5 Å²	71.5	27%	0.27	39%	0.387	S	S	.	.	H	α-helix	trans	-55.1	-25	177.4	-74.1	-172.8	180	-177.2	0	113.8	H484 M489 E490 E534	H484-K487 PolarHBondContact O-N 3.38Å; K487-M489 PolarHBondContact O-N 3.06Å; K487-E490 PolarHBondContact O-N 3.07Å; K487-E534 IonicContact NZ-OE2 3.89Å; K487-E534 PolarHBondContact NZ-OE2 2.8Å
488	F	56.1	Low	47	Very low	37 Å²	37	72.1 Å²	72.1	16%	0.162	40%	0.399	C	S	.	.	H	α-helix	trans	-62.7	-25.7	174.5	71.3	-94.5	0	0	0	113.4	E485 F486 S492 M622 Q623 N626 H749	E485-F488 WeakPolarHBondContact O-CD1 3.19Å; E485-F488 WeakPolarHBondContact O-CE1 3.08Å; F486-F488 PolarHBondContact O-N 3.33Å; F488-S492 PolarHBondContact O-OG 3.36Å; F488-S492 VanDerWaalsContact O-OG 3.12Å; F488-M622 HydrophobicContact CE1-CB 4.12Å; F488-M622 HydrophobicContact CE2-CB 4.44Å; F488-M622 HydrophobicContact CE2-CE 4.49Å; F488-M622 HydrophobicContact CZ-CB 3.53Å; F488-M622 HydrophobicContact CZ-CE 4.13Å; F488-Q623 HydrophobicContact CD1-CG 3.43Å; F488-Q623 VanDerWaalsContact CD1-CG 3.43Å; F488-Q623 HydrophobicContact CE1-CG 3.59Å; F488-Q623 HydrophobicContact CG-CG 4.42Å; F488-N626 WeakPolarHBondContact CD2-ND2 3.44Å; F488-N626 WeakPolarHBondContact CE2-ND2 3.46Å; F488-H749 AromaticContact CE2-NE2 3.82Å
489	M	54.6	Low	45.7	Very low	24 Å²	24	77.1 Å²	77.1	12%	0.118	43%	0.434	C	S	.	.	H	α-helix	trans	-82.3	-26.5	178.2	-62	-174.6	60.2	0	0	112.7	L481 F486 K487 S492 M622 L746 H749	L481-M489 HydrophobicContact CD2-CB 4.06Å; F486-M489 HydrophobicContact CD1-SD 3.98Å; F486-M489 WeakPolarHBondContact O-CB 3.34Å; F486-M489 PolarHBondContact O-N 2.99Å; K487-M489 PolarHBondContact O-N 3.06Å; M489-S492 PolarHBondContact O-N 3.48Å; M489-S492 PolarHBondContact O-OG 2.96Å; M489-M622 HydrophobicContact SD-CE 3.78Å; M489-L746 HydrophobicContact CE-CD2 4.12Å; M489-L746 HydrophobicContact SD-CD2 4Å; M489-H749 HydrophobicContact CE-CB 3.83Å
490	E	46.4	Very low	44	Very low	107 Å²	107	80 Å²	80	50%	0.5	45%	0.454	S	S	.	.	H	α-helix	trans	-67.4	-37.5	175.1	-83.5	-170.9	149.7	0	0	111.6	L481 K487 S492 R493	L481-E490 HydrophobicContact CB-CG 4.44Å; K487-E490 PolarHBondContact O-N 3.07Å; E490-S492 PolarHBondContact O-N 3.14Å; E490-R493 PolarHBondContact O-N 3.43Å
491	Q	41.5	Very low	42.4	Very low	153 Å²	153	89.1 Å²	89.1	72%	0.715	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.8	176.9	-70.8	175.8	0.9	0	0	113.6
492	S	32	Very low	40.7	Very low	84 Å²	84	97.2 Å²	97.2	59%	0.587	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.6	177.6	1.6	0	0	0	0	113.8	F488 M489 E490	F488-S492 PolarHBondContact O-OG 3.36Å; F488-S492 VanDerWaalsContact O-OG 3.12Å; M489-S492 PolarHBondContact O-N 3.48Å; M489-S492 PolarHBondContact O-OG 2.96Å; E490-S492 PolarHBondContact O-N 3.14Å
493	R	28.6	Very low	39.3	Very low	173 Å²	173	98.7 Å²	98.7	65%	0.653	55%	0.549	S	S	*	.	S	Bend	trans	-88.3	115.5	170.3	-78.4	-174.2	173.4	-169.3	-0.6	109.5	E490	E490-R493 PolarHBondContact O-N 3.43Å
494	S	27.1	Very low	37.6	Very low	105 Å²	105	104.8 Å²	104.8	73%	0.734	59%	0.586	S	S	*	*			trans	-53.3	144	169.9	41.5	0	0	0	0	111.5	S496	S494-S496 PolarHBondContact O-N 2.84Å; S494-S496 VanDerWaalsContact O-N 3.15Å
495	P	29.8	Very low	36.2	Very low	132 Å²	132	106.2 Å²	106.2	86%	0.857	61%	0.605	S	S	*	*			trans	-72.5	110.2	-177.6	28.1	-31.7	0	0	0	109.6	V497	P495-V497 PolarHBondContact O-N 3.43Å
496	S	24.8	Very low	34.4	Very low	109 Å²	109	111.3 Å²	111.3	76%	0.762	64%	0.638	S	S	*	*			trans	-88.6	105.6	170.8	67.1	0	0	0	0	110.4	S494	S494-S496 PolarHBondContact O-N 2.84Å; S494-S496 VanDerWaalsContact O-N 3.15Å
497	V	27.3	Very low	32.9	Very low	129 Å²	129	116.9 Å²	116.9	78%	0.782	68%	0.676	S	S	*	*			trans	73	93.7	147.2	-165.5	0	0	0	0	117.7	P495	P495-V497 PolarHBondContact O-N 3.43Å
498	S	24.1	Very low	31.5	Very low	116 Å²	116	119 Å²	119	81%	0.811	70%	0.699	S	S	*	*				-160.2	136.6	122.5	-78.6	0	0	0	0	110
499	P	32.2	Very low	30.2	Very low	127 Å²	127	126.2 Å²	126.2	83%	0.825	73%	0.73	S	S	*	*			trans	-94.7	114.8	-173.2	34.4	-26.5	0	0	0	110.2
500	S	26.2	Very low	28.9	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	77%	0.766	S	S	*	*			trans	169.8	108.3	142.7	-177.6	0	0	0	0	109.8
501	K	26.8	Very low	28.3	Very low	193 Å²	193	130.4 Å²	130.4	84%	0.839	77%	0.765	S	S	*	*			trans	143.4	91.2	155.3	-81.4	172.9	-176.7	-176.6	0	107.3	P503	K501-P503 WeakPolarHBondContact O-CD 3.36Å
502	Q	24.1	Very low	28.3	Very low	189 Å²	189	126 Å²	126	88%	0.883	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-60.7	126.5	167.6	-69.3	-174.3	-28.1	0	0	109
503	P	26.6	Very low	28.9	Very low	123 Å²	123	123.4 Å²	123.4	80%	0.799	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-82.4	128.7	148.6	29.7	-20.5	0	0	0	107.7	K501 S505	K501-P503 WeakPolarHBondContact O-CD 3.36Å; P503-S505 PolarHBondContact O-N 3.04Å
504	V	24.5	Very low	29.7	Very low	127 Å²	127	115.5 Å²	115.5	77%	0.77	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-55.3	120.1	174.8	178.7	0	0	0	0	108.7	T506	V504-T506 PolarHBondContact O-N 3.43Å
505	S	27	Very low	30.6	Very low	113 Å²	113	116.4 Å²	116.4	79%	0.79	69%	0.691	S	S	*	*			trans	-68.9	92.7	171.1	53.4	0	0	0	0	109.7	P503 S507	P503-S505 PolarHBondContact O-N 3.04Å; S505-S507 PolarHBondContact O-N 2.79Å
506	T	25.7	Very low	31.2	Very low	126 Å²	126	115.7 Å²	115.7	77%	0.773	68%	0.676	S	S	*	*			trans	-73.6	109.6	153.7	21.8	0	0	0	0	107.8	V504 S508	V504-T506 PolarHBondContact O-N 3.43Å; T506-S508 VanDerWaalsContact C-N 3.28Å; T506-S508 PolarHBondContact O-N 3.18Å
507	S	28.1	Very low	32.4	Very low	116 Å²	116	112.7 Å²	112.7	81%	0.811	65%	0.648	S	S	*	*			trans	-60.9	88	163.8	54.5	0	0	0	0	109.4	S505 K509	S505-S507 PolarHBondContact O-N 2.79Å; S507-K509 PolarHBondContact O-N 2.63Å
508	S	28	Very low	33	Very low	107 Å²	107	108.3 Å²	108.3	75%	0.748	62%	0.623	S	S	*	*			trans	-73.6	106.1	165.5	53.2	0	0	0	0	107.5	T506 T510	T506-S508 VanDerWaalsContact C-N 3.28Å; T506-S508 PolarHBondContact O-N 3.18Å; S508-T510 PolarHBondContact O-N 3.15Å
509	K	28.1	Very low	33.5	Very low	188 Å²	188	108.5 Å²	108.5	82%	0.817	62%	0.624	S	S	*	*			trans	-46.9	134.4	153.1	-73.1	176.9	175.8	178.7	0	106.9	S507 V511	S507-K509 PolarHBondContact O-N 2.63Å; K509-V511 VanDerWaalsContact C-N 3.31Å; K509-V511 PolarHBondContact O-N 2.89Å
510	T	28.3	Very low	33.6	Very low	141 Å²	141	105.2 Å²	105.2	87%	0.865	61%	0.614	S	S	*	*			trans	-56.8	97.3	170.4	45.9	0	0	0	0	108	S508	S508-T510 PolarHBondContact O-N 3.15Å
511	V	32.8	Very low	34.2	Very low	79 Å²	79	102 Å²	102	48%	0.479	60%	0.597	S	S	.	*			trans	-65.2	129.5	169.3	179.2	0	0	0	0	105.9	K509 E515 Q516	K509-V511 VanDerWaalsContact C-N 3.31Å; K509-V511 PolarHBondContact O-N 2.89Å; V511-E515 HydrophobicContact CG1-CB 3.72Å; V511-Q516 HydrophobicContact CG1-CB 4.23Å
512	T	41.5	Very low	35	Very low	59 Å²	59	94 Å²	94	36%	0.362	56%	0.564	S	S	.	*			trans	-61.8	144.8	179.2	56.5	0	0	0	0	110	F514 E515 Q516	T512-F514 PolarHBondContact O-N 3.06Å; T512-F514 VanDerWaalsContact O-N 3.16Å; T512-E515 PolarHBondContact N-OE2 2.93Å; T512-E515 PolarHBondContact O-N 3.34Å; T512-E515 VanDerWaalsContact OG1-CB 3.27Å; T512-E515 WeakPolarHBondContact OG1-CB 3.43Å; T512-E515 WeakPolarHBondContact OG1-CG 3.49Å; T512-E515 PolarHBondContact OG1-N 3.34Å; T512-E515 PolarHBondContact OG1-OE2 2.89Å; T512-Q516 PolarHBondContact O-N 2.91Å
513	L	46.3	Very low	35.8	Very low	31 Å²	31	85 Å²	85	16%	0.162	52%	0.522	C	S	.	.	H	α-helix	trans	-57.9	-32.2	178.6	-77.1	158.7	0	0	0	110.7	E428 Q516 Y517	E428-L513 VanDerWaalsContact OE2-CB 3.31Å; E428-L513 WeakPolarHBondContact OE2-CB 3.5Å; E428-L513 PolarHBondContact OE2-N 2.83Å; L513-Q516 PolarHBondContact O-N 2.8Å; L513-Y517 HydrophobicContact CD2-CD2 4.24Å; L513-Y517 HydrophobicContact CD2-CE2 3.71Å; L513-Y517 VanDerWaalsContact O-CD2 3.24Å; L513-Y517 WeakPolarHBondContact O-CD2 3.27Å; L513-Y517 PolarHBondContact O-N 3.29Å
514	F	44.5	Very low	36.8	Very low	7 Å²	7	79.9 Å²	79.9	3%	0.031	49%	0.487	C	S	.	.	H	α-helix	trans	-65.6	-42.8	174.1	-82.7	-89.8	0	0	0	113.1	W333 L337 Y340 F429 T512 Q516 C518	W333-F514 HydrophobicContact CE3-CZ 4.36Å; W333-F514 HydrophobicContact CH2-CD1 4.05Å; W333-F514 HydrophobicContact CH2-CD2 4.07Å; W333-F514 AromaticContact CH2-CE1 3.83Å; W333-F514 HydrophobicContact CH2-CE1 3.83Å; W333-F514 AromaticContact CH2-CE2 3.85Å; W333-F514 HydrophobicContact CH2-CE2 3.85Å; W333-F514 HydrophobicContact CH2-CG 4.16Å; W333-F514 AromaticContact CH2-CZ 3.71Å; W333-F514 HydrophobicContact CH2-CZ 3.71Å; W333-F514 HydrophobicContact CZ2-CE1 4.44Å; W333-F514 HydrophobicContact CZ3-CD2 4.4Å; W333-F514 HydrophobicContact CZ3-CE1 4.02Å; W333-F514 AromaticContact CZ3-CE2 3.74Å; W333-F514 HydrophobicContact CZ3-CE2 3.74Å; W333-F514 AromaticContact CZ3-CZ 3.51Å; W333-F514 HydrophobicContact CZ3-CZ 3.51Å; L337-F514 HydrophobicContact CD1-CD1 4Å; L337-F514 HydrophobicContact CD1-CE1 4.14Å; Y340-F514 AromaticContact CD1-CD1 3.71Å; Y340-F514 HydrophobicContact CD1-CD1 3.71Å; Y340-F514 HydrophobicContact CD1-CE1 4.37Å; Y340-F514 HydrophobicContact CD1-CG 4.43Å; Y340-F514 HydrophobicContact CD2-CD1 4.14Å; Y340-F514 HydrophobicContact CD2-CE1 4.37Å; Y340-F514 HydrophobicContact CE1-CB 4.14Å; Y340-F514 HydrophobicContact CE1-CD1 4.15Å; Y340-F514 HydrophobicContact CE1-CG 4.44Å; Y340-F514 AromaticContact CG-CD1 3.71Å; Y340-F514 HydrophobicContact CG-CD1 3.71Å; Y340-F514 AromaticContact CG-CE1 3.96Å; Y340-F514 HydrophobicContact CG-CE1 3.96Å; Y340-F514 HydrophobicContact CG-CG 4.48Å; F429-F514 HydrophobicContact CB-CE2 4.37Å; F429-F514 HydrophobicContact CB-CZ 4.47Å; F429-F514 HydrophobicContact CD2-CE1 4.35Å; F429-F514 HydrophobicContact CD2-CE2 4.26Å; F429-F514 AromaticContact CD2-CZ 3.67Å; F429-F514 HydrophobicContact CD2-CZ 3.67Å; F429-F514 HydrophobicContact CE2-CZ 4.43Å; T512-F514 PolarHBondContact O-N 3.06Å; T512-F514 VanDerWaalsContact O-N 3.16Å; F514-Q516 VanDerWaalsContact C-N 3.29Å; F514-Q516 PolarHBondContact O-N 3.18Å; F514-C518 WeakPolarHBondContact O-CB 3.46Å; F514-C518 PolarHBondContact O-N 2.93Å; F514-C518 PolarHBondContact O-SG 3.34Å
515	E	45.2	Very low	37.7	Very low	123 Å²	123	79.5 Å²	79.5	58%	0.575	48%	0.477	S	S	*	.	H	α-helix	trans	-65.3	-33.1	173	-81.5	170.1	140.7	0	0	112.5	V511 T512	V511-E515 HydrophobicContact CG1-CB 3.72Å; T512-E515 PolarHBondContact N-OE2 2.93Å; T512-E515 PolarHBondContact O-N 3.34Å; T512-E515 VanDerWaalsContact OG1-CB 3.27Å; T512-E515 WeakPolarHBondContact OG1-CB 3.43Å; T512-E515 WeakPolarHBondContact OG1-CG 3.49Å; T512-E515 PolarHBondContact OG1-N 3.34Å; T512-E515 PolarHBondContact OG1-OE2 2.89Å
516	Q	43.3	Very low	38.4	Very low	118 Å²	118	80.1 Å²	80.1	55%	0.551	47%	0.47	S	S	*	.	H	α-helix	trans	-77.3	-30.1	-176.1	-146.5	171.9	11.5	0	0	113.2	V511 T512 L513 F514	V511-Q516 HydrophobicContact CG1-CB 4.23Å; T512-Q516 PolarHBondContact O-N 2.91Å; L513-Q516 PolarHBondContact O-N 2.8Å; F514-Q516 VanDerWaalsContact C-N 3.29Å; F514-Q516 PolarHBondContact O-N 3.18Å
517	Y	49.3	Very low	38.7	Very low	46 Å²	46	82.6 Å²	82.6	18%	0.18	47%	0.473	C	S	.	.	H	α-helix	trans	-106.8	-2.9	-179.8	-68.3	-71.8	0	0	0	114.4	R421 L513 S519 G520 G521 P523	R421-Y517 PolarHBondContact NH2-OH 3.03Å; R421-Y517 VanDerWaalsContact NH2-OH 3.1Å; L513-Y517 HydrophobicContact CD2-CD2 4.24Å; L513-Y517 HydrophobicContact CD2-CE2 3.71Å; L513-Y517 VanDerWaalsContact O-CD2 3.24Å; L513-Y517 WeakPolarHBondContact O-CD2 3.27Å; L513-Y517 PolarHBondContact O-N 3.29Å; Y517-S519 PolarHBondContact O-N 3.28Å; Y517-S519 VanDerWaalsContact O-N 3.11Å; Y517-G520 PolarHBondContact O-N 2.91Å; Y517-G521 WeakPolarHBondContact CD1-O 3.29Å; Y517-P523 HydrophobicContact CD2-CG 3.92Å; Y517-P523 HydrophobicContact CE2-CB 4.48Å; Y517-P523 HydrophobicContact CE2-CG 4.09Å; Y517-P523 HydrophobicContact CG-CG 4.28Å
518	C	40.3	Very low	38.9	Very low	37 Å²	37	80.8 Å²	80.8	25%	0.25	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.9	176.2	-100.3	0	0	0	0	114.3	R341 F514	R341-C518 PolarHBondContact NH2-O 2.87Å; F514-C518 WeakPolarHBondContact O-CB 3.46Å; F514-C518 PolarHBondContact O-N 2.93Å; F514-C518 PolarHBondContact O-SG 3.34Å
519	S	34.9	Very low	38.7	Very low	119 Å²	119	82.1 Å²	82.1	83%	0.832	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	4.6	-177.2	43.1	0	0	0	0	114.9	Y517	Y517-S519 PolarHBondContact O-N 3.28Å; Y517-S519 VanDerWaalsContact O-N 3.11Å
520	G	33.7	Very low	39	Very low	59 Å²	59	81.7 Å²	81.7	61%	0.608	46%	0.464	S	S	*	.	S	Bend	trans	132.5	131.7	173.5	0	0	0	0	0	113.5	Y517	Y517-G520 PolarHBondContact O-N 2.91Å
521	G	40.3	Very low	39.1	Very low	40 Å²	40	82.6 Å²	82.6	41%	0.412	46%	0.456	S	S	.	.			trans	127.8	145.5	177.6	0	0	0	0	0	112	Y517	Y517-G521 WeakPolarHBondContact CD1-O 3.29Å
522	N	42.4	Very low	39	Very low	26 Å²	26	86.2 Å²	86.2	14%	0.139	47%	0.473	C	S	.	.			trans	-103.2	131.5	177.6	-123.8	-36.8	0	0	0	110	K330 F524 E525	K330-N522 WeakPolarHBondContact CG-ND2 3.49Å; N522-F524 PolarHBondContact O-N 3.23Å; N522-E525 HydrophobicContact CB-CB 4.07Å; N522-E525 HydrophobicContact CB-CG 3.83Å; N522-E525 PolarHBondContact O-N 3.47Å
523	P	41.9	Very low	38.6	Very low	0 Å²	0	92.3 Å²	92.3	0%	0	50%	0.497	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.2	167.6	-21.4	31.8	0	0	0	112.5	W333 R421 Y517	W333-P523 HydrophobicContact CD2-CG 3.93Å; W333-P523 HydrophobicContact CE3-CG 4.22Å; W333-P523 HydrophobicContact CG-CG 4.49Å; W333-P523 HydrophobicContact CH2-CG 4.13Å; W333-P523 HydrophobicContact CZ2-CG 3.84Å; W333-P523 HydrophobicContact CZ3-CG 4.31Å; R421-P523 WeakPolarHBondContact CD-O 3.32Å; R421-P523 PolarHBondContact NE-O 3.43Å; R421-P523 PolarHBondContact NH1-O 3.43Å; R421-P523 PolarHBondContact NH2-O 2.89Å; R421-P523 VanDerWaalsContact NH2-O 3.16Å; Y517-P523 HydrophobicContact CD2-CG 3.92Å; Y517-P523 HydrophobicContact CE2-CB 4.48Å; Y517-P523 HydrophobicContact CE2-CG 4.09Å; Y517-P523 HydrophobicContact CG-CG 4.28Å
524	F	47.1	Very low	38	Very low	16 Å²	16	97.8 Å²	97.8	7%	0.07	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	8.5	179.5	-55.7	-77.4	0	0	0	113.2	C329 K330 W333 I418 R421 L422 N522	C329-F524 HydrophobicContact CB-CD1 3.77Å; C329-F524 HydrophobicContact CB-CD2 3.9Å; C329-F524 HydrophobicContact CB-CE1 3.65Å; C329-F524 HydrophobicContact CB-CE2 3.79Å; C329-F524 HydrophobicContact CB-CG 3.89Å; C329-F524 HydrophobicContact CB-CZ 3.67Å; C329-F524 WeakPolarHBondContact O-CE2 3.46Å; K330-F524 HydrophobicContact CG-CB 3.78Å; K330-F524 HydrophobicContact CG-CD2 4.37Å; K330-F524 HydrophobicContact CG-CG 4.47Å; W333-F524 HydrophobicContact CB-CE2 4.13Å; I418-F524 HydrophobicContact CG2-CD1 3.99Å; I418-F524 HydrophobicContact CG2-CE1 4.03Å; R421-F524 HydrophobicContact CB-CE1 4.3Å; R421-F524 HydrophobicContact CG-CE1 4.49Å; L422-F524 HydrophobicContact CB-CE1 4.42Å; L422-F524 HydrophobicContact CB-CZ 4.25Å; L422-F524 HydrophobicContact CD1-CZ 4.13Å; N522-F524 PolarHBondContact O-N 3.23Å
525	E	42.5	Very low	37.5	Very low	119 Å²	119	104 Å²	104	56%	0.556	56%	0.561	S	S	*	*	S	Bend	trans	-82.4	124.1	170.2	-90	178.4	158.8	0	0	110.9	N522 Q527	N522-E525 HydrophobicContact CB-CB 4.07Å; N522-E525 HydrophobicContact CB-CG 3.83Å; N522-E525 PolarHBondContact O-N 3.47Å; E525-Q527 PolarHBondContact O-N 3.25Å
526	I	43.1	Very low	37.5	Very low	126 Å²	126	101.8 Å²	101.8	65%	0.646	55%	0.551	S	S	*	*			trans	-57.8	115.2	-172	-67.8	155.8	0	0	0	110.6	F414 A528	F414-I526 HydrophobicContact CZ-CG1 4.19Å; I526-A528 HydrophobicContact CG2-CB 3.55Å; I526-A528 VanDerWaalsContact CG2-N 3.33Å; I526-A528 PolarHBondContact O-N 2.93Å
527	Q	31.3	Very low	37.3	Very low	177 Å²	177	101.3 Å²	101.3	83%	0.827	55%	0.552	S	S	*	*			trans	-77.9	73.3	156.6	-77.8	-176.6	1.2	0	0	108.5	E525 N529	E525-Q527 PolarHBondContact O-N 3.25Å; Q527-N529 PolarHBondContact O-N 2.76Å
528	A	32.1	Very low	37.3	Very low	79 Å²	79	99.8 Å²	99.8	65%	0.653	55%	0.547	S	S	*	.			trans	-76	77.9	160.2	0	0	0	0	0	106.7	I526	I526-A528 HydrophobicContact CG2-CB 3.55Å; I526-A528 VanDerWaalsContact CG2-N 3.33Å; I526-A528 PolarHBondContact O-N 2.93Å
529	N	24.6	Very low	37.8	Very low	135 Å²	135	102.9 Å²	102.9	72%	0.722	56%	0.561	S	S	*	*			trans	-130.2	104.9	168.7	-105.9	-9.2	0	0	0	109.8	Q527	Q527-N529 PolarHBondContact O-N 2.76Å
530	H	32.7	Very low	38.1	Very low	178 Å²	178	98.9 Å²	98.9	82%	0.824	54%	0.535	S	S	*	.	S	Bend	trans	54.3	84.5	152.2	-75.8	-73.8	0	0	0	117.8
531	K	30.9	Very low	38	Very low	160 Å²	160	100.6 Å²	100.6	70%	0.696	54%	0.538	S	S	*	.			trans	-141.1	11	150.7	-76.9	-163.9	179.6	170	0	115.6
532	D	30.7	Very low	37.6	Very low	156 Å²	156	106.2 Å²	106.2	83%	0.834	56%	0.558	S	S	*	*			trans	-106.8	65	179.7	-64.2	-29.3	0	0	0	111.2
533	E	33.3	Very low	37.1	Very low	187 Å²	187	107.2 Å²	107.2	87%	0.874	58%	0.575	S	S	*	*			trans	-164	63.3	160	-118.8	176	-162	0	0	111.4
534	E	34.1	Very low	36.5	Very low	145 Å²	145	118.4 Å²	118.4	68%	0.678	62%	0.619	S	S	*	*			trans	-130.9	97.6	155	-79.3	-174.3	170.3	0	0	108	K487 E536	K487-E534 IonicContact NZ-OE2 3.89Å; K487-E534 PolarHBondContact NZ-OE2 2.8Å; E534-E536 PolarHBondContact O-N 3.49Å
535	T	34.8	Very low	35.5	Very low	139 Å²	139	127.5 Å²	127.5	85%	0.853	66%	0.661	S	S	*	*			trans	-51.9	120.4	170.8	-15.2	0	0	0	0	109.5	D537	T535-D537 PolarHBondContact O-N 3.38Å
536	E	43.2	Very low	34.7	Very low	76 Å²	76	126.7 Å²	126.7	36%	0.355	67%	0.669	S	S	.	*			trans	-63.5	99.4	177.1	-73.9	-158.2	153.9	0	0	111.1	H484 E534 V538 R616	H484-E536 HydrophobicContact CB-CG 4.35Å; H484-E536 WeakPolarHBondContact CB-OE1 3.29Å; H484-E536 PolarHBondContact N-OE1 3.45Å; E534-E536 PolarHBondContact O-N 3.49Å; E536-V538 HydrophobicContact CB-CG2 4.12Å; E536-V538 PolarHBondContact O-N 3.29Å; E536-R616 IonicContact OE2-CZ 3.74Å; E536-R616 IonicContact OE2-NE 3.85Å; E536-R616 IonicContact OE2-NH2 3.88Å; E536-R616 PolarHBondContact OE2-NH2 3.38Å
537	D	40.7	Very low	34.1	Very low	108 Å²	108	128.5 Å²	128.5	58%	0.578	68%	0.68	S	S	*	*			trans	-87.2	59.8	178.8	-159.1	36.5	0	0	0	111.7	K475 T535	K475-D537 WeakPolarHBondContact CE-O 3.47Å; K475-D537 PolarHBondContact NZ-O 2.85Å; K475-D537 IonicContact NZ-OD2 3.71Å; K475-D537 PolarHBondContact NZ-OD2 3.01Å; T535-D537 PolarHBondContact O-N 3.38Å
538	V	48.8	Very low	33.8	Very low	13 Å²	13	128.2 Å²	128.2	8%	0.079	68%	0.679	C	S	.	*			trans	-84.9	-26.8	-176.6	176.3	0	0	0	0	112.4	F478 L483 E536	F478-V538 HydrophobicContact CD2-CG1 4.18Å; F478-V538 HydrophobicContact CE2-CG1 3.81Å; L483-V538 HydrophobicContact CD2-CG2 4.16Å; E536-V538 HydrophobicContact CB-CG2 4.12Å; E536-V538 PolarHBondContact O-N 3.29Å
539	L	50.4	Low	33.6	Very low	103 Å²	103	133.3 Å²	133.3	54%	0.539	69%	0.689	S	S	.	*	B	Isolated β-bridge	trans	-87.7	144.6	-178.7	-61.6	176.7	0	0	0	110.9	S541	L539-S541 PolarHBondContact O-N 3.43Å; L539-S541 VanDerWaalsContact O-N 3.08Å
540	A	40.5	Very low	33.7	Very low	35 Å²	35	136.3 Å²	136.3	29%	0.289	70%	0.698	S	S	.	*			trans	-67.3	108.2	171.4	0	0	0	0	0	109.3	N542	A540-N542 PolarHBondContact O-N 2.76Å
541	S	33.4	Very low	33.3	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	70%	0.701	S	S	*	*			trans	-58.1	129.6	173.9	-172	0	0	0	0	109.9	L539 G543	L539-S541 PolarHBondContact O-N 3.43Å; L539-S541 VanDerWaalsContact O-N 3.08Å; S541-G543 VanDerWaalsContact C-N 3.35Å; S541-G543 PolarHBondContact O-N 3.15Å
542	N	31.4	Very low	33.1	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	71%	0.706	S	S	*	*			trans	-68.4	94.5	174.1	-91.2	-14.8	0	0	0	109.1	A540	A540-N542 PolarHBondContact O-N 2.76Å
543	G	31.5	Very low	32.8	Very low	48 Å²	48	132.2 Å²	132.2	50%	0.495	70%	0.702	S	S	.	*	S	Bend	trans	32.3	101.1	156.6	0	0	0	0	0	118.7	S541	S541-G543 VanDerWaalsContact C-N 3.35Å; S541-G543 PolarHBondContact O-N 3.15Å
544	Y	29.4	Very low	32.5	Very low	235 Å²	235	133.6 Å²	133.6	92%	0.922	70%	0.701	S	S	*	*				-157.1	85.6	126.9	-83	-74.8	0	0	0	107.4	S546	Y544-S546 PolarHBondContact O-N 3.33Å
545	E	25.3	Very low	32.1	Very low	206 Å²	206	134.9 Å²	134.9	96%	0.963	71%	0.707	S	S	*	*			trans	-76	97.8	158.4	-83	-179.5	166.2	0	0	106.6
546	S	27.1	Very low	31.6	Very low	102 Å²	102	135.5 Å²	135.5	71%	0.713	70%	0.7	S	S	*	*			trans	-89.7	108.8	159.3	179.9	0	0	0	0	107.3	Y544 E548	Y544-S546 PolarHBondContact O-N 3.33Å; S546-E548 VanDerWaalsContact C-N 3.31Å; S546-E548 PolarHBondContact O-N 2.92Å
547	D	29.1	Very low	30.8	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	72%	0.722	S	S	*	*			trans	-66.3	80.8	173	-154.1	14.4	0	0	0	109.4
548	E	26.5	Very low	30.1	Very low	171 Å²	171	143.6 Å²	143.6	80%	0.799	73%	0.732	S	S	*	*			trans	-136.3	105.4	165.1	-74.2	-160.7	167.9	0	0	111.7	S546	S546-E548 VanDerWaalsContact C-N 3.31Å; S546-E548 PolarHBondContact O-N 2.92Å
549	Q	26.4	Very low	29.2	Very low	186 Å²	186	147.5 Å²	147.5	87%	0.869	76%	0.76	S	S	*	*			trans	1	124.9	155.2	-96.4	134.9	6.6	0	0	118.8	K551	Q549-K551 PolarHBondContact O-N 2.91Å; Q549-K551 VanDerWaalsContact O-N 3.16Å
550	E	28.7	Very low	28.4	Very low	197 Å²	197	150.2 Å²	150.2	92%	0.921	78%	0.775	S	S	*	*			trans	-38.3	116.2	151	-70.3	179.1	147.6	0	0	111.9
551	K	24.3	Very low	28	Very low	201 Å²	201	153.4 Å²	153.4	87%	0.874	80%	0.795	S	S	*	*			trans	-128.7	105.2	151.3	-94.7	-176.3	178.4	173.7	0	109.5	Q549	Q549-K551 PolarHBondContact O-N 2.91Å; Q549-K551 VanDerWaalsContact O-N 3.16Å
552	S	25.3	Very low	28.6	Very low	116 Å²	116	156.8 Å²	156.8	81%	0.811	81%	0.806	S	S	*	*			trans	-52.6	130.6	153.8	160.8	0	0	0	0	110.6
553	A	24.5	Very low	28.9	Very low	91 Å²	91	154.2 Å²	154.2	75%	0.752	80%	0.795	S	S	*	*			trans	-166.2	128.8	145.2	0	0	0	0	0	111.7
554	Y	27.3	Very low	29.3	Very low	217 Å²	217	156.7 Å²	156.7	85%	0.851	80%	0.803	S	S	*	*			trans	-22.1	160.9	159.1	-77.2	-100	0	0	0	120.1
555	Q	25.7	Very low	29.7	Very low	171 Å²	171	154.3 Å²	154.3	80%	0.799	80%	0.8	S	S	*	*			trans	102.4	102.5	161	-68	175.6	-44.9	0	0	114.9
556	E	23.9	Very low	30.8	Very low	153 Å²	153	153.4 Å²	153.4	72%	0.715	80%	0.796	S	S	*	*				84.9	119.9	79.6	-89.4	-166.8	148.4	0	0	113.3
557	Y	27	Very low	31.7	Very low	207 Å²	207	155.9 Å²	155.9	81%	0.812	80%	0.8	S	S	*	*			trans	35	124.3	151.4	-59.5	-83.1	0	0	0	120.1
558	D	26	Very low	32.4	Very low	147 Å²	147	157.4 Å²	157.4	79%	0.786	80%	0.799	S	S	*	*				148.4	149.8	100.9	-163.1	24.2	0	0	0	113.5
559	S	29.5	Very low	33.2	Very low	95 Å²	95	160.2 Å²	160.2	66%	0.664	80%	0.802	S	S	*	*			trans	80	113.6	149.8	-87.7	0	0	0	0	122.2
560	D	33.9	Very low	33.6	Very low	160 Å²	160	158.1 Å²	158.1	86%	0.856	80%	0.797	S	S	*	*			trans	-12.3	134.6	143.9	-83.4	-24.8	0	0	0	117.2
561	S	31.5	Very low	33.9	Very low	101 Å²	101	160.2 Å²	160.2	71%	0.706	80%	0.798	S	S	*	*			trans	-162.3	91.8	148	169.8	0	0	0	0	111.6	V563	S561-V563 PolarHBondContact O-N 3.25Å
562	D	46.9	Very low	34.2	Very low	167 Å²	167	156.2 Å²	156.2	89%	0.893	79%	0.791	S	S	*	*			trans	-63.8	104.3	156.2	-80.5	-36.6	0	0	0	110.4
563	V	37.5	Very low	34.7	Very low	102 Å²	102	158.3 Å²	158.3	62%	0.618	79%	0.793	S	S	*	*			trans	-140.6	119.9	160.3	-174.4	0	0	0	0	109.9	S561	S561-V563 PolarHBondContact O-N 3.25Å
564	P	40.7	Very low	35.3	Very low	100 Å²	100	161.1 Å²	161.1	65%	0.649	79%	0.79	S	S	*	*			trans	-63.3	143.1	177.4	-22.3	33.1	0	0	0	113.8	E566	P564-E566 PolarHBondContact O-N 2.91Å
565	E	37.8	Very low	35.6	Very low	185 Å²	185	159.1 Å²	159.1	86%	0.864	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-63.8	-6.5	-174.6	-72.5	-162.4	136.7	0	0	116	L567	E565-L567 VanDerWaalsContact C-N 3.27Å; E565-L567 PolarHBondContact O-N 3.24Å
566	E	47.4	Very low	36.2	Very low	188 Å²	188	158 Å²	158	88%	0.879	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-75.3	-8.9	-174.6	-64.9	-174.8	166.2	0	0	114.4	P564	P564-E566 PolarHBondContact O-N 2.91Å
567	L	45.5	Very low	36.9	Very low	154 Å²	154	154.6 Å²	154.6	81%	0.806	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-103.7	10.1	-176.3	-97.7	144.2	0	0	0	115.3	E565	E565-L567 VanDerWaalsContact C-N 3.27Å; E565-L567 PolarHBondContact O-N 3.24Å
568	K	44.2	Very low	37.1	Very low	196 Å²	196	152 Å²	152	85%	0.852	80%	0.8	S	S	*	*	S	Bend	trans	-96.2	11.3	-180	-86	-175.9	-178.6	172.3	0	116
569	R	43.3	Very low	37.5	Very low	230 Å²	230	151.7 Å²	151.7	87%	0.868	80%	0.803	S	S	*	*			trans	-123.4	98.4	171.2	-64.7	-160.8	-170.2	-158.5	5	110.3
570	D	35.3	Very low	37.4	Very low	142 Å²	142	152.6 Å²	152.6	76%	0.759	81%	0.806	S	S	*	*			trans	178	108	135.2	-89.5	-15.3	0	0	0	109
571	Y	33.9	Very low	37.1	Very low	241 Å²	241	150.6 Å²	150.6	95%	0.945	80%	0.8	S	S	*	*			trans	-128.3	105.9	148.6	-95.9	-86.3	0	0	0	107.6
572	V	32	Very low	37.1	Very low	118 Å²	118	155.8 Å²	155.8	72%	0.715	81%	0.809	S	S	*	*			trans	-70.8	123.6	160.8	177.2	0	0	0	0	106.4	E574	V572-E574 HydrophobicContact CG1-CG 4.3Å
573	D	35.8	Very low	36	Very low	160 Å²	160	152.4 Å²	152.4	86%	0.856	80%	0.799	S	S	*	*			trans	-113.4	110.1	162.6	-164.2	13.6	0	0	0	108.4
574	E	36.3	Very low	35.5	Very low	150 Å²	150	154.2 Å²	154.2	70%	0.701	81%	0.81	S	S	*	*			trans	-80.3	144.4	170.6	-77.7	-174.1	144.3	0	0	109.2	V572	V572-E574 HydrophobicContact CG1-CG 4.3Å
575	Q	33.8	Very low	34.8	Very low	175 Å²	175	155 Å²	155	82%	0.818	82%	0.818	S	S	*	*			trans	97.3	76.4	163.1	-51.4	179.6	14.7	0	0	117.2
576	T	37.1	Very low	34.6	Very low	148 Å²	148	157.3 Å²	157.3	91%	0.908	82%	0.819	S	S	*	*				-150.7	106.5	119.3	-16.4	0	0	0	0	109.5	D578	T576-D578 PolarHBondContact O-N 2.84Å; T576-D578 VanDerWaalsContact O-N 3.14Å
577	G	39.6	Very low	33.6	Very low	81 Å²	81	156.4 Å²	156.4	84%	0.835	82%	0.815	S	S	*	*			trans	-81.2	84.9	-176.9	0	0	0	0	0	112.3
578	D	30.9	Very low	33.1	Very low	153 Å²	153	155.5 Å²	155.5	82%	0.818	82%	0.816	S	S	*	*			trans	-127.6	125.1	157.8	-103.6	-29.5	0	0	0	109.6	T576 P580	T576-D578 PolarHBondContact O-N 2.84Å; T576-D578 VanDerWaalsContact O-N 3.14Å; D578-P580 WeakPolarHBondContact O-CD 3.45Å
579	V	35.6	Very low	32.6	Very low	139 Å²	139	154 Å²	154	84%	0.842	82%	0.816	S	S	*	*			trans	-92.2	123	178.9	176.9	0	0	0	0	108.5
580	P	27.3	Very low	31.8	Very low	114 Å²	114	152 Å²	152	74%	0.74	81%	0.813	S	S	*	*			trans	-116.9	106.5	155.2	21.8	-2.5	0	0	0	110.4	D578	D578-P580 WeakPolarHBondContact O-CD 3.45Å
581	V	26.3	Very low	31.4	Very low	119 Å²	119	149.2 Å²	149.2	72%	0.721	81%	0.805	S	S	*	*			trans	35.5	106.9	133.3	-169.3	0	0	0	0	116.5	S583	V581-S583 PolarHBondContact O-N 3.4Å
582	K	31.6	Very low	31.2	Very low	209 Å²	209	150 Å²	150	91%	0.909	81%	0.807	S	S	*	*			trans	-52.4	102.4	154.8	-76	176.7	174.9	175.5	0	110
583	S	25.1	Very low	31	Very low	96 Å²	96	152.6 Å²	152.6	67%	0.671	81%	0.808	S	S	*	*			trans	-116.3	103.8	152.2	62.6	0	0	0	0	108.1	V581 S585	V581-S583 PolarHBondContact O-N 3.4Å; S583-S585 PolarHBondContact O-N 2.88Å
584	V	26.5	Very low	30.7	Very low	141 Å²	141	154.1 Å²	154.1	86%	0.855	81%	0.807	S	S	*	*			trans	-56.5	103	169.7	178.1	0	0	0	0	108.2	R586	V584-R586 PolarHBondContact O-N 2.96Å; V584-R586 VanDerWaalsContact O-N 3.1Å
585	S	25.1	Very low	30.3	Very low	116 Å²	116	152.2 Å²	152.2	81%	0.811	81%	0.81	S	S	*	*			trans	-73.9	97.6	167.6	13.4	0	0	0	0	108.6	S583 E587	S583-S585 PolarHBondContact O-N 2.88Å; S585-E587 PolarHBondContact O-N 3.31Å; S585-E587 VanDerWaalsContact O-N 3.08Å
586	R	34.7	Very low	30	Very low	233 Å²	233	151.4 Å²	151.4	88%	0.879	81%	0.811	S	S	*	*			trans	-32.2	98.7	160.1	-174.1	-176.4	-171.6	174.2	2.6	113	V584	V584-R586 PolarHBondContact O-N 2.96Å; V584-R586 VanDerWaalsContact O-N 3.1Å
587	E	25.7	Very low	29.8	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.794	80%	0.799	S	S	*	*			trans	-164.1	50.3	158	-111.9	164.6	-151	0	0	113.6	S585	S585-E587 PolarHBondContact O-N 3.31Å; S585-E587 VanDerWaalsContact O-N 3.08Å
588	T	36	Very low	29.5	Very low	135 Å²	135	151.9 Å²	151.9	83%	0.828	78%	0.784	S	S	*	*			trans	-80.7	126.3	146.2	43.8	0	0	0	0	108
589	L	33.9	Very low	30	Very low	163 Å²	163	149.4 Å²	149.4	85%	0.853	77%	0.77	S	S	*	*			trans	98.6	78.5	-176.7	-56.4	166.4	0	0	0	114.5
590	K	26.1	Very low	29.9	Very low	189 Å²	189	149.9 Å²	149.9	82%	0.822	77%	0.768	S	S	*	*			trans	-162.2	110.7	138.5	-105.4	161.3	-169.3	-179.3	0	111.4
591	S	27.5	Very low	30.6	Very low	84 Å²	84	151.2 Å²	151.2	59%	0.587	76%	0.762	S	S	*	*			trans	63.7	103.7	140.7	-169.9	0	0	0	0	118.3	K593	S591-K593 PolarHBondContact O-N 3.4Å; S591-K593 WeakPolarHBondContact OG-CG 3.29Å
592	R	29.3	Very low	31.6	Very low	258 Å²	258	150.5 Å²	150.5	97%	0.974	76%	0.758	S	S	*	*			trans	-48.4	88.8	140	-82	175	162.8	172	-6	108.8	K594	R592-K594 PolarHBondContact O-N 3.3Å
593	K	26.9	Very low	32.6	Very low	172 Å²	172	146.5 Å²	146.5	75%	0.748	75%	0.747	S	S	*	*			trans	-85.3	99.5	160.8	-78.4	-172	173.3	-179.8	0	106.9	S591 S595	S591-K593 PolarHBondContact O-N 3.4Å; S591-K593 WeakPolarHBondContact OG-CG 3.29Å; K593-S595 PolarHBondContact O-N 3.15Å
594	K	30.1	Very low	34.1	Very low	192 Å²	192	144 Å²	144	84%	0.835	73%	0.732	S	S	*	*			trans	-51	126.5	153.5	-80.6	-177.6	170.6	-172.6	0	106	R592 D596	R592-K594 PolarHBondContact O-N 3.3Å; K594-D596 PolarHBondContact O-N 2.84Å; K594-D596 VanDerWaalsContact O-N 3.09Å
595	S	27.7	Very low	35.9	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	70%	0.701	S	S	*	*			trans	-55.4	113.2	177.5	45.5	0	0	0	0	109.6	K593 Y597	K593-S595 PolarHBondContact O-N 3.15Å; S595-Y597 PolarHBondContact O-N 2.79Å
596	D	27.9	Very low	38	Very low	158 Å²	158	134.2 Å²	134.2	85%	0.845	67%	0.667	S	S	*	*			trans	-64	75.1	165.8	-70.7	-47.6	0	0	0	108.6	K594 S598	K594-D596 PolarHBondContact O-N 2.84Å; K594-D596 VanDerWaalsContact O-N 3.09Å; D596-S598 PolarHBondContact O-N 3.28Å
597	Y	32.7	Very low	40	Very low	164 Å²	164	123.1 Å²	123.1	64%	0.643	63%	0.625	S	S	*	*			trans	-72.1	120.2	165.1	-159.2	-102	0	0	0	107.1	S595 L599	S595-Y597 PolarHBondContact O-N 2.79Å; Y597-L599 PolarHBondContact O-N 3.06Å
598	S	32.9	Very low	42.5	Very low	76 Å²	76	115 Å²	115	53%	0.531	59%	0.587	S	S	.	*			trans	-43.5	99.2	-173.6	49.4	0	0	0	0	114.8	D596 N600	D596-S598 PolarHBondContact O-N 3.28Å; S598-N600 PolarHBondContact O-N 2.99Å; S598-N600 VanDerWaalsContact O-N 3.14Å
599	L	41.9	Very low	44.7	Very low	100 Å²	100	113.1 Å²	113.1	52%	0.524	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	7.5	163.8	-73.4	167.1	0	0	0	113.4	Y597	Y597-L599 PolarHBondContact O-N 3.06Å
600	N	33.2	Very low	47	Very low	149 Å²	149	105.6 Å²	105.6	80%	0.797	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	8.6	-172.8	-81.8	-9.9	0	0	0	115.3	S598 V602	S598-N600 PolarHBondContact O-N 2.99Å; S598-N600 VanDerWaalsContact O-N 3.14Å; N600-V602 PolarHBondContact O-N 3.3Å
601	K	41.4	Very low	49.6	Very low	143 Å²	143	96.6 Å²	96.6	62%	0.622	49%	0.494	S	S	*	.			trans	-82.4	112.8	165.6	-81.4	-174.9	179.2	177.6	0	109.2	N603 R838	K601-N603 PolarHBondContact O-N 3.39Å; K601-R838 PolarHBondContact O-NH1 3.2Å
602	V	48.6	Very low	52.2	Low	104 Å²	104	92.9 Å²	92.9	63%	0.63	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-11.6	-166.2	178.9	0	0	0	0	114.9	N600 R838	N600-V602 PolarHBondContact O-N 3.3Å; V602-R838 VanDerWaalsContact O-CZ 3.25Å; V602-R838 PolarHBondContact O-NH1 3.41Å; V602-R838 PolarHBondContact O-NH2 3.02Å
603	N	50.9	Low	54.6	Low	125 Å²	125	82.8 Å²	82.8	67%	0.668	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	15.2	-166	-67.2	-5.7	0	0	0	117.4	K601	K601-N603 PolarHBondContact O-N 3.39Å
604	A	56.8	Low	57.4	Low	44 Å²	44	74.7 Å²	74.7	36%	0.364	40%	0.398	S	S	.	.			trans	-74.7	128.3	174.8	0	0	0	0	0	111.7
605	P	64.6	Low	59.9	Low	30 Å²	30	65.8 Å²	65.8	20%	0.195	36%	0.359	C	S	.	.			trans	-68.9	144	178.2	28.4	-33.6	0	0	0	111.3	F478 L607 F738	F478-P605 HydrophobicContact CD1-CG 4.45Å; P605-L607 HydrophobicContact CB-CD1 4.14Å; P605-L607 HydrophobicContact CB-CD2 4.48Å; P605-L607 HydrophobicContact CB-CG 4.1Å; P605-L607 HydrophobicContact CG-CD1 3.81Å; P605-L607 HydrophobicContact CG-CG 4.28Å; P605-F738 HydrophobicContact CB-CD2 3.77Å; P605-F738 HydrophobicContact CB-CE2 3.57Å; P605-F738 HydrophobicContact CB-CZ 4.29Å; P605-F738 HydrophobicContact CG-CE2 4.19Å
606	I	70.3	Confident	62.4	Low	20 Å²	20	63.6 Å²	63.6	10%	0.103	33%	0.334	C	S	.	.			trans	-84.6	112.8	174.6	-67	167.6	0	0	0	107.2	L471 V731 E734 S735 R838 P840	L471-I606 HydrophobicContact CD2-CB 4.16Å; L471-I606 HydrophobicContact CD2-CG1 4.16Å; L471-I606 HydrophobicContact CD2-CG2 3.71Å; I606-V731 HydrophobicContact CG2-CB 4.46Å; I606-V731 HydrophobicContact CG2-CG1 4.44Å; I606-V731 HydrophobicContact CG2-CG2 4.33Å; I606-E734 HydrophobicContact CB-CB 4.05Å; I606-E734 HydrophobicContact CD1-CB 4.22Å; I606-E734 HydrophobicContact CD1-CG 4.3Å; I606-E734 HydrophobicContact CG2-CB 3.88Å; I606-S735 PolarHBondContact O-OG 3.45Å; I606-R838 VanDerWaalsContact CD1-O 3.28Å; I606-R838 WeakPolarHBondContact CD1-O 3.41Å; I606-P840 HydrophobicContact CD1-CG 3.92Å
607	L	74.8	Confident	65	Low	1 Å²	1	57 Å²	57	1%	0.005	30%	0.299	C	S	.	.			trans	-135.6	148.3	-173.6	-61.1	171.6	0	0	0	111.2	C472 V474 F478 P605 S735 F738	C472-L607 HydrophobicContact CB-CB 4.47Å; C472-L607 WeakPolarHBondContact CB-O 3.49Å; C472-L607 PolarHBondContact N-O 2.76Å; V474-L607 HydrophobicContact CB-CD1 4.3Å; V474-L607 HydrophobicContact CG1-CD1 4.35Å; V474-L607 HydrophobicContact CG2-CD1 3.98Å; F478-L607 HydrophobicContact CD1-CD1 4.12Å; F478-L607 HydrophobicContact CE1-CD1 4.07Å; P605-L607 HydrophobicContact CB-CD1 4.14Å; P605-L607 HydrophobicContact CB-CD2 4.48Å; P605-L607 HydrophobicContact CB-CG 4.1Å; P605-L607 HydrophobicContact CG-CD1 3.81Å; P605-L607 HydrophobicContact CG-CG 4.28Å; L607-S735 WeakPolarHBondContact CA-OG 3.46Å; L607-F738 HydrophobicContact CD1-CE1 4.27Å; L607-F738 HydrophobicContact CD1-CZ 4.36Å; L607-F738 HydrophobicContact CD2-CB 4.09Å; L607-F738 HydrophobicContact CD2-CD1 3.1Å; L607-F738 HydrophobicContact CD2-CD2 4.16Å; L607-F738 HydrophobicContact CD2-CE1 3.35Å; L607-F738 HydrophobicContact CD2-CE2 4.38Å; L607-F738 HydrophobicContact CD2-CG 3.52Å; L607-F738 HydrophobicContact CD2-CZ 4Å; L607-F738 HydrophobicContact CG-CD1 4.45Å; L607-F738 HydrophobicContact CG-CE1 4.43Å
608	T	79.9	Confident	67.3	Low	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.			trans	-102.3	163.4	165.1	65.9	0	0	0	0	112.2	E467 W469 T610 T611 L612 V731 S735	E467-T608 WeakPolarHBondContact OE1-CB 3.48Å; E467-T608 WeakPolarHBondContact OE1-CG2 3.36Å; E467-T608 PolarHBondContact OE1-OG1 3.11Å; E467-T608 VanDerWaalsContact OE1-OG1 3.09Å; W469-T608 HydrophobicContact CE3-CG2 3.86Å; W469-T608 HydrophobicContact CZ3-CG2 4.29Å; T608-T610 VanDerWaalsContact C-N 3.31Å; T608-T610 PolarHBondContact O-N 3.27Å; T608-T610 PolarHBondContact OG1-OG1 3.26Å; T608-T611 PolarHBondContact N-OG1 3.46Å; T608-T611 PolarHBondContact O-N 3.12Å; T608-T611 PolarHBondContact O-OG1 3.11Å; T608-T611 PolarHBondContact OG1-N 3.3Å; T608-T611 VanDerWaalsContact OG1-N 3.16Å; T608-T611 PolarHBondContact OG1-OG1 3.4Å; T608-L612 PolarHBondContact O-N 3.2Å; T608-V731 HydrophobicContact CG2-CG1 3.39Å; T608-S735 PolarHBondContact N-OG 3.45Å
609	N	80.5	Confident	69.5	Low	95 Å²	95	45.7 Å²	45.7	51%	0.508	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-36.3	174.3	-168.9	42.6	0	0	0	112.7	L612 N613	N609-L612 PolarHBondContact O-N 3.47Å; N609-N613 PolarHBondContact O-N 3.23Å; N609-N613 PolarHBondContact O-ND2 3.49Å
610	T	83	Confident	71.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-64.1	-45.4	174.3	39.9	0	0	0	0	112.1	F463 E467 T608 L612 N613 V614	F463-T610 HydrophobicContact CB-CG2 3.46Å; F463-T610 VanDerWaalsContact CB-CG2 3.46Å; F463-T610 HydrophobicContact CG-CG2 4.5Å; E467-T610 PolarHBondContact OE1-OG1 2.97Å; E467-T610 WeakPolarHBondContact OE2-CB 3.29Å; E467-T610 WeakPolarHBondContact OE2-CG2 3.3Å; E467-T610 PolarHBondContact OE2-OG1 3.36Å; T608-T610 VanDerWaalsContact C-N 3.31Å; T608-T610 PolarHBondContact O-N 3.27Å; T608-T610 PolarHBondContact OG1-OG1 3.26Å; T610-L612 VanDerWaalsContact C-N 3.29Å; T610-L612 PolarHBondContact O-N 2.82Å; T610-N613 PolarHBondContact O-N 3.28Å; T610-N613 VanDerWaalsContact O-N 3.14Å; T610-V614 WeakPolarHBondContact O-CG2 3.46Å; T610-V614 PolarHBondContact O-N 3.47Å
611	T	81.3	Confident	73.5	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-39.1	177.1	51.3	0	0	0	0	112.6	T608 V614 I615 Y646 S735	T608-T611 PolarHBondContact N-OG1 3.46Å; T608-T611 PolarHBondContact O-N 3.12Å; T608-T611 PolarHBondContact O-OG1 3.11Å; T608-T611 PolarHBondContact OG1-N 3.3Å; T608-T611 VanDerWaalsContact OG1-N 3.16Å; T608-T611 PolarHBondContact OG1-OG1 3.4Å; T611-V614 PolarHBondContact O-N 3.28Å; T611-I615 VanDerWaalsContact O-CG1 3.28Å; T611-I615 WeakPolarHBondContact O-CG1 3.4Å; T611-I615 PolarHBondContact O-N 3.36Å; T611-Y646 HydrophobicContact CG2-CE1 3.84Å; T611-Y646 HydrophobicContact CG2-CE2 4Å; T611-Y646 WeakPolarHBondContact CG2-OH 3.46Å; T611-S735 VanDerWaalsContact CG2-CB 3.48Å
612	L	80.9	Confident	75.1	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-43.3	174.6	-173.5	65.5	0	0	0	111.8	F478 L483 T608 N609 T610 I615 R616	F478-L612 HydrophobicContact CE1-CD1 4.48Å; F478-L612 HydrophobicContact CE2-CD1 4.34Å; F478-L612 HydrophobicContact CZ-CD1 3.69Å; L483-L612 HydrophobicContact CD2-CD1 4.42Å; T608-L612 PolarHBondContact O-N 3.2Å; N609-L612 PolarHBondContact O-N 3.47Å; T610-L612 VanDerWaalsContact C-N 3.29Å; T610-L612 PolarHBondContact O-N 2.82Å; L612-I615 PolarHBondContact O-N 3.22Å; L612-R616 WeakPolarHBondContact O-CG 3.47Å; L612-R616 PolarHBondContact O-N 2.89Å
613	N	81.3	Confident	76.2	Confident	45 Å²	45	27.2 Å²	27.2	24%	0.241	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-37.7	176	-73.8	-21.4	0	0	0	112.6	N609 T610 R616 L617	N609-N613 PolarHBondContact O-N 3.23Å; N609-N613 PolarHBondContact O-ND2 3.49Å; T610-N613 PolarHBondContact O-N 3.28Å; T610-N613 VanDerWaalsContact O-N 3.14Å; N613-R616 PolarHBondContact O-N 2.81Å; N613-L617 WeakPolarHBondContact O-CB 3.42Å; N613-L617 PolarHBondContact O-N 2.89Å
614	V	84.9	Confident	77.1	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.018	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-43.1	173.4	172.2	0	0	0	0	110.5	L460 T610 T611 L617 V618 L739	L460-V614 HydrophobicContact CD1-CG2 3.45Å; L460-V614 VanDerWaalsContact CD1-CG2 3.45Å; L460-V614 HydrophobicContact CD2-CG2 4.22Å; L460-V614 HydrophobicContact CG-CG2 4.48Å; T610-V614 WeakPolarHBondContact O-CG2 3.46Å; T610-V614 PolarHBondContact O-N 3.47Å; T611-V614 PolarHBondContact O-N 3.28Å; V614-L617 WeakPolarHBondContact O-CB 3.28Å; V614-L617 PolarHBondContact O-N 3.28Å; V614-V618 WeakPolarHBondContact O-CG2 3.44Å; V614-V618 PolarHBondContact O-N 3.35Å; V614-L739 HydrophobicContact CG1-CD1 4.19Å; V614-L739 HydrophobicContact CG1-CD2 4.22Å
615	I	82	Confident	77.8	Confident	4 Å²	4	19.3 Å²	19.3	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-63.8	-44.9	176.8	-70.4	167.6	0	0	0	111.3	I480 L483 F486 T611 L612 L617 V618 G619 F738 L739 Q742	I480-I615 HydrophobicContact CD1-CD1 4.31Å; I480-I615 HydrophobicContact CD1-CG1 4.44Å; I480-I615 HydrophobicContact CD1-CG2 3.59Å; I480-I615 HydrophobicContact CG1-CG2 3.88Å; I480-I615 HydrophobicContact CG2-CG2 4.33Å; L483-I615 HydrophobicContact CD1-CG2 3.7Å; F486-I615 HydrophobicContact CE2-CG2 4.02Å; F486-I615 WeakPolarHBondContact CE2-O 3.43Å; F486-I615 HydrophobicContact CZ-CG2 4.31Å; T611-I615 VanDerWaalsContact O-CG1 3.28Å; T611-I615 WeakPolarHBondContact O-CG1 3.4Å; T611-I615 PolarHBondContact O-N 3.36Å; L612-I615 PolarHBondContact O-N 3.22Å; I615-L617 VanDerWaalsContact C-N 3.31Å; I615-L617 PolarHBondContact O-N 2.86Å; I615-V618 WeakPolarHBondContact O-CB 3.48Å; I615-V618 PolarHBondContact O-N 3.27Å; I615-G619 PolarHBondContact O-N 3.28Å; I615-F738 HydrophobicContact CD1-CD1 4.14Å; I615-F738 HydrophobicContact CD1-CE1 3.69Å; I615-L739 HydrophobicContact CD1-CD1 4.26Å; I615-L739 HydrophobicContact CG1-CD1 3.66Å; I615-Q742 HydrophobicContact CD1-CG 4.43Å
616	R	81.6	Confident	78	Confident	63 Å²	63	20.4 Å²	20.4	24%	0.238	10%	0.1	C	C	.	.	H	α-helix	trans	-58.2	-43.6	173.7	-75.8	178.5	164.7	157.8	-7.6	111.5	L483 E536 L612 N613 V618 G619 K620	L483-R616 HydrophobicContact CD1-CG 4.23Å; L483-R616 HydrophobicContact CD2-CG 4.33Å; E536-R616 IonicContact OE2-CZ 3.74Å; E536-R616 IonicContact OE2-NE 3.85Å; E536-R616 IonicContact OE2-NH2 3.88Å; E536-R616 PolarHBondContact OE2-NH2 3.38Å; L612-R616 WeakPolarHBondContact O-CG 3.47Å; L612-R616 PolarHBondContact O-N 2.89Å; N613-R616 PolarHBondContact O-N 2.81Å; R616-V618 PolarHBondContact O-N 3.16Å; R616-G619 WeakPolarHBondContact O-CA 3.47Å; R616-G619 PolarHBondContact O-N 2.95Å; R616-G619 VanDerWaalsContact O-N 3.13Å; R616-K620 WeakPolarHBondContact O-CG 3.11Å; R616-K620 PolarHBondContact O-N 3.44Å
617	L	81.1	Confident	77.9	Confident	20 Å²	20	23.2 Å²	23.2	11%	0.105	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-41.6	177	-177.8	62.5	0	0	0	112.1	Y452 R456 N613 V614 I615 G619 K620 Y621 L642	Y452-L617 HydrophobicContact CE1-CD1 4.23Å; R456-L617 HydrophobicContact CB-CD1 4.25Å; R456-L617 HydrophobicContact CB-CD2 3.76Å; R456-L617 HydrophobicContact CG-CD1 3.84Å; R456-L617 HydrophobicContact CG-CD2 4.26Å; N613-L617 WeakPolarHBondContact O-CB 3.42Å; N613-L617 PolarHBondContact O-N 2.89Å; V614-L617 WeakPolarHBondContact O-CB 3.28Å; V614-L617 PolarHBondContact O-N 3.28Å; I615-L617 VanDerWaalsContact C-N 3.31Å; I615-L617 PolarHBondContact O-N 2.86Å; L617-G619 VanDerWaalsContact C-N 3.3Å; L617-G619 PolarHBondContact O-N 2.94Å; L617-K620 PolarHBondContact O-N 3.42Å; L617-Y621 HydrophobicContact CD1-CD1 4.2Å; L617-Y621 HydrophobicContact CD1-CE1 3.67Å; L617-Y621 HydrophobicContact CG-CE1 4.14Å; L617-Y621 HydrophobicContact CG-CE2 4.34Å; L617-Y621 PolarHBondContact O-N 2.93Å; L617-L642 HydrophobicContact CD2-CD1 3.58Å; L617-L642 HydrophobicContact CD2-CD2 3.94Å; L617-L642 HydrophobicContact CD2-CG 4.44Å; L617-L642 HydrophobicContact CG-CD1 3.97Å
618	V	82.3	Confident	77.5	Confident	3 Å²	3	24 Å²	24	2%	0.018	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-42.3	172.1	164.9	0	0	0	0	110.8	F486 V614 I615 R616 Y621 M622 M639 L642 F743 L746	F486-V618 HydrophobicContact CZ-CG1 4.31Å; V614-V618 WeakPolarHBondContact O-CG2 3.44Å; V614-V618 PolarHBondContact O-N 3.35Å; I615-V618 WeakPolarHBondContact O-CB 3.48Å; I615-V618 PolarHBondContact O-N 3.27Å; R616-V618 PolarHBondContact O-N 3.16Å; V618-Y621 WeakPolarHBondContact O-CB 3.43Å; V618-Y621 PolarHBondContact O-N 2.98Å; V618-M622 HydrophobicContact CG1-SD 4.32Å; V618-M622 WeakPolarHBondContact O-CG 3.21Å; V618-M622 PolarHBondContact O-N 3.31Å; V618-M639 HydrophobicContact CG1-CE 3.47Å; V618-M639 VanDerWaalsContact CG1-CE 3.47Å; V618-M639 HydrophobicContact CG1-SD 4.48Å; V618-L642 HydrophobicContact CG2-CD1 4.34Å; V618-F743 HydrophobicContact CG2-CE2 4.26Å; V618-F743 HydrophobicContact CG2-CZ 3.74Å; V618-L746 HydrophobicContact CG1-CD1 3.98Å
619	G	78.8	Confident	76.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.9	-47.8	173.4	0	0	0	0	0	112.8	F486 I615 R616 L617 Y621 M622 Q623	F486-G619 VanDerWaalsContact CE2-CA 3.45Å; I615-G619 PolarHBondContact O-N 3.28Å; R616-G619 WeakPolarHBondContact O-CA 3.47Å; R616-G619 PolarHBondContact O-N 2.95Å; R616-G619 VanDerWaalsContact O-N 3.13Å; L617-G619 VanDerWaalsContact C-N 3.3Å; L617-G619 PolarHBondContact O-N 2.94Å; G619-Y621 VanDerWaalsContact C-N 3.33Å; G619-Y621 PolarHBondContact O-N 3.18Å; G619-M622 PolarHBondContact O-N 2.99Å; G619-M622 VanDerWaalsContact O-N 3.15Å; G619-Q623 PolarHBondContact O-N 3.35Å
620	K	77.7	Confident	76.2	Confident	66 Å²	66	31.1 Å²	31.1	29%	0.287	15%	0.153	S	C	.	.	H	α-helix	trans	-60.7	-39.6	175.6	-64.3	-171	-178	-175	0	112.7	Y409 E485 R616 L617 Q623 M624	Y409-K620 HydrophobicContact CE2-CB 3.87Å; Y409-K620 HydrophobicContact CE2-CG 4.49Å; Y409-K620 PolarHBondContact OH-O 3.35Å; Y409-K620 VanDerWaalsContact OH-O 3.1Å; E485-K620 HydrophobicContact CG-CG 3.76Å; R616-K620 WeakPolarHBondContact O-CG 3.11Å; R616-K620 PolarHBondContact O-N 3.44Å; L617-K620 PolarHBondContact O-N 3.42Å; K620-Q623 PolarHBondContact O-N 3.41Å; K620-M624 WeakPolarHBondContact O-CG 3.49Å; K620-M624 PolarHBondContact O-N 2.59Å; K620-M624 VanDerWaalsContact O-N 3.12Å
621	Y	80.4	Confident	75.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-40.6	174.6	-75.5	1.5	0	0	0	111.6	F449 Y452 H453 L617 V618 G619 M624 M625 V635 F638 M639 L642	F449-Y621 HydrophobicContact CE1-CD1 4.49Å; F449-Y621 HydrophobicContact CE1-CD2 4.38Å; F449-Y621 HydrophobicContact CE1-CE1 4.22Å; F449-Y621 HydrophobicContact CE1-CE2 4.14Å; F449-Y621 AromaticContact CE2-CD1 3.75Å; F449-Y621 HydrophobicContact CE2-CD1 3.75Å; F449-Y621 HydrophobicContact CE2-CE1 4.03Å; F449-Y621 HydrophobicContact CE2-CG 4.1Å; F449-Y621 AromaticContact CZ-CD1 3.46Å; F449-Y621 HydrophobicContact CZ-CD1 3.46Å; F449-Y621 VanDerWaalsContact CZ-CD1 3.46Å; F449-Y621 AromaticContact CZ-CD2 3.69Å; F449-Y621 HydrophobicContact CZ-CD2 3.69Å; F449-Y621 AromaticContact CZ-CE1 3.57Å; F449-Y621 HydrophobicContact CZ-CE1 3.57Å; F449-Y621 AromaticContact CZ-CE2 3.83Å; F449-Y621 HydrophobicContact CZ-CE2 3.83Å; F449-Y621 AromaticContact CZ-CG 3.54Å; F449-Y621 HydrophobicContact CZ-CG 3.54Å; F449-Y621 AromaticContact CZ-CZ 3.8Å; Y452-Y621 AromaticContact CD1-CE1 3.77Å; Y452-Y621 HydrophobicContact CD1-CE1 3.77Å; Y452-Y621 HydrophobicContact CE1-CD1 4.39Å; Y452-Y621 AromaticContact CE1-CE1 3.66Å; Y452-Y621 HydrophobicContact CE1-CE1 3.66Å; H453-Y621 WeakPolarHBondContact CA-OH 3.39Å; H453-Y621 AromaticContact ND1-CE2 3.61Å; H453-Y621 AromaticContact ND1-CZ 3.62Å; H453-Y621 PolarHBondContact ND1-OH 3.26Å; L617-Y621 HydrophobicContact CD1-CD1 4.2Å; L617-Y621 HydrophobicContact CD1-CE1 3.67Å; L617-Y621 HydrophobicContact CG-CE1 4.14Å; L617-Y621 HydrophobicContact CG-CE2 4.34Å; L617-Y621 PolarHBondContact O-N 2.93Å; V618-Y621 WeakPolarHBondContact O-CB 3.43Å; V618-Y621 PolarHBondContact O-N 2.98Å; G619-Y621 VanDerWaalsContact C-N 3.33Å; G619-Y621 PolarHBondContact O-N 3.18Å; Y621-M624 PolarHBondContact O-N 2.71Å; Y621-M625 WeakPolarHBondContact O-CB 3.33Å; Y621-M625 PolarHBondContact O-N 3.17Å; Y621-V635 HydrophobicContact CG-CG1 4.47Å; Y621-V635 WeakPolarHBondContact O-CG1 3.33Å; Y621-F638 HydrophobicContact CE2-CB 4.45Å; Y621-M639 HydrophobicContact CD2-CG 3.78Å; Y621-M639 HydrophobicContact CG-CG 4.47Å; Y621-L642 HydrophobicContact CD2-CD1 4.1Å; Y621-L642 HydrophobicContact CE2-CD1 3.56Å; Y621-L642 HydrophobicContact CE2-CG 4.25Å
622	M	74.8	Confident	75	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-36.3	176.3	-68.9	-177.2	71.3	0	0	113	F486 F488 M489 V618 G619 M625 N626 M639 L746 H749 L750	F486-M622 HydrophobicContact CD1-SD 4.43Å; F486-M622 HydrophobicContact CE1-SD 3.75Å; F488-M622 HydrophobicContact CE1-CB 4.12Å; F488-M622 HydrophobicContact CE2-CB 4.44Å; F488-M622 HydrophobicContact CE2-CE 4.49Å; F488-M622 HydrophobicContact CZ-CB 3.53Å; F488-M622 HydrophobicContact CZ-CE 4.13Å; M489-M622 HydrophobicContact SD-CE 3.78Å; V618-M622 HydrophobicContact CG1-SD 4.32Å; V618-M622 WeakPolarHBondContact O-CG 3.21Å; V618-M622 PolarHBondContact O-N 3.31Å; G619-M622 PolarHBondContact O-N 2.99Å; G619-M622 VanDerWaalsContact O-N 3.15Å; M622-M625 HydrophobicContact CE-CE 4.49Å; M622-M625 HydrophobicContact CG-CE 4.49Å; M622-M625 WeakPolarHBondContact O-CB 3.45Å; M622-M625 PolarHBondContact O-N 3.01Å; M622-N626 PolarHBondContact O-N 3.47Å; M622-M639 HydrophobicContact CG-CE 4.21Å; M622-M639 HydrophobicContact CG-SD 4.11Å; M622-L746 HydrophobicContact CE-CD2 4.07Å; M622-L746 HydrophobicContact SD-CD1 3.89Å; M622-L746 HydrophobicContact SD-CD2 3.93Å; M622-L746 HydrophobicContact SD-CG 4.38Å; M622-H749 HydrophobicContact CE-CB 4.5Å; M622-H749 WeakPolarHBondContact CE-CD2 3.05Å; M622-L750 HydrophobicContact CE-CD2 4.21Å
623	Q	71.6	Confident	74.9	Confident	42 Å²	42	33 Å²	33	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-47.3	171.4	-73.6	-175.4	-11.4	0	0	111.3	Y409 E485 F488 G619 K620 M625 N626 I627	Y409-Q623 WeakPolarHBondContact OH-CB 3.26Å; Y409-Q623 PolarHBondContact OH-OE1 2.99Å; E485-Q623 VanDerWaalsContact CA-NE2 3.32Å; E485-Q623 WeakPolarHBondContact O-CG 3.43Å; E485-Q623 PolarHBondContact O-NE2 2.85Å; F488-Q623 HydrophobicContact CD1-CG 3.43Å; F488-Q623 VanDerWaalsContact CD1-CG 3.43Å; F488-Q623 HydrophobicContact CE1-CG 3.59Å; F488-Q623 HydrophobicContact CG-CG 4.42Å; G619-Q623 PolarHBondContact O-N 3.35Å; K620-Q623 PolarHBondContact O-N 3.41Å; Q623-M625 VanDerWaalsContact C-N 3.31Å; Q623-M625 PolarHBondContact O-N 3.09Å; Q623-N626 PolarHBondContact O-N 3.18Å; Q623-I627 WeakPolarHBondContact O-CG1 3.45Å; Q623-I627 PolarHBondContact O-N 3.16Å
624	M	69.9	Low	74.6	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-39.9	174.6	-69.5	-171.5	-174.8	0	0	112.3	Y409 Y448 F449 Y452 K620 Y621 N626 I627 L628	Y409-M624 HydrophobicContact CD2-CE 3.14Å; Y409-M624 HydrophobicContact CE2-CE 3.16Å; Y409-M624 HydrophobicContact CE2-CG 3.73Å; Y409-M624 HydrophobicContact CE2-SD 4.19Å; Y409-M624 HydrophobicContact CG-CE 4.42Å; Y448-M624 HydrophobicContact CE1-CE 3.92Å; F449-M624 HydrophobicContact CD2-SD 3.63Å; F449-M624 HydrophobicContact CE2-SD 3.59Å; F449-M624 VanDerWaalsContact CE2-SD 3.59Å; Y452-M624 HydrophobicContact CD1-CE 4.12Å; Y452-M624 HydrophobicContact CE1-CE 4.05Å; K620-M624 WeakPolarHBondContact O-CG 3.49Å; K620-M624 PolarHBondContact O-N 2.59Å; K620-M624 VanDerWaalsContact O-N 3.12Å; Y621-M624 PolarHBondContact O-N 2.71Å; M624-N626 VanDerWaalsContact C-N 3.3Å; M624-N626 PolarHBondContact O-N 2.8Å; M624-I627 PolarHBondContact O-N 3.47Å; M624-L628 WeakPolarHBondContact O-CB 3.49Å; M624-L628 PolarHBondContact O-N 3.46Å
625	M	72.8	Confident	74.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-39.7	177.5	179.6	-177.2	67.3	0	0	112	Y621 M622 Q623 L628 K629 A632 V635 I636 L750 V753	Y621-M625 WeakPolarHBondContact O-CB 3.33Å; Y621-M625 PolarHBondContact O-N 3.17Å; M622-M625 HydrophobicContact CE-CE 4.49Å; M622-M625 HydrophobicContact CG-CE 4.49Å; M622-M625 WeakPolarHBondContact O-CB 3.45Å; M622-M625 PolarHBondContact O-N 3.01Å; Q623-M625 VanDerWaalsContact C-N 3.31Å; Q623-M625 PolarHBondContact O-N 3.09Å; M625-L628 CarbonylContact O-C 3.59Å; M625-L628 VanDerWaalsContact O-C 3.23Å; M625-L628 PolarHBondContact O-N 2.8Å; M625-K629 PolarHBondContact O-N 2.77Å; M625-A632 HydrophobicContact CG-CB 3.62Å; M625-A632 HydrophobicContact SD-CB 4.07Å; M625-V635 HydrophobicContact CB-CG1 4.21Å; M625-I636 HydrophobicContact SD-CD1 4.02Å; M625-I636 HydrophobicContact SD-CG1 4.1Å; M625-L750 HydrophobicContact CE-CD2 3.81Å; M625-L750 HydrophobicContact SD-CD2 4.1Å; M625-V753 HydrophobicContact CE-CB 4.23Å; M625-V753 HydrophobicContact CE-CG1 4.16Å; M625-V753 HydrophobicContact CE-CG2 4.07Å; M625-V753 HydrophobicContact CG-CG1 3.9Å; M625-V753 HydrophobicContact SD-CB 4.27Å; M625-V753 HydrophobicContact SD-CG1 3.84Å
626	N	68.3	Low	74.2	Confident	53 Å²	53	32.6 Å²	32.6	28%	0.283	16%	0.159	S	C	.	.	H	α-helix	trans	-69	-35.1	178.8	-80.5	-21.7	0	0	0	112.8	F488 M622 Q623 M624	F488-N626 WeakPolarHBondContact CD2-ND2 3.44Å; F488-N626 WeakPolarHBondContact CE2-ND2 3.46Å; M622-N626 PolarHBondContact O-N 3.47Å; Q623-N626 PolarHBondContact O-N 3.18Å; M624-N626 VanDerWaalsContact C-N 3.3Å; M624-N626 PolarHBondContact O-N 2.8Å
627	I	67.9	Low	74.3	Confident	80 Å²	80	32.7 Å²	32.7	41%	0.41	16%	0.163	S	C	.	.	H	α-helix	trans	-72.7	-40	174.4	-60.4	163.4	0	0	0	110.2	I413 L416 Q623 M624	I413-I627 HydrophobicContact CD1-CD1 4.03Å; I413-I627 HydrophobicContact CG1-CD1 4.15Å; I413-I627 HydrophobicContact CG2-CD1 3.87Å; L416-I627 HydrophobicContact CB-CG2 4.41Å; Q623-I627 WeakPolarHBondContact O-CG1 3.45Å; Q623-I627 PolarHBondContact O-N 3.16Å; M624-I627 PolarHBondContact O-N 3.47Å
628	L	67.2	Low	74.3	Confident	17 Å²	17	32.4 Å²	32.4	9%	0.089	16%	0.16	C	C	.	.			trans	-112.8	65.1	-174.5	-65.4	165.1	0	0	0	112.4	F412 L416 I441 M624 M625 P630 I631	F412-L628 HydrophobicContact CE1-CD1 4.43Å; L416-L628 HydrophobicContact CD1-CD1 3.57Å; L416-L628 HydrophobicContact CD1-CD2 3.87Å; L416-L628 HydrophobicContact CD1-CG 3.83Å; L416-L628 HydrophobicContact CD2-CD2 3.95Å; I441-L628 HydrophobicContact CG2-CD2 4.06Å; M624-L628 WeakPolarHBondContact O-CB 3.49Å; M624-L628 PolarHBondContact O-N 3.46Å; M625-L628 CarbonylContact O-C 3.59Å; M625-L628 VanDerWaalsContact O-C 3.23Å; M625-L628 PolarHBondContact O-N 2.8Å; L628-P630 VanDerWaalsContact C-N 3.25Å; L628-P630 VanDerWaalsContact O-N 3.1Å; L628-I631 HydrophobicContact CB-CB 4.43Å; L628-I631 HydrophobicContact CB-CD1 4.29Å; L628-I631 HydrophobicContact CD1-CD1 4.19Å; L628-I631 HydrophobicContact CD2-CD1 4.32Å; L628-I631 PolarHBondContact O-N 3.49Å
629	K	67.7	Low	74.3	Confident	158 Å²	158	32.4 Å²	32.4	69%	0.687	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-47.5	-37.9	175.1	-65	-177.5	-179.1	175.8	0	114.6	M625 I631 A632	M625-K629 PolarHBondContact O-N 2.77Å; K629-I631 PolarHBondContact O-N 3.26Å; K629-A632 WeakPolarHBondContact O-CB 3.39Å; K629-A632 PolarHBondContact O-N 3.11Å
630	P	65.4	Low	74.5	Confident	86 Å²	86	32.6 Å²	32.6	56%	0.558	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-66.6	-14.6	179.6	-22.8	35.2	0	0	0	115.6	R442 L628	R442-P630 HydrophobicContact CG-CB 4.38Å; L628-P630 VanDerWaalsContact C-N 3.25Å; L628-P630 VanDerWaalsContact O-N 3.1Å
631	I	68.9	Low	74.7	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.015	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-112.6	3.9	-175	-51.4	173	0	0	0	111	R442 V446 L628 K629 F633 D634 V635	R442-I631 HydrophobicContact CG-CD1 4.19Å; R442-I631 HydrophobicContact CG-CG1 3.73Å; V446-I631 HydrophobicContact CG2-CD1 4.25Å; V446-I631 HydrophobicContact CG2-CG1 4.28Å; V446-I631 HydrophobicContact CG2-CG2 3.77Å; L628-I631 HydrophobicContact CB-CB 4.43Å; L628-I631 HydrophobicContact CB-CD1 4.29Å; L628-I631 HydrophobicContact CD1-CD1 4.19Å; L628-I631 HydrophobicContact CD2-CD1 4.32Å; L628-I631 PolarHBondContact O-N 3.49Å; K629-I631 PolarHBondContact O-N 3.26Å; I631-F633 PolarHBondContact O-N 3.44Å; I631-D634 HydrophobicContact CG2-CB 3.87Å; I631-D634 PolarHBondContact O-N 2.89Å; I631-V635 HydrophobicContact CG2-CG2 4.29Å; I631-V635 PolarHBondContact O-N 3.38Å; I631-V635 VanDerWaalsContact O-N 3.13Å
632	A	70.1	Confident	74.9	Confident	2 Å²	2	30.6 Å²	30.6	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-52.5	-35.6	-175.4	0	0	0	0	0	114	M625 K629 I636 V753	M625-A632 HydrophobicContact CG-CB 3.62Å; M625-A632 HydrophobicContact SD-CB 4.07Å; K629-A632 WeakPolarHBondContact O-CB 3.39Å; K629-A632 PolarHBondContact O-N 3.11Å; A632-I636 WeakPolarHBondContact O-CB 3.26Å; A632-I636 WeakPolarHBondContact O-CD1 3.21Å; A632-I636 VanDerWaalsContact O-CG1 3.25Å; A632-I636 WeakPolarHBondContact O-CG1 3.34Å; A632-I636 PolarHBondContact O-N 3.46Å; A632-V753 HydrophobicContact CB-CG1 3.76Å
633	F	78.5	Confident	75.4	Confident	47 Å²	47	30.6 Å²	30.6	21%	0.206	15%	0.153	C	C	.	.	H	α-helix	trans	-63.4	-46.4	175.6	174.9	-103.1	0	0	0	113.2	I631 V635 I636 H637 M754 K758 F761	I631-F633 PolarHBondContact O-N 3.44Å; F633-V635 VanDerWaalsContact C-N 3.33Å; F633-I636 PolarHBondContact O-N 3.15Å; F633-H637 PolarHBondContact O-N 3.36Å; F633-M754 HydrophobicContact CD2-CE 4.1Å; F633-K758 HydrophobicContact CB-CD 3.98Å; F633-K758 HydrophobicContact CD1-CD 3.9Å; F633-K758 HydrophobicContact CD2-CB 3.93Å; F633-K758 HydrophobicContact CD2-CD 3.21Å; F633-K758 HydrophobicContact CD2-CG 4.2Å; F633-K758 HydrophobicContact CE1-CD 4.17Å; F633-K758 HydrophobicContact CE2-CB 4.13Å; F633-K758 HydrophobicContact CE2-CD 3.54Å; F633-K758 HydrophobicContact CE2-CG 4.36Å; F633-K758 HydrophobicContact CG-CD 3.38Å; F633-K758 VanDerWaalsContact CG-NZ 3.32Å; F633-K758 HydrophobicContact CZ-CD 3.99Å; F633-F761 HydrophobicContact CE2-CB 4.47Å; F633-F761 AromaticContact CE2-CD1 4Å; F633-F761 HydrophobicContact CE2-CD1 4Å; F633-F761 HydrophobicContact CE2-CG 4.21Å
634	D	75.4	Confident	76.1	Confident	37 Å²	37	28.9 Å²	28.9	20%	0.198	15%	0.146	C	C	.	.	H	α-helix	trans	-66.6	-41.5	-177.2	-57.6	-45	0	0	0	109.1	R442 I631 I636 H637 F638	R442-D634 IonicContact NH1-OD2 3.52Å; I631-D634 HydrophobicContact CG2-CB 3.87Å; I631-D634 PolarHBondContact O-N 2.89Å; D634-I636 PolarHBondContact O-N 2.95Å; D634-H637 WeakPolarHBondContact O-CB 3.32Å; D634-H637 PolarHBondContact O-N 2.93Å; D634-H637 VanDerWaalsContact O-N 3.16Å; D634-F638 VanDerWaalsContact C-CD2 3.49Å; D634-F638 HydrophobicContact CB-CD2 4.5Å; D634-F638 HydrophobicContact CB-CE2 4.06Å; D634-F638 WeakPolarHBondContact O-CD2 2.86Å; D634-F638 WeakPolarHBondContact O-CG 3Å; D634-F638 PolarHBondContact O-N 3.47Å
635	V	80.1	Confident	76.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-58.7	-45.3	174.5	-179.5	0	0	0	0	112	F449 Y621 M625 I631 F633 H637 F638 M639	F449-V635 HydrophobicContact CD2-CG2 4.08Å; F449-V635 HydrophobicContact CE2-CB 4.37Å; F449-V635 HydrophobicContact CE2-CG1 4.03Å; F449-V635 HydrophobicContact CE2-CG2 3.75Å; F449-V635 HydrophobicContact CZ-CB 4.21Å; F449-V635 HydrophobicContact CZ-CG1 3.82Å; F449-V635 HydrophobicContact CZ-CG2 4.04Å; Y621-V635 HydrophobicContact CG-CG1 4.47Å; Y621-V635 WeakPolarHBondContact O-CG1 3.33Å; M625-V635 HydrophobicContact CB-CG1 4.21Å; I631-V635 HydrophobicContact CG2-CG2 4.29Å; I631-V635 PolarHBondContact O-N 3.38Å; I631-V635 VanDerWaalsContact O-N 3.13Å; F633-V635 VanDerWaalsContact C-N 3.33Å; V635-H637 VanDerWaalsContact C-N 3.33Å; V635-H637 PolarHBondContact O-N 3.4Å; V635-F638 PolarHBondContact O-N 2.87Å; V635-M639 HydrophobicContact CG1-SD 4.4Å; V635-M639 WeakPolarHBondContact O-CG 3.22Å; V635-M639 PolarHBondContact O-N 2.98Å
636	I	78.7	Confident	77.3	Confident	5 Å²	5	28.9 Å²	28.9	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-38.2	177.2	-71.7	166.1	0	0	0	111.2	M625 A632 F633 D634 M639 S640 L750 M754 L762	M625-I636 HydrophobicContact SD-CD1 4.02Å; M625-I636 HydrophobicContact SD-CG1 4.1Å; A632-I636 WeakPolarHBondContact O-CB 3.26Å; A632-I636 WeakPolarHBondContact O-CD1 3.21Å; A632-I636 VanDerWaalsContact O-CG1 3.25Å; A632-I636 WeakPolarHBondContact O-CG1 3.34Å; A632-I636 PolarHBondContact O-N 3.46Å; F633-I636 PolarHBondContact O-N 3.15Å; D634-I636 PolarHBondContact O-N 2.95Å; I636-M639 PolarHBondContact O-N 3.23Å; I636-S640 PolarHBondContact O-N 3.35Å; I636-L750 HydrophobicContact CD1-CB 4.47Å; I636-L750 HydrophobicContact CD1-CD2 4.24Å; I636-L750 HydrophobicContact CG1-CD2 4.12Å; I636-M754 HydrophobicContact CD1-CG 3.55Å; I636-M754 HydrophobicContact CD1-SD 3.47Å; I636-M754 WeakPolarHBondContact CD1-SD 3.34Å; I636-L762 HydrophobicContact CG2-CD1 3.88Å
637	H	82.3	Confident	78.1	Confident	65 Å²	65	26.4 Å²	26.4	30%	0.301	13%	0.132	S	C	.	.	H	α-helix	trans	-59.3	-47.7	173	-178.1	67.5	0	0	0	110.8	F633 D634 V635 M639 S640 Q641 F761	F633-H637 PolarHBondContact O-N 3.36Å; D634-H637 WeakPolarHBondContact O-CB 3.32Å; D634-H637 PolarHBondContact O-N 2.93Å; D634-H637 VanDerWaalsContact O-N 3.16Å; V635-H637 VanDerWaalsContact C-N 3.33Å; V635-H637 PolarHBondContact O-N 3.4Å; H637-M639 PolarHBondContact O-N 2.87Å; H637-S640 WeakPolarHBondContact O-CB 3.44Å; H637-S640 PolarHBondContact O-N 3Å; H637-S640 VanDerWaalsContact O-N 3.1Å; H637-S640 PolarHBondContact O-OG 3.44Å; H637-Q641 PolarHBondContact CD2-NE2 2.89Å; H637-Q641 PolarHBondContact NE2-NE2 3.39Å; H637-Q641 WeakPolarHBondContact O-CG 3.41Å; H637-Q641 PolarHBondContact O-N 2.96Å; H637-F761 AromaticContact ND1-CZ 3.56Å
638	F	81.1	Confident	78.9	Confident	14 Å²	14	22.7 Å²	22.7	6%	0.061	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-34.1	176.6	-64.6	-55.5	0	0	0	113.6	F449 K450 H453 Y621 D634 V635 S640 Q641 L642	F449-F638 HydrophobicContact CD1-CB 4.28Å; F449-F638 AromaticContact CD1-CD2 3.04Å; F449-F638 HydrophobicContact CD1-CD2 3.04Å; F449-F638 AromaticContact CD1-CE2 3.42Å; F449-F638 HydrophobicContact CD1-CE2 3.42Å; F449-F638 VanDerWaalsContact CD1-CE2 3.42Å; F449-F638 AromaticContact CD1-CG 3.81Å; F449-F638 HydrophobicContact CD1-CG 3.81Å; F449-F638 HydrophobicContact CD1-CZ 4.41Å; F449-F638 HydrophobicContact CE1-CB 3.47Å; F449-F638 VanDerWaalsContact CE1-CB 3.47Å; F449-F638 AromaticContact CE1-CD2 3.09Å; F449-F638 HydrophobicContact CE1-CD2 3.09Å; F449-F638 AromaticContact CE1-CE2 3.97Å; F449-F638 HydrophobicContact CE1-CE2 3.97Å; F449-F638 AromaticContact CE1-CG 3.5Å; F449-F638 HydrophobicContact CE1-CG 3.5Å; F449-F638 HydrophobicContact CG-CD2 4.22Å; F449-F638 HydrophobicContact CG-CE2 4.37Å; F449-F638 HydrophobicContact CZ-CB 4.31Å; F449-F638 HydrophobicContact CZ-CD2 4.25Å; K450-F638 HydrophobicContact CG-CE1 4.42Å; K450-F638 HydrophobicContact CG-CE2 4.44Å; K450-F638 HydrophobicContact CG-CZ 3.66Å; H453-F638 HydrophobicContact CB-CD1 4.25Å; H453-F638 HydrophobicContact CB-CG 4.36Å; H453-F638 AromaticContact CD2-CD1 3.25Å; H453-F638 WeakPolarHBondContact CD2-CD1 3.36Å; H453-F638 AromaticContact CD2-CE1 3.94Å; H453-F638 AromaticContact CD2-CG 3.93Å; H453-F638 PolarHBondContact CE1-O 3.26Å; H453-F638 AromaticContact CG-CD1 3.68Å; H453-F638 AromaticContact CG-CG 3.91Å; H453-F638 AromaticContact NE2-CD1 3.63Å; Y621-F638 HydrophobicContact CE2-CB 4.45Å; D634-F638 VanDerWaalsContact C-CD2 3.49Å; D634-F638 HydrophobicContact CB-CD2 4.5Å; D634-F638 HydrophobicContact CB-CE2 4.06Å; D634-F638 WeakPolarHBondContact O-CD2 2.86Å; D634-F638 WeakPolarHBondContact O-CG 3Å; D634-F638 PolarHBondContact O-N 3.47Å; V635-F638 PolarHBondContact O-N 2.87Å; F638-S640 VanDerWaalsContact C-N 3.31Å; F638-S640 PolarHBondContact O-N 3.09Å; F638-Q641 WeakPolarHBondContact O-CB 3.46Å; F638-Q641 PolarHBondContact O-N 2.62Å; F638-L642 PolarHBondContact O-N 2.98Å
639	M	82.7	Confident	79.6	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-41.6	169.6	-73.3	176.6	55.2	0	0	111.4	V618 Y621 M622 V635 I636 H637 Q641 L642 F643 F743 L750	V618-M639 HydrophobicContact CG1-CE 3.47Å; V618-M639 VanDerWaalsContact CG1-CE 3.47Å; V618-M639 HydrophobicContact CG1-SD 4.48Å; Y621-M639 HydrophobicContact CD2-CG 3.78Å; Y621-M639 HydrophobicContact CG-CG 4.47Å; M622-M639 HydrophobicContact CG-CE 4.21Å; M622-M639 HydrophobicContact CG-SD 4.11Å; V635-M639 HydrophobicContact CG1-SD 4.4Å; V635-M639 WeakPolarHBondContact O-CG 3.22Å; V635-M639 PolarHBondContact O-N 2.98Å; I636-M639 PolarHBondContact O-N 3.23Å; H637-M639 PolarHBondContact O-N 2.87Å; M639-Q641 VanDerWaalsContact C-N 3.32Å; M639-Q641 PolarHBondContact O-N 3.4Å; M639-L642 PolarHBondContact O-N 2.94Å; M639-F643 PolarHBondContact O-N 2.92Å; M639-F743 HydrophobicContact CB-CE1 4.32Å; M639-F743 HydrophobicContact CE-CE1 3.86Å; M639-L750 HydrophobicContact CE-CD1 4.09Å; M639-L750 HydrophobicContact CE-CD2 4.31Å
640	S	82.6	Confident	80.4	Confident	5 Å²	5	14.3 Å²	14.3	4%	0.035	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-35.1	174.6	68.3	0	0	0	0	112.4	I636 H637 F638 F643 D644 F765	I636-S640 PolarHBondContact O-N 3.35Å; H637-S640 WeakPolarHBondContact O-CB 3.44Å; H637-S640 PolarHBondContact O-N 3Å; H637-S640 VanDerWaalsContact O-N 3.1Å; H637-S640 PolarHBondContact O-OG 3.44Å; F638-S640 VanDerWaalsContact C-N 3.31Å; F638-S640 PolarHBondContact O-N 3.09Å; S640-F643 PolarHBondContact O-N 3.36Å; S640-D644 VanDerWaalsContact O-CB 3.32Å; S640-D644 WeakPolarHBondContact O-CB 3.38Å; S640-D644 VanDerWaalsContact O-CG 3.3Å; S640-D644 PolarHBondContact O-N 2.84Å; S640-F765 VanDerWaalsContact CB-CE2 3.41Å
641	Q	82.4	Confident	81.1	Confident	24 Å²	24	11.9 Å²	11.9	11%	0.112	6%	0.056	C	C	.	.	H	α-helix	trans	-65.1	-39.8	175.1	-66.3	-174.2	-9.5	0	0	112.6	H453 H637 F638 M639 F643 D644 Y645 L683	H453-Q641 PolarHBondContact CD2-OE1 3.41Å; H453-Q641 PolarHBondContact NE2-OE1 3.17Å; H637-Q641 PolarHBondContact CD2-NE2 2.89Å; H637-Q641 PolarHBondContact NE2-NE2 3.39Å; H637-Q641 WeakPolarHBondContact O-CG 3.41Å; H637-Q641 PolarHBondContact O-N 2.96Å; F638-Q641 WeakPolarHBondContact O-CB 3.46Å; F638-Q641 PolarHBondContact O-N 2.62Å; M639-Q641 VanDerWaalsContact C-N 3.32Å; M639-Q641 PolarHBondContact O-N 3.4Å; Q641-F643 VanDerWaalsContact C-N 3.33Å; Q641-F643 PolarHBondContact O-N 2.87Å; Q641-D644 PolarHBondContact O-N 3.49Å; Q641-Y645 WeakPolarHBondContact O-CB 3.44Å; Q641-Y645 PolarHBondContact O-N 3.39Å; Q641-L683 HydrophobicContact CB-CD1 4.33Å; Q641-L683 HydrophobicContact CB-CD2 4.18Å; Q641-L683 HydrophobicContact CG-CD1 4.32Å; Q641-L683 HydrophobicContact CG-CD2 3.76Å
642	L	84.6	Confident	81.6	Confident	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.1	-45.5	174.4	-68.4	178.6	0	0	0	111.5	L457 L460 L617 V618 Y621 F638 M639 Y646	L457-L642 HydrophobicContact CD2-CD2 3.73Å; L457-L642 HydrophobicContact CG-CD2 4.24Å; L460-L642 HydrophobicContact CD2-CD2 4.2Å; L617-L642 HydrophobicContact CD2-CD1 3.58Å; L617-L642 HydrophobicContact CD2-CD2 3.94Å; L617-L642 HydrophobicContact CD2-CG 4.44Å; L617-L642 HydrophobicContact CG-CD1 3.97Å; V618-L642 HydrophobicContact CG2-CD1 4.34Å; Y621-L642 HydrophobicContact CD2-CD1 4.1Å; Y621-L642 HydrophobicContact CE2-CD1 3.56Å; Y621-L642 HydrophobicContact CE2-CG 4.25Å; F638-L642 PolarHBondContact O-N 2.98Å; M639-L642 PolarHBondContact O-N 2.94Å; L642-Y646 WeakPolarHBondContact O-CB 3.37Å; L642-Y646 PolarHBondContact O-N 3.44Å
643	F	85.8	Confident	82	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-68.1	-45	179.1	-176.1	-89.5	0	0	0	111.7	M639 S640 Q641 Y645 Y646 L647 L736 L739 A740 F743 F765 T769 V770 A773	M639-F643 PolarHBondContact O-N 2.92Å; S640-F643 PolarHBondContact O-N 3.36Å; Q641-F643 VanDerWaalsContact C-N 3.33Å; Q641-F643 PolarHBondContact O-N 2.87Å; F643-Y645 VanDerWaalsContact C-N 3.32Å; F643-Y645 PolarHBondContact O-N 2.95Å; F643-Y646 PolarHBondContact O-N 3.32Å; F643-L647 HydrophobicContact CE1-CD2 4.5Å; F643-L647 WeakPolarHBondContact O-CB 3.28Å; F643-L647 PolarHBondContact O-N 2.85Å; F643-L736 HydrophobicContact CE2-CD1 4.33Å; F643-L736 HydrophobicContact CZ-CD1 4.36Å; F643-L739 HydrophobicContact CD2-CD2 3.76Å; F643-L739 HydrophobicContact CD2-CG 3.96Å; F643-L739 HydrophobicContact CE2-CD2 4.17Å; F643-L739 HydrophobicContact CE2-CG 4.14Å; F643-A740 HydrophobicContact CE2-CB 4.12Å; F643-A740 HydrophobicContact CZ-CB 4.08Å; F643-F743 HydrophobicContact CB-CE2 4.26Å; F643-F743 HydrophobicContact CB-CZ 4.24Å; F643-F743 AromaticContact CD2-CD2 3.84Å; F643-F743 HydrophobicContact CD2-CD2 3.84Å; F643-F743 AromaticContact CD2-CE2 3.87Å; F643-F743 HydrophobicContact CD2-CE2 3.87Å; F643-F743 HydrophobicContact CE2-CD2 4.38Å; F643-F743 HydrophobicContact CG-CE2 4.47Å; F643-F765 HydrophobicContact CB-CE2 4.38Å; F643-F765 HydrophobicContact CB-CZ 3.91Å; F643-F765 AromaticContact CD1-CE2 3.96Å; F643-F765 HydrophobicContact CD1-CE2 3.96Å; F643-F765 AromaticContact CD1-CZ 3.78Å; F643-F765 HydrophobicContact CD1-CZ 3.78Å; F643-F765 HydrophobicContact CG-CE2 4.48Å; F643-F765 AromaticContact CG-CZ 3.96Å; F643-F765 HydrophobicContact CG-CZ 3.96Å; F643-T769 HydrophobicContact CD1-CG2 3.7Å; F643-T769 HydrophobicContact CE1-CG2 3.58Å; F643-V770 HydrophobicContact CE1-CG2 4.22Å; F643-V770 HydrophobicContact CZ-CG2 4.33Å; F643-A773 HydrophobicContact CZ-CB 3.98Å
644	D	84.9	Confident	81.9	Confident	6 Å²	6	11.7 Å²	11.7	3%	0.032	6%	0.057	C	C	.	.	H	α-helix	trans	-58.5	-43.1	177	-80.1	-1.7	0	0	0	110.9	S640 Q641 Y648 R678 I679 L683 T769	S640-D644 VanDerWaalsContact O-CB 3.32Å; S640-D644 WeakPolarHBondContact O-CB 3.38Å; S640-D644 VanDerWaalsContact O-CG 3.3Å; S640-D644 PolarHBondContact O-N 2.84Å; Q641-D644 PolarHBondContact O-N 3.49Å; D644-Y648 WeakPolarHBondContact O-CB 3.47Å; D644-Y648 PolarHBondContact O-N 3.42Å; D644-R678 IonicContact OD1-NH2 3.89Å; D644-R678 IonicContact OD2-CZ 3.03Å; D644-R678 IonicContact OD2-NH2 3.24Å; D644-R678 PolarHBondContact OD2-NH2 2.88Å; D644-I679 HydrophobicContact CB-CD1 3.89Å; D644-I679 HydrophobicContact CB-CG1 3.89Å; D644-I679 HydrophobicContact CB-CG2 4.29Å; D644-L683 HydrophobicContact CB-CD1 3.64Å; D644-T769 WeakPolarHBondContact OD1-CG2 3.5Å; D644-T769 PolarHBondContact OD1-OG1 2.84Å
645	Y	84.5	Confident	81.6	Confident	2 Å²	2	10.2 Å²	10.2	1%	0.008	5%	0.05	C	C	.	.	H	α-helix	trans	-66.4	-44.4	177.1	-170.4	-103.4	0	0	0	112.3	L457 L460 R461 L464 Q641 F643 Y648 A649 V706 P707	L457-Y645 HydrophobicContact CD2-CG 4.41Å; L460-Y645 HydrophobicContact CD2-CD1 3.97Å; L460-Y645 HydrophobicContact CG-CD1 4.31Å; R461-Y645 HydrophobicContact CB-CE1 4.16Å; R461-Y645 WeakPolarHBondContact CB-OH 3.45Å; R461-Y645 WeakPolarHBondContact CG-OH 3.34Å; L464-Y645 HydrophobicContact CD1-CD1 4.14Å; L464-Y645 HydrophobicContact CD1-CE1 3.87Å; Q641-Y645 WeakPolarHBondContact O-CB 3.44Å; Q641-Y645 PolarHBondContact O-N 3.39Å; F643-Y645 VanDerWaalsContact C-N 3.32Å; F643-Y645 PolarHBondContact O-N 2.95Å; Y645-Y648 PolarHBondContact O-N 3.32Å; Y645-A649 WeakPolarHBondContact O-CB 3.41Å; Y645-A649 PolarHBondContact O-N 3.24Å; Y645-V706 HydrophobicContact CE2-CB 4Å; Y645-V706 HydrophobicContact CE2-CG1 3.72Å; Y645-P707 PolarHBondContact OH-O 3.49Å
646	Y	85.4	Confident	81.1	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.6	-42.7	177.9	-170.6	-97.1	0	0	0	111.9	L464 T611 L642 F643 A649 I650 L736 L739	L464-Y646 HydrophobicContact CD1-CD2 4.49Å; L464-Y646 HydrophobicContact CD2-CD2 3.96Å; L464-Y646 HydrophobicContact CD2-CE2 3.76Å; T611-Y646 HydrophobicContact CG2-CE1 3.84Å; T611-Y646 HydrophobicContact CG2-CE2 4Å; T611-Y646 WeakPolarHBondContact CG2-OH 3.46Å; L642-Y646 WeakPolarHBondContact O-CB 3.37Å; L642-Y646 PolarHBondContact O-N 3.44Å; F643-Y646 PolarHBondContact O-N 3.32Å; Y646-A649 PolarHBondContact O-N 3.24Å; Y646-I650 HydrophobicContact CD1-CD1 3.82Å; Y646-I650 HydrophobicContact CE1-CD1 3.25Å; Y646-I650 HydrophobicContact CE1-CG1 4.35Å; Y646-I650 WeakPolarHBondContact O-CG1 3.35Å; Y646-I650 PolarHBondContact O-N 3.13Å; Y646-L736 HydrophobicContact CD1-CD1 3.73Å; Y646-L736 HydrophobicContact CE1-CB 4.02Å; Y646-L736 HydrophobicContact CE1-CD1 4.08Å; Y646-L739 HydrophobicContact CD1-CD2 3.8Å; Y646-L739 HydrophobicContact CE1-CD2 4.31Å; Y646-L739 HydrophobicContact CG-CD2 4.28Å
647	L	84.8	Confident	80.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.1	-46.6	174.1	178.5	68.7	0	0	0	111.6	F643 I650 Y651 I679 L736 T769 A773 L776	F643-L647 HydrophobicContact CE1-CD2 4.5Å; F643-L647 WeakPolarHBondContact O-CB 3.28Å; F643-L647 PolarHBondContact O-N 2.85Å; L647-I650 PolarHBondContact O-N 2.92Å; L647-Y651 PolarHBondContact O-N 3.02Å; L647-Y651 VanDerWaalsContact O-N 3.11Å; L647-I679 HydrophobicContact CD2-CD1 4.23Å; L647-L736 HydrophobicContact CB-CD1 4.27Å; L647-L736 HydrophobicContact CD1-CD1 4Å; L647-L736 HydrophobicContact CD1-CD2 3.51Å; L647-L736 HydrophobicContact CD1-CG 4.3Å; L647-T769 HydrophobicContact CD2-CG2 3.69Å; L647-A773 HydrophobicContact CD1-CB 4.3Å; L647-L776 HydrophobicContact CD1-CD2 4.04Å
648	Y	83.4	Confident	79.1	Confident	2 Å²	2	20.6 Å²	20.6	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-66.4	-37.7	179.1	-176.9	-94	0	0	0	112.7	D644 Y645 Y651 T652 L676 I679 Q680 I684	D644-Y648 WeakPolarHBondContact O-CB 3.47Å; D644-Y648 PolarHBondContact O-N 3.42Å; Y645-Y648 PolarHBondContact O-N 3.32Å; Y648-Y651 PolarHBondContact O-N 3.33Å; Y648-T652 VanDerWaalsContact CE1-OG1 3.22Å; Y648-T652 WeakPolarHBondContact CE1-OG1 3.47Å; Y648-T652 WeakPolarHBondContact O-CB 3.5Å; Y648-T652 PolarHBondContact O-N 2.97Å; Y648-T652 PolarHBondContact O-OG1 3.02Å; Y648-L676 HydrophobicContact CD2-CD2 4.22Å; Y648-I679 HydrophobicContact CD2-CG2 4.16Å; Y648-I679 HydrophobicContact CG-CG2 4.18Å; Y648-Q680 HydrophobicContact CE2-CB 4.13Å; Y648-I684 HydrophobicContact CD1-CD1 3.29Å; Y648-I684 HydrophobicContact CD1-CG1 3.85Å; Y648-I684 HydrophobicContact CD2-CD1 3.63Å; Y648-I684 HydrophobicContact CE1-CD1 3.29Å; Y648-I684 HydrophobicContact CE1-CG1 3.64Å; Y648-I684 HydrophobicContact CE1-CG2 4.45Å; Y648-I684 HydrophobicContact CE2-CD1 3.64Å; Y648-I684 HydrophobicContact CG-CD1 3.45Å; Y648-I684 VanDerWaalsContact CG-CD1 3.45Å; Y648-I684 HydrophobicContact CG-CG1 4.47Å; Y648-I684 VanDerWaalsContact CZ-CD1 3.47Å
649	A	82.8	Confident	77.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.8	-48.2	176.2	0	0	0	0	0	111.2	L464 Y645 Y646 Y651 T652 F653 P709	L464-A649 HydrophobicContact CD1-CB 3.8Å; Y645-A649 WeakPolarHBondContact O-CB 3.41Å; Y645-A649 PolarHBondContact O-N 3.24Å; Y646-A649 PolarHBondContact O-N 3.24Å; A649-Y651 PolarHBondContact O-N 3.48Å; A649-T652 PolarHBondContact O-N 3.2Å; A649-F653 HydrophobicContact CB-CE2 4.29Å; A649-F653 WeakPolarHBondContact O-CB 3.45Å; A649-F653 WeakPolarHBondContact O-CD2 3.47Å; A649-F653 WeakPolarHBondContact O-CG 3.25Å; A649-F653 PolarHBondContact O-N 3.25Å; A649-P709 HydrophobicContact CB-CB 4.26Å; A649-P709 HydrophobicContact CB-CG 3.67Å
650	I	83.6	Confident	76.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-41.9	179	-67.1	172.4	0	0	0	111.4	W469 Y646 L647 T652 F653 F654 A732 L736 L776 I780	W469-I650 HydrophobicContact CH2-CD1 4.45Å; W469-I650 HydrophobicContact CH2-CG1 3.97Å; W469-I650 HydrophobicContact CZ3-CG1 4.49Å; Y646-I650 HydrophobicContact CD1-CD1 3.82Å; Y646-I650 HydrophobicContact CE1-CD1 3.25Å; Y646-I650 HydrophobicContact CE1-CG1 4.35Å; Y646-I650 WeakPolarHBondContact O-CG1 3.35Å; Y646-I650 PolarHBondContact O-N 3.13Å; L647-I650 PolarHBondContact O-N 2.92Å; I650-T652 VanDerWaalsContact C-N 3.34Å; I650-T652 PolarHBondContact O-N 3.33Å; I650-F653 PolarHBondContact O-N 2.97Å; I650-F654 HydrophobicContact CG2-CD2 4.32Å; I650-F654 PolarHBondContact O-N 3.38Å; I650-A732 WeakPolarHBondContact CD1-O 3.33Å; I650-A732 HydrophobicContact CG2-CB 4.4Å; I650-L736 HydrophobicContact CD1-CB 3.61Å; I650-L736 HydrophobicContact CD1-CD1 4.33Å; I650-L736 HydrophobicContact CD1-CD2 4.12Å; I650-L736 HydrophobicContact CD1-CG 4.22Å; I650-L776 HydrophobicContact CB-CD2 4.14Å; I650-L776 HydrophobicContact CG2-CD2 3.63Å; I650-I780 HydrophobicContact CG2-CD1 3.71Å
651	Y	81.4	Confident	74.7	Confident	35 Å²	35	30.6 Å²	30.6	14%	0.137	15%	0.154	C	C	.	.	I	π-helix	trans	-60.3	-45.1	174.1	173.9	-108.2	0	0	0	111.5	L647 Y648 A649 F653 G655 R656 E661 L676 L776	L647-Y651 PolarHBondContact O-N 3.02Å; L647-Y651 VanDerWaalsContact O-N 3.11Å; Y648-Y651 PolarHBondContact O-N 3.33Å; A649-Y651 PolarHBondContact O-N 3.48Å; Y651-F653 PolarHBondContact O-N 2.95Å; Y651-G655 CarbonylContact O-C 3.34Å; Y651-G655 WeakPolarHBondContact O-CA 3.35Å; Y651-G655 PolarHBondContact O-N 3.1Å; Y651-R656 PolarHBondContact O-N 2.95Å; Y651-E661 PolarHBondContact OH-OE1 3.31Å; Y651-L676 HydrophobicContact CD1-CD1 3.8Å; Y651-L676 HydrophobicContact CD1-CD2 3.82Å; Y651-L676 HydrophobicContact CD1-CG 4.38Å; Y651-L676 HydrophobicContact CD2-CD1 3.83Å; Y651-L676 HydrophobicContact CE1-CD1 3.78Å; Y651-L676 HydrophobicContact CE1-CD2 4.49Å; Y651-L676 HydrophobicContact CE2-CD1 3.82Å; Y651-L676 HydrophobicContact CG-CD1 3.81Å; Y651-L676 HydrophobicContact CG-CD2 3.9Å; Y651-L776 HydrophobicContact CD2-CD1 3.81Å; Y651-L776 HydrophobicContact CG-CD1 4.27Å
652	T	79.4	Confident	72.9	Confident	27 Å²	27	34.2 Å²	34.2	17%	0.166	18%	0.182	C	C	.	.	I	π-helix	trans	-66.1	-39.5	-179.3	-57.1	0	0	0	0	111.9	Y648 A649 I650	Y648-T652 VanDerWaalsContact CE1-OG1 3.22Å; Y648-T652 WeakPolarHBondContact CE1-OG1 3.47Å; Y648-T652 WeakPolarHBondContact O-CB 3.5Å; Y648-T652 PolarHBondContact O-N 2.97Å; Y648-T652 PolarHBondContact O-OG1 3.02Å; A649-T652 PolarHBondContact O-N 3.2Å; I650-T652 VanDerWaalsContact C-N 3.34Å; I650-T652 PolarHBondContact O-N 3.33Å
653	F	78.6	Confident	71.3	Confident	17 Å²	17	37.5 Å²	37.5	8%	0.075	20%	0.203	C	C	.	.	I	π-helix	trans	-72.4	-44.8	-179.1	-67.6	-13.3	0	0	0	113.7	L464 W469 A649 I650 Y651 P709 H710 L711	L464-F653 HydrophobicContact CB-CE2 4.29Å; L464-F653 HydrophobicContact CB-CZ 4.45Å; W469-F653 AromaticContact CZ2-CD2 3.76Å; W469-F653 HydrophobicContact CZ2-CD2 3.76Å; W469-F653 AromaticContact CZ2-CE2 3.95Å; W469-F653 HydrophobicContact CZ2-CE2 3.95Å; A649-F653 HydrophobicContact CB-CE2 4.29Å; A649-F653 WeakPolarHBondContact O-CB 3.45Å; A649-F653 WeakPolarHBondContact O-CD2 3.47Å; A649-F653 WeakPolarHBondContact O-CG 3.25Å; A649-F653 PolarHBondContact O-N 3.25Å; I650-F653 PolarHBondContact O-N 2.97Å; Y651-F653 PolarHBondContact O-N 2.95Å; F653-P709 HydrophobicContact CE1-CB 3.85Å; F653-P709 HydrophobicContact CE1-CG 4.19Å; F653-P709 WeakPolarHBondContact CE1-O 3.36Å; F653-P709 HydrophobicContact CZ-CB 3.71Å; F653-P709 HydrophobicContact CZ-CG 4.31Å; F653-H710 WeakPolarHBondContact CE1-O 3.15Å; F653-H710 WeakPolarHBondContact CZ-O 3.47Å; F653-L711 HydrophobicContact CB-CD1 4.11Å; F653-L711 HydrophobicContact CD1-CB 3.95Å; F653-L711 HydrophobicContact CD1-CD1 4.4Å; F653-L711 HydrophobicContact CD2-CD1 4.18Å; F653-L711 HydrophobicContact CE1-CB 4.29Å; F653-L711 VanDerWaalsContact CE1-N 3.33Å; F653-L711 HydrophobicContact CG-CB 4.36Å; F653-L711 HydrophobicContact CG-CD1 3.99Å
654	F	75.5	Confident	69.5	Low	4 Å²	4	40.8 Å²	40.8	2%	0.018	24%	0.236	C	C	.	.	I	π-helix	trans	-122	-14.5	-167.3	-58.3	-70.1	0	0	0	114.4	W469 I650 L711 V715 L717 E728 R729 A732 I780 I783	W469-F654 AromaticContact CD1-CZ 3.96Å; W469-F654 HydrophobicContact CD2-CE2 4.16Å; W469-F654 HydrophobicContact CD2-CZ 4.21Å; W469-F654 AromaticContact CE2-CE2 3.84Å; W469-F654 HydrophobicContact CG-CZ 4.18Å; W469-F654 HydrophobicContact CZ2-CE2 4.06Å; W469-F654 AromaticContact NE1-CZ 3.84Å; I650-F654 HydrophobicContact CG2-CD2 4.32Å; I650-F654 PolarHBondContact O-N 3.38Å; F654-L711 HydrophobicContact CZ-CD1 4.32Å; F654-V715 HydrophobicContact CE1-CG1 4.29Å; F654-L717 HydrophobicContact CD1-CD1 4.42Å; F654-L717 HydrophobicContact CD1-CD2 4.04Å; F654-L717 HydrophobicContact CE1-CD2 3.93Å; F654-E728 HydrophobicContact CE1-CB 4.41Å; F654-E728 HydrophobicContact CZ-CB 4.46Å; F654-R729 HydrophobicContact CB-CG 4.17Å; F654-R729 HydrophobicContact CD1-CG 3.48Å; F654-R729 VanDerWaalsContact CD1-CG 3.48Å; F654-R729 HydrophobicContact CE1-CG 4.04Å; F654-R729 HydrophobicContact CG-CG 3.97Å; F654-A732 HydrophobicContact CD2-CB 3.92Å; F654-A732 HydrophobicContact CE2-CB 3.53Å; F654-A732 HydrophobicContact CZ-CB 4.33Å; F654-I780 HydrophobicContact CB-CD1 4.31Å; F654-I780 HydrophobicContact CB-CG1 4.13Å; F654-I780 HydrophobicContact CB-CG2 3.96Å; F654-I783 VanDerWaalsContact O-CD1 3.31Å; F654-I783 WeakPolarHBondContact O-CD1 3.44Å
655	G	69.1	Low	68	Low	6 Å²	6	42.7 Å²	42.7	6%	0.062	25%	0.246	C	C	.	.	I	π-helix	trans	-107.5	-22.3	-176	0	0	0	0	0	115.3	Y651 N657	Y651-G655 CarbonylContact O-C 3.34Å; Y651-G655 WeakPolarHBondContact O-CA 3.35Å; Y651-G655 PolarHBondContact O-N 3.1Å; G655-N657 PolarHBondContact O-N 3.17Å
656	R	69.3	Low	66.5	Low	127 Å²	127	45 Å²	45	48%	0.479	27%	0.27	S	S	.	.			trans	-80.4	108.8	-178.9	-168	172.3	-178	164.7	-0.5	110.8	Y651	Y651-R656 PolarHBondContact O-N 2.95Å
657	N	64.1	Low	65.1	Low	40 Å²	40	46.7 Å²	46.7	21%	0.214	28%	0.279	C	S	.	.			trans	-146.2	99.9	172.5	-168	23	0	0	0	111.2	G655 S659 L660 I783	G655-N657 PolarHBondContact O-N 3.17Å; N657-S659 PolarHBondContact ND2-OG 3.06Å; N657-S659 PolarHBondContact O-N 3.26Å; N657-S659 PolarHBondContact OD1-OG 3.43Å; N657-L660 PolarHBondContact O-N 3Å; N657-I783 HydrophobicContact CB-CD1 3.75Å; N657-I783 HydrophobicContact CB-CG1 4.09Å
658	D	55.1	Low	64	Low	121 Å²	121	47.9 Å²	47.9	65%	0.647	29%	0.288	S	S	*	.	H	α-helix	trans	-56.4	-27.1	-174.9	-62.6	-13	0	0	0	113.3	L660	D658-L660 VanDerWaalsContact C-N 3.34Å; D658-L660 PolarHBondContact O-N 3.16Å
659	S	52.3	Low	63.3	Low	77 Å²	77	49.5 Å²	49.5	54%	0.538	30%	0.299	S	S	.	.	H	α-helix	trans	-70.3	-29.9	-179.6	75.8	0	0	0	0	113.1	N657 S662	N657-S659 PolarHBondContact ND2-OG 3.06Å; N657-S659 PolarHBondContact O-N 3.26Å; N657-S659 PolarHBondContact OD1-OG 3.43Å; S659-S662 PolarHBondContact O-OG 3.42Å
660	L	52.3	Low	62.7	Low	43 Å²	43	53.8 Å²	53.8	23%	0.225	33%	0.329	C	S	.	.	H	α-helix	trans	-103.4	-14.8	-166	-139.4	67	0	0	0	112.9	N657 D658 S662 T663 W782 I783	N657-L660 PolarHBondContact O-N 3Å; D658-L660 VanDerWaalsContact C-N 3.34Å; D658-L660 PolarHBondContact O-N 3.16Å; L660-S662 VanDerWaalsContact C-N 3.28Å; L660-T663 PolarHBondContact O-N 3.24Å; L660-T663 PolarHBondContact O-OG1 3.16Å; L660-W782 HydrophobicContact CD2-CG 4.32Å; L660-I783 HydrophobicContact CD2-CB 4.42Å; L660-I783 HydrophobicContact CD2-CG1 3.89Å
661	E	49.4	Very low	62.3	Low	112 Å²	112	60 Å²	60	52%	0.523	35%	0.353	S	S	.	.	H	α-helix	trans	-69.6	-27.7	170.3	-68.5	-170.6	162.5	0	0	112.1	Y651 T663 G664	Y651-E661 PolarHBondContact OH-OE1 3.31Å; E661-T663 PolarHBondContact O-N 3.24Å; E661-G664 PolarHBondContact O-N 3.05Å
662	S	45.5	Very low	62	Low	100 Å²	100	58.4 Å²	58.4	70%	0.699	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.1	176.8	71.1	0	0	0	0	114.2	S659 L660 G664	S659-S662 PolarHBondContact O-OG 3.42Å; L660-S662 VanDerWaalsContact C-N 3.28Å; S662-G664 PolarHBondContact O-N 2.87Å; S662-G664 VanDerWaalsContact O-N 3.08Å
663	T	50.3	Low	61.8	Low	69 Å²	69	62.7 Å²	62.7	42%	0.423	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	4.1	180	-32	0	0	0	0	112.8	L660 E661 L665	L660-T663 PolarHBondContact O-N 3.24Å; L660-T663 PolarHBondContact O-OG1 3.16Å; E661-T663 PolarHBondContact O-N 3.24Å; T663-L665 VanDerWaalsContact C-N 3.26Å; T663-L665 PolarHBondContact O-N 3.33Å; T663-L665 VanDerWaalsContact O-N 3.17Å
664	G	48	Very low	61.8	Low	69 Å²	69	66.5 Å²	66.5	71%	0.711	38%	0.384	S	S	*	.			trans	71.4	13	163.4	0	0	0	0	0	115.5	E661 S662 G666	E661-G664 PolarHBondContact O-N 3.05Å; S662-G664 PolarHBondContact O-N 2.87Å; S662-G664 VanDerWaalsContact O-N 3.08Å; G664-G666 PolarHBondContact O-N 3.02Å
665	L	53.3	Low	61.9	Low	46 Å²	46	66.4 Å²	66.4	24%	0.241	38%	0.384	C	S	.	.			trans	-89.5	2.1	-161.6	-131.2	89.9	0	0	0	117.1	T663 L667 W782	T663-L665 VanDerWaalsContact C-N 3.26Å; T663-L665 PolarHBondContact O-N 3.33Å; T663-L665 VanDerWaalsContact O-N 3.17Å; L665-L667 HydrophobicContact CB-CD1 3.81Å; L665-L667 HydrophobicContact CB-CG 3.92Å; L665-L667 HydrophobicContact CD2-CD1 4.26Å; L665-L667 HydrophobicContact CD2-CD2 4.13Å; L665-L667 HydrophobicContact CD2-CG 4.12Å; L665-L667 PolarHBondContact O-N 3.46Å; L665-W782 HydrophobicContact CD2-CH2 3.73Å; L665-W782 HydrophobicContact CD2-CZ2 4.17Å; L665-W782 HydrophobicContact CD2-CZ3 4.23Å
666	G	52.6	Low	62.3	Low	49 Å²	49	66.4 Å²	66.4	51%	0.505	38%	0.383	S	S	.	.			trans	54	28.9	179.7	0	0	0	0	0	114.1	G664 S668	G664-G666 PolarHBondContact O-N 3.02Å; G666-S668 CarbonylContact O-C 3.59Å; G666-S668 PolarHBondContact O-N 3.45Å
667	L	57	Low	62.6	Low	36 Å²	36	64.5 Å²	64.5	19%	0.188	38%	0.382	C	S	.	.			trans	-62.2	-32.9	-175.8	-74	149.3	0	0	0	112.3	L665 W782	L665-L667 HydrophobicContact CB-CD1 3.81Å; L665-L667 HydrophobicContact CB-CG 3.92Å; L665-L667 HydrophobicContact CD2-CD1 4.26Å; L665-L667 HydrophobicContact CD2-CD2 4.13Å; L665-L667 HydrophobicContact CD2-CG 4.12Å; L665-L667 PolarHBondContact O-N 3.46Å; L667-W782 HydrophobicContact CD1-CB 4.48Å; L667-W782 HydrophobicContact CD1-CD2 3.51Å; L667-W782 VanDerWaalsContact CD1-CE2 3.4Å; L667-W782 HydrophobicContact CD1-CE3 4.13Å; L667-W782 HydrophobicContact CD1-CG 3.65Å; L667-W782 HydrophobicContact CD1-CZ2 3.94Å; L667-W782 HydrophobicContact CD2-CD2 4Å; L667-W782 HydrophobicContact CD2-CE3 3.82Å; L667-W782 HydrophobicContact CD2-CG 4.37Å; L667-W782 HydrophobicContact CD2-CZ3 4.26Å; L667-W782 HydrophobicContact CG-CD2 4.41Å
668	S	61.1	Low	63.4	Low	26 Å²	26	66.1 Å²	66.1	18%	0.182	39%	0.385	C	S	.	.	S	Bend	trans	-83.6	118.4	165.4	55.1	0	0	0	0	109.2	G666 R673	G666-S668 CarbonylContact O-C 3.59Å; G666-S668 PolarHBondContact O-N 3.45Å; S668-R673 PolarHBondContact O-NE 3.44Å; S668-R673 VanDerWaalsContact O-NE 3.13Å; S668-R673 PolarHBondContact O-NH2 3.42Å; S668-R673 WeakPolarHBondContact OG-CD 3.28Å; S668-R673 PolarHBondContact OG-NE 2.72Å; S668-R673 VanDerWaalsContact OG-NE 3.14Å
669	S	69.8	Low	64.5	Low	35 Å²	35	60.3 Å²	60.3	25%	0.245	35%	0.354	C	S	.	.			trans	-53.8	153.2	171.3	72.2	0	0	0	0	110	R671 L672 R673 E775	S669-R671 PolarHBondContact O-N 2.68Å; S669-L672 PolarHBondContact O-N 3.31Å; S669-L672 WeakPolarHBondContact OG-CB 3.44Å; S669-L672 PolarHBondContact OG-N 3.45Å; S669-R673 PolarHBondContact O-N 3.32Å; S669-R673 VanDerWaalsContact O-N 3.11Å; S669-E775 VanDerWaalsContact CB-OE2 3.29Å; S669-E775 WeakPolarHBondContact CB-OE2 3.47Å; S669-E775 PolarHBondContact OG-OE2 3.48Å
670	S	69.9	Low	65.6	Low	91 Å²	91	59.2 Å²	59.2	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-57.4	-32.3	172.4	52	0	0	0	0	110.8	T674	S670-T674 WeakPolarHBondContact O-CB 3.14Å; S670-T674 PolarHBondContact O-N 3.19Å; S670-T674 PolarHBondContact O-OG1 2.88Å
671	R	74.1	Confident	66.5	Low	130 Å²	130	64.3 Å²	64.3	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-52	175.1	-169.8	-180	-66.8	165	0.4	112.2	S669 R673 T674 T675 T772	S669-R671 PolarHBondContact O-N 2.68Å; R671-R673 VanDerWaalsContact C-N 3.31Å; R671-R673 PolarHBondContact O-N 2.9Å; R671-T674 PolarHBondContact O-N 2.79Å; R671-T675 WeakPolarHBondContact O-CG2 3.46Å; R671-T675 PolarHBondContact O-N 3.44Å; R671-T675 PolarHBondContact O-OG1 3.48Å; R671-T772 HydrophobicContact CB-CG2 4.45Å; R671-T772 HydrophobicContact CG-CG2 3.79Å
672	L	75.9	Confident	67.6	Low	1 Å²	1	61.9 Å²	61.9	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-39.7	178.9	-179.3	65.4	0	0	0	111.8	S669 T675 L676 L776 P779	S669-L672 PolarHBondContact O-N 3.31Å; S669-L672 WeakPolarHBondContact OG-CB 3.44Å; S669-L672 PolarHBondContact OG-N 3.45Å; L672-T675 VanDerWaalsContact CA-OG1 3.3Å; L672-T675 WeakPolarHBondContact CA-OG1 3.47Å; L672-T675 PolarHBondContact O-N 3.43Å; L672-T675 PolarHBondContact O-OG1 3.22Å; L672-L676 HydrophobicContact CD1-CD1 4.02Å; L672-L676 HydrophobicContact CD1-CG 4.15Å; L672-L676 HydrophobicContact CG-CD1 3.84Å; L672-L676 HydrophobicContact CG-CG 4.38Å; L672-L676 WeakPolarHBondContact O-CB 3.12Å; L672-L676 WeakPolarHBondContact O-CG 3.36Å; L672-L676 PolarHBondContact O-N 3.47Å; L672-L776 HydrophobicContact CD1-CD1 4.42Å; L672-L776 HydrophobicContact CD2-CD1 4.39Å; L672-P779 HydrophobicContact CD2-CG 4.41Å
673	R	75.3	Confident	68.6	Low	118 Å²	118	57.6 Å²	57.6	45%	0.445	33%	0.328	S	S	.	.	H	α-helix	trans	-64.5	-45.4	175.2	-82.9	177.7	-80.5	177.1	-11.1	112	S668 S669 R671 T675 L676 N677	S668-R673 PolarHBondContact O-NE 3.44Å; S668-R673 VanDerWaalsContact O-NE 3.13Å; S668-R673 PolarHBondContact O-NH2 3.42Å; S668-R673 WeakPolarHBondContact OG-CD 3.28Å; S668-R673 PolarHBondContact OG-NE 2.72Å; S668-R673 VanDerWaalsContact OG-NE 3.14Å; S669-R673 PolarHBondContact O-N 3.32Å; S669-R673 VanDerWaalsContact O-N 3.11Å; R671-R673 VanDerWaalsContact C-N 3.31Å; R671-R673 PolarHBondContact O-N 2.9Å; R673-T675 VanDerWaalsContact C-N 3.33Å; R673-T675 PolarHBondContact O-N 3.36Å; R673-L676 PolarHBondContact O-N 3.45Å; R673-N677 VanDerWaalsContact O-CB 3.32Å; R673-N677 WeakPolarHBondContact O-CB 3.44Å; R673-N677 PolarHBondContact O-N 3.26Å; R673-N677 PolarHBondContact O-ND2 3.07Å
674	T	78.5	Confident	69.7	Low	96 Å²	96	54.4 Å²	54.4	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-63	-39.4	176.5	-57.2	0	0	0	0	111.7	S670 R671 R678	S670-T674 WeakPolarHBondContact O-CB 3.14Å; S670-T674 PolarHBondContact O-N 3.19Å; S670-T674 PolarHBondContact O-OG1 2.88Å; R671-T674 PolarHBondContact O-N 2.79Å; T674-R678 VanDerWaalsContact O-CB 3.28Å; T674-R678 WeakPolarHBondContact O-CB 3.32Å; T674-R678 PolarHBondContact O-N 3.34Å
675	T	77.3	Confident	70.5	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-70.3	-42.5	178.8	54.3	0	0	0	0	112	R671 L672 R673 R678 I679 Q768	R671-T675 WeakPolarHBondContact O-CG2 3.46Å; R671-T675 PolarHBondContact O-N 3.44Å; R671-T675 PolarHBondContact O-OG1 3.48Å; L672-T675 VanDerWaalsContact CA-OG1 3.3Å; L672-T675 WeakPolarHBondContact CA-OG1 3.47Å; L672-T675 PolarHBondContact O-N 3.43Å; L672-T675 PolarHBondContact O-OG1 3.22Å; R673-T675 VanDerWaalsContact C-N 3.33Å; R673-T675 PolarHBondContact O-N 3.36Å; T675-R678 PolarHBondContact O-N 3.37Å; T675-I679 WeakPolarHBondContact O-CB 3.48Å; T675-I679 WeakPolarHBondContact O-CD1 3.4Å; T675-I679 WeakPolarHBondContact O-CG1 3.12Å; T675-I679 PolarHBondContact O-N 3.38Å; T675-Q768 HydrophobicContact CG2-CB 4.08Å; T675-Q768 WeakPolarHBondContact CG2-O 3.38Å
676	L	76.5	Confident	70.6	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-42.2	175.9	-71.3	169.7	0	0	0	111.6	Y648 Y651 L672 R673 I679 Q680	Y648-L676 HydrophobicContact CD2-CD2 4.22Å; Y651-L676 HydrophobicContact CD1-CD1 3.8Å; Y651-L676 HydrophobicContact CD1-CD2 3.82Å; Y651-L676 HydrophobicContact CD1-CG 4.38Å; Y651-L676 HydrophobicContact CD2-CD1 3.83Å; Y651-L676 HydrophobicContact CE1-CD1 3.78Å; Y651-L676 HydrophobicContact CE1-CD2 4.49Å; Y651-L676 HydrophobicContact CE2-CD1 3.82Å; Y651-L676 HydrophobicContact CG-CD1 3.81Å; Y651-L676 HydrophobicContact CG-CD2 3.9Å; L672-L676 HydrophobicContact CD1-CD1 4.02Å; L672-L676 HydrophobicContact CD1-CG 4.15Å; L672-L676 HydrophobicContact CG-CD1 3.84Å; L672-L676 HydrophobicContact CG-CG 4.38Å; L672-L676 WeakPolarHBondContact O-CB 3.12Å; L672-L676 WeakPolarHBondContact O-CG 3.36Å; L672-L676 PolarHBondContact O-N 3.47Å; R673-L676 PolarHBondContact O-N 3.45Å; L676-I679 PolarHBondContact O-N 3.28Å; L676-Q680 VanDerWaalsContact O-CB 3.24Å; L676-Q680 WeakPolarHBondContact O-CB 3.45Å; L676-Q680 PolarHBondContact O-N 2.87Å
677	N	76.8	Confident	70.1	Confident	87 Å²	87	59.6 Å²	59.6	47%	0.465	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-43.2	174.9	-71.7	-9.2	0	0	0	111.6	R673 I679 Q680 E681	R673-N677 VanDerWaalsContact O-CB 3.32Å; R673-N677 WeakPolarHBondContact O-CB 3.44Å; R673-N677 PolarHBondContact O-N 3.26Å; R673-N677 PolarHBondContact O-ND2 3.07Å; N677-I679 PolarHBondContact O-N 3.47Å; N677-Q680 PolarHBondContact O-N 3.32Å; N677-E681 WeakPolarHBondContact O-CB 3.33Å; N677-E681 WeakPolarHBondContact O-CG 3.39Å; N677-E681 PolarHBondContact O-N 3.47Å
678	R	80.2	Confident	69.4	Low	74 Å²	74	64.8 Å²	64.8	28%	0.279	34%	0.336	S	S	.	.	H	α-helix	trans	-57.2	-49.1	174.2	-179.3	-170.9	70	110.4	13.5	111	D644 T674 T675 Q680 E681 S682 T769	D644-R678 IonicContact OD1-NH2 3.89Å; D644-R678 IonicContact OD2-CZ 3.03Å; D644-R678 IonicContact OD2-NH2 3.24Å; D644-R678 PolarHBondContact OD2-NH2 2.88Å; T674-R678 VanDerWaalsContact O-CB 3.28Å; T674-R678 WeakPolarHBondContact O-CB 3.32Å; T674-R678 PolarHBondContact O-N 3.34Å; T675-R678 PolarHBondContact O-N 3.37Å; R678-Q680 VanDerWaalsContact C-N 3.35Å; R678-E681 PolarHBondContact O-N 2.92Å; R678-S682 VanDerWaalsContact O-CB 3.27Å; R678-S682 WeakPolarHBondContact O-CB 3.39Å; R678-S682 PolarHBondContact O-N 3.48Å; R678-S682 PolarHBondContact O-OG 2.93Å; R678-T769 PolarHBondContact NH2-OG1 3Å; R678-T769 VanDerWaalsContact NH2-OG1 3.14Å
679	I	79.2	Confident	68.1	Low	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-44	179.9	-68.1	165.6	0	0	0	110.4	D644 L647 Y648 T675 L676 N677 E681 S682 L683 I684	D644-I679 HydrophobicContact CB-CD1 3.89Å; D644-I679 HydrophobicContact CB-CG1 3.89Å; D644-I679 HydrophobicContact CB-CG2 4.29Å; L647-I679 HydrophobicContact CD2-CD1 4.23Å; Y648-I679 HydrophobicContact CD2-CG2 4.16Å; Y648-I679 HydrophobicContact CG-CG2 4.18Å; T675-I679 WeakPolarHBondContact O-CB 3.48Å; T675-I679 WeakPolarHBondContact O-CD1 3.4Å; T675-I679 WeakPolarHBondContact O-CG1 3.12Å; T675-I679 PolarHBondContact O-N 3.38Å; L676-I679 PolarHBondContact O-N 3.28Å; N677-I679 PolarHBondContact O-N 3.47Å; I679-E681 PolarHBondContact O-N 3.24Å; I679-S682 PolarHBondContact O-N 3.34Å; I679-S682 PolarHBondContact O-OG 3.39Å; I679-L683 HydrophobicContact CG2-CD1 4.29Å; I679-L683 WeakPolarHBondContact O-CB 3.34Å; I679-L683 PolarHBondContact O-N 2.85Å; I679-I684 HydrophobicContact CG2-CD1 3.85Å
680	Q	75.6	Confident	66.5	Low	53 Å²	53	69.3 Å²	69.3	25%	0.248	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-42.8	176.9	-176.4	173.8	-19.1	0	0	112.6	Y648 L676 N677 R678 I684 L686	Y648-Q680 HydrophobicContact CE2-CB 4.13Å; L676-Q680 VanDerWaalsContact O-CB 3.24Å; L676-Q680 WeakPolarHBondContact O-CB 3.45Å; L676-Q680 PolarHBondContact O-N 2.87Å; N677-Q680 PolarHBondContact O-N 3.32Å; R678-Q680 VanDerWaalsContact C-N 3.35Å; Q680-I684 HydrophobicContact CB-CD1 4.44Å; Q680-L686 HydrophobicContact CG-CD1 3.66Å; Q680-L686 VanDerWaalsContact NE2-CD1 3.29Å
681	E	71	Confident	64.8	Low	150 Å²	150	70.4 Å²	70.4	70%	0.701	37%	0.373	S	S	*	.	H	α-helix	trans	-72.5	-35.9	177.6	-72.8	176.1	-178.4	0	0	112.6	N677 R678 I679 K705	N677-E681 WeakPolarHBondContact O-CB 3.33Å; N677-E681 WeakPolarHBondContact O-CG 3.39Å; N677-E681 PolarHBondContact O-N 3.47Å; R678-E681 PolarHBondContact O-N 2.92Å; I679-E681 PolarHBondContact O-N 3.24Å; E681-K705 PolarHBondContact O-NZ 3.19Å
682	S	71.1	Confident	63.2	Low	61 Å²	61	70.1 Å²	70.1	43%	0.427	39%	0.388	S	S	.	.	H	α-helix	trans	-86.9	-35.9	-173.4	67.2	0	0	0	0	114.8	R678 I679	R678-S682 VanDerWaalsContact O-CB 3.27Å; R678-S682 WeakPolarHBondContact O-CB 3.39Å; R678-S682 PolarHBondContact O-N 3.48Å; R678-S682 PolarHBondContact O-OG 2.93Å; I679-S682 PolarHBondContact O-N 3.34Å; I679-S682 PolarHBondContact O-OG 3.39Å
683	L	67.6	Low	61.6	Low	10 Å²	10	76.2 Å²	76.2	5%	0.052	43%	0.425	C	S	.	.	H	α-helix	trans	-121.6	-22.6	-166.6	-69.2	170.1	0	0	0	114.8	Q641 D644 I679 V706	Q641-L683 HydrophobicContact CB-CD1 4.33Å; Q641-L683 HydrophobicContact CB-CD2 4.18Å; Q641-L683 HydrophobicContact CG-CD1 4.32Å; Q641-L683 HydrophobicContact CG-CD2 3.76Å; D644-L683 HydrophobicContact CB-CD1 3.64Å; I679-L683 HydrophobicContact CG2-CD1 4.29Å; I679-L683 WeakPolarHBondContact O-CB 3.34Å; I679-L683 PolarHBondContact O-N 2.85Å; L683-V706 PolarHBondContact O-N 3.35Å
684	I	72.2	Confident	59.8	Low	3 Å²	3	72.6 Å²	72.6	2%	0.015	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.5	-176	-66.4	117	0	0	0	111.3	Y648 I679 Q680 L686 V706	Y648-I684 HydrophobicContact CD1-CD1 3.29Å; Y648-I684 HydrophobicContact CD1-CG1 3.85Å; Y648-I684 HydrophobicContact CD2-CD1 3.63Å; Y648-I684 HydrophobicContact CE1-CD1 3.29Å; Y648-I684 HydrophobicContact CE1-CG1 3.64Å; Y648-I684 HydrophobicContact CE1-CG2 4.45Å; Y648-I684 HydrophobicContact CE2-CD1 3.64Å; Y648-I684 HydrophobicContact CG-CD1 3.45Å; Y648-I684 VanDerWaalsContact CG-CD1 3.45Å; Y648-I684 HydrophobicContact CG-CG1 4.47Å; Y648-I684 VanDerWaalsContact CZ-CD1 3.47Å; I679-I684 HydrophobicContact CG2-CD1 3.85Å; Q680-I684 HydrophobicContact CB-CD1 4.44Å; I684-L686 HydrophobicContact CG2-CG 4.34Å; I684-V706 WeakPolarHBondContact CA-O 3.39Å
685	D	66	Low	58.2	Low	43 Å²	43	72.8 Å²	72.8	23%	0.23	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.9	165.7	-157.1	-12.2	0	0	0	109.7	E687 K705 V706	D685-E687 PolarHBondContact OD1-N 3Å; D685-K705 HydrophobicContact CB-CB 4.03Å; D685-V706 PolarHBondContact N-O 3.3Å
686	L	55.2	Low	56.8	Low	100 Å²	100	80.3 Å²	80.3	52%	0.524	46%	0.461	S	S	.	.			trans	-87.2	-15.9	177	-77.3	134	0	0	0	112.4	Q680 I684	Q680-L686 HydrophobicContact CG-CD1 3.66Å; Q680-L686 VanDerWaalsContact NE2-CD1 3.29Å; I684-L686 HydrophobicContact CG2-CG 4.34Å
687	E	41.8	Very low	55.3	Low	130 Å²	130	84.8 Å²	84.8	61%	0.607	49%	0.489	S	S	*	.			trans	-104.5	85.6	-175.4	-68.6	-168.7	-178.3	0	0	110.9	D685 S689	D685-E687 PolarHBondContact OD1-N 3Å; E687-S689 PolarHBondContact O-N 3.46Å
688	V	43.1	Very low	53.4	Low	144 Å²	144	81.9 Å²	81.9	87%	0.873	48%	0.477	S	S	*	.			trans	-75.1	58.9	154.2	-169.1	0	0	0	0	108.1
689	S	34.1	Very low	51.3	Low	54 Å²	54	80.4 Å²	80.4	38%	0.378	48%	0.481	S	S	.	.			trans	-97.8	115.2	171.7	68.4	0	0	0	0	108.8	E687 D691	E687-S689 PolarHBondContact O-N 3.46Å; S689-D691 PolarHBondContact O-N 3.43Å
690	A	35.3	Very low	49.6	Very low	103 Å²	103	87 Å²	87	85%	0.851	51%	0.511	S	S	*	.			trans	-75.7	56.9	-179.1	0	0	0	0	0	112
691	D	34.1	Very low	47.9	Very low	114 Å²	114	91.3 Å²	91.3	61%	0.61	53%	0.532	S	S	*	.			trans	-102.6	113.6	173.1	-94.1	-18.1	0	0	0	111.3	S689 T693	S689-D691 PolarHBondContact O-N 3.43Å; D691-T693 PolarHBondContact O-N 2.79Å; D691-T693 VanDerWaalsContact O-N 3.15Å
692	P	39.4	Very low	46.6	Very low	124 Å²	124	89.2 Å²	89.2	81%	0.805	52%	0.517	S	S	*	.			trans	-81	14.6	-172.1	32.8	-34.2	0	0	0	114.2
693	T	43.8	Very low	45.6	Very low	128 Å²	128	92.4 Å²	92.4	79%	0.785	52%	0.523	S	S	*	.			trans	-117.5	39.8	-172.3	53.3	0	0	0	0	114.2	D691	D691-T693 PolarHBondContact O-N 2.79Å; D691-T693 VanDerWaalsContact O-N 3.15Å
694	A	37	Very low	44.8	Very low	43 Å²	43	97.3 Å²	97.3	36%	0.355	55%	0.546	S	S	.	.			trans	-94.4	135.9	171.1	0	0	0	0	0	111.3	A698	A694-A698 HydrophobicContact CB-CB 4.08Å
695	T	44.8	Very low	44.3	Very low	100 Å²	100	101 Å²	101	61%	0.613	56%	0.562	S	S	*	*			trans	-56.7	152.6	179.6	40.8	0	0	0	0	113	T697 A698 A699	T695-T697 PolarHBondContact O-N 2.92Å; T695-A698 WeakPolarHBondContact O-CB 3.47Å; T695-A698 PolarHBondContact O-N 2.7Å; T695-A699 PolarHBondContact O-N 2.99Å
696	L	48.6	Very low	44.2	Very low	160 Å²	160	99.4 Å²	99.4	84%	0.838	55%	0.554	S	S	*	*	H	α-helix	trans	-51.4	-26.7	-177.8	-73.7	160.3	0	0	0	114.5
697	T	44.2	Very low	44.8	Very low	99 Å²	99	97 Å²	97	61%	0.607	54%	0.544	S	S	*	.	H	α-helix	trans	-75.4	-34.1	176.3	52.3	0	0	0	0	113.3	T695 A699 E700 E701	T695-T697 PolarHBondContact O-N 2.92Å; T697-A699 VanDerWaalsContact C-N 3.29Å; T697-A699 PolarHBondContact O-N 3.09Å; T697-E700 PolarHBondContact O-N 3.5Å; T697-E701 PolarHBondContact O-N 2.88Å
698	A	36.8	Very low	45.7	Very low	26 Å²	26	92.5 Å²	92.5	22%	0.215	53%	0.527	C	S	.	.	H	α-helix	trans	-72.9	-23.8	175.4	0	0	0	0	0	112.1	A694 T695 R702	A694-A698 HydrophobicContact CB-CB 4.08Å; T695-A698 WeakPolarHBondContact O-CB 3.47Å; T695-A698 PolarHBondContact O-N 2.7Å; A698-R702 VanDerWaalsContact O-CB 3.28Å; A698-R702 WeakPolarHBondContact O-CB 3.44Å; A698-R702 VanDerWaalsContact O-CG 3.23Å; A698-R702 WeakPolarHBondContact O-CG 3.39Å; A698-R702 PolarHBondContact O-N 3.29Å
699	A	37.2	Very low	47	Very low	44 Å²	44	85.8 Å²	85.8	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-73.1	-26.5	175.4	0	0	0	0	0	113.2	T695 T697 K703	T695-A699 PolarHBondContact O-N 2.99Å; T697-A699 VanDerWaalsContact C-N 3.29Å; T697-A699 PolarHBondContact O-N 3.09Å; A699-K703 VanDerWaalsContact O-CG 3.26Å; A699-K703 WeakPolarHBondContact O-CG 3.42Å; A699-K703 PolarHBondContact O-N 3.04Å
700	E	43.5	Very low	48.5	Very low	137 Å²	137	88.9 Å²	88.9	64%	0.64	50%	0.495	S	S	*	.	H	α-helix	trans	-79	-38.6	173.6	-73.7	-176.2	157.1	0	0	112	T697 K703	T697-E700 PolarHBondContact O-N 3.5Å; E700-K703 WeakPolarHBondContact O-CB 3.33Å; E700-K703 PolarHBondContact O-N 3.42Å; E700-K703 VanDerWaalsContact O-N 3.17Å
701	E	39.8	Very low	50	Low	144 Å²	144	86.3 Å²	86.3	67%	0.673	47%	0.466	S	S	*	.	H	α-helix	trans	-69.4	-35.4	173.4	-70.7	-179.6	166	0	0	112.5	T697 K703 E704	T697-E701 PolarHBondContact O-N 2.88Å; E701-K703 PolarHBondContact O-N 2.9Å; E701-E704 PolarHBondContact O-N 2.85Å
702	R	44	Very low	51.4	Low	107 Å²	107	81.6 Å²	81.6	40%	0.404	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.5	170.4	-77.9	176.5	-179.2	173.3	-1.5	113.6	A698	A698-R702 VanDerWaalsContact O-CB 3.28Å; A698-R702 WeakPolarHBondContact O-CB 3.44Å; A698-R702 VanDerWaalsContact O-CG 3.23Å; A698-R702 WeakPolarHBondContact O-CG 3.39Å; A698-R702 PolarHBondContact O-N 3.29Å
703	K	48.8	Very low	52.3	Low	127 Å²	127	85 Å²	85	55%	0.552	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-16.4	177	-82.8	173	-179.2	-178.8	0	113.4	R454 A699 E700 E701	R454-K703 VanDerWaalsContact NH1-CA 3.31Å; R454-K703 VanDerWaalsContact NH1-CB 3.34Å; R454-K703 PolarHBondContact NH1-O 2.72Å; A699-K703 VanDerWaalsContact O-CG 3.26Å; A699-K703 WeakPolarHBondContact O-CG 3.42Å; A699-K703 PolarHBondContact O-N 3.04Å; E700-K703 WeakPolarHBondContact O-CB 3.33Å; E700-K703 PolarHBondContact O-N 3.42Å; E700-K703 VanDerWaalsContact O-N 3.17Å; E701-K703 PolarHBondContact O-N 2.9Å
704	E	50.8	Low	52.9	Low	113 Å²	113	84.9 Å²	84.9	53%	0.528	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-14.7	178.9	-72.6	-172.8	164.1	0	0	113.5	K450 E701	K450-E704 IonicContact NZ-OE1 3.57Å; K450-E704 PolarHBondContact NZ-OE1 3.41Å; E701-E704 PolarHBondContact O-N 2.85Å
705	K	61.5	Low	54	Low	81 Å²	81	83.4 Å²	83.4	35%	0.352	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-91.7	140	179.8	-62.8	-171.4	177.7	-163.5	0	112.4	E681 D685	E681-K705 PolarHBondContact O-NZ 3.19Å; D685-K705 HydrophobicContact CB-CB 4.03Å
706	V	64.9	Low	54.8	Low	9 Å²	9	82.2 Å²	82.2	6%	0.055	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	142	-179.4	-173.4	0	0	0	0	109.6	L457 Y645 L683 I684 D685	L457-V706 HydrophobicContact CB-CG2 4.19Å; L457-V706 HydrophobicContact CD1-CG2 3.92Å; Y645-V706 HydrophobicContact CE2-CB 4Å; Y645-V706 HydrophobicContact CE2-CG1 3.72Å; L683-V706 PolarHBondContact O-N 3.35Å; I684-V706 WeakPolarHBondContact CA-O 3.39Å; D685-V706 PolarHBondContact N-O 3.3Å
707	P	66.6	Low	55.6	Low	49 Å²	49	76.2 Å²	76.2	32%	0.318	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	151	173.4	-23.1	33.3	0	0	0	112.8	Y645	Y645-P707 PolarHBondContact OH-O 3.49Å
708	S	61.7	Low	56.4	Low	37 Å²	37	77.1 Å²	77.1	26%	0.259	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-60.7	132.3	175.1	58.2	0	0	0	0	111.2	H710	S708-H710 PolarHBondContact O-CD2 3.46Å
709	P	70.4	Confident	57.7	Low	2 Å²	2	77.7 Å²	77.7	1%	0.013	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-69.8	145.2	179.9	29.7	-34.5	0	0	0	110.9	A649 F653	A649-P709 HydrophobicContact CB-CB 4.26Å; A649-P709 HydrophobicContact CB-CG 3.67Å; F653-P709 HydrophobicContact CE1-CB 3.85Å; F653-P709 HydrophobicContact CE1-CG 4.19Å; F653-P709 WeakPolarHBondContact CE1-O 3.36Å; F653-P709 HydrophobicContact CZ-CB 3.71Å; F653-P709 HydrophobicContact CZ-CG 4.31Å
710	H	65.9	Low	58.8	Low	120 Å²	120	76.7 Å²	76.7	56%	0.556	39%	0.39	S	S	*	.			trans	-109.8	141.5	176.3	-66	170.3	0	0	0	112.1	E465 F653 S708	E465-H710 WeakPolarHBondContact CG-O 3.26Å; F653-H710 WeakPolarHBondContact CE1-O 3.15Å; F653-H710 WeakPolarHBondContact CZ-O 3.47Å; S708-H710 PolarHBondContact O-CD2 3.46Å
711	L	66.3	Low	59.7	Low	48 Å²	48	76.4 Å²	76.4	25%	0.251	39%	0.393	S	S	.	.			trans	-71.4	135.5	178.1	-177.6	66.3	0	0	0	110.1	F653 F654 H713 V715 L717	F653-L711 HydrophobicContact CB-CD1 4.11Å; F653-L711 HydrophobicContact CD1-CB 3.95Å; F653-L711 HydrophobicContact CD1-CD1 4.4Å; F653-L711 HydrophobicContact CD2-CD1 4.18Å; F653-L711 HydrophobicContact CE1-CB 4.29Å; F653-L711 VanDerWaalsContact CE1-N 3.33Å; F653-L711 HydrophobicContact CG-CB 4.36Å; F653-L711 HydrophobicContact CG-CD1 3.99Å; F654-L711 HydrophobicContact CZ-CD1 4.32Å; L711-H713 PolarHBondContact O-N 3.37Å; L711-V715 HydrophobicContact CD1-CB 4.1Å; L711-V715 HydrophobicContact CD1-CG1 4.16Å; L711-V715 HydrophobicContact CD1-CG2 4.08Å; L711-V715 HydrophobicContact CD2-CB 4.22Å; L711-V715 HydrophobicContact CD2-CG1 4.12Å; L711-V715 HydrophobicContact CG-CB 4.17Å; L711-V715 HydrophobicContact CG-CG1 4.45Å; L711-L717 HydrophobicContact CD2-CD1 3.4Å; L711-L717 VanDerWaalsContact CD2-CD1 3.4Å; L711-L717 HydrophobicContact CD2-CG 4.07Å
712	S	63	Low	60.7	Low	15 Å²	15	71.5 Å²	71.5	11%	0.105	37%	0.373	C	S	.	.			trans	-55.3	135.6	174.3	-168.7	0	0	0	0	111.6	E465 L714 V715	E465-S712 WeakPolarHBondContact O-CA 3.25Å; E465-S712 WeakPolarHBondContact O-CB 3.38Å; E465-S712 PolarHBondContact O-OG 3.07Å; S712-L714 PolarHBondContact O-N 3.22Å; S712-L714 PolarHBondContact OG-N 3.49Å; S712-V715 PolarHBondContact O-N 2.95Å; S712-V715 VanDerWaalsContact O-N 3.16Å
713	H	58	Low	61.7	Low	197 Å²	197	66.4 Å²	66.4	91%	0.912	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-11.9	173.9	-65.3	-64.1	0	0	0	113.8	L711	L711-H713 PolarHBondContact O-N 3.37Å
714	L	57	Low	62.9	Low	125 Å²	125	63 Å²	63	65%	0.654	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-18.6	179.1	-59.5	176.5	0	0	0	113.2	T468 S712	T468-L714 HydrophobicContact CG2-CD1 4.27Å; S712-L714 PolarHBondContact O-N 3.22Å; S712-L714 PolarHBondContact OG-N 3.49Å
715	V	60.6	Low	63.9	Low	11 Å²	11	57.8 Å²	57.8	7%	0.067	32%	0.315	C	S	.	.			trans	-87.3	110.6	-178.6	179.1	0	0	0	0	109.6	F654 L711 S712 L717 E728	F654-V715 HydrophobicContact CE1-CG1 4.29Å; L711-V715 HydrophobicContact CD1-CB 4.1Å; L711-V715 HydrophobicContact CD1-CG1 4.16Å; L711-V715 HydrophobicContact CD1-CG2 4.08Å; L711-V715 HydrophobicContact CD2-CB 4.22Å; L711-V715 HydrophobicContact CD2-CG1 4.12Å; L711-V715 HydrophobicContact CG-CB 4.17Å; L711-V715 HydrophobicContact CG-CG1 4.45Å; S712-V715 PolarHBondContact O-N 2.95Å; S712-V715 VanDerWaalsContact O-N 3.16Å; V715-L717 HydrophobicContact CG1-CD2 3.96Å; V715-L717 HydrophobicContact CG1-CG 4.02Å; V715-L717 PolarHBondContact O-N 3.49Å; V715-E728 HydrophobicContact CG1-CG 4.49Å; V715-E728 WeakPolarHBondContact CG1-OE2 3.21Å
716	V	60.7	Low	64.7	Low	76 Å²	76	54 Å²	54	46%	0.461	30%	0.298	S	S	.	.			trans	-94.2	87.9	-175.5	-175.4	0	0	0	0	111.3	T718	V716-T718 VanDerWaalsContact C-N 3.28Å; V716-T718 PolarHBondContact O-N 3.03Å
717	L	65.7	Low	65.3	Low	34 Å²	34	54.8 Å²	54.8	18%	0.178	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-2	179.4	-65.8	-178.8	0	0	0	115.4	F654 L711 V715 Y724	F654-L717 HydrophobicContact CD1-CD1 4.42Å; F654-L717 HydrophobicContact CD1-CD2 4.04Å; F654-L717 HydrophobicContact CE1-CD2 3.93Å; L711-L717 HydrophobicContact CD2-CD1 3.4Å; L711-L717 VanDerWaalsContact CD2-CD1 3.4Å; L711-L717 HydrophobicContact CD2-CG 4.07Å; V715-L717 HydrophobicContact CG1-CD2 3.96Å; V715-L717 HydrophobicContact CG1-CG 4.02Å; V715-L717 PolarHBondContact O-N 3.49Å; L717-Y724 WeakPolarHBondContact O-CB 3.47Å
718	T	61.5	Low	66	Low	118 Å²	118	54.4 Å²	54.4	72%	0.724	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-10.8	-171.6	46.3	0	0	0	0	114.5	V716	V716-T718 VanDerWaalsContact C-N 3.28Å; V716-T718 PolarHBondContact O-N 3.03Å
719	S	63.9	Low	67	Low	37 Å²	37	53 Å²	53	26%	0.259	29%	0.289	S	S	.	.			trans	-83.7	121.3	-174.7	63.2	0	0	0	0	112.6	D721 T722 Y724	S719-D721 VanDerWaalsContact C-N 3.28Å; S719-D721 PolarHBondContact O-N 2.84Å; S719-T722 PolarHBondContact O-N 2.99Å; S719-T722 PolarHBondContact O-OG1 2.94Å; S719-T722 PolarHBondContact OG-OG1 3.16Å; S719-Y724 PolarHBondContact O-N 3.22Å
720	G	60.8	Low	67.5	Low	23 Å²	23	52.9 Å²	52.9	24%	0.237	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-67.9	-25.1	177.4	0	0	0	0	0	114	T722 L723	G720-T722 VanDerWaalsContact C-N 3.32Å; G720-T722 PolarHBondContact O-N 2.92Å; G720-L723 PolarHBondContact O-N 3.1Å
721	D	61.2	Low	68.3	Low	131 Å²	131	47.2 Å²	47.2	70%	0.701	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-73.5	-21.8	179.3	-67	-24.3	0	0	0	113.3	S719	S719-D721 VanDerWaalsContact C-N 3.28Å; S719-D721 PolarHBondContact O-N 2.84Å
722	T	62.6	Low	69.1	Low	42 Å²	42	45 Å²	45	26%	0.258	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-101.6	14	174.5	68	0	0	0	0	112.8	S719 G720 Y724 G725 L726	S719-T722 PolarHBondContact O-N 2.99Å; S719-T722 PolarHBondContact O-OG1 2.94Å; S719-T722 PolarHBondContact OG-OG1 3.16Å; G720-T722 VanDerWaalsContact C-N 3.32Å; G720-T722 PolarHBondContact O-N 2.92Å; T722-Y724 VanDerWaalsContact C-N 3.31Å; T722-Y724 PolarHBondContact O-N 2.58Å; T722-G725 PolarHBondContact O-N 3.1Å; T722-G725 PolarHBondContact OG1-N 2.92Å; T722-L726 PolarHBondContact O-N 2.92Å
723	L	64.4	Low	70.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	47.2	-170.7	-68.4	171.1	0	0	0	112	G720 G725 L726 V784 A788 F826 R829 V833	G720-L723 PolarHBondContact O-N 3.1Å; L723-G725 VanDerWaalsContact C-N 3.33Å; L723-G725 PolarHBondContact O-N 3.35Å; L723-L726 HydrophobicContact CB-CB 3.8Å; L723-L726 HydrophobicContact CB-CD2 4.26Å; L723-L726 HydrophobicContact CD1-CD2 3.73Å; L723-L726 PolarHBondContact O-N 2.93Å; L723-V784 HydrophobicContact CB-CG1 4.42Å; L723-A788 HydrophobicContact CD2-CB 4.37Å; L723-F826 HydrophobicContact CD1-CE2 4.42Å; L723-F826 HydrophobicContact CD2-CD2 4Å; L723-F826 HydrophobicContact CD2-CE2 4.25Å; L723-R829 HydrophobicContact CD1-CB 3.83Å; L723-R829 HydrophobicContact CD2-CB 3.98Å; L723-R829 HydrophobicContact CG-CB 3.88Å; L723-V833 HydrophobicContact CD1-CG2 4.09Å
724	Y	73.4	Confident	71.3	Confident	55 Å²	55	35.8 Å²	35.8	22%	0.216	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	42	176	-54.8	-82.3	0	0	0	113.7	L717 S719 T722 R729 K787	L717-Y724 WeakPolarHBondContact O-CB 3.47Å; S719-Y724 PolarHBondContact O-N 3.22Å; T722-Y724 VanDerWaalsContact C-N 3.31Å; T722-Y724 PolarHBondContact O-N 2.58Å; Y724-R729 PolarHBondContact O-NE 3.2Å; Y724-R729 VanDerWaalsContact O-NE 3.11Å; Y724-R729 PolarHBondContact O-NH2 3.37Å; Y724-K787 HydrophobicContact CD1-CB 4.26Å; Y724-K787 HydrophobicContact CD1-CD 4Å; Y724-K787 HydrophobicContact CD2-CB 3.63Å; Y724-K787 HydrophobicContact CE1-CB 4.04Å; Y724-K787 HydrophobicContact CE1-CD 4.14Å; Y724-K787 VanDerWaalsContact CE2-C 3.41Å; Y724-K787 HydrophobicContact CE2-CB 3.41Å; Y724-K787 VanDerWaalsContact CE2-CB 3.41Å; Y724-K787 WeakPolarHBondContact CE2-O 2.97Å; Y724-K787 HydrophobicContact CG-CB 4.07Å; Y724-K787 HydrophobicContact CG-CD 4.27Å; Y724-K787 PolarHBondContact OH-O 3.49Å
725	G	72.3	Confident	72.6	Confident	4 Å²	4	29.9 Å²	29.9	4%	0.041	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	33.5	-179.6	0	0	0	0	0	113.6	T722 L723 A727 E728 R729	T722-G725 PolarHBondContact O-N 3.1Å; T722-G725 PolarHBondContact OG1-N 2.92Å; L723-G725 VanDerWaalsContact C-N 3.33Å; L723-G725 PolarHBondContact O-N 3.35Å; G725-A727 VanDerWaalsContact C-N 3.26Å; G725-A727 PolarHBondContact O-N 3.48Å; G725-E728 PolarHBondContact O-N 3.31Å; G725-R729 WeakPolarHBondContact O-CG 3.37Å; G725-R729 PolarHBondContact O-N 3.03Å; G725-R729 VanDerWaalsContact O-N 3.07Å
726	L	78.5	Confident	73.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-39.6	-178	177.7	62.1	0	0	0	112.2	T722 L723 E728 R729 V730 Y781 V784 L830 V833 I839 L847	T722-L726 PolarHBondContact O-N 2.92Å; L723-L726 HydrophobicContact CB-CB 3.8Å; L723-L726 HydrophobicContact CB-CD2 4.26Å; L723-L726 HydrophobicContact CD1-CD2 3.73Å; L723-L726 PolarHBondContact O-N 2.93Å; L726-E728 PolarHBondContact O-N 3.35Å; L726-R729 PolarHBondContact O-N 3.12Å; L726-V730 HydrophobicContact CD1-CG2 3.79Å; L726-V730 HydrophobicContact CG-CG2 4.15Å; L726-V730 WeakPolarHBondContact O-CB 3.39Å; L726-V730 WeakPolarHBondContact O-CG2 3.48Å; L726-V730 PolarHBondContact O-N 2.99Å; L726-Y781 HydrophobicContact CD1-CD1 4.19Å; L726-Y781 HydrophobicContact CD1-CE1 4.28Å; L726-V784 HydrophobicContact CB-CG1 4.5Å; L726-V784 HydrophobicContact CD1-CG1 4.25Å; L726-V784 HydrophobicContact CD1-CG2 4.25Å; L726-L830 HydrophobicContact CD2-CD1 3.73Å; L726-V833 HydrophobicContact CB-CG1 4.46Å; L726-V833 HydrophobicContact CD2-CG1 4.23Å; L726-V833 HydrophobicContact CG-CG1 4.31Å; L726-I839 HydrophobicContact CD2-CD1 4.48Å; L726-L847 HydrophobicContact CD1-CD1 3.94Å; L726-L847 HydrophobicContact CD1-CD2 4.18Å; L726-L847 HydrophobicContact CD2-CD1 4.15Å
727	A	77.1	Confident	75	Confident	26 Å²	26	26.1 Å²	26.1	22%	0.215	15%	0.153	C	C	.	.	H	α-helix	trans	-56	-49.7	177.6	0	0	0	0	0	112.1	G725 V730 V731 V833 V837	G725-A727 VanDerWaalsContact C-N 3.26Å; G725-A727 PolarHBondContact O-N 3.48Å; A727-V730 PolarHBondContact O-N 3.33Å; A727-V731 WeakPolarHBondContact O-CG2 3.45Å; A727-V731 PolarHBondContact O-N 2.99Å; A727-V833 HydrophobicContact CB-CG1 4.21Å; A727-V837 HydrophobicContact CB-CB 4.42Å; A727-V837 HydrophobicContact CB-CG2 3.73Å
728	E	80.4	Confident	75.8	Confident	41 Å²	41	25.6 Å²	25.6	19%	0.192	15%	0.149	C	C	.	.	H	α-helix	trans	-66.4	-41.6	-178.8	-61.3	156.3	160.2	0	0	110.8	W469 F654 V715 G725 L726 V730 V731 A732	W469-E728 HydrophobicContact CB-CB 3.91Å; W469-E728 HydrophobicContact CB-CG 4.23Å; F654-E728 HydrophobicContact CE1-CB 4.41Å; F654-E728 HydrophobicContact CZ-CB 4.46Å; V715-E728 HydrophobicContact CG1-CG 4.49Å; V715-E728 WeakPolarHBondContact CG1-OE2 3.21Å; G725-E728 PolarHBondContact O-N 3.31Å; L726-E728 PolarHBondContact O-N 3.35Å; E728-V730 PolarHBondContact O-N 3.4Å; E728-V731 PolarHBondContact O-N 3.21Å; E728-A732 WeakPolarHBondContact O-CB 3.31Å; E728-A732 PolarHBondContact O-N 3.27Å
729	R	82.8	Confident	76.9	Confident	8 Å²	8	20 Å²	20	3%	0.03	11%	0.114	C	C	.	.	H	α-helix	trans	-62.2	-40.9	175.6	-69	175.1	-168.9	-127.1	-1.6	112.9	F654 Y724 G725 L726 T733 I780 I783	F654-R729 HydrophobicContact CB-CG 4.17Å; F654-R729 HydrophobicContact CD1-CG 3.48Å; F654-R729 VanDerWaalsContact CD1-CG 3.48Å; F654-R729 HydrophobicContact CE1-CG 4.04Å; F654-R729 HydrophobicContact CG-CG 3.97Å; Y724-R729 PolarHBondContact O-NE 3.2Å; Y724-R729 VanDerWaalsContact O-NE 3.11Å; Y724-R729 PolarHBondContact O-NH2 3.37Å; G725-R729 WeakPolarHBondContact O-CG 3.37Å; G725-R729 PolarHBondContact O-N 3.03Å; G725-R729 VanDerWaalsContact O-N 3.07Å; L726-R729 PolarHBondContact O-N 3.12Å; R729-T733 WeakPolarHBondContact O-CB 3.47Å; R729-T733 PolarHBondContact O-N 3.17Å; R729-T733 PolarHBondContact O-OG1 3.43Å; R729-I780 HydrophobicContact CB-CG2 3.86Å; R729-I780 HydrophobicContact CG-CG2 4.05Å; R729-I780 PolarHBondContact NH1-O 3.05Å; R729-I780 VanDerWaalsContact NH1-O 3.08Å; R729-I783 VanDerWaalsContact NH1-CG2 3.34Å
730	V	82.3	Confident	78	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.2	-47.2	177.8	172.1	0	0	0	0	110	L726 A727 E728 A732 T733 E734 Y781 V837 V843	L726-V730 HydrophobicContact CD1-CG2 3.79Å; L726-V730 HydrophobicContact CG-CG2 4.15Å; L726-V730 WeakPolarHBondContact O-CB 3.39Å; L726-V730 WeakPolarHBondContact O-CG2 3.48Å; L726-V730 PolarHBondContact O-N 2.99Å; A727-V730 PolarHBondContact O-N 3.33Å; E728-V730 PolarHBondContact O-N 3.4Å; V730-A732 VanDerWaalsContact C-N 3.34Å; V730-A732 PolarHBondContact O-N 3.04Å; V730-T733 PolarHBondContact O-N 3.5Å; V730-E734 HydrophobicContact CG1-CG 4.14Å; V730-E734 WeakPolarHBondContact O-CB 3.33Å; V730-E734 WeakPolarHBondContact O-CG 3.44Å; V730-E734 PolarHBondContact O-N 3.41Å; V730-Y781 HydrophobicContact CG2-CE1 3.78Å; V730-V837 HydrophobicContact CB-CG1 4.49Å; V730-V837 HydrophobicContact CG1-CG1 4.09Å; V730-V843 HydrophobicContact CG2-CG1 4.01Å
731	V	82.5	Confident	79.1	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-59.9	-45.7	177.3	173.8	0	0	0	0	110.7	W469 L471 I606 T608 A727 E728 S735 V837	W469-V731 WeakPolarHBondContact O-CG1 3.45Å; L471-V731 HydrophobicContact CD2-CG2 4.27Å; L471-V731 HydrophobicContact CG-CG2 4.03Å; I606-V731 HydrophobicContact CG2-CB 4.46Å; I606-V731 HydrophobicContact CG2-CG1 4.44Å; I606-V731 HydrophobicContact CG2-CG2 4.33Å; T608-V731 HydrophobicContact CG2-CG1 3.39Å; A727-V731 WeakPolarHBondContact O-CG2 3.45Å; A727-V731 PolarHBondContact O-N 2.99Å; E728-V731 PolarHBondContact O-N 3.21Å; V731-S735 WeakPolarHBondContact O-CB 3.4Å; V731-S735 PolarHBondContact O-N 3.31Å; V731-S735 PolarHBondContact O-OG 2.96Å; V731-V837 HydrophobicContact CG2-CG1 3.79Å; V731-V837 HydrophobicContact CG2-CG2 4.03Å
732	A	83.3	Confident	80.1	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.9	-50.1	177.9	0	0	0	0	0	112.8	W469 I650 F654 E728 V730 S735 L736	W469-A732 HydrophobicContact CD2-CB 3.97Å; W469-A732 VanDerWaalsContact CE3-CA 3.46Å; W469-A732 HydrophobicContact CE3-CB 3.32Å; W469-A732 HydrophobicContact CH2-CB 4.05Å; W469-A732 VanDerWaalsContact CZ3-CA 3.49Å; W469-A732 HydrophobicContact CZ3-CB 3.37Å; I650-A732 WeakPolarHBondContact CD1-O 3.33Å; I650-A732 HydrophobicContact CG2-CB 4.4Å; F654-A732 HydrophobicContact CD2-CB 3.92Å; F654-A732 HydrophobicContact CE2-CB 3.53Å; F654-A732 HydrophobicContact CZ-CB 4.33Å; E728-A732 WeakPolarHBondContact O-CB 3.31Å; E728-A732 PolarHBondContact O-N 3.27Å; V730-A732 VanDerWaalsContact C-N 3.34Å; V730-A732 PolarHBondContact O-N 3.04Å; A732-S735 PolarHBondContact O-N 2.91Å; A732-L736 PolarHBondContact O-N 3.34Å; A732-L736 VanDerWaalsContact O-N 3.09Å
733	T	83.3	Confident	80.9	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-70.7	-40.8	-175.1	-49.6	0	0	0	0	111.9	R729 V730 L736 V737 R777 I780	R729-T733 WeakPolarHBondContact O-CB 3.47Å; R729-T733 PolarHBondContact O-N 3.17Å; R729-T733 PolarHBondContact O-OG1 3.43Å; V730-T733 PolarHBondContact O-N 3.5Å; T733-L736 WeakPolarHBondContact O-CB 3.4Å; T733-L736 PolarHBondContact O-N 3.5Å; T733-V737 WeakPolarHBondContact O-CG2 3.06Å; T733-V737 PolarHBondContact O-N 3.19Å; T733-R777 HydrophobicContact CG2-CB 4.3Å; T733-R777 HydrophobicContact CG2-CG 3.48Å; T733-R777 VanDerWaalsContact CG2-CG 3.48Å; T733-I780 HydrophobicContact CG2-CD1 4.42Å; T733-I780 WeakPolarHBondContact OG1-CD1 3.49Å
734	E	83.8	Confident	81.9	Confident	20 Å²	20	20.7 Å²	20.7	9%	0.093	10%	0.101	C	C	.	.	H	α-helix	trans	-73.5	-31.6	178.6	-64.8	-56.8	129.5	0	0	112	I606 V730 L736 V737 F738 R777 P840 V843	I606-E734 HydrophobicContact CB-CB 4.05Å; I606-E734 HydrophobicContact CD1-CB 4.22Å; I606-E734 HydrophobicContact CD1-CG 4.3Å; I606-E734 HydrophobicContact CG2-CB 3.88Å; V730-E734 HydrophobicContact CG1-CG 4.14Å; V730-E734 WeakPolarHBondContact O-CB 3.33Å; V730-E734 WeakPolarHBondContact O-CG 3.44Å; V730-E734 PolarHBondContact O-N 3.41Å; E734-L736 VanDerWaalsContact C-N 3.32Å; E734-L736 PolarHBondContact O-N 2.87Å; E734-V737 PolarHBondContact O-N 3.3Å; E734-F738 WeakPolarHBondContact O-CB 3.48Å; E734-F738 PolarHBondContact O-N 3.18Å; E734-R777 IonicContact OE1-CZ 2.81Å; E734-R777 IonicContact OE1-NE 3.11Å; E734-R777 PolarHBondContact OE1-NE 3.41Å; E734-R777 IonicContact OE1-NH2 3.12Å; E734-R777 PolarHBondContact OE1-NH2 3.08Å; E734-R777 VanDerWaalsContact OE1-NH2 3.1Å; E734-R777 IonicContact OE2-CZ 2.84Å; E734-R777 IonicContact OE2-NH2 2.74Å; E734-R777 PolarHBondContact OE2-NH2 3.11Å; E734-P840 HydrophobicContact CG-CG 3.9Å; E734-V843 HydrophobicContact CG-CG2 4.31Å; E734-V843 WeakPolarHBondContact OE1-CG2 3.17Å
735	S	84.8	Confident	82.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.2	-34.7	172.6	-53.3	0	0	0	0	111.7	I606 L607 T608 T611 V731 A732 L739	I606-S735 PolarHBondContact O-OG 3.45Å; L607-S735 WeakPolarHBondContact CA-OG 3.46Å; T608-S735 PolarHBondContact N-OG 3.45Å; T611-S735 VanDerWaalsContact CG2-CB 3.48Å; V731-S735 WeakPolarHBondContact O-CB 3.4Å; V731-S735 PolarHBondContact O-N 3.31Å; V731-S735 PolarHBondContact O-OG 2.96Å; A732-S735 PolarHBondContact O-N 2.91Å; S735-L739 WeakPolarHBondContact O-CB 3.41Å; S735-L739 PolarHBondContact O-N 2.99Å
736	L	85.4	Confident	82.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.6	-43.8	171.3	172.9	69.1	0	0	0	112.6	F643 Y646 L647 I650 A732 T733 E734 F738 L739 A740 A773 L776	F643-L736 HydrophobicContact CE2-CD1 4.33Å; F643-L736 HydrophobicContact CZ-CD1 4.36Å; Y646-L736 HydrophobicContact CD1-CD1 3.73Å; Y646-L736 HydrophobicContact CE1-CB 4.02Å; Y646-L736 HydrophobicContact CE1-CD1 4.08Å; L647-L736 HydrophobicContact CB-CD1 4.27Å; L647-L736 HydrophobicContact CD1-CD1 4Å; L647-L736 HydrophobicContact CD1-CD2 3.51Å; L647-L736 HydrophobicContact CD1-CG 4.3Å; I650-L736 HydrophobicContact CD1-CB 3.61Å; I650-L736 HydrophobicContact CD1-CD1 4.33Å; I650-L736 HydrophobicContact CD1-CD2 4.12Å; I650-L736 HydrophobicContact CD1-CG 4.22Å; A732-L736 PolarHBondContact O-N 3.34Å; A732-L736 VanDerWaalsContact O-N 3.09Å; T733-L736 WeakPolarHBondContact O-CB 3.4Å; T733-L736 PolarHBondContact O-N 3.5Å; E734-L736 VanDerWaalsContact C-N 3.32Å; E734-L736 PolarHBondContact O-N 2.87Å; L736-F738 VanDerWaalsContact C-N 3.32Å; L736-L739 WeakPolarHBondContact O-CB 3.42Å; L736-L739 PolarHBondContact O-N 3.45Å; L736-A740 PolarHBondContact O-N 3.5Å; L736-A773 HydrophobicContact CD1-CB 4.37Å; L736-A773 HydrophobicContact CD2-CB 4.25Å; L736-A773 HydrophobicContact CG-CB 4.06Å; L736-L776 HydrophobicContact CD2-CB 4.46Å; L736-L776 HydrophobicContact CD2-CD2 3.56Å
737	V	84.9	Confident	82.7	Confident	9 Å²	9	25.2 Å²	25.2	6%	0.055	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-40.7	178.2	171.7	0	0	0	0	110.3	T733 E734 L739 A740 E741 R777	T733-V737 WeakPolarHBondContact O-CG2 3.06Å; T733-V737 PolarHBondContact O-N 3.19Å; E734-V737 PolarHBondContact O-N 3.3Å; V737-L739 PolarHBondContact O-N 3.4Å; V737-A740 WeakPolarHBondContact O-CB 3.44Å; V737-A740 PolarHBondContact O-N 2.88Å; V737-E741 WeakPolarHBondContact O-CG 3.48Å; V737-E741 PolarHBondContact O-N 3.47Å; V737-R777 VanDerWaalsContact CG1-NH2 3.3Å
738	F	83.4	Confident	82.8	Confident	22 Å²	22	28.3 Å²	28.3	10%	0.096	14%	0.14	C	C	.	.	H	α-helix	trans	-57.8	-49.2	170.7	-179.9	-92.3	0	0	0	111.1	F478 P605 L607 I615 E734 L736 A740 E741 Q742	F478-F738 HydrophobicContact CD1-CZ 4.37Å; F478-F738 HydrophobicContact CE1-CZ 4.3Å; P605-F738 HydrophobicContact CB-CD2 3.77Å; P605-F738 HydrophobicContact CB-CE2 3.57Å; P605-F738 HydrophobicContact CB-CZ 4.29Å; P605-F738 HydrophobicContact CG-CE2 4.19Å; L607-F738 HydrophobicContact CD1-CE1 4.27Å; L607-F738 HydrophobicContact CD1-CZ 4.36Å; L607-F738 HydrophobicContact CD2-CB 4.09Å; L607-F738 HydrophobicContact CD2-CD1 3.1Å; L607-F738 HydrophobicContact CD2-CD2 4.16Å; L607-F738 HydrophobicContact CD2-CE1 3.35Å; L607-F738 HydrophobicContact CD2-CE2 4.38Å; L607-F738 HydrophobicContact CD2-CG 3.52Å; L607-F738 HydrophobicContact CD2-CZ 4Å; L607-F738 HydrophobicContact CG-CD1 4.45Å; L607-F738 HydrophobicContact CG-CE1 4.43Å; I615-F738 HydrophobicContact CD1-CD1 4.14Å; I615-F738 HydrophobicContact CD1-CE1 3.69Å; E734-F738 WeakPolarHBondContact O-CB 3.48Å; E734-F738 PolarHBondContact O-N 3.18Å; L736-F738 VanDerWaalsContact C-N 3.32Å; F738-A740 PolarHBondContact O-N 3.38Å; F738-E741 WeakPolarHBondContact O-CB 3.33Å; F738-E741 PolarHBondContact O-N 2.92Å; F738-E741 VanDerWaalsContact O-N 3.1Å; F738-Q742 HydrophobicContact CD1-CG 3.78Å; F738-Q742 HydrophobicContact CE1-CG 3.44Å; F738-Q742 VanDerWaalsContact CE1-CG 3.44Å; F738-Q742 HydrophobicContact CE2-CG 4.36Å; F738-Q742 VanDerWaalsContact CE2-NE2 3.35Å; F738-Q742 HydrophobicContact CG-CG 4.43Å; F738-Q742 HydrophobicContact CZ-CG 3.77Å; F738-Q742 VanDerWaalsContact O-CG 3.29Å; F738-Q742 WeakPolarHBondContact O-CG 3.36Å; F738-Q742 PolarHBondContact O-N 3.33Å
739	L	84.6	Confident	82.5	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-55.1	-42.5	176.9	-174.4	65.8	0	0	0	111.4	V614 I615 F643 Y646 S735 L736 V737 Q742 F743	V614-L739 HydrophobicContact CG1-CD1 4.19Å; V614-L739 HydrophobicContact CG1-CD2 4.22Å; I615-L739 HydrophobicContact CD1-CD1 4.26Å; I615-L739 HydrophobicContact CG1-CD1 3.66Å; F643-L739 HydrophobicContact CD2-CD2 3.76Å; F643-L739 HydrophobicContact CD2-CG 3.96Å; F643-L739 HydrophobicContact CE2-CD2 4.17Å; F643-L739 HydrophobicContact CE2-CG 4.14Å; Y646-L739 HydrophobicContact CD1-CD2 3.8Å; Y646-L739 HydrophobicContact CE1-CD2 4.31Å; Y646-L739 HydrophobicContact CG-CD2 4.28Å; S735-L739 WeakPolarHBondContact O-CB 3.41Å; S735-L739 PolarHBondContact O-N 2.99Å; L736-L739 WeakPolarHBondContact O-CB 3.42Å; L736-L739 PolarHBondContact O-N 3.45Å; V737-L739 PolarHBondContact O-N 3.4Å; L739-Q742 WeakPolarHBondContact O-CB 3.34Å; L739-Q742 PolarHBondContact O-N 2.89Å; L739-F743 HydrophobicContact CD1-CD2 4.12Å; L739-F743 HydrophobicContact CD1-CE2 3.86Å; L739-F743 HydrophobicContact CG-CD2 4.05Å; L739-F743 HydrophobicContact CG-CE2 4Å; L739-F743 WeakPolarHBondContact O-CD2 3.18Å; L739-F743 PolarHBondContact O-N 2.83Å
740	A	85.6	Confident	82.1	Confident	6 Å²	6	28.1 Å²	28.1	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-60.9	-46.4	175.8	0	0	0	0	0	112.5	F643 L736 V737 F738 Q742 F743 E744 V770 A773	F643-A740 HydrophobicContact CE2-CB 4.12Å; F643-A740 HydrophobicContact CZ-CB 4.08Å; L736-A740 PolarHBondContact O-N 3.5Å; V737-A740 WeakPolarHBondContact O-CB 3.44Å; V737-A740 PolarHBondContact O-N 2.88Å; F738-A740 PolarHBondContact O-N 3.38Å; A740-Q742 VanDerWaalsContact C-N 3.25Å; A740-Q742 PolarHBondContact O-N 3.31Å; A740-F743 PolarHBondContact O-N 2.74Å; A740-E744 PolarHBondContact O-N 3.32Å; A740-V770 HydrophobicContact CB-CG1 3.77Å; A740-A773 HydrophobicContact CB-CB 3.93Å
741	E	84	Confident	81.8	Confident	105 Å²	105	29.8 Å²	29.8	49%	0.491	15%	0.149	S	C	.	.	H	α-helix	trans	-59.4	-36.8	175.3	-69.9	175.5	-179.4	0	0	111.9	V737 F738 E744 F745	V737-E741 WeakPolarHBondContact O-CG 3.48Å; V737-E741 PolarHBondContact O-N 3.47Å; F738-E741 WeakPolarHBondContact O-CB 3.33Å; F738-E741 PolarHBondContact O-N 2.92Å; F738-E741 VanDerWaalsContact O-N 3.1Å; E741-E744 PolarHBondContact O-N 2.8Å; E741-F745 PolarHBondContact O-N 3.48Å
742	Q	82.1	Confident	81.4	Confident	29 Å²	29	33.7 Å²	33.7	14%	0.136	18%	0.181	C	C	.	.	H	α-helix	trans	-69.2	-39.3	176.5	-63.5	-45.7	-54.4	0	0	112.6	I480 I615 F738 L739 A740 F745 L746	I480-Q742 HydrophobicContact CD1-CB 3.41Å; I480-Q742 VanDerWaalsContact CD1-CB 3.41Å; I480-Q742 HydrophobicContact CD1-CG 3.37Å; I480-Q742 HydrophobicContact CG1-CG 4.16Å; I480-Q742 VanDerWaalsContact CG1-OE1 3.23Å; I615-Q742 HydrophobicContact CD1-CG 4.43Å; F738-Q742 HydrophobicContact CD1-CG 3.78Å; F738-Q742 HydrophobicContact CE1-CG 3.44Å; F738-Q742 VanDerWaalsContact CE1-CG 3.44Å; F738-Q742 HydrophobicContact CE2-CG 4.36Å; F738-Q742 VanDerWaalsContact CE2-NE2 3.35Å; F738-Q742 HydrophobicContact CG-CG 4.43Å; F738-Q742 HydrophobicContact CZ-CG 3.77Å; F738-Q742 VanDerWaalsContact O-CG 3.29Å; F738-Q742 WeakPolarHBondContact O-CG 3.36Å; F738-Q742 PolarHBondContact O-N 3.33Å; L739-Q742 WeakPolarHBondContact O-CB 3.34Å; L739-Q742 PolarHBondContact O-N 2.89Å; A740-Q742 VanDerWaalsContact C-N 3.25Å; A740-Q742 PolarHBondContact O-N 3.31Å; Q742-F745 WeakPolarHBondContact O-CB 3.48Å; Q742-F745 PolarHBondContact O-N 2.88Å; Q742-L746 WeakPolarHBondContact O-CG 3.48Å; Q742-L746 PolarHBondContact O-N 3.09Å
743	F	80.8	Confident	80.6	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-40.5	171.9	-90.4	-88.6	0	0	0	111.5	V618 M639 F643 L739 A740 F745 L746 Q747 F765 Y766	V618-F743 HydrophobicContact CG2-CE2 4.26Å; V618-F743 HydrophobicContact CG2-CZ 3.74Å; M639-F743 HydrophobicContact CB-CE1 4.32Å; M639-F743 HydrophobicContact CE-CE1 3.86Å; F643-F743 HydrophobicContact CB-CE2 4.26Å; F643-F743 HydrophobicContact CB-CZ 4.24Å; F643-F743 AromaticContact CD2-CD2 3.84Å; F643-F743 HydrophobicContact CD2-CD2 3.84Å; F643-F743 AromaticContact CD2-CE2 3.87Å; F643-F743 HydrophobicContact CD2-CE2 3.87Å; F643-F743 HydrophobicContact CE2-CD2 4.38Å; F643-F743 HydrophobicContact CG-CE2 4.47Å; L739-F743 HydrophobicContact CD1-CD2 4.12Å; L739-F743 HydrophobicContact CD1-CE2 3.86Å; L739-F743 HydrophobicContact CG-CD2 4.05Å; L739-F743 HydrophobicContact CG-CE2 4Å; L739-F743 WeakPolarHBondContact O-CD2 3.18Å; L739-F743 PolarHBondContact O-N 2.83Å; A740-F743 PolarHBondContact O-N 2.74Å; F743-F745 VanDerWaalsContact C-N 3.3Å; F743-F745 PolarHBondContact O-N 3.11Å; F743-L746 PolarHBondContact O-N 2.98Å; F743-L746 VanDerWaalsContact O-N 3.16Å; F743-Q747 PolarHBondContact O-N 2.89Å; F743-F765 HydrophobicContact CD1-CE1 4.24Å; F743-Y766 HydrophobicContact CB-CE1 4.08Å; F743-Y766 WeakPolarHBondContact O-CE1 3.44Å; F743-Y766 PolarHBondContact O-OH 3.38Å; F743-Y766 VanDerWaalsContact O-OH 3.05Å
744	E	84.3	Confident	79.8	Confident	104 Å²	104	36 Å²	36	49%	0.486	19%	0.194	S	C	.	.	H	α-helix	trans	-60.7	-38.9	173.1	-70.3	-176.6	175.2	0	0	111.9	A740 E741 L746 Q747 V770	A740-E744 PolarHBondContact O-N 3.32Å; E741-E744 PolarHBondContact O-N 2.8Å; E744-L746 VanDerWaalsContact C-N 3.33Å; E744-L746 PolarHBondContact O-N 2.98Å; E744-Q747 VanDerWaalsContact O-CB 3.28Å; E744-Q747 WeakPolarHBondContact O-CB 3.28Å; E744-Q747 PolarHBondContact O-N 3.34Å; E744-V770 HydrophobicContact CG-CG1 3.9Å
745	F	82	Confident	79	Confident	89 Å²	89	38.5 Å²	38.5	39%	0.39	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-36.6	174.1	178.8	-99.2	0	0	0	112.9	L481 E741 Q742 F743 Q747 P748	L481-F745 HydrophobicContact CD1-CZ 4.27Å; L481-F745 HydrophobicContact CD2-CE1 4.48Å; L481-F745 HydrophobicContact CG-CE1 4.46Å; E741-F745 PolarHBondContact O-N 3.48Å; Q742-F745 WeakPolarHBondContact O-CB 3.48Å; Q742-F745 PolarHBondContact O-N 2.88Å; F743-F745 VanDerWaalsContact C-N 3.3Å; F743-F745 PolarHBondContact O-N 3.11Å; F745-Q747 VanDerWaalsContact C-N 3.34Å; F745-P748 VanDerWaalsContact O-CD 3.29Å; F745-P748 WeakPolarHBondContact O-CD 3.45Å
746	L	80.2	Confident	77.9	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-79.2	-15.7	179.2	-65.3	172.9	0	0	0	113.4	F486 M489 V618 M622 Q742 F743 E744 P748 H749 L750	F486-L746 HydrophobicContact CD1-CD2 4.35Å; F486-L746 HydrophobicContact CE1-CD1 4.09Å; F486-L746 HydrophobicContact CE1-CD2 3.95Å; M489-L746 HydrophobicContact CE-CD2 4.12Å; M489-L746 HydrophobicContact SD-CD2 4Å; V618-L746 HydrophobicContact CG1-CD1 3.98Å; M622-L746 HydrophobicContact CE-CD2 4.07Å; M622-L746 HydrophobicContact SD-CD1 3.89Å; M622-L746 HydrophobicContact SD-CD2 3.93Å; M622-L746 HydrophobicContact SD-CG 4.38Å; Q742-L746 WeakPolarHBondContact O-CG 3.48Å; Q742-L746 PolarHBondContact O-N 3.09Å; F743-L746 PolarHBondContact O-N 2.98Å; F743-L746 VanDerWaalsContact O-N 3.16Å; E744-L746 VanDerWaalsContact C-N 3.33Å; E744-L746 PolarHBondContact O-N 2.98Å; L746-P748 VanDerWaalsContact C-CD 3.46Å; L746-H749 PolarHBondContact O-N 3.41Å; L746-H749 VanDerWaalsContact O-N 3.11Å; L746-L750 HydrophobicContact CB-CD1 4.36Å; L746-L750 WeakPolarHBondContact O-CG 3.41Å; L746-L750 PolarHBondContact O-N 3.47Å; L746-L750 VanDerWaalsContact O-N 3.12Å
747	Q	80.3	Confident	76.9	Confident	61 Å²	61	48.7 Å²	48.7	29%	0.285	28%	0.283	S	S	.	.	H	α-helix	trans	-49	-48.5	-177.3	-178.6	-177.4	-5	0	0	114.1	F743 E744 F745 H749 L750 D751 Y766	F743-Q747 PolarHBondContact O-N 2.89Å; E744-Q747 VanDerWaalsContact O-CB 3.28Å; E744-Q747 WeakPolarHBondContact O-CB 3.28Å; E744-Q747 PolarHBondContact O-N 3.34Å; F745-Q747 VanDerWaalsContact C-N 3.34Å; Q747-H749 VanDerWaalsContact C-N 3.26Å; Q747-H749 PolarHBondContact O-N 3.3Å; Q747-L750 PolarHBondContact O-N 3.34Å; Q747-D751 WeakPolarHBondContact O-CB 3.47Å; Q747-D751 PolarHBondContact O-N 2.93Å; Q747-Y766 HydrophobicContact CB-CE1 4.13Å; Q747-Y766 HydrophobicContact CB-CE2 3.91Å; Q747-Y766 HydrophobicContact CG-CD2 3.96Å; Q747-Y766 HydrophobicContact CG-CE2 3.62Å
748	P	79.2	Confident	76.1	Confident	92 Å²	92	52.3 Å²	52.3	60%	0.597	30%	0.298	S	S	*	.	H	α-helix	trans	-63.2	-32.2	-176.9	-21.1	34	0	0	0	113.2	F745 L746 A752	F745-P748 VanDerWaalsContact O-CD 3.29Å; F745-P748 WeakPolarHBondContact O-CD 3.45Å; L746-P748 VanDerWaalsContact C-CD 3.46Å; P748-A752 PolarHBondContact O-N 3.26Å
749	H	72.9	Confident	75.7	Confident	42 Å²	42	54.9 Å²	54.9	19%	0.194	31%	0.309	C	S	.	.	H	α-helix	trans	-74.3	-42	177.3	-170.1	81.5	0	0	0	111	F488 M489 M622 L746 Q747 D751 A752 V753	F488-H749 AromaticContact CE2-NE2 3.82Å; M489-H749 HydrophobicContact CE-CB 3.83Å; M622-H749 HydrophobicContact CE-CB 4.5Å; M622-H749 WeakPolarHBondContact CE-CD2 3.05Å; L746-H749 PolarHBondContact O-N 3.41Å; L746-H749 VanDerWaalsContact O-N 3.11Å; Q747-H749 VanDerWaalsContact C-N 3.26Å; Q747-H749 PolarHBondContact O-N 3.3Å; H749-D751 VanDerWaalsContact C-N 3.32Å; H749-D751 PolarHBondContact O-N 3.15Å; H749-A752 PolarHBondContact O-N 3.17Å; H749-V753 WeakPolarHBondContact O-CG2 3.26Å; H749-V753 PolarHBondContact O-N 3.45Å
750	L	74.7	Confident	75.4	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-37.1	175.7	-62.3	175.2	0	0	0	111.7	M622 M625 I636 M639 L746 Q747 A752 V753 M754 L762 Y766	M622-L750 HydrophobicContact CE-CD2 4.21Å; M625-L750 HydrophobicContact CE-CD2 3.81Å; M625-L750 HydrophobicContact SD-CD2 4.1Å; I636-L750 HydrophobicContact CD1-CB 4.47Å; I636-L750 HydrophobicContact CD1-CD2 4.24Å; I636-L750 HydrophobicContact CG1-CD2 4.12Å; M639-L750 HydrophobicContact CE-CD1 4.09Å; M639-L750 HydrophobicContact CE-CD2 4.31Å; L746-L750 HydrophobicContact CB-CD1 4.36Å; L746-L750 WeakPolarHBondContact O-CG 3.41Å; L746-L750 PolarHBondContact O-N 3.47Å; L746-L750 VanDerWaalsContact O-N 3.12Å; Q747-L750 PolarHBondContact O-N 3.34Å; L750-A752 VanDerWaalsContact C-N 3.31Å; L750-A752 PolarHBondContact O-N 3.44Å; L750-V753 PolarHBondContact O-N 3.49Å; L750-M754 WeakPolarHBondContact O-CB 3.41Å; L750-M754 WeakPolarHBondContact O-CG 3.39Å; L750-M754 PolarHBondContact O-N 3.37Å; L750-L762 HydrophobicContact CB-CD2 4.01Å; L750-Y766 WeakPolarHBondContact CD1-OH 3.45Å
751	D	75.3	Confident	75	Confident	36 Å²	36	61 Å²	61	19%	0.193	34%	0.342	C	S	.	.	H	α-helix	trans	-66.5	-28.9	175.4	-91.9	-35.7	0	0	0	113.6	Q747 H749 K759 L762	Q747-D751 WeakPolarHBondContact O-CB 3.47Å; Q747-D751 PolarHBondContact O-N 2.93Å; H749-D751 VanDerWaalsContact C-N 3.32Å; H749-D751 PolarHBondContact O-N 3.15Å; D751-K759 WeakPolarHBondContact O-CE 3.37Å; D751-K759 PolarHBondContact O-NZ 3.48Å; D751-L762 WeakPolarHBondContact OD1-CD2 3.33Å
752	A	74.1	Confident	74.6	Confident	82 Å²	82	56 Å²	56	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-75.7	-32.5	177.8	0	0	0	0	0	112.7	P748 H749 L750	P748-A752 PolarHBondContact O-N 3.26Å; H749-A752 PolarHBondContact O-N 3.17Å; L750-A752 VanDerWaalsContact C-N 3.31Å; L750-A752 PolarHBondContact O-N 3.44Å
753	V	66.9	Low	74.4	Confident	38 Å²	38	60.1 Å²	60.1	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-85.2	-17.9	-179.1	-178	0	0	0	0	112	M625 A632 H749 L750	M625-V753 HydrophobicContact CE-CB 4.23Å; M625-V753 HydrophobicContact CE-CG1 4.16Å; M625-V753 HydrophobicContact CE-CG2 4.07Å; M625-V753 HydrophobicContact CG-CG1 3.9Å; M625-V753 HydrophobicContact SD-CB 4.27Å; M625-V753 HydrophobicContact SD-CG1 3.84Å; A632-V753 HydrophobicContact CB-CG1 3.76Å; H749-V753 WeakPolarHBondContact O-CG2 3.26Å; H749-V753 PolarHBondContact O-N 3.45Å; L750-V753 PolarHBondContact O-N 3.49Å
754	M	66.7	Low	74.3	Confident	11 Å²	11	64.1 Å²	64.1	5%	0.054	36%	0.357	C	S	.	.	S	Bend	trans	-79.4	132.7	-174	-83.3	-73.8	-81.1	0	0	114.9	F633 I636 L750 K758 K759 L762	F633-M754 HydrophobicContact CD2-CE 4.1Å; I636-M754 HydrophobicContact CD1-CG 3.55Å; I636-M754 HydrophobicContact CD1-SD 3.47Å; I636-M754 WeakPolarHBondContact CD1-SD 3.34Å; L750-M754 WeakPolarHBondContact O-CB 3.41Å; L750-M754 WeakPolarHBondContact O-CG 3.39Å; L750-M754 PolarHBondContact O-N 3.37Å; M754-K758 HydrophobicContact CE-CB 3.68Å; M754-K758 VanDerWaalsContact CE-O 3.28Å; M754-K758 WeakPolarHBondContact CE-O 3.11Å; M754-K759 HydrophobicContact CB-CG 4.4Å; M754-L762 HydrophobicContact CG-CD2 4.39Å
755	P	66.9	Low	74	Confident	72 Å²	72	59.7 Å²	59.7	47%	0.468	34%	0.336	S	S	.	.			trans	-59.9	138.2	166.8	-21.9	32.8	0	0	0	111.8	V757 K758	P755-V757 PolarHBondContact O-N 3.14Å; P755-K758 PolarHBondContact O-N 2.91Å
756	A	62.4	Low	74	Confident	83 Å²	83	56.2 Å²	56.2	69%	0.686	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-53	-31.3	-173.8	0	0	0	0	0	114.4	K758	A756-K758 VanDerWaalsContact C-N 3.3Å; A756-K758 PolarHBondContact O-N 3.17Å
757	V	62.8	Low	73.9	Confident	132 Å²	132	59 Å²	59	80%	0.8	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-67.8	-26.9	-177.1	-170.2	0	0	0	0	112.9	P755	P755-V757 PolarHBondContact O-N 3.14Å
758	K	69.6	Low	73.7	Confident	85 Å²	85	59.2 Å²	59.2	37%	0.37	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-109	3.5	-173.4	-58.8	-166.4	-177.9	-177.1	0	114	F633 M754 P755 A756 P760 F761	F633-K758 HydrophobicContact CB-CD 3.98Å; F633-K758 HydrophobicContact CD1-CD 3.9Å; F633-K758 HydrophobicContact CD2-CB 3.93Å; F633-K758 HydrophobicContact CD2-CD 3.21Å; F633-K758 HydrophobicContact CD2-CG 4.2Å; F633-K758 HydrophobicContact CE1-CD 4.17Å; F633-K758 HydrophobicContact CE2-CB 4.13Å; F633-K758 HydrophobicContact CE2-CD 3.54Å; F633-K758 HydrophobicContact CE2-CG 4.36Å; F633-K758 HydrophobicContact CG-CD 3.38Å; F633-K758 VanDerWaalsContact CG-NZ 3.32Å; F633-K758 HydrophobicContact CZ-CD 3.99Å; M754-K758 HydrophobicContact CE-CB 3.68Å; M754-K758 VanDerWaalsContact CE-O 3.28Å; M754-K758 WeakPolarHBondContact CE-O 3.11Å; P755-K758 PolarHBondContact O-N 2.91Å; A756-K758 VanDerWaalsContact C-N 3.3Å; A756-K758 PolarHBondContact O-N 3.17Å; K758-P760 VanDerWaalsContact C-N 3.33Å; K758-F761 WeakPolarHBondContact O-CB 3.38Å; K758-F761 PolarHBondContact O-N 2.9Å
759	K	74.6	Confident	73.5	Confident	75 Å²	75	54.9 Å²	54.9	33%	0.326	31%	0.313	S	S	.	.	H	α-helix	trans	-55.9	-34.7	174	-67.8	-168.4	172.2	-161.3	0	114.7	D751 M754 F761 L762 Q763	D751-K759 WeakPolarHBondContact O-CE 3.37Å; D751-K759 PolarHBondContact O-NZ 3.48Å; M754-K759 HydrophobicContact CB-CG 4.4Å; K759-F761 VanDerWaalsContact C-N 3.26Å; K759-F761 PolarHBondContact O-N 3.36Å; K759-L762 PolarHBondContact O-N 3.03Å; K759-Q763 PolarHBondContact O-N 2.85Å; K759-Q763 VanDerWaalsContact O-N 3.12Å
760	P	78.6	Confident	73.9	Confident	80 Å²	80	53 Å²	53	52%	0.519	31%	0.305	S	S	.	.	H	α-helix	trans	-60.3	-32.1	176.7	-26.4	35.9	0	0	0	114	K758 Q764	K758-P760 VanDerWaalsContact C-N 3.33Å; P760-Q764 WeakPolarHBondContact O-CB 3.49Å; P760-Q764 PolarHBondContact O-N 3.01Å
761	F	76.2	Confident	74.2	Confident	55 Å²	55	54.6 Å²	54.6	24%	0.241	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-44.3	176.8	175.3	-95.6	0	0	0	111.6	F633 H637 K758 K759 Q764 F765	F633-F761 HydrophobicContact CE2-CB 4.47Å; F633-F761 AromaticContact CE2-CD1 4Å; F633-F761 HydrophobicContact CE2-CD1 4Å; F633-F761 HydrophobicContact CE2-CG 4.21Å; H637-F761 AromaticContact ND1-CZ 3.56Å; K758-F761 WeakPolarHBondContact O-CB 3.38Å; K758-F761 PolarHBondContact O-N 2.9Å; K759-F761 VanDerWaalsContact C-N 3.26Å; K759-F761 PolarHBondContact O-N 3.36Å; F761-Q764 WeakPolarHBondContact O-CB 3.48Å; F761-Q764 PolarHBondContact O-N 3.45Å; F761-F765 PolarHBondContact O-N 2.88Å
762	L	75.6	Confident	74.3	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-43.2	179.3	-170.7	61.7	0	0	0	111.1	I636 L750 D751 M754 K759 Q764 F765 Y766	I636-L762 HydrophobicContact CG2-CD1 3.88Å; L750-L762 HydrophobicContact CB-CD2 4.01Å; D751-L762 WeakPolarHBondContact OD1-CD2 3.33Å; M754-L762 HydrophobicContact CG-CD2 4.39Å; K759-L762 PolarHBondContact O-N 3.03Å; L762-Q764 VanDerWaalsContact C-N 3.29Å; L762-Q764 PolarHBondContact O-N 3.03Å; L762-F765 PolarHBondContact O-N 2.73Å; L762-Y766 HydrophobicContact CD1-CD2 3.96Å; L762-Y766 HydrophobicContact CD1-CE2 3.37Å; L762-Y766 HydrophobicContact CD2-CE2 4.16Å; L762-Y766 HydrophobicContact CG-CD2 3.84Å; L762-Y766 HydrophobicContact CG-CE2 3.54Å; L762-Y766 WeakPolarHBondContact O-CD2 3.32Å; L762-Y766 PolarHBondContact O-N 3.27Å
763	Q	77.9	Confident	74.7	Confident	115 Å²	115	49 Å²	49	54%	0.537	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-38.1	173.9	-69.6	180	-11.7	0	0	112	K759 S767	K759-Q763 PolarHBondContact O-N 2.85Å; K759-Q763 VanDerWaalsContact O-N 3.12Å; Q763-S767 WeakPolarHBondContact O-CB 3.41Å; Q763-S767 PolarHBondContact O-N 3.47Å; Q763-S767 PolarHBondContact O-OG 3.14Å
764	Q	79.4	Confident	75.4	Confident	87 Å²	87	50 Å²	50	41%	0.407	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-43.7	174.3	-171.8	178.2	-9.5	0	0	111.4	P760 F761 L762 S767 Q768	P760-Q764 WeakPolarHBondContact O-CB 3.49Å; P760-Q764 PolarHBondContact O-N 3.01Å; F761-Q764 WeakPolarHBondContact O-CB 3.48Å; F761-Q764 PolarHBondContact O-N 3.45Å; L762-Q764 VanDerWaalsContact C-N 3.29Å; L762-Q764 PolarHBondContact O-N 3.03Å; Q764-S767 WeakPolarHBondContact CA-OG 3.5Å; Q764-S767 PolarHBondContact O-N 3.32Å; Q764-S767 PolarHBondContact O-OG 3.45Å; Q764-Q768 HydrophobicContact CG-CG 3.99Å; Q764-Q768 VanDerWaalsContact CG-OE1 3.32Å; Q764-Q768 WeakPolarHBondContact O-CB 3.37Å; Q764-Q768 WeakPolarHBondContact O-CG 3.36Å; Q764-Q768 PolarHBondContact O-N 3.37Å
765	F	78.8	Confident	76	Confident	11 Å²	11	51.9 Å²	51.9	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-48.2	176.8	173.3	-106.5	0	0	0	112.7	S640 F643 F743 F761 L762 T769 V770	S640-F765 VanDerWaalsContact CB-CE2 3.41Å; F643-F765 HydrophobicContact CB-CE2 4.38Å; F643-F765 HydrophobicContact CB-CZ 3.91Å; F643-F765 AromaticContact CD1-CE2 3.96Å; F643-F765 HydrophobicContact CD1-CE2 3.96Å; F643-F765 AromaticContact CD1-CZ 3.78Å; F643-F765 HydrophobicContact CD1-CZ 3.78Å; F643-F765 HydrophobicContact CG-CE2 4.48Å; F643-F765 AromaticContact CG-CZ 3.96Å; F643-F765 HydrophobicContact CG-CZ 3.96Å; F743-F765 HydrophobicContact CD1-CE1 4.24Å; F761-F765 PolarHBondContact O-N 2.88Å; L762-F765 PolarHBondContact O-N 2.73Å; F765-T769 HydrophobicContact CE2-CG2 4.17Å; F765-T769 WeakPolarHBondContact O-CA 2.92Å; F765-T769 WeakPolarHBondContact O-CB 3.35Å; F765-T769 PolarHBondContact O-N 3.14Å; F765-V770 HydrophobicContact CD1-CG2 3.97Å; F765-V770 HydrophobicContact CE1-CG2 3.49Å; F765-V770 VanDerWaalsContact CE1-CG2 3.49Å; F765-V770 HydrophobicContact CZ-CG2 3.8Å; F765-V770 PolarHBondContact O-N 2.91Å; F765-V770 VanDerWaalsContact O-N 3.14Å
766	Y	80.4	Confident	76.5	Confident	16 Å²	16	48.5 Å²	48.5	6%	0.063	27%	0.27	C	S	.	.	I	π-helix	trans	-65.7	-44.7	177.7	-75.9	-70.5	0	0	0	112.3	F743 Q747 L750 L762 V770 S771	F743-Y766 HydrophobicContact CB-CE1 4.08Å; F743-Y766 WeakPolarHBondContact O-CE1 3.44Å; F743-Y766 PolarHBondContact O-OH 3.38Å; F743-Y766 VanDerWaalsContact O-OH 3.05Å; Q747-Y766 HydrophobicContact CB-CE1 4.13Å; Q747-Y766 HydrophobicContact CB-CE2 3.91Å; Q747-Y766 HydrophobicContact CG-CD2 3.96Å; Q747-Y766 HydrophobicContact CG-CE2 3.62Å; L750-Y766 WeakPolarHBondContact CD1-OH 3.45Å; L762-Y766 HydrophobicContact CD1-CD2 3.96Å; L762-Y766 HydrophobicContact CD1-CE2 3.37Å; L762-Y766 HydrophobicContact CD2-CE2 4.16Å; L762-Y766 HydrophobicContact CG-CD2 3.84Å; L762-Y766 HydrophobicContact CG-CE2 3.54Å; L762-Y766 WeakPolarHBondContact O-CD2 3.32Å; L762-Y766 PolarHBondContact O-N 3.27Å; Y766-V770 HydrophobicContact CD1-CB 3.98Å; Y766-V770 HydrophobicContact CD1-CG1 4.2Å; Y766-V770 HydrophobicContact CD1-CG2 3.67Å; Y766-V770 HydrophobicContact CE1-CG2 4.07Å; Y766-V770 HydrophobicContact CG-CG2 4.45Å; Y766-S771 PolarHBondContact O-N 3.24Å; Y766-S771 VanDerWaalsContact O-N 3.14Å
767	S	78.6	Confident	77.5	Confident	63 Å²	63	46.2 Å²	46.2	44%	0.441	24%	0.244	S	C	.	.	I	π-helix	trans	-72.1	-32.4	-177.9	62.8	0	0	0	0	113.7	Q763 Q764 S771	Q763-S767 WeakPolarHBondContact O-CB 3.41Å; Q763-S767 PolarHBondContact O-N 3.47Å; Q763-S767 PolarHBondContact O-OG 3.14Å; Q764-S767 WeakPolarHBondContact CA-OG 3.5Å; Q764-S767 PolarHBondContact O-N 3.32Å; Q764-S767 PolarHBondContact O-OG 3.45Å; S767-S771 PolarHBondContact O-OG 3.26Å
768	Q	76.6	Confident	78.3	Confident	65 Å²	65	44.7 Å²	44.7	30%	0.304	23%	0.226	S	C	.	.	I	π-helix	trans	-98.1	-45.8	-176.8	-62.1	-175.3	-9	0	0	112.9	T675 Q764 T772	T675-Q768 HydrophobicContact CG2-CB 4.08Å; T675-Q768 WeakPolarHBondContact CG2-O 3.38Å; Q764-Q768 HydrophobicContact CG-CG 3.99Å; Q764-Q768 VanDerWaalsContact CG-OE1 3.32Å; Q764-Q768 WeakPolarHBondContact O-CB 3.37Å; Q764-Q768 WeakPolarHBondContact O-CG 3.36Å; Q764-Q768 PolarHBondContact O-N 3.37Å; Q768-T772 WeakPolarHBondContact O-CB 3.24Å; Q768-T772 WeakPolarHBondContact O-CG2 3.46Å; Q768-T772 PolarHBondContact O-OG1 2.68Å
769	T	75.3	Confident	78.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-97.1	-48.6	-173.6	-46.8	0	0	0	0	112.9	F643 D644 L647 R678 F765 S771 T772 A773	F643-T769 HydrophobicContact CD1-CG2 3.7Å; F643-T769 HydrophobicContact CE1-CG2 3.58Å; D644-T769 WeakPolarHBondContact OD1-CG2 3.5Å; D644-T769 PolarHBondContact OD1-OG1 2.84Å; L647-T769 HydrophobicContact CD2-CG2 3.69Å; R678-T769 PolarHBondContact NH2-OG1 3Å; R678-T769 VanDerWaalsContact NH2-OG1 3.14Å; F765-T769 HydrophobicContact CE2-CG2 4.17Å; F765-T769 WeakPolarHBondContact O-CA 2.92Å; F765-T769 WeakPolarHBondContact O-CB 3.35Å; F765-T769 PolarHBondContact O-N 3.14Å; T769-S771 PolarHBondContact O-N 3.48Å; T769-T772 WeakPolarHBondContact CA-OG1 3.33Å; T769-T772 PolarHBondContact O-N 3.38Å; T769-T772 PolarHBondContact O-OG1 2.7Å; T769-A773 PolarHBondContact O-N 2.95Å
770	V	81.4	Confident	79	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.018	20%	0.198	C	C	.	.	I	π-helix	trans	-67.2	-41.8	-175.9	-177.2	0	0	0	0	111.1	F643 A740 E744 F765 Y766 T772 A773	F643-V770 HydrophobicContact CE1-CG2 4.22Å; F643-V770 HydrophobicContact CZ-CG2 4.33Å; A740-V770 HydrophobicContact CB-CG1 3.77Å; E744-V770 HydrophobicContact CG-CG1 3.9Å; F765-V770 HydrophobicContact CD1-CG2 3.97Å; F765-V770 HydrophobicContact CE1-CG2 3.49Å; F765-V770 VanDerWaalsContact CE1-CG2 3.49Å; F765-V770 HydrophobicContact CZ-CG2 3.8Å; F765-V770 PolarHBondContact O-N 2.91Å; F765-V770 VanDerWaalsContact O-N 3.14Å; Y766-V770 HydrophobicContact CD1-CB 3.98Å; Y766-V770 HydrophobicContact CD1-CG1 4.2Å; Y766-V770 HydrophobicContact CD1-CG2 3.67Å; Y766-V770 HydrophobicContact CE1-CG2 4.07Å; Y766-V770 HydrophobicContact CG-CG2 4.45Å; V770-T772 VanDerWaalsContact C-N 3.3Å; V770-T772 PolarHBondContact O-N 3.2Å; V770-A773 WeakPolarHBondContact O-CB 2.93Å; V770-A773 PolarHBondContact O-N 2.83Å
771	S	80.6	Confident	79.3	Confident	36 Å²	36	34 Å²	34	25%	0.252	17%	0.173	S	C	.	.	H	α-helix	trans	-63.7	-32.8	176.3	77.9	0	0	0	0	113.7	Y766 S767 T769 A773 S774	Y766-S771 PolarHBondContact O-N 3.24Å; Y766-S771 VanDerWaalsContact O-N 3.14Å; S767-S771 PolarHBondContact O-OG 3.26Å; T769-S771 PolarHBondContact O-N 3.48Å; S771-A773 VanDerWaalsContact C-N 3.31Å; S771-A773 PolarHBondContact O-N 2.9Å; S771-S774 PolarHBondContact O-OG 2.98Å
772	T	77.6	Confident	79.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-77.9	-14.3	-177.8	52.2	0	0	0	0	113.3	R671 Q768 T769 V770 S774 E775 L776	R671-T772 HydrophobicContact CB-CG2 4.45Å; R671-T772 HydrophobicContact CG-CG2 3.79Å; Q768-T772 WeakPolarHBondContact O-CB 3.24Å; Q768-T772 WeakPolarHBondContact O-CG2 3.46Å; Q768-T772 PolarHBondContact O-OG1 2.68Å; T769-T772 WeakPolarHBondContact CA-OG1 3.33Å; T769-T772 PolarHBondContact O-N 3.38Å; T769-T772 PolarHBondContact O-OG1 2.7Å; V770-T772 VanDerWaalsContact C-N 3.3Å; V770-T772 PolarHBondContact O-N 3.2Å; T772-S774 VanDerWaalsContact C-N 3.26Å; T772-S774 PolarHBondContact O-N 3.18Å; T772-E775 WeakPolarHBondContact O-CB 3.35Å; T772-E775 PolarHBondContact O-N 3.46Å; T772-L776 PolarHBondContact O-N 3.42Å
773	A	81.3	Confident	79.4	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.3	-39.4	173.5	0	0	0	0	0	112.4	F643 L647 L736 A740 T769 V770 S771 E775 L776	F643-A773 HydrophobicContact CZ-CB 3.98Å; L647-A773 HydrophobicContact CD1-CB 4.3Å; L736-A773 HydrophobicContact CD1-CB 4.37Å; L736-A773 HydrophobicContact CD2-CB 4.25Å; L736-A773 HydrophobicContact CG-CB 4.06Å; A740-A773 HydrophobicContact CB-CB 3.93Å; T769-A773 PolarHBondContact O-N 2.95Å; V770-A773 WeakPolarHBondContact O-CB 2.93Å; V770-A773 PolarHBondContact O-N 2.83Å; S771-A773 VanDerWaalsContact C-N 3.31Å; S771-A773 PolarHBondContact O-N 2.9Å; A773-E775 VanDerWaalsContact C-N 3.31Å; A773-E775 PolarHBondContact O-N 3.16Å; A773-L776 WeakPolarHBondContact O-CB 3.48Å; A773-L776 PolarHBondContact O-N 3.39Å
774	S	81.4	Confident	79.4	Confident	58 Å²	58	26.6 Å²	26.6	41%	0.406	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-69.2	-28.2	176.4	72.3	0	0	0	0	113.3	S771 T772 L776 R777	S771-S774 PolarHBondContact O-OG 2.98Å; T772-S774 VanDerWaalsContact C-N 3.26Å; T772-S774 PolarHBondContact O-N 3.18Å; S774-L776 VanDerWaalsContact C-N 3.26Å; S774-L776 PolarHBondContact O-N 3.36Å; S774-R777 WeakPolarHBondContact O-CB 3.42Å; S774-R777 PolarHBondContact O-N 2.82Å
775	E	79.3	Confident	79.4	Confident	52 Å²	52	22.4 Å²	22.4	24%	0.243	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-70.6	-24.8	178.4	-60.5	-174.8	-178.5	0	0	111.7	S669 T772 A773 R777 K778 P779	S669-E775 VanDerWaalsContact CB-OE2 3.29Å; S669-E775 WeakPolarHBondContact CB-OE2 3.47Å; S669-E775 PolarHBondContact OG-OE2 3.48Å; T772-E775 WeakPolarHBondContact O-CB 3.35Å; T772-E775 PolarHBondContact O-N 3.46Å; A773-E775 VanDerWaalsContact C-N 3.31Å; A773-E775 PolarHBondContact O-N 3.16Å; E775-R777 PolarHBondContact O-N 3.32Å; E775-K778 PolarHBondContact O-N 3.22Å; E775-K778 VanDerWaalsContact O-N 3.15Å; E775-P779 VanDerWaalsContact O-CD 3.28Å; E775-P779 WeakPolarHBondContact O-CD 3.2Å
776	L	78.7	Confident	79.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-63	-20.2	179.1	-159.5	72.9	0	0	0	113.3	L647 I650 Y651 L672 L736 T772 A773 S774 K778 P779 I780	L647-L776 HydrophobicContact CD1-CD2 4.04Å; I650-L776 HydrophobicContact CB-CD2 4.14Å; I650-L776 HydrophobicContact CG2-CD2 3.63Å; Y651-L776 HydrophobicContact CD2-CD1 3.81Å; Y651-L776 HydrophobicContact CG-CD1 4.27Å; L672-L776 HydrophobicContact CD1-CD1 4.42Å; L672-L776 HydrophobicContact CD2-CD1 4.39Å; L736-L776 HydrophobicContact CD2-CB 4.46Å; L736-L776 HydrophobicContact CD2-CD2 3.56Å; T772-L776 PolarHBondContact O-N 3.42Å; A773-L776 WeakPolarHBondContact O-CB 3.48Å; A773-L776 PolarHBondContact O-N 3.39Å; S774-L776 VanDerWaalsContact C-N 3.26Å; S774-L776 PolarHBondContact O-N 3.36Å; L776-K778 VanDerWaalsContact C-N 3.25Å; L776-K778 PolarHBondContact O-N 3.31Å; L776-P779 HydrophobicContact CD1-CG 4.28Å; L776-P779 VanDerWaalsContact O-CD 3.24Å; L776-P779 WeakPolarHBondContact O-CD 3.3Å; L776-P779 WeakPolarHBondContact O-CG 3.32Å; L776-I780 HydrophobicContact CD2-CD1 3.75Å; L776-I780 HydrophobicContact CG-CD1 3.68Å; L776-I780 HydrophobicContact CG-CG1 4.28Å; L776-I780 WeakPolarHBondContact O-CG1 3.38Å; L776-I780 PolarHBondContact O-N 2.92Å
777	R	82.4	Confident	79	Confident	36 Å²	36	26.4 Å²	26.4	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-53.1	-43.2	171.5	-71.7	-179	173.3	133.3	-5.3	111.8	T733 E734 V737 S774 E775 Y781 I846	T733-R777 HydrophobicContact CG2-CB 4.3Å; T733-R777 HydrophobicContact CG2-CG 3.48Å; T733-R777 VanDerWaalsContact CG2-CG 3.48Å; E734-R777 IonicContact OE1-CZ 2.81Å; E734-R777 IonicContact OE1-NE 3.11Å; E734-R777 PolarHBondContact OE1-NE 3.41Å; E734-R777 IonicContact OE1-NH2 3.12Å; E734-R777 PolarHBondContact OE1-NH2 3.08Å; E734-R777 VanDerWaalsContact OE1-NH2 3.1Å; E734-R777 IonicContact OE2-CZ 2.84Å; E734-R777 IonicContact OE2-NH2 2.74Å; E734-R777 PolarHBondContact OE2-NH2 3.11Å; V737-R777 VanDerWaalsContact CG1-NH2 3.3Å; S774-R777 WeakPolarHBondContact O-CB 3.42Å; S774-R777 PolarHBondContact O-N 2.82Å; E775-R777 PolarHBondContact O-N 3.32Å; R777-Y781 HydrophobicContact CB-CD2 3.92Å; R777-Y781 HydrophobicContact CB-CE2 3.72Å; R777-Y781 HydrophobicContact CG-CE2 3.88Å; R777-Y781 WeakPolarHBondContact O-CB 3.45Å; R777-Y781 WeakPolarHBondContact O-CD2 3.41Å; R777-Y781 VanDerWaalsContact O-CG 3.31Å; R777-Y781 PolarHBondContact O-N 2.85Å; R777-Y781 VanDerWaalsContact O-N 3.09Å; R777-I846 HydrophobicContact CB-CD1 3.9Å
778	K	80.8	Confident	78.8	Confident	99 Å²	99	23.8 Å²	23.8	43%	0.43	13%	0.125	S	C	.	.	H	α-helix	trans	-62.3	-57.7	-174.9	-63.9	179.5	-179.3	178.9	0	112.9	E775 L776 I780 W782 H850	E775-K778 PolarHBondContact O-N 3.22Å; E775-K778 VanDerWaalsContact O-N 3.15Å; L776-K778 VanDerWaalsContact C-N 3.25Å; L776-K778 PolarHBondContact O-N 3.31Å; K778-I780 PolarHBondContact O-N 2.82Å; K778-W782 WeakPolarHBondContact O-CB 3.43Å; K778-W782 PolarHBondContact O-N 3.06Å; K778-H850 PolarHBondContact O-NE2 2.99Å
779	P	77.4	Confident	78.9	Confident	15 Å²	15	20.9 Å²	20.9	10%	0.097	11%	0.112	C	C	.	.	H	α-helix	trans	-63.2	-37.9	-179.1	23.5	-33.7	0	0	0	113.3	L672 E775 L776 W782 I783	L672-P779 HydrophobicContact CD2-CG 4.41Å; E775-P779 VanDerWaalsContact O-CD 3.28Å; E775-P779 WeakPolarHBondContact O-CD 3.2Å; L776-P779 HydrophobicContact CD1-CG 4.28Å; L776-P779 VanDerWaalsContact O-CD 3.24Å; L776-P779 WeakPolarHBondContact O-CD 3.3Å; L776-P779 WeakPolarHBondContact O-CG 3.32Å; P779-W782 PolarHBondContact O-N 3.24Å; P779-I783 PolarHBondContact O-N 2.91Å
780	I	81.4	Confident	79.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-47.6	-178.6	-68	173.2	0	0	0	111.4	I650 F654 R729 T733 L776 K778	I650-I780 HydrophobicContact CG2-CD1 3.71Å; F654-I780 HydrophobicContact CB-CD1 4.31Å; F654-I780 HydrophobicContact CB-CG1 4.13Å; F654-I780 HydrophobicContact CB-CG2 3.96Å; R729-I780 HydrophobicContact CB-CG2 3.86Å; R729-I780 HydrophobicContact CG-CG2 4.05Å; R729-I780 PolarHBondContact NH1-O 3.05Å; R729-I780 VanDerWaalsContact NH1-O 3.08Å; T733-I780 HydrophobicContact CG2-CD1 4.42Å; T733-I780 WeakPolarHBondContact OG1-CD1 3.49Å; L776-I780 HydrophobicContact CD2-CD1 3.75Å; L776-I780 HydrophobicContact CG-CD1 3.68Å; L776-I780 HydrophobicContact CG-CG1 4.28Å; L776-I780 WeakPolarHBondContact O-CG1 3.38Å; L776-I780 PolarHBondContact O-N 2.92Å; K778-I780 PolarHBondContact O-N 2.82Å
781	Y	83.5	Confident	78.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-76.6	-25.7	-178.9	-63	-42.5	0	0	0	112.6	L726 V730 R777 I783 V784 A785 V843 I846 L847	L726-Y781 HydrophobicContact CD1-CD1 4.19Å; L726-Y781 HydrophobicContact CD1-CE1 4.28Å; V730-Y781 HydrophobicContact CG2-CE1 3.78Å; R777-Y781 HydrophobicContact CB-CD2 3.92Å; R777-Y781 HydrophobicContact CB-CE2 3.72Å; R777-Y781 HydrophobicContact CG-CE2 3.88Å; R777-Y781 WeakPolarHBondContact O-CB 3.45Å; R777-Y781 WeakPolarHBondContact O-CD2 3.41Å; R777-Y781 VanDerWaalsContact O-CG 3.31Å; R777-Y781 PolarHBondContact O-N 2.85Å; R777-Y781 VanDerWaalsContact O-N 3.09Å; Y781-I783 VanDerWaalsContact C-N 3.32Å; Y781-I783 PolarHBondContact O-N 3.46Å; Y781-V784 WeakPolarHBondContact O-CB 3.45Å; Y781-V784 PolarHBondContact O-N 3.46Å; Y781-A785 PolarHBondContact O-N 3.46Å; Y781-V843 HydrophobicContact CD1-CG1 4.4Å; Y781-V843 HydrophobicContact CD2-CG1 4.18Å; Y781-V843 HydrophobicContact CE1-CG1 3.81Å; Y781-V843 HydrophobicContact CE2-CB 4.16Å; Y781-V843 HydrophobicContact CE2-CG1 3.57Å; Y781-V843 HydrophobicContact CE2-CG2 3.86Å; Y781-V843 WeakPolarHBondContact OH-CG1 3.5Å; Y781-V843 WeakPolarHBondContact OH-CG2 3.3Å; Y781-I846 HydrophobicContact CD2-CG2 4.01Å; Y781-L847 HydrophobicContact CD1-CD2 4.07Å; Y781-L847 HydrophobicContact CD1-CG 4.38Å; Y781-L847 HydrophobicContact CG-CD2 4.07Å; Y781-L847 HydrophobicContact CG-CG 4.24Å
782	W	79.1	Confident	78.7	Confident	7 Å²	7	31.2 Å²	31.2	3%	0.027	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-40.7	172.8	179.5	-101.6	0	0	0	112.6	L660 L665 L667 K778 P779 V784 A785 G786 H850 R853 L854	L660-W782 HydrophobicContact CD2-CG 4.32Å; L665-W782 HydrophobicContact CD2-CH2 3.73Å; L665-W782 HydrophobicContact CD2-CZ2 4.17Å; L665-W782 HydrophobicContact CD2-CZ3 4.23Å; L667-W782 HydrophobicContact CD1-CB 4.48Å; L667-W782 HydrophobicContact CD1-CD2 3.51Å; L667-W782 VanDerWaalsContact CD1-CE2 3.4Å; L667-W782 HydrophobicContact CD1-CE3 4.13Å; L667-W782 HydrophobicContact CD1-CG 3.65Å; L667-W782 HydrophobicContact CD1-CZ2 3.94Å; L667-W782 HydrophobicContact CD2-CD2 4Å; L667-W782 HydrophobicContact CD2-CE3 3.82Å; L667-W782 HydrophobicContact CD2-CG 4.37Å; L667-W782 HydrophobicContact CD2-CZ3 4.26Å; L667-W782 HydrophobicContact CG-CD2 4.41Å; K778-W782 WeakPolarHBondContact O-CB 3.43Å; K778-W782 PolarHBondContact O-N 3.06Å; P779-W782 PolarHBondContact O-N 3.24Å; W782-V784 VanDerWaalsContact C-N 3.28Å; W782-V784 PolarHBondContact O-N 3.03Å; W782-A785 PolarHBondContact O-N 3.01Å; W782-G786 PolarHBondContact O-N 3.24Å; W782-H850 HydrophobicContact CE3-CB 3.78Å; W782-H850 AromaticContact CE3-CG 3.61Å; W782-H850 AromaticContact CE3-ND1 3.48Å; W782-H850 HydrophobicContact CZ3-CB 4.22Å; W782-H850 AromaticContact CZ3-ND1 3.88Å; W782-R853 HydrophobicContact CH2-CG 4.35Å; W782-R853 HydrophobicContact CZ3-CG 4.24Å; W782-L854 HydrophobicContact CE3-CD1 4.37Å; W782-L854 HydrophobicContact CE3-CG 4.44Å; W782-L854 HydrophobicContact CH2-CD1 4.15Å; W782-L854 HydrophobicContact CH2-CD2 3.38Å; W782-L854 HydrophobicContact CH2-CG 3.44Å; W782-L854 VanDerWaalsContact CH2-CG 3.44Å; W782-L854 HydrophobicContact CZ2-CD1 4.31Å; W782-L854 HydrophobicContact CZ2-CD2 3.35Å; W782-L854 HydrophobicContact CZ2-CG 3.85Å; W782-L854 HydrophobicContact CZ3-CD1 4.18Å; W782-L854 HydrophobicContact CZ3-CD2 4.22Å; W782-L854 HydrophobicContact CZ3-CG 3.78Å
783	I	75.6	Confident	78.9	Confident	10 Å²	10	35.7 Å²	35.7	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-36.8	176.7	-67.1	160.9	0	0	0	111.2	F654 N657 L660 R729 P779 Y781 K787	F654-I783 VanDerWaalsContact O-CD1 3.31Å; F654-I783 WeakPolarHBondContact O-CD1 3.44Å; N657-I783 HydrophobicContact CB-CD1 3.75Å; N657-I783 HydrophobicContact CB-CG1 4.09Å; L660-I783 HydrophobicContact CD2-CB 4.42Å; L660-I783 HydrophobicContact CD2-CG1 3.89Å; R729-I783 VanDerWaalsContact NH1-CG2 3.34Å; P779-I783 PolarHBondContact O-N 2.91Å; Y781-I783 VanDerWaalsContact C-N 3.32Å; Y781-I783 PolarHBondContact O-N 3.46Å; I783-K787 PolarHBondContact O-N 2.85Å
784	V	78.9	Confident	78.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-49.1	175.4	-177.9	0	0	0	0	109.8	L723 L726 Y781 W782 G786 K787 A788 L847	L723-V784 HydrophobicContact CB-CG1 4.42Å; L726-V784 HydrophobicContact CB-CG1 4.5Å; L726-V784 HydrophobicContact CD1-CG1 4.25Å; L726-V784 HydrophobicContact CD1-CG2 4.25Å; Y781-V784 WeakPolarHBondContact O-CB 3.45Å; Y781-V784 PolarHBondContact O-N 3.46Å; W782-V784 VanDerWaalsContact C-N 3.28Å; W782-V784 PolarHBondContact O-N 3.03Å; V784-G786 VanDerWaalsContact C-N 3.33Å; V784-G786 PolarHBondContact O-N 3.4Å; V784-K787 PolarHBondContact O-N 3.49Å; V784-A788 WeakPolarHBondContact O-CB 3.35Å; V784-A788 PolarHBondContact O-N 2.95Å; V784-L847 HydrophobicContact CB-CD2 4.3Å; V784-L847 HydrophobicContact CG1-CD2 4.38Å
785	A	78.9	Confident	78.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.6	-42	178.9	0	0	0	0	0	112.4	Y781 W782 K787 A788 Y791 H850 C851 L854	Y781-A785 PolarHBondContact O-N 3.46Å; W782-A785 PolarHBondContact O-N 3.01Å; A785-K787 VanDerWaalsContact C-N 3.27Å; A785-K787 PolarHBondContact O-N 3.29Å; A785-A788 PolarHBondContact O-N 3.41Å; A785-Y791 PolarHBondContact O-OH 3.23Å; A785-H850 HydrophobicContact CB-CB 3.7Å; A785-C851 VanDerWaalsContact CB-SG 3.56Å; A785-L854 HydrophobicContact CB-CD1 3.85Å
786	G	75.1	Confident	78.9	Confident	20 Å²	20	38.3 Å²	38.3	21%	0.206	19%	0.189	C	C	.	.	H	α-helix	trans	-63.6	-27.7	178.6	0	0	0	0	0	114.6	W782 V784	W782-G786 PolarHBondContact O-N 3.24Å; V784-G786 VanDerWaalsContact C-N 3.33Å; V784-G786 PolarHBondContact O-N 3.4Å
787	K	75.2	Confident	79	Confident	90 Å²	90	41.1 Å²	41.1	39%	0.391	20%	0.203	S	C	.	.	H	α-helix	trans	-100.7	-19.6	177.8	-63.7	-175.9	179.6	-177.4	0	113.1	Y724 I783 V784 A785 L789	Y724-K787 HydrophobicContact CD1-CB 4.26Å; Y724-K787 HydrophobicContact CD1-CD 4Å; Y724-K787 HydrophobicContact CD2-CB 3.63Å; Y724-K787 HydrophobicContact CE1-CB 4.04Å; Y724-K787 HydrophobicContact CE1-CD 4.14Å; Y724-K787 VanDerWaalsContact CE2-C 3.41Å; Y724-K787 HydrophobicContact CE2-CB 3.41Å; Y724-K787 VanDerWaalsContact CE2-CB 3.41Å; Y724-K787 WeakPolarHBondContact CE2-O 2.97Å; Y724-K787 HydrophobicContact CG-CB 4.07Å; Y724-K787 HydrophobicContact CG-CD 4.27Å; Y724-K787 PolarHBondContact OH-O 3.49Å; I783-K787 PolarHBondContact O-N 2.85Å; V784-K787 PolarHBondContact O-N 3.49Å; A785-K787 VanDerWaalsContact C-N 3.27Å; A785-K787 PolarHBondContact O-N 3.29Å; K787-L789 VanDerWaalsContact C-N 3.29Å; K787-L789 PolarHBondContact O-N 3.17Å
788	A	74.8	Confident	78.9	Confident	8 Å²	8	39.6 Å²	39.6	7%	0.066	20%	0.198	C	C	.	.	H	α-helix	trans	-68	-26.8	-175.2	0	0	0	0	0	113.7	L723 V784 A785 F826	L723-A788 HydrophobicContact CD2-CB 4.37Å; V784-A788 WeakPolarHBondContact O-CB 3.35Å; V784-A788 PolarHBondContact O-N 2.95Å; A785-A788 PolarHBondContact O-N 3.41Å; A788-F826 HydrophobicContact CB-CD2 3.89Å; A788-F826 HydrophobicContact CB-CE2 4.04Å
789	L	78.9	Confident	78.9	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	21%	0.207	C	C	.	.	S	Bend	trans	-119	134.3	-179.6	-64.7	168.9	0	0	0	109.1	K787 Y791 E822 F823 C851	K787-L789 VanDerWaalsContact C-N 3.29Å; K787-L789 PolarHBondContact O-N 3.17Å; L789-Y791 VanDerWaalsContact C-N 3.34Å; L789-Y791 HydrophobicContact CB-CD1 4.35Å; L789-Y791 HydrophobicContact CB-CD2 4.29Å; L789-Y791 HydrophobicContact CB-CE1 3.82Å; L789-Y791 HydrophobicContact CB-CE2 3.75Å; L789-Y791 HydrophobicContact CD1-CE1 3.96Å; L789-Y791 WeakPolarHBondContact CD1-OH 3.46Å; L789-Y791 WeakPolarHBondContact O-CD2 3.17Å; L789-Y791 WeakPolarHBondContact O-CE2 3.46Å; L789-Y791 PolarHBondContact O-N 3.41Å; L789-E822 HydrophobicContact CD2-CB 3.52Å; L789-F823 HydrophobicContact CD1-CD1 4.44Å; L789-F823 HydrophobicContact CD1-CE1 3.94Å; L789-F823 HydrophobicContact CD1-CE2 4.28Å; L789-F823 HydrophobicContact CD1-CZ 3.84Å; L789-C851 HydrophobicContact CD1-CB 4.12Å
790	D	78.4	Confident	78.9	Confident	76 Å²	76	44 Å²	44	41%	0.406	24%	0.236	S	C	.	.			trans	-80.2	82.1	175.9	-171.7	-13.4	0	0	0	110.6	E792 Q793 M794	D790-E792 VanDerWaalsContact C-N 3.28Å; D790-E792 PolarHBondContact O-N 3.43Å; D790-E792 PolarHBondContact OD1-N 2.95Å; D790-Q793 HydrophobicContact CB-CB 4.23Å; D790-Q793 VanDerWaalsContact CG-CB 3.47Å; D790-Q793 PolarHBondContact OD1-N 3.5Å; D790-Q793 WeakPolarHBondContact OD2-CB 3.21Å; D790-M794 WeakPolarHBondContact O-CG 3.49Å; D790-M794 PolarHBondContact O-N 3.44Å
791	Y	76.6	Confident	78.8	Confident	26 Å²	26	45.6 Å²	45.6	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-26.1	179.8	-60.1	-71	0	0	0	113.1	A785 L789 M794 L795 C851 L854 A855 T858	A785-Y791 PolarHBondContact O-OH 3.23Å; L789-Y791 VanDerWaalsContact C-N 3.34Å; L789-Y791 HydrophobicContact CB-CD1 4.35Å; L789-Y791 HydrophobicContact CB-CD2 4.29Å; L789-Y791 HydrophobicContact CB-CE1 3.82Å; L789-Y791 HydrophobicContact CB-CE2 3.75Å; L789-Y791 HydrophobicContact CD1-CE1 3.96Å; L789-Y791 WeakPolarHBondContact CD1-OH 3.46Å; L789-Y791 WeakPolarHBondContact O-CD2 3.17Å; L789-Y791 WeakPolarHBondContact O-CE2 3.46Å; L789-Y791 PolarHBondContact O-N 3.41Å; Y791-M794 PolarHBondContact O-N 3.41Å; Y791-L795 WeakPolarHBondContact O-CG 3.32Å; Y791-L795 PolarHBondContact O-N 2.92Å; Y791-C851 PolarHBondContact OH-O 3.39Å; Y791-L854 HydrophobicContact CE1-CB 3.96Å; Y791-L854 HydrophobicContact CE2-CB 4.09Å; Y791-L854 HydrophobicContact CE2-CD1 4.16Å; Y791-L854 VanDerWaalsContact CZ-CB 3.46Å; Y791-L854 WeakPolarHBondContact OH-CB 3.28Å; Y791-A855 HydrophobicContact CE1-CB 4.32Å; Y791-T858 HydrophobicContact CD1-CG2 4.09Å; Y791-T858 WeakPolarHBondContact CD1-OG1 3.23Å
792	E	77.8	Confident	78.4	Confident	153 Å²	153	54.1 Å²	54.1	72%	0.715	28%	0.282	S	S	*	.	H	α-helix	trans	-69.1	-43.8	178.6	-67.1	-172.8	176	0	0	111	D790 M794 L795 L796	D790-E792 VanDerWaalsContact C-N 3.28Å; D790-E792 PolarHBondContact O-N 3.43Å; D790-E792 PolarHBondContact OD1-N 2.95Å; E792-M794 VanDerWaalsContact C-N 3.26Å; E792-M794 PolarHBondContact O-N 2.92Å; E792-L795 PolarHBondContact O-N 3.48Å; E792-L796 WeakPolarHBondContact O-CG 3.14Å; E792-L796 PolarHBondContact O-N 2.84Å
793	Q	80.8	Confident	78.4	Confident	94 Å²	94	54.1 Å²	54.1	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-37.8	173.1	-172.2	176.7	46.4	0	0	111.6	D790 L796 L797	D790-Q793 HydrophobicContact CB-CB 4.23Å; D790-Q793 VanDerWaalsContact CG-CB 3.47Å; D790-Q793 PolarHBondContact OD1-N 3.5Å; D790-Q793 WeakPolarHBondContact OD2-CB 3.21Å; Q793-L796 PolarHBondContact O-N 3.32Å; Q793-L797 HydrophobicContact CG-CD1 4.42Å; Q793-L797 WeakPolarHBondContact O-CG 3.22Å; Q793-L797 PolarHBondContact O-N 3.33Å
794	M	80.1	Confident	78.3	Confident	9 Å²	9	59 Å²	59	4%	0.044	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-44.1	176.2	-62.8	-55.7	119.3	0	0	112.1	D790 Y791 E792 L796 L797 M798 A818 L819 E822 T858	D790-M794 WeakPolarHBondContact O-CG 3.49Å; D790-M794 PolarHBondContact O-N 3.44Å; Y791-M794 PolarHBondContact O-N 3.41Å; E792-M794 VanDerWaalsContact C-N 3.26Å; E792-M794 PolarHBondContact O-N 2.92Å; M794-L796 VanDerWaalsContact C-N 3.3Å; M794-L796 PolarHBondContact O-N 3.47Å; M794-L797 HydrophobicContact CE-CD1 4.11Å; M794-L797 PolarHBondContact O-N 3.04Å; M794-L797 HydrophobicContact SD-CD1 4.31Å; M794-M798 VanDerWaalsContact O-CG 3.31Å; M794-M798 WeakPolarHBondContact O-CG 3.47Å; M794-M798 PolarHBondContact O-N 3.34Å; M794-A818 HydrophobicContact CE-CB 4.02Å; M794-A818 HydrophobicContact SD-CB 4.1Å; M794-L819 HydrophobicContact CG-CD1 4.2Å; M794-L819 HydrophobicContact SD-CB 4.1Å; M794-L819 HydrophobicContact SD-CD1 4.5Å; M794-E822 HydrophobicContact CE-CG 4.42Å; M794-T858 HydrophobicContact CB-CG2 4.37Å
795	L	81.3	Confident	78.2	Confident	41 Å²	41	60.6 Å²	60.6	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-38.7	175.3	-71.7	173.9	0	0	0	112.1	Y791 E792 M798 A799 T858 E861	Y791-L795 WeakPolarHBondContact O-CG 3.32Å; Y791-L795 PolarHBondContact O-N 2.92Å; E792-L795 PolarHBondContact O-N 3.48Å; L795-M798 PolarHBondContact O-N 3.36Å; L795-A799 WeakPolarHBondContact O-CB 3.12Å; L795-A799 PolarHBondContact O-N 2.88Å; L795-T858 HydrophobicContact CD1-CG2 4.43Å; L795-T858 HydrophobicContact CD2-CG2 3.78Å; L795-T858 WeakPolarHBondContact CD2-O 3.31Å; L795-T858 HydrophobicContact CG-CG2 3.74Å; L795-E861 HydrophobicContact CD2-CB 4.18Å; L795-E861 HydrophobicContact CD2-CG 4.11Å
796	L	81.8	Confident	77.5	Confident	116 Å²	116	69.4 Å²	69.4	61%	0.607	36%	0.356	S	S	*	.	H	α-helix	trans	-64.7	-43.2	174.7	-72.8	170.3	0	0	0	112.2	E792 Q793 M794 A799 N800	E792-L796 WeakPolarHBondContact O-CG 3.14Å; E792-L796 PolarHBondContact O-N 2.84Å; Q793-L796 PolarHBondContact O-N 3.32Å; M794-L796 VanDerWaalsContact C-N 3.3Å; M794-L796 PolarHBondContact O-N 3.47Å; L796-A799 PolarHBondContact O-N 2.93Å; L796-N800 PolarHBondContact O-N 3.4Å; L796-N800 PolarHBondContact O-ND2 2.96Å
797	L	80.4	Confident	77.1	Confident	59 Å²	59	76 Å²	76	31%	0.309	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-42.2	176	-72	172.6	0	0	0	111.3	Q793 M794 N800 V801 A818	Q793-L797 HydrophobicContact CG-CD1 4.42Å; Q793-L797 WeakPolarHBondContact O-CG 3.22Å; Q793-L797 PolarHBondContact O-N 3.33Å; M794-L797 HydrophobicContact CE-CD1 4.11Å; M794-L797 PolarHBondContact O-N 3.04Å; M794-L797 HydrophobicContact SD-CD1 4.31Å; L797-N800 PolarHBondContact O-N 2.98Å; L797-V801 WeakPolarHBondContact O-CG2 3.24Å; L797-A818 HydrophobicContact CD1-CB 4.05Å
798	M	80.8	Confident	76.7	Confident	3 Å²	3	77 Å²	77	2%	0.015	39%	0.391	C	S	.	.	H	α-helix	trans	-66	-35.4	176.5	-69.4	-177.5	76.8	0	0	112.8	M794 L795 N800 V801 Y815 I859 Y863	M794-M798 VanDerWaalsContact O-CG 3.31Å; M794-M798 WeakPolarHBondContact O-CG 3.47Å; M794-M798 PolarHBondContact O-N 3.34Å; L795-M798 PolarHBondContact O-N 3.36Å; M798-N800 VanDerWaalsContact C-N 3.28Å; M798-N800 PolarHBondContact O-N 3.47Å; M798-V801 PolarHBondContact O-N 3.13Å; M798-Y815 HydrophobicContact CE-CE2 4.09Å; M798-Y815 HydrophobicContact CG-CD1 4.1Å; M798-Y815 HydrophobicContact CG-CD2 3.76Å; M798-Y815 HydrophobicContact CG-CE1 4.4Å; M798-Y815 HydrophobicContact CG-CE2 4.09Å; M798-Y815 HydrophobicContact CG-CG 3.78Å; M798-Y815 HydrophobicContact SD-CD2 4.14Å; M798-Y815 HydrophobicContact SD-CE2 4.09Å; M798-I859 HydrophobicContact CE-CG2 4.48Å; M798-I859 WeakPolarHBondContact CE-O 3.33Å; M798-Y863 HydrophobicContact CE-CD1 3.55Å; M798-Y863 HydrophobicContact CE-CE1 3.53Å; M798-Y863 HydrophobicContact CE-CG 4.35Å
799	A	79.8	Confident	76.1	Confident	75 Å²	75	81.9 Å²	81.9	62%	0.62	41%	0.413	S	S	*	.	H	α-helix	trans	-67.2	-27.9	176.3	0	0	0	0	0	113.2	L795 L796	L795-A799 WeakPolarHBondContact O-CB 3.12Å; L795-A799 PolarHBondContact O-N 2.88Å; L796-A799 PolarHBondContact O-N 2.93Å
800	N	78.8	Confident	75.5	Confident	133 Å²	133	87.2 Å²	87.2	71%	0.711	45%	0.451	S	S	*	.	H	α-helix	trans	-81	-13.3	178.3	-71	-30.8	0	0	0	113.5	L796 L797 M798	L796-N800 PolarHBondContact O-N 3.4Å; L796-N800 PolarHBondContact O-ND2 2.96Å; L797-N800 PolarHBondContact O-N 2.98Å; M798-N800 VanDerWaalsContact C-N 3.28Å; M798-N800 PolarHBondContact O-N 3.47Å
801	V	79.5	Confident	75.2	Confident	32 Å²	32	90.2 Å²	90.2	19%	0.194	46%	0.462	C	S	.	.	S	Bend	trans	-75.4	132.9	177.6	177.4	0	0	0	0	110.4	L797 M798 W803 Y815	L797-V801 WeakPolarHBondContact O-CG2 3.24Å; M798-V801 PolarHBondContact O-N 3.13Å; V801-W803 HydrophobicContact CB-CZ2 4.2Å; V801-W803 HydrophobicContact CG1-CD2 4.06Å; V801-W803 HydrophobicContact CG1-CH2 4.35Å; V801-W803 HydrophobicContact CG1-CZ2 3.9Å; V801-W803 VanDerWaalsContact O-CD1 3.25Å; V801-Y815 HydrophobicContact CG2-CD1 4.3Å
802	K	75.2	Confident	75.2	Confident	179 Å²	179	91.1 Å²	91.1	78%	0.778	47%	0.467	S	S	*	.			trans	-87.9	114.3	173	-67.7	-178.1	-178.6	176.1	0	109.8	V805	K802-V805 WeakPolarHBondContact O-CG2 3.32Å
803	W	78.1	Confident	75.4	Confident	8 Å²	8	85.3 Å²	85.3	3%	0.03	44%	0.441	C	S	.	.			trans	-92.2	8.4	-179.7	-60	96.4	0	0	0	114.1	V801 Y815 Y863 V866 C869 S870 L876 M877	V801-W803 HydrophobicContact CB-CZ2 4.2Å; V801-W803 HydrophobicContact CG1-CD2 4.06Å; V801-W803 HydrophobicContact CG1-CH2 4.35Å; V801-W803 HydrophobicContact CG1-CZ2 3.9Å; V801-W803 VanDerWaalsContact O-CD1 3.25Å; W803-Y815 HydrophobicContact CH2-CE1 4.08Å; W803-Y815 HydrophobicContact CZ2-CE1 4.26Å; W803-Y863 HydrophobicContact CH2-CD1 4.34Å; W803-Y863 AromaticContact CH2-CE1 3.72Å; W803-Y863 HydrophobicContact CH2-CE1 3.72Å; W803-Y863 HydrophobicContact CZ2-CD1 4.21Å; W803-Y863 AromaticContact CZ2-CE1 3.96Å; W803-Y863 HydrophobicContact CZ2-CE1 3.96Å; W803-V866 HydrophobicContact CB-CG1 3.82Å; W803-V866 HydrophobicContact CD2-CG2 4.49Å; W803-V866 HydrophobicContact CG-CG1 3.79Å; W803-V866 HydrophobicContact CG-CG2 4.06Å; W803-C869 HydrophobicContact CB-CB 4.41Å; W803-S870 PolarHBondContact O-N 2.93Å; W803-S870 PolarHBondContact O-OG 3.37Å; W803-L876 HydrophobicContact CZ3-CD2 4.39Å; W803-L876 HydrophobicContact CZ3-CG 4.43Å; W803-M877 HydrophobicContact CB-CE 4.29Å; W803-M877 HydrophobicContact CD2-CE 3.42Å; W803-M877 VanDerWaalsContact CD2-CE 3.42Å; W803-M877 HydrophobicContact CD2-CG 4.35Å; W803-M877 HydrophobicContact CE3-CE 3.48Å; W803-M877 VanDerWaalsContact CE3-CE 3.48Å; W803-M877 HydrophobicContact CE3-CG 3.52Å; W803-M877 HydrophobicContact CE3-SD 4.35Å; W803-M877 HydrophobicContact CG-CE 3.82Å; W803-M877 HydrophobicContact CH2-CE 4.41Å; W803-M877 HydrophobicContact CH2-CG 3.71Å; W803-M877 HydrophobicContact CZ2-CE 4.37Å; W803-M877 HydrophobicContact CZ2-CG 4.5Å; W803-M877 HydrophobicContact CZ3-CB 4.14Å; W803-M877 HydrophobicContact CZ3-CE 4.01Å; W803-M877 HydrophobicContact CZ3-CG 3.17Å; W803-M877 HydrophobicContact CZ3-SD 4.47Å
804	D	73.9	Confident	75.5	Confident	111 Å²	111	87.4 Å²	87.4	59%	0.594	45%	0.454	S	S	*	.			trans	-104.6	78.2	176.2	-167.9	17	0	0	0	109.2
805	V	75.3	Confident	75.7	Confident	35 Å²	35	87.3 Å²	87.3	21%	0.212	45%	0.453	C	S	.	.			trans	-109.7	145.3	-176	-164.5	0	0	0	0	108.4	K802 E807 S870	K802-V805 WeakPolarHBondContact O-CG2 3.32Å; V805-E807 WeakPolarHBondContact CG1-O 3.47Å; V805-S870 PolarHBondContact N-OG 3.34Å; V805-S870 VanDerWaalsContact N-OG 3.13Å; V805-S870 PolarHBondContact O-OG 2.92Å
806	K	65.4	Low	75.8	Confident	185 Å²	185	85.4 Å²	85.4	80%	0.804	44%	0.443	S	S	*	.	S	Bend	trans	-107	-4.7	-178	-66	-175.1	180	-179.1	0	114.5	E872	K806-E872 WeakPolarHBondContact CA-OE2 3.42Å; K806-E872 PolarHBondContact N-OE2 3.38Å
807	E	67.1	Low	75.9	Confident	157 Å²	157	83.1 Å²	83.1	73%	0.734	43%	0.432	S	S	*	.	S	Bend	trans	-140.2	139.9	170	-67	-177.9	174.9	0	0	109.5	V805 M809 E872	V805-E807 WeakPolarHBondContact CG1-O 3.47Å; E807-M809 PolarHBondContact O-N 3.3Å; E807-M809 VanDerWaalsContact O-N 3.1Å; E807-E872 PolarHBondContact N-OE2 3.36Å
808	I	66.3	Low	76.1	Confident	113 Å²	113	81.5 Å²	81.5	58%	0.579	43%	0.427	S	S	*	.			trans	-68.2	111.1	176.4	-59.3	172	0	0	0	108.3	E872	I808-E872 HydrophobicContact CG1-CB 4.06Å; I808-E872 HydrophobicContact CG1-CG 3.93Å
809	M	62	Low	76.3	Confident	110 Å²	110	81.7 Å²	81.7	54%	0.542	43%	0.428	S	S	.	.			trans	-70.9	136.8	171.2	-65.6	-170.8	64.6	0	0	109.8	E807 Q811	E807-M809 PolarHBondContact O-N 3.3Å; E807-M809 VanDerWaalsContact O-N 3.1Å; M809-Q811 PolarHBondContact O-N 3.33Å
810	S	67.2	Low	76.5	Confident	116 Å²	116	78.5 Å²	78.5	81%	0.811	40%	0.4	S	S	*	.	S	Bend	trans	-77.2	-2.5	177.9	52.3	0	0	0	0	113.9
811	Q	71.3	Confident	76.8	Confident	140 Å²	140	78.7 Å²	78.7	65%	0.654	40%	0.395	S	S	*	.	S	Bend	trans	-114.7	143.2	-176.9	-64	-178.9	-9.3	0	0	110.2	M809	M809-Q811 PolarHBondContact O-N 3.33Å
812	H	76.6	Confident	77	Confident	44 Å²	44	79.1 Å²	79.1	20%	0.204	39%	0.394	C	S	.	.			trans	-77.8	162.7	173.9	54.4	74.8	0	0	0	111.8	D817 L879 D880 Q883 K887	H812-D817 IonicContact CE1-OD1 3.97Å; H812-D817 PolarHBondContact CE1-OD1 3.4Å; H812-D817 IonicContact CE1-OD2 3.11Å; H812-D817 PolarHBondContact CE1-OD2 3.12Å; H812-D817 IonicContact ND1-OD1 3.68Å; H812-D817 IonicContact ND1-OD2 3.31Å; H812-D817 IonicContact NE2-OD1 3.89Å; H812-L879 HydrophobicContact CB-CD2 3.9Å; H812-D880 WeakPolarHBondContact CA-OD1 3.43Å; H812-D880 WeakPolarHBondContact CB-OD1 3.46Å; H812-Q883 HydrophobicContact CB-CG 4.47Å; H812-Q883 VanDerWaalsContact CD2-CG 3.44Å; H812-Q883 WeakPolarHBondContact CD2-CG 3.49Å; H812-Q883 PolarHBondContact CD2-NE2 3.06Å; H812-Q883 PolarHBondContact NE2-NE2 2.88Å; H812-K887 PolarHBondContact NE2-NZ 3.28Å
813	N	81.8	Confident	77.5	Confident	31 Å²	31	70.6 Å²	70.6	17%	0.166	36%	0.357	C	S	.	.			trans	-74.2	155.1	-179	-76	-50.6	0	0	0	113.7	Y815 V816 D880	N813-Y815 VanDerWaalsContact C-N 3.25Å; N813-Y815 HydrophobicContact CB-CD1 3.48Å; N813-Y815 VanDerWaalsContact CB-CD1 3.48Å; N813-Y815 HydrophobicContact CB-CE1 3.47Å; N813-Y815 VanDerWaalsContact CB-CE1 3.47Å; N813-Y815 PolarHBondContact O-N 2.89Å; N813-V816 WeakPolarHBondContact O-CB 3.14Å; N813-V816 PolarHBondContact O-N 3.2Å; N813-V816 VanDerWaalsContact O-N 3.15Å; N813-D880 PolarHBondContact N-OD1 3.1Å; N813-D880 PolarHBondContact ND2-OD2 2.91Å
814	I	82.1	Confident	77.8	Confident	138 Å²	138	74.1 Å²	74.1	71%	0.708	37%	0.374	S	S	*	.	H	α-helix	trans	-63.4	-29.5	-176	-58.3	167.3	0	0	0	112.2	V816 D817 A818	I814-V816 PolarHBondContact O-N 3.42Å; I814-D817 PolarHBondContact O-N 3.47Å; I814-A818 PolarHBondContact O-N 3.46Å
815	Y	84.4	Confident	78.3	Confident	7 Å²	7	72.1 Å²	72.1	3%	0.027	36%	0.361	C	S	.	.	H	α-helix	trans	-64.6	-29.7	179	79.5	-94.8	0	0	0	112.2	M798 V801 W803 N813 A818 L819 Y863 D880	M798-Y815 HydrophobicContact CE-CE2 4.09Å; M798-Y815 HydrophobicContact CG-CD1 4.1Å; M798-Y815 HydrophobicContact CG-CD2 3.76Å; M798-Y815 HydrophobicContact CG-CE1 4.4Å; M798-Y815 HydrophobicContact CG-CE2 4.09Å; M798-Y815 HydrophobicContact CG-CG 3.78Å; M798-Y815 HydrophobicContact SD-CD2 4.14Å; M798-Y815 HydrophobicContact SD-CE2 4.09Å; V801-Y815 HydrophobicContact CG2-CD1 4.3Å; W803-Y815 HydrophobicContact CH2-CE1 4.08Å; W803-Y815 HydrophobicContact CZ2-CE1 4.26Å; N813-Y815 VanDerWaalsContact C-N 3.25Å; N813-Y815 HydrophobicContact CB-CD1 3.48Å; N813-Y815 VanDerWaalsContact CB-CD1 3.48Å; N813-Y815 HydrophobicContact CB-CE1 3.47Å; N813-Y815 VanDerWaalsContact CB-CE1 3.47Å; N813-Y815 PolarHBondContact O-N 2.89Å; Y815-A818 PolarHBondContact O-N 3.3Å; Y815-L819 VanDerWaalsContact O-CB 3.3Å; Y815-L819 WeakPolarHBondContact O-CB 3.23Å; Y815-L819 PolarHBondContact O-N 2.81Å; Y815-Y863 PolarHBondContact OH-OH 2.87Å; Y815-D880 WeakPolarHBondContact OH-CB 3.16Å; Y815-D880 PolarHBondContact OH-OD2 3.23Å
816	V	83.6	Confident	78.7	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.012	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-42.7	177.4	179.2	0	0	0	0	110.2	N813 I814 L819 L820 D880 F884	N813-V816 WeakPolarHBondContact O-CB 3.14Å; N813-V816 PolarHBondContact O-N 3.2Å; N813-V816 VanDerWaalsContact O-N 3.15Å; I814-V816 PolarHBondContact O-N 3.42Å; V816-L819 PolarHBondContact O-N 3.12Å; V816-L820 HydrophobicContact CG1-CD1 3.95Å; V816-L820 WeakPolarHBondContact O-CB 3.21Å; V816-L820 WeakPolarHBondContact O-CD1 3.49Å; V816-L820 WeakPolarHBondContact O-CG 3.19Å; V816-L820 PolarHBondContact O-N 2.55Å; V816-D880 HydrophobicContact CG2-CB 3.75Å; V816-F884 HydrophobicContact CG1-CB 3.97Å
817	D	84.3	Confident	79.6	Confident	68 Å²	68	63.9 Å²	63.9	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-69.2	-36.7	175.6	-68.6	-37.3	0	0	0	112.2	H812 I814 L820 K821 K887	H812-D817 IonicContact CE1-OD1 3.97Å; H812-D817 PolarHBondContact CE1-OD1 3.4Å; H812-D817 IonicContact CE1-OD2 3.11Å; H812-D817 PolarHBondContact CE1-OD2 3.12Å; H812-D817 IonicContact ND1-OD1 3.68Å; H812-D817 IonicContact ND1-OD2 3.31Å; H812-D817 IonicContact NE2-OD1 3.89Å; I814-D817 PolarHBondContact O-N 3.47Å; D817-L820 PolarHBondContact O-N 3.26Å; D817-K821 VanDerWaalsContact O-CB 3.32Å; D817-K821 WeakPolarHBondContact O-CB 3.27Å; D817-K821 PolarHBondContact O-N 2.93Å; D817-K887 IonicContact OD1-NZ 2.87Å; D817-K887 PolarHBondContact OD1-NZ 2.64Å
818	A	84.8	Confident	80.4	Confident	24 Å²	24	64.1 Å²	64.1	20%	0.198	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-47	174.5	0	0	0	0	0	111	M794 L797 I814 Y815 L820 K821 E822	M794-A818 HydrophobicContact CE-CB 4.02Å; M794-A818 HydrophobicContact SD-CB 4.1Å; L797-A818 HydrophobicContact CD1-CB 4.05Å; I814-A818 PolarHBondContact O-N 3.46Å; Y815-A818 PolarHBondContact O-N 3.3Å; A818-L820 PolarHBondContact O-N 3.11Å; A818-K821 WeakPolarHBondContact O-CB 3.39Å; A818-K821 PolarHBondContact O-N 3.27Å; A818-E822 WeakPolarHBondContact O-CG 3.19Å; A818-E822 PolarHBondContact O-N 2.92Å
819	L	84.6	Confident	81.1	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-44.6	176.9	-177	63.6	0	0	0	111.7	M794 Y815 V816 K821 E822 F823 A855 I859 F884	M794-L819 HydrophobicContact CG-CD1 4.2Å; M794-L819 HydrophobicContact SD-CB 4.1Å; M794-L819 HydrophobicContact SD-CD1 4.5Å; Y815-L819 VanDerWaalsContact O-CB 3.3Å; Y815-L819 WeakPolarHBondContact O-CB 3.23Å; Y815-L819 PolarHBondContact O-N 2.81Å; V816-L819 PolarHBondContact O-N 3.12Å; L819-K821 VanDerWaalsContact C-N 3.33Å; L819-K821 PolarHBondContact O-N 2.87Å; L819-E822 PolarHBondContact O-N 2.92Å; L819-F823 HydrophobicContact CD1-CD2 4.24Å; L819-F823 HydrophobicContact CD1-CE2 3.84Å; L819-F823 HydrophobicContact CD2-CE2 4.4Å; L819-F823 HydrophobicContact CG-CD2 4.05Å; L819-F823 HydrophobicContact CG-CE2 3.85Å; L819-F823 VanDerWaalsContact O-CD2 3.23Å; L819-F823 WeakPolarHBondContact O-CD2 3.18Å; L819-F823 PolarHBondContact O-N 2.9Å; L819-A855 HydrophobicContact CD1-CB 4.39Å; L819-A855 HydrophobicContact CD2-CB 4.44Å; L819-I859 HydrophobicContact CD2-CD1 4Å; L819-I859 HydrophobicContact CD2-CG1 4.4Å; L819-F884 HydrophobicContact CD2-CD2 3.8Å; L819-F884 HydrophobicContact CD2-CE2 3.39Å; L819-F884 HydrophobicContact CD2-CZ 3.84Å; L819-F884 HydrophobicContact CG-CD2 4.39Å; L819-F884 HydrophobicContact CG-CE2 3.8Å; L819-F884 HydrophobicContact CG-CZ 4.48Å
820	L	84.7	Confident	82	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-36.2	177.5	-72	166.2	0	0	0	112.7	V816 D817 A818 E822 F823 E824 F884 K887	V816-L820 HydrophobicContact CG1-CD1 3.95Å; V816-L820 WeakPolarHBondContact O-CB 3.21Å; V816-L820 WeakPolarHBondContact O-CD1 3.49Å; V816-L820 WeakPolarHBondContact O-CG 3.19Å; V816-L820 PolarHBondContact O-N 2.55Å; D817-L820 PolarHBondContact O-N 3.26Å; A818-L820 PolarHBondContact O-N 3.11Å; L820-E822 VanDerWaalsContact C-N 3.33Å; L820-F823 WeakPolarHBondContact O-CB 3.34Å; L820-F823 PolarHBondContact O-N 3.15Å; L820-E824 PolarHBondContact O-N 2.9Å; L820-F884 HydrophobicContact CD2-CD2 3.87Å; L820-F884 HydrophobicContact CD2-CE2 4.12Å; L820-F884 HydrophobicContact CG-CD2 4.11Å; L820-K887 HydrophobicContact CD1-CB 3.73Å; L820-K887 HydrophobicContact CD1-CD 3.3Å; L820-K887 HydrophobicContact CD1-CG 4.15Å; L820-K887 HydrophobicContact CD2-CB 3.78Å; L820-K887 HydrophobicContact CG-CB 4.42Å
821	K	85.8	Confident	82.6	Confident	137 Å²	137	54.8 Å²	54.8	60%	0.596	26%	0.259	S	S	*	.	H	α-helix	trans	-63.9	-39.7	174.1	-172.6	-177.2	177.1	-171	0	111.5	D817 A818 L819 E824 Q825	D817-K821 VanDerWaalsContact O-CB 3.32Å; D817-K821 WeakPolarHBondContact O-CB 3.27Å; D817-K821 PolarHBondContact O-N 2.93Å; A818-K821 WeakPolarHBondContact O-CB 3.39Å; A818-K821 PolarHBondContact O-N 3.27Å; L819-K821 VanDerWaalsContact C-N 3.33Å; L819-K821 PolarHBondContact O-N 2.87Å; K821-E824 PolarHBondContact O-N 2.98Å; K821-Q825 WeakPolarHBondContact O-CB 3.5Å; K821-Q825 PolarHBondContact O-N 3.41Å
822	E	83.6	Confident	82.9	Confident	41 Å²	41	53.4 Å²	53.4	19%	0.192	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-38.3	173.3	-67.5	-56.9	136.7	0	0	111.7	L789 M794 A818 L819 L820 Q825 F826	L789-E822 HydrophobicContact CD2-CB 3.52Å; M794-E822 HydrophobicContact CE-CG 4.42Å; A818-E822 WeakPolarHBondContact O-CG 3.19Å; A818-E822 PolarHBondContact O-N 2.92Å; L819-E822 PolarHBondContact O-N 2.92Å; L820-E822 VanDerWaalsContact C-N 3.33Å; E822-Q825 PolarHBondContact O-N 3.36Å; E822-F826 WeakPolarHBondContact O-CB 3.42Å; E822-F826 PolarHBondContact O-N 3.43Å
823	F	84.8	Confident	82.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-38.8	171.9	-84.5	-72.5	0	0	0	113.4	L789 L819 L820 F826 N827 W848 C851 I852 A855 F884 L888 L891	L789-F823 HydrophobicContact CD1-CD1 4.44Å; L789-F823 HydrophobicContact CD1-CE1 3.94Å; L789-F823 HydrophobicContact CD1-CE2 4.28Å; L789-F823 HydrophobicContact CD1-CZ 3.84Å; L819-F823 HydrophobicContact CD1-CD2 4.24Å; L819-F823 HydrophobicContact CD1-CE2 3.84Å; L819-F823 HydrophobicContact CD2-CE2 4.4Å; L819-F823 HydrophobicContact CG-CD2 4.05Å; L819-F823 HydrophobicContact CG-CE2 3.85Å; L819-F823 VanDerWaalsContact O-CD2 3.23Å; L819-F823 WeakPolarHBondContact O-CD2 3.18Å; L819-F823 PolarHBondContact O-N 2.9Å; L820-F823 WeakPolarHBondContact O-CB 3.34Å; L820-F823 PolarHBondContact O-N 3.15Å; F823-F826 PolarHBondContact O-N 3.02Å; F823-N827 WeakPolarHBondContact O-CB 3.42Å; F823-N827 PolarHBondContact O-N 3.27Å; F823-W848 HydrophobicContact CD1-CE3 4.37Å; F823-W848 HydrophobicContact CD1-CH2 4.47Å; F823-W848 AromaticContact CD1-CZ3 3.63Å; F823-W848 HydrophobicContact CD1-CZ3 3.63Å; F823-W848 HydrophobicContact CE1-CZ3 4.2Å; F823-C851 HydrophobicContact CE1-CB 3.87Å; F823-I852 HydrophobicContact CE1-CG1 4.42Å; F823-A855 HydrophobicContact CE2-CB 3.82Å; F823-A855 HydrophobicContact CZ-CB 3.64Å; F823-F884 AromaticContact CD2-CE2 4Å; F823-F884 HydrophobicContact CD2-CE2 4Å; F823-F884 HydrophobicContact CD2-CZ 4.38Å; F823-F884 AromaticContact CE2-CE2 3.71Å; F823-F884 HydrophobicContact CE2-CE2 3.71Å; F823-F884 AromaticContact CE2-CZ 3.68Å; F823-F884 HydrophobicContact CE2-CZ 3.68Å; F823-F884 HydrophobicContact CZ-CZ 4.26Å; F823-L888 HydrophobicContact CD1-CD1 4.18Å; F823-L888 HydrophobicContact CD2-CD1 4.4Å; F823-L888 HydrophobicContact CE1-CD1 4.22Å; F823-L888 HydrophobicContact CE2-CD1 4.49Å; F823-L888 HydrophobicContact CG-CD1 4.26Å; F823-L888 HydrophobicContact CZ-CD1 4.38Å; F823-L891 HydrophobicContact CB-CD1 4.26Å
824	E	85.3	Confident	82.4	Confident	83 Å²	83	52.5 Å²	52.5	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-41.4	172.9	-75.1	-176.5	-168	0	0	111.6	L820 K821 N827 R828 L891	L820-E824 PolarHBondContact O-N 2.9Å; K821-E824 PolarHBondContact O-N 2.98Å; E824-N827 PolarHBondContact O-N 2.96Å; E824-R828 WeakPolarHBondContact O-CG 3.28Å; E824-R828 PolarHBondContact O-N 3.07Å; E824-R828 IonicContact OE2-NH2 2.81Å; E824-L891 HydrophobicContact CG-CD1 4.09Å; E824-L891 HydrophobicContact CG-CD2 4.17Å
825	Q	83.8	Confident	81.9	Confident	68 Å²	68	53.4 Å²	53.4	32%	0.318	25%	0.252	S	S	.	.	H	α-helix	trans	-66.6	-40.4	177	-176.6	163.7	-11.1	0	0	111.4	K821 E822 R828 R829	K821-Q825 WeakPolarHBondContact O-CB 3.5Å; K821-Q825 PolarHBondContact O-N 3.41Å; E822-Q825 PolarHBondContact O-N 3.36Å; Q825-R828 PolarHBondContact O-N 3.35Å; Q825-R829 WeakPolarHBondContact O-CB 3.3Å; Q825-R829 WeakPolarHBondContact O-CG 3.37Å; Q825-R829 PolarHBondContact O-N 2.88Å
826	F	84	Confident	81.1	Confident	3 Å²	3	61.8 Å²	61.8	1%	0.013	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-48.5	170.4	174.4	-103.4	0	0	0	111.2	L723 A788 E822 F823 R828 R829 L830 L847 W848	L723-F826 HydrophobicContact CD1-CE2 4.42Å; L723-F826 HydrophobicContact CD2-CD2 4Å; L723-F826 HydrophobicContact CD2-CE2 4.25Å; A788-F826 HydrophobicContact CB-CD2 3.89Å; A788-F826 HydrophobicContact CB-CE2 4.04Å; E822-F826 WeakPolarHBondContact O-CB 3.42Å; E822-F826 PolarHBondContact O-N 3.43Å; F823-F826 PolarHBondContact O-N 3.02Å; F826-R828 VanDerWaalsContact C-N 3.33Å; F826-R828 PolarHBondContact O-N 3.32Å; F826-R829 PolarHBondContact O-N 3.48Å; F826-L830 HydrophobicContact CE1-CD2 4.26Å; F826-L830 VanDerWaalsContact O-CB 3.31Å; F826-L830 WeakPolarHBondContact O-CB 3.28Å; F826-L830 PolarHBondContact O-N 3.42Å; F826-L847 HydrophobicContact CZ-CB 4.45Å; F826-W848 HydrophobicContact CD1-CH2 4.12Å; F826-W848 HydrophobicContact CD1-CZ2 4.19Å; F826-W848 HydrophobicContact CD1-CZ3 4.32Å; F826-W848 HydrophobicContact CE1-CD2 4.21Å; F826-W848 HydrophobicContact CE1-CE3 4.41Å; F826-W848 HydrophobicContact CE1-CZ2 4.29Å
827	N	84.6	Confident	80.3	Confident	44 Å²	44	62.3 Å²	62.3	24%	0.235	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-40.2	177.8	-168.9	20.8	0	0	0	112	F823 E824 L830 N831 W848	F823-N827 WeakPolarHBondContact O-CB 3.42Å; F823-N827 PolarHBondContact O-N 3.27Å; E824-N827 PolarHBondContact O-N 2.96Å; N827-L830 PolarHBondContact O-N 3.48Å; N827-N831 WeakPolarHBondContact O-CB 3.47Å; N827-N831 VanDerWaalsContact O-CG 3.3Å; N827-N831 PolarHBondContact O-N 3.27Å; N827-N831 PolarHBondContact O-ND2 3.07Å; N827-N831 PolarHBondContact OD1-ND2 3.28Å; N827-W848 HydrophobicContact CB-CH2 4.03Å; N827-W848 HydrophobicContact CB-CZ2 3.88Å
828	R	83.4	Confident	79.5	Confident	163 Å²	163	63.6 Å²	63.6	62%	0.615	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-47.3	174.7	-71.4	177.8	-163.5	-177	8.3	111.8	E824 Q825 F826 L830 N831 E832	E824-R828 WeakPolarHBondContact O-CG 3.28Å; E824-R828 PolarHBondContact O-N 3.07Å; E824-R828 IonicContact OE2-NH2 2.81Å; Q825-R828 PolarHBondContact O-N 3.35Å; F826-R828 VanDerWaalsContact C-N 3.33Å; F826-R828 PolarHBondContact O-N 3.32Å; R828-L830 VanDerWaalsContact C-N 3.34Å; R828-L830 PolarHBondContact O-N 3.26Å; R828-N831 CarbonylContact O-C 3.47Å; R828-N831 WeakPolarHBondContact O-CB 3.15Å; R828-N831 PolarHBondContact O-N 2.96Å; R828-E832 WeakPolarHBondContact O-CG 3.22Å; R828-E832 PolarHBondContact O-N 2.93Å
829	R	80.4	Confident	79	Confident	55 Å²	55	63.8 Å²	63.8	21%	0.208	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-40.3	176.9	-73.1	175	171.5	164.3	-5.2	111.9	L723 Q825 F826 N831 E832 V833	L723-R829 HydrophobicContact CD1-CB 3.83Å; L723-R829 HydrophobicContact CD2-CB 3.98Å; L723-R829 HydrophobicContact CG-CB 3.88Å; Q825-R829 WeakPolarHBondContact O-CB 3.3Å; Q825-R829 WeakPolarHBondContact O-CG 3.37Å; Q825-R829 PolarHBondContact O-N 2.88Å; F826-R829 PolarHBondContact O-N 3.48Å; R829-N831 VanDerWaalsContact C-N 3.3Å; R829-N831 PolarHBondContact O-N 3.48Å; R829-E832 WeakPolarHBondContact O-CB 3.37Å; R829-E832 PolarHBondContact O-N 3.37Å; R829-E832 VanDerWaalsContact O-N 3.09Å; R829-V833 WeakPolarHBondContact O-CG2 3.29Å; R829-V833 PolarHBondContact O-N 3.11Å
830	L	81.6	Confident	78.6	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-41.1	175.2	-172.6	67.2	0	0	0	111.1	L726 F826 N827 R828 E832 V833 S834 I839 L847	L726-L830 HydrophobicContact CD2-CD1 3.73Å; F826-L830 HydrophobicContact CE1-CD2 4.26Å; F826-L830 VanDerWaalsContact O-CB 3.31Å; F826-L830 WeakPolarHBondContact O-CB 3.28Å; F826-L830 PolarHBondContact O-N 3.42Å; N827-L830 PolarHBondContact O-N 3.48Å; R828-L830 VanDerWaalsContact C-N 3.34Å; R828-L830 PolarHBondContact O-N 3.26Å; L830-E832 VanDerWaalsContact C-N 3.31Å; L830-E832 PolarHBondContact O-N 3.47Å; L830-V833 PolarHBondContact O-N 3.03Å; L830-S834 WeakPolarHBondContact O-CB 3.16Å; L830-S834 PolarHBondContact O-N 3.37Å; L830-I839 HydrophobicContact CD1-CD1 3.5Å; L830-I839 HydrophobicContact CG-CD1 4.19Å; L830-L847 HydrophobicContact CD1-CD1 4.13Å
831	N	79.4	Confident	78	Confident	79 Å²	79	70.9 Å²	70.9	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-70.6	-22.1	174.3	-73.5	-47.5	0	0	0	114	N827 R828 R829 S834 K835	N827-N831 WeakPolarHBondContact O-CB 3.47Å; N827-N831 VanDerWaalsContact O-CG 3.3Å; N827-N831 PolarHBondContact O-N 3.27Å; N827-N831 PolarHBondContact O-ND2 3.07Å; N827-N831 PolarHBondContact OD1-ND2 3.28Å; R828-N831 CarbonylContact O-C 3.47Å; R828-N831 WeakPolarHBondContact O-CB 3.15Å; R828-N831 PolarHBondContact O-N 2.96Å; R829-N831 VanDerWaalsContact C-N 3.3Å; R829-N831 PolarHBondContact O-N 3.48Å; N831-S834 WeakPolarHBondContact CA-OG 3.35Å; N831-S834 PolarHBondContact O-OG 2.98Å; N831-K835 WeakPolarHBondContact O-CG 3.33Å
832	E	78.2	Confident	77.6	Confident	112 Å²	112	67.4 Å²	67.4	52%	0.523	31%	0.314	S	S	.	.	H	α-helix	trans	-78.9	-37.9	171.3	-72.8	175.9	176.6	0	0	111.7	R828 R829 L830 K835	R828-E832 WeakPolarHBondContact O-CG 3.22Å; R828-E832 PolarHBondContact O-N 2.93Å; R829-E832 WeakPolarHBondContact O-CB 3.37Å; R829-E832 PolarHBondContact O-N 3.37Å; R829-E832 VanDerWaalsContact O-N 3.09Å; L830-E832 VanDerWaalsContact C-N 3.31Å; L830-E832 PolarHBondContact O-N 3.47Å; E832-K835 PolarHBondContact O-N 2.92Å
833	V	75.6	Confident	77.3	Confident	12 Å²	12	65.5 Å²	65.5	7%	0.073	31%	0.305	C	S	.	.	H	α-helix	trans	-68.3	-37.1	173.1	176.6	0	0	0	0	110.9	L723 L726 A727 R829 L830 K835 R836 V837 I839	L723-V833 HydrophobicContact CD1-CG2 4.09Å; L726-V833 HydrophobicContact CB-CG1 4.46Å; L726-V833 HydrophobicContact CD2-CG1 4.23Å; L726-V833 HydrophobicContact CG-CG1 4.31Å; A727-V833 HydrophobicContact CB-CG1 4.21Å; R829-V833 WeakPolarHBondContact O-CG2 3.29Å; R829-V833 PolarHBondContact O-N 3.11Å; L830-V833 PolarHBondContact O-N 3.03Å; V833-K835 PolarHBondContact O-N 3.25Å; V833-K835 VanDerWaalsContact O-N 3.15Å; V833-R836 PolarHBondContact O-N 2.96Å; V833-V837 PolarHBondContact O-N 3.42Å; V833-I839 HydrophobicContact CB-CD1 4.49Å; V833-I839 HydrophobicContact CG1-CD1 4.18Å
834	S	70.9	Confident	77.1	Confident	44 Å²	44	66.9 Å²	66.9	31%	0.308	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.1	177.4	75.9	0	0	0	0	113.7	L830 N831 V837	L830-S834 WeakPolarHBondContact O-CB 3.16Å; L830-S834 PolarHBondContact O-N 3.37Å; N831-S834 WeakPolarHBondContact CA-OG 3.35Å; N831-S834 PolarHBondContact O-OG 2.98Å; S834-V837 CarbonylContact C-O 3.59Å; S834-V837 VanDerWaalsContact CA-O 3.26Å; S834-V837 WeakPolarHBondContact CA-O 3.46Å
835	K	71.8	Confident	76.9	Confident	156 Å²	156	66.5 Å²	66.5	68%	0.678	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-23.2	172.5	-67.3	172.5	-175	176.1	0	113.3	N831 E832 V833	N831-K835 WeakPolarHBondContact O-CG 3.33Å; E832-K835 PolarHBondContact O-N 2.92Å; V833-K835 PolarHBondContact O-N 3.25Å; V833-K835 VanDerWaalsContact O-N 3.15Å
836	R	67.7	Low	76.8	Confident	184 Å²	184	64.5 Å²	64.5	69%	0.694	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-40.7	179.2	-62.2	-174.4	-175.2	-174.8	3.8	111.8	V833	V833-R836 PolarHBondContact O-N 2.96Å
837	V	67.1	Low	76.7	Confident	12 Å²	12	64.3 Å²	64.3	7%	0.073	31%	0.306	C	S	.	.	S	Bend	trans	-135.6	132.1	179	174.5	0	0	0	0	108.3	L471 A727 V730 V731 V833 S834 I839	L471-V837 HydrophobicContact CD1-CB 4.38Å; L471-V837 HydrophobicContact CD1-CG1 4.27Å; L471-V837 HydrophobicContact CD1-CG2 4.07Å; A727-V837 HydrophobicContact CB-CB 4.42Å; A727-V837 HydrophobicContact CB-CG2 3.73Å; V730-V837 HydrophobicContact CB-CG1 4.49Å; V730-V837 HydrophobicContact CG1-CG1 4.09Å; V731-V837 HydrophobicContact CG2-CG1 3.79Å; V731-V837 HydrophobicContact CG2-CG2 4.03Å; V833-V837 PolarHBondContact O-N 3.42Å; S834-V837 CarbonylContact C-O 3.59Å; S834-V837 VanDerWaalsContact CA-O 3.26Å; S834-V837 WeakPolarHBondContact CA-O 3.46Å; V837-I839 PolarHBondContact O-N 3.12Å
838	R	68.4	Low	76.7	Confident	96 Å²	96	62.9 Å²	62.9	36%	0.362	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-65.8	119.8	173.7	-177.2	178	178.1	-174.3	-6	109.5	K601 V602 I606 P840	K601-R838 PolarHBondContact O-NH1 3.2Å; V602-R838 VanDerWaalsContact O-CZ 3.25Å; V602-R838 PolarHBondContact O-NH1 3.41Å; V602-R838 PolarHBondContact O-NH2 3.02Å; I606-R838 VanDerWaalsContact CD1-O 3.28Å; I606-R838 WeakPolarHBondContact CD1-O 3.41Å; R838-P840 WeakPolarHBondContact O-CD 3.48Å
839	I	72.6	Confident	76.7	Confident	27 Å²	27	57.9 Å²	57.9	14%	0.138	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-92.9	117.5	177	-55.3	176.4	0	0	0	108.5	L726 L830 V833 V837 V843	L726-I839 HydrophobicContact CD2-CD1 4.48Å; L830-I839 HydrophobicContact CD1-CD1 3.5Å; L830-I839 HydrophobicContact CG-CD1 4.19Å; V833-I839 HydrophobicContact CB-CD1 4.49Å; V833-I839 HydrophobicContact CG1-CD1 4.18Å; V837-I839 PolarHBondContact O-N 3.12Å; I839-V843 HydrophobicContact CG2-CB 3.93Å; I839-V843 HydrophobicContact CG2-CG1 3.77Å
840	P	76.1	Confident	76.8	Confident	26 Å²	26	55.3 Å²	55.3	17%	0.169	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.5	147.6	174.5	-24.6	36	0	0	0	112.2	I606 E734 R838 P842 V843 S844	I606-P840 HydrophobicContact CD1-CG 3.92Å; E734-P840 HydrophobicContact CG-CG 3.9Å; R838-P840 WeakPolarHBondContact O-CD 3.48Å; P840-P842 VanDerWaalsContact C-CD 3.46Å; P840-P842 VanDerWaalsContact C-N 3.33Å; P840-V843 HydrophobicContact CB-CG2 4.19Å; P840-V843 HydrophobicContact CG-CG2 4.22Å; P840-V843 WeakPolarHBondContact O-CB 3.42Å; P840-V843 PolarHBondContact O-N 3.31Å; P840-S844 PolarHBondContact O-N 3.21Å
841	L	74	Confident	76.9	Confident	139 Å²	139	55 Å²	55	73%	0.728	27%	0.269	S	S	*	.	H	α-helix	trans	-51.3	-43.5	175.1	-81.3	143.7	0	0	0	113.2	V843 S844 N845	L841-V843 VanDerWaalsContact C-N 3.28Å; L841-V843 PolarHBondContact O-N 3.14Å; L841-S844 PolarHBondContact O-N 3Å; L841-N845 WeakPolarHBondContact O-CB 3.47Å; L841-N845 PolarHBondContact O-N 2.81Å; L841-N845 PolarHBondContact O-ND2 3.13Å; L841-N845 PolarHBondContact O-OD1 3.33Å
842	P	75.4	Confident	77.1	Confident	64 Å²	64	51.2 Å²	51.2	42%	0.416	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-38	175.2	-26	35.3	0	0	0	113.5	P840 N845 I846	P840-P842 VanDerWaalsContact C-CD 3.46Å; P840-P842 VanDerWaalsContact C-N 3.33Å; P842-N845 PolarHBondContact O-N 2.97Å; P842-I846 WeakPolarHBondContact O-CD1 3.47Å; P842-I846 WeakPolarHBondContact O-CG1 3.14Å; P842-I846 PolarHBondContact O-N 2.96Å
843	V	79	Confident	77.3	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.8	-45.3	179.7	174.5	0	0	0	0	111.1	V730 E734 Y781 I839 P840 L841 N845 I846 L847	V730-V843 HydrophobicContact CG2-CG1 4.01Å; E734-V843 HydrophobicContact CG-CG2 4.31Å; E734-V843 WeakPolarHBondContact OE1-CG2 3.17Å; Y781-V843 HydrophobicContact CD1-CG1 4.4Å; Y781-V843 HydrophobicContact CD2-CG1 4.18Å; Y781-V843 HydrophobicContact CE1-CG1 3.81Å; Y781-V843 HydrophobicContact CE2-CB 4.16Å; Y781-V843 HydrophobicContact CE2-CG1 3.57Å; Y781-V843 HydrophobicContact CE2-CG2 3.86Å; Y781-V843 WeakPolarHBondContact OH-CG1 3.5Å; Y781-V843 WeakPolarHBondContact OH-CG2 3.3Å; I839-V843 HydrophobicContact CG2-CB 3.93Å; I839-V843 HydrophobicContact CG2-CG1 3.77Å; P840-V843 HydrophobicContact CB-CG2 4.19Å; P840-V843 HydrophobicContact CG-CG2 4.22Å; P840-V843 WeakPolarHBondContact O-CB 3.42Å; P840-V843 PolarHBondContact O-N 3.31Å; L841-V843 VanDerWaalsContact C-N 3.28Å; L841-V843 PolarHBondContact O-N 3.14Å; V843-N845 VanDerWaalsContact C-N 3.28Å; V843-N845 PolarHBondContact O-N 3.4Å; V843-I846 PolarHBondContact O-N 3.11Å; V843-L847 HydrophobicContact CG1-CD1 3.91Å; V843-L847 HydrophobicContact CG1-CG 4.47Å; V843-L847 WeakPolarHBondContact O-CB 3.49Å; V843-L847 WeakPolarHBondContact O-CG 3.38Å; V843-L847 PolarHBondContact O-N 3.48Å
844	S	79.8	Confident	77.5	Confident	30 Å²	30	48.4 Å²	48.4	21%	0.21	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-45.1	174.2	-177	0	0	0	0	110.8	P840 L841 I846 L847 W848	P840-S844 PolarHBondContact O-N 3.21Å; L841-S844 PolarHBondContact O-N 3Å; S844-I846 PolarHBondContact O-N 3.42Å; S844-L847 PolarHBondContact O-N 2.88Å; S844-W848 WeakPolarHBondContact O-CB 3.38Å; S844-W848 PolarHBondContact O-N 2.91Å
845	N	81.7	Confident	78.1	Confident	75 Å²	75	46.4 Å²	46.4	40%	0.401	22%	0.22	S	C	.	.	H	α-helix	trans	-62.3	-43.1	178.8	-70.3	-11	0	0	0	112.3	L841 P842 V843 E849 I894	L841-N845 WeakPolarHBondContact O-CB 3.47Å; L841-N845 PolarHBondContact O-N 2.81Å; L841-N845 PolarHBondContact O-ND2 3.13Å; L841-N845 PolarHBondContact O-OD1 3.33Å; P842-N845 PolarHBondContact O-N 2.97Å; V843-N845 VanDerWaalsContact C-N 3.28Å; V843-N845 PolarHBondContact O-N 3.4Å; N845-E849 VanDerWaalsContact O-CB 3.3Å; N845-E849 WeakPolarHBondContact O-CB 3.09Å; N845-E849 PolarHBondContact O-N 3.33Å; N845-I894 HydrophobicContact CB-CD1 4.38Å; N845-I894 WeakPolarHBondContact O-CD1 3.48Å
846	I	81.3	Confident	78.8	Confident	25 Å²	25	39 Å²	39	13%	0.128	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-42.7	178	-69.4	165.2	0	0	0	111.2	R777 Y781 P842 V843 S844 E849 H850	R777-I846 HydrophobicContact CB-CD1 3.9Å; Y781-I846 HydrophobicContact CD2-CG2 4.01Å; P842-I846 WeakPolarHBondContact O-CD1 3.47Å; P842-I846 WeakPolarHBondContact O-CG1 3.14Å; P842-I846 PolarHBondContact O-N 2.96Å; V843-I846 PolarHBondContact O-N 3.11Å; S844-I846 PolarHBondContact O-N 3.42Å; I846-E849 PolarHBondContact O-N 3.45Å; I846-H850 VanDerWaalsContact CG2-CD2 3.46Å; I846-H850 WeakPolarHBondContact CG2-CD2 3.32Å; I846-H850 WeakPolarHBondContact CG2-NE2 3.39Å; I846-H850 WeakPolarHBondContact O-CB 3.43Å; I846-H850 PolarHBondContact O-CD2 3.48Å; I846-H850 VanDerWaalsContact O-CD2 3.3Å; I846-H850 VanDerWaalsContact O-CG 3.26Å; I846-H850 PolarHBondContact O-N 2.92Å
847	L	82.3	Confident	79.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-48	177.4	-77.8	164.9	0	0	0	111.5	L726 Y781 V784 F826 L830 V843 S844 H850 C851	L726-L847 HydrophobicContact CD1-CD1 3.94Å; L726-L847 HydrophobicContact CD1-CD2 4.18Å; L726-L847 HydrophobicContact CD2-CD1 4.15Å; Y781-L847 HydrophobicContact CD1-CD2 4.07Å; Y781-L847 HydrophobicContact CD1-CG 4.38Å; Y781-L847 HydrophobicContact CG-CD2 4.07Å; Y781-L847 HydrophobicContact CG-CG 4.24Å; V784-L847 HydrophobicContact CB-CD2 4.3Å; V784-L847 HydrophobicContact CG1-CD2 4.38Å; F826-L847 HydrophobicContact CZ-CB 4.45Å; L830-L847 HydrophobicContact CD1-CD1 4.13Å; V843-L847 HydrophobicContact CG1-CD1 3.91Å; V843-L847 HydrophobicContact CG1-CG 4.47Å; V843-L847 WeakPolarHBondContact O-CB 3.49Å; V843-L847 WeakPolarHBondContact O-CG 3.38Å; V843-L847 PolarHBondContact O-N 3.48Å; S844-L847 PolarHBondContact O-N 2.88Å; L847-H850 PolarHBondContact O-N 2.94Å; L847-C851 PolarHBondContact O-N 3.38Å; L847-C851 PolarHBondContact O-SG 3.36Å
848	W	84.6	Confident	80.2	Confident	13 Å²	13	33 Å²	33	5%	0.049	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-42.5	176.1	-82.9	112	0	0	0	112	F823 F826 N827 S844 H850 C851 I852 L891 T892 I894	F823-W848 HydrophobicContact CD1-CE3 4.37Å; F823-W848 HydrophobicContact CD1-CH2 4.47Å; F823-W848 AromaticContact CD1-CZ3 3.63Å; F823-W848 HydrophobicContact CD1-CZ3 3.63Å; F823-W848 HydrophobicContact CE1-CZ3 4.2Å; F826-W848 HydrophobicContact CD1-CH2 4.12Å; F826-W848 HydrophobicContact CD1-CZ2 4.19Å; F826-W848 HydrophobicContact CD1-CZ3 4.32Å; F826-W848 HydrophobicContact CE1-CD2 4.21Å; F826-W848 HydrophobicContact CE1-CE3 4.41Å; F826-W848 HydrophobicContact CE1-CZ2 4.29Å; N827-W848 HydrophobicContact CB-CH2 4.03Å; N827-W848 HydrophobicContact CB-CZ2 3.88Å; S844-W848 WeakPolarHBondContact O-CB 3.38Å; S844-W848 PolarHBondContact O-N 2.91Å; W848-H850 VanDerWaalsContact C-N 3.3Å; W848-H850 PolarHBondContact O-N 3.07Å; W848-C851 PolarHBondContact O-N 3.33Å; W848-I852 WeakPolarHBondContact O-CB 3.35Å; W848-I852 WeakPolarHBondContact O-CD1 3.4Å; W848-I852 WeakPolarHBondContact O-CG1 3.44Å; W848-I852 PolarHBondContact O-N 2.95Å; W848-L891 HydrophobicContact CH2-CB 4.43Å; W848-T892 HydrophobicContact CD2-CG2 3.55Å; W848-T892 HydrophobicContact CE3-CG2 3.16Å; W848-T892 HydrophobicContact CG-CG2 4.25Å; W848-T892 HydrophobicContact CH2-CG2 3.86Å; W848-T892 HydrophobicContact CZ2-CG2 4.21Å; W848-T892 HydrophobicContact CZ3-CG2 3.31Å; W848-I894 HydrophobicContact CB-CD1 3.41Å; W848-I894 VanDerWaalsContact CB-CD1 3.41Å; W848-I894 HydrophobicContact CG-CD1 4.44Å
849	E	83.6	Confident	81	Confident	58 Å²	58	28.7 Å²	28.7	27%	0.271	15%	0.149	S	C	.	.	H	α-helix	trans	-56.2	-46.2	174.2	172.1	178.7	175.4	0	0	111.3	N845 I846 R853 P898	N845-E849 VanDerWaalsContact O-CB 3.3Å; N845-E849 WeakPolarHBondContact O-CB 3.09Å; N845-E849 PolarHBondContact O-N 3.33Å; I846-E849 PolarHBondContact O-N 3.45Å; E849-R853 VanDerWaalsContact O-CB 3.22Å; E849-R853 WeakPolarHBondContact O-CB 3.4Å; E849-R853 PolarHBondContact O-N 3.11Å; E849-R853 IonicContact OE1-CZ 3.75Å; E849-R853 IonicContact OE1-NH1 3.61Å; E849-R853 PolarHBondContact OE1-NH1 3.31Å; E849-R853 VanDerWaalsContact OE1-NH1 3.12Å; E849-R853 IonicContact OE1-NH2 3.9Å; E849-R853 PolarHBondContact OE1-NH2 3.25Å; E849-P898 HydrophobicContact CB-CG 4.09Å; E849-P898 HydrophobicContact CG-CB 4.08Å; E849-P898 HydrophobicContact CG-CG 3.68Å
850	H	81.6	Confident	81.6	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.009	14%	0.143	C	C	.	.	H	α-helix	trans	-68.2	-43	-179.6	-70.4	-29	0	0	0	112.9	K778 W782 A785 I846 L847 W848 I852 R853 L854	K778-H850 PolarHBondContact O-NE2 2.99Å; W782-H850 HydrophobicContact CE3-CB 3.78Å; W782-H850 AromaticContact CE3-CG 3.61Å; W782-H850 AromaticContact CE3-ND1 3.48Å; W782-H850 HydrophobicContact CZ3-CB 4.22Å; W782-H850 AromaticContact CZ3-ND1 3.88Å; A785-H850 HydrophobicContact CB-CB 3.7Å; I846-H850 VanDerWaalsContact CG2-CD2 3.46Å; I846-H850 WeakPolarHBondContact CG2-CD2 3.32Å; I846-H850 WeakPolarHBondContact CG2-NE2 3.39Å; I846-H850 WeakPolarHBondContact O-CB 3.43Å; I846-H850 PolarHBondContact O-CD2 3.48Å; I846-H850 VanDerWaalsContact O-CD2 3.3Å; I846-H850 VanDerWaalsContact O-CG 3.26Å; I846-H850 PolarHBondContact O-N 2.92Å; L847-H850 PolarHBondContact O-N 2.94Å; W848-H850 VanDerWaalsContact C-N 3.3Å; W848-H850 PolarHBondContact O-N 3.07Å; H850-I852 VanDerWaalsContact C-N 3.35Å; H850-I852 PolarHBondContact O-N 3Å; H850-R853 PolarHBondContact O-N 3.27Å; H850-L854 WeakPolarHBondContact O-CB 3.19Å; H850-L854 WeakPolarHBondContact O-CG 3.39Å; H850-L854 PolarHBondContact O-N 2.92Å
851	C	84.1	Confident	81.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.4	-42.5	177	-65.6	0	0	0	0	111.6	A785 L789 Y791 F823 L847 W848 A855	A785-C851 VanDerWaalsContact CB-SG 3.56Å; L789-C851 HydrophobicContact CD1-CB 4.12Å; Y791-C851 PolarHBondContact OH-O 3.39Å; F823-C851 HydrophobicContact CE1-CB 3.87Å; L847-C851 PolarHBondContact O-N 3.38Å; L847-C851 PolarHBondContact O-SG 3.36Å; W848-C851 PolarHBondContact O-N 3.33Å; C851-A855 WeakPolarHBondContact O-CB 3.37Å; C851-A855 PolarHBondContact O-N 3.15Å
852	I	84.1	Confident	82.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.7	-46.7	178	-66.6	170.6	0	0	0	110.8	F823 W848 H850 L854 A855 N856 L888 T892 I897	F823-I852 HydrophobicContact CE1-CG1 4.42Å; W848-I852 WeakPolarHBondContact O-CB 3.35Å; W848-I852 WeakPolarHBondContact O-CD1 3.4Å; W848-I852 WeakPolarHBondContact O-CG1 3.44Å; W848-I852 PolarHBondContact O-N 2.95Å; H850-I852 VanDerWaalsContact C-N 3.35Å; H850-I852 PolarHBondContact O-N 3Å; I852-L854 VanDerWaalsContact C-N 3.32Å; I852-L854 PolarHBondContact O-N 3.02Å; I852-A855 PolarHBondContact O-N 3.23Å; I852-N856 WeakPolarHBondContact O-CB 3.49Å; I852-N856 PolarHBondContact O-N 3.48Å; I852-L888 HydrophobicContact CD1-CD2 4.1Å; I852-L888 HydrophobicContact CD1-CG 4.5Å; I852-L888 HydrophobicContact CG1-CD1 4.3Å; I852-L888 HydrophobicContact CG1-CD2 3.97Å; I852-L888 HydrophobicContact CG2-CD2 4.14Å; I852-T892 HydrophobicContact CD1-CG2 4.29Å; I852-I897 HydrophobicContact CG2-CG2 3.73Å
853	R	81.6	Confident	82.7	Confident	44 Å²	44	20.9 Å²	20.9	17%	0.166	10%	0.101	C	C	.	.	H	α-helix	trans	-57.8	-46	177.8	172.3	165.9	-60.9	133.1	8.6	111.4	W782 E849 H850 R857 D899	W782-R853 HydrophobicContact CH2-CG 4.35Å; W782-R853 HydrophobicContact CZ3-CG 4.24Å; E849-R853 VanDerWaalsContact O-CB 3.22Å; E849-R853 WeakPolarHBondContact O-CB 3.4Å; E849-R853 PolarHBondContact O-N 3.11Å; E849-R853 IonicContact OE1-CZ 3.75Å; E849-R853 IonicContact OE1-NH1 3.61Å; E849-R853 PolarHBondContact OE1-NH1 3.31Å; E849-R853 VanDerWaalsContact OE1-NH1 3.12Å; E849-R853 IonicContact OE1-NH2 3.9Å; E849-R853 PolarHBondContact OE1-NH2 3.25Å; H850-R853 PolarHBondContact O-N 3.27Å; R853-R857 WeakPolarHBondContact O-CG 3.47Å; R853-R857 PolarHBondContact O-N 2.87Å; R853-R857 VanDerWaalsContact O-N 3.12Å; R853-D899 WeakPolarHBondContact CD-OD2 3.44Å; R853-D899 WeakPolarHBondContact CG-OD2 3.4Å; R853-D899 IonicContact CZ-OD1 3.02Å; R853-D899 IonicContact NE-OD1 3.92Å; R853-D899 PolarHBondContact NE-OD1 3.46Å; R853-D899 IonicContact NE-OD2 2.65Å; R853-D899 PolarHBondContact NE-OD2 3.26Å; R853-D899 VanDerWaalsContact NE-OD2 3.11Å; R853-D899 IonicContact NH2-OD1 2.72Å
854	L	80.7	Confident	82.7	Confident	22 Å²	22	21 Å²	21	12%	0.115	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-47.1	176.5	-78.4	165.4	0	0	0	111.7	W782 A785 Y791 H850 I852 N856 R857 T858	W782-L854 HydrophobicContact CE3-CD1 4.37Å; W782-L854 HydrophobicContact CE3-CG 4.44Å; W782-L854 HydrophobicContact CH2-CD1 4.15Å; W782-L854 HydrophobicContact CH2-CD2 3.38Å; W782-L854 HydrophobicContact CH2-CG 3.44Å; W782-L854 VanDerWaalsContact CH2-CG 3.44Å; W782-L854 HydrophobicContact CZ2-CD1 4.31Å; W782-L854 HydrophobicContact CZ2-CD2 3.35Å; W782-L854 HydrophobicContact CZ2-CG 3.85Å; W782-L854 HydrophobicContact CZ3-CD1 4.18Å; W782-L854 HydrophobicContact CZ3-CD2 4.22Å; W782-L854 HydrophobicContact CZ3-CG 3.78Å; A785-L854 HydrophobicContact CB-CD1 3.85Å; Y791-L854 HydrophobicContact CE1-CB 3.96Å; Y791-L854 HydrophobicContact CE2-CB 4.09Å; Y791-L854 HydrophobicContact CE2-CD1 4.16Å; Y791-L854 VanDerWaalsContact CZ-CB 3.46Å; Y791-L854 WeakPolarHBondContact OH-CB 3.28Å; H850-L854 WeakPolarHBondContact O-CB 3.19Å; H850-L854 WeakPolarHBondContact O-CG 3.39Å; H850-L854 PolarHBondContact O-N 2.92Å; I852-L854 VanDerWaalsContact C-N 3.32Å; I852-L854 PolarHBondContact O-N 3.02Å; L854-N856 PolarHBondContact O-N 3.45Å; L854-R857 PolarHBondContact O-N 3.28Å; L854-R857 VanDerWaalsContact O-N 3.15Å; L854-T858 PolarHBondContact O-N 2.91Å; L854-T858 PolarHBondContact O-OG1 3.23Å
855	A	83.8	Confident	82.8	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-59.4	-45	177.7	0	0	0	0	0	112.6	Y791 L819 F823 C851 I852 R857 T858 I859 F884	Y791-A855 HydrophobicContact CE1-CB 4.32Å; L819-A855 HydrophobicContact CD1-CB 4.39Å; L819-A855 HydrophobicContact CD2-CB 4.44Å; F823-A855 HydrophobicContact CE2-CB 3.82Å; F823-A855 HydrophobicContact CZ-CB 3.64Å; C851-A855 WeakPolarHBondContact O-CB 3.37Å; C851-A855 PolarHBondContact O-N 3.15Å; I852-A855 PolarHBondContact O-N 3.23Å; A855-R857 VanDerWaalsContact C-N 3.28Å; A855-R857 PolarHBondContact O-N 2.94Å; A855-T858 PolarHBondContact O-N 3.39Å; A855-I859 VanDerWaalsContact O-CG1 3.28Å; A855-I859 WeakPolarHBondContact O-CG1 3.31Å; A855-I859 PolarHBondContact O-N 2.89Å; A855-F884 HydrophobicContact CB-CZ 4.24Å
856	N	85.1	Confident	82.6	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-36.9	176.7	-76.9	-18	0	0	0	112	I852 L854 V860 P898 D899 V903	I852-N856 WeakPolarHBondContact O-CB 3.49Å; I852-N856 PolarHBondContact O-N 3.48Å; L854-N856 PolarHBondContact O-N 3.45Å; N856-V860 WeakPolarHBondContact O-CG2 2.9Å; N856-V860 PolarHBondContact O-N 2.86Å; N856-V860 VanDerWaalsContact O-N 3.13Å; N856-P898 PolarHBondContact ND2-O 3.15Å; N856-D899 HydrophobicContact CB-CB 4.47Å; N856-V903 HydrophobicContact CB-CG2 3.65Å
857	R	81.9	Confident	82.1	Confident	58 Å²	58	29 Å²	29	22%	0.219	13%	0.134	C	C	.	.	H	α-helix	trans	-70.8	-41.8	173.8	-71.5	-149.8	-179.2	96.8	2.7	113.5	R853 L854 A855 I859 V860 E861 D899 F902	R853-R857 WeakPolarHBondContact O-CG 3.47Å; R853-R857 PolarHBondContact O-N 2.87Å; R853-R857 VanDerWaalsContact O-N 3.12Å; L854-R857 PolarHBondContact O-N 3.28Å; L854-R857 VanDerWaalsContact O-N 3.15Å; A855-R857 VanDerWaalsContact C-N 3.28Å; A855-R857 PolarHBondContact O-N 2.94Å; R857-I859 PolarHBondContact O-N 3.36Å; R857-V860 PolarHBondContact O-N 3.13Å; R857-V860 VanDerWaalsContact O-N 3.17Å; R857-E861 WeakPolarHBondContact O-CB 3.17Å; R857-E861 PolarHBondContact O-N 2.89Å; R857-D899 IonicContact CZ-OD2 2.88Å; R857-D899 IonicContact NH2-OD2 2.78Å; R857-F902 HydrophobicContact CG-CE1 4.01Å
858	T	82.9	Confident	81.5	Confident	13 Å²	13	36.5 Å²	36.5	8%	0.08	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-37.8	174.9	-53.9	0	0	0	0	111	Y791 M794 L795 L854 A855 E861 G862	Y791-T858 HydrophobicContact CD1-CG2 4.09Å; Y791-T858 WeakPolarHBondContact CD1-OG1 3.23Å; M794-T858 HydrophobicContact CB-CG2 4.37Å; L795-T858 HydrophobicContact CD1-CG2 4.43Å; L795-T858 HydrophobicContact CD2-CG2 3.78Å; L795-T858 WeakPolarHBondContact CD2-O 3.31Å; L795-T858 HydrophobicContact CG-CG2 3.74Å; L854-T858 PolarHBondContact O-N 2.91Å; L854-T858 PolarHBondContact O-OG1 3.23Å; A855-T858 PolarHBondContact O-N 3.39Å; T858-E861 PolarHBondContact O-N 3.17Å; T858-G862 PolarHBondContact O-N 3.34Å
859	I	85.1	Confident	81	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-47.3	173.9	-69.7	166.5	0	0	0	110.8	M798 L819 A855 R857 E861 G862 Y863 F881 F884 V903	M798-I859 HydrophobicContact CE-CG2 4.48Å; M798-I859 WeakPolarHBondContact CE-O 3.33Å; L819-I859 HydrophobicContact CD2-CD1 4Å; L819-I859 HydrophobicContact CD2-CG1 4.4Å; A855-I859 VanDerWaalsContact O-CG1 3.28Å; A855-I859 WeakPolarHBondContact O-CG1 3.31Å; A855-I859 PolarHBondContact O-N 2.89Å; R857-I859 PolarHBondContact O-N 3.36Å; I859-E861 PolarHBondContact O-N 3.15Å; I859-G862 PolarHBondContact O-N 3.26Å; I859-Y863 HydrophobicContact CG2-CD2 3.84Å; I859-Y863 HydrophobicContact CG2-CE1 4.33Å; I859-Y863 HydrophobicContact CG2-CE2 3.28Å; I859-Y863 WeakPolarHBondContact O-CD2 3.43Å; I859-Y863 PolarHBondContact O-N 3.11Å; I859-F881 HydrophobicContact CD1-CD2 4.44Å; I859-F884 HydrophobicContact CD1-CD1 3.98Å; I859-F884 HydrophobicContact CD1-CE1 4.01Å; I859-F884 HydrophobicContact CD1-CG 4.46Å; I859-V903 HydrophobicContact CG2-CG1 4.07Å
860	V	84.3	Confident	80.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-40	177.4	170.6	0	0	0	0	111.8	N856 R857 G862 Y863 A864 F902 V903 Y906 Y927	N856-V860 WeakPolarHBondContact O-CG2 2.9Å; N856-V860 PolarHBondContact O-N 2.86Å; N856-V860 VanDerWaalsContact O-N 3.13Å; R857-V860 PolarHBondContact O-N 3.13Å; R857-V860 VanDerWaalsContact O-N 3.17Å; V860-G862 VanDerWaalsContact C-N 3.35Å; V860-Y863 PolarHBondContact O-N 3.46Å; V860-A864 VanDerWaalsContact O-CB 3.27Å; V860-A864 WeakPolarHBondContact O-CB 3.2Å; V860-A864 PolarHBondContact O-N 3.42Å; V860-F902 HydrophobicContact CB-CE1 3.88Å; V860-F902 HydrophobicContact CG1-CE1 3.96Å; V860-F902 HydrophobicContact CG1-CZ 4.31Å; V860-F902 HydrophobicContact CG2-CD1 3.86Å; V860-F902 HydrophobicContact CG2-CE1 3.7Å; V860-V903 HydrophobicContact CG2-CB 4.12Å; V860-V903 HydrophobicContact CG2-CG1 4.03Å; V860-V903 HydrophobicContact CG2-CG2 3.87Å; V860-Y906 HydrophobicContact CG1-CD1 4.09Å; V860-Y906 HydrophobicContact CG1-CD2 3.96Å; V860-Y906 HydrophobicContact CG1-CE1 4.32Å; V860-Y906 HydrophobicContact CG1-CE2 4.2Å; V860-Y906 HydrophobicContact CG1-CG 3.91Å; V860-Y927 HydrophobicContact CG1-CD1 4.23Å; V860-Y927 HydrophobicContact CG1-CE1 4.18Å
861	E	83.1	Confident	80.7	Confident	87 Å²	87	39.9 Å²	39.9	41%	0.407	19%	0.191	S	C	.	.	H	α-helix	trans	-64.5	-39.9	174.6	-175.3	168	-165.4	0	0	111.9	L795 R857 T858 I859 A864 N865	L795-E861 HydrophobicContact CD2-CB 4.18Å; L795-E861 HydrophobicContact CD2-CG 4.11Å; R857-E861 WeakPolarHBondContact O-CB 3.17Å; R857-E861 PolarHBondContact O-N 2.89Å; T858-E861 PolarHBondContact O-N 3.17Å; I859-E861 PolarHBondContact O-N 3.15Å; E861-A864 PolarHBondContact O-N 3.4Å; E861-N865 VanDerWaalsContact O-CG 3.32Å; E861-N865 PolarHBondContact O-N 2.93Å; E861-N865 PolarHBondContact O-ND2 3.33Å
862	G	82.6	Confident	80.4	Confident	3 Å²	3	43.1 Å²	43.1	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-44.6	172.5	0	0	0	0	0	112.5	T858 I859 V860 N865	T858-G862 PolarHBondContact O-N 3.34Å; I859-G862 PolarHBondContact O-N 3.26Å; V860-G862 VanDerWaalsContact C-N 3.35Å; G862-N865 PolarHBondContact O-N 3.39Å
863	Y	82.8	Confident	80.3	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-37.5	174.9	-64.9	-25.1	0	0	0	112.8	M798 W803 Y815 I859 V860 N865 V866 M877 V903 I907 Y910	M798-Y863 HydrophobicContact CE-CD1 3.55Å; M798-Y863 HydrophobicContact CE-CE1 3.53Å; M798-Y863 HydrophobicContact CE-CG 4.35Å; W803-Y863 HydrophobicContact CH2-CD1 4.34Å; W803-Y863 AromaticContact CH2-CE1 3.72Å; W803-Y863 HydrophobicContact CH2-CE1 3.72Å; W803-Y863 HydrophobicContact CZ2-CD1 4.21Å; W803-Y863 AromaticContact CZ2-CE1 3.96Å; W803-Y863 HydrophobicContact CZ2-CE1 3.96Å; Y815-Y863 PolarHBondContact OH-OH 2.87Å; I859-Y863 HydrophobicContact CG2-CD2 3.84Å; I859-Y863 HydrophobicContact CG2-CE1 4.33Å; I859-Y863 HydrophobicContact CG2-CE2 3.28Å; I859-Y863 WeakPolarHBondContact O-CD2 3.43Å; I859-Y863 PolarHBondContact O-N 3.11Å; V860-Y863 PolarHBondContact O-N 3.46Å; Y863-N865 PolarHBondContact O-N 3.29Å; Y863-V866 WeakPolarHBondContact O-CB 3.28Å; Y863-V866 WeakPolarHBondContact O-CG2 3.36Å; Y863-V866 PolarHBondContact O-N 3.33Å; Y863-M877 HydrophobicContact CD1-CE 4.05Å; Y863-M877 HydrophobicContact CD1-CG 3.98Å; Y863-M877 HydrophobicContact CD1-SD 4.04Å; Y863-M877 HydrophobicContact CE1-CB 4.07Å; Y863-M877 HydrophobicContact CE1-CG 3.73Å; Y863-M877 HydrophobicContact CE1-SD 4.38Å; Y863-M877 HydrophobicContact CE2-CB 4.28Å; Y863-M877 HydrophobicContact CG-SD 4.21Å; Y863-M877 PolarHBondContact OH-O 3.33Å; Y863-M877 VanDerWaalsContact OH-O 3.06Å; Y863-V903 HydrophobicContact CE2-CG1 4.29Å; Y863-I907 HydrophobicContact CD2-CG1 4.35Å; Y863-I907 HydrophobicContact CE2-CD1 3.95Å; Y863-I907 HydrophobicContact CE2-CG1 4.2Å; Y863-Y910 PolarHBondContact O-OH 2.83Å
864	A	80.6	Confident	80.3	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-26.1	176	0	0	0	0	0	113	V860 E861 V866 Y906 Q931 N934	V860-A864 VanDerWaalsContact O-CB 3.27Å; V860-A864 WeakPolarHBondContact O-CB 3.2Å; V860-A864 PolarHBondContact O-N 3.42Å; E861-A864 PolarHBondContact O-N 3.4Å; A864-V866 VanDerWaalsContact C-N 3.29Å; A864-Y906 WeakPolarHBondContact CA-OH 3.46Å; A864-Y906 VanDerWaalsContact CB-OH 3.31Å; A864-Y906 WeakPolarHBondContact CB-OH 3.47Å; A864-Q931 HydrophobicContact CB-CB 4.03Å; A864-Q931 HydrophobicContact CB-CG 3.79Å; A864-N934 WeakPolarHBondContact O-CB 3.36Å; A864-N934 PolarHBondContact O-ND2 3.05Å
865	N	80.6	Confident	80.4	Confident	90 Å²	90	42.3 Å²	42.3	48%	0.481	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-5.4	178.7	-74.6	-29.1	0	0	0	113.8	E861 G862 Y863	E861-N865 VanDerWaalsContact O-CG 3.32Å; E861-N865 PolarHBondContact O-N 2.93Å; E861-N865 PolarHBondContact O-ND2 3.33Å; G862-N865 PolarHBondContact O-N 3.39Å; Y863-N865 PolarHBondContact O-N 3.29Å
866	V	78.1	Confident	80.3	Confident	15 Å²	15	42.7 Å²	42.7	9%	0.091	21%	0.21	C	C	.	.			trans	-69.7	130.9	178.5	179	0	0	0	0	110.4	W803 Y863 A864 K868 C869 M877 V938	W803-V866 HydrophobicContact CB-CG1 3.82Å; W803-V866 HydrophobicContact CD2-CG2 4.49Å; W803-V866 HydrophobicContact CG-CG1 3.79Å; W803-V866 HydrophobicContact CG-CG2 4.06Å; Y863-V866 WeakPolarHBondContact O-CB 3.28Å; Y863-V866 WeakPolarHBondContact O-CG2 3.36Å; Y863-V866 PolarHBondContact O-N 3.33Å; A864-V866 VanDerWaalsContact C-N 3.29Å; V866-K868 WeakPolarHBondContact CG1-O 3.47Å; V866-C869 HydrophobicContact CG1-CB 4.24Å; V866-M877 HydrophobicContact CB-CE 4.49Å; V866-M877 HydrophobicContact CG1-CE 4.42Å; V866-M877 HydrophobicContact CG2-CE 4.01Å; V866-V938 WeakPolarHBondContact O-CG2 3.4Å
867	K	71.5	Confident	80.4	Confident	193 Å²	193	42.7 Å²	42.7	84%	0.839	21%	0.21	S	C	*	.	S	Bend	trans	-89.5	-29.6	-178.1	-65.1	-179.3	-178	175.8	0	114.4
868	K	70.1	Confident	80.5	Confident	159 Å²	159	43.9 Å²	43.9	69%	0.691	22%	0.218	S	C	*	.			trans	-143.5	130.2	-179.8	-66.9	-174.7	180	-177.5	0	109.2	V866	V866-K868 WeakPolarHBondContact CG1-O 3.47Å
869	C	73.5	Confident	80.6	Confident	16 Å²	16	45.8 Å²	45.8	11%	0.108	23%	0.227	C	C	.	.			trans	-138.8	123.9	-178.8	-169.8	0	0	0	0	110.5	W803 V866 R874 V938	W803-C869 HydrophobicContact CB-CB 4.41Å; V866-C869 HydrophobicContact CG1-CB 4.24Å; C869-R874 VanDerWaalsContact SG-CG 3.51Å; C869-V938 HydrophobicContact CB-CG1 3.73Å
870	S	79.6	Confident	80.7	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.14	23%	0.226	C	C	.	.			trans	-80	161.7	175.1	58.8	0	0	0	0	111.3	W803 V805 E872 G873 R874	W803-S870 PolarHBondContact O-N 2.93Å; W803-S870 PolarHBondContact O-OG 3.37Å; V805-S870 PolarHBondContact N-OG 3.34Å; V805-S870 VanDerWaalsContact N-OG 3.13Å; V805-S870 PolarHBondContact O-OG 2.92Å; S870-E872 PolarHBondContact O-N 3.11Å; S870-G873 PolarHBondContact O-N 3.22Å; S870-G873 VanDerWaalsContact O-N 3.15Å; S870-G873 PolarHBondContact OG-N 3.43Å; S870-R874 WeakPolarHBondContact O-CG 3.43Å; S870-R874 PolarHBondContact O-N 3.29Å
871	N	77.9	Confident	80.7	Confident	108 Å²	108	45.7 Å²	45.7	58%	0.578	23%	0.227	S	C	*	.	H	α-helix	trans	-59.3	-35.4	175.7	-74.1	-15.1	0	0	0	112.1	R874 A875	N871-R874 PolarHBondContact O-N 3.24Å; N871-A875 PolarHBondContact O-N 3.41Å; N871-A875 VanDerWaalsContact O-N 3.17Å
872	E	79.6	Confident	80.9	Confident	67 Å²	67	46.3 Å²	46.3	31%	0.313	23%	0.23	S	C	.	.	H	α-helix	trans	-75.2	-34.4	177.1	-64.6	162.8	-174.2	0	0	111.7	K806 E807 I808 S870 R874 A875 L876	K806-E872 WeakPolarHBondContact CA-OE2 3.42Å; K806-E872 PolarHBondContact N-OE2 3.38Å; E807-E872 PolarHBondContact N-OE2 3.36Å; I808-E872 HydrophobicContact CG1-CB 4.06Å; I808-E872 HydrophobicContact CG1-CG 3.93Å; S870-E872 PolarHBondContact O-N 3.11Å; E872-R874 VanDerWaalsContact C-N 3.31Å; E872-R874 PolarHBondContact O-N 2.88Å; E872-A875 WeakPolarHBondContact O-CB 3.41Å; E872-A875 PolarHBondContact O-N 3.2Å; E872-L876 PolarHBondContact O-N 3.43Å
873	G	80.5	Confident	81	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-35.1	169.3	0	0	0	0	0	113.1	S870 L876 M877	S870-G873 PolarHBondContact O-N 3.22Å; S870-G873 VanDerWaalsContact O-N 3.15Å; S870-G873 PolarHBondContact OG-N 3.43Å; G873-L876 WeakPolarHBondContact O-CB 3.34Å; G873-L876 PolarHBondContact O-N 3.33Å; G873-M877 WeakPolarHBondContact O-CG 3.38Å; G873-M877 PolarHBondContact O-N 2.71Å
874	R	82.5	Confident	81.1	Confident	18 Å²	18	48.8 Å²	48.8	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-39.9	172.8	-62.3	167.7	-170	-164	-5.3	111.9	C869 S870 N871 E872 L876 M877 Q878 Y910 Y911	C869-R874 VanDerWaalsContact SG-CG 3.51Å; S870-R874 WeakPolarHBondContact O-CG 3.43Å; S870-R874 PolarHBondContact O-N 3.29Å; N871-R874 PolarHBondContact O-N 3.24Å; E872-R874 VanDerWaalsContact C-N 3.31Å; E872-R874 PolarHBondContact O-N 2.88Å; R874-L876 VanDerWaalsContact C-N 3.27Å; R874-L876 PolarHBondContact O-N 2.81Å; R874-M877 WeakPolarHBondContact O-CB 3.4Å; R874-M877 PolarHBondContact O-N 2.89Å; R874-Q878 PolarHBondContact O-N 3.49Å; R874-Q878 VanDerWaalsContact O-N 3.15Å; R874-Y910 PolarHBondContact NH1-O 3.34Å; R874-Y911 HydrophobicContact CB-CE2 4.49Å; R874-Y911 VanDerWaalsContact CB-OH 3.3Å; R874-Y911 WeakPolarHBondContact CB-OH 3.33Å
875	A	81.8	Confident	81.3	Confident	32 Å²	32	49 Å²	49	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-36.5	172.6	0	0	0	0	0	111.3	N871 E872 Q878 L879	N871-A875 PolarHBondContact O-N 3.41Å; N871-A875 VanDerWaalsContact O-N 3.17Å; E872-A875 WeakPolarHBondContact O-CB 3.41Å; E872-A875 PolarHBondContact O-N 3.2Å; A875-Q878 PolarHBondContact O-N 3.41Å; A875-L879 PolarHBondContact O-N 2.94Å
876	L	83.3	Confident	81.4	Confident	9 Å²	9	50.3 Å²	50.3	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-42.5	173.4	-170.8	66.4	0	0	0	112.2	W803 E872 G873 R874 Q878 L879 D880	W803-L876 HydrophobicContact CZ3-CD2 4.39Å; W803-L876 HydrophobicContact CZ3-CG 4.43Å; E872-L876 PolarHBondContact O-N 3.43Å; G873-L876 WeakPolarHBondContact O-CB 3.34Å; G873-L876 PolarHBondContact O-N 3.33Å; R874-L876 VanDerWaalsContact C-N 3.27Å; R874-L876 PolarHBondContact O-N 2.81Å; L876-Q878 PolarHBondContact O-N 3.26Å; L876-L879 PolarHBondContact O-N 3.08Å; L876-D880 WeakPolarHBondContact O-CB 3.5Å; L876-D880 PolarHBondContact O-N 3.17Å
877	M	85.3	Confident	81.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-38.7	173.5	-68.8	174.4	175.8	0	0	112.2	W803 Y863 V866 G873 R874 F881	W803-M877 HydrophobicContact CB-CE 4.29Å; W803-M877 HydrophobicContact CD2-CE 3.42Å; W803-M877 VanDerWaalsContact CD2-CE 3.42Å; W803-M877 HydrophobicContact CD2-CG 4.35Å; W803-M877 HydrophobicContact CE3-CE 3.48Å; W803-M877 VanDerWaalsContact CE3-CE 3.48Å; W803-M877 HydrophobicContact CE3-CG 3.52Å; W803-M877 HydrophobicContact CE3-SD 4.35Å; W803-M877 HydrophobicContact CG-CE 3.82Å; W803-M877 HydrophobicContact CH2-CE 4.41Å; W803-M877 HydrophobicContact CH2-CG 3.71Å; W803-M877 HydrophobicContact CZ2-CE 4.37Å; W803-M877 HydrophobicContact CZ2-CG 4.5Å; W803-M877 HydrophobicContact CZ3-CB 4.14Å; W803-M877 HydrophobicContact CZ3-CE 4.01Å; W803-M877 HydrophobicContact CZ3-CG 3.17Å; W803-M877 HydrophobicContact CZ3-SD 4.47Å; Y863-M877 HydrophobicContact CD1-CE 4.05Å; Y863-M877 HydrophobicContact CD1-CG 3.98Å; Y863-M877 HydrophobicContact CD1-SD 4.04Å; Y863-M877 HydrophobicContact CE1-CB 4.07Å; Y863-M877 HydrophobicContact CE1-CG 3.73Å; Y863-M877 HydrophobicContact CE1-SD 4.38Å; Y863-M877 HydrophobicContact CE2-CB 4.28Å; Y863-M877 HydrophobicContact CG-SD 4.21Å; Y863-M877 PolarHBondContact OH-O 3.33Å; Y863-M877 VanDerWaalsContact OH-O 3.06Å; V866-M877 HydrophobicContact CB-CE 4.49Å; V866-M877 HydrophobicContact CG1-CE 4.42Å; V866-M877 HydrophobicContact CG2-CE 4.01Å; G873-M877 WeakPolarHBondContact O-CG 3.38Å; G873-M877 PolarHBondContact O-N 2.71Å; R874-M877 WeakPolarHBondContact O-CB 3.4Å; R874-M877 PolarHBondContact O-N 2.89Å; M877-F881 WeakPolarHBondContact O-CB 3.46Å; M877-F881 PolarHBondContact O-N 3.17Å; M877-F881 VanDerWaalsContact O-N 3.11Å
878	Q	84.6	Confident	82	Confident	82 Å²	82	43.4 Å²	43.4	38%	0.383	21%	0.214	S	C	.	.	H	α-helix	trans	-70.5	-41.2	177.3	-171.6	174.4	-2.8	0	0	111.8	R874 A875 L876 F881 Q882 I907	R874-Q878 PolarHBondContact O-N 3.49Å; R874-Q878 VanDerWaalsContact O-N 3.15Å; A875-Q878 PolarHBondContact O-N 3.41Å; L876-Q878 PolarHBondContact O-N 3.26Å; Q878-F881 PolarHBondContact O-N 3.31Å; Q878-Q882 WeakPolarHBondContact O-CB 3.27Å; Q878-Q882 WeakPolarHBondContact O-CG 3.41Å; Q878-Q882 PolarHBondContact O-N 2.9Å; Q878-I907 HydrophobicContact CB-CG2 4.34Å
879	L	85.8	Confident	82.5	Confident	53 Å²	53	39.9 Å²	39.9	28%	0.277	20%	0.201	S	C	.	.	H	α-helix	trans	-62.9	-47.4	175.4	-171.1	163.3	0	0	0	111	H812 A875 L876 F881 Q882 Q883	H812-L879 HydrophobicContact CB-CD2 3.9Å; A875-L879 PolarHBondContact O-N 2.94Å; L876-L879 PolarHBondContact O-N 3.08Å; L879-F881 VanDerWaalsContact C-N 3.31Å; L879-F881 PolarHBondContact O-N 2.82Å; L879-Q882 PolarHBondContact O-N 2.82Å; L879-Q883 WeakPolarHBondContact O-CB 3.4Å; L879-Q883 PolarHBondContact O-N 3.48Å
880	D	85.9	Confident	82.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.5	-45.7	177.2	-77.1	-19.8	0	0	0	111.3	H812 N813 Y815 V816 L876 Q883 F884	H812-D880 WeakPolarHBondContact CA-OD1 3.43Å; H812-D880 WeakPolarHBondContact CB-OD1 3.46Å; N813-D880 PolarHBondContact N-OD1 3.1Å; N813-D880 PolarHBondContact ND2-OD2 2.91Å; Y815-D880 WeakPolarHBondContact OH-CB 3.16Å; Y815-D880 PolarHBondContact OH-OD2 3.23Å; V816-D880 HydrophobicContact CG2-CB 3.75Å; L876-D880 WeakPolarHBondContact O-CB 3.5Å; L876-D880 PolarHBondContact O-N 3.17Å; D880-Q883 PolarHBondContact O-N 3.3Å; D880-F884 WeakPolarHBondContact O-CB 3.38Å; D880-F884 PolarHBondContact O-N 3.31Å
881	F	85.9	Confident	82.5	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-68.7	-41.2	178.4	-174.7	-115.3	0	0	0	112.7	I859 M877 Q878 L879 Q883 F884 L885 K900 V903 E904 I907	I859-F881 HydrophobicContact CD1-CD2 4.44Å; M877-F881 WeakPolarHBondContact O-CB 3.46Å; M877-F881 PolarHBondContact O-N 3.17Å; M877-F881 VanDerWaalsContact O-N 3.11Å; Q878-F881 PolarHBondContact O-N 3.31Å; L879-F881 VanDerWaalsContact C-N 3.31Å; L879-F881 PolarHBondContact O-N 2.82Å; F881-Q883 VanDerWaalsContact C-N 3.34Å; F881-Q883 PolarHBondContact O-N 3.15Å; F881-F884 HydrophobicContact CD2-CD1 4.32Å; F881-F884 HydrophobicContact CE2-CD1 4.3Å; F881-F884 WeakPolarHBondContact O-CB 3.32Å; F881-F884 PolarHBondContact O-N 2.96Å; F881-L885 HydrophobicContact CD1-CD1 3.97Å; F881-L885 HydrophobicContact CD1-CG 4.46Å; F881-L885 HydrophobicContact CE1-CD1 3.49Å; F881-L885 VanDerWaalsContact CE1-CD1 3.49Å; F881-L885 HydrophobicContact CE1-CD2 4.47Å; F881-L885 HydrophobicContact CE1-CG 4.08Å; F881-L885 HydrophobicContact CE2-CD2 4.26Å; F881-L885 HydrophobicContact CE2-CG 4.26Å; F881-L885 HydrophobicContact CZ-CD1 3.82Å; F881-L885 HydrophobicContact CZ-CD2 3.93Å; F881-L885 HydrophobicContact CZ-CG 3.96Å; F881-L885 WeakPolarHBondContact O-CG 3.49Å; F881-L885 PolarHBondContact O-N 3.41Å; F881-K900 HydrophobicContact CE1-CG 4.37Å; F881-K900 HydrophobicContact CZ-CG 4.42Å; F881-V903 HydrophobicContact CD1-CB 4.41Å; F881-V903 HydrophobicContact CD1-CG1 4.17Å; F881-V903 HydrophobicContact CD2-CB 4.17Å; F881-V903 HydrophobicContact CD2-CG1 3.68Å; F881-V903 HydrophobicContact CD2-CG2 4.48Å; F881-V903 HydrophobicContact CE1-CB 3.9Å; F881-V903 HydrophobicContact CE1-CG1 4.15Å; F881-V903 HydrophobicContact CE2-CB 3.64Å; F881-V903 HydrophobicContact CE2-CG1 3.68Å; F881-V903 HydrophobicContact CE2-CG2 3.69Å; F881-V903 HydrophobicContact CG-CG1 3.94Å; F881-V903 HydrophobicContact CZ-CB 3.49Å; F881-V903 VanDerWaalsContact CZ-CB 3.49Å; F881-V903 HydrophobicContact CZ-CG1 3.93Å; F881-V903 HydrophobicContact CZ-CG2 3.8Å; F881-E904 HydrophobicContact CD1-CG 4.31Å; F881-E904 HydrophobicContact CE1-CG 3.8Å; F881-I907 HydrophobicContact CB-CD1 4.23Å
882	Q	85.9	Confident	82.2	Confident	101 Å²	101	44.2 Å²	44.2	47%	0.472	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-41.3	175.6	-77.5	-178	-10.9	0	0	111.9	Q878 L879 L885 M886	Q878-Q882 WeakPolarHBondContact O-CB 3.27Å; Q878-Q882 WeakPolarHBondContact O-CG 3.41Å; Q878-Q882 PolarHBondContact O-N 2.9Å; L879-Q882 PolarHBondContact O-N 2.82Å; Q882-L885 PolarHBondContact O-N 2.95Å; Q882-M886 WeakPolarHBondContact O-CG 3.46Å; Q882-M886 PolarHBondContact O-N 2.87Å
883	Q	85	Confident	81.6	Confident	53 Å²	53	48.8 Å²	48.8	25%	0.248	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-41	176.8	-174.7	75.4	-22	0	0	111.9	H812 L879 D880 F881 M886 K887	H812-Q883 HydrophobicContact CB-CG 4.47Å; H812-Q883 VanDerWaalsContact CD2-CG 3.44Å; H812-Q883 WeakPolarHBondContact CD2-CG 3.49Å; H812-Q883 PolarHBondContact CD2-NE2 3.06Å; H812-Q883 PolarHBondContact NE2-NE2 2.88Å; L879-Q883 WeakPolarHBondContact O-CB 3.4Å; L879-Q883 PolarHBondContact O-N 3.48Å; D880-Q883 PolarHBondContact O-N 3.3Å; F881-Q883 VanDerWaalsContact C-N 3.34Å; F881-Q883 PolarHBondContact O-N 3.15Å; Q883-M886 PolarHBondContact O-N 3.31Å; Q883-K887 HydrophobicContact CG-CD 4.38Å; Q883-K887 VanDerWaalsContact NE2-CE 3.31Å; Q883-K887 PolarHBondContact O-N 3.37Å; Q883-K887 VanDerWaalsContact O-N 3.12Å
884	F	85.8	Confident	81	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-56.2	-50.4	172.7	174.4	-111.7	0	0	0	110.8	V816 L819 L820 F823 A855 I859 D880 F881 K887 L888	V816-F884 HydrophobicContact CG1-CB 3.97Å; L819-F884 HydrophobicContact CD2-CD2 3.8Å; L819-F884 HydrophobicContact CD2-CE2 3.39Å; L819-F884 HydrophobicContact CD2-CZ 3.84Å; L819-F884 HydrophobicContact CG-CD2 4.39Å; L819-F884 HydrophobicContact CG-CE2 3.8Å; L819-F884 HydrophobicContact CG-CZ 4.48Å; L820-F884 HydrophobicContact CD2-CD2 3.87Å; L820-F884 HydrophobicContact CD2-CE2 4.12Å; L820-F884 HydrophobicContact CG-CD2 4.11Å; F823-F884 AromaticContact CD2-CE2 4Å; F823-F884 HydrophobicContact CD2-CE2 4Å; F823-F884 HydrophobicContact CD2-CZ 4.38Å; F823-F884 AromaticContact CE2-CE2 3.71Å; F823-F884 HydrophobicContact CE2-CE2 3.71Å; F823-F884 AromaticContact CE2-CZ 3.68Å; F823-F884 HydrophobicContact CE2-CZ 3.68Å; F823-F884 HydrophobicContact CZ-CZ 4.26Å; A855-F884 HydrophobicContact CB-CZ 4.24Å; I859-F884 HydrophobicContact CD1-CD1 3.98Å; I859-F884 HydrophobicContact CD1-CE1 4.01Å; I859-F884 HydrophobicContact CD1-CG 4.46Å; D880-F884 WeakPolarHBondContact O-CB 3.38Å; D880-F884 PolarHBondContact O-N 3.31Å; F881-F884 HydrophobicContact CD2-CD1 4.32Å; F881-F884 HydrophobicContact CE2-CD1 4.3Å; F881-F884 WeakPolarHBondContact O-CB 3.32Å; F881-F884 PolarHBondContact O-N 2.96Å; F884-K887 PolarHBondContact O-N 3.34Å; F884-L888 HydrophobicContact CE1-CD2 3.94Å; F884-L888 HydrophobicContact CZ-CD1 4.39Å; F884-L888 HydrophobicContact CZ-CD2 3.95Å; F884-L888 WeakPolarHBondContact O-CB 3.18Å; F884-L888 PolarHBondContact O-N 2.85Å
885	L	84.1	Confident	80.1	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-48.2	178.1	-68.9	176	0	0	0	112.7	F881 Q882 K887 L888 E889 I897 K900	F881-L885 HydrophobicContact CD1-CD1 3.97Å; F881-L885 HydrophobicContact CD1-CG 4.46Å; F881-L885 HydrophobicContact CE1-CD1 3.49Å; F881-L885 VanDerWaalsContact CE1-CD1 3.49Å; F881-L885 HydrophobicContact CE1-CD2 4.47Å; F881-L885 HydrophobicContact CE1-CG 4.08Å; F881-L885 HydrophobicContact CE2-CD2 4.26Å; F881-L885 HydrophobicContact CE2-CG 4.26Å; F881-L885 HydrophobicContact CZ-CD1 3.82Å; F881-L885 HydrophobicContact CZ-CD2 3.93Å; F881-L885 HydrophobicContact CZ-CG 3.96Å; F881-L885 WeakPolarHBondContact O-CG 3.49Å; F881-L885 PolarHBondContact O-N 3.41Å; Q882-L885 PolarHBondContact O-N 2.95Å; L885-K887 VanDerWaalsContact C-N 3.28Å; L885-K887 PolarHBondContact O-N 3.26Å; L885-L888 PolarHBondContact O-N 3.5Å; L885-E889 WeakPolarHBondContact O-CB 3.28Å; L885-E889 WeakPolarHBondContact O-CG 3.3Å; L885-E889 PolarHBondContact O-N 3.48Å; L885-I897 HydrophobicContact CD2-CD1 3.8Å; L885-I897 HydrophobicContact CD2-CG2 4.18Å; L885-K900 HydrophobicContact CD1-CD 3.92Å; L885-K900 HydrophobicContact CD1-CG 4.04Å
886	M	83.4	Confident	79.2	Confident	116 Å²	116	63.5 Å²	63.5	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-61.3	-35.4	-178.4	-75	-174.1	73.4	0	0	113.2	Q882 Q883	Q882-M886 WeakPolarHBondContact O-CG 3.46Å; Q882-M886 PolarHBondContact O-N 2.87Å; Q883-M886 PolarHBondContact O-N 3.31Å
887	K	80.3	Confident	78.5	Confident	63 Å²	63	64 Å²	64	27%	0.274	31%	0.308	S	S	.	.	H	α-helix	trans	-81.8	-35.3	177.3	-71	-179.3	178.8	170.5	0	111.4	H812 D817 L820 Q883 F884 L885 K890	H812-K887 PolarHBondContact NE2-NZ 3.28Å; D817-K887 IonicContact OD1-NZ 2.87Å; D817-K887 PolarHBondContact OD1-NZ 2.64Å; L820-K887 HydrophobicContact CD1-CB 3.73Å; L820-K887 HydrophobicContact CD1-CD 3.3Å; L820-K887 HydrophobicContact CD1-CG 4.15Å; L820-K887 HydrophobicContact CD2-CB 3.78Å; L820-K887 HydrophobicContact CG-CB 4.42Å; Q883-K887 HydrophobicContact CG-CD 4.38Å; Q883-K887 VanDerWaalsContact NE2-CE 3.31Å; Q883-K887 PolarHBondContact O-N 3.37Å; Q883-K887 VanDerWaalsContact O-N 3.12Å; F884-K887 PolarHBondContact O-N 3.34Å; L885-K887 VanDerWaalsContact C-N 3.28Å; L885-K887 PolarHBondContact O-N 3.26Å; K887-K890 PolarHBondContact O-N 3.39Å
888	L	81.7	Confident	77.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-40.3	174.5	-175.1	72.1	0	0	0	112.1	F823 I852 F884 L885 K890 L891 T892 I897	F823-L888 HydrophobicContact CD1-CD1 4.18Å; F823-L888 HydrophobicContact CD2-CD1 4.4Å; F823-L888 HydrophobicContact CE1-CD1 4.22Å; F823-L888 HydrophobicContact CE2-CD1 4.49Å; F823-L888 HydrophobicContact CG-CD1 4.26Å; F823-L888 HydrophobicContact CZ-CD1 4.38Å; I852-L888 HydrophobicContact CD1-CD2 4.1Å; I852-L888 HydrophobicContact CD1-CG 4.5Å; I852-L888 HydrophobicContact CG1-CD1 4.3Å; I852-L888 HydrophobicContact CG1-CD2 3.97Å; I852-L888 HydrophobicContact CG2-CD2 4.14Å; F884-L888 HydrophobicContact CE1-CD2 3.94Å; F884-L888 HydrophobicContact CZ-CD1 4.39Å; F884-L888 HydrophobicContact CZ-CD2 3.95Å; F884-L888 WeakPolarHBondContact O-CB 3.18Å; F884-L888 PolarHBondContact O-N 2.85Å; L885-L888 PolarHBondContact O-N 3.5Å; L888-K890 PolarHBondContact O-N 2.84Å; L888-K890 VanDerWaalsContact O-N 3.11Å; L888-L891 PolarHBondContact O-N 3Å; L888-T892 HydrophobicContact CD1-CG2 4.46Å; L888-T892 PolarHBondContact O-N 2.72Å; L888-T892 VanDerWaalsContact O-N 3.17Å; L888-T892 PolarHBondContact O-OG1 3.26Å; L888-I897 HydrophobicContact CD2-CG2 4.45Å
889	E	79.9	Confident	77.1	Confident	86 Å²	86	62.8 Å²	62.8	40%	0.402	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.3	175.7	-78.8	-180	-174.9	0	0	113.6	L885 I897	L885-E889 WeakPolarHBondContact O-CB 3.28Å; L885-E889 WeakPolarHBondContact O-CG 3.3Å; L885-E889 PolarHBondContact O-N 3.48Å; E889-I897 HydrophobicContact CG-CD1 3.63Å
890	K	78.7	Confident	76.8	Confident	180 Å²	180	63.7 Å²	63.7	78%	0.783	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-18.4	175.3	-63.7	179.4	-177.3	-179.5	0	113	K887 L888	K887-K890 PolarHBondContact O-N 3.39Å; L888-K890 PolarHBondContact O-N 2.84Å; L888-K890 VanDerWaalsContact O-N 3.11Å
891	L	74.1	Confident	76.4	Confident	45 Å²	45	71 Å²	71	24%	0.236	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-19.5	-178.1	-64.2	175.1	0	0	0	112.4	F823 E824 W848 L888	F823-L891 HydrophobicContact CB-CD1 4.26Å; E824-L891 HydrophobicContact CG-CD1 4.09Å; E824-L891 HydrophobicContact CG-CD2 4.17Å; W848-L891 HydrophobicContact CH2-CB 4.43Å; L888-L891 PolarHBondContact O-N 3Å
892	T	72.8	Confident	76.1	Confident	9 Å²	9	71.3 Å²	71.3	6%	0.055	34%	0.342	C	S	.	.			trans	-132.6	140.1	-175.3	67.5	0	0	0	0	112.9	W848 I852 L888 I894	W848-T892 HydrophobicContact CD2-CG2 3.55Å; W848-T892 HydrophobicContact CE3-CG2 3.16Å; W848-T892 HydrophobicContact CG-CG2 4.25Å; W848-T892 HydrophobicContact CH2-CG2 3.86Å; W848-T892 HydrophobicContact CZ2-CG2 4.21Å; W848-T892 HydrophobicContact CZ3-CG2 3.31Å; I852-T892 HydrophobicContact CD1-CG2 4.29Å; L888-T892 HydrophobicContact CD1-CG2 4.46Å; L888-T892 PolarHBondContact O-N 2.72Å; L888-T892 VanDerWaalsContact O-N 3.17Å; L888-T892 PolarHBondContact O-OG1 3.26Å; T892-I894 VanDerWaalsContact C-N 3.33Å
893	D	66.3	Low	75.9	Confident	164 Å²	164	66.5 Å²	66.5	88%	0.877	32%	0.32	S	S	*	.			trans	-86.6	1.1	174.9	-65.5	-39.2	0	0	0	113.9	R895	D893-R895 PolarHBondContact O-N 3.32Å
894	I	67.3	Low	75.8	Confident	32 Å²	32	66.5 Å²	66.5	16%	0.164	32%	0.32	C	S	.	.			trans	-74.1	121.6	-174.9	-58.4	179.9	0	0	0	110.8	N845 W848 T892	N845-I894 HydrophobicContact CB-CD1 4.38Å; N845-I894 WeakPolarHBondContact O-CD1 3.48Å; W848-I894 HydrophobicContact CB-CD1 3.41Å; W848-I894 VanDerWaalsContact CB-CD1 3.41Å; W848-I894 HydrophobicContact CG-CD1 4.44Å; T892-I894 VanDerWaalsContact C-N 3.33Å
895	R	63.6	Low	75.7	Confident	208 Å²	208	68.1 Å²	68.1	79%	0.785	33%	0.33	S	S	*	.	S	Bend	trans	-133.2	130.6	172.5	-61.3	-173.5	-177.9	-134.9	-3.9	110	D893	D893-R895 PolarHBondContact O-N 3.32Å
896	P	64	Low	75.6	Confident	118 Å²	118	67.8 Å²	67.8	77%	0.766	33%	0.328	S	S	*	.	S	Bend	cis	-75.8	157.3	-3.5	31.8	-34.6	0	0	0	113.3	P898	P896-P898 WeakPolarHBondContact O-CD 3.14Å
897	I	68.9	Low	75.5	Confident	20 Å²	20	62.5 Å²	62.5	10%	0.103	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-67.7	123.5	177.4	-60.4	171.4	0	0	0	109.3	I852 L885 L888 E889 K900	I852-I897 HydrophobicContact CG2-CG2 3.73Å; L885-I897 HydrophobicContact CD2-CD1 3.8Å; L885-I897 HydrophobicContact CD2-CG2 4.18Å; L888-I897 HydrophobicContact CD2-CG2 4.45Å; E889-I897 HydrophobicContact CG-CD1 3.63Å; I897-K900 HydrophobicContact CB-CB 4.43Å
898	P	68.9	Low	75.5	Confident	17 Å²	17	64.9 Å²	64.9	11%	0.11	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	137.6	178.6	-23.8	33.5	0	0	0	112.4	E849 N856 P896 K900	E849-P898 HydrophobicContact CB-CG 4.09Å; E849-P898 HydrophobicContact CG-CB 4.08Å; E849-P898 HydrophobicContact CG-CG 3.68Å; N856-P898 PolarHBondContact ND2-O 3.15Å; P896-P898 WeakPolarHBondContact O-CD 3.14Å; P898-K900 PolarHBondContact O-N 3.23Å; P898-K900 VanDerWaalsContact O-N 3.07Å
899	D	71.1	Confident	75.4	Confident	40 Å²	40	64.9 Å²	64.9	21%	0.214	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	23.4	172.8	-58.5	15.5	0	0	0	114.8	R853 N856 R857 F902	R853-D899 WeakPolarHBondContact CD-OD2 3.44Å; R853-D899 WeakPolarHBondContact CG-OD2 3.4Å; R853-D899 IonicContact CZ-OD1 3.02Å; R853-D899 IonicContact NE-OD1 3.92Å; R853-D899 PolarHBondContact NE-OD1 3.46Å; R853-D899 IonicContact NE-OD2 2.65Å; R853-D899 PolarHBondContact NE-OD2 3.26Å; R853-D899 VanDerWaalsContact NE-OD2 3.11Å; R853-D899 IonicContact NH2-OD1 2.72Å; N856-D899 HydrophobicContact CB-CB 4.47Å; R857-D899 IonicContact CZ-OD2 2.88Å; R857-D899 IonicContact NH2-OD2 2.78Å; D899-F902 HydrophobicContact CB-CB 4.08Å; D899-F902 WeakPolarHBondContact O-CB 3.33Å; D899-F902 PolarHBondContact O-N 3.35Å
900	K	78.3	Confident	75.2	Confident	72 Å²	72	60.9 Å²	60.9	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-45.3	171.2	174.7	177.4	172.6	177.2	0	111.7	F881 L885 I897 P898 F902 V903 E904	F881-K900 HydrophobicContact CE1-CG 4.37Å; F881-K900 HydrophobicContact CZ-CG 4.42Å; L885-K900 HydrophobicContact CD1-CD 3.92Å; L885-K900 HydrophobicContact CD1-CG 4.04Å; I897-K900 HydrophobicContact CB-CB 4.43Å; P898-K900 PolarHBondContact O-N 3.23Å; P898-K900 VanDerWaalsContact O-N 3.07Å; K900-F902 PolarHBondContact O-N 3.33Å; K900-V903 PolarHBondContact O-N 3.09Å; K900-E904 WeakPolarHBondContact CE-OE1 3.38Å; K900-E904 HydrophobicContact CG-CG 4.49Å; K900-E904 IonicContact NZ-OE1 3.3Å; K900-E904 PolarHBondContact O-N 3.06Å; K900-E904 VanDerWaalsContact O-N 3.11Å
901	E	77.4	Confident	75.1	Confident	153 Å²	153	57.9 Å²	57.9	72%	0.715	28%	0.278	S	S	*	.	H	α-helix	trans	-63.5	-30.4	179.4	-64.6	-175.7	171.8	0	0	112.1	E904 T905	E901-E904 PolarHBondContact O-N 2.99Å; E901-T905 VanDerWaalsContact O-CB 3.28Å; E901-T905 WeakPolarHBondContact O-CB 3.42Å; E901-T905 VanDerWaalsContact O-CG2 3.3Å; E901-T905 WeakPolarHBondContact O-CG2 3.37Å; E901-T905 PolarHBondContact O-N 2.94Å; E901-T905 PolarHBondContact O-OG1 3.24Å
902	F	80.8	Confident	75.3	Confident	10 Å²	10	58.5 Å²	58.5	4%	0.044	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-47.2	176	-179.4	-100.8	0	0	0	111.3	R857 V860 D899 K900 T905 Y906 E926 Y927	R857-F902 HydrophobicContact CG-CE1 4.01Å; V860-F902 HydrophobicContact CB-CE1 3.88Å; V860-F902 HydrophobicContact CG1-CE1 3.96Å; V860-F902 HydrophobicContact CG1-CZ 4.31Å; V860-F902 HydrophobicContact CG2-CD1 3.86Å; V860-F902 HydrophobicContact CG2-CE1 3.7Å; D899-F902 HydrophobicContact CB-CB 4.08Å; D899-F902 WeakPolarHBondContact O-CB 3.33Å; D899-F902 PolarHBondContact O-N 3.35Å; K900-F902 PolarHBondContact O-N 3.33Å; F902-T905 PolarHBondContact O-OG1 3.46Å; F902-Y906 PolarHBondContact O-N 3.41Å; F902-E926 HydrophobicContact CD2-CB 4.26Å; F902-E926 HydrophobicContact CE2-CB 3.94Å; F902-Y927 HydrophobicContact CD1-CE1 4.37Å; F902-Y927 HydrophobicContact CD2-CD1 4.33Å; F902-Y927 AromaticContact CD2-CE1 3.65Å; F902-Y927 HydrophobicContact CD2-CE1 3.65Å; F902-Y927 AromaticContact CD2-CZ 3.82Å; F902-Y927 HydrophobicContact CE1-CD1 4.39Å; F902-Y927 HydrophobicContact CE1-CE1 4Å; F902-Y927 AromaticContact CE2-CD1 3.45Å; F902-Y927 HydrophobicContact CE2-CD1 3.45Å; F902-Y927 VanDerWaalsContact CE2-CD1 3.45Å; F902-Y927 AromaticContact CE2-CE1 3.2Å; F902-Y927 HydrophobicContact CE2-CE1 3.2Å; F902-Y927 HydrophobicContact CE2-CE2 4.42Å; F902-Y927 HydrophobicContact CE2-CG 4.16Å; F902-Y927 AromaticContact CE2-CZ 3.75Å; F902-Y927 HydrophobicContact CG-CE1 4.21Å; F902-Y927 AromaticContact CZ-CD1 3.48Å; F902-Y927 HydrophobicContact CZ-CD1 3.48Å; F902-Y927 VanDerWaalsContact CZ-CD1 3.48Å; F902-Y927 AromaticContact CZ-CE1 3.4Å; F902-Y927 HydrophobicContact CZ-CE1 3.4Å; F902-Y927 HydrophobicContact CZ-CG 4.49Å; F902-Y927 PolarHBondContact O-OH 3.42Å
903	V	81.4	Confident	75.3	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-71.9	-42	178	-169.4	0	0	0	0	111.5	N856 I859 V860 Y863 F881 K900 T905 Y906 I907	N856-V903 HydrophobicContact CB-CG2 3.65Å; I859-V903 HydrophobicContact CG2-CG1 4.07Å; V860-V903 HydrophobicContact CG2-CB 4.12Å; V860-V903 HydrophobicContact CG2-CG1 4.03Å; V860-V903 HydrophobicContact CG2-CG2 3.87Å; Y863-V903 HydrophobicContact CE2-CG1 4.29Å; F881-V903 HydrophobicContact CD1-CB 4.41Å; F881-V903 HydrophobicContact CD1-CG1 4.17Å; F881-V903 HydrophobicContact CD2-CB 4.17Å; F881-V903 HydrophobicContact CD2-CG1 3.68Å; F881-V903 HydrophobicContact CD2-CG2 4.48Å; F881-V903 HydrophobicContact CE1-CB 3.9Å; F881-V903 HydrophobicContact CE1-CG1 4.15Å; F881-V903 HydrophobicContact CE2-CB 3.64Å; F881-V903 HydrophobicContact CE2-CG1 3.68Å; F881-V903 HydrophobicContact CE2-CG2 3.69Å; F881-V903 HydrophobicContact CG-CG1 3.94Å; F881-V903 HydrophobicContact CZ-CB 3.49Å; F881-V903 VanDerWaalsContact CZ-CB 3.49Å; F881-V903 HydrophobicContact CZ-CG1 3.93Å; F881-V903 HydrophobicContact CZ-CG2 3.8Å; K900-V903 PolarHBondContact O-N 3.09Å; V903-T905 PolarHBondContact O-N 3.15Å; V903-Y906 PolarHBondContact O-N 3.17Å; V903-I907 HydrophobicContact CG1-CD1 4.04Å; V903-I907 WeakPolarHBondContact O-CG1 3.3Å; V903-I907 PolarHBondContact O-N 2.88Å
904	E	82.9	Confident	75.4	Confident	53 Å²	53	57.6 Å²	57.6	25%	0.248	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-41.2	-179.3	-71.4	-167.5	-172.1	0	0	113	F881 K900 E901 Y906 I907 K908	F881-E904 HydrophobicContact CD1-CG 4.31Å; F881-E904 HydrophobicContact CE1-CG 3.8Å; K900-E904 WeakPolarHBondContact CE-OE1 3.38Å; K900-E904 HydrophobicContact CG-CG 4.49Å; K900-E904 IonicContact NZ-OE1 3.3Å; K900-E904 PolarHBondContact O-N 3.06Å; K900-E904 VanDerWaalsContact O-N 3.11Å; E901-E904 PolarHBondContact O-N 2.99Å; E904-Y906 VanDerWaalsContact C-N 3.33Å; E904-I907 PolarHBondContact O-N 3.12Å; E904-K908 VanDerWaalsContact O-CB 3.32Å; E904-K908 WeakPolarHBondContact O-CB 3.31Å; E904-K908 WeakPolarHBondContact O-CD 3.03Å; E904-K908 WeakPolarHBondContact O-CG 3.41Å; E904-K908 PolarHBondContact O-N 3.41Å; E904-K908 IonicContact OE2-NZ 3.83Å; E904-K908 PolarHBondContact OE2-NZ 2.94Å
905	T	83.6	Confident	75.5	Confident	37 Å²	37	61.1 Å²	61.1	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-66.9	-37.1	177.9	49.5	0	0	0	0	111	E901 F902 V903 K908 A909 Y927	E901-T905 VanDerWaalsContact O-CB 3.28Å; E901-T905 WeakPolarHBondContact O-CB 3.42Å; E901-T905 VanDerWaalsContact O-CG2 3.3Å; E901-T905 WeakPolarHBondContact O-CG2 3.37Å; E901-T905 PolarHBondContact O-N 2.94Å; E901-T905 PolarHBondContact O-OG1 3.24Å; F902-T905 PolarHBondContact O-OG1 3.46Å; V903-T905 PolarHBondContact O-N 3.15Å; T905-K908 PolarHBondContact O-N 3.39Å; T905-A909 WeakPolarHBondContact O-CB 3.47Å; T905-A909 PolarHBondContact O-N 3.24Å; T905-Y927 PolarHBondContact OG1-OH 2.97Å
906	Y	82.2	Confident	76.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-44.2	172.5	-166.3	-96.3	0	0	0	112.6	V860 A864 F902 V903 E904 A909 Y910 W920 Y927 Q931 L935	V860-Y906 HydrophobicContact CG1-CD1 4.09Å; V860-Y906 HydrophobicContact CG1-CD2 3.96Å; V860-Y906 HydrophobicContact CG1-CE1 4.32Å; V860-Y906 HydrophobicContact CG1-CE2 4.2Å; V860-Y906 HydrophobicContact CG1-CG 3.91Å; A864-Y906 WeakPolarHBondContact CA-OH 3.46Å; A864-Y906 VanDerWaalsContact CB-OH 3.31Å; A864-Y906 WeakPolarHBondContact CB-OH 3.47Å; F902-Y906 PolarHBondContact O-N 3.41Å; V903-Y906 PolarHBondContact O-N 3.17Å; E904-Y906 VanDerWaalsContact C-N 3.33Å; Y906-A909 WeakPolarHBondContact O-CB 3.49Å; Y906-A909 PolarHBondContact O-N 3.2Å; Y906-Y910 HydrophobicContact CD1-CE2 4.1Å; Y906-Y910 AromaticContact CE1-CE2 3.92Å; Y906-Y910 HydrophobicContact CE1-CE2 3.92Å; Y906-W920 HydrophobicContact CD2-CH2 4.34Å; Y906-Y927 AromaticContact CD2-CD1 3.75Å; Y906-Y927 HydrophobicContact CD2-CD1 3.75Å; Y906-Y927 AromaticContact CD2-CE1 3.53Å; Y906-Y927 HydrophobicContact CD2-CE1 3.53Å; Y906-Y927 HydrophobicContact CD2-CG 4.45Å; Y906-Y927 HydrophobicContact CE2-CD1 4.28Å; Y906-Y927 HydrophobicContact CE2-CE1 4.48Å; Y906-Y927 HydrophobicContact CG-CE1 4.1Å; Y906-Y927 PolarHBondContact N-OH 3.37Å; Y906-Q931 HydrophobicContact CE2-CB 4.42Å; Y906-Q931 PolarHBondContact OH-O 3.27Å; Y906-Q931 VanDerWaalsContact OH-O 3.09Å; Y906-L935 HydrophobicContact CD2-CD2 4.38Å; Y906-L935 HydrophobicContact CE1-CD1 4.26Å; Y906-L935 HydrophobicContact CE2-CB 4.25Å; Y906-L935 HydrophobicContact CE2-CD1 4.3Å; Y906-L935 HydrophobicContact CE2-CD2 3.99Å; Y906-L935 HydrophobicContact CE2-CG 4.42Å
907	I	81.1	Confident	76.6	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-41.9	176.4	-64.3	169.8	0	0	0	110.9	Y863 Q878 F881 V903 E904 A909 Y910	Y863-I907 HydrophobicContact CD2-CG1 4.35Å; Y863-I907 HydrophobicContact CE2-CD1 3.95Å; Y863-I907 HydrophobicContact CE2-CG1 4.2Å; Q878-I907 HydrophobicContact CB-CG2 4.34Å; F881-I907 HydrophobicContact CB-CD1 4.23Å; V903-I907 HydrophobicContact CG1-CD1 4.04Å; V903-I907 WeakPolarHBondContact O-CG1 3.3Å; V903-I907 PolarHBondContact O-N 2.88Å; E904-I907 PolarHBondContact O-N 3.12Å; I907-A909 PolarHBondContact O-N 3.1Å; I907-Y910 WeakPolarHBondContact O-CB 3.37Å; I907-Y910 WeakPolarHBondContact O-CD2 3.37Å; I907-Y910 PolarHBondContact O-N 2.88Å
908	K	81.5	Confident	76.8	Confident	113 Å²	113	49.7 Å²	49.7	49%	0.491	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-30	176.6	-72.7	166.5	-168.7	162.8	0	111.9	E904 T905 Y910 Y911	E904-K908 VanDerWaalsContact O-CB 3.32Å; E904-K908 WeakPolarHBondContact O-CB 3.31Å; E904-K908 WeakPolarHBondContact O-CD 3.03Å; E904-K908 WeakPolarHBondContact O-CG 3.41Å; E904-K908 PolarHBondContact O-N 3.41Å; E904-K908 IonicContact OE2-NZ 3.83Å; E904-K908 PolarHBondContact OE2-NZ 2.94Å; T905-K908 PolarHBondContact O-N 3.39Å; K908-Y910 PolarHBondContact O-N 2.94Å; K908-Y911 PolarHBondContact O-N 2.96Å
909	A	79.1	Confident	77.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-24.2	177.5	0	0	0	0	0	113.2	T905 Y906 I907 Y911 L912 W920 L935	T905-A909 WeakPolarHBondContact O-CB 3.47Å; T905-A909 PolarHBondContact O-N 3.24Å; Y906-A909 WeakPolarHBondContact O-CB 3.49Å; Y906-A909 PolarHBondContact O-N 3.2Å; I907-A909 PolarHBondContact O-N 3.1Å; A909-Y911 PolarHBondContact O-N 3.42Å; A909-L912 HydrophobicContact CB-CD1 4.15Å; A909-L912 PolarHBondContact O-N 3.48Å; A909-W920 HydrophobicContact CB-CD2 4.14Å; A909-W920 HydrophobicContact CB-CE3 4.28Å; A909-W920 HydrophobicContact CB-CH2 3.89Å; A909-W920 HydrophobicContact CB-CZ2 3.74Å; A909-W920 HydrophobicContact CB-CZ3 4.16Å; A909-L935 HydrophobicContact CB-CD2 3.82Å
910	Y	74.8	Confident	77.6	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.012	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.4	172.5	-72.2	-77.2	0	0	0	114	Y863 R874 Y906 I907 K908 L935 V938 C939	Y863-Y910 PolarHBondContact O-OH 2.83Å; R874-Y910 PolarHBondContact NH1-O 3.34Å; Y906-Y910 HydrophobicContact CD1-CE2 4.1Å; Y906-Y910 AromaticContact CE1-CE2 3.92Å; Y906-Y910 HydrophobicContact CE1-CE2 3.92Å; I907-Y910 WeakPolarHBondContact O-CB 3.37Å; I907-Y910 WeakPolarHBondContact O-CD2 3.37Å; I907-Y910 PolarHBondContact O-N 2.88Å; K908-Y910 PolarHBondContact O-N 2.94Å; Y910-L935 HydrophobicContact CD1-CD1 3.73Å; Y910-L935 HydrophobicContact CD2-CD1 4.07Å; Y910-L935 HydrophobicContact CE1-CD1 3.45Å; Y910-L935 VanDerWaalsContact CE1-CD1 3.45Å; Y910-L935 HydrophobicContact CE2-CD1 3.81Å; Y910-L935 HydrophobicContact CG-CD1 4.03Å; Y910-L935 VanDerWaalsContact CZ-CD1 3.48Å; Y910-V938 HydrophobicContact CE1-CB 4.24Å; Y910-V938 HydrophobicContact CE1-CG1 3.9Å; Y910-C939 HydrophobicContact CD1-CB 4.24Å; Y910-C939 PolarHBondContact O-SG 3.36Å
911	Y	76.8	Confident	77.5	Confident	117 Å²	117	52.2 Å²	52.2	46%	0.459	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	0.5	-178.3	-59.8	-83	0	0	0	113.5	R874 K908 A909	R874-Y911 HydrophobicContact CB-CE2 4.49Å; R874-Y911 VanDerWaalsContact CB-OH 3.3Å; R874-Y911 WeakPolarHBondContact CB-OH 3.33Å; K908-Y911 PolarHBondContact O-N 2.96Å; A909-Y911 PolarHBondContact O-N 3.42Å
912	L	77.9	Confident	77.4	Confident	58 Å²	58	50.2 Å²	50.2	30%	0.304	24%	0.235	S	C	.	.			trans	-75.8	151.7	-177.9	-68.6	176	0	0	0	112.7	A909 D916 M917 W920	A909-L912 HydrophobicContact CB-CD1 4.15Å; A909-L912 PolarHBondContact O-N 3.48Å; L912-D916 HydrophobicContact CB-CB 4.47Å; L912-D916 HydrophobicContact CD2-CB 4.24Å; L912-M917 HydrophobicContact CB-CG 3.75Å; L912-M917 HydrophobicContact CB-SD 4.48Å; L912-W920 HydrophobicContact CD1-CB 3.87Å; L912-W920 HydrophobicContact CD1-CD2 4.29Å; L912-W920 HydrophobicContact CD1-CG 3.68Å
913	T	73.8	Confident	77.2	Confident	82 Å²	82	56.6 Å²	56.6	50%	0.503	26%	0.264	S	S	.	.			trans	-80.4	166.4	173.8	76.1	0	0	0	0	111.8	N915 D916 M917	T913-N915 VanDerWaalsContact C-N 3.32Å; T913-N915 PolarHBondContact O-N 3.02Å; T913-D916 PolarHBondContact O-N 2.97Å; T913-D916 PolarHBondContact OG1-OD2 3.13Å; T913-M917 WeakPolarHBondContact O-CB 3.48Å; T913-M917 WeakPolarHBondContact O-CG 3.29Å; T913-M917 PolarHBondContact O-N 3.13Å
914	E	67.1	Low	76.9	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.332	27%	0.274	S	S	.	.	H	α-helix	trans	-53.9	-43.8	-177.7	-174	-176.7	161.9	0	0	113.4	E918 I944 A948	E914-E918 PolarHBondContact O-N 2.91Å; E914-I944 HydrophobicContact CB-CD1 4.11Å; E914-A948 HydrophobicContact CG-CB 4.44Å; E914-A948 WeakPolarHBondContact OE1-CB 3.39Å
915	N	70.6	Confident	76.1	Confident	106 Å²	106	65.7 Å²	65.7	57%	0.567	30%	0.298	S	S	*	.	H	α-helix	trans	-74	-33.5	-177.7	-69	-33.6	0	0	0	112.5	T913	T913-N915 VanDerWaalsContact C-N 3.32Å; T913-N915 PolarHBondContact O-N 3.02Å
916	D	77.1	Confident	75.5	Confident	63 Å²	63	70.3 Å²	70.3	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-77.3	-32.6	179.1	-58.7	-39.7	0	0	0	111	L912 T913 R919 W920	L912-D916 HydrophobicContact CB-CB 4.47Å; L912-D916 HydrophobicContact CD2-CB 4.24Å; T913-D916 PolarHBondContact O-N 2.97Å; T913-D916 PolarHBondContact OG1-OD2 3.13Å; D916-R919 PolarHBondContact O-N 3.32Å; D916-R919 IonicContact OD1-NH1 2.75Å; D916-W920 VanDerWaalsContact O-CB 3.25Å; D916-W920 WeakPolarHBondContact O-CB 3.39Å; D916-W920 PolarHBondContact O-N 3.41Å
917	M	73.1	Confident	75.3	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-42.6	171.4	-80.4	-101.2	-79.4	0	0	112.3	L912 T913 R919 W920 I921 V936 C939 L940	L912-M917 HydrophobicContact CB-CG 3.75Å; L912-M917 HydrophobicContact CB-SD 4.48Å; T913-M917 WeakPolarHBondContact O-CB 3.48Å; T913-M917 WeakPolarHBondContact O-CG 3.29Å; T913-M917 PolarHBondContact O-N 3.13Å; M917-R919 VanDerWaalsContact C-N 3.29Å; M917-R919 PolarHBondContact O-N 3.44Å; M917-W920 PolarHBondContact O-N 2.93Å; M917-I921 WeakPolarHBondContact O-CB 3.28Å; M917-I921 WeakPolarHBondContact O-CD1 2.95Å; M917-I921 VanDerWaalsContact O-CG1 3.23Å; M917-I921 WeakPolarHBondContact O-CG1 3.37Å; M917-I921 PolarHBondContact O-N 3.45Å; M917-V936 HydrophobicContact CE-CG2 4.16Å; M917-C939 HydrophobicContact CE-CB 4.2Å; M917-L940 HydrophobicContact CE-CD1 3.91Å; M917-L940 HydrophobicContact CE-CD2 4.34Å; M917-L940 HydrophobicContact CE-CG 4.14Å
918	E	73.4	Confident	75.1	Confident	43 Å²	43	73.3 Å²	73.3	20%	0.201	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-35.2	177.9	-162.2	-170.6	141.5	0	0	112	E914 K922 K951 L952	E914-E918 PolarHBondContact O-N 2.91Å; E918-K922 WeakPolarHBondContact O-CG 3.48Å; E918-K922 IonicContact OE1-NZ 2.79Å; E918-K922 PolarHBondContact OE1-NZ 3.01Å; E918-K951 IonicContact OE2-NZ 3.39Å; E918-K951 PolarHBondContact OE2-NZ 3.2Å; E918-L952 HydrophobicContact CB-CD2 3.83Å; E918-L952 HydrophobicContact CG-CD2 4.16Å
919	R	76.3	Confident	74.7	Confident	156 Å²	156	70 Å²	70	59%	0.589	33%	0.326	S	S	*	.	H	α-helix	trans	-73	-45	174.8	-67.2	-179.3	-171.3	151.5	0.7	111.5	D916 M917 I921 K922 E923	D916-R919 PolarHBondContact O-N 3.32Å; D916-R919 IonicContact OD1-NH1 2.75Å; M917-R919 VanDerWaalsContact C-N 3.29Å; M917-R919 PolarHBondContact O-N 3.44Å; R919-I921 VanDerWaalsContact C-N 3.34Å; R919-I921 PolarHBondContact O-N 3.14Å; R919-K922 PolarHBondContact O-N 3.29Å; R919-E923 WeakPolarHBondContact O-CG 3.34Å; R919-E923 PolarHBondContact O-N 2.87Å
920	W	81.1	Confident	74.6	Confident	22 Å²	22	77.7 Å²	77.7	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-43.4	180	-172	86.3	0	0	0	112.2	Y906 A909 L912 D916 M917 K922 E923 H924 Y927 L932 L935	Y906-W920 HydrophobicContact CD2-CH2 4.34Å; A909-W920 HydrophobicContact CB-CD2 4.14Å; A909-W920 HydrophobicContact CB-CE3 4.28Å; A909-W920 HydrophobicContact CB-CH2 3.89Å; A909-W920 HydrophobicContact CB-CZ2 3.74Å; A909-W920 HydrophobicContact CB-CZ3 4.16Å; L912-W920 HydrophobicContact CD1-CB 3.87Å; L912-W920 HydrophobicContact CD1-CD2 4.29Å; L912-W920 HydrophobicContact CD1-CG 3.68Å; D916-W920 VanDerWaalsContact O-CB 3.25Å; D916-W920 WeakPolarHBondContact O-CB 3.39Å; D916-W920 PolarHBondContact O-N 3.41Å; M917-W920 PolarHBondContact O-N 2.93Å; W920-K922 VanDerWaalsContact C-N 3.27Å; W920-K922 PolarHBondContact O-N 2.97Å; W920-E923 PolarHBondContact O-N 2.88Å; W920-H924 AromaticContact CD1-CD2 3.31Å; W920-H924 AromaticContact CD1-NE2 3.5Å; W920-H924 AromaticContact CD2-CD2 3.78Å; W920-H924 AromaticContact CE2-CD2 3.41Å; W920-H924 VanDerWaalsContact CE2-CD2 3.41Å; W920-H924 AromaticContact CE2-NE2 3.94Å; W920-H924 AromaticContact CG-CD2 3.72Å; W920-H924 HydrophobicContact CZ2-CB 4.44Å; W920-H924 AromaticContact NE1-CD2 3.1Å; W920-H924 PolarHBondContact NE1-CD2 2.93Å; W920-H924 AromaticContact NE1-NE2 3.2Å; W920-H924 PolarHBondContact NE1-NE2 2.92Å; W920-H924 VanDerWaalsContact NE1-NE2 3.2Å; W920-H924 PolarHBondContact O-CD2 3.44Å; W920-H924 PolarHBondContact O-N 3.42Å; W920-Y927 AromaticContact CH2-CD2 3.64Å; W920-Y927 HydrophobicContact CH2-CD2 3.64Å; W920-Y927 AromaticContact CH2-CE2 3.34Å; W920-Y927 HydrophobicContact CH2-CE2 3.34Å; W920-Y927 HydrophobicContact CH2-CG 4.46Å; W920-Y927 AromaticContact CH2-CZ 3.95Å; W920-Y927 HydrophobicContact CZ2-CD2 4.24Å; W920-Y927 AromaticContact CZ2-CE2 3.51Å; W920-Y927 HydrophobicContact CZ2-CE2 3.51Å; W920-Y927 HydrophobicContact CZ3-CD2 4.3Å; W920-Y927 HydrophobicContact CZ3-CE2 4.36Å; W920-L932 HydrophobicContact CH2-CD2 4.37Å; W920-L932 HydrophobicContact CZ3-CD2 3.65Å; W920-L935 HydrophobicContact CE3-CD2 4.48Å; W920-L935 HydrophobicContact CH2-CD2 4.05Å; W920-L935 HydrophobicContact CZ3-CD2 3.68Å
921	I	76.3	Confident	74.9	Confident	4 Å²	4	78.8 Å²	78.8	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-62	-34.5	175.8	-70.1	166.6	0	0	0	111.7	M917 R919 V936 L952 I956 I959	M917-I921 WeakPolarHBondContact O-CB 3.28Å; M917-I921 WeakPolarHBondContact O-CD1 2.95Å; M917-I921 VanDerWaalsContact O-CG1 3.23Å; M917-I921 WeakPolarHBondContact O-CG1 3.37Å; M917-I921 PolarHBondContact O-N 3.45Å; R919-I921 VanDerWaalsContact C-N 3.34Å; R919-I921 PolarHBondContact O-N 3.14Å; I921-V936 HydrophobicContact CD1-CG2 3.99Å; I921-L952 HydrophobicContact CD1-CD2 4.46Å; I921-I956 HydrophobicContact CD1-CD1 4.24Å; I921-I956 HydrophobicContact CD1-CG1 4.25Å; I921-I956 HydrophobicContact CG2-CG1 3.8Å; I921-I959 HydrophobicContact CG2-CD1 3.57Å; I921-I959 WeakPolarHBondContact O-CD1 3.04Å
922	K	74.8	Confident	74.9	Confident	112 Å²	112	73.8 Å²	73.8	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-77	-30.7	178.3	-71	174.2	-170.9	167.9	0	112.8	E918 R919 W920 I959	E918-K922 WeakPolarHBondContact O-CG 3.48Å; E918-K922 IonicContact OE1-NZ 2.79Å; E918-K922 PolarHBondContact OE1-NZ 3.01Å; R919-K922 PolarHBondContact O-N 3.29Å; W920-K922 VanDerWaalsContact C-N 3.27Å; W920-K922 PolarHBondContact O-N 2.97Å; K922-I959 HydrophobicContact CG-CD1 4.41Å
923	E	77.4	Confident	74.8	Confident	143 Å²	143	72.8 Å²	72.8	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-81.5	-37.7	-179.4	-73.1	174.2	-178.1	0	0	112.5	R919 W920 R925	R919-E923 WeakPolarHBondContact O-CG 3.34Å; R919-E923 PolarHBondContact O-N 2.87Å; W920-E923 PolarHBondContact O-N 2.88Å; E923-R925 PolarHBondContact O-N 3.4Å
924	H	74.1	Confident	74.9	Confident	45 Å²	45	71.2 Å²	71.2	21%	0.208	33%	0.331	C	S	.	.			trans	-100.2	88.8	-175.7	-67.9	-79.6	0	0	0	113.2	W920 E926 Y927	W920-H924 AromaticContact CD1-CD2 3.31Å; W920-H924 AromaticContact CD1-NE2 3.5Å; W920-H924 AromaticContact CD2-CD2 3.78Å; W920-H924 AromaticContact CE2-CD2 3.41Å; W920-H924 VanDerWaalsContact CE2-CD2 3.41Å; W920-H924 AromaticContact CE2-NE2 3.94Å; W920-H924 AromaticContact CG-CD2 3.72Å; W920-H924 HydrophobicContact CZ2-CB 4.44Å; W920-H924 AromaticContact NE1-CD2 3.1Å; W920-H924 PolarHBondContact NE1-CD2 2.93Å; W920-H924 AromaticContact NE1-NE2 3.2Å; W920-H924 PolarHBondContact NE1-NE2 2.92Å; W920-H924 VanDerWaalsContact NE1-NE2 3.2Å; W920-H924 PolarHBondContact O-CD2 3.44Å; W920-H924 PolarHBondContact O-N 3.42Å; H924-E926 VanDerWaalsContact C-N 3.26Å; H924-E926 PolarHBondContact O-N 3.1Å; H924-Y927 HydrophobicContact CB-CD2 3.86Å; H924-Y927 HydrophobicContact CB-CE2 3.77Å
925	R	66.6	Low	75.3	Confident	199 Å²	199	67.9 Å²	67.9	75%	0.751	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	3.5	176.4	-62.9	-174	177.1	-160.7	-4.2	115	E923	E923-R925 PolarHBondContact O-N 3.4Å
926	E	70.5	Confident	75.5	Confident	134 Å²	134	62.9 Å²	62.9	63%	0.626	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-15	-173.4	-61	173.7	178.8	0	0	112.9	F902 H924	F902-E926 HydrophobicContact CD2-CB 4.26Å; F902-E926 HydrophobicContact CE2-CB 3.94Å; H924-E926 VanDerWaalsContact C-N 3.26Å; H924-E926 PolarHBondContact O-N 3.1Å
927	Y	78.5	Confident	75.3	Confident	12 Å²	12	62.1 Å²	62.1	5%	0.047	29%	0.285	C	S	.	.	S	Bend	trans	-94	145.5	-179.9	-59	-75.7	0	0	0	111.8	V860 F902 T905 Y906 W920 H924 L932	V860-Y927 HydrophobicContact CG1-CD1 4.23Å; V860-Y927 HydrophobicContact CG1-CE1 4.18Å; F902-Y927 HydrophobicContact CD1-CE1 4.37Å; F902-Y927 HydrophobicContact CD2-CD1 4.33Å; F902-Y927 AromaticContact CD2-CE1 3.65Å; F902-Y927 HydrophobicContact CD2-CE1 3.65Å; F902-Y927 AromaticContact CD2-CZ 3.82Å; F902-Y927 HydrophobicContact CE1-CD1 4.39Å; F902-Y927 HydrophobicContact CE1-CE1 4Å; F902-Y927 AromaticContact CE2-CD1 3.45Å; F902-Y927 HydrophobicContact CE2-CD1 3.45Å; F902-Y927 VanDerWaalsContact CE2-CD1 3.45Å; F902-Y927 AromaticContact CE2-CE1 3.2Å; F902-Y927 HydrophobicContact CE2-CE1 3.2Å; F902-Y927 HydrophobicContact CE2-CE2 4.42Å; F902-Y927 HydrophobicContact CE2-CG 4.16Å; F902-Y927 AromaticContact CE2-CZ 3.75Å; F902-Y927 HydrophobicContact CG-CE1 4.21Å; F902-Y927 AromaticContact CZ-CD1 3.48Å; F902-Y927 HydrophobicContact CZ-CD1 3.48Å; F902-Y927 VanDerWaalsContact CZ-CD1 3.48Å; F902-Y927 AromaticContact CZ-CE1 3.4Å; F902-Y927 HydrophobicContact CZ-CE1 3.4Å; F902-Y927 HydrophobicContact CZ-CG 4.49Å; F902-Y927 PolarHBondContact O-OH 3.42Å; T905-Y927 PolarHBondContact OG1-OH 2.97Å; Y906-Y927 AromaticContact CD2-CD1 3.75Å; Y906-Y927 HydrophobicContact CD2-CD1 3.75Å; Y906-Y927 AromaticContact CD2-CE1 3.53Å; Y906-Y927 HydrophobicContact CD2-CE1 3.53Å; Y906-Y927 HydrophobicContact CD2-CG 4.45Å; Y906-Y927 HydrophobicContact CE2-CD1 4.28Å; Y906-Y927 HydrophobicContact CE2-CE1 4.48Å; Y906-Y927 HydrophobicContact CG-CE1 4.1Å; Y906-Y927 PolarHBondContact N-OH 3.37Å; W920-Y927 AromaticContact CH2-CD2 3.64Å; W920-Y927 HydrophobicContact CH2-CD2 3.64Å; W920-Y927 AromaticContact CH2-CE2 3.34Å; W920-Y927 HydrophobicContact CH2-CE2 3.34Å; W920-Y927 HydrophobicContact CH2-CG 4.46Å; W920-Y927 AromaticContact CH2-CZ 3.95Å; W920-Y927 HydrophobicContact CZ2-CD2 4.24Å; W920-Y927 AromaticContact CZ2-CE2 3.51Å; W920-Y927 HydrophobicContact CZ2-CE2 3.51Å; W920-Y927 HydrophobicContact CZ3-CD2 4.3Å; W920-Y927 HydrophobicContact CZ3-CE2 4.36Å; H924-Y927 HydrophobicContact CB-CD2 3.86Å; H924-Y927 HydrophobicContact CB-CE2 3.77Å; Y927-L932 HydrophobicContact CD2-CD2 4.31Å; Y927-L932 HydrophobicContact CG-CD2 4.33Å
928	S	75.6	Confident	75.1	Confident	57 Å²	57	62.7 Å²	62.7	40%	0.399	29%	0.288	S	S	.	.			trans	-67	147.7	175.4	177.2	0	0	0	0	111.6	K930 Q931 L932	S928-K930 PolarHBondContact O-N 2.98Å; S928-K930 VanDerWaalsContact O-N 3.12Å; S928-K930 PolarHBondContact OG-N 3.17Å; S928-Q931 WeakPolarHBondContact O-CA 3.07Å; S928-Q931 WeakPolarHBondContact O-CB 3.34Å; S928-Q931 PolarHBondContact O-N 3.2Å; S928-L932 PolarHBondContact O-N 2.73Å
929	T	74.4	Confident	74.4	Confident	43 Å²	43	61.2 Å²	61.2	26%	0.264	28%	0.282	S	S	.	.	H	α-helix	trans	-48.8	-40.3	172.2	-30.5	0	0	0	0	111.3	L932 T933 I956 D960	T929-L932 PolarHBondContact O-N 3.35Å; T929-T933 WeakPolarHBondContact O-CB 3.45Å; T929-T933 PolarHBondContact O-N 2.95Å; T929-T933 PolarHBondContact O-OG1 3.22Å; T929-I956 HydrophobicContact CG2-CG2 3.42Å; T929-I956 VanDerWaalsContact CG2-CG2 3.42Å; T929-D960 WeakPolarHBondContact CG2-OD2 2.96Å; T929-D960 PolarHBondContact OG1-OD2 2.98Å
930	K	77.6	Confident	73.5	Confident	162 Å²	162	54.4 Å²	54.4	70%	0.704	26%	0.258	S	S	*	.	H	α-helix	trans	-63.5	-42.9	175.8	-66.7	-179.6	-178.7	174.6	0	112.8	S928 N934	S928-K930 PolarHBondContact O-N 2.98Å; S928-K930 VanDerWaalsContact O-N 3.12Å; S928-K930 PolarHBondContact OG-N 3.17Å; K930-N934 WeakPolarHBondContact O-CB 3.48Å; K930-N934 VanDerWaalsContact O-CG 3.28Å; K930-N934 PolarHBondContact O-N 3.4Å
931	Q	79	Confident	72.2	Confident	26 Å²	26	56.5 Å²	56.5	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-67.6	-38.4	-179.8	-67.3	169.8	-20.2	0	0	111.4	A864 Y906 S928 L935	A864-Q931 HydrophobicContact CB-CB 4.03Å; A864-Q931 HydrophobicContact CB-CG 3.79Å; Y906-Q931 HydrophobicContact CE2-CB 4.42Å; Y906-Q931 PolarHBondContact OH-O 3.27Å; Y906-Q931 VanDerWaalsContact OH-O 3.09Å; S928-Q931 WeakPolarHBondContact O-CA 3.07Å; S928-Q931 WeakPolarHBondContact O-CB 3.34Å; S928-Q931 PolarHBondContact O-N 3.2Å; Q931-L935 VanDerWaalsContact O-CB 3.28Å; Q931-L935 WeakPolarHBondContact O-CB 3.46Å; Q931-L935 PolarHBondContact O-N 2.84Å
932	L	77	Confident	71.1	Confident	11 Å²	11	60.3 Å²	60.3	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-70	-45.1	175.6	-65.4	175.1	0	0	0	111.7	W920 Y927 S928 T929 N934 L935 V936 I956	W920-L932 HydrophobicContact CH2-CD2 4.37Å; W920-L932 HydrophobicContact CZ3-CD2 3.65Å; Y927-L932 HydrophobicContact CD2-CD2 4.31Å; Y927-L932 HydrophobicContact CG-CD2 4.33Å; S928-L932 PolarHBondContact O-N 2.73Å; T929-L932 PolarHBondContact O-N 3.35Å; L932-N934 VanDerWaalsContact C-N 3.32Å; L932-N934 PolarHBondContact O-N 3.25Å; L932-L935 PolarHBondContact O-N 3.27Å; L932-V936 WeakPolarHBondContact O-CG2 3.23Å; L932-V936 PolarHBondContact O-N 3.35Å; L932-I956 HydrophobicContact CB-CD1 3.95Å; L932-I956 HydrophobicContact CB-CG1 4.36Å
933	T	76.6	Confident	70.2	Confident	37 Å²	37	62.5 Å²	62.5	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-43.9	175.3	-62.9	0	0	0	0	111.4	T929 V936 N937 L953	T929-T933 WeakPolarHBondContact O-CB 3.45Å; T929-T933 PolarHBondContact O-N 2.95Å; T929-T933 PolarHBondContact O-OG1 3.22Å; T933-V936 PolarHBondContact O-N 3.4Å; T933-N937 WeakPolarHBondContact O-CB 3.5Å; T933-N937 PolarHBondContact O-N 2.72Å; T933-N937 PolarHBondContact O-ND2 3.07Å; T933-L953 HydrophobicContact CG2-CD2 3.84Å
934	N	75.9	Confident	69.2	Low	50 Å²	50	59 Å²	59	27%	0.267	31%	0.309	S	S	.	.	H	α-helix	trans	-70.7	-38.2	179.1	-71	-12.2	0	0	0	112.6	A864 K930 L932 V936 N937 V938	A864-N934 WeakPolarHBondContact O-CB 3.36Å; A864-N934 PolarHBondContact O-ND2 3.05Å; K930-N934 WeakPolarHBondContact O-CB 3.48Å; K930-N934 VanDerWaalsContact O-CG 3.28Å; K930-N934 PolarHBondContact O-N 3.4Å; L932-N934 VanDerWaalsContact C-N 3.32Å; L932-N934 PolarHBondContact O-N 3.25Å; N934-V936 VanDerWaalsContact C-N 3.34Å; N934-V936 PolarHBondContact O-N 3.35Å; N934-N937 PolarHBondContact O-N 3.39Å; N934-N937 VanDerWaalsContact O-N 3.13Å; N934-V938 VanDerWaalsContact O-CG2 3.29Å; N934-V938 WeakPolarHBondContact O-CG2 3.25Å; N934-V938 PolarHBondContact O-N 3.34Å
935	L	76.4	Confident	68.7	Low	1 Å²	1	62.7 Å²	62.7	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-57.1	-47.6	173.1	-176.9	66.1	0	0	0	111.1	Y906 A909 Y910 W920 Q931 L932 N937 V938 C939	Y906-L935 HydrophobicContact CD2-CD2 4.38Å; Y906-L935 HydrophobicContact CE1-CD1 4.26Å; Y906-L935 HydrophobicContact CE2-CB 4.25Å; Y906-L935 HydrophobicContact CE2-CD1 4.3Å; Y906-L935 HydrophobicContact CE2-CD2 3.99Å; Y906-L935 HydrophobicContact CE2-CG 4.42Å; A909-L935 HydrophobicContact CB-CD2 3.82Å; Y910-L935 HydrophobicContact CD1-CD1 3.73Å; Y910-L935 HydrophobicContact CD2-CD1 4.07Å; Y910-L935 HydrophobicContact CE1-CD1 3.45Å; Y910-L935 VanDerWaalsContact CE1-CD1 3.45Å; Y910-L935 HydrophobicContact CE2-CD1 3.81Å; Y910-L935 HydrophobicContact CG-CD1 4.03Å; Y910-L935 VanDerWaalsContact CZ-CD1 3.48Å; W920-L935 HydrophobicContact CE3-CD2 4.48Å; W920-L935 HydrophobicContact CH2-CD2 4.05Å; W920-L935 HydrophobicContact CZ3-CD2 3.68Å; Q931-L935 VanDerWaalsContact O-CB 3.28Å; Q931-L935 WeakPolarHBondContact O-CB 3.46Å; Q931-L935 PolarHBondContact O-N 2.84Å; L932-L935 PolarHBondContact O-N 3.27Å; L935-N937 VanDerWaalsContact C-N 3.31Å; L935-N937 PolarHBondContact O-N 3.1Å; L935-V938 PolarHBondContact O-N 3.47Å; L935-C939 WeakPolarHBondContact O-CB 3.46Å; L935-C939 PolarHBondContact O-N 2.99Å
936	V	73.6	Confident	68.8	Low	1 Å²	1	61.2 Å²	61.2	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-38.6	175.8	171.5	0	0	0	0	111.2	M917 I921 L932 T933 N934 L940 R949 L952 L953 I956	M917-V936 HydrophobicContact CE-CG2 4.16Å; I921-V936 HydrophobicContact CD1-CG2 3.99Å; L932-V936 WeakPolarHBondContact O-CG2 3.23Å; L932-V936 PolarHBondContact O-N 3.35Å; T933-V936 PolarHBondContact O-N 3.4Å; N934-V936 VanDerWaalsContact C-N 3.34Å; N934-V936 PolarHBondContact O-N 3.35Å; V936-L940 HydrophobicContact CB-CD1 4.45Å; V936-L940 HydrophobicContact CG1-CD1 3.74Å; V936-L940 VanDerWaalsContact O-CB 3.3Å; V936-L940 WeakPolarHBondContact O-CB 3.3Å; V936-L940 WeakPolarHBondContact O-CD1 3.41Å; V936-L940 WeakPolarHBondContact O-CG 3.44Å; V936-L940 PolarHBondContact O-N 3.44Å; V936-R949 HydrophobicContact CG1-CG 4.47Å; V936-L952 HydrophobicContact CG1-CB 4.15Å; V936-L953 HydrophobicContact CG1-CD2 4.32Å; V936-L953 HydrophobicContact CG1-CG 4.47Å; V936-I956 HydrophobicContact CG2-CD1 3.9Å
937	N	72.6	Confident	68.7	Low	46 Å²	46	62.9 Å²	62.9	25%	0.246	34%	0.335	C	S	.	.	H	α-helix	trans	-69.5	-36.4	179.3	-70.5	-31.1	0	0	0	113.4	T933 N934 L935 R949	T933-N937 WeakPolarHBondContact O-CB 3.5Å; T933-N937 PolarHBondContact O-N 2.72Å; T933-N937 PolarHBondContact O-ND2 3.07Å; N934-N937 PolarHBondContact O-N 3.39Å; N934-N937 VanDerWaalsContact O-N 3.13Å; L935-N937 VanDerWaalsContact C-N 3.31Å; L935-N937 PolarHBondContact O-N 3.1Å; N937-R949 VanDerWaalsContact OD1-CZ 3.28Å; N937-R949 PolarHBondContact OD1-NE 3.01Å; N937-R949 VanDerWaalsContact OD1-NE 3.1Å; N937-R949 PolarHBondContact OD1-NH2 3.41Å
938	V	69.5	Low	68.2	Low	12 Å²	12	62.8 Å²	62.8	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-85.9	-42	-177.3	177	0	0	0	0	112.1	V866 C869 Y910 N934 L935 L940	V866-V938 WeakPolarHBondContact O-CG2 3.4Å; C869-V938 HydrophobicContact CB-CG1 3.73Å; Y910-V938 HydrophobicContact CE1-CB 4.24Å; Y910-V938 HydrophobicContact CE1-CG1 3.9Å; N934-V938 VanDerWaalsContact O-CG2 3.29Å; N934-V938 WeakPolarHBondContact O-CG2 3.25Å; N934-V938 PolarHBondContact O-N 3.34Å; L935-V938 PolarHBondContact O-N 3.47Å; V938-L940 PolarHBondContact O-N 3.28Å
939	C	59.3	Low	67.9	Low	12 Å²	12	65.3 Å²	65.3	8%	0.081	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-31.7	-178.6	-164.9	0	0	0	0	111.7	Y910 M917 L935	Y910-C939 HydrophobicContact CD1-CB 4.24Å; Y910-C939 PolarHBondContact O-SG 3.36Å; M917-C939 HydrophobicContact CE-CB 4.2Å; L935-C939 WeakPolarHBondContact O-CB 3.46Å; L935-C939 PolarHBondContact O-N 2.99Å
940	L	57.4	Low	67.9	Low	14 Å²	14	69 Å²	69	7%	0.073	35%	0.352	C	S	.	.	S	Bend	trans	-114.1	2.4	-167	-54.4	169	0	0	0	114.7	M917 V936 V938 S942 I944 L952	M917-L940 HydrophobicContact CE-CD1 3.91Å; M917-L940 HydrophobicContact CE-CD2 4.34Å; M917-L940 HydrophobicContact CE-CG 4.14Å; V936-L940 HydrophobicContact CB-CD1 4.45Å; V936-L940 HydrophobicContact CG1-CD1 3.74Å; V936-L940 VanDerWaalsContact O-CB 3.3Å; V936-L940 WeakPolarHBondContact O-CB 3.3Å; V936-L940 WeakPolarHBondContact O-CD1 3.41Å; V936-L940 WeakPolarHBondContact O-CG 3.44Å; V936-L940 PolarHBondContact O-N 3.44Å; V938-L940 PolarHBondContact O-N 3.28Å; L940-S942 VanDerWaalsContact C-N 3.27Å; L940-S942 PolarHBondContact O-N 3.12Å; L940-I944 HydrophobicContact CD2-CB 4.34Å; L940-I944 HydrophobicContact CD2-CD1 3.51Å; L940-I944 HydrophobicContact CD2-CG1 4.44Å; L940-L952 HydrophobicContact CD1-CD1 3.59Å
941	G	53.5	Low	67.9	Low	65 Å²	65	66.7 Å²	66.7	67%	0.67	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.2	-176.6	0	0	0	0	0	115.4
942	S	53.5	Low	67.6	Low	84 Å²	84	65.6 Å²	65.6	59%	0.587	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-15	-176.4	28.8	0	0	0	0	114.9	L940	L940-S942 VanDerWaalsContact C-N 3.27Å; L940-S942 PolarHBondContact O-N 3.12Å
943	H	55.2	Low	67.7	Low	159 Å²	159	67.2 Å²	67.2	74%	0.736	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	-1.5	-166.9	-73.7	-72.6	0	0	0	117.9
944	I	57.4	Low	67.7	Low	68 Å²	68	67.7 Å²	67.7	35%	0.349	35%	0.353	S	S	.	.			trans	-136.5	156.2	-171.6	-90.5	166.9	0	0	0	116	E914 L940 A948	E914-I944 HydrophobicContact CB-CD1 4.11Å; L940-I944 HydrophobicContact CD2-CB 4.34Å; L940-I944 HydrophobicContact CD2-CD1 3.51Å; L940-I944 HydrophobicContact CD2-CG1 4.44Å; I944-A948 HydrophobicContact CG2-CB 3.6Å
945	N	62.7	Low	67.7	Low	124 Å²	124	65.9 Å²	65.9	66%	0.663	35%	0.345	S	S	*	.			trans	-68.6	140.2	-176.9	-156.4	-9.6	0	0	0	113.1	K947 A948 R949	N945-K947 PolarHBondContact O-N 3.33Å; N945-A948 WeakPolarHBondContact O-CB 3.42Å; N945-A948 PolarHBondContact O-N 3.04Å; N945-R949 PolarHBondContact O-N 3.09Å
946	K	68.1	Low	67.6	Low	168 Å²	168	66 Å²	66	73%	0.73	35%	0.346	S	S	*	.	H	α-helix	trans	-55.7	-29.7	-174.8	-168.6	175.8	-179.8	-179.9	0	113.9	Q950	K946-Q950 PolarHBondContact O-N 3.37Å
947	K	69.2	Low	67.6	Low	169 Å²	169	70.8 Å²	70.8	74%	0.735	37%	0.371	S	S	*	.	H	α-helix	trans	-71.5	-36.4	179.4	-167.1	176.7	-178.5	-179.5	0	113.3	N945 Q950 K951	N945-K947 PolarHBondContact O-N 3.33Å; K947-Q950 PolarHBondContact O-N 3.16Å; K947-K951 PolarHBondContact O-N 3.43Å; K947-K951 VanDerWaalsContact O-N 3.15Å
948	A	67.5	Low	67.6	Low	9 Å²	9	73.8 Å²	73.8	7%	0.074	39%	0.387	C	S	.	.	H	α-helix	trans	-68.9	-41.9	177.7	0	0	0	0	0	111.7	E914 I944 N945 Q950 K951 L952	E914-A948 HydrophobicContact CG-CB 4.44Å; E914-A948 WeakPolarHBondContact OE1-CB 3.39Å; I944-A948 HydrophobicContact CG2-CB 3.6Å; N945-A948 WeakPolarHBondContact O-CB 3.42Å; N945-A948 PolarHBondContact O-N 3.04Å; A948-Q950 VanDerWaalsContact C-N 3.34Å; A948-Q950 PolarHBondContact O-N 3.43Å; A948-K951 WeakPolarHBondContact O-CB 3.35Å; A948-K951 PolarHBondContact O-N 2.98Å; A948-K951 VanDerWaalsContact O-N 3.14Å; A948-L952 PolarHBondContact O-N 3.28Å
949	R	70.1	Confident	67.4	Low	110 Å²	110	76.5 Å²	76.5	42%	0.415	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-43.4	174	-176.7	176.8	174.7	-167.7	-3.8	112.2	V936 N937 N945 K951 L952 L953	V936-R949 HydrophobicContact CG1-CG 4.47Å; N937-R949 VanDerWaalsContact OD1-CZ 3.28Å; N937-R949 PolarHBondContact OD1-NE 3.01Å; N937-R949 VanDerWaalsContact OD1-NE 3.1Å; N937-R949 PolarHBondContact OD1-NH2 3.41Å; N945-R949 PolarHBondContact O-N 3.09Å; R949-K951 VanDerWaalsContact C-N 3.33Å; R949-K951 PolarHBondContact O-N 2.9Å; R949-L952 PolarHBondContact O-N 3.36Å; R949-L953 HydrophobicContact CG-CD1 4.18Å; R949-L953 VanDerWaalsContact O-CG 3.3Å; R949-L953 WeakPolarHBondContact O-CG 3.37Å; R949-L953 PolarHBondContact O-N 3.31Å
950	Q	74.1	Confident	67.3	Low	122 Å²	122	80.8 Å²	80.8	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-64.8	-36.5	176.2	-75.6	179.4	-22.6	0	0	112.4	K946 K947 A948 A954	K946-Q950 PolarHBondContact O-N 3.37Å; K947-Q950 PolarHBondContact O-N 3.16Å; A948-Q950 VanDerWaalsContact C-N 3.34Å; A948-Q950 PolarHBondContact O-N 3.43Å; Q950-A954 WeakPolarHBondContact O-CB 3.3Å; Q950-A954 PolarHBondContact O-N 3.43Å
951	K	77.1	Confident	67.1	Low	113 Å²	113	88.9 Å²	88.9	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-65.3	-42.7	176.5	-168.2	-169.6	-179.5	-139.5	0	112.2	E918 K947 A948 R949 A954 A955	E918-K951 IonicContact OE2-NZ 3.39Å; E918-K951 PolarHBondContact OE2-NZ 3.2Å; K947-K951 PolarHBondContact O-N 3.43Å; K947-K951 VanDerWaalsContact O-N 3.15Å; A948-K951 WeakPolarHBondContact O-CB 3.35Å; A948-K951 PolarHBondContact O-N 2.98Å; A948-K951 VanDerWaalsContact O-N 3.14Å; R949-K951 VanDerWaalsContact C-N 3.33Å; R949-K951 PolarHBondContact O-N 2.9Å; K951-A954 PolarHBondContact O-N 3.03Å; K951-A955 PolarHBondContact O-N 3.44Å
952	L	74	Confident	66.7	Low	2 Å²	2	91.4 Å²	91.4	1%	0.01	46%	0.457	C	S	.	.	H	α-helix	trans	-69.8	-38.4	177.9	-69	171.9	0	0	0	112.4	E918 I921 V936 L940 A948 R949 A955 I956	E918-L952 HydrophobicContact CB-CD2 3.83Å; E918-L952 HydrophobicContact CG-CD2 4.16Å; I921-L952 HydrophobicContact CD1-CD2 4.46Å; V936-L952 HydrophobicContact CG1-CB 4.15Å; L940-L952 HydrophobicContact CD1-CD1 3.59Å; A948-L952 PolarHBondContact O-N 3.28Å; R949-L952 PolarHBondContact O-N 3.36Å; L952-A955 PolarHBondContact O-N 2.74Å; L952-I956 WeakPolarHBondContact O-CG1 3.39Å; L952-I956 PolarHBondContact O-N 2.78Å; L952-I956 VanDerWaalsContact O-N 3.12Å
953	L	77.6	Confident	66	Low	45 Å²	45	96.8 Å²	96.8	24%	0.236	47%	0.47	C	S	.	.	H	α-helix	trans	-64.2	-41.2	173.3	-69.7	173.3	0	0	0	111.6	T933 V936 R949 A955 I956 D957	T933-L953 HydrophobicContact CG2-CD2 3.84Å; V936-L953 HydrophobicContact CG1-CD2 4.32Å; V936-L953 HydrophobicContact CG1-CG 4.47Å; R949-L953 HydrophobicContact CG-CD1 4.18Å; R949-L953 VanDerWaalsContact O-CG 3.3Å; R949-L953 WeakPolarHBondContact O-CG 3.37Å; R949-L953 PolarHBondContact O-N 3.31Å; L953-A955 VanDerWaalsContact C-N 3.31Å; L953-A955 PolarHBondContact O-N 3.5Å; L953-I956 PolarHBondContact O-N 3.02Å; L953-I956 VanDerWaalsContact O-N 3.16Å; L953-D957 PolarHBondContact O-N 2.98Å
954	A	77.4	Confident	64.8	Low	47 Å²	47	104.3 Å²	104.3	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-36.9	173.8	0	0	0	0	0	112.5	Q950 K951 I956 D957 D958	Q950-A954 WeakPolarHBondContact O-CB 3.3Å; Q950-A954 PolarHBondContact O-N 3.43Å; K951-A954 PolarHBondContact O-N 3.03Å; A954-I956 VanDerWaalsContact C-N 3.29Å; A954-I956 PolarHBondContact O-N 3.5Å; A954-D957 PolarHBondContact O-N 3.41Å; A954-D958 PolarHBondContact O-N 3.48Å
955	A	74.5	Confident	65.1	Low	13 Å²	13	106.1 Å²	106.1	11%	0.107	50%	0.499	C	S	.	.	H	α-helix	trans	-66.4	-29.3	175.2	0	0	0	0	0	113.1	K951 L952 L953 I959	K951-A955 PolarHBondContact O-N 3.44Å; L952-A955 PolarHBondContact O-N 2.74Å; L953-A955 VanDerWaalsContact C-N 3.31Å; L953-A955 PolarHBondContact O-N 3.5Å; A955-I959 WeakPolarHBondContact O-CD1 3.3Å; A955-I959 VanDerWaalsContact O-CG1 3.3Å; A955-I959 WeakPolarHBondContact O-CG1 3.45Å
956	I	75.3	Confident	65.3	Low	3 Å²	3	105.2 Å²	105.2	2%	0.015	49%	0.49	C	S	.	.	H	α-helix	trans	-73	-44.5	173.2	-67.2	165.4	0	0	0	110.2	I921 T929 L932 V936 L952 L953 A954 D958 I959 D960	I921-I956 HydrophobicContact CD1-CD1 4.24Å; I921-I956 HydrophobicContact CD1-CG1 4.25Å; I921-I956 HydrophobicContact CG2-CG1 3.8Å; T929-I956 HydrophobicContact CG2-CG2 3.42Å; T929-I956 VanDerWaalsContact CG2-CG2 3.42Å; L932-I956 HydrophobicContact CB-CD1 3.95Å; L932-I956 HydrophobicContact CB-CG1 4.36Å; V936-I956 HydrophobicContact CG2-CD1 3.9Å; L952-I956 WeakPolarHBondContact O-CG1 3.39Å; L952-I956 PolarHBondContact O-N 2.78Å; L952-I956 VanDerWaalsContact O-N 3.12Å; L953-I956 PolarHBondContact O-N 3.02Å; L953-I956 VanDerWaalsContact O-N 3.16Å; A954-I956 VanDerWaalsContact C-N 3.29Å; A954-I956 PolarHBondContact O-N 3.5Å; I956-D958 VanDerWaalsContact C-N 3.29Å; I956-D958 PolarHBondContact O-N 3.14Å; I956-I959 WeakPolarHBondContact O-CB 3.44Å; I956-I959 PolarHBondContact O-N 3.15Å; I956-I959 VanDerWaalsContact O-N 3.09Å; I956-D960 PolarHBondContact O-N 3.01Å
957	D	74.3	Confident	65.1	Low	102 Å²	102	101.7 Å²	101.7	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-33.5	177.8	-72.4	-15.8	0	0	0	112.5	L953 A954 I959 D960 R961	L953-D957 PolarHBondContact O-N 2.98Å; A954-D957 PolarHBondContact O-N 3.41Å; D957-I959 VanDerWaalsContact C-N 3.28Å; D957-I959 PolarHBondContact O-N 3.37Å; D957-D960 PolarHBondContact O-N 3.45Å; D957-R961 PolarHBondContact O-N 2.75Å
958	D	70.9	Confident	64.9	Low	108 Å²	108	97.7 Å²	97.7	58%	0.578	46%	0.461	S	S	*	.	H	α-helix	trans	-70.1	-21.2	175.3	-82.5	-19.7	0	0	0	113.3	A954 I956	A954-D958 PolarHBondContact O-N 3.48Å; I956-D958 VanDerWaalsContact C-N 3.29Å; I956-D958 PolarHBondContact O-N 3.14Å
959	I	65.9	Low	64.7	Low	69 Å²	69	103.3 Å²	103.3	35%	0.354	49%	0.486	S	S	.	.	H	α-helix	trans	-79.8	-32.6	175.9	-69.3	165	0	0	0	111.4	I921 K922 A955 I956 D957 R961	I921-I959 HydrophobicContact CG2-CD1 3.57Å; I921-I959 WeakPolarHBondContact O-CD1 3.04Å; K922-I959 HydrophobicContact CG-CD1 4.41Å; A955-I959 WeakPolarHBondContact O-CD1 3.3Å; A955-I959 VanDerWaalsContact O-CG1 3.3Å; A955-I959 WeakPolarHBondContact O-CG1 3.45Å; I956-I959 WeakPolarHBondContact O-CB 3.44Å; I956-I959 PolarHBondContact O-N 3.15Å; I956-I959 VanDerWaalsContact O-N 3.09Å; D957-I959 VanDerWaalsContact C-N 3.28Å; D957-I959 PolarHBondContact O-N 3.37Å; I959-R961 VanDerWaalsContact C-N 3.33Å
960	D	57.3	Low	64.3	Low	103 Å²	103	102.8 Å²	102.8	55%	0.551	49%	0.49	S	S	*	.	H	α-helix	trans	-80.1	-15.3	-178.8	-138.8	-8.4	0	0	0	112.6	T929 I956 D957 P962	T929-D960 WeakPolarHBondContact CG2-OD2 2.96Å; T929-D960 PolarHBondContact OG1-OD2 2.98Å; I956-D960 PolarHBondContact O-N 3.01Å; D957-D960 PolarHBondContact O-N 3.45Å; D960-P962 WeakPolarHBondContact O-CD 3.46Å
961	R	53.8	Low	63.7	Low	184 Å²	184	101.4 Å²	101.4	69%	0.694	49%	0.485	S	S	*	.	S	Bend	trans	-69.3	118.8	172.1	-82.4	-177.2	172.6	177.8	-0.4	109.8	D957 I959 K963	D957-R961 PolarHBondContact O-N 2.75Å; I959-R961 VanDerWaalsContact C-N 3.33Å; R961-K963 PolarHBondContact O-N 3.04Å; R961-K963 VanDerWaalsContact O-N 3.1Å
962	P	44.1	Very low	62.6	Low	117 Å²	117	100.5 Å²	100.5	76%	0.76	48%	0.484	S	S	*	.			trans	-60.7	122.8	172.9	25.7	-31.6	0	0	0	107.5	D960 R964	D960-P962 WeakPolarHBondContact O-CD 3.46Å; P962-R964 PolarHBondContact O-N 3.05Å
963	K	39.1	Very low	61.7	Low	197 Å²	197	108.8 Å²	108.8	86%	0.857	52%	0.523	S	S	*	.			trans	-57	113.1	165.8	-74.7	-174.4	176.8	-175.5	0	106.2	R961	R961-K963 PolarHBondContact O-N 3.04Å; R961-K963 VanDerWaalsContact O-N 3.1Å
964	R	29.8	Very low	60.2	Low	317 Å²	317	114.5 Å²	114.5	100%	1.196	55%	0.55	S	S	*	.			trans	-52.1	0	173	-92.6	-174.4	175.4	177.8	-1.8	111.5	P962	P962-R964 PolarHBondContact O-N 3.05Å

Retrieved 964 of 964 residues in 3653.7 ms (Link to these results)

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