A0A087XKJ7_POEFO Loading...

Dishevelled associated activator of morphogenesis 1b

AlphaFold DB , UniProt , Accession A0A087XKJ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,081 aa.

						>A0A087XKJ7_POEFO|A0A087XKJ7
MAPRKRGGGGSRGGLSFVFCCFSSNDHPEITYKLREDFALQSMEPSLPMPGYDELDNMFSDLVDELDLTEKHREAMFALPAEKKWQIYCSKKKEQEENKSATSWPEYYIDQLNLMAARKTLLALEKEDEEERNKTIESLKTALRTQPMSFVTRFIDLDGLTCILNFLKSMDYDTTESQIHTSLIGCIKALMNNSQGRAHVLAHSESINIIAQSLATENIKTKVAVLEIMGAVCLVPGGHKKILEAMLHYQRFACERTRFQTLINELDRSTGRYRDEVSLKTAIMSFINAVLSQGAGETSLEFRIHLRYEFLMLGIQPVIDKLRSHENSTLDRHLDYFEMLRNDDELALSKRFESVHIDTKSATQVFDLIRKKMNLTDAYPHFMSVLHHCLLMPHKRSGNTVQYWLLLDRIVQQMVLQNDKGHDPDIAPLENFNVKNVVRMLVNENEVKQWKEQAEKMRKEHHELQQKFEKKERECDAKTQEKEEMMQTLNKMKEKLEKESNEHKNVKQQVAELTAQLHELSTRQAAAVVPGGPPLPPGPPGSPLPPPPMPSLAGMCPPPPPPPGGAMPPPPPPPPPGGPPPPPGHAPMGGIPPPPGAPLGPSLKKKTIPQPTNPLKSFNWSKLAENKLEGTVWMDVDDARVFKVLDLVDIEKTFSAYQRQQDFLMINNSKQKEAEDDTLSSKKVKELSVIDGRRAQNCNILLSRLKLSNEEIKRAILTMDEHEDLPKDMLEQLLKFVPEKSDVDLLEEHKHELDRMAKPDRFLYEMSRINHYQQRLQSLYFKKKFAERIAEIKPKIEALTKASKEILHSRNLKQLLEVVLAFGNYMNKGQRGNAYGFKVSSLNKIADTKSSIDKNITLLHYLITILEKKYPKVLKFQDDLQSVSEAAKVNMTELEKDIGNLRSGLKSVESELDFQKNRPQEVGDKFVSVVSQFITVASFSFSDVEDSLAEAKELFLRAVKHFGEDASKMQPDEFFGIFDQFLQSFTEAQQENENIRKRKEEEERRAKMEAQLKEQREKERKARKAKANGEDDGGEFDDLVSALWSGEVFDKDLSKMKRNRKRINNQSTDSSRERPVTKLNI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	35.2	Very low	254 Å²	254	137.7 Å²	137.7	100%	1.251	84%	0.836	S	S	*	*				0	175.2	0	-75	176.8	170.6	0	0	109.3
2	A	28.8	Very low	34.6	Very low	90 Å²	90	146.1 Å²	146.1	74%	0.744	84%	0.841	S	S	*	*			trans	-138.6	-174.1	-170.1	0	0	0	0	0	109
3	P	62.1	Low	33.8	Very low	99 Å²	99	140.8 Å²	140.8	64%	0.643	84%	0.838	S	S	*	*				-142.7	-161.8	-53	35.3	-15.2	0	0	0	113.5
4	R	34	Very low	33.1	Very low	223 Å²	223	135.7 Å²	135.7	84%	0.842	83%	0.829	S	S	*	*			trans	76.9	160.3	154.3	-67.8	163.6	-178.5	-169.5	0.4	117.9
5	K	39.1	Very low	32.5	Very low	186 Å²	186	138.5 Å²	138.5	81%	0.809	84%	0.836	S	S	*	*			cis	-158.2	-180	-24.1	-112.2	-179.1	174.7	-176.5	0	106.8
6	R	33.7	Very low	31.9	Very low	235 Å²	235	135.5 Å²	135.5	89%	0.887	82%	0.823	S	S	*	*			cis	-149.9	-179.9	20.5	-137.4	-177.1	174.7	134.7	-4.3	106.6
7	G	33.1	Very low	31.4	Very low	65 Å²	65	138.9 Å²	138.9	67%	0.67	83%	0.825	S	S	*	*			cis	99	116.4	1.1	0	0	0	0	0	114.3
8	G	32.8	Very low	30.9	Very low	86 Å²	86	137.4 Å²	137.4	89%	0.887	82%	0.816	S	S	*	*			cis	153.2	-167.3	5.6	0	0	0	0	0	112.8
9	G	30.3	Very low	30.6	Very low	87 Å²	87	140.4 Å²	140.4	90%	0.897	82%	0.818	S	S	*	*			trans	128.1	143.2	168.2	0	0	0	0	0	114.9
10	G	30.5	Very low	30.1	Very low	72 Å²	72	138.9 Å²	138.9	74%	0.742	82%	0.815	S	S	*	*			cis	177.5	169.2	-6.9	0	0	0	0	0	114
11	S	30.6	Very low	29.9	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	81%	0.81	S	S	*	*			trans	65.2	131.9	178.2	-70.5	0	0	0	0	116.8
12	R	28.5	Very low	29.5	Very low	238 Å²	238	135.3 Å²	135.3	90%	0.898	80%	0.795	S	S	*	*			cis	-154.8	170.1	-0.4	-92.9	172.2	-174.4	171.9	0.6	107.2
13	G	24.7	Very low	29.4	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	80%	0.795	S	S	*	*			cis	109.5	109.4	-1.1	0	0	0	0	0	114
14	G	23.9	Very low	27.5	Very low	70 Å²	70	137.2 Å²	137.2	72%	0.722	81%	0.805	S	S	*	*			cis	172.6	-165.2	-1	0	0	0	0	0	113.3
15	L	23.7	Very low	27.6	Very low	178 Å²	178	133.7 Å²	133.7	93%	0.932	80%	0.803	S	S	*	*			trans	81	140.1	-177.3	-56.9	173.2	0	0	0	115.9
16	S	22.6	Very low	26.9	Very low	90 Å²	90	132 Å²	132	63%	0.629	80%	0.803	S	S	*	*			cis	-168	176.7	-16.3	-167.4	0	0	0	0	112.4
17	F	23.2	Very low	26.7	Very low	194 Å²	194	129.2 Å²	129.2	85%	0.851	80%	0.799	S	S	*	*			trans	103.8	154.3	153.8	-83.3	-71.7	0	0	0	123.8
18	V	23.5	Very low	26.5	Very low	111 Å²	111	131.8 Å²	131.8	67%	0.673	80%	0.804	S	S	*	*			trans	-169.7	138.3	-154.3	115.2	0	0	0	0	109.6
19	F	23.7	Very low	26.3	Very low	194 Å²	194	136 Å²	136	85%	0.851	80%	0.801	S	S	*	*			trans	61.1	164	166.9	-75.9	-124.4	0	0	0	116.3
20	C	22	Very low	26.2	Very low	111 Å²	111	139.4 Å²	139.4	75%	0.75	80%	0.797	S	S	*	*			cis	-153.3	-175	13	-150.5	0	0	0	0	113.3
21	C	25.4	Very low	26	Very low	107 Å²	107	141 Å²	141	72%	0.723	79%	0.793	S	S	*	*			trans	-68.7	159.2	-176.3	-44.6	0	0	0	0	116.6
22	F	23.4	Very low	26	Very low	211 Å²	211	145.7 Å²	145.7	93%	0.925	79%	0.793	S	S	*	*				-168.1	167.8	118	-114.4	-77.6	0	0	0	112.3
23	S	25.8	Very low	26	Very low	107 Å²	107	143.3 Å²	143.3	75%	0.748	79%	0.79	S	S	*	*			trans	-109.7	143	-173.1	-42.5	0	0	0	0	113.4
24	S	22.2	Very low	26.7	Very low	122 Å²	122	146.6 Å²	146.6	85%	0.853	79%	0.788	S	S	*	*			trans	-175	164	142.8	-83.1	0	0	0	0	111.4
25	N	37.1	Very low	26.9	Very low	149 Å²	149	154.7 Å²	154.7	80%	0.797	80%	0.797	S	S	*	*			trans	-68.4	144	166.3	-69.8	-12.9	0	0	0	110.1
26	D	24.8	Very low	27.7	Very low	151 Å²	151	153.9 Å²	153.9	81%	0.807	79%	0.788	S	S	*	*				-168.2	163.1	107.9	-95.3	-27.3	0	0	0	111.4
27	H	28.8	Very low	28.6	Very low	176 Å²	176	157.1 Å²	157.1	82%	0.815	80%	0.799	S	S	*	*			trans	-80.8	137.2	179.1	-75.6	-95.4	0	0	0	111.2	E29	H27-E29 PolarHBondContact O-N 3.1Å
28	P	29	Very low	29	Very low	118 Å²	118	157.9 Å²	157.9	77%	0.766	80%	0.802	S	S	*	*			trans	-72.7	107	162.8	29.9	-31.2	0	0	0	109.3	I30	P28-I30 PolarHBondContact O-N 3.48Å
29	E	28.9	Very low	29.5	Very low	175 Å²	175	157.2 Å²	157.2	82%	0.818	81%	0.809	S	S	*	*			trans	-62.6	120.5	167.6	-66.1	-173.5	126.2	0	0	109.8	H27 T31	H27-E29 PolarHBondContact O-N 3.1Å; E29-T31 VanDerWaalsContact C-N 3.3Å; E29-T31 PolarHBondContact O-N 3.43Å
30	I	29.1	Very low	30.1	Very low	158 Å²	158	156.3 Å²	156.3	81%	0.81	81%	0.812	S	S	*	*			trans	-79.8	86.6	167.2	-59.3	-179.5	0	0	0	107.4	P28 Y32	P28-I30 PolarHBondContact O-N 3.48Å; I30-Y32 PolarHBondContact O-N 3.32Å
31	T	26.1	Very low	30.5	Very low	107 Å²	107	159.9 Å²	159.9	66%	0.656	82%	0.817	S	S	*	*			trans	-62.9	117.2	175.4	-39.1	0	0	0	0	109.7	E29 K33	E29-T31 VanDerWaalsContact C-N 3.3Å; E29-T31 PolarHBondContact O-N 3.43Å; T31-K33 PolarHBondContact O-N 2.7Å
32	Y	30.2	Very low	31	Very low	215 Å²	215	159.7 Å²	159.7	84%	0.843	82%	0.817	S	S	*	*			trans	-61.7	108.4	170.7	-86.9	-100.6	0	0	0	109.9	I30	I30-Y32 PolarHBondContact O-N 3.32Å
33	K	27.8	Very low	31.6	Very low	189 Å²	189	157 Å²	157	82%	0.822	81%	0.809	S	S	*	*			trans	-104.3	110	157.5	-77.8	-172.6	175.2	179.7	0	108	T31 R35	T31-K33 PolarHBondContact O-N 2.7Å; K33-R35 PolarHBondContact O-N 3.04Å; K33-R35 VanDerWaalsContact O-N 3.15Å
34	L	38.9	Very low	32.3	Very low	146 Å²	146	160 Å²	160	76%	0.764	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.3	119.1	158.5	-95.9	66.6	0	0	0	107.6
35	R	29.7	Very low	33.4	Very low	239 Å²	239	157 Å²	157	90%	0.902	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-101.1	123	138.1	-86.2	-168.5	172.3	-168.1	-2.4	106.3	K33	K33-R35 PolarHBondContact O-N 3.04Å; K33-R35 VanDerWaalsContact O-N 3.15Å
36	E	40.6	Very low	34.1	Very low	161 Å²	161	155.7 Å²	155.7	75%	0.752	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64.2	173.5	155.7	-65.4	162.4	136.5	0	0	108.4
37	D	40.2	Very low	35.7	Very low	159 Å²	159	152.9 Å²	152.9	85%	0.85	78%	0.776	S	S	*	*			trans	83.3	38.7	-172.9	-51	-25.9	0	0	0	117.4
38	F	32	Very low	37.3	Very low	209 Å²	209	150.1 Å²	150.1	92%	0.917	77%	0.774	S	S	*	*			trans	-129.4	102.3	144.6	-100.4	-86.4	0	0	0	110	L40	F38-L40 PolarHBondContact O-N 3.07Å
39	A	34.2	Very low	39	Very low	98 Å²	98	147.8 Å²	147.8	81%	0.81	75%	0.753	S	S	*	*			trans	-72.9	117.2	168.8	0	0	0	0	0	109.1	Q41	A39-Q41 PolarHBondContact O-N 2.86Å; A39-Q41 VanDerWaalsContact O-N 3.07Å
40	L	35.4	Very low	41.1	Very low	175 Å²	175	140.6 Å²	140.6	92%	0.916	72%	0.722	S	S	*	*			trans	-64.4	107.8	167.4	-83	165.2	0	0	0	108.3	F38 S42	F38-L40 PolarHBondContact O-N 3.07Å; L40-S42 PolarHBondContact O-N 3.44Å
41	Q	31.3	Very low	43.3	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	71%	0.705	S	S	*	*			trans	-71.7	100.5	177.7	-171	171.6	8.8	0	0	109.2	A39 M43	A39-Q41 PolarHBondContact O-N 2.86Å; A39-Q41 VanDerWaalsContact O-N 3.07Å; Q41-M43 PolarHBondContact O-N 3.47Å; Q41-M43 VanDerWaalsContact O-N 3.16Å
42	S	34.7	Very low	45.5	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	70%	0.702	S	S	*	*			trans	-62.3	113.3	172.1	51.1	0	0	0	0	109.8	L40 E44	L40-S42 PolarHBondContact O-N 3.44Å; S42-E44 PolarHBondContact O-N 3.06Å; S42-E44 VanDerWaalsContact O-N 3.1Å
43	M	36.8	Very low	47.5	Very low	154 Å²	154	133.4 Å²	133.4	76%	0.759	70%	0.696	S	S	*	*			trans	-71.5	101.9	167.1	-71	-163.5	71.3	0	0	109.1	Q41	Q41-M43 PolarHBondContact O-N 3.47Å; Q41-M43 VanDerWaalsContact O-N 3.16Å
44	E	40.2	Very low	49.8	Very low	171 Å²	171	130 Å²	130	80%	0.799	68%	0.683	S	S	*	*			trans	-64.5	128.9	161.4	-66.6	-172.2	128.5	0	0	108.7	S42 S46	S42-E44 PolarHBondContact O-N 3.06Å; S42-E44 VanDerWaalsContact O-N 3.1Å; E44-S46 PolarHBondContact O-N 2.97Å
45	P	45.1	Very low	51.6	Low	58 Å²	58	123.1 Å²	123.1	38%	0.377	65%	0.647	S	S	.	*			trans	-60.1	127.7	172.2	-23.1	34.3	0	0	0	110.2	L47	P45-L47 PolarHBondContact O-N 3.48Å
46	S	52.4	Low	53.9	Low	123 Å²	123	114.8 Å²	114.8	86%	0.86	62%	0.62	S	S	*	*	S	Bend	trans	-72.1	5.9	-177.8	52.7	0	0	0	0	114.6	E44	E44-S46 PolarHBondContact O-N 2.97Å
47	L	57.6	Low	55.5	Low	92 Å²	92	112.3 Å²	112.3	48%	0.482	61%	0.612	S	S	.	*	S	Bend	trans	-138.2	139.3	178.5	-68.6	172.5	0	0	0	109.3	P45 W85	P45-L47 PolarHBondContact O-N 3.48Å; L47-W85 HydrophobicContact CB-CZ2 3.86Å; L47-W85 PolarHBondContact O-NE1 3.47Å
48	P	62.4	Low	57.1	Low	117 Å²	117	106.9 Å²	106.9	76%	0.76	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.3	173.7	28.5	-34.6	0	0	0	110.1	W85	P48-W85 WeakPolarHBondContact O-CZ2 3.49Å
49	M	64.9	Low	59.4	Low	69 Å²	69	97 Å²	97	34%	0.34	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-64.8	128.5	177.7	-169.9	169.3	74.3	0	0	109.8	L55 A81 W85	M49-L55 HydrophobicContact CG-CD2 3.97Å; M49-L55 HydrophobicContact SD-CD2 3.85Å; M49-A81 HydrophobicContact CE-CB 4.13Å; M49-A81 HydrophobicContact SD-CB 4.16Å; M49-W85 HydrophobicContact CB-CD2 4.47Å; M49-W85 HydrophobicContact CB-CG 4.13Å; M49-W85 HydrophobicContact CG-CB 3.97Å; M49-W85 HydrophobicContact CG-CD2 4.19Å; M49-W85 HydrophobicContact CG-CG 3.76Å; M49-W85 HydrophobicContact SD-CB 3.86Å; M49-W85 HydrophobicContact SD-CG 4.22Å
50	P	74.2	Confident	61.3	Low	24 Å²	24	93.7 Å²	93.7	16%	0.156	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-66.6	171.1	176.5	25.2	-31.4	0	0	0	111.7	E54 L55 M58 W85	P50-E54 HydrophobicContact CB-CB 4.17Å; P50-E54 HydrophobicContact CB-CG 3.92Å; P50-E54 VanDerWaalsContact CB-OE2 3.29Å; P50-E54 WeakPolarHBondContact CB-OE2 3.47Å; P50-L55 HydrophobicContact CG-CB 4.12Å; P50-L55 HydrophobicContact CG-CD1 4.26Å; P50-M58 HydrophobicContact CG-SD 4.11Å; P50-W85 HydrophobicContact CG-CE3 4.29Å; P50-W85 HydrophobicContact CG-CH2 4.16Å; P50-W85 HydrophobicContact CG-CZ3 3.89Å
51	G	74.4	Confident	63	Low	44 Å²	44	90.8 Å²	90.8	45%	0.454	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-60.2	150.3	178.2	0	0	0	0	0	111.6	D53 E54 L55	G51-D53 VanDerWaalsContact C-N 3.28Å; G51-D53 PolarHBondContact O-N 2.86Å; G51-D53 VanDerWaalsContact O-N 3.15Å; G51-E54 CarbonylContact O-C 3.6Å; G51-E54 WeakPolarHBondContact O-CA 3.46Å; G51-E54 WeakPolarHBondContact O-CB 3.48Å; G51-E54 PolarHBondContact O-N 3.3Å; G51-L55 PolarHBondContact O-N 3.38Å
52	Y	73.4	Confident	65.1	Low	150 Å²	150	82.5 Å²	82.5	59%	0.588	46%	0.457	S	S	*	.	H	α-helix	trans	-51.6	-43.1	-172.8	-69.1	-77.7	0	0	0	113.8	L55 D56 A81	Y52-L55 PolarHBondContact O-N 3.07Å; Y52-D56 PolarHBondContact O-N 3.48Å; Y52-A81 HydrophobicContact CD1-CB 3.89Å; Y52-A81 HydrophobicContact CE1-CB 3.6Å
53	D	70.9	Confident	66.9	Low	136 Å²	136	77.6 Å²	77.6	73%	0.727	42%	0.423	S	S	*	.	H	α-helix	trans	-67	-36.5	177.9	-50.4	-58.7	0	0	0	112.5	G51 N57	G51-D53 VanDerWaalsContact C-N 3.28Å; G51-D53 PolarHBondContact O-N 2.86Å; G51-D53 VanDerWaalsContact O-N 3.15Å; D53-N57 PolarHBondContact O-N 3.26Å; D53-N57 PolarHBondContact O-ND2 2.99Å
54	E	76.1	Confident	68.6	Low	116 Å²	116	73.9 Å²	73.9	54%	0.542	41%	0.406	S	S	.	.	H	α-helix	trans	-73.2	-40.4	177.9	-176.9	176	-145.3	0	0	110.9	P50 G51 N57 M58	P50-E54 HydrophobicContact CB-CB 4.17Å; P50-E54 HydrophobicContact CB-CG 3.92Å; P50-E54 VanDerWaalsContact CB-OE2 3.29Å; P50-E54 WeakPolarHBondContact CB-OE2 3.47Å; G51-E54 CarbonylContact O-C 3.6Å; G51-E54 WeakPolarHBondContact O-CA 3.46Å; G51-E54 WeakPolarHBondContact O-CB 3.48Å; G51-E54 PolarHBondContact O-N 3.3Å; E54-N57 PolarHBondContact O-N 2.89Å; E54-M58 HydrophobicContact CG-SD 4.15Å; E54-M58 WeakPolarHBondContact O-CB 3.5Å; E54-M58 VanDerWaalsContact O-CG 3.29Å; E54-M58 WeakPolarHBondContact O-CG 3.4Å; E54-M58 PolarHBondContact O-N 3.43Å
55	L	77.6	Confident	69.9	Low	2 Å²	2	68.1 Å²	68.1	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-61.5	-45.8	173.2	180	63.4	0	0	0	111.9	M49 P50 G51 Y52 N57 M58 F59 A81 K84 W85	M49-L55 HydrophobicContact CG-CD2 3.97Å; M49-L55 HydrophobicContact SD-CD2 3.85Å; P50-L55 HydrophobicContact CG-CB 4.12Å; P50-L55 HydrophobicContact CG-CD1 4.26Å; G51-L55 PolarHBondContact O-N 3.38Å; Y52-L55 PolarHBondContact O-N 3.07Å; L55-N57 VanDerWaalsContact C-N 3.34Å; L55-M58 PolarHBondContact O-N 2.89Å; L55-F59 WeakPolarHBondContact O-CB 3.21Å; L55-F59 PolarHBondContact O-N 3.07Å; L55-A81 HydrophobicContact CD2-CB 3.71Å; L55-K84 HydrophobicContact CD2-CB 4.49Å; L55-W85 HydrophobicContact CD1-CB 4.06Å; L55-W85 HydrophobicContact CD1-CD2 4.27Å; L55-W85 HydrophobicContact CD1-CE3 3.59Å; L55-W85 HydrophobicContact CD1-CZ3 4.38Å
56	D	76.6	Confident	71	Confident	64 Å²	64	68.8 Å²	68.8	34%	0.342	38%	0.379	S	S	.	.	H	α-helix	trans	-70.9	-28.3	-179.8	-89.9	-17.5	0	0	0	112.7	Y52 S60 K84	Y52-D56 PolarHBondContact O-N 3.48Å; D56-S60 WeakPolarHBondContact O-CB 3.31Å; D56-S60 PolarHBondContact O-N 2.92Å; D56-K84 VanDerWaalsContact OD1-CD 3.26Å; D56-K84 WeakPolarHBondContact OD1-CD 3.49Å; D56-K84 WeakPolarHBondContact OD1-CE 3.41Å; D56-K84 IonicContact OD1-NZ 3.49Å; D56-K84 PolarHBondContact OD1-NZ 2.92Å; D56-K84 IonicContact OD2-NZ 2.67Å; D56-K84 PolarHBondContact OD2-NZ 2.66Å
57	N	75.6	Confident	71.4	Confident	109 Å²	109	65.7 Å²	65.7	58%	0.583	35%	0.353	S	S	*	.	H	α-helix	trans	-67.3	-53.3	167.6	-77.2	-60.9	0	0	0	111.4	D53 E54 L55 F59 S60 D61	D53-N57 PolarHBondContact O-N 3.26Å; D53-N57 PolarHBondContact O-ND2 2.99Å; E54-N57 PolarHBondContact O-N 2.89Å; L55-N57 VanDerWaalsContact C-N 3.34Å; N57-F59 PolarHBondContact O-N 3.29Å; N57-S60 WeakPolarHBondContact O-CA 3.46Å; N57-S60 WeakPolarHBondContact O-CB 3.34Å; N57-S60 PolarHBondContact O-N 3.18Å; N57-D61 PolarHBondContact O-N 3.46Å
58	M	73.4	Confident	72	Confident	46 Å²	46	64.2 Å²	64.2	23%	0.227	35%	0.345	C	S	.	.	H	α-helix	trans	-60.6	-29.3	178.1	-69.7	173.1	64.4	0	0	113	P50 E54 L55 L62 W85 Y88	P50-M58 HydrophobicContact CG-SD 4.11Å; E54-M58 HydrophobicContact CG-SD 4.15Å; E54-M58 WeakPolarHBondContact O-CB 3.5Å; E54-M58 VanDerWaalsContact O-CG 3.29Å; E54-M58 WeakPolarHBondContact O-CG 3.4Å; E54-M58 PolarHBondContact O-N 3.43Å; L55-M58 PolarHBondContact O-N 2.89Å; M58-L62 PolarHBondContact O-N 3.28Å; M58-W85 HydrophobicContact CE-CZ3 4.11Å; M58-Y88 HydrophobicContact CB-CD2 4.46Å; M58-Y88 HydrophobicContact CB-CE2 4.05Å; M58-Y88 HydrophobicContact CE-CD1 4.36Å; M58-Y88 HydrophobicContact CE-CE1 3.54Å; M58-Y88 HydrophobicContact CE-CE2 4.15Å; M58-Y88 VanDerWaalsContact CE-CZ 3.44Å; M58-Y88 WeakPolarHBondContact CE-OH 3.38Å; M58-Y88 WeakPolarHBondContact O-CE2 3.39Å
59	F	79.3	Confident	72	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-81.9	-26.4	174.3	-167.4	-101.4	0	0	0	112.5	L55 N57 L62 V63 M76 F77 L79 K84 I87	L55-F59 WeakPolarHBondContact O-CB 3.21Å; L55-F59 PolarHBondContact O-N 3.07Å; N57-F59 PolarHBondContact O-N 3.29Å; F59-L62 HydrophobicContact CD2-CD2 4.03Å; F59-L62 HydrophobicContact CE2-CD2 4.15Å; F59-L62 PolarHBondContact O-N 2.95Å; F59-V63 HydrophobicContact CD1-CG2 3.8Å; F59-V63 HydrophobicContact CE1-CG2 3.5Å; F59-V63 VanDerWaalsContact CE1-CG2 3.5Å; F59-V63 HydrophobicContact CG-CG2 4.48Å; F59-V63 HydrophobicContact CZ-CG2 3.94Å; F59-V63 WeakPolarHBondContact O-CB 3.47Å; F59-V63 VanDerWaalsContact O-CG2 3.24Å; F59-V63 WeakPolarHBondContact O-CG2 2.85Å; F59-V63 PolarHBondContact O-N 3.21Å; F59-M76 HydrophobicContact CE1-CB 4.08Å; F59-M76 WeakPolarHBondContact CE1-O 3.43Å; F59-M76 HydrophobicContact CZ-CB 4.31Å; F59-M76 HydrophobicContact CZ-CE 3.85Å; F59-M76 HydrophobicContact CZ-SD 4.5Å; F59-F77 HydrophobicContact CD1-CD1 4.42Å; F59-F77 HydrophobicContact CD1-CE1 4.38Å; F59-L79 HydrophobicContact CZ-CD1 4.48Å; F59-K84 HydrophobicContact CD1-CB 4.31Å; F59-K84 HydrophobicContact CD1-CD 3.85Å; F59-K84 HydrophobicContact CD1-CG 3.89Å; F59-K84 HydrophobicContact CD2-CB 3.68Å; F59-K84 HydrophobicContact CD2-CG 4.1Å; F59-K84 HydrophobicContact CE1-CB 4.44Å; F59-K84 HydrophobicContact CE1-CD 4.13Å; F59-K84 HydrophobicContact CE1-CG 3.79Å; F59-K84 HydrophobicContact CE2-CB 3.86Å; F59-K84 HydrophobicContact CE2-CG 4.02Å; F59-K84 HydrophobicContact CG-CB 3.93Å; F59-K84 HydrophobicContact CG-CD 4.15Å; F59-K84 HydrophobicContact CG-CG 4.03Å; F59-K84 HydrophobicContact CZ-CB 4.23Å; F59-K84 HydrophobicContact CZ-CG 3.86Å; F59-I87 HydrophobicContact CE2-CB 4.22Å; F59-I87 HydrophobicContact CE2-CG2 4.11Å
60	S	75.5	Confident	72.1	Confident	29 Å²	29	65.7 Å²	65.7	20%	0.203	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-48.8	168.6	-163	0	0	0	0	111	D56 N57 L62 V63 D64	D56-S60 WeakPolarHBondContact O-CB 3.31Å; D56-S60 PolarHBondContact O-N 2.92Å; N57-S60 WeakPolarHBondContact O-CA 3.46Å; N57-S60 WeakPolarHBondContact O-CB 3.34Å; N57-S60 PolarHBondContact O-N 3.18Å; S60-L62 PolarHBondContact O-N 2.83Å; S60-V63 PolarHBondContact O-N 2.9Å; S60-D64 WeakPolarHBondContact O-CB 3.18Å; S60-D64 VanDerWaalsContact O-CG 3.28Å; S60-D64 PolarHBondContact O-N 3.34Å; S60-D64 PolarHBondContact OG-OD2 2.93Å; S60-D64 VanDerWaalsContact OG-OD2 3.05Å
61	D	71.3	Confident	71.7	Confident	115 Å²	115	72 Å²	72	62%	0.615	37%	0.37	S	S	*	.	H	α-helix	trans	-53.4	-43.9	176.4	-65.7	-27.2	0	0	0	110.9	N57 E65	N57-D61 PolarHBondContact O-N 3.46Å; D61-E65 WeakPolarHBondContact O-CB 3.43Å; D61-E65 WeakPolarHBondContact O-CG 3.31Å; D61-E65 PolarHBondContact O-N 3.21Å
62	L	74.4	Confident	71.5	Confident	11 Å²	11	75 Å²	75	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-39.8	176.2	178.2	65.8	0	0	0	113.7	M58 F59 S60 E65 L66 I87 Y88 K91	M58-L62 PolarHBondContact O-N 3.28Å; F59-L62 HydrophobicContact CD2-CD2 4.03Å; F59-L62 HydrophobicContact CE2-CD2 4.15Å; F59-L62 PolarHBondContact O-N 2.95Å; S60-L62 PolarHBondContact O-N 2.83Å; L62-E65 PolarHBondContact O-N 3.38Å; L62-L66 WeakPolarHBondContact O-CD1 3.26Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å; L62-I87 HydrophobicContact CD2-CG2 4.11Å; L62-Y88 HydrophobicContact CB-CD2 4.23Å; L62-Y88 HydrophobicContact CD2-CD2 3.95Å; L62-Y88 HydrophobicContact CD2-CG 4.43Å; L62-K91 HydrophobicContact CD1-CB 3.95Å; L62-K91 HydrophobicContact CD1-CG 3.88Å
63	V	73.2	Confident	71.5	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-71.3	-34.9	179.4	162.6	0	0	0	0	111.2	F59 S60 L66 R73 M76 F77	F59-V63 HydrophobicContact CD1-CG2 3.8Å; F59-V63 HydrophobicContact CE1-CG2 3.5Å; F59-V63 VanDerWaalsContact CE1-CG2 3.5Å; F59-V63 HydrophobicContact CG-CG2 4.48Å; F59-V63 HydrophobicContact CZ-CG2 3.94Å; F59-V63 WeakPolarHBondContact O-CB 3.47Å; F59-V63 VanDerWaalsContact O-CG2 3.24Å; F59-V63 WeakPolarHBondContact O-CG2 2.85Å; F59-V63 PolarHBondContact O-N 3.21Å; S60-V63 PolarHBondContact O-N 2.9Å; V63-L66 PolarHBondContact O-N 3.47Å; V63-R73 HydrophobicContact CG1-CB 4.44Å; V63-R73 HydrophobicContact CG1-CG 3.31Å; V63-M76 HydrophobicContact CG2-CB 3.95Å; V63-M76 HydrophobicContact CG2-CE 4.17Å; V63-F77 HydrophobicContact CB-CE2 4.36Å; V63-F77 HydrophobicContact CG1-CD2 4.5Å; V63-F77 HydrophobicContact CG1-CE2 3.88Å; V63-F77 HydrophobicContact CG1-CZ 4.49Å
64	D	71.3	Confident	71.7	Confident	76 Å²	76	71.8 Å²	71.8	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-78.4	-24.4	176.1	-59.9	-35.5	0	0	0	111.2	S60 L66 R73	S60-D64 WeakPolarHBondContact O-CB 3.18Å; S60-D64 VanDerWaalsContact O-CG 3.28Å; S60-D64 PolarHBondContact O-N 3.34Å; S60-D64 PolarHBondContact OG-OD2 2.93Å; S60-D64 VanDerWaalsContact OG-OD2 3.05Å; D64-L66 PolarHBondContact O-N 3.27Å; D64-R73 IonicContact OD1-CZ 3.2Å; D64-R73 IonicContact OD1-NH1 2.71Å; D64-R73 PolarHBondContact OD1-NH1 3.2Å; D64-R73 IonicContact OD2-NH1 3.37Å; D64-R73 PolarHBondContact OD2-NH1 3Å
65	E	67.9	Low	71.6	Confident	50 Å²	50	69 Å²	69	23%	0.234	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.9	165.7	-85.7	-149.7	132.4	0	0	114.3	D61 L62 Q95 M148 S149	D61-E65 WeakPolarHBondContact O-CB 3.43Å; D61-E65 WeakPolarHBondContact O-CG 3.31Å; D61-E65 PolarHBondContact O-N 3.21Å; L62-E65 PolarHBondContact O-N 3.38Å; E65-Q95 PolarHBondContact OE2-NE2 3.28Å; E65-M148 VanDerWaalsContact O-CB 3.24Å; E65-M148 WeakPolarHBondContact O-CB 3.39Å; E65-M148 PolarHBondContact O-N 2.95Å; E65-S149 WeakPolarHBondContact OE1-CB 3.47Å; E65-S149 PolarHBondContact OE1-OG 2.88Å
66	L	68.1	Low	71.3	Confident	71 Å²	71	70.8 Å²	70.8	37%	0.372	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	1.9	-173.9	-70.3	167.2	0	0	0	114.8	L62 V63 D64 L68 M76	L62-L66 WeakPolarHBondContact O-CD1 3.26Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å; V63-L66 PolarHBondContact O-N 3.47Å; D64-L66 PolarHBondContact O-N 3.27Å; L66-L68 HydrophobicContact CB-CD1 4.11Å; L66-L68 HydrophobicContact CB-CD2 4.25Å; L66-L68 HydrophobicContact CB-CG 3.75Å; L66-L68 HydrophobicContact CD1-CD1 4.39Å; L66-L68 PolarHBondContact O-N 3.21Å; L66-L68 VanDerWaalsContact O-N 3.13Å; L66-M76 HydrophobicContact CD1-CE 4.24Å
67	D	61.8	Low	71.4	Confident	58 Å²	58	70.5 Å²	70.5	31%	0.31	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	36.2	177.7	-157.8	31.1	0	0	0	114.1	N193 S194	D67-N193 VanDerWaalsContact CG-ND2 3.33Å; D67-N193 WeakPolarHBondContact OD2-CA 3.36Å; D67-N193 PolarHBondContact OD2-ND2 3.31Å; D67-S194 VanDerWaalsContact OD1-CB 3.28Å; D67-S194 WeakPolarHBondContact OD1-CB 3.49Å; D67-S194 PolarHBondContact OD1-OG 2.86Å; D67-S194 PolarHBondContact OD2-N 2.9Å; D67-S194 PolarHBondContact OD2-OG 2.61Å
68	L	69.9	Low	71.5	Confident	61 Å²	61	69.2 Å²	69.2	32%	0.319	36%	0.36	S	S	.	.			trans	-78.1	133.9	-171.7	-63.7	179	0	0	0	113.2	L66 H72 M76	L66-L68 HydrophobicContact CB-CD1 4.11Å; L66-L68 HydrophobicContact CB-CD2 4.25Å; L66-L68 HydrophobicContact CB-CG 3.75Å; L66-L68 HydrophobicContact CD1-CD1 4.39Å; L66-L68 PolarHBondContact O-N 3.21Å; L66-L68 VanDerWaalsContact O-N 3.13Å; L68-H72 HydrophobicContact CB-CB 4.47Å; L68-M76 HydrophobicContact CD1-CE 4.45Å; L68-M76 HydrophobicContact CD1-CG 3.89Å
69	T	62.3	Low	71.7	Confident	60 Å²	60	69.3 Å²	69.3	37%	0.368	36%	0.362	S	S	.	.			trans	-50.2	141.3	167.7	49.8	0	0	0	0	112	K71 H72 R73 E1035	T69-K71 VanDerWaalsContact C-N 3.25Å; T69-K71 PolarHBondContact O-N 2.83Å; T69-H72 WeakPolarHBondContact O-CA 3.44Å; T69-H72 PolarHBondContact O-N 3.49Å; T69-H72 PolarHBondContact OG1-ND1 2.87Å; T69-R73 PolarHBondContact O-N 2.98Å; T69-E1035 WeakPolarHBondContact CG2-OE1 3.5Å
70	E	67.2	Low	71.8	Confident	158 Å²	158	72.5 Å²	72.5	74%	0.738	38%	0.382	S	S	*	.	H	α-helix	trans	-51.1	-39.2	-168.9	-168.5	163.7	-144.2	0	0	114.1	H72 R73 E74	E70-H72 PolarHBondContact O-N 2.78Å; E70-R73 WeakPolarHBondContact O-CA 3.46Å; E70-R73 WeakPolarHBondContact O-CB 3.41Å; E70-R73 PolarHBondContact O-N 3.45Å; E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.1Å
71	K	65.9	Low	71.8	Confident	157 Å²	157	71.8 Å²	71.8	68%	0.683	38%	0.378	S	S	*	.	H	α-helix	trans	-65.5	-34.3	175.3	-173.5	-171	173.5	-162	0	114	T69 A75	T69-K71 VanDerWaalsContact C-N 3.25Å; T69-K71 PolarHBondContact O-N 2.83Å; K71-A75 PolarHBondContact O-N 2.85Å; K71-A75 VanDerWaalsContact O-N 3.15Å
72	H	68.8	Low	72	Confident	106 Å²	106	71.4 Å²	71.4	49%	0.491	37%	0.372	S	S	.	.	H	α-helix	trans	-79.7	-30.1	173.5	-67	100	0	0	0	111.1	L68 T69 E70 A75 M76	L68-H72 HydrophobicContact CB-CB 4.47Å; T69-H72 WeakPolarHBondContact O-CA 3.44Å; T69-H72 PolarHBondContact O-N 3.49Å; T69-H72 PolarHBondContact OG1-ND1 2.87Å; E70-H72 PolarHBondContact O-N 2.78Å; H72-A75 PolarHBondContact O-N 2.63Å; H72-M76 VanDerWaalsContact O-CG 3.32Å; H72-M76 WeakPolarHBondContact O-CG 3.44Å; H72-M76 PolarHBondContact O-N 2.86Å
73	R	74.9	Confident	71.9	Confident	87 Å²	87	76.3 Å²	76.3	33%	0.328	39%	0.393	S	S	.	.	H	α-helix	trans	-55.4	-53.9	166	-133.6	-177.8	80.2	99.7	5.1	110.6	V63 D64 T69 E70 A75 M76 F77	V63-R73 HydrophobicContact CG1-CB 4.44Å; V63-R73 HydrophobicContact CG1-CG 3.31Å; D64-R73 IonicContact OD1-CZ 3.2Å; D64-R73 IonicContact OD1-NH1 2.71Å; D64-R73 PolarHBondContact OD1-NH1 3.2Å; D64-R73 IonicContact OD2-NH1 3.37Å; D64-R73 PolarHBondContact OD2-NH1 3Å; T69-R73 PolarHBondContact O-N 2.98Å; E70-R73 WeakPolarHBondContact O-CA 3.46Å; E70-R73 WeakPolarHBondContact O-CB 3.41Å; E70-R73 PolarHBondContact O-N 3.45Å; R73-A75 VanDerWaalsContact C-N 3.33Å; R73-A75 PolarHBondContact O-N 2.96Å; R73-M76 PolarHBondContact O-N 3.48Å; R73-F77 HydrophobicContact CG-CD2 4.48Å; R73-F77 HydrophobicContact CG-CE2 4.21Å; R73-F77 VanDerWaalsContact O-CD2 3.28Å; R73-F77 WeakPolarHBondContact O-CD2 3.34Å; R73-F77 PolarHBondContact O-N 3.48Å
74	E	74.4	Confident	72.1	Confident	132 Å²	132	77 Å²	77	62%	0.617	40%	0.396	S	S	*	.	H	α-helix	trans	-54.3	-45.7	173.7	-71.7	178.8	150.6	0	0	112.3	E70 M76 F77 A78	E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.1Å; E74-M76 VanDerWaalsContact C-N 3.34Å; E74-M76 PolarHBondContact O-N 3.49Å; E74-F77 PolarHBondContact O-N 2.87Å; E74-A78 WeakPolarHBondContact O-CB 3.41Å; E74-A78 PolarHBondContact O-N 3.37Å
75	A	73.2	Confident	72.5	Confident	57 Å²	57	74.1 Å²	74.1	47%	0.471	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-34.6	179.8	0	0	0	0	0	113.4	K71 H72 R73	K71-A75 PolarHBondContact O-N 2.85Å; K71-A75 VanDerWaalsContact O-N 3.15Å; H72-A75 PolarHBondContact O-N 2.63Å; R73-A75 VanDerWaalsContact C-N 3.33Å; R73-A75 PolarHBondContact O-N 2.96Å
76	M	71.6	Confident	72.8	Confident	39 Å²	39	77.1 Å²	77.1	19%	0.192	39%	0.394	C	S	.	.	H	α-helix	trans	-70.2	-44.5	173.9	-72.7	-75.4	-84.9	0	0	111.4	F59 V63 L66 L68 H72 R73 E74 A78 L79	F59-M76 HydrophobicContact CE1-CB 4.08Å; F59-M76 WeakPolarHBondContact CE1-O 3.43Å; F59-M76 HydrophobicContact CZ-CB 4.31Å; F59-M76 HydrophobicContact CZ-CE 3.85Å; F59-M76 HydrophobicContact CZ-SD 4.5Å; V63-M76 HydrophobicContact CG2-CB 3.95Å; V63-M76 HydrophobicContact CG2-CE 4.17Å; L66-M76 HydrophobicContact CD1-CE 4.24Å; L68-M76 HydrophobicContact CD1-CE 4.45Å; L68-M76 HydrophobicContact CD1-CG 3.89Å; H72-M76 VanDerWaalsContact O-CG 3.32Å; H72-M76 WeakPolarHBondContact O-CG 3.44Å; H72-M76 PolarHBondContact O-N 2.86Å; R73-M76 PolarHBondContact O-N 3.48Å; E74-M76 VanDerWaalsContact C-N 3.34Å; E74-M76 PolarHBondContact O-N 3.49Å; M76-A78 PolarHBondContact O-N 3.16Å; M76-L79 WeakPolarHBondContact O-CB 3.38Å; M76-L79 WeakPolarHBondContact O-CG 3.48Å; M76-L79 PolarHBondContact O-N 3.45Å; M76-L79 HydrophobicContact SD-CD1 4.03Å
77	F	78.3	Confident	72.9	Confident	59 Å²	59	76.7 Å²	76.7	26%	0.259	39%	0.391	S	S	.	.	H	α-helix	trans	-66.7	-24.5	175.9	-80.5	-71	0	0	0	113.5	F59 V63 R73 E74 L79 K84	F59-F77 HydrophobicContact CD1-CD1 4.42Å; F59-F77 HydrophobicContact CD1-CE1 4.38Å; V63-F77 HydrophobicContact CB-CE2 4.36Å; V63-F77 HydrophobicContact CG1-CD2 4.5Å; V63-F77 HydrophobicContact CG1-CE2 3.88Å; V63-F77 HydrophobicContact CG1-CZ 4.49Å; R73-F77 HydrophobicContact CG-CD2 4.48Å; R73-F77 HydrophobicContact CG-CE2 4.21Å; R73-F77 VanDerWaalsContact O-CD2 3.28Å; R73-F77 WeakPolarHBondContact O-CD2 3.34Å; R73-F77 PolarHBondContact O-N 3.48Å; E74-F77 PolarHBondContact O-N 2.87Å; F77-L79 PolarHBondContact O-N 3.18Å; F77-K84 WeakPolarHBondContact O-CE 3.37Å; F77-K84 PolarHBondContact O-NZ 3.48Å
78	A	77.9	Confident	73.5	Confident	82 Å²	82	76.1 Å²	76.1	68%	0.678	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-0.5	174	0	0	0	0	0	114.7	E74 M76	E74-A78 WeakPolarHBondContact O-CB 3.41Å; E74-A78 PolarHBondContact O-N 3.37Å; M76-A78 PolarHBondContact O-N 3.16Å
79	L	79	Confident	73.7	Confident	48 Å²	48	75 Å²	75	25%	0.251	38%	0.382	S	S	.	.	S	Bend	trans	-74	146.6	176.2	-65.6	174.4	0	0	0	112.3	F59 M76 F77 K83 K84 I87	F59-L79 HydrophobicContact CZ-CD1 4.48Å; M76-L79 WeakPolarHBondContact O-CB 3.38Å; M76-L79 WeakPolarHBondContact O-CG 3.48Å; M76-L79 PolarHBondContact O-N 3.45Å; M76-L79 HydrophobicContact SD-CD1 4.03Å; F77-L79 PolarHBondContact O-N 3.18Å; L79-K83 HydrophobicContact CB-CB 4.43Å; L79-K84 HydrophobicContact CB-CG 4.11Å; L79-K84 WeakPolarHBondContact O-CE 3.36Å; L79-I87 HydrophobicContact CD1-CD1 3.64Å
80	P	79.8	Confident	74	Confident	67 Å²	67	75.5 Å²	75.5	44%	0.435	39%	0.388	S	S	.	.			trans	-56.6	146.9	167.7	-24	34.1	0	0	0	112.4	E82 K83 K84	P80-E82 VanDerWaalsContact CB-OE2 3.3Å; P80-E82 WeakPolarHBondContact CB-OE2 3.48Å; P80-E82 PolarHBondContact O-N 3.03Å; P80-K83 WeakPolarHBondContact O-CA 3.48Å; P80-K83 WeakPolarHBondContact O-CB 3.41Å; P80-K83 PolarHBondContact O-N 2.9Å; P80-K84 PolarHBondContact O-N 2.96Å
81	A	76	Confident	74	Confident	14 Å²	14	71.9 Å²	71.9	12%	0.116	37%	0.37	C	S	.	.	H	α-helix	trans	-54	-38.6	-177.3	0	0	0	0	0	112.9	M49 Y52 L55 K83 K84 W85	M49-A81 HydrophobicContact CE-CB 4.13Å; M49-A81 HydrophobicContact SD-CB 4.16Å; Y52-A81 HydrophobicContact CD1-CB 3.89Å; Y52-A81 HydrophobicContact CE1-CB 3.6Å; L55-A81 HydrophobicContact CD2-CB 3.71Å; A81-K83 VanDerWaalsContact C-N 3.25Å; A81-K83 PolarHBondContact O-N 2.98Å; A81-K84 WeakPolarHBondContact O-CB 3.42Å; A81-K84 PolarHBondContact O-N 3.23Å; A81-W85 WeakPolarHBondContact O-CB 3.38Å; A81-W85 PolarHBondContact O-N 3.45Å
82	E	75.3	Confident	74	Confident	106 Å²	106	68 Å²	68	50%	0.495	35%	0.353	S	S	.	.	H	α-helix	trans	-63.4	-33.8	179.9	-54.5	71.8	-155.4	0	0	111.3	P80 Q86	P80-E82 VanDerWaalsContact CB-OE2 3.3Å; P80-E82 WeakPolarHBondContact CB-OE2 3.48Å; P80-E82 PolarHBondContact O-N 3.03Å; E82-Q86 WeakPolarHBondContact O-CG 3.49Å; E82-Q86 PolarHBondContact O-N 3.04Å; E82-Q86 VanDerWaalsContact O-N 3.12Å
83	K	73.4	Confident	73.7	Confident	115 Å²	115	68.3 Å²	68.3	50%	0.5	35%	0.353	S	S	.	.	H	α-helix	trans	-77.9	-40.3	174.1	-67.6	-165	177.4	-172.9	0	112.1	L79 P80 A81 W85 Q86 I87	L79-K83 HydrophobicContact CB-CB 4.43Å; P80-K83 WeakPolarHBondContact O-CA 3.48Å; P80-K83 WeakPolarHBondContact O-CB 3.41Å; P80-K83 PolarHBondContact O-N 2.9Å; A81-K83 VanDerWaalsContact C-N 3.25Å; A81-K83 PolarHBondContact O-N 2.98Å; K83-W85 VanDerWaalsContact C-N 3.29Å; K83-W85 PolarHBondContact O-N 2.9Å; K83-Q86 PolarHBondContact O-N 3.39Å; K83-I87 WeakPolarHBondContact O-CB 3.45Å; K83-I87 WeakPolarHBondContact O-CD1 3.42Å; K83-I87 VanDerWaalsContact O-CG1 3.27Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 3.04Å
84	K	77.1	Confident	72.8	Confident	13 Å²	13	68.8 Å²	68.8	6%	0.057	36%	0.359	C	S	.	.	H	α-helix	trans	-55.8	-46.6	173.2	-67.4	-179.7	172.9	167.8	0	110.6	L55 D56 F59 F77 L79 P80 A81 I87 Y88	L55-K84 HydrophobicContact CD2-CB 4.49Å; D56-K84 VanDerWaalsContact OD1-CD 3.26Å; D56-K84 WeakPolarHBondContact OD1-CD 3.49Å; D56-K84 WeakPolarHBondContact OD1-CE 3.41Å; D56-K84 IonicContact OD1-NZ 3.49Å; D56-K84 PolarHBondContact OD1-NZ 2.92Å; D56-K84 IonicContact OD2-NZ 2.67Å; D56-K84 PolarHBondContact OD2-NZ 2.66Å; F59-K84 HydrophobicContact CD1-CB 4.31Å; F59-K84 HydrophobicContact CD1-CD 3.85Å; F59-K84 HydrophobicContact CD1-CG 3.89Å; F59-K84 HydrophobicContact CD2-CB 3.68Å; F59-K84 HydrophobicContact CD2-CG 4.1Å; F59-K84 HydrophobicContact CE1-CB 4.44Å; F59-K84 HydrophobicContact CE1-CD 4.13Å; F59-K84 HydrophobicContact CE1-CG 3.79Å; F59-K84 HydrophobicContact CE2-CB 3.86Å; F59-K84 HydrophobicContact CE2-CG 4.02Å; F59-K84 HydrophobicContact CG-CB 3.93Å; F59-K84 HydrophobicContact CG-CD 4.15Å; F59-K84 HydrophobicContact CG-CG 4.03Å; F59-K84 HydrophobicContact CZ-CB 4.23Å; F59-K84 HydrophobicContact CZ-CG 3.86Å; F77-K84 WeakPolarHBondContact O-CE 3.37Å; F77-K84 PolarHBondContact O-NZ 3.48Å; L79-K84 HydrophobicContact CB-CG 4.11Å; L79-K84 WeakPolarHBondContact O-CE 3.36Å; P80-K84 PolarHBondContact O-N 2.96Å; A81-K84 WeakPolarHBondContact O-CB 3.42Å; A81-K84 PolarHBondContact O-N 3.23Å; K84-I87 PolarHBondContact O-N 3.42Å; K84-Y88 WeakPolarHBondContact O-CB 3.24Å; K84-Y88 PolarHBondContact O-N 2.86Å
85	W	79.2	Confident	71.9	Confident	16 Å²	16	66.5 Å²	66.5	6%	0.061	35%	0.348	C	S	.	.	H	α-helix	trans	-65.3	-43.3	177.4	-170.1	-129.9	0	0	0	112.9	L47 P48 M49 P50 L55 M58 A81 K83 I87 Y88 C89	L47-W85 HydrophobicContact CB-CZ2 3.86Å; L47-W85 PolarHBondContact O-NE1 3.47Å; P48-W85 WeakPolarHBondContact O-CZ2 3.49Å; M49-W85 HydrophobicContact CB-CD2 4.47Å; M49-W85 HydrophobicContact CB-CG 4.13Å; M49-W85 HydrophobicContact CG-CB 3.97Å; M49-W85 HydrophobicContact CG-CD2 4.19Å; M49-W85 HydrophobicContact CG-CG 3.76Å; M49-W85 HydrophobicContact SD-CB 3.86Å; M49-W85 HydrophobicContact SD-CG 4.22Å; P50-W85 HydrophobicContact CG-CE3 4.29Å; P50-W85 HydrophobicContact CG-CH2 4.16Å; P50-W85 HydrophobicContact CG-CZ3 3.89Å; L55-W85 HydrophobicContact CD1-CB 4.06Å; L55-W85 HydrophobicContact CD1-CD2 4.27Å; L55-W85 HydrophobicContact CD1-CE3 3.59Å; L55-W85 HydrophobicContact CD1-CZ3 4.38Å; M58-W85 HydrophobicContact CE-CZ3 4.11Å; A81-W85 WeakPolarHBondContact O-CB 3.38Å; A81-W85 PolarHBondContact O-N 3.45Å; K83-W85 VanDerWaalsContact C-N 3.29Å; K83-W85 PolarHBondContact O-N 2.9Å; W85-I87 PolarHBondContact O-N 3.2Å; W85-Y88 AromaticContact CE3-CD1 3.98Å; W85-Y88 HydrophobicContact CE3-CD1 3.98Å; W85-Y88 HydrophobicContact CE3-CG 4.44Å; W85-Y88 HydrophobicContact CH2-CD1 4.48Å; W85-Y88 AromaticContact CZ3-CD1 3.62Å; W85-Y88 HydrophobicContact CZ3-CD1 3.62Å; W85-Y88 HydrophobicContact CZ3-CE1 4.04Å; W85-Y88 HydrophobicContact CZ3-CG 4.41Å; W85-Y88 PolarHBondContact O-N 3.48Å; W85-C89 VanDerWaalsContact CE2-SG 3.57Å; W85-C89 WeakPolarHBondContact O-CB 3.33Å; W85-C89 PolarHBondContact O-N 3.1Å; W85-C89 PolarHBondContact O-SG 3.28Å
86	Q	73.8	Confident	71	Confident	114 Å²	114	69.1 Å²	69.1	53%	0.533	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-44.4	174.2	-80.9	-177	-27.4	0	0	112.9	E82 K83 C89 S90	E82-Q86 WeakPolarHBondContact O-CG 3.49Å; E82-Q86 PolarHBondContact O-N 3.04Å; E82-Q86 VanDerWaalsContact O-N 3.12Å; K83-Q86 PolarHBondContact O-N 3.39Å; Q86-C89 PolarHBondContact O-N 2.9Å; Q86-S90 WeakPolarHBondContact O-CB 3.47Å; Q86-S90 PolarHBondContact O-N 3.27Å
87	I	72.1	Confident	70.1	Confident	61 Å²	61	73.9 Å²	73.9	31%	0.313	37%	0.372	S	S	.	.	H	α-helix	trans	-62.8	-45.7	177.4	-67.8	164.1	0	0	0	110.2	F59 L62 L79 K83 K84 W85 S90 K91	F59-I87 HydrophobicContact CE2-CB 4.22Å; F59-I87 HydrophobicContact CE2-CG2 4.11Å; L62-I87 HydrophobicContact CD2-CG2 4.11Å; L79-I87 HydrophobicContact CD1-CD1 3.64Å; K83-I87 WeakPolarHBondContact O-CB 3.45Å; K83-I87 WeakPolarHBondContact O-CD1 3.42Å; K83-I87 VanDerWaalsContact O-CG1 3.27Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 3.04Å; K84-I87 PolarHBondContact O-N 3.42Å; W85-I87 PolarHBondContact O-N 3.2Å; I87-S90 PolarHBondContact O-N 3.32Å; I87-K91 PolarHBondContact O-N 3.46Å
88	Y	74.3	Confident	68.7	Low	47 Å²	47	75.4 Å²	75.4	18%	0.184	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-49.1	176.9	-176.2	-85.3	0	0	0	112.5	M58 L62 K84 W85 S90 K91 K92	M58-Y88 HydrophobicContact CB-CD2 4.46Å; M58-Y88 HydrophobicContact CB-CE2 4.05Å; M58-Y88 HydrophobicContact CE-CD1 4.36Å; M58-Y88 HydrophobicContact CE-CE1 3.54Å; M58-Y88 HydrophobicContact CE-CE2 4.15Å; M58-Y88 VanDerWaalsContact CE-CZ 3.44Å; M58-Y88 WeakPolarHBondContact CE-OH 3.38Å; M58-Y88 WeakPolarHBondContact O-CE2 3.39Å; L62-Y88 HydrophobicContact CB-CD2 4.23Å; L62-Y88 HydrophobicContact CD2-CD2 3.95Å; L62-Y88 HydrophobicContact CD2-CG 4.43Å; K84-Y88 WeakPolarHBondContact O-CB 3.24Å; K84-Y88 PolarHBondContact O-N 2.86Å; W85-Y88 AromaticContact CE3-CD1 3.98Å; W85-Y88 HydrophobicContact CE3-CD1 3.98Å; W85-Y88 HydrophobicContact CE3-CG 4.44Å; W85-Y88 HydrophobicContact CH2-CD1 4.48Å; W85-Y88 AromaticContact CZ3-CD1 3.62Å; W85-Y88 HydrophobicContact CZ3-CD1 3.62Å; W85-Y88 HydrophobicContact CZ3-CE1 4.04Å; W85-Y88 HydrophobicContact CZ3-CG 4.41Å; W85-Y88 PolarHBondContact O-N 3.48Å; Y88-S90 VanDerWaalsContact C-N 3.31Å; Y88-S90 PolarHBondContact O-N 3Å; Y88-K91 PolarHBondContact O-N 2.94Å; Y88-K92 HydrophobicContact CE1-CB 4.44Å; Y88-K92 HydrophobicContact CE1-CD 3.95Å; Y88-K92 VanDerWaalsContact O-CB 3.3Å; Y88-K92 WeakPolarHBondContact O-CB 3.49Å; Y88-K92 PolarHBondContact O-N 3.18Å
89	C	72.7	Confident	67.5	Low	36 Å²	36	79.1 Å²	79.1	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-60.3	-39.6	176.6	-69.2	0	0	0	0	112.4	W85 Q86 K93	W85-C89 VanDerWaalsContact CE2-SG 3.57Å; W85-C89 WeakPolarHBondContact O-CB 3.33Å; W85-C89 PolarHBondContact O-N 3.1Å; W85-C89 PolarHBondContact O-SG 3.28Å; Q86-C89 PolarHBondContact O-N 2.9Å; C89-K93 PolarHBondContact O-N 2.81Å; C89-K93 VanDerWaalsContact O-N 3.15Å
90	S	70	Confident	66.6	Low	72 Å²	72	79.5 Å²	79.5	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-49.6	177.1	-163.1	0	0	0	0	111.4	Q86 I87 Y88 K93 E94	Q86-S90 WeakPolarHBondContact O-CB 3.47Å; Q86-S90 PolarHBondContact O-N 3.27Å; I87-S90 PolarHBondContact O-N 3.32Å; Y88-S90 VanDerWaalsContact C-N 3.31Å; Y88-S90 PolarHBondContact O-N 3Å; S90-K93 PolarHBondContact O-N 2.93Å; S90-E94 PolarHBondContact O-N 3.32Å
91	K	65.9	Low	65.6	Low	82 Å²	82	79.7 Å²	79.7	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-68.7	-38.9	-178.3	-159	75.6	-166.4	162.8	0	112.5	L62 I87 Y88 K93 E94 Q95	L62-K91 HydrophobicContact CD1-CB 3.95Å; L62-K91 HydrophobicContact CD1-CG 3.88Å; I87-K91 PolarHBondContact O-N 3.46Å; Y88-K91 PolarHBondContact O-N 2.94Å; K91-K93 VanDerWaalsContact C-N 3.28Å; K91-K93 PolarHBondContact O-N 3.4Å; K91-E94 WeakPolarHBondContact CD-OE2 3.45Å; K91-E94 WeakPolarHBondContact CE-OE2 3.42Å; K91-E94 IonicContact NZ-OE2 2.94Å; K91-E94 PolarHBondContact NZ-OE2 3.47Å; K91-E94 WeakPolarHBondContact O-CB 3.49Å; K91-E94 PolarHBondContact O-N 3.01Å; K91-Q95 PolarHBondContact O-N 3.09Å
92	K	66.6	Low	65.1	Low	74 Å²	74	81.4 Å²	81.4	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-60.3	-37.4	174.7	-177.5	170.4	178	174	0	112.2	Y88 Q95 E96	Y88-K92 HydrophobicContact CE1-CB 4.44Å; Y88-K92 HydrophobicContact CE1-CD 3.95Å; Y88-K92 VanDerWaalsContact O-CB 3.3Å; Y88-K92 WeakPolarHBondContact O-CB 3.49Å; Y88-K92 PolarHBondContact O-N 3.18Å; K92-Q95 WeakPolarHBondContact O-CB 3.29Å; K92-Q95 PolarHBondContact O-N 2.96Å; K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 PolarHBondContact O-N 3.3Å
93	K	61.8	Low	64.7	Low	113 Å²	113	77.6 Å²	77.6	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-64.4	-43.8	175.8	-166.6	-178.4	-179.5	-95.9	0	112	C89 S90 K91 Q95 E96 E97	C89-K93 PolarHBondContact O-N 2.81Å; C89-K93 VanDerWaalsContact O-N 3.15Å; S90-K93 PolarHBondContact O-N 2.93Å; K91-K93 VanDerWaalsContact C-N 3.28Å; K91-K93 PolarHBondContact O-N 3.4Å; K93-Q95 VanDerWaalsContact C-N 3.31Å; K93-Q95 PolarHBondContact O-N 3.21Å; K93-E96 PolarHBondContact O-N 3.27Å; K93-E97 VanDerWaalsContact CE-OE1 3.25Å; K93-E97 WeakPolarHBondContact CE-OE1 3.26Å; K93-E97 IonicContact NZ-OE1 2.64Å; K93-E97 PolarHBondContact NZ-OE1 2.9Å; K93-E97 PolarHBondContact O-N 3.09Å
94	E	56.2	Low	65	Low	98 Å²	98	78.5 Å²	78.5	46%	0.458	39%	0.392	S	S	.	.	H	α-helix	trans	-59.8	-40.4	173	-66.1	178.2	175.9	0	0	112	S90 K91 N98	S90-E94 PolarHBondContact O-N 3.32Å; K91-E94 WeakPolarHBondContact CD-OE2 3.45Å; K91-E94 WeakPolarHBondContact CE-OE2 3.42Å; K91-E94 IonicContact NZ-OE2 2.94Å; K91-E94 PolarHBondContact NZ-OE2 3.47Å; K91-E94 WeakPolarHBondContact O-CB 3.49Å; K91-E94 PolarHBondContact O-N 3.01Å; E94-N98 WeakPolarHBondContact O-CB 3.4Å
95	Q	55.1	Low	65.3	Low	84 Å²	84	77.9 Å²	77.9	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-37	176.1	-107.9	175.7	5.1	0	0	113.1	E65 K91 K92 K93	E65-Q95 PolarHBondContact OE2-NE2 3.28Å; K91-Q95 PolarHBondContact O-N 3.09Å; K92-Q95 WeakPolarHBondContact O-CB 3.29Å; K92-Q95 PolarHBondContact O-N 2.96Å; K93-Q95 VanDerWaalsContact C-N 3.31Å; K93-Q95 PolarHBondContact O-N 3.21Å
96	E	55.1	Low	65.6	Low	111 Å²	111	79.9 Å²	79.9	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-75.4	-31	-179.3	-76.1	-177.5	-171	0	0	113.5	K92 K93	K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 PolarHBondContact O-N 3.3Å; K93-E96 PolarHBondContact O-N 3.27Å
97	E	52.6	Low	66.2	Low	139 Å²	139	78.5 Å²	78.5	65%	0.65	39%	0.39	S	S	*	.	H	α-helix	trans	-75.8	-18.1	178.6	-71	178.6	-173.5	0	0	113.8	K93	K93-E97 VanDerWaalsContact CE-OE1 3.25Å; K93-E97 WeakPolarHBondContact CE-OE1 3.26Å; K93-E97 IonicContact NZ-OE1 2.64Å; K93-E97 PolarHBondContact NZ-OE1 2.9Å; K93-E97 PolarHBondContact O-N 3.09Å
98	N	49.2	Very low	66.9	Low	91 Å²	91	75.9 Å²	75.9	49%	0.487	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	17.2	-164.4	-145.2	1.8	0	0	0	116.1	E94 S100	E94-N98 WeakPolarHBondContact O-CB 3.4Å; N98-S100 PolarHBondContact O-N 3.24Å
99	K	52	Low	67.5	Low	161 Å²	161	74.3 Å²	74.3	70%	0.7	37%	0.371	S	S	*	.			trans	-77.6	72.5	-170.8	-68.6	172.7	-178.3	162	0	114.2
100	S	60.6	Low	68.1	Low	55 Å²	55	77.4 Å²	77.4	39%	0.385	39%	0.385	S	S	.	.	S	Bend	trans	-109.7	166.8	172.4	65.8	0	0	0	0	112.4	N98 T102 S103	N98-S100 PolarHBondContact O-N 3.24Å; S100-T102 PolarHBondContact O-N 2.83Å; S100-T102 PolarHBondContact OG-OG1 2.92Å; S100-T102 VanDerWaalsContact OG-OG1 3.12Å; S100-S103 WeakPolarHBondContact O-CB 3.49Å; S100-S103 PolarHBondContact O-N 3.05Å; S100-S103 PolarHBondContact O-OG 3.33Å
101	A	59.2	Low	68.8	Low	71 Å²	71	76.6 Å²	76.6	59%	0.587	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-60.6	-29.5	-179.4	0	0	0	0	0	113.4	S103 W104	A101-S103 PolarHBondContact O-N 3.4Å; A101-W104 PolarHBondContact O-N 3.43Å
102	T	65.4	Low	69.8	Low	50 Å²	50	72.9 Å²	72.9	31%	0.307	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-76	4.5	176.3	43.2	0	0	0	0	114.3	S100 Y107 Y108	S100-T102 PolarHBondContact O-N 2.83Å; S100-T102 PolarHBondContact OG-OG1 2.92Å; S100-T102 VanDerWaalsContact OG-OG1 3.12Å; T102-Y107 HydrophobicContact CG2-CD1 4.23Å; T102-Y107 HydrophobicContact CG2-CE1 3.89Å; T102-Y108 WeakPolarHBondContact CB-OH 3.41Å; T102-Y108 VanDerWaalsContact O-CE2 3.31Å; T102-Y108 WeakPolarHBondContact O-CE2 3.46Å; T102-Y108 PolarHBondContact O-OH 3.37Å
103	S	67.4	Low	70.6	Confident	27 Å²	27	72.6 Å²	72.6	19%	0.189	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-87.2	-2.8	169.5	67	0	0	0	0	114.2	S100 A101 F150	S100-S103 WeakPolarHBondContact O-CB 3.49Å; S100-S103 PolarHBondContact O-N 3.05Å; S100-S103 PolarHBondContact O-OG 3.33Å; A101-S103 PolarHBondContact O-N 3.4Å; S103-F150 WeakPolarHBondContact O-CD2 3.32Å
104	W	78	Confident	71.6	Confident	133 Å²	133	72.2 Å²	72.2	50%	0.504	36%	0.362	S	S	.	.			trans	-111.3	129	-178.6	-64.8	97	0	0	0	112.4	A101 E106 Y107	A101-W104 PolarHBondContact O-N 3.43Å; W104-E106 VanDerWaalsContact C-N 3.27Å; W104-E106 PolarHBondContact O-N 3.47Å; W104-Y107 PolarHBondContact O-N 2.9Å
105	P	84.1	Confident	72.7	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-54.5	-39.2	175.3	-30.8	38.7	0	0	0	114.2	Y107 Y108 I109 F150 R153 F154 L157	P105-Y107 VanDerWaalsContact C-N 3.31Å; P105-Y107 PolarHBondContact O-N 2.7Å; P105-Y108 PolarHBondContact O-N 3.22Å; P105-Y108 VanDerWaalsContact O-N 3.09Å; P105-I109 HydrophobicContact CB-CD1 4.45Å; P105-I109 WeakPolarHBondContact O-CG1 3.33Å; P105-I109 PolarHBondContact O-N 3.05Å; P105-F150 HydrophobicContact CB-CE2 4.49Å; P105-F150 HydrophobicContact CG-CD1 4.34Å; P105-F150 HydrophobicContact CG-CD2 3.69Å; P105-F150 HydrophobicContact CG-CE1 4.39Å; P105-F150 HydrophobicContact CG-CE2 3.76Å; P105-F150 HydrophobicContact CG-CG 3.99Å; P105-F150 HydrophobicContact CG-CZ 4.11Å; P105-F150 WeakPolarHBondContact CG-O 3.41Å; P105-R153 HydrophobicContact CG-CB 4.1Å; P105-R153 HydrophobicContact CG-CG 4.06Å; P105-F154 HydrophobicContact CB-CB 3.96Å; P105-F154 HydrophobicContact CB-CD2 4.12Å; P105-F154 HydrophobicContact CG-CB 4.26Å; P105-L157 HydrophobicContact CB-CD1 4.43Å
106	E	85.2	Confident	73.7	Confident	57 Å²	57	65.7 Å²	65.7	27%	0.266	34%	0.336	S	S	.	.	H	α-helix	trans	-52.2	-46.2	-177.6	-70.1	84.4	161.5	0	0	112.2	W104 Y108 I109 D110 R153 L157	W104-E106 VanDerWaalsContact C-N 3.27Å; W104-E106 PolarHBondContact O-N 3.47Å; E106-Y108 VanDerWaalsContact C-N 3.29Å; E106-Y108 PolarHBondContact O-N 3.43Å; E106-I109 PolarHBondContact O-N 3.13Å; E106-D110 PolarHBondContact O-N 3.44Å; E106-R153 IonicContact OE1-CZ 2.63Å; E106-R153 IonicContact OE1-NE 2.65Å; E106-R153 PolarHBondContact OE1-NE 3.27Å; E106-R153 IonicContact OE1-NH2 2.65Å; E106-R153 PolarHBondContact OE1-NH2 2.89Å; E106-R153 IonicContact OE2-NE 2.73Å; E106-R153 PolarHBondContact OE2-NE 3.37Å; E106-L157 HydrophobicContact CG-CD1 3.8Å
107	Y	86.4	Confident	74.4	Confident	86 Å²	86	64 Å²	64	34%	0.337	34%	0.341	S	S	.	.	H	α-helix	trans	-55.7	-45.5	179.6	167.6	-101.7	0	0	0	111.5	T102 W104 P105 Q111 T135	T102-Y107 HydrophobicContact CG2-CD1 4.23Å; T102-Y107 HydrophobicContact CG2-CE1 3.89Å; W104-Y107 PolarHBondContact O-N 2.9Å; P105-Y107 VanDerWaalsContact C-N 3.31Å; P105-Y107 PolarHBondContact O-N 2.7Å; Y107-Q111 HydrophobicContact CD2-CG 4.42Å; Y107-Q111 HydrophobicContact CE1-CG 4.34Å; Y107-Q111 HydrophobicContact CE2-CG 3.98Å; Y107-Q111 VanDerWaalsContact O-CG 3.26Å; Y107-Q111 WeakPolarHBondContact O-CG 3.48Å; Y107-Q111 PolarHBondContact O-N 3.04Å; Y107-T135 HydrophobicContact CE1-CG2 4.45Å
108	Y	87.4	Confident	75.1	Confident	6 Å²	6	64.2 Å²	64.2	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-72.9	-35.4	-179.8	-63	-74.4	0	0	0	112.7	T102 P105 E106 Q111 L112 T135 S138 L139 A142 F150	T102-Y108 WeakPolarHBondContact CB-OH 3.41Å; T102-Y108 VanDerWaalsContact O-CE2 3.31Å; T102-Y108 WeakPolarHBondContact O-CE2 3.46Å; T102-Y108 PolarHBondContact O-OH 3.37Å; P105-Y108 PolarHBondContact O-N 3.22Å; P105-Y108 VanDerWaalsContact O-N 3.09Å; E106-Y108 VanDerWaalsContact C-N 3.29Å; E106-Y108 PolarHBondContact O-N 3.43Å; Y108-Q111 PolarHBondContact O-N 3.17Å; Y108-L112 WeakPolarHBondContact O-CB 3.43Å; Y108-L112 VanDerWaalsContact O-CG 3.28Å; Y108-L112 WeakPolarHBondContact O-CG 3.36Å; Y108-L112 PolarHBondContact O-N 3.28Å; Y108-T135 HydrophobicContact CD1-CG2 4.41Å; Y108-S138 PolarHBondContact OH-OG 2.97Å; Y108-L139 HydrophobicContact CD1-CB 3.64Å; Y108-L139 HydrophobicContact CD1-CD1 4.29Å; Y108-L139 HydrophobicContact CD1-CG 4.45Å; Y108-L139 HydrophobicContact CD2-CD1 3.98Å; Y108-L139 HydrophobicContact CE1-CB 3.97Å; Y108-L139 HydrophobicContact CG-CB 4.03Å; Y108-L139 HydrophobicContact CG-CD1 3.78Å; Y108-L139 HydrophobicContact CG-CG 4.37Å; Y108-A142 HydrophobicContact CE2-CB 4.13Å; Y108-F150 HydrophobicContact CD2-CE2 4.49Å; Y108-F150 AromaticContact CD2-CZ 3.94Å; Y108-F150 HydrophobicContact CD2-CZ 3.94Å; Y108-F150 HydrophobicContact CE2-CE2 4.26Å; Y108-F150 AromaticContact CE2-CZ 3.87Å; Y108-F150 HydrophobicContact CE2-CZ 3.87Å
109	I	87.3	Confident	75.4	Confident	14 Å²	14	66.7 Å²	66.7	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-45.2	176.8	-68.2	171	0	0	0	110.1	P105 E106 Q111 L112 N113 F154 L157	P105-I109 HydrophobicContact CB-CD1 4.45Å; P105-I109 WeakPolarHBondContact O-CG1 3.33Å; P105-I109 PolarHBondContact O-N 3.05Å; E106-I109 PolarHBondContact O-N 3.13Å; I109-Q111 PolarHBondContact O-N 3.04Å; I109-L112 PolarHBondContact O-N 3.35Å; I109-N113 WeakPolarHBondContact O-CB 3.23Å; I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 2.93Å; I109-N113 PolarHBondContact O-ND2 3.38Å; I109-N113 VanDerWaalsContact O-ND2 3.09Å; I109-F154 HydrophobicContact CD1-CD2 3.89Å; I109-F154 HydrophobicContact CD1-CE2 4.12Å; I109-F154 HydrophobicContact CG1-CD2 3.91Å; I109-F154 HydrophobicContact CG1-CE2 3.67Å; I109-L157 HydrophobicContact CD1-CB 3.55Å; I109-L157 HydrophobicContact CD1-CD1 4.28Å
110	D	84.9	Confident	75.3	Confident	100 Å²	100	64.9 Å²	64.9	54%	0.535	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-44.6	173.6	-77.5	-19.7	0	0	0	111.7	E106 N113 L114	E106-D110 PolarHBondContact O-N 3.44Å; D110-N113 PolarHBondContact O-N 3.13Å; D110-L114 WeakPolarHBondContact O-CB 3.5Å; D110-L114 VanDerWaalsContact O-CG 3.24Å; D110-L114 WeakPolarHBondContact O-CG 3.16Å; D110-L114 PolarHBondContact O-N 2.67Å
111	Q	84.9	Confident	74.4	Confident	56 Å²	56	69.4 Å²	69.4	26%	0.262	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-43	176.6	-71.5	-53.9	-52.8	0	0	112.7	Y107 Y108 I109 N113 L114 M115 T135	Y107-Q111 HydrophobicContact CD2-CG 4.42Å; Y107-Q111 HydrophobicContact CE1-CG 4.34Å; Y107-Q111 HydrophobicContact CE2-CG 3.98Å; Y107-Q111 VanDerWaalsContact O-CG 3.26Å; Y107-Q111 WeakPolarHBondContact O-CG 3.48Å; Y107-Q111 PolarHBondContact O-N 3.04Å; Y108-Q111 PolarHBondContact O-N 3.17Å; I109-Q111 PolarHBondContact O-N 3.04Å; Q111-N113 PolarHBondContact O-N 2.87Å; Q111-L114 PolarHBondContact O-N 3.23Å; Q111-M115 HydrophobicContact CB-CE 4.22Å; Q111-M115 VanDerWaalsContact O-CG 3.26Å; Q111-M115 WeakPolarHBondContact O-CG 3.34Å; Q111-M115 PolarHBondContact O-N 3.36Å; Q111-T135 HydrophobicContact CB-CG2 4.04Å; Q111-T135 HydrophobicContact CG-CG2 4.12Å
112	L	85.9	Confident	73.7	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.016	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-45.2	174.7	-73.9	170.9	0	0	0	111.6	Y108 I109 M115 A116 I136 L139 C162 I163 F166 L183	Y108-L112 WeakPolarHBondContact O-CB 3.43Å; Y108-L112 VanDerWaalsContact O-CG 3.28Å; Y108-L112 WeakPolarHBondContact O-CG 3.36Å; Y108-L112 PolarHBondContact O-N 3.28Å; I109-L112 PolarHBondContact O-N 3.35Å; L112-M115 PolarHBondContact O-N 3.26Å; L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 3.07Å; L112-I136 HydrophobicContact CD2-CG1 4.33Å; L112-L139 HydrophobicContact CD1-CD2 3.66Å; L112-L139 HydrophobicContact CD2-CD2 4.49Å; L112-L139 HydrophobicContact CG-CD2 4.28Å; L112-C162 HydrophobicContact CD1-CB 4.47Å; L112-I163 HydrophobicContact CD1-CG1 3.68Å; L112-F166 HydrophobicContact CD2-CD1 3.86Å; L112-F166 HydrophobicContact CD2-CE1 4.34Å; L112-L183 HydrophobicContact CD2-CD2 3.7Å
113	N	85	Confident	73	Confident	68 Å²	68	75.8 Å²	75.8	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-64.9	-41.8	178.7	-73.3	-35.8	0	0	0	111.9	I109 D110 Q111 M115 A116 A117 C162	I109-N113 WeakPolarHBondContact O-CB 3.23Å; I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 2.93Å; I109-N113 PolarHBondContact O-ND2 3.38Å; I109-N113 VanDerWaalsContact O-ND2 3.09Å; D110-N113 PolarHBondContact O-N 3.13Å; Q111-N113 PolarHBondContact O-N 2.87Å; N113-M115 PolarHBondContact O-N 3.01Å; N113-A116 PolarHBondContact O-N 2.9Å; N113-A117 WeakPolarHBondContact O-CB 3.41Å; N113-A117 PolarHBondContact O-N 3.18Å; N113-C162 PolarHBondContact ND2-SG 2.96Å; N113-C162 PolarHBondContact OD1-SG 3.48Å
114	L	81.3	Confident	72.1	Confident	106 Å²	106	78.9 Å²	78.9	56%	0.555	41%	0.414	S	S	*	.	H	α-helix	trans	-62.4	-39.8	174.5	-74.9	167.6	0	0	0	112.4	D110 Q111 R118	D110-L114 WeakPolarHBondContact O-CB 3.5Å; D110-L114 VanDerWaalsContact O-CG 3.24Å; D110-L114 WeakPolarHBondContact O-CG 3.16Å; D110-L114 PolarHBondContact O-N 2.67Å; Q111-L114 PolarHBondContact O-N 3.23Å; L114-R118 PolarHBondContact O-N 2.69Å
115	M	80.2	Confident	71	Confident	22 Å²	22	80.2 Å²	80.2	11%	0.108	43%	0.426	C	S	.	.	H	α-helix	trans	-69	-44.7	176.1	-68.8	-179.6	-152.9	0	0	112	Q111 L112 N113 A117 R118 R132 T135 I136 F166	Q111-M115 HydrophobicContact CB-CE 4.22Å; Q111-M115 VanDerWaalsContact O-CG 3.26Å; Q111-M115 WeakPolarHBondContact O-CG 3.34Å; Q111-M115 PolarHBondContact O-N 3.36Å; L112-M115 PolarHBondContact O-N 3.26Å; N113-M115 PolarHBondContact O-N 3.01Å; M115-A117 VanDerWaalsContact C-N 3.31Å; M115-A117 PolarHBondContact O-N 3.17Å; M115-R118 PolarHBondContact O-N 2.97Å; M115-R132 HydrophobicContact CE-CB 4.07Å; M115-R132 HydrophobicContact CE-CG 3.84Å; M115-R132 HydrophobicContact CG-CG 4.13Å; M115-R132 HydrophobicContact SD-CB 3.82Å; M115-R132 HydrophobicContact SD-CG 3.68Å; M115-T135 HydrophobicContact CE-CG2 4.16Å; M115-I136 HydrophobicContact SD-CD1 3.98Å; M115-I136 HydrophobicContact SD-CG1 4.44Å; M115-F166 HydrophobicContact CB-CD1 4.47Å; M115-F166 HydrophobicContact CB-CE1 3.64Å; M115-F166 HydrophobicContact CB-CZ 3.68Å; M115-F166 HydrophobicContact SD-CE1 4.2Å
116	A	75	Confident	69.6	Low	23 Å²	23	89 Å²	89	19%	0.19	46%	0.464	C	S	.	.	H	α-helix	trans	-65.1	-32.6	177.9	0	0	0	0	0	112.9	L112 N113 F166	L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 3.07Å; N113-A116 PolarHBondContact O-N 2.9Å; A116-F166 HydrophobicContact CB-CB 4.02Å; A116-F166 HydrophobicContact CB-CD2 4.04Å; A116-F166 HydrophobicContact CB-CG 4.01Å
117	A	71.1	Confident	68	Low	76 Å²	76	94.1 Å²	94.1	63%	0.628	49%	0.488	S	S	*	.	H	α-helix	trans	-78.3	-12.4	178.9	0	0	0	0	0	114.6	N113 M115 K119	N113-A117 WeakPolarHBondContact O-CB 3.41Å; N113-A117 PolarHBondContact O-N 3.18Å; M115-A117 VanDerWaalsContact C-N 3.31Å; M115-A117 PolarHBondContact O-N 3.17Å; A117-K119 PolarHBondContact O-N 3.04Å
118	R	66.8	Low	67.2	Low	143 Å²	143	92.4 Å²	92.4	54%	0.54	48%	0.484	S	S	.	.			trans	-75.5	30.6	-169.5	-131.2	176.9	-175.6	-161.3	0.9	114.9	L114 M115 T120 D128	L114-R118 PolarHBondContact O-N 2.69Å; M115-R118 PolarHBondContact O-N 2.97Å; R118-T120 PolarHBondContact O-N 2.64Å; R118-D128 IonicContact CZ-OD2 3.16Å; R118-D128 IonicContact NH1-OD2 3.95Å; R118-D128 PolarHBondContact NH1-OD2 3.23Å; R118-D128 IonicContact NH2-OD2 2.67Å
119	K	54.9	Low	66.4	Low	142 Å²	142	95.9 Å²	95.9	62%	0.617	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	22.2	-158.8	-157.1	168.1	-179	153.5	0	116.1	A117 S169	A117-K119 PolarHBondContact O-N 3.04Å; K119-S169 PolarHBondContact NZ-O 3.45Å
120	T	49.8	Very low	66	Low	124 Å²	124	100.8 Å²	100.8	76%	0.761	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.6	-8.6	-164.9	-42.8	0	0	0	0	119.2	R118	R118-T120 PolarHBondContact O-N 2.64Å
121	L	42.3	Very low	65.7	Low	149 Å²	149	102.3 Å²	102.3	78%	0.78	53%	0.527	S	S	*	.	S	Bend	trans	-149.4	130.6	179.2	-141.5	84.1	0	0	0	116.8
122	L	45.3	Very low	65.6	Low	153 Å²	153	102 Å²	102	80%	0.801	52%	0.524	S	S	*	.			trans	62.8	146.9	167.6	-69.1	166	0	0	0	117.9	L124	L122-L124 PolarHBondContact O-N 2.86Å
123	A	50.1	Low	65.6	Low	103 Å²	103	102.9 Å²	102.9	85%	0.851	53%	0.529	S	S	*	.			trans	-75.6	111.1	172.6	0	0	0	0	0	109.1
124	L	49.2	Very low	65.7	Low	91 Å²	91	105.3 Å²	105.3	48%	0.476	54%	0.536	S	S	.	.			trans	-80.4	149.5	176	-70	161.4	0	0	0	110.6	L122 D128	L122-L124 PolarHBondContact O-N 2.86Å; L124-D128 HydrophobicContact CB-CB 4.11Å
125	E	54.7	Low	66	Low	162 Å²	162	101.2 Å²	101.2	76%	0.757	52%	0.515	S	S	*	.			trans	-73.8	156.9	-176.7	-63.1	175.4	127.6	0	0	110.9	E127 D128	E125-E127 PolarHBondContact O-N 3.17Å; E125-D128 VanDerWaalsContact O-CB 3.32Å; E125-D128 WeakPolarHBondContact O-CB 3.4Å; E125-D128 PolarHBondContact O-N 2.86Å
126	K	54.4	Low	66.5	Low	184 Å²	184	100.3 Å²	100.3	80%	0.8	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.1	-169.4	-73.2	-172.5	173.2	-174.5	0	114.9	D128 E129 E130	K126-D128 VanDerWaalsContact C-N 3.28Å; K126-D128 PolarHBondContact O-N 3.2Å; K126-E129 PolarHBondContact O-N 2.88Å; K126-E130 PolarHBondContact O-N 3.21Å
127	E	51.2	Low	67.1	Low	166 Å²	166	102.1 Å²	102.1	78%	0.776	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-34.8	176.2	-59	-171.5	132.5	0	0	111.4	E125 E129 E130 E131	E125-E127 PolarHBondContact O-N 3.17Å; E127-E129 PolarHBondContact O-N 3.12Å; E127-E130 PolarHBondContact O-N 3.21Å; E127-E131 PolarHBondContact O-N 3Å; E127-E131 VanDerWaalsContact O-N 3.15Å
128	D	70.3	Confident	68	Low	49 Å²	49	100.6 Å²	100.6	26%	0.262	50%	0.5	S	S	.	.	H	α-helix	trans	-68.3	-19.5	178	-131.4	78	0	0	0	112.6	R118 L124 E125 K126 R132	R118-D128 IonicContact CZ-OD2 3.16Å; R118-D128 IonicContact NH1-OD2 3.95Å; R118-D128 PolarHBondContact NH1-OD2 3.23Å; R118-D128 IonicContact NH2-OD2 2.67Å; L124-D128 HydrophobicContact CB-CB 4.11Å; E125-D128 VanDerWaalsContact O-CB 3.32Å; E125-D128 WeakPolarHBondContact O-CB 3.4Å; E125-D128 PolarHBondContact O-N 2.86Å; K126-D128 VanDerWaalsContact C-N 3.28Å; K126-D128 PolarHBondContact O-N 3.2Å; D128-R132 VanDerWaalsContact O-CG 3.23Å; D128-R132 WeakPolarHBondContact O-CG 3.34Å; D128-R132 PolarHBondContact O-NE 2.92Å
129	E	70.3	Confident	69.1	Low	79 Å²	79	93.8 Å²	93.8	37%	0.369	48%	0.475	S	S	.	.	H	α-helix	trans	-83.6	-39.8	172.9	-166.2	-174.1	148.6	0	0	112.1	K126 E127 R132 N133 S177 I179	K126-E129 PolarHBondContact O-N 2.88Å; E127-E129 PolarHBondContact O-N 3.12Å; E129-R132 PolarHBondContact O-N 3.2Å; E129-N133 WeakPolarHBondContact O-CB 3.38Å; E129-N133 PolarHBondContact O-N 3.47Å; E129-S177 WeakPolarHBondContact OE1-CB 3.31Å; E129-I179 HydrophobicContact CG-CD1 4.09Å
130	E	77.6	Confident	70.8	Confident	118 Å²	118	90.1 Å²	90.1	55%	0.551	46%	0.459	S	S	*	.	H	α-helix	trans	-70.1	-35.1	-179	-153.9	-173.3	112	0	0	111.8	K126 E127 K134	K126-E130 PolarHBondContact O-N 3.21Å; E127-E130 PolarHBondContact O-N 3.21Å; E130-K134 WeakPolarHBondContact O-CD 3.38Å; E130-K134 VanDerWaalsContact O-CG 3.24Å; E130-K134 WeakPolarHBondContact O-CG 3.25Å; E130-K134 PolarHBondContact O-N 3.45Å; E130-K134 WeakPolarHBondContact OE1-CE 3.41Å; E130-K134 IonicContact OE1-NZ 2.83Å; E130-K134 PolarHBondContact OE1-NZ 2.91Å
131	E	80.3	Confident	72.7	Confident	131 Å²	131	87.1 Å²	87.1	61%	0.612	44%	0.44	S	S	*	.	H	α-helix	trans	-66.8	-47.3	172.8	-171.4	163.7	-138.5	0	0	112.1	E127 N133 K134 T135	E127-E131 PolarHBondContact O-N 3Å; E127-E131 VanDerWaalsContact O-N 3.15Å; E131-N133 VanDerWaalsContact C-N 3.28Å; E131-N133 PolarHBondContact O-N 2.99Å; E131-K134 WeakPolarHBondContact O-CB 3.38Å; E131-K134 PolarHBondContact O-N 3.09Å; E131-T135 PolarHBondContact O-N 2.73Å; E131-T135 PolarHBondContact O-OG1 3.28Å; E131-T135 VanDerWaalsContact O-OG1 3.12Å
132	R	82.1	Confident	74.7	Confident	51 Å²	51	80.2 Å²	80.2	19%	0.192	40%	0.404	C	S	.	.	H	α-helix	trans	-54.3	-43.9	173.4	-75.6	-177.2	-70.5	146.7	0.7	112.2	M115 D128 E129 T135 I136 I179	M115-R132 HydrophobicContact CE-CB 4.07Å; M115-R132 HydrophobicContact CE-CG 3.84Å; M115-R132 HydrophobicContact CG-CG 4.13Å; M115-R132 HydrophobicContact SD-CB 3.82Å; M115-R132 HydrophobicContact SD-CG 3.68Å; D128-R132 VanDerWaalsContact O-CG 3.23Å; D128-R132 WeakPolarHBondContact O-CG 3.34Å; D128-R132 PolarHBondContact O-NE 2.92Å; E129-R132 PolarHBondContact O-N 3.2Å; R132-T135 PolarHBondContact O-N 3.46Å; R132-I136 WeakPolarHBondContact O-CG1 3.34Å; R132-I136 PolarHBondContact O-N 3.1Å; R132-I179 HydrophobicContact CB-CD1 3.96Å
133	N	86.6	Confident	76.7	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.112	37%	0.368	C	S	.	.	H	α-helix	trans	-65.6	-38.8	177.3	-169.7	51.9	0	0	0	112.4	E129 E131 I136 E137 Q178 I179 S182	E129-N133 WeakPolarHBondContact O-CB 3.38Å; E129-N133 PolarHBondContact O-N 3.47Å; E131-N133 VanDerWaalsContact C-N 3.28Å; E131-N133 PolarHBondContact O-N 2.99Å; N133-I136 PolarHBondContact O-N 3.37Å; N133-E137 PolarHBondContact O-N 2.68Å; N133-Q178 PolarHBondContact ND2-OE1 3.39Å; N133-I179 HydrophobicContact CB-CG1 3.92Å; N133-S182 PolarHBondContact OD1-OG 2.65Å
134	K	87.1	Confident	78.3	Confident	118 Å²	118	75.5 Å²	75.5	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-62.3	-40.9	174.1	-73.3	160.8	-172.9	158.5	0	112	E130 E131 I136 S138	E130-K134 WeakPolarHBondContact O-CD 3.38Å; E130-K134 VanDerWaalsContact O-CG 3.24Å; E130-K134 WeakPolarHBondContact O-CG 3.25Å; E130-K134 PolarHBondContact O-N 3.45Å; E130-K134 WeakPolarHBondContact OE1-CE 3.41Å; E130-K134 IonicContact OE1-NZ 2.83Å; E130-K134 PolarHBondContact OE1-NZ 2.91Å; E131-K134 WeakPolarHBondContact O-CB 3.38Å; E131-K134 PolarHBondContact O-N 3.09Å; K134-I136 VanDerWaalsContact C-N 3.31Å; K134-I136 PolarHBondContact O-N 3Å; K134-S138 VanDerWaalsContact O-CB 3.31Å; K134-S138 WeakPolarHBondContact O-CB 3.42Å; K134-S138 PolarHBondContact O-N 3.29Å
135	T	87.8	Confident	79.9	Confident	20 Å²	20	75.2 Å²	75.2	12%	0.123	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-40.3	175.7	-47.6	0	0	0	0	111.8	Y107 Y108 Q111 M115 E131 R132 S138 L139	Y107-T135 HydrophobicContact CE1-CG2 4.45Å; Y108-T135 HydrophobicContact CD1-CG2 4.41Å; Q111-T135 HydrophobicContact CB-CG2 4.04Å; Q111-T135 HydrophobicContact CG-CG2 4.12Å; M115-T135 HydrophobicContact CE-CG2 4.16Å; E131-T135 PolarHBondContact O-N 2.73Å; E131-T135 PolarHBondContact O-OG1 3.28Å; E131-T135 VanDerWaalsContact O-OG1 3.12Å; R132-T135 PolarHBondContact O-N 3.46Å; T135-S138 WeakPolarHBondContact O-CB 3.41Å; T135-S138 PolarHBondContact O-N 2.89Å; T135-L139 PolarHBondContact O-N 3.4Å
136	I	89.2	Confident	81.1	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-78.5	-37.1	-177.9	-61.5	168.3	0	0	0	111.7	L112 M115 R132 N133 K134 S138 L139 K140 F166 I179 L183	L112-I136 HydrophobicContact CD2-CG1 4.33Å; M115-I136 HydrophobicContact SD-CD1 3.98Å; M115-I136 HydrophobicContact SD-CG1 4.44Å; R132-I136 WeakPolarHBondContact O-CG1 3.34Å; R132-I136 PolarHBondContact O-N 3.1Å; N133-I136 PolarHBondContact O-N 3.37Å; K134-I136 VanDerWaalsContact C-N 3.31Å; K134-I136 PolarHBondContact O-N 3Å; I136-S138 VanDerWaalsContact C-N 3.28Å; I136-S138 PolarHBondContact O-N 2.59Å; I136-L139 PolarHBondContact O-N 2.93Å; I136-K140 WeakPolarHBondContact O-CB 3.29Å; I136-K140 PolarHBondContact O-N 3.03Å; I136-F166 HydrophobicContact CD1-CE1 4Å; I136-I179 HydrophobicContact CD1-CG1 4.45Å; I136-I179 HydrophobicContact CD1-CG2 3.6Å; I136-L183 HydrophobicContact CD1-CD2 4.2Å; I136-L183 HydrophobicContact CD1-CG 4.39Å; I136-L183 HydrophobicContact CG2-CD2 3.91Å; I136-L183 HydrophobicContact CG2-CG 4.11Å
137	E	89	Confident	82.1	Confident	61 Å²	61	62.8 Å²	62.8	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-31.6	168.9	-79.4	-70.9	135	0	0	112.1	N133 K140 T141 S182	N133-E137 PolarHBondContact O-N 2.68Å; E137-K140 WeakPolarHBondContact OE1-CD 3.37Å; E137-K140 IonicContact OE1-NZ 2.67Å; E137-K140 PolarHBondContact OE1-NZ 3.1Å; E137-K140 IonicContact OE2-NZ 2.6Å; E137-K140 PolarHBondContact OE2-NZ 3.15Å; E137-T141 WeakPolarHBondContact O-CB 3.33Å; E137-T141 PolarHBondContact O-N 2.91Å; E137-T141 PolarHBondContact O-OG1 3.31Å; E137-S182 WeakPolarHBondContact OE1-CB 3.46Å; E137-S182 PolarHBondContact OE1-OG 3.35Å; E137-S182 VanDerWaalsContact OE1-OG 3.09Å
138	S	88.8	Confident	83.4	Confident	44 Å²	44	56.1 Å²	56.1	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-66.1	-43.6	170.3	-170.5	0	0	0	0	111.7	Y108 K134 T135 I136 T141 A142	Y108-S138 PolarHBondContact OH-OG 2.97Å; K134-S138 VanDerWaalsContact O-CB 3.31Å; K134-S138 WeakPolarHBondContact O-CB 3.42Å; K134-S138 PolarHBondContact O-N 3.29Å; T135-S138 WeakPolarHBondContact O-CB 3.41Å; T135-S138 PolarHBondContact O-N 2.89Å; I136-S138 VanDerWaalsContact C-N 3.28Å; I136-S138 PolarHBondContact O-N 2.59Å; S138-T141 PolarHBondContact O-N 3.46Å; S138-A142 WeakPolarHBondContact O-CB 3.35Å; S138-A142 PolarHBondContact O-N 3.09Å
139	L	90.6	Very high	83.8	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-50.3	173.2	173.2	59.2	0	0	0	111.7	Y108 L112 T135 I136 T141 A142 L143 F154 I163	Y108-L139 HydrophobicContact CD1-CB 3.64Å; Y108-L139 HydrophobicContact CD1-CD1 4.29Å; Y108-L139 HydrophobicContact CD1-CG 4.45Å; Y108-L139 HydrophobicContact CD2-CD1 3.98Å; Y108-L139 HydrophobicContact CE1-CB 3.97Å; Y108-L139 HydrophobicContact CG-CB 4.03Å; Y108-L139 HydrophobicContact CG-CD1 3.78Å; Y108-L139 HydrophobicContact CG-CG 4.37Å; L112-L139 HydrophobicContact CD1-CD2 3.66Å; L112-L139 HydrophobicContact CD2-CD2 4.49Å; L112-L139 HydrophobicContact CG-CD2 4.28Å; T135-L139 PolarHBondContact O-N 3.4Å; I136-L139 PolarHBondContact O-N 2.93Å; L139-T141 PolarHBondContact O-N 2.58Å; L139-A142 PolarHBondContact O-N 3Å; L139-A142 VanDerWaalsContact O-N 3.11Å; L139-L143 HydrophobicContact CD1-CD1 3.81Å; L139-L143 HydrophobicContact CD1-CD2 4.38Å; L139-L143 HydrophobicContact CD1-CG 3.78Å; L139-L143 HydrophobicContact CD2-CD1 4.49Å; L139-L143 HydrophobicContact CG-CD1 3.84Å; L139-L143 HydrophobicContact CG-CG 4.27Å; L139-L143 WeakPolarHBondContact O-CB 3.41Å; L139-L143 WeakPolarHBondContact O-CG 3.17Å; L139-L143 PolarHBondContact O-N 2.98Å; L139-F154 HydrophobicContact CD1-CD2 4.31Å; L139-F154 HydrophobicContact CD1-CE2 3.84Å; L139-F154 HydrophobicContact CD1-CZ 4.36Å; L139-F154 HydrophobicContact CD2-CE2 4.28Å; L139-F154 HydrophobicContact CD2-CZ 4.32Å; L139-I163 HydrophobicContact CD2-CD1 4.42Å
140	K	90.8	Very high	84.6	Confident	65 Å²	65	53.5 Å²	53.5	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-54.4	-40	175.6	170.7	-171.8	164.6	-154.4	0	112.3	I136 E137	I136-K140 WeakPolarHBondContact O-CB 3.29Å; I136-K140 PolarHBondContact O-N 3.03Å; E137-K140 WeakPolarHBondContact OE1-CD 3.37Å; E137-K140 IonicContact OE1-NZ 2.67Å; E137-K140 PolarHBondContact OE1-NZ 3.1Å; E137-K140 IonicContact OE2-NZ 2.6Å; E137-K140 PolarHBondContact OE2-NZ 3.15Å
141	T	88.3	Confident	84.9	Confident	60 Å²	60	48 Å²	48	37%	0.368	24%	0.241	S	C	.	.	H	α-helix	trans	-68.6	-48.2	175.6	-57.4	0	0	0	0	110.3	E137 S138 L139 L143 R144 T145	E137-T141 WeakPolarHBondContact O-CB 3.33Å; E137-T141 PolarHBondContact O-N 2.91Å; E137-T141 PolarHBondContact O-OG1 3.31Å; S138-T141 PolarHBondContact O-N 3.46Å; L139-T141 PolarHBondContact O-N 2.58Å; T141-L143 PolarHBondContact O-N 2.92Å; T141-R144 PolarHBondContact O-N 2.95Å; T141-T145 HydrophobicContact CG2-CG2 4.31Å; T141-T145 PolarHBondContact O-N 2.85Å; T141-T145 PolarHBondContact O-OG1 3.16Å
142	A	85.4	Confident	85	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-44.3	179.2	0	0	0	0	0	112.7	Y108 S138 L139 R144 T145 Q146 F150	Y108-A142 HydrophobicContact CE2-CB 4.13Å; S138-A142 WeakPolarHBondContact O-CB 3.35Å; S138-A142 PolarHBondContact O-N 3.09Å; L139-A142 PolarHBondContact O-N 3Å; L139-A142 VanDerWaalsContact O-N 3.11Å; A142-R144 PolarHBondContact O-N 3.42Å; A142-R144 VanDerWaalsContact O-N 3.07Å; A142-T145 PolarHBondContact O-N 3.24Å; A142-Q146 HydrophobicContact CB-CG 3.89Å; A142-Q146 VanDerWaalsContact O-CB 3.25Å; A142-Q146 WeakPolarHBondContact O-CB 3.32Å; A142-Q146 WeakPolarHBondContact O-CG 3.26Å; A142-Q146 PolarHBondContact O-N 3.23Å; A142-F150 HydrophobicContact CB-CE1 4Å; A142-F150 HydrophobicContact CB-CE2 4.47Å; A142-F150 HydrophobicContact CB-CZ 3.79Å
143	L	87.1	Confident	85.3	Confident	5 Å²	5	47 Å²	47	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-14.8	174.8	-72.6	170.9	0	0	0	114.2	L139 T141 F150 F154 C186 A189	L139-L143 HydrophobicContact CD1-CD1 3.81Å; L139-L143 HydrophobicContact CD1-CD2 4.38Å; L139-L143 HydrophobicContact CD1-CG 3.78Å; L139-L143 HydrophobicContact CD2-CD1 4.49Å; L139-L143 HydrophobicContact CG-CD1 3.84Å; L139-L143 HydrophobicContact CG-CG 4.27Å; L139-L143 WeakPolarHBondContact O-CB 3.41Å; L139-L143 WeakPolarHBondContact O-CG 3.17Å; L139-L143 PolarHBondContact O-N 2.98Å; T141-L143 PolarHBondContact O-N 2.92Å; L143-F150 HydrophobicContact CD2-CE1 4.1Å; L143-F150 HydrophobicContact CG-CE1 4.5Å; L143-F154 HydrophobicContact CD1-CE1 4.43Å; L143-F154 HydrophobicContact CD2-CB 4.36Å; L143-F154 HydrophobicContact CD2-CD1 3.74Å; L143-F154 HydrophobicContact CD2-CD2 4.42Å; L143-F154 HydrophobicContact CD2-CE1 4.11Å; L143-F154 HydrophobicContact CD2-CG 3.92Å; L143-C186 HydrophobicContact CD1-CB 3.88Å; L143-A189 HydrophobicContact CB-CB 3.96Å
144	R	84.3	Confident	85.5	Confident	153 Å²	153	46 Å²	46	58%	0.577	23%	0.232	S	C	*	.	H	α-helix	trans	-106.5	-27.2	177.3	-170.3	177.6	63.7	146.5	5	113.5	T141 A142 A189	T141-R144 PolarHBondContact O-N 2.95Å; A142-R144 PolarHBondContact O-N 3.42Å; A142-R144 VanDerWaalsContact O-N 3.07Å; R144-A189 HydrophobicContact CB-CB 4.16Å
145	T	81.4	Confident	85.6	Confident	85 Å²	85	41.4 Å²	41.4	52%	0.521	21%	0.213	S	C	.	.	H	α-helix	trans	-122.3	-5.7	-169.9	71.2	0	0	0	0	115.3	T141 A142	T141-T145 HydrophobicContact CG2-CG2 4.31Å; T141-T145 PolarHBondContact O-N 2.85Å; T141-T145 PolarHBondContact O-OG1 3.16Å; A142-T145 PolarHBondContact O-N 3.24Å
146	Q	81.1	Confident	85.6	Confident	49 Å²	49	46.4 Å²	46.4	23%	0.229	24%	0.239	C	C	.	.	S	Bend	trans	-84.8	158.3	170.4	-65.5	-64.8	-12.3	0	0	110.8	A142 F150	A142-Q146 HydrophobicContact CB-CG 3.89Å; A142-Q146 VanDerWaalsContact O-CB 3.25Å; A142-Q146 WeakPolarHBondContact O-CB 3.32Å; A142-Q146 WeakPolarHBondContact O-CG 3.26Å; A142-Q146 PolarHBondContact O-N 3.23Å; Q146-F150 HydrophobicContact CB-CB 3.63Å; Q146-F150 HydrophobicContact CB-CD1 4Å; Q146-F150 HydrophobicContact CB-CD2 4.09Å; Q146-F150 HydrophobicContact CB-CG 3.66Å; Q146-F150 HydrophobicContact CG-CD1 4.41Å; Q146-F150 HydrophobicContact CG-CD2 4.06Å; Q146-F150 HydrophobicContact CG-CE2 4.38Å; Q146-F150 HydrophobicContact CG-CG 4.1Å
147	P	75.8	Confident	85.6	Confident	35 Å²	35	49.7 Å²	49.7	23%	0.227	26%	0.256	C	S	.	.			trans	-57.5	158	177.5	-24.5	34.8	0	0	0	113.4	S149 F150	P147-S149 PolarHBondContact O-N 3.2Å; P147-F150 VanDerWaalsContact O-CB 3.31Å; P147-F150 WeakPolarHBondContact O-CB 3.43Å; P147-F150 PolarHBondContact O-N 2.9Å
148	M	77.1	Confident	85.6	Confident	27 Å²	27	51.3 Å²	51.3	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-53	-28.8	177.8	177.2	51.8	144.9	0	0	113.9	E65 F150 V151 T152 N193 Q195	E65-M148 VanDerWaalsContact O-CB 3.24Å; E65-M148 WeakPolarHBondContact O-CB 3.39Å; E65-M148 PolarHBondContact O-N 2.95Å; M148-F150 VanDerWaalsContact C-N 3.32Å; M148-F150 PolarHBondContact O-N 3.45Å; M148-V151 PolarHBondContact O-N 3.36Å; M148-V151 HydrophobicContact SD-CB 4.41Å; M148-T152 WeakPolarHBondContact O-CB 3.49Å; M148-T152 PolarHBondContact O-N 3.14Å; M148-T152 PolarHBondContact O-OG1 2.79Å; M148-N193 VanDerWaalsContact CE-ND2 3.25Å; M148-N193 WeakPolarHBondContact CE-ND2 3.25Å; M148-N193 PolarHBondContact SD-ND2 2.88Å; M148-Q195 HydrophobicContact CE-CB 3.86Å; M148-Q195 HydrophobicContact CE-CG 3.39Å
149	S	78.9	Confident	85.7	Confident	62 Å²	62	49.2 Å²	49.2	43%	0.434	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-30.5	174.1	49.6	0	0	0	0	113.6	E65 P147 R153	E65-S149 WeakPolarHBondContact OE1-CB 3.47Å; E65-S149 PolarHBondContact OE1-OG 2.88Å; P147-S149 PolarHBondContact O-N 3.2Å; S149-R153 VanDerWaalsContact O-CB 3.25Å; S149-R153 WeakPolarHBondContact O-CB 3.35Å; S149-R153 PolarHBondContact O-N 2.92Å
150	F	86.5	Confident	85.8	Confident	10 Å²	10	49.1 Å²	49.1	4%	0.044	25%	0.252	C	S	.	.	H	α-helix	trans	-68.9	-45.9	170.5	179.9	-82.5	0	0	0	111.4	S103 P105 Y108 A142 L143 Q146 P147 M148 R153 F154	S103-F150 WeakPolarHBondContact O-CD2 3.32Å; P105-F150 HydrophobicContact CB-CE2 4.49Å; P105-F150 HydrophobicContact CG-CD1 4.34Å; P105-F150 HydrophobicContact CG-CD2 3.69Å; P105-F150 HydrophobicContact CG-CE1 4.39Å; P105-F150 HydrophobicContact CG-CE2 3.76Å; P105-F150 HydrophobicContact CG-CG 3.99Å; P105-F150 HydrophobicContact CG-CZ 4.11Å; P105-F150 WeakPolarHBondContact CG-O 3.41Å; Y108-F150 HydrophobicContact CD2-CE2 4.49Å; Y108-F150 AromaticContact CD2-CZ 3.94Å; Y108-F150 HydrophobicContact CD2-CZ 3.94Å; Y108-F150 HydrophobicContact CE2-CE2 4.26Å; Y108-F150 AromaticContact CE2-CZ 3.87Å; Y108-F150 HydrophobicContact CE2-CZ 3.87Å; A142-F150 HydrophobicContact CB-CE1 4Å; A142-F150 HydrophobicContact CB-CE2 4.47Å; A142-F150 HydrophobicContact CB-CZ 3.79Å; L143-F150 HydrophobicContact CD2-CE1 4.1Å; L143-F150 HydrophobicContact CG-CE1 4.5Å; Q146-F150 HydrophobicContact CB-CB 3.63Å; Q146-F150 HydrophobicContact CB-CD1 4Å; Q146-F150 HydrophobicContact CB-CD2 4.09Å; Q146-F150 HydrophobicContact CB-CG 3.66Å; Q146-F150 HydrophobicContact CG-CD1 4.41Å; Q146-F150 HydrophobicContact CG-CD2 4.06Å; Q146-F150 HydrophobicContact CG-CE2 4.38Å; Q146-F150 HydrophobicContact CG-CG 4.1Å; P147-F150 VanDerWaalsContact O-CB 3.31Å; P147-F150 WeakPolarHBondContact O-CB 3.43Å; P147-F150 PolarHBondContact O-N 2.9Å; M148-F150 VanDerWaalsContact C-N 3.32Å; M148-F150 PolarHBondContact O-N 3.45Å; F150-R153 PolarHBondContact O-N 3.13Å; F150-F154 WeakPolarHBondContact O-CB 3.39Å; F150-F154 PolarHBondContact O-N 3.23Å
151	V	85.1	Confident	85.9	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.024	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-45.4	-176.7	-178.6	0	0	0	0	110.9	M148 F154 I155 L190 N193	M148-V151 PolarHBondContact O-N 3.36Å; M148-V151 HydrophobicContact SD-CB 4.41Å; V151-F154 PolarHBondContact O-N 2.98Å; V151-I155 HydrophobicContact CG1-CD1 4.19Å; V151-I155 WeakPolarHBondContact O-CG1 3.33Å; V151-I155 PolarHBondContact O-N 3.12Å; V151-L190 HydrophobicContact CG1-CD1 3.67Å; V151-N193 HydrophobicContact CG1-CB 4.31Å
152	T	83.1	Confident	86	Confident	52 Å²	52	45.3 Å²	45.3	32%	0.319	23%	0.234	S	C	.	.	H	α-helix	trans	-58.3	-49.8	174.6	-53.3	0	0	0	0	110.9	M148 F154 I155 D156	M148-T152 WeakPolarHBondContact O-CB 3.49Å; M148-T152 PolarHBondContact O-N 3.14Å; M148-T152 PolarHBondContact O-OG1 2.79Å; T152-F154 VanDerWaalsContact C-N 3.32Å; T152-F154 PolarHBondContact O-N 2.9Å; T152-I155 WeakPolarHBondContact O-CA 3.32Å; T152-I155 WeakPolarHBondContact O-CB 3.27Å; T152-I155 PolarHBondContact O-N 3.33Å; T152-D156 PolarHBondContact O-N 3.2Å
153	R	86.6	Confident	86.4	Confident	108 Å²	108	45.1 Å²	45.1	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-63.2	-33.4	178	-175.4	-177.8	-172.5	113.4	0.1	113.2	P105 E106 S149 F150 I155 L157	P105-R153 HydrophobicContact CG-CB 4.1Å; P105-R153 HydrophobicContact CG-CG 4.06Å; E106-R153 IonicContact OE1-CZ 2.63Å; E106-R153 IonicContact OE1-NE 2.65Å; E106-R153 PolarHBondContact OE1-NE 3.27Å; E106-R153 IonicContact OE1-NH2 2.65Å; E106-R153 PolarHBondContact OE1-NH2 2.89Å; E106-R153 IonicContact OE2-NE 2.73Å; E106-R153 PolarHBondContact OE2-NE 3.37Å; S149-R153 VanDerWaalsContact O-CB 3.25Å; S149-R153 WeakPolarHBondContact O-CB 3.35Å; S149-R153 PolarHBondContact O-N 2.92Å; F150-R153 PolarHBondContact O-N 3.13Å; R153-I155 VanDerWaalsContact C-N 3.33Å; R153-L157 HydrophobicContact CG-CD1 4Å; R153-L157 WeakPolarHBondContact O-CB 3.32Å; R153-L157 WeakPolarHBondContact O-CD1 3.34Å; R153-L157 VanDerWaalsContact O-CG 3.23Å; R153-L157 WeakPolarHBondContact O-CG 3.43Å; R153-L157 PolarHBondContact O-N 3.01Å
154	F	90.9	Very high	86.7	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-33.7	173	-178	-93.1	0	0	0	112.4	P105 I109 L139 L143 F150 V151 T152 G159 I163	P105-F154 HydrophobicContact CB-CB 3.96Å; P105-F154 HydrophobicContact CB-CD2 4.12Å; P105-F154 HydrophobicContact CG-CB 4.26Å; I109-F154 HydrophobicContact CD1-CD2 3.89Å; I109-F154 HydrophobicContact CD1-CE2 4.12Å; I109-F154 HydrophobicContact CG1-CD2 3.91Å; I109-F154 HydrophobicContact CG1-CE2 3.67Å; L139-F154 HydrophobicContact CD1-CD2 4.31Å; L139-F154 HydrophobicContact CD1-CE2 3.84Å; L139-F154 HydrophobicContact CD1-CZ 4.36Å; L139-F154 HydrophobicContact CD2-CE2 4.28Å; L139-F154 HydrophobicContact CD2-CZ 4.32Å; L143-F154 HydrophobicContact CD1-CE1 4.43Å; L143-F154 HydrophobicContact CD2-CB 4.36Å; L143-F154 HydrophobicContact CD2-CD1 3.74Å; L143-F154 HydrophobicContact CD2-CD2 4.42Å; L143-F154 HydrophobicContact CD2-CE1 4.11Å; L143-F154 HydrophobicContact CD2-CG 3.92Å; F150-F154 WeakPolarHBondContact O-CB 3.39Å; F150-F154 PolarHBondContact O-N 3.23Å; V151-F154 PolarHBondContact O-N 2.98Å; T152-F154 VanDerWaalsContact C-N 3.32Å; T152-F154 PolarHBondContact O-N 2.9Å; F154-G159 WeakPolarHBondContact CZ-O 3.46Å; F154-G159 WeakPolarHBondContact O-CA 3.44Å; F154-G159 PolarHBondContact O-N 2.88Å; F154-I163 HydrophobicContact CE1-CD1 4Å; F154-I163 HydrophobicContact CZ-CD1 3.7Å; F154-I163 HydrophobicContact CZ-CG1 4.31Å
155	I	89.3	Confident	87	Confident	22 Å²	22	41.7 Å²	41.7	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-70.6	-49.1	174.2	-68.1	162.7	0	0	0	110.6	V151 T152 R153 L157 D158 L190 Q195 H199	V151-I155 HydrophobicContact CG1-CD1 4.19Å; V151-I155 WeakPolarHBondContact O-CG1 3.33Å; V151-I155 PolarHBondContact O-N 3.12Å; T152-I155 WeakPolarHBondContact O-CA 3.32Å; T152-I155 WeakPolarHBondContact O-CB 3.27Å; T152-I155 PolarHBondContact O-N 3.33Å; R153-I155 VanDerWaalsContact C-N 3.33Å; I155-L157 PolarHBondContact O-N 2.58Å; I155-L157 VanDerWaalsContact O-N 3.16Å; I155-D158 PolarHBondContact O-N 3.02Å; I155-L190 HydrophobicContact CD1-CD1 4.12Å; I155-L190 HydrophobicContact CG1-CD1 4.12Å; I155-Q195 HydrophobicContact CD1-CB 4.33Å; I155-H199 HydrophobicContact CD1-CB 4.39Å; I155-H199 HydrophobicContact CG2-CB 4.14Å
156	D	89.1	Confident	87.4	Confident	125 Å²	125	38 Å²	38	67%	0.668	20%	0.202	S	C	*	.	H	α-helix	trans	-60.4	-24.8	-179.4	-66.7	-29.7	0	0	0	113.4	T152	T152-D156 PolarHBondContact O-N 3.2Å
157	L	89	Confident	88	Confident	72 Å²	72	36.4 Å²	36.4	38%	0.377	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	21.1	177.5	-65.9	173.2	0	0	0	113.5	P105 E106 I109 R153 I155 G159	P105-L157 HydrophobicContact CB-CD1 4.43Å; E106-L157 HydrophobicContact CG-CD1 3.8Å; I109-L157 HydrophobicContact CD1-CB 3.55Å; I109-L157 HydrophobicContact CD1-CD1 4.28Å; R153-L157 HydrophobicContact CG-CD1 4Å; R153-L157 WeakPolarHBondContact O-CB 3.32Å; R153-L157 WeakPolarHBondContact O-CD1 3.34Å; R153-L157 VanDerWaalsContact O-CG 3.23Å; R153-L157 WeakPolarHBondContact O-CG 3.43Å; R153-L157 PolarHBondContact O-N 3.01Å; I155-L157 PolarHBondContact O-N 2.58Å; I155-L157 VanDerWaalsContact O-N 3.16Å; L157-G159 PolarHBondContact O-N 3.01Å; L157-G159 VanDerWaalsContact O-N 3.13Å
158	D	89.6	Confident	88.7	Confident	94 Å²	94	39 Å²	39	50%	0.503	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	21.6	178.8	-103	-54.1	0	0	0	114.2	I155 L160 T161 C162	I155-D158 PolarHBondContact O-N 3.02Å; D158-L160 VanDerWaalsContact C-N 3.28Å; D158-L160 PolarHBondContact O-N 3.35Å; D158-T161 CarbonylContact O-C 3.6Å; D158-T161 WeakPolarHBondContact O-CA 3.25Å; D158-T161 WeakPolarHBondContact O-CB 3.14Å; D158-T161 PolarHBondContact O-N 2.82Å; D158-T161 VanDerWaalsContact OD1-CB 3.29Å; D158-T161 WeakPolarHBondContact OD1-CB 3.44Å; D158-T161 PolarHBondContact OD1-OG1 2.86Å; D158-C162 PolarHBondContact O-N 3.42Å
159	G	90.8	Very high	89.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-31.5	-173.4	0	0	0	0	0	114.4	F154 L157 C162 I163	F154-G159 WeakPolarHBondContact CZ-O 3.46Å; F154-G159 WeakPolarHBondContact O-CA 3.44Å; F154-G159 PolarHBondContact O-N 2.88Å; L157-G159 PolarHBondContact O-N 3.01Å; L157-G159 VanDerWaalsContact O-N 3.13Å; G159-C162 PolarHBondContact O-N 3.15Å; G159-I163 WeakPolarHBondContact O-CG1 3.41Å; G159-I163 PolarHBondContact O-N 3.11Å; G159-I163 VanDerWaalsContact O-N 3.13Å
160	L	92.1	Very high	89.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.2	-45.8	169.1	173.6	61.8	0	0	0	111.1	D158 C162 I163 L164 L190 H199 V200 H203	D158-L160 VanDerWaalsContact C-N 3.28Å; D158-L160 PolarHBondContact O-N 3.35Å; L160-C162 VanDerWaalsContact C-N 3.27Å; L160-C162 PolarHBondContact O-N 3.28Å; L160-I163 PolarHBondContact O-N 3.25Å; L160-I163 VanDerWaalsContact O-N 3.16Å; L160-L164 HydrophobicContact CD1-CD1 3.99Å; L160-L164 HydrophobicContact CD1-CG 3.97Å; L160-L164 HydrophobicContact CD2-CD1 4.42Å; L160-L164 HydrophobicContact CG-CD1 3.86Å; L160-L164 HydrophobicContact CG-CG 4.26Å; L160-L164 WeakPolarHBondContact O-CB 3.39Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.28Å; L160-L164 PolarHBondContact O-N 3.05Å; L160-L190 HydrophobicContact CB-CD2 4.22Å; L160-L190 HydrophobicContact CD1-CD2 4.08Å; L160-H199 WeakPolarHBondContact CD2-ND1 3.45Å; L160-V200 HydrophobicContact CD1-CG2 3.94Å; L160-V200 HydrophobicContact CD2-CB 4.36Å; L160-V200 HydrophobicContact CD2-CG2 3.76Å; L160-V200 HydrophobicContact CG-CG2 4.5Å; L160-H203 HydrophobicContact CD2-CB 4.22Å
161	T	91.8	Very high	89.4	Confident	30 Å²	30	41.5 Å²	41.5	18%	0.184	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-37.1	179.3	-47.2	0	0	0	0	110.6	D158 L164 N165	D158-T161 CarbonylContact O-C 3.6Å; D158-T161 WeakPolarHBondContact O-CA 3.25Å; D158-T161 WeakPolarHBondContact O-CB 3.14Å; D158-T161 PolarHBondContact O-N 2.82Å; D158-T161 VanDerWaalsContact OD1-CB 3.29Å; D158-T161 WeakPolarHBondContact OD1-CB 3.44Å; D158-T161 PolarHBondContact OD1-OG1 2.86Å; T161-L164 PolarHBondContact O-N 3Å; T161-N165 VanDerWaalsContact O-CB 3.27Å; T161-N165 WeakPolarHBondContact O-CB 3.29Å; T161-N165 PolarHBondContact O-N 3.1Å; T161-N165 PolarHBondContact O-ND2 3.47Å
162	C	91.3	Very high	89.4	Confident	14 Å²	14	49.2 Å²	49.2	10%	0.095	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-46.6	170.9	-70.2	0	0	0	0	113.3	L112 N113 D158 G159 L160 L164 N165 F166	L112-C162 HydrophobicContact CD1-CB 4.47Å; N113-C162 PolarHBondContact ND2-SG 2.96Å; N113-C162 PolarHBondContact OD1-SG 3.48Å; D158-C162 PolarHBondContact O-N 3.42Å; G159-C162 PolarHBondContact O-N 3.15Å; L160-C162 VanDerWaalsContact C-N 3.27Å; L160-C162 PolarHBondContact O-N 3.28Å; C162-L164 PolarHBondContact O-N 2.95Å; C162-N165 PolarHBondContact O-N 2.6Å; C162-F166 PolarHBondContact O-N 3.25Å
163	I	93.8	Very high	89.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-46.6	174.9	-66.3	167	0	0	0	110.7	L112 L139 F154 G159 L160 N165 F166 L167 L183 C186 I187	L112-I163 HydrophobicContact CD1-CG1 3.68Å; L139-I163 HydrophobicContact CD2-CD1 4.42Å; F154-I163 HydrophobicContact CE1-CD1 4Å; F154-I163 HydrophobicContact CZ-CD1 3.7Å; F154-I163 HydrophobicContact CZ-CG1 4.31Å; G159-I163 WeakPolarHBondContact O-CG1 3.41Å; G159-I163 PolarHBondContact O-N 3.11Å; G159-I163 VanDerWaalsContact O-N 3.13Å; L160-I163 PolarHBondContact O-N 3.25Å; L160-I163 VanDerWaalsContact O-N 3.16Å; I163-N165 PolarHBondContact O-N 3.08Å; I163-F166 PolarHBondContact O-N 3.41Å; I163-L167 HydrophobicContact CG2-CD1 4.08Å; I163-L167 WeakPolarHBondContact O-CG 3.46Å; I163-L167 PolarHBondContact O-N 2.95Å; I163-L183 HydrophobicContact CG2-CB 4.48Å; I163-L183 HydrophobicContact CG2-CD2 4.23Å; I163-C186 HydrophobicContact CD1-CB 3.77Å; I163-I187 HydrophobicContact CG2-CD1 4Å; I163-I187 HydrophobicContact CG2-CG1 3.87Å
164	L	93.6	Very high	89.4	Confident	2 Å²	2	48 Å²	48	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-37.4	-179.3	-70.3	178.8	0	0	0	112.5	L160 T161 C162 K168 I187 H203 I209	L160-L164 HydrophobicContact CD1-CD1 3.99Å; L160-L164 HydrophobicContact CD1-CG 3.97Å; L160-L164 HydrophobicContact CD2-CD1 4.42Å; L160-L164 HydrophobicContact CG-CD1 3.86Å; L160-L164 HydrophobicContact CG-CG 4.26Å; L160-L164 WeakPolarHBondContact O-CB 3.39Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.28Å; L160-L164 PolarHBondContact O-N 3.05Å; T161-L164 PolarHBondContact O-N 3Å; C162-L164 PolarHBondContact O-N 2.95Å; L164-K168 WeakPolarHBondContact O-CB 3.29Å; L164-K168 WeakPolarHBondContact O-CG 3.31Å; L164-K168 PolarHBondContact O-N 3.02Å; L164-I187 HydrophobicContact CD2-CD1 3.99Å; L164-H203 VanDerWaalsContact CD1-CE1 3.49Å; L164-H203 WeakPolarHBondContact CD1-CE1 3.24Å; L164-H203 WeakPolarHBondContact CD1-ND1 3.39Å; L164-I209 HydrophobicContact CB-CD1 3.86Å; L164-I209 HydrophobicContact CD1-CD1 4.39Å; L164-I209 HydrophobicContact CD2-CB 4.06Å; L164-I209 HydrophobicContact CD2-CD1 3.99Å; L164-I209 HydrophobicContact CD2-CG2 3.98Å; L164-I209 HydrophobicContact CG-CD1 4.3Å
165	N	90.2	Very high	89.3	Confident	84 Å²	84	49.6 Å²	49.6	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-68	-40.7	174.5	-78.4	-28.5	0	0	0	112.1	T161 C162 I163 K168 S169	T161-N165 VanDerWaalsContact O-CB 3.27Å; T161-N165 WeakPolarHBondContact O-CB 3.29Å; T161-N165 PolarHBondContact O-N 3.1Å; T161-N165 PolarHBondContact O-ND2 3.47Å; C162-N165 PolarHBondContact O-N 2.6Å; I163-N165 PolarHBondContact O-N 3.08Å; N165-K168 WeakPolarHBondContact O-CB 3.43Å; N165-K168 PolarHBondContact O-N 2.86Å; N165-S169 VanDerWaalsContact O-CB 3.31Å; N165-S169 WeakPolarHBondContact O-CB 3.37Å; N165-S169 PolarHBondContact O-N 3.43Å; N165-S169 PolarHBondContact O-OG 3.43Å
166	F	90.6	Very high	89.2	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-47.3	174.8	-168.2	-178.9	0	0	0	110.6	L112 M115 A116 I136 C162 I163 K168 S169 M170 T174 I179 L183	L112-F166 HydrophobicContact CD2-CD1 3.86Å; L112-F166 HydrophobicContact CD2-CE1 4.34Å; M115-F166 HydrophobicContact CB-CD1 4.47Å; M115-F166 HydrophobicContact CB-CE1 3.64Å; M115-F166 HydrophobicContact CB-CZ 3.68Å; M115-F166 HydrophobicContact SD-CE1 4.2Å; A116-F166 HydrophobicContact CB-CB 4.02Å; A116-F166 HydrophobicContact CB-CD2 4.04Å; A116-F166 HydrophobicContact CB-CG 4.01Å; I136-F166 HydrophobicContact CD1-CE1 4Å; C162-F166 PolarHBondContact O-N 3.25Å; I163-F166 PolarHBondContact O-N 3.41Å; F166-K168 VanDerWaalsContact C-N 3.26Å; F166-K168 PolarHBondContact O-N 2.81Å; F166-S169 PolarHBondContact O-N 2.98Å; F166-S169 PolarHBondContact O-OG 2.91Å; F166-M170 HydrophobicContact CD2-CG 4.16Å; F166-M170 HydrophobicContact CE2-CG 4.3Å; F166-M170 WeakPolarHBondContact O-CG 3.13Å; F166-M170 PolarHBondContact O-N 3.27Å; F166-M170 VanDerWaalsContact O-N 3.12Å; F166-T174 HydrophobicContact CE2-CG2 4.44Å; F166-I179 HydrophobicContact CE1-CG2 4.41Å; F166-I179 HydrophobicContact CZ-CG2 4.19Å; F166-L183 HydrophobicContact CD1-CD1 3.86Å; F166-L183 HydrophobicContact CD1-CD2 4Å; F166-L183 HydrophobicContact CE1-CD1 4.12Å; F166-L183 HydrophobicContact CE1-CD2 4.46Å; F166-L183 HydrophobicContact CG-CD1 4.1Å
167	L	92.6	Very high	89.3	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-38.5	174.6	-73.7	171.2	0	0	0	112.7	I163 S169 M170 L183 I184 I187 I209	I163-L167 HydrophobicContact CG2-CD1 4.08Å; I163-L167 WeakPolarHBondContact O-CG 3.46Å; I163-L167 PolarHBondContact O-N 2.95Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-M170 HydrophobicContact CD2-CE 4.02Å; L167-M170 HydrophobicContact CD2-SD 4.35Å; L167-L183 HydrophobicContact CD2-CB 3.82Å; L167-L183 HydrophobicContact CD2-CD1 3.96Å; L167-L183 HydrophobicContact CG-CB 4.26Å; L167-L183 HydrophobicContact CG-CD1 4.33Å; L167-I184 HydrophobicContact CD1-CD1 3.92Å; L167-I184 HydrophobicContact CD2-CD1 4.27Å; L167-I187 HydrophobicContact CD1-CD1 3.75Å; L167-I209 HydrophobicContact CB-CG2 3.83Å; L167-I209 HydrophobicContact CD1-CG2 4.22Å
168	K	89.9	Confident	89.2	Confident	90 Å²	90	47.8 Å²	47.8	39%	0.391	24%	0.241	S	C	.	.	H	α-helix	trans	-69.9	-23.7	173	-83.3	175.9	152.6	-176.8	0	114.4	L164 N165 F166 E205 I209	L164-K168 WeakPolarHBondContact O-CB 3.29Å; L164-K168 WeakPolarHBondContact O-CG 3.31Å; L164-K168 PolarHBondContact O-N 3.02Å; N165-K168 WeakPolarHBondContact O-CB 3.43Å; N165-K168 PolarHBondContact O-N 2.86Å; F166-K168 VanDerWaalsContact C-N 3.26Å; F166-K168 PolarHBondContact O-N 2.81Å; K168-E205 IonicContact NZ-OE1 3.4Å; K168-E205 PolarHBondContact NZ-OE1 3.4Å; K168-E205 IonicContact NZ-OE2 2.66Å; K168-E205 PolarHBondContact NZ-OE2 2.87Å; K168-I209 HydrophobicContact CD-CD1 3.78Å; K168-I209 HydrophobicContact CD-CG1 4.23Å; K168-I209 HydrophobicContact CG-CD1 4.02Å; K168-I209 HydrophobicContact CG-CG1 4.05Å; K168-I209 HydrophobicContact CG-CG2 4.48Å
169	S	87	Confident	89.3	Confident	29 Å²	29	43.4 Å²	43.4	20%	0.203	22%	0.217	C	C	.	.	H	α-helix	trans	-107.4	-4.9	-168.5	78.4	0	0	0	0	115.3	K119 N165 F166 L167	K119-S169 PolarHBondContact NZ-O 3.45Å; N165-S169 VanDerWaalsContact O-CB 3.31Å; N165-S169 WeakPolarHBondContact O-CB 3.37Å; N165-S169 PolarHBondContact O-N 3.43Å; N165-S169 PolarHBondContact O-OG 3.43Å; F166-S169 PolarHBondContact O-N 2.98Å; F166-S169 PolarHBondContact O-OG 2.91Å; L167-S169 VanDerWaalsContact C-N 3.34Å
170	M	87.4	Confident	89.4	Confident	30 Å²	30	43.5 Å²	43.5	15%	0.148	22%	0.217	C	C	.	.			trans	-54.2	154.8	-179.5	-58.8	-169.4	-65.9	0	0	113.4	F166 L167 T174 T175 H180 L183	F166-M170 HydrophobicContact CD2-CG 4.16Å; F166-M170 HydrophobicContact CE2-CG 4.3Å; F166-M170 WeakPolarHBondContact O-CG 3.13Å; F166-M170 PolarHBondContact O-N 3.27Å; F166-M170 VanDerWaalsContact O-N 3.12Å; L167-M170 HydrophobicContact CD2-CE 4.02Å; L167-M170 HydrophobicContact CD2-SD 4.35Å; M170-T174 HydrophobicContact CB-CG2 4.48Å; M170-T174 HydrophobicContact CG-CG2 4.21Å; M170-T174 HydrophobicContact SD-CG2 4.01Å; M170-T175 HydrophobicContact CE-CG2 4.34Å; M170-H180 HydrophobicContact CE-CB 4.27Å; M170-H180 HydrophobicContact SD-CB 4.13Å; M170-L183 HydrophobicContact SD-CD1 4.33Å
171	D	84.8	Confident	89.5	Confident	92 Å²	92	44.9 Å²	44.9	49%	0.492	23%	0.226	S	C	.	.			trans	-90.1	176.7	162.7	59.6	13	0	0	0	111.2	T174 T175	D171-T174 WeakPolarHBondContact OD1-CB 3.5Å; D171-T174 PolarHBondContact OD1-N 2.93Å; D171-T174 PolarHBondContact OD1-OG1 3.46Å; D171-T175 VanDerWaalsContact O-CB 3.32Å; D171-T175 WeakPolarHBondContact O-CB 3.34Å; D171-T175 PolarHBondContact O-N 2.86Å; D171-T175 PolarHBondContact O-OG1 3.46Å
172	Y	84.6	Confident	89.6	Confident	166 Å²	166	43.6 Å²	43.6	65%	0.651	22%	0.218	S	C	*	.	H	α-helix	trans	-61.5	-44.8	-177.7	-179.5	-92.2	0	0	0	112.2	T175 E176	Y172-T175 WeakPolarHBondContact O-CB 3.22Å; Y172-T175 PolarHBondContact O-N 3.5Å; Y172-E176 HydrophobicContact CE1-CG 4.11Å; Y172-E176 PolarHBondContact O-N 2.67Å
173	D	83	Confident	89.7	Confident	120 Å²	120	42.9 Å²	42.9	64%	0.642	21%	0.214	S	C	*	.	H	α-helix	trans	-67.9	-41.9	-177.1	-63.4	-42.7	0	0	0	111.5	T175 E176 S177	D173-T175 VanDerWaalsContact C-N 3.31Å; D173-T175 PolarHBondContact O-N 3.39Å; D173-E176 PolarHBondContact O-N 3.31Å; D173-S177 WeakPolarHBondContact O-CB 3.2Å; D173-S177 PolarHBondContact O-N 3.17Å
174	T	86.6	Confident	89.8	Confident	15 Å²	15	42.9 Å²	42.9	9%	0.092	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-35.8	172.6	-51.9	0	0	0	0	111.5	F166 M170 D171 E176 S177 I179	F166-T174 HydrophobicContact CE2-CG2 4.44Å; M170-T174 HydrophobicContact CB-CG2 4.48Å; M170-T174 HydrophobicContact CG-CG2 4.21Å; M170-T174 HydrophobicContact SD-CG2 4.01Å; D171-T174 WeakPolarHBondContact OD1-CB 3.5Å; D171-T174 PolarHBondContact OD1-N 2.93Å; D171-T174 PolarHBondContact OD1-OG1 3.46Å; T174-E176 VanDerWaalsContact C-N 3.31Å; T174-E176 PolarHBondContact O-N 2.81Å; T174-S177 WeakPolarHBondContact O-CB 3.47Å; T174-S177 PolarHBondContact O-N 2.92Å; T174-S177 PolarHBondContact O-OG 3.17Å; T174-I179 HydrophobicContact CG2-CB 4.14Å; T174-I179 HydrophobicContact CG2-CD1 4.48Å; T174-I179 HydrophobicContact CG2-CG2 3.85Å
175	T	88.3	Confident	89.8	Confident	34 Å²	34	43.3 Å²	43.3	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-35.5	176.9	-59.6	0	0	0	0	112.3	M170 D171 Y172 D173 H180 T216	M170-T175 HydrophobicContact CE-CG2 4.34Å; D171-T175 VanDerWaalsContact O-CB 3.32Å; D171-T175 WeakPolarHBondContact O-CB 3.34Å; D171-T175 PolarHBondContact O-N 2.86Å; D171-T175 PolarHBondContact O-OG1 3.46Å; Y172-T175 WeakPolarHBondContact O-CB 3.22Å; Y172-T175 PolarHBondContact O-N 3.5Å; D173-T175 VanDerWaalsContact C-N 3.31Å; D173-T175 PolarHBondContact O-N 3.39Å; T175-H180 WeakPolarHBondContact O-CB 3.43Å; T175-H180 PolarHBondContact O-ND1 3.09Å; T175-T216 PolarHBondContact O-OG1 3.11Å
176	E	88.1	Confident	90	Very high	43 Å²	43	39.3 Å²	39.3	20%	0.201	20%	0.197	C	C	.	.	H	α-helix	trans	-85	-20.4	176.4	-68.7	-54.4	116.7	0	0	113.9	Y172 D173 T174 T216 E217 N218	Y172-E176 HydrophobicContact CE1-CG 4.11Å; Y172-E176 PolarHBondContact O-N 2.67Å; D173-E176 PolarHBondContact O-N 3.31Å; T174-E176 VanDerWaalsContact C-N 3.31Å; T174-E176 PolarHBondContact O-N 2.81Å; E176-T216 VanDerWaalsContact CD-OG1 3.31Å; E176-T216 VanDerWaalsContact OE1-CA 3.23Å; E176-T216 WeakPolarHBondContact OE1-CA 3.42Å; E176-T216 WeakPolarHBondContact OE1-CB 3.21Å; E176-T216 PolarHBondContact OE1-OG1 3.31Å; E176-E217 VanDerWaalsContact CD-N 3.32Å; E176-E217 PolarHBondContact OE1-N 2.9Å; E176-E217 VanDerWaalsContact OE2-C 3.22Å; E176-E217 VanDerWaalsContact OE2-CA 3.3Å; E176-E217 WeakPolarHBondContact OE2-CA 3.38Å; E176-E217 VanDerWaalsContact OE2-CB 3.25Å; E176-E217 WeakPolarHBondContact OE2-CB 3.38Å; E176-E217 PolarHBondContact OE2-N 3.3Å; E176-E217 VanDerWaalsContact OE2-N 3.13Å; E176-N218 PolarHBondContact O-ND2 3.28Å; E176-N218 VanDerWaalsContact O-ND2 3.13Å; E176-N218 PolarHBondContact OE2-N 2.62Å
177	S	89.4	Confident	90.2	Very high	12 Å²	12	39 Å²	39	8%	0.084	20%	0.196	C	C	.	.	S	Bend	trans	-65.1	177.3	-178.8	80	0	0	0	0	114.5	E129 D173 T174 I179 N218	E129-S177 WeakPolarHBondContact OE1-CB 3.31Å; D173-S177 WeakPolarHBondContact O-CB 3.2Å; D173-S177 PolarHBondContact O-N 3.17Å; T174-S177 WeakPolarHBondContact O-CB 3.47Å; T174-S177 PolarHBondContact O-N 2.92Å; T174-S177 PolarHBondContact O-OG 3.17Å; S177-I179 VanDerWaalsContact C-N 3.3Å; S177-I179 WeakPolarHBondContact OG-CB 3.39Å; S177-I179 PolarHBondContact OG-N 3.06Å; S177-I179 VanDerWaalsContact OG-N 3.09Å; S177-N218 PolarHBondContact O-ND2 2.88Å
178	Q	88.6	Confident	90.2	Very high	126 Å²	126	40 Å²	40	59%	0.589	20%	0.2	S	C	*	.	H	α-helix	trans	-70.1	-25.9	170.7	-61.9	-173.2	26.7	0	0	112.9	N133 H180 T181 S182	N133-Q178 PolarHBondContact ND2-OE1 3.39Å; Q178-H180 PolarHBondContact O-N 3.36Å; Q178-T181 WeakPolarHBondContact O-CA 3.3Å; Q178-T181 WeakPolarHBondContact O-CB 3.41Å; Q178-T181 PolarHBondContact O-N 3.43Å; Q178-S182 PolarHBondContact O-N 2.75Å; Q178-S182 PolarHBondContact O-OG 3.42Å
179	I	90.1	Very high	90.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-56.2	-41.5	-178.5	-71.1	165.4	0	0	0	110.8	E129 R132 N133 I136 F166 T174 S177 S182 L183	E129-I179 HydrophobicContact CG-CD1 4.09Å; R132-I179 HydrophobicContact CB-CD1 3.96Å; N133-I179 HydrophobicContact CB-CG1 3.92Å; I136-I179 HydrophobicContact CD1-CG1 4.45Å; I136-I179 HydrophobicContact CD1-CG2 3.6Å; F166-I179 HydrophobicContact CE1-CG2 4.41Å; F166-I179 HydrophobicContact CZ-CG2 4.19Å; T174-I179 HydrophobicContact CG2-CB 4.14Å; T174-I179 HydrophobicContact CG2-CD1 4.48Å; T174-I179 HydrophobicContact CG2-CG2 3.85Å; S177-I179 VanDerWaalsContact C-N 3.3Å; S177-I179 WeakPolarHBondContact OG-CB 3.39Å; S177-I179 PolarHBondContact OG-N 3.06Å; S177-I179 VanDerWaalsContact OG-N 3.09Å; I179-S182 PolarHBondContact O-N 2.92Å; I179-L183 HydrophobicContact CG2-CD1 3.93Å; I179-L183 HydrophobicContact CG2-CG 4.32Å; I179-L183 WeakPolarHBondContact O-CG 3.48Å; I179-L183 PolarHBondContact O-N 2.88Å
180	H	93.2	Very high	90.4	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-43.5	175.4	-173.1	-173.9	0	0	0	112.3	M170 T175 Q178 S182 L183 I184 S213	M170-H180 HydrophobicContact CE-CB 4.27Å; M170-H180 HydrophobicContact SD-CB 4.13Å; T175-H180 WeakPolarHBondContact O-CB 3.43Å; T175-H180 PolarHBondContact O-ND1 3.09Å; Q178-H180 PolarHBondContact O-N 3.36Å; H180-S182 VanDerWaalsContact C-N 3.33Å; H180-S182 PolarHBondContact O-N 2.93Å; H180-L183 PolarHBondContact O-N 3.32Å; H180-I184 WeakPolarHBondContact O-CG1 3.47Å; H180-I184 PolarHBondContact O-N 2.67Å; H180-I184 VanDerWaalsContact O-N 3.16Å; H180-S213 WeakPolarHBondContact NE2-CB 3.26Å; H180-S213 PolarHBondContact NE2-OG 3.49Å
181	T	94.1	Very high	90.5	Very high	29 Å²	29	33.2 Å²	33.2	18%	0.178	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-41	174.2	-45.2	0	0	0	0	111.4	Q178 I184 G185 N218 K220 T221	Q178-T181 WeakPolarHBondContact O-CA 3.3Å; Q178-T181 WeakPolarHBondContact O-CB 3.41Å; Q178-T181 PolarHBondContact O-N 3.43Å; T181-I184 PolarHBondContact O-N 2.66Å; T181-G185 PolarHBondContact O-N 2.79Å; T181-N218 PolarHBondContact OG1-ND2 2.89Å; T181-K220 HydrophobicContact CG2-CB 3.82Å; T181-T221 PolarHBondContact N-OG1 2.85Å; T181-T221 PolarHBondContact OG1-OG1 3.29Å
182	S	93.5	Very high	90.5	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-68.8	-38	-179.8	-50.9	0	0	0	0	112.7	N133 E137 Q178 I179 H180 G185 C186	N133-S182 PolarHBondContact OD1-OG 2.65Å; E137-S182 WeakPolarHBondContact OE1-CB 3.46Å; E137-S182 PolarHBondContact OE1-OG 3.35Å; E137-S182 VanDerWaalsContact OE1-OG 3.09Å; Q178-S182 PolarHBondContact O-N 2.75Å; Q178-S182 PolarHBondContact O-OG 3.42Å; I179-S182 PolarHBondContact O-N 2.92Å; H180-S182 VanDerWaalsContact C-N 3.33Å; H180-S182 PolarHBondContact O-N 2.93Å; S182-G185 CarbonylContact O-C 3.5Å; S182-G185 WeakPolarHBondContact O-CA 3.33Å; S182-G185 PolarHBondContact O-N 3.41Å; S182-C186 PolarHBondContact O-N 3.49Å; S182-C186 PolarHBondContact O-SG 3.14Å
183	L	94.8	Very high	90.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.2	-72.7	169.4	0	0	0	112	L112 I136 I163 F166 L167 M170 I179 H180 G185 C186 I187	L112-L183 HydrophobicContact CD2-CD2 3.7Å; I136-L183 HydrophobicContact CD1-CD2 4.2Å; I136-L183 HydrophobicContact CD1-CG 4.39Å; I136-L183 HydrophobicContact CG2-CD2 3.91Å; I136-L183 HydrophobicContact CG2-CG 4.11Å; I163-L183 HydrophobicContact CG2-CB 4.48Å; I163-L183 HydrophobicContact CG2-CD2 4.23Å; F166-L183 HydrophobicContact CD1-CD1 3.86Å; F166-L183 HydrophobicContact CD1-CD2 4Å; F166-L183 HydrophobicContact CE1-CD1 4.12Å; F166-L183 HydrophobicContact CE1-CD2 4.46Å; F166-L183 HydrophobicContact CG-CD1 4.1Å; L167-L183 HydrophobicContact CD2-CB 3.82Å; L167-L183 HydrophobicContact CD2-CD1 3.96Å; L167-L183 HydrophobicContact CG-CB 4.26Å; L167-L183 HydrophobicContact CG-CD1 4.33Å; M170-L183 HydrophobicContact SD-CD1 4.33Å; I179-L183 HydrophobicContact CG2-CD1 3.93Å; I179-L183 HydrophobicContact CG2-CG 4.32Å; I179-L183 WeakPolarHBondContact O-CG 3.48Å; I179-L183 PolarHBondContact O-N 2.88Å; H180-L183 PolarHBondContact O-N 3.32Å; L183-G185 VanDerWaalsContact C-N 3.25Å; L183-G185 PolarHBondContact O-N 2.81Å; L183-C186 WeakPolarHBondContact O-CB 3.4Å; L183-C186 PolarHBondContact O-N 3.08Å; L183-C186 VanDerWaalsContact O-N 3.15Å; L183-I187 PolarHBondContact O-N 3.16Å
184	I	96.1	Very high	90.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.7	-35.1	171.2	-63.5	-61.5	0	0	0	110.6	L167 H180 T181 C186 I187 K188 T221 A224 V225 I228	L167-I184 HydrophobicContact CD1-CD1 3.92Å; L167-I184 HydrophobicContact CD2-CD1 4.27Å; H180-I184 WeakPolarHBondContact O-CG1 3.47Å; H180-I184 PolarHBondContact O-N 2.67Å; H180-I184 VanDerWaalsContact O-N 3.16Å; T181-I184 PolarHBondContact O-N 2.66Å; I184-C186 PolarHBondContact O-N 3.33Å; I184-I187 HydrophobicContact CD1-CD1 4.48Å; I184-I187 PolarHBondContact O-N 2.83Å; I184-K188 PolarHBondContact O-N 3.08Å; I184-T221 HydrophobicContact CG1-CG2 4.14Å; I184-A224 HydrophobicContact CG2-CB 3.81Å; I184-V225 HydrophobicContact CD1-CG2 4.19Å; I184-V225 HydrophobicContact CG1-CG2 4.18Å; I184-V225 HydrophobicContact CG2-CG2 4.06Å; I184-I228 HydrophobicContact CG2-CD1 3.65Å
185	G	93.8	Very high	90.1	Very high	11 Å²	11	23.8 Å²	23.8	11%	0.113	13%	0.126	C	C	.	.	H	α-helix	trans	-60.5	-38.3	170.5	0	0	0	0	0	114	T181 S182 L183 K188 A189	T181-G185 PolarHBondContact O-N 2.79Å; S182-G185 CarbonylContact O-C 3.5Å; S182-G185 WeakPolarHBondContact O-CA 3.33Å; S182-G185 PolarHBondContact O-N 3.41Å; L183-G185 VanDerWaalsContact C-N 3.25Å; L183-G185 PolarHBondContact O-N 2.81Å; G185-K188 PolarHBondContact O-N 3.39Å; G185-A189 WeakPolarHBondContact O-CB 3.34Å; G185-A189 PolarHBondContact O-N 3.27Å
186	C	94.1	Very high	90.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-43	173.9	-62.7	0	0	0	0	111.4	L143 I163 S182 L183 I184 A189 L190	L143-C186 HydrophobicContact CD1-CB 3.88Å; I163-C186 HydrophobicContact CD1-CB 3.77Å; S182-C186 PolarHBondContact O-N 3.49Å; S182-C186 PolarHBondContact O-SG 3.14Å; L183-C186 WeakPolarHBondContact O-CB 3.4Å; L183-C186 PolarHBondContact O-N 3.08Å; L183-C186 VanDerWaalsContact O-N 3.15Å; I184-C186 PolarHBondContact O-N 3.33Å; C186-A189 PolarHBondContact O-N 3.12Å; C186-L190 WeakPolarHBondContact O-CB 3.48Å; C186-L190 PolarHBondContact O-N 2.89Å
187	I	94.4	Very high	90.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.9	-44	175.4	-61.1	177.4	0	0	0	110.4	I163 L164 L167 L183 I184 A189 L190 M191 V200 I210	I163-I187 HydrophobicContact CG2-CD1 4Å; I163-I187 HydrophobicContact CG2-CG1 3.87Å; L164-I187 HydrophobicContact CD2-CD1 3.99Å; L167-I187 HydrophobicContact CD1-CD1 3.75Å; L183-I187 PolarHBondContact O-N 3.16Å; I184-I187 HydrophobicContact CD1-CD1 4.48Å; I184-I187 PolarHBondContact O-N 2.83Å; I187-A189 PolarHBondContact O-N 3.25Å; I187-L190 PolarHBondContact O-N 2.7Å; I187-M191 HydrophobicContact CG2-CG 4.39Å; I187-M191 HydrophobicContact CG2-SD 4.04Å; I187-M191 VanDerWaalsContact O-CG 3.31Å; I187-M191 WeakPolarHBondContact O-CG 3.35Å; I187-M191 PolarHBondContact O-N 3.11Å; I187-V200 HydrophobicContact CG2-CG1 4.34Å; I187-V200 HydrophobicContact CG2-CG2 4.47Å; I187-I210 HydrophobicContact CD1-CD1 4.33Å; I187-I210 HydrophobicContact CD1-CG1 4Å; I187-I210 HydrophobicContact CG2-CD1 3.83Å; I187-I210 HydrophobicContact CG2-CG1 4.48Å
188	K	92	Very high	89.9	Confident	38 Å²	38	23.9 Å²	23.9	17%	0.165	13%	0.13	C	C	.	.	H	α-helix	trans	-59.1	-44.9	177	-166.7	179.2	177.5	-164.8	0	112	I184 G185 M191 N192 E227 I228 D1037	I184-K188 PolarHBondContact O-N 3.08Å; G185-K188 PolarHBondContact O-N 3.39Å; K188-M191 PolarHBondContact O-N 3.02Å; K188-N192 PolarHBondContact O-N 3.42Å; K188-E227 IonicContact NZ-OE2 3.19Å; K188-E227 PolarHBondContact NZ-OE2 3.43Å; K188-I228 HydrophobicContact CB-CD1 4.04Å; K188-I228 HydrophobicContact CB-CG1 4.15Å; K188-I228 HydrophobicContact CG-CG1 4.16Å; K188-D1037 WeakPolarHBondContact CE-OD1 3.48Å; K188-D1037 IonicContact NZ-OD1 2.88Å; K188-D1037 PolarHBondContact NZ-OD1 3.44Å
189	A	90.3	Very high	90	Very high	6 Å²	6	20.6 Å²	20.6	5%	0.05	12%	0.115	C	C	.	.	H	α-helix	trans	-60.2	-47.9	175.4	0	0	0	0	0	111.8	L143 R144 G185 C186 I187 M191 N192	L143-A189 HydrophobicContact CB-CB 3.96Å; R144-A189 HydrophobicContact CB-CB 4.16Å; G185-A189 WeakPolarHBondContact O-CB 3.34Å; G185-A189 PolarHBondContact O-N 3.27Å; C186-A189 PolarHBondContact O-N 3.12Å; I187-A189 PolarHBondContact O-N 3.25Å; A189-M191 VanDerWaalsContact C-N 3.27Å; A189-M191 PolarHBondContact O-N 3.26Å; A189-N192 VanDerWaalsContact O-CB 3.28Å; A189-N192 WeakPolarHBondContact O-CB 3.32Å; A189-N192 PolarHBondContact O-N 3.05Å
190	L	90.4	Very high	90.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.2	-35.4	176.6	-177.5	63.3	0	0	0	112.5	V151 I155 L160 C186 I187 N192 N193 G196 R197 V200	V151-L190 HydrophobicContact CG1-CD1 3.67Å; I155-L190 HydrophobicContact CD1-CD1 4.12Å; I155-L190 HydrophobicContact CG1-CD1 4.12Å; L160-L190 HydrophobicContact CB-CD2 4.22Å; L160-L190 HydrophobicContact CD1-CD2 4.08Å; C186-L190 WeakPolarHBondContact O-CB 3.48Å; C186-L190 PolarHBondContact O-N 2.89Å; I187-L190 PolarHBondContact O-N 2.7Å; L190-N192 VanDerWaalsContact C-N 3.28Å; L190-N192 PolarHBondContact O-N 3.12Å; L190-N193 PolarHBondContact O-N 3.48Å; L190-G196 CarbonylContact O-C 3.35Å; L190-G196 VanDerWaalsContact O-CA 3.25Å; L190-G196 WeakPolarHBondContact O-CA 3.17Å; L190-R197 PolarHBondContact O-N 3.14Å; L190-V200 HydrophobicContact CD2-CG2 3.76Å; L190-V200 HydrophobicContact CG-CG2 4.18Å
191	M	89.3	Confident	89.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-75.6	-12.2	176.7	-66.9	-177.4	75.6	0	0	114.3	I187 K188 A189 N193 R197 V200 I228 V232 F1036	I187-M191 HydrophobicContact CG2-CG 4.39Å; I187-M191 HydrophobicContact CG2-SD 4.04Å; I187-M191 VanDerWaalsContact O-CG 3.31Å; I187-M191 WeakPolarHBondContact O-CG 3.35Å; I187-M191 PolarHBondContact O-N 3.11Å; K188-M191 PolarHBondContact O-N 3.02Å; A189-M191 VanDerWaalsContact C-N 3.27Å; A189-M191 PolarHBondContact O-N 3.26Å; M191-N193 VanDerWaalsContact C-N 3.28Å; M191-R197 WeakPolarHBondContact O-CB 3.29Å; M191-R197 PolarHBondContact O-NH1 3.42Å; M191-R197 VanDerWaalsContact O-NH1 3.14Å; M191-V200 HydrophobicContact CE-CG1 4.15Å; M191-V200 HydrophobicContact CG-CB 4.01Å; M191-V200 HydrophobicContact CG-CG1 3.98Å; M191-V200 HydrophobicContact CG-CG2 3.98Å; M191-V200 HydrophobicContact SD-CB 4.37Å; M191-V200 HydrophobicContact SD-CG1 3.68Å; M191-I228 HydrophobicContact CE-CG2 4.25Å; M191-I228 HydrophobicContact SD-CG2 3.67Å; M191-V232 HydrophobicContact CE-CG2 3.44Å; M191-V232 VanDerWaalsContact CE-CG2 3.44Å; M191-F1036 HydrophobicContact CB-CD1 3.77Å; M191-F1036 HydrophobicContact CB-CE1 3.76Å; M191-F1036 HydrophobicContact CB-CG 4.21Å; M191-F1036 HydrophobicContact CB-CZ 4.19Å; M191-F1036 HydrophobicContact CE-CE1 4.32Å; M191-F1036 HydrophobicContact CE-CE2 3.99Å; M191-F1036 HydrophobicContact CE-CZ 3.67Å; M191-F1036 WeakPolarHBondContact O-CB 3.35Å; M191-F1036 WeakPolarHBondContact O-CG 3.43Å; M191-F1036 HydrophobicContact SD-CE1 4.33Å; M191-F1036 HydrophobicContact SD-CZ 4.21Å
192	N	86.3	Confident	89.7	Confident	29 Å²	29	23.8 Å²	23.8	16%	0.155	14%	0.142	C	C	.	.	H	α-helix	trans	-70.6	-28	173.6	-156.7	40.2	0	0	0	112.7	K188 A189 L190 R197 G1034 F1036 D1037	K188-N192 PolarHBondContact O-N 3.42Å; A189-N192 VanDerWaalsContact O-CB 3.28Å; A189-N192 WeakPolarHBondContact O-CB 3.32Å; A189-N192 PolarHBondContact O-N 3.05Å; L190-N192 VanDerWaalsContact C-N 3.28Å; L190-N192 PolarHBondContact O-N 3.12Å; N192-R197 PolarHBondContact O-NH1 2.71Å; N192-G1034 PolarHBondContact OD1-O 3.33Å; N192-F1036 HydrophobicContact CB-CB 4.4Å; N192-F1036 PolarHBondContact OD1-N 3.42Å; N192-F1036 VanDerWaalsContact OD1-N 3.15Å; N192-D1037 PolarHBondContact OD1-N 3.27Å
193	N	82.8	Confident	89.6	Confident	16 Å²	16	25.8 Å²	25.8	9%	0.086	15%	0.15	C	C	.	.	S	Bend	trans	-84.9	147.6	174	172.8	-106.2	0	0	0	112.6	D67 M148 V151 L190 M191 Q195 G196 R197	D67-N193 VanDerWaalsContact CG-ND2 3.33Å; D67-N193 WeakPolarHBondContact OD2-CA 3.36Å; D67-N193 PolarHBondContact OD2-ND2 3.31Å; M148-N193 VanDerWaalsContact CE-ND2 3.25Å; M148-N193 WeakPolarHBondContact CE-ND2 3.25Å; M148-N193 PolarHBondContact SD-ND2 2.88Å; V151-N193 HydrophobicContact CG1-CB 4.31Å; L190-N193 PolarHBondContact O-N 3.48Å; M191-N193 VanDerWaalsContact C-N 3.28Å; N193-Q195 PolarHBondContact OD1-N 2.88Å; N193-G196 PolarHBondContact OD1-N 3.46Å; N193-R197 WeakPolarHBondContact O-CB 3.47Å; N193-R197 PolarHBondContact O-N 2.72Å
194	S	81.4	Confident	89.2	Confident	39 Å²	39	30.7 Å²	30.7	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-48.3	-178.1	67.4	0	0	0	0	113.8	D67 A198	D67-S194 VanDerWaalsContact OD1-CB 3.28Å; D67-S194 WeakPolarHBondContact OD1-CB 3.49Å; D67-S194 PolarHBondContact OD1-OG 2.86Å; D67-S194 PolarHBondContact OD2-N 2.9Å; D67-S194 PolarHBondContact OD2-OG 2.61Å; S194-A198 PolarHBondContact O-N 3.4Å; S194-A198 VanDerWaalsContact O-N 3.11Å
195	Q	81.8	Confident	88.9	Confident	110 Å²	110	34.2 Å²	34.2	51%	0.514	20%	0.201	S	C	.	.	H	α-helix	trans	-71.2	-44.9	179.5	-68.2	-67.9	-8.1	0	0	111.5	M148 I155 N193 R197 A198 H199	M148-Q195 HydrophobicContact CE-CB 3.86Å; M148-Q195 HydrophobicContact CE-CG 3.39Å; I155-Q195 HydrophobicContact CD1-CB 4.33Å; N193-Q195 PolarHBondContact OD1-N 2.88Å; Q195-R197 VanDerWaalsContact C-N 3.31Å; Q195-R197 PolarHBondContact O-N 3Å; Q195-A198 WeakPolarHBondContact O-CB 3.38Å; Q195-A198 PolarHBondContact O-N 2.89Å; Q195-A198 VanDerWaalsContact O-N 3.13Å; Q195-H199 WeakPolarHBondContact O-CB 3.38Å; Q195-H199 PolarHBondContact O-N 3.5Å
196	G	86.9	Confident	88.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-39.9	176.6	0	0	0	0	0	112.9	L190 N193 H199 V200	L190-G196 CarbonylContact O-C 3.35Å; L190-G196 VanDerWaalsContact O-CA 3.25Å; L190-G196 WeakPolarHBondContact O-CA 3.17Å; N193-G196 PolarHBondContact OD1-N 3.46Å; G196-H199 PolarHBondContact O-N 2.67Å; G196-V200 WeakPolarHBondContact O-CB 3.43Å; G196-V200 VanDerWaalsContact O-CG2 3.27Å; G196-V200 WeakPolarHBondContact O-CG2 3.35Å; G196-V200 PolarHBondContact O-N 3.45Å
197	R	87.9	Confident	89	Confident	38 Å²	38	34.2 Å²	34.2	14%	0.143	20%	0.198	C	C	.	.	H	α-helix	trans	-61.8	-44.1	171.8	-173.8	163.4	60	-118.1	11.2	112.6	L190 M191 N192 N193 Q195 L201 E1035	L190-R197 PolarHBondContact O-N 3.14Å; M191-R197 WeakPolarHBondContact O-CB 3.29Å; M191-R197 PolarHBondContact O-NH1 3.42Å; M191-R197 VanDerWaalsContact O-NH1 3.14Å; N192-R197 PolarHBondContact O-NH1 2.71Å; N193-R197 WeakPolarHBondContact O-CB 3.47Å; N193-R197 PolarHBondContact O-N 2.72Å; Q195-R197 VanDerWaalsContact C-N 3.31Å; Q195-R197 PolarHBondContact O-N 3Å; R197-L201 HydrophobicContact CG-CD1 4.2Å; R197-L201 WeakPolarHBondContact O-CB 3.39Å; R197-L201 WeakPolarHBondContact O-CG 3.27Å; R197-L201 PolarHBondContact O-N 2.75Å; R197-L201 VanDerWaalsContact O-N 3.1Å; R197-E1035 IonicContact CZ-OE2 2.73Å; R197-E1035 IonicContact NH1-OE2 2.88Å; R197-E1035 IonicContact NH2-OE2 3.29Å; R197-E1035 PolarHBondContact NH2-OE2 2.95Å
198	A	86.8	Confident	89	Confident	53 Å²	53	35.8 Å²	35.8	44%	0.438	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-44.9	176.1	0	0	0	0	0	111.8	S194 Q195 L201 A202	S194-A198 PolarHBondContact O-N 3.4Å; S194-A198 VanDerWaalsContact O-N 3.11Å; Q195-A198 WeakPolarHBondContact O-CB 3.38Å; Q195-A198 PolarHBondContact O-N 2.89Å; Q195-A198 VanDerWaalsContact O-N 3.13Å; A198-L201 PolarHBondContact O-N 2.98Å; A198-A202 WeakPolarHBondContact O-CB 3.28Å; A198-A202 PolarHBondContact O-N 3.15Å
199	H	89.5	Confident	89.2	Confident	58 Å²	58	34.1 Å²	34.1	27%	0.269	20%	0.2	S	C	.	.	H	α-helix	trans	-66.6	-45	-179.8	-165.4	-107.5	0	0	0	112.5	I155 L160 Q195 G196 L201 A202 H203	I155-H199 HydrophobicContact CD1-CB 4.39Å; I155-H199 HydrophobicContact CG2-CB 4.14Å; L160-H199 WeakPolarHBondContact CD2-ND1 3.45Å; Q195-H199 WeakPolarHBondContact O-CB 3.38Å; Q195-H199 PolarHBondContact O-N 3.5Å; G196-H199 PolarHBondContact O-N 2.67Å; H199-L201 VanDerWaalsContact C-N 3.29Å; H199-L201 PolarHBondContact O-N 2.76Å; H199-A202 PolarHBondContact O-N 2.89Å; H199-A202 VanDerWaalsContact O-N 3.14Å; H199-H203 PolarHBondContact O-N 2.96Å
200	V	92	Very high	89.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-40.6	174.2	171.9	0	0	0	0	111.1	L160 I187 L190 M191 G196 S206 I207	L160-V200 HydrophobicContact CD1-CG2 3.94Å; L160-V200 HydrophobicContact CD2-CB 4.36Å; L160-V200 HydrophobicContact CD2-CG2 3.76Å; L160-V200 HydrophobicContact CG-CG2 4.5Å; I187-V200 HydrophobicContact CG2-CG1 4.34Å; I187-V200 HydrophobicContact CG2-CG2 4.47Å; L190-V200 HydrophobicContact CD2-CG2 3.76Å; L190-V200 HydrophobicContact CG-CG2 4.18Å; M191-V200 HydrophobicContact CE-CG1 4.15Å; M191-V200 HydrophobicContact CG-CB 4.01Å; M191-V200 HydrophobicContact CG-CG1 3.98Å; M191-V200 HydrophobicContact CG-CG2 3.98Å; M191-V200 HydrophobicContact SD-CB 4.37Å; M191-V200 HydrophobicContact SD-CG1 3.68Å; G196-V200 WeakPolarHBondContact O-CB 3.43Å; G196-V200 VanDerWaalsContact O-CG2 3.27Å; G196-V200 WeakPolarHBondContact O-CG2 3.35Å; G196-V200 PolarHBondContact O-N 3.45Å; V200-S206 WeakPolarHBondContact O-CB 3.22Å; V200-S206 PolarHBondContact O-OG 3.29Å; V200-I207 HydrophobicContact CG1-CD1 4.33Å
201	L	89.9	Confident	89.8	Confident	24 Å²	24	33.9 Å²	33.9	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-74.3	-27.8	176.8	-71.2	169	0	0	0	113.3	R197 A198 H199 I207 V232 V235 K241	R197-L201 HydrophobicContact CG-CD1 4.2Å; R197-L201 WeakPolarHBondContact O-CB 3.39Å; R197-L201 WeakPolarHBondContact O-CG 3.27Å; R197-L201 PolarHBondContact O-N 2.75Å; R197-L201 VanDerWaalsContact O-N 3.1Å; A198-L201 PolarHBondContact O-N 2.98Å; H199-L201 VanDerWaalsContact C-N 3.29Å; H199-L201 PolarHBondContact O-N 2.76Å; L201-I207 HydrophobicContact CD2-CD1 4.23Å; L201-V232 HydrophobicContact CD2-CG1 3.92Å; L201-V232 HydrophobicContact CD2-CG2 4.38Å; L201-V235 HydrophobicContact CD1-CB 4.47Å; L201-V235 HydrophobicContact CD1-CG1 3.72Å; L201-K241 PolarHBondContact O-NZ 3.44Å
202	A	89.9	Confident	90	Very high	75 Å²	75	35.6 Å²	35.6	62%	0.62	21%	0.206	S	C	*	.	H	α-helix	trans	-74.4	-37.2	177.6	0	0	0	0	0	112.7	A198 H199 S204	A198-A202 WeakPolarHBondContact O-CB 3.28Å; A198-A202 PolarHBondContact O-N 3.15Å; H199-A202 PolarHBondContact O-N 2.89Å; H199-A202 VanDerWaalsContact O-N 3.14Å; A202-S204 PolarHBondContact O-N 3Å
203	H	91.9	Very high	90.5	Very high	45 Å²	45	34.7 Å²	34.7	21%	0.208	20%	0.201	C	C	.	.	S	Bend	trans	-60.4	129.5	-179.8	-172.6	-81.7	0	0	0	112	L160 L164 H199 E205 S206	L160-H203 HydrophobicContact CD2-CB 4.22Å; L164-H203 VanDerWaalsContact CD1-CE1 3.49Å; L164-H203 WeakPolarHBondContact CD1-CE1 3.24Å; L164-H203 WeakPolarHBondContact CD1-ND1 3.39Å; H199-H203 PolarHBondContact O-N 2.96Å; H203-E205 PolarHBondContact ND1-N 3.38Å; H203-E205 PolarHBondContact O-N 3.24Å; H203-S206 PolarHBondContact ND1-N 2.96Å; H203-S206 PolarHBondContact O-OG 3.43Å; H203-S206 VanDerWaalsContact O-OG 3.05Å
204	S	85.9	Confident	91.1	Very high	103 Å²	103	34 Å²	34	72%	0.72	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-33.8	-167.2	53.9	0	0	0	0	114.9	A202	A202-S204 PolarHBondContact O-N 3Å
205	E	89.7	Confident	91.6	Very high	74 Å²	74	35 Å²	35	35%	0.346	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-3.4	-176	-64.8	-172.1	94.4	0	0	114.7	K168 H203 I207 N208 I209	K168-E205 IonicContact NZ-OE1 3.4Å; K168-E205 PolarHBondContact NZ-OE1 3.4Å; K168-E205 IonicContact NZ-OE2 2.66Å; K168-E205 PolarHBondContact NZ-OE2 2.87Å; H203-E205 PolarHBondContact ND1-N 3.38Å; H203-E205 PolarHBondContact O-N 3.24Å; E205-I207 PolarHBondContact O-N 2.86Å; E205-N208 WeakPolarHBondContact O-CB 3.45Å; E205-N208 PolarHBondContact O-N 3.39Å; E205-N208 VanDerWaalsContact O-N 3.14Å; E205-I209 HydrophobicContact CB-CD1 3.88Å; E205-I209 HydrophobicContact CB-CG1 4.37Å; E205-I209 WeakPolarHBondContact O-CD1 3.48Å; E205-I209 VanDerWaalsContact O-CG1 3.29Å; E205-I209 WeakPolarHBondContact O-CG1 3.44Å; E205-I209 PolarHBondContact O-N 3.5Å
206	S	94.1	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.6	-53.5	-169.3	53.1	0	0	0	0	112.1	V200 H203 N208 I209 I210	V200-S206 WeakPolarHBondContact O-CB 3.22Å; V200-S206 PolarHBondContact O-OG 3.29Å; H203-S206 PolarHBondContact ND1-N 2.96Å; H203-S206 PolarHBondContact O-OG 3.43Å; H203-S206 VanDerWaalsContact O-OG 3.05Å; S206-N208 VanDerWaalsContact C-N 3.29Å; S206-N208 PolarHBondContact O-N 3.21Å; S206-I209 PolarHBondContact O-N 3Å; S206-I210 WeakPolarHBondContact O-CD1 3.4Å; S206-I210 VanDerWaalsContact O-CG1 3.25Å; S206-I210 WeakPolarHBondContact O-CG1 3.36Å; S206-I210 PolarHBondContact O-N 2.86Å
207	I	95.4	Very high	92.3	Very high	11 Å²	11	33 Å²	33	6%	0.056	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-33	-179.7	-45.4	-54.5	0	0	0	111	V200 L201 E205 I210 A211 I242 A245	V200-I207 HydrophobicContact CG1-CD1 4.33Å; L201-I207 HydrophobicContact CD2-CD1 4.23Å; E205-I207 PolarHBondContact O-N 2.86Å; I207-I210 HydrophobicContact CD1-CD1 4.29Å; I207-A211 WeakPolarHBondContact O-CB 3.02Å; I207-A211 PolarHBondContact O-N 3.26Å; I207-I242 HydrophobicContact CG2-CD1 3.65Å; I207-A245 HydrophobicContact CB-CB 4.33Å; I207-A245 HydrophobicContact CG2-CB 3.71Å
208	N	95.1	Very high	92.4	Very high	32 Å²	32	32.2 Å²	32.2	17%	0.171	20%	0.198	C	C	.	.	H	α-helix	trans	-67.4	-37.2	175.8	-63.4	-16.9	0	0	0	111.7	E205 S206 Q212 A245 H248	E205-N208 WeakPolarHBondContact O-CB 3.45Å; E205-N208 PolarHBondContact O-N 3.39Å; E205-N208 VanDerWaalsContact O-N 3.14Å; S206-N208 VanDerWaalsContact C-N 3.29Å; S206-N208 PolarHBondContact O-N 3.21Å; N208-Q212 VanDerWaalsContact C-NE2 3.33Å; N208-Q212 VanDerWaalsContact O-CG 3.3Å; N208-Q212 WeakPolarHBondContact O-CG 3.34Å; N208-Q212 PolarHBondContact O-N 2.9Å; N208-Q212 VanDerWaalsContact O-N 3.15Å; N208-Q212 PolarHBondContact O-NE2 3.35Å; N208-A245 VanDerWaalsContact OD1-CA 3.32Å; N208-A245 WeakPolarHBondContact OD1-CA 3.39Å; N208-A245 WeakPolarHBondContact OD1-CB 3.33Å; N208-H248 HydrophobicContact CB-CB 4.47Å
209	I	95.4	Very high	92.6	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-73.9	-43.8	177.6	-65	160.9	0	0	0	110.2	L164 L167 K168 E205 S206 A211 Q212 S213	L164-I209 HydrophobicContact CB-CD1 3.86Å; L164-I209 HydrophobicContact CD1-CD1 4.39Å; L164-I209 HydrophobicContact CD2-CB 4.06Å; L164-I209 HydrophobicContact CD2-CD1 3.99Å; L164-I209 HydrophobicContact CD2-CG2 3.98Å; L164-I209 HydrophobicContact CG-CD1 4.3Å; L167-I209 HydrophobicContact CB-CG2 3.83Å; L167-I209 HydrophobicContact CD1-CG2 4.22Å; K168-I209 HydrophobicContact CD-CD1 3.78Å; K168-I209 HydrophobicContact CD-CG1 4.23Å; K168-I209 HydrophobicContact CG-CD1 4.02Å; K168-I209 HydrophobicContact CG-CG1 4.05Å; K168-I209 HydrophobicContact CG-CG2 4.48Å; E205-I209 HydrophobicContact CB-CD1 3.88Å; E205-I209 HydrophobicContact CB-CG1 4.37Å; E205-I209 WeakPolarHBondContact O-CD1 3.48Å; E205-I209 VanDerWaalsContact O-CG1 3.29Å; E205-I209 WeakPolarHBondContact O-CG1 3.44Å; E205-I209 PolarHBondContact O-N 3.5Å; S206-I209 PolarHBondContact O-N 3Å; I209-A211 PolarHBondContact O-N 3.04Å; I209-Q212 WeakPolarHBondContact O-CB 3.34Å; I209-Q212 PolarHBondContact O-N 3.47Å; I209-S213 PolarHBondContact O-N 2.92Å
210	I	96.4	Very high	92.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.2	-40.1	173.3	-65.7	160.1	0	0	0	110.7	I187 S206 I207 S213 V225 I228 M229	I187-I210 HydrophobicContact CD1-CD1 4.33Å; I187-I210 HydrophobicContact CD1-CG1 4Å; I187-I210 HydrophobicContact CG2-CD1 3.83Å; I187-I210 HydrophobicContact CG2-CG1 4.48Å; S206-I210 WeakPolarHBondContact O-CD1 3.4Å; S206-I210 VanDerWaalsContact O-CG1 3.25Å; S206-I210 WeakPolarHBondContact O-CG1 3.36Å; S206-I210 PolarHBondContact O-N 2.86Å; I207-I210 HydrophobicContact CD1-CD1 4.29Å; I210-S213 WeakPolarHBondContact O-CB 3.18Å; I210-S213 PolarHBondContact O-N 2.96Å; I210-V225 HydrophobicContact CG2-CG1 4.07Å; I210-V225 WeakPolarHBondContact O-CG1 3.49Å; I210-I228 HydrophobicContact CG2-CG2 4.35Å; I210-M229 HydrophobicContact CG2-CG 4.14Å
211	A	96.4	Very high	92.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-35.8	174.5	0	0	0	0	0	113.4	I207 I209 S213 L214 M229 A245 Y249	I207-A211 WeakPolarHBondContact O-CB 3.02Å; I207-A211 PolarHBondContact O-N 3.26Å; I209-A211 PolarHBondContact O-N 3.04Å; A211-S213 PolarHBondContact O-N 3.37Å; A211-L214 VanDerWaalsContact O-CB 3.32Å; A211-L214 WeakPolarHBondContact O-CB 3.48Å; A211-L214 VanDerWaalsContact O-CG 3.3Å; A211-L214 WeakPolarHBondContact O-CG 3.36Å; A211-L214 PolarHBondContact O-N 3.01Å; A211-L214 VanDerWaalsContact O-N 3.11Å; A211-M229 HydrophobicContact CB-CE 3.82Å; A211-M229 HydrophobicContact CB-SD 4.04Å; A211-A245 HydrophobicContact CB-CB 4.07Å; A211-Y249 WeakPolarHBondContact O-CD2 3.4Å; A211-Y249 WeakPolarHBondContact O-CE2 3.23Å
212	Q	95.5	Very high	93.1	Very high	37 Å²	37	34.1 Å²	34.1	17%	0.173	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-32.6	175.5	-75.3	161.8	74.6	0	0	112.4	N208 I209 L214 A215 H248 F252	N208-Q212 VanDerWaalsContact C-NE2 3.33Å; N208-Q212 VanDerWaalsContact O-CG 3.3Å; N208-Q212 WeakPolarHBondContact O-CG 3.34Å; N208-Q212 PolarHBondContact O-N 2.9Å; N208-Q212 VanDerWaalsContact O-N 3.15Å; N208-Q212 PolarHBondContact O-NE2 3.35Å; I209-Q212 WeakPolarHBondContact O-CB 3.34Å; I209-Q212 PolarHBondContact O-N 3.47Å; Q212-L214 PolarHBondContact O-N 3.44Å; Q212-A215 WeakPolarHBondContact O-CB 3.09Å; Q212-A215 PolarHBondContact O-N 2.94Å; Q212-A215 VanDerWaalsContact O-N 3.12Å; Q212-H248 PolarHBondContact NE2-CE1 3.48Å; Q212-F252 HydrophobicContact CB-CD1 4.25Å; Q212-F252 HydrophobicContact CB-CE1 3.92Å; Q212-F252 HydrophobicContact CB-CE2 4.41Å; Q212-F252 HydrophobicContact CB-CZ 4.01Å; Q212-F252 HydrophobicContact CG-CB 4.36Å; Q212-F252 HydrophobicContact CG-CD1 3.79Å; Q212-F252 HydrophobicContact CG-CD2 3.83Å; Q212-F252 HydrophobicContact CG-CE1 3.92Å; Q212-F252 HydrophobicContact CG-CE2 3.96Å; Q212-F252 HydrophobicContact CG-CG 3.75Å; Q212-F252 HydrophobicContact CG-CZ 4Å
213	S	95.8	Very high	93.4	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.063	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-61.8	-7.6	174.7	-65.5	0	0	0	0	115.3	H180 I209 I210 A211 A215 T216	H180-S213 WeakPolarHBondContact NE2-CB 3.26Å; H180-S213 PolarHBondContact NE2-OG 3.49Å; I209-S213 PolarHBondContact O-N 2.92Å; I210-S213 WeakPolarHBondContact O-CB 3.18Å; I210-S213 PolarHBondContact O-N 2.96Å; A211-S213 PolarHBondContact O-N 3.37Å; S213-A215 PolarHBondContact O-N 2.95Å; S213-T216 VanDerWaalsContact O-CG2 3.26Å; S213-T216 WeakPolarHBondContact O-CG2 3.49Å
214	L	95.4	Very high	93.5	Very high	3 Å²	3	30 Å²	30	2%	0.016	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-67	-20.9	169.6	-67.4	172.5	0	0	0	113.7	A211 Q212 T216 K222 V225 L226 M229 M246 Y249 L262	A211-L214 VanDerWaalsContact O-CB 3.32Å; A211-L214 WeakPolarHBondContact O-CB 3.48Å; A211-L214 VanDerWaalsContact O-CG 3.3Å; A211-L214 WeakPolarHBondContact O-CG 3.36Å; A211-L214 PolarHBondContact O-N 3.01Å; A211-L214 VanDerWaalsContact O-N 3.11Å; Q212-L214 PolarHBondContact O-N 3.44Å; L214-T216 VanDerWaalsContact C-N 3.32Å; L214-T216 PolarHBondContact O-N 3.27Å; L214-K222 VanDerWaalsContact O-CE 3.31Å; L214-K222 WeakPolarHBondContact O-CE 3.37Å; L214-V225 HydrophobicContact CD2-CB 4.15Å; L214-V225 HydrophobicContact CD2-CG1 3.56Å; L214-V225 HydrophobicContact CG-CG1 3.8Å; L214-L226 HydrophobicContact CD2-CD2 4.18Å; L214-L226 HydrophobicContact CD2-CG 4.02Å; L214-M229 HydrophobicContact CD1-SD 4.41Å; L214-M246 HydrophobicContact CD1-CE 4.16Å; L214-M246 HydrophobicContact CD1-SD 4.15Å; L214-Y249 HydrophobicContact CB-CE2 3.83Å; L214-L262 HydrophobicContact CD1-CD2 4.19Å; L214-L262 HydrophobicContact CD2-CD2 4.32Å
215	A	92.8	Very high	94	Very high	59 Å²	59	25 Å²	25	49%	0.488	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-77.8	-7.3	-172.1	0	0	0	0	0	115.5	Q212 S213 Y249 F252	Q212-A215 WeakPolarHBondContact O-CB 3.09Å; Q212-A215 PolarHBondContact O-N 2.94Å; Q212-A215 VanDerWaalsContact O-N 3.12Å; S213-A215 PolarHBondContact O-N 2.95Å; A215-Y249 HydrophobicContact CB-CE2 4.31Å; A215-F252 HydrophobicContact CB-CE1 4.01Å
216	T	92.3	Very high	94.3	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.018	12%	0.116	C	C	.	.	S	Bend	trans	-64.7	169.4	173.8	-177.5	0	0	0	0	112.8	T175 E176 S213 L214 N218 T221 K222	T175-T216 PolarHBondContact O-OG1 3.11Å; E176-T216 VanDerWaalsContact CD-OG1 3.31Å; E176-T216 VanDerWaalsContact OE1-CA 3.23Å; E176-T216 WeakPolarHBondContact OE1-CA 3.42Å; E176-T216 WeakPolarHBondContact OE1-CB 3.21Å; E176-T216 PolarHBondContact OE1-OG1 3.31Å; S213-T216 VanDerWaalsContact O-CG2 3.26Å; S213-T216 WeakPolarHBondContact O-CG2 3.49Å; L214-T216 VanDerWaalsContact C-N 3.32Å; L214-T216 PolarHBondContact O-N 3.27Å; T216-N218 HydrophobicContact CG2-CB 4.23Å; T216-N218 WeakPolarHBondContact OG1-CB 3.46Å; T216-N218 PolarHBondContact OG1-N 3.38Å; T216-T221 HydrophobicContact CG2-CG2 4.22Å; T216-K222 HydrophobicContact CG2-CG 4.06Å; T216-K222 WeakPolarHBondContact O-CE 3.47Å; T216-K222 PolarHBondContact O-NZ 2.83Å
217	E	89.4	Confident	94.4	Very high	64 Å²	64	23.5 Å²	23.5	30%	0.299	13%	0.125	S	C	.	.	S	Bend	trans	-103.3	7.6	163.9	-75.1	-84	157.5	0	0	112.2	E176 I219 R268 R272 Y273	E176-E217 VanDerWaalsContact CD-N 3.32Å; E176-E217 PolarHBondContact OE1-N 2.9Å; E176-E217 VanDerWaalsContact OE2-C 3.22Å; E176-E217 VanDerWaalsContact OE2-CA 3.3Å; E176-E217 WeakPolarHBondContact OE2-CA 3.38Å; E176-E217 VanDerWaalsContact OE2-CB 3.25Å; E176-E217 WeakPolarHBondContact OE2-CB 3.38Å; E176-E217 PolarHBondContact OE2-N 3.3Å; E176-E217 VanDerWaalsContact OE2-N 3.13Å; E217-I219 PolarHBondContact O-N 3.15Å; E217-R268 VanDerWaalsContact CD-NH2 3.28Å; E217-R268 IonicContact OE1-CZ 2.81Å; E217-R268 VanDerWaalsContact OE1-CZ 3.29Å; E217-R268 IonicContact OE1-NH1 3.43Å; E217-R268 PolarHBondContact OE1-NH1 2.94Å; E217-R268 IonicContact OE1-NH2 2.63Å; E217-R268 PolarHBondContact OE1-NH2 3.28Å; E217-R268 IonicContact OE2-CZ 3.58Å; E217-R268 IonicContact OE2-NH1 2.65Å; E217-R268 PolarHBondContact OE2-NH1 3.07Å; E217-R268 IonicContact OE2-NH2 3.61Å; E217-R268 PolarHBondContact OE2-NH2 3.02Å; E217-R272 PolarHBondContact O-NH2 2.98Å; E217-Y273 WeakPolarHBondContact CA-OH 3.33Å; E217-Y273 VanDerWaalsContact CD-OH 3.25Å; E217-Y273 PolarHBondContact O-OH 3.38Å; E217-Y273 WeakPolarHBondContact OE2-CE2 3.35Å; E217-Y273 VanDerWaalsContact OE2-CZ 3.3Å; E217-Y273 PolarHBondContact OE2-OH 3.5Å
218	N	90.9	Very high	94.3	Very high	22 Å²	22	23 Å²	23	12%	0.118	12%	0.122	C	C	.	.			trans	-84	104.6	172.8	-175.7	-22.4	0	0	0	111.7	E176 S177 T181 T216 K220 T221 K222	E176-N218 PolarHBondContact O-ND2 3.28Å; E176-N218 VanDerWaalsContact O-ND2 3.13Å; E176-N218 PolarHBondContact OE2-N 2.62Å; S177-N218 PolarHBondContact O-ND2 2.88Å; T181-N218 PolarHBondContact OG1-ND2 2.89Å; T216-N218 HydrophobicContact CG2-CB 4.23Å; T216-N218 WeakPolarHBondContact OG1-CB 3.46Å; T216-N218 PolarHBondContact OG1-N 3.38Å; N218-K220 VanDerWaalsContact C-N 3.31Å; N218-K220 PolarHBondContact O-N 3.39Å; N218-K220 PolarHBondContact OD1-N 3.24Å; N218-T221 PolarHBondContact O-N 2.88Å; N218-T221 PolarHBondContact OD1-N 3.17Å; N218-K222 PolarHBondContact O-N 2.92Å
219	I	91.6	Very high	94.4	Very high	15 Å²	15	21.6 Å²	21.6	8%	0.077	12%	0.115	C	C	.	.	H	α-helix	trans	-57.6	-37.6	-177.9	-63.1	-178.2	0	0	0	112.8	E217 K222 V223 R272 Y273 E276 L279	E217-I219 PolarHBondContact O-N 3.15Å; I219-K222 PolarHBondContact O-N 2.76Å; I219-V223 WeakPolarHBondContact O-CG2 3.18Å; I219-V223 PolarHBondContact O-N 3.28Å; I219-R272 HydrophobicContact CD1-CB 4.08Å; I219-Y273 HydrophobicContact CD1-CD1 3.85Å; I219-Y273 HydrophobicContact CD1-CE1 3.82Å; I219-Y273 HydrophobicContact CD1-CG 4.34Å; I219-Y273 HydrophobicContact CG1-CD1 4.15Å; I219-Y273 HydrophobicContact CG1-CE1 3.64Å; I219-E276 HydrophobicContact CD1-CB 4.22Å; I219-E276 HydrophobicContact CD1-CG 3.84Å; I219-L279 HydrophobicContact CG2-CB 4.01Å; I219-L279 HydrophobicContact CG2-CD2 4.32Å
220	K	92.3	Very high	94.3	Very high	149 Å²	149	21.4 Å²	21.4	65%	0.648	11%	0.114	S	C	*	.	H	α-helix	trans	-67.3	-39.7	-179.2	-64.6	-174.1	178.5	-177.5	0	111.6	T181 N218 V223 A224	T181-K220 HydrophobicContact CG2-CB 3.82Å; N218-K220 VanDerWaalsContact C-N 3.31Å; N218-K220 PolarHBondContact O-N 3.39Å; N218-K220 PolarHBondContact OD1-N 3.24Å; K220-V223 PolarHBondContact O-N 3.3Å; K220-A224 PolarHBondContact O-N 3.05Å
221	T	94.6	Very high	94.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.2	-45.1	175.6	-54	0	0	0	0	110.6	T181 I184 T216 N218 V223 A224 V225	T181-T221 PolarHBondContact N-OG1 2.85Å; T181-T221 PolarHBondContact OG1-OG1 3.29Å; I184-T221 HydrophobicContact CG1-CG2 4.14Å; T216-T221 HydrophobicContact CG2-CG2 4.22Å; N218-T221 PolarHBondContact O-N 2.88Å; N218-T221 PolarHBondContact OD1-N 3.17Å; T221-V223 VanDerWaalsContact C-N 3.34Å; T221-V223 PolarHBondContact O-N 2.89Å; T221-A224 PolarHBondContact O-N 2.86Å; T221-V225 HydrophobicContact CG2-CG2 4.35Å; T221-V225 WeakPolarHBondContact O-CB 3.26Å; T221-V225 VanDerWaalsContact O-CG2 3.27Å; T221-V225 WeakPolarHBondContact O-CG2 3.23Å; T221-V225 PolarHBondContact O-N 2.92Å
222	K	94.9	Very high	93.9	Very high	12 Å²	12	21.4 Å²	21.4	5%	0.052	11%	0.114	C	C	.	.	H	α-helix	trans	-58.2	-43.5	175.6	-63.7	-169.9	-169.1	-165.9	0	112.7	L214 T216 N218 I219 V225 L226 E265 L279	L214-K222 VanDerWaalsContact O-CE 3.31Å; L214-K222 WeakPolarHBondContact O-CE 3.37Å; T216-K222 HydrophobicContact CG2-CG 4.06Å; T216-K222 WeakPolarHBondContact O-CE 3.47Å; T216-K222 PolarHBondContact O-NZ 2.83Å; N218-K222 PolarHBondContact O-N 2.92Å; I219-K222 PolarHBondContact O-N 2.76Å; K222-V225 PolarHBondContact O-N 2.99Å; K222-L226 WeakPolarHBondContact O-CB 3.22Å; K222-L226 WeakPolarHBondContact O-CD1 3.42Å; K222-L226 VanDerWaalsContact O-CG 3.24Å; K222-L226 WeakPolarHBondContact O-CG 3.42Å; K222-L226 PolarHBondContact O-N 3.42Å; K222-E265 IonicContact NZ-OE2 2.62Å; K222-E265 PolarHBondContact NZ-OE2 3.44Å; K222-L279 HydrophobicContact CB-CD1 3.61Å; K222-L279 HydrophobicContact CD-CD1 4.37Å; K222-L279 HydrophobicContact CD-CD2 4.23Å
223	V	94.9	Very high	93.8	Very high	18 Å²	18	19.8 Å²	19.8	11%	0.109	11%	0.107	C	C	.	.	H	α-helix	trans	-61.1	-50.6	176.4	170.3	0	0	0	0	110.9	I219 K220 T221 V225 L226 E227 L279 A282	I219-V223 WeakPolarHBondContact O-CG2 3.18Å; I219-V223 PolarHBondContact O-N 3.28Å; K220-V223 PolarHBondContact O-N 3.3Å; T221-V223 VanDerWaalsContact C-N 3.34Å; T221-V223 PolarHBondContact O-N 2.89Å; V223-V225 VanDerWaalsContact C-N 3.34Å; V223-V225 PolarHBondContact O-N 2.61Å; V223-L226 PolarHBondContact O-N 3.37Å; V223-E227 HydrophobicContact CG1-CG 4.46Å; V223-E227 WeakPolarHBondContact CG1-OE1 3.49Å; V223-E227 WeakPolarHBondContact O-CG 3.35Å; V223-E227 PolarHBondContact O-N 3.12Å; V223-L279 HydrophobicContact CG2-CB 4.14Å; V223-L279 HydrophobicContact CG2-CD1 4.2Å; V223-A282 HydrophobicContact CG1-CB 4.34Å; V223-A282 HydrophobicContact CG2-CB 4.23Å
224	A	94.7	Very high	93.5	Very high	14 Å²	14	21.2 Å²	21.2	12%	0.116	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-38.2	179.9	0	0	0	0	0	113.1	I184 K220 T221 I228	I184-A224 HydrophobicContact CG2-CB 3.81Å; K220-A224 PolarHBondContact O-N 3.05Å; T221-A224 PolarHBondContact O-N 2.86Å; A224-I228 WeakPolarHBondContact O-CG1 3.5Å; A224-I228 PolarHBondContact O-N 2.9Å; A224-I228 VanDerWaalsContact O-N 3.14Å
225	V	96.8	Very high	93.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-48.1	173.5	169.8	0	0	0	0	111.1	I184 I210 L214 T221 K222 V223 E227 I228 M229	I184-V225 HydrophobicContact CD1-CG2 4.19Å; I184-V225 HydrophobicContact CG1-CG2 4.18Å; I184-V225 HydrophobicContact CG2-CG2 4.06Å; I210-V225 HydrophobicContact CG2-CG1 4.07Å; I210-V225 WeakPolarHBondContact O-CG1 3.49Å; L214-V225 HydrophobicContact CD2-CB 4.15Å; L214-V225 HydrophobicContact CD2-CG1 3.56Å; L214-V225 HydrophobicContact CG-CG1 3.8Å; T221-V225 HydrophobicContact CG2-CG2 4.35Å; T221-V225 WeakPolarHBondContact O-CB 3.26Å; T221-V225 VanDerWaalsContact O-CG2 3.27Å; T221-V225 WeakPolarHBondContact O-CG2 3.23Å; T221-V225 PolarHBondContact O-N 2.92Å; K222-V225 PolarHBondContact O-N 2.99Å; V223-V225 VanDerWaalsContact C-N 3.34Å; V223-V225 PolarHBondContact O-N 2.61Å; V225-E227 VanDerWaalsContact C-N 3.33Å; V225-E227 PolarHBondContact O-N 2.99Å; V225-I228 PolarHBondContact O-N 3.13Å; V225-M229 HydrophobicContact CG1-CG 4.21Å; V225-M229 HydrophobicContact CG1-SD 3.62Å; V225-M229 WeakPolarHBondContact O-CB 3.34Å; V225-M229 VanDerWaalsContact O-CG 3.26Å; V225-M229 WeakPolarHBondContact O-CG 3.19Å; V225-M229 PolarHBondContact O-N 3.1Å
226	L	96.8	Very high	92.6	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-32.3	179.6	-72.1	165.2	0	0	0	112.9	L214 K222 V223 G230 L262 L279 A282 I283 F286	L214-L226 HydrophobicContact CD2-CD2 4.18Å; L214-L226 HydrophobicContact CD2-CG 4.02Å; K222-L226 WeakPolarHBondContact O-CB 3.22Å; K222-L226 WeakPolarHBondContact O-CD1 3.42Å; K222-L226 VanDerWaalsContact O-CG 3.24Å; K222-L226 WeakPolarHBondContact O-CG 3.42Å; K222-L226 PolarHBondContact O-N 3.42Å; V223-L226 PolarHBondContact O-N 3.37Å; L226-G230 WeakPolarHBondContact O-CA 3.49Å; L226-G230 PolarHBondContact O-N 3.37Å; L226-L262 HydrophobicContact CD2-CD2 3.99Å; L226-L279 HydrophobicContact CD1-CD1 3.84Å; L226-A282 HydrophobicContact CB-CB 4.06Å; L226-A282 HydrophobicContact CD1-CB 4.11Å; L226-I283 HydrophobicContact CD1-CB 4.46Å; L226-I283 HydrophobicContact CD1-CG1 3.52Å; L226-F286 HydrophobicContact CD2-CB 3.86Å; L226-F286 HydrophobicContact CD2-CD1 3.88Å; L226-F286 HydrophobicContact CD2-CD2 4.3Å; L226-F286 HydrophobicContact CD2-CG 3.74Å
227	E	94.6	Very high	92.1	Very high	38 Å²	38	28.1 Å²	28.1	18%	0.178	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-52.3	170.6	-78.9	175.3	-162.4	0	0	111.6	K188 V223 V225 G230 A231 V1040	K188-E227 IonicContact NZ-OE2 3.19Å; K188-E227 PolarHBondContact NZ-OE2 3.43Å; V223-E227 HydrophobicContact CG1-CG 4.46Å; V223-E227 WeakPolarHBondContact CG1-OE1 3.49Å; V223-E227 WeakPolarHBondContact O-CG 3.35Å; V223-E227 PolarHBondContact O-N 3.12Å; V225-E227 VanDerWaalsContact C-N 3.33Å; V225-E227 PolarHBondContact O-N 2.99Å; E227-G230 PolarHBondContact O-N 3.17Å; E227-A231 WeakPolarHBondContact O-CB 3.3Å; E227-A231 PolarHBondContact O-N 2.86Å; E227-V1040 HydrophobicContact CB-CG1 3.76Å; E227-V1040 HydrophobicContact CG-CG1 3.76Å
228	I	94.8	Very high	92.1	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-51.4	177.1	-65.6	164.1	0	0	0	110.1	I184 K188 M191 I210 A224 V225 G230 A231 V232	I184-I228 HydrophobicContact CG2-CD1 3.65Å; K188-I228 HydrophobicContact CB-CD1 4.04Å; K188-I228 HydrophobicContact CB-CG1 4.15Å; K188-I228 HydrophobicContact CG-CG1 4.16Å; M191-I228 HydrophobicContact CE-CG2 4.25Å; M191-I228 HydrophobicContact SD-CG2 3.67Å; I210-I228 HydrophobicContact CG2-CG2 4.35Å; A224-I228 WeakPolarHBondContact O-CG1 3.5Å; A224-I228 PolarHBondContact O-N 2.9Å; A224-I228 VanDerWaalsContact O-N 3.14Å; V225-I228 PolarHBondContact O-N 3.13Å; I228-G230 VanDerWaalsContact C-N 3.3Å; I228-G230 PolarHBondContact O-N 3.33Å; I228-A231 PolarHBondContact O-N 3.27Å; I228-V232 HydrophobicContact CG2-CG2 4.26Å; I228-V232 WeakPolarHBondContact O-CB 3.23Å; I228-V232 VanDerWaalsContact O-CG2 3.26Å; I228-V232 WeakPolarHBondContact O-CG2 3.2Å; I228-V232 PolarHBondContact O-N 3.44Å
229	M	95.8	Very high	92.1	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64.7	-34.5	-176.9	-70.9	-174.4	73.8	0	0	112.5	I210 A211 L214 V225 C233 I242 M246 F286	I210-M229 HydrophobicContact CG2-CG 4.14Å; A211-M229 HydrophobicContact CB-CE 3.82Å; A211-M229 HydrophobicContact CB-SD 4.04Å; L214-M229 HydrophobicContact CD1-SD 4.41Å; V225-M229 HydrophobicContact CG1-CG 4.21Å; V225-M229 HydrophobicContact CG1-SD 3.62Å; V225-M229 WeakPolarHBondContact O-CB 3.34Å; V225-M229 VanDerWaalsContact O-CG 3.26Å; V225-M229 WeakPolarHBondContact O-CG 3.19Å; V225-M229 PolarHBondContact O-N 3.1Å; M229-C233 PolarHBondContact O-N 2.93Å; M229-C233 PolarHBondContact O-SG 3.15Å; M229-I242 HydrophobicContact CB-CD1 3.75Å; M229-I242 HydrophobicContact CE-CD1 3.95Å; M229-I242 HydrophobicContact CE-CG2 4.22Å; M229-I242 HydrophobicContact CG-CD1 3.85Å; M229-I242 WeakPolarHBondContact O-CD1 3.2Å; M229-M246 HydrophobicContact CE-CG 4.22Å; M229-M246 HydrophobicContact CE-SD 3.53Å; M229-M246 VanDerWaalsContact CE-SD 3.53Å; M229-F286 HydrophobicContact CB-CD2 3.99Å; M229-F286 HydrophobicContact CB-CE2 3.71Å; M229-F286 HydrophobicContact CE-CE2 4.35Å; M229-F286 HydrophobicContact CE-CZ 4.35Å
230	G	93.5	Very high	92	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-51.5	171.9	0	0	0	0	0	111.9	L226 E227 I228 V232 C233 L234	L226-G230 WeakPolarHBondContact O-CA 3.49Å; L226-G230 PolarHBondContact O-N 3.37Å; E227-G230 PolarHBondContact O-N 3.17Å; I228-G230 VanDerWaalsContact C-N 3.3Å; I228-G230 PolarHBondContact O-N 3.33Å; G230-V232 VanDerWaalsContact C-N 3.34Å; G230-V232 PolarHBondContact O-N 3.16Å; G230-C233 VanDerWaalsContact O-CB 3.29Å; G230-C233 WeakPolarHBondContact O-CB 3.37Å; G230-C233 PolarHBondContact O-N 3.47Å; G230-C233 VanDerWaalsContact O-N 3.08Å; G230-L234 VanDerWaalsContact O-CD1 3.23Å; G230-L234 WeakPolarHBondContact O-CD1 3.26Å
231	A	91.9	Very high	91.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-37.4	179.9	0	0	0	0	0	112.5	E227 I228 C233 L234 F1036 V1040	E227-A231 WeakPolarHBondContact O-CB 3.3Å; E227-A231 PolarHBondContact O-N 2.86Å; I228-A231 PolarHBondContact O-N 3.27Å; A231-C233 PolarHBondContact O-N 2.99Å; A231-L234 WeakPolarHBondContact O-CB 3.45Å; A231-L234 PolarHBondContact O-N 3.42Å; A231-F1036 HydrophobicContact CB-CD2 4.37Å; A231-F1036 HydrophobicContact CB-CE1 4.27Å; A231-F1036 HydrophobicContact CB-CE2 3.6Å; A231-F1036 HydrophobicContact CB-CZ 3.53Å; A231-V1040 HydrophobicContact CB-CG2 3.6Å
232	V	93.2	Very high	91.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.1	-28.6	173.4	169.8	0	0	0	0	112.5	M191 L201 I228 G230 L234 V235 G238 I242 F1036	M191-V232 HydrophobicContact CE-CG2 3.44Å; M191-V232 VanDerWaalsContact CE-CG2 3.44Å; L201-V232 HydrophobicContact CD2-CG1 3.92Å; L201-V232 HydrophobicContact CD2-CG2 4.38Å; I228-V232 HydrophobicContact CG2-CG2 4.26Å; I228-V232 WeakPolarHBondContact O-CB 3.23Å; I228-V232 VanDerWaalsContact O-CG2 3.26Å; I228-V232 WeakPolarHBondContact O-CG2 3.2Å; I228-V232 PolarHBondContact O-N 3.44Å; G230-V232 VanDerWaalsContact C-N 3.34Å; G230-V232 PolarHBondContact O-N 3.16Å; V232-L234 PolarHBondContact O-N 2.89Å; V232-V235 PolarHBondContact O-N 3.49Å; V232-V235 VanDerWaalsContact O-N 3.15Å; V232-G238 CarbonylContact O-C 3.58Å; V232-G238 WeakPolarHBondContact O-CA 3.48Å; V232-I242 HydrophobicContact CB-CD1 4.03Å; V232-I242 HydrophobicContact CB-CG1 4.12Å; V232-I242 HydrophobicContact CG1-CD1 3.85Å; V232-I242 HydrophobicContact CG1-CG1 3.66Å; V232-F1036 HydrophobicContact CG2-CZ 4.41Å
233	C	92.7	Very high	91.8	Very high	3 Å²	3	25 Å²	25	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-26.4	174.6	-67	0	0	0	0	113.1	M229 G230 A231 A289 Q293	M229-C233 PolarHBondContact O-N 2.93Å; M229-C233 PolarHBondContact O-SG 3.15Å; G230-C233 VanDerWaalsContact O-CB 3.29Å; G230-C233 WeakPolarHBondContact O-CB 3.37Å; G230-C233 PolarHBondContact O-N 3.47Å; G230-C233 VanDerWaalsContact O-N 3.08Å; A231-C233 PolarHBondContact O-N 2.99Å; C233-A289 HydrophobicContact CB-CB 3.99Å; C233-Q293 HydrophobicContact CB-CB 4.29Å; C233-Q293 HydrophobicContact CB-CG 4.32Å; C233-Q293 VanDerWaalsContact O-CB 3.22Å; C233-Q293 WeakPolarHBondContact O-CB 3.42Å
234	L	88.9	Confident	91.6	Very high	38 Å²	38	27.1 Å²	27.1	20%	0.199	16%	0.156	C	C	.	.	H	α-helix	trans	-83.6	-15.1	178.8	-71.2	69.3	0	0	0	112.1	G230 A231 V232 A289 Q293 L1039 L1043 V1048	G230-L234 VanDerWaalsContact O-CD1 3.23Å; G230-L234 WeakPolarHBondContact O-CD1 3.26Å; A231-L234 WeakPolarHBondContact O-CB 3.45Å; A231-L234 PolarHBondContact O-N 3.42Å; V232-L234 PolarHBondContact O-N 2.89Å; L234-A289 HydrophobicContact CD1-CB 4.25Å; L234-Q293 HydrophobicContact CD1-CG 4.13Å; L234-Q293 HydrophobicContact CG-CG 4.25Å; L234-L1039 HydrophobicContact CD2-CD2 3.89Å; L234-L1043 HydrophobicContact CD1-CD1 4.37Å; L234-L1043 HydrophobicContact CD1-CD2 4.02Å; L234-V1048 HydrophobicContact CD2-CG1 4.12Å; L234-V1048 HydrophobicContact CD2-CG2 3.92Å
235	V	86.8	Confident	91.6	Very high	25 Å²	25	26.5 Å²	26.5	15%	0.152	15%	0.151	C	C	.	.	S	Bend	trans	-83.7	137.5	-179.2	-174.3	0	0	0	0	109.8	L201 V232 G237 G238	L201-V235 HydrophobicContact CD1-CB 4.47Å; L201-V235 HydrophobicContact CD1-CG1 3.72Å; V232-V235 PolarHBondContact O-N 3.49Å; V232-V235 VanDerWaalsContact O-N 3.15Å; V235-G237 PolarHBondContact O-N 2.74Å; V235-G238 PolarHBondContact O-N 3.1Å
236	P	82.3	Confident	91.4	Very high	128 Å²	128	26.5 Å²	26.5	83%	0.831	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	122.1	178.7	-31.1	37.2	0	0	0	113.7	G238	P236-G238 PolarHBondContact O-N 2.71Å
237	G	83.6	Confident	91.1	Very high	57 Å²	57	27.7 Å²	27.7	59%	0.588	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.6	-12.3	-176.8	0	0	0	0	0	115.8	V235 K240	V235-G237 PolarHBondContact O-N 2.74Å; G237-K240 PolarHBondContact O-N 3.29Å
238	G	88.5	Confident	90.9	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-38.8	-179.2	0	0	0	0	0	113.5	V232 V235 P236 K240 K241 I242	V232-G238 CarbonylContact O-C 3.58Å; V232-G238 WeakPolarHBondContact O-CA 3.48Å; V235-G238 PolarHBondContact O-N 3.1Å; P236-G238 PolarHBondContact O-N 2.71Å; G238-K240 VanDerWaalsContact C-N 3.27Å; G238-K240 PolarHBondContact O-N 3.06Å; G238-K241 PolarHBondContact O-N 2.95Å; G238-I242 WeakPolarHBondContact O-CG1 3.45Å; G238-I242 PolarHBondContact O-N 3.17Å
239	H	91.4	Very high	90.9	Very high	10 Å²	10	29.3 Å²	29.3	5%	0.046	16%	0.164	C	C	.	.	H	α-helix	trans	-49.7	-43.4	173.9	177.7	-102.6	0	0	0	113.4	I242 L243 V290 Q293 F302	H239-I242 PolarHBondContact O-N 3.33Å; H239-L243 PolarHBondContact O-N 2.91Å; H239-V290 PolarHBondContact NE2-O 2.93Å; H239-Q293 PolarHBondContact CD2-O 3.35Å; H239-Q293 PolarHBondContact CE1-O 2.99Å; H239-Q293 PolarHBondContact NE2-O 2.79Å; H239-F302 AromaticContact CE1-CE1 3.8Å; H239-F302 AromaticContact CE1-CZ 3.92Å
240	K	89.6	Confident	90.7	Very high	107 Å²	107	31.4 Å²	31.4	47%	0.465	17%	0.174	S	C	.	.	H	α-helix	trans	-64.2	-45.3	177.2	-170.1	175.7	-175.3	-78.7	0	111.8	G237 G238 I242 L243 E244 I426	G237-K240 PolarHBondContact O-N 3.29Å; G238-K240 VanDerWaalsContact C-N 3.27Å; G238-K240 PolarHBondContact O-N 3.06Å; K240-I242 VanDerWaalsContact C-N 3.28Å; K240-I242 PolarHBondContact O-N 3.41Å; K240-L243 PolarHBondContact O-N 3.48Å; K240-E244 IonicContact NZ-OE1 2.79Å; K240-E244 PolarHBondContact NZ-OE1 2.97Å; K240-E244 WeakPolarHBondContact O-CG 3.42Å; K240-E244 PolarHBondContact O-N 3.23Å; K240-I426 HydrophobicContact CG-CD1 3.95Å
241	K	90.5	Very high	90.5	Very high	77 Å²	77	40.2 Å²	40.2	34%	0.335	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-31.5	178.4	-69.2	-176.6	171.7	178.9	0	112.6	L201 G238 A245	L201-K241 PolarHBondContact O-NZ 3.44Å; G238-K241 PolarHBondContact O-N 2.95Å; K241-A245 VanDerWaalsContact O-CB 3.26Å; K241-A245 WeakPolarHBondContact O-CB 3.34Å; K241-A245 PolarHBondContact O-N 2.95Å
242	I	94.6	Very high	90.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-41.3	174.2	-67.5	-68	0	0	0	111.5	I207 M229 V232 G238 H239 K240 A245 M246 F286 V290	I207-I242 HydrophobicContact CG2-CD1 3.65Å; M229-I242 HydrophobicContact CB-CD1 3.75Å; M229-I242 HydrophobicContact CE-CD1 3.95Å; M229-I242 HydrophobicContact CE-CG2 4.22Å; M229-I242 HydrophobicContact CG-CD1 3.85Å; M229-I242 WeakPolarHBondContact O-CD1 3.2Å; V232-I242 HydrophobicContact CB-CD1 4.03Å; V232-I242 HydrophobicContact CB-CG1 4.12Å; V232-I242 HydrophobicContact CG1-CD1 3.85Å; V232-I242 HydrophobicContact CG1-CG1 3.66Å; G238-I242 WeakPolarHBondContact O-CG1 3.45Å; G238-I242 PolarHBondContact O-N 3.17Å; H239-I242 PolarHBondContact O-N 3.33Å; K240-I242 VanDerWaalsContact C-N 3.28Å; K240-I242 PolarHBondContact O-N 3.41Å; I242-A245 PolarHBondContact O-N 3.1Å; I242-M246 WeakPolarHBondContact O-CG 3.45Å; I242-M246 PolarHBondContact O-N 3.33Å; I242-F286 HydrophobicContact CG2-CE2 3.69Å; I242-F286 HydrophobicContact CG2-CZ 3.87Å; I242-V290 HydrophobicContact CG2-CG2 4.18Å
243	L	92.3	Very high	90.3	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-40	175.6	-66.2	170	0	0	0	111.9	H239 K240 M246 L247 F259 V290 F302 L306 I426	H239-L243 PolarHBondContact O-N 2.91Å; K240-L243 PolarHBondContact O-N 3.48Å; L243-M246 PolarHBondContact O-N 2.96Å; L243-L247 PolarHBondContact O-N 3.25Å; L243-F259 HydrophobicContact CD2-CZ 4.16Å; L243-V290 HydrophobicContact CD2-CG1 4.11Å; L243-F302 HydrophobicContact CD1-CE2 4.44Å; L243-F302 HydrophobicContact CD1-CZ 3.73Å; L243-L306 HydrophobicContact CD2-CD1 4.23Å; L243-L306 HydrophobicContact CD2-CD2 4.41Å; L243-I426 HydrophobicContact CB-CD1 4.23Å
244	E	90.7	Very high	90.1	Very high	63 Å²	63	52.1 Å²	52.1	29%	0.294	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-44.4	171.3	-70.7	168	166.9	0	0	111.8	K240 L247 H248 I426	K240-E244 IonicContact NZ-OE1 2.79Å; K240-E244 PolarHBondContact NZ-OE1 2.97Å; K240-E244 WeakPolarHBondContact O-CG 3.42Å; K240-E244 PolarHBondContact O-N 3.23Å; E244-L247 WeakPolarHBondContact O-CB 3.4Å; E244-L247 PolarHBondContact O-N 3.1Å; E244-H248 PolarHBondContact O-N 3.41Å; E244-I426 HydrophobicContact CG-CB 4.44Å; E244-I426 HydrophobicContact CG-CD1 3.73Å; E244-I426 HydrophobicContact CG-CG1 3.74Å
245	A	93.4	Very high	90	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67	-35.1	177.4	0	0	0	0	0	113	I207 N208 A211 K241 I242 H248 Y249	I207-A245 HydrophobicContact CB-CB 4.33Å; I207-A245 HydrophobicContact CG2-CB 3.71Å; N208-A245 VanDerWaalsContact OD1-CA 3.32Å; N208-A245 WeakPolarHBondContact OD1-CA 3.39Å; N208-A245 WeakPolarHBondContact OD1-CB 3.33Å; A211-A245 HydrophobicContact CB-CB 4.07Å; K241-A245 VanDerWaalsContact O-CB 3.26Å; K241-A245 WeakPolarHBondContact O-CB 3.34Å; K241-A245 PolarHBondContact O-N 2.95Å; I242-A245 PolarHBondContact O-N 3.1Å; A245-H248 WeakPolarHBondContact O-CB 3.49Å; A245-H248 PolarHBondContact O-N 3.04Å; A245-Y249 VanDerWaalsContact O-CB 3.3Å; A245-Y249 WeakPolarHBondContact O-CB 3.38Å; A245-Y249 PolarHBondContact O-N 2.95Å
246	M	94.3	Very high	89.8	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-71.2	-32.2	172.8	-65.9	-53.6	-53.8	0	0	112.2	L214 M229 I242 L243 Y249 Q250 R258 F259 L262 F286	L214-M246 HydrophobicContact CD1-CE 4.16Å; L214-M246 HydrophobicContact CD1-SD 4.15Å; M229-M246 HydrophobicContact CE-CG 4.22Å; M229-M246 HydrophobicContact CE-SD 3.53Å; M229-M246 VanDerWaalsContact CE-SD 3.53Å; I242-M246 WeakPolarHBondContact O-CG 3.45Å; I242-M246 PolarHBondContact O-N 3.33Å; L243-M246 PolarHBondContact O-N 2.96Å; M246-Y249 HydrophobicContact CE-CD1 3.79Å; M246-Y249 HydrophobicContact CE-CG 4.38Å; M246-Y249 PolarHBondContact O-N 3.27Å; M246-Q250 PolarHBondContact O-N 3.07Å; M246-R258 HydrophobicContact CB-CB 4.16Å; M246-R258 WeakPolarHBondContact CE-O 3.34Å; M246-R258 WeakPolarHBondContact O-CB 3.15Å; M246-F259 HydrophobicContact CB-CE1 4.17Å; M246-F259 HydrophobicContact CE-CD1 4.26Å; M246-F259 HydrophobicContact CG-CE1 3.99Å; M246-L262 HydrophobicContact CE-CD1 3.96Å; M246-L262 HydrophobicContact CE-CG 4.49Å; M246-F286 HydrophobicContact CG-CZ 4.26Å; M246-F286 HydrophobicContact SD-CZ 4.28Å
247	L	89.6	Confident	90	Very high	29 Å²	29	54 Å²	54	15%	0.152	27%	0.268	C	S	.	.	H	α-helix	trans	-66.5	-37.1	169.2	-86.7	150.7	0	0	0	112.4	L243 E244 I426	L243-L247 PolarHBondContact O-N 3.25Å; E244-L247 WeakPolarHBondContact O-CB 3.4Å; E244-L247 PolarHBondContact O-N 3.1Å; L247-I426 HydrophobicContact CD1-CB 3.84Å; L247-I426 HydrophobicContact CD1-CG2 4.38Å; L247-I426 WeakPolarHBondContact CD1-O 3.28Å
248	H	91.3	Very high	90.2	Very high	68 Å²	68	51.5 Å²	51.5	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-66.2	-48	171.2	-174.3	-80.6	0	0	0	111.3	N208 Q212 E244 A245 Q250 R251 F252	N208-H248 HydrophobicContact CB-CB 4.47Å; Q212-H248 PolarHBondContact NE2-CE1 3.48Å; E244-H248 PolarHBondContact O-N 3.41Å; A245-H248 WeakPolarHBondContact O-CB 3.49Å; A245-H248 PolarHBondContact O-N 3.04Å; H248-Q250 VanDerWaalsContact C-N 3.27Å; H248-Q250 PolarHBondContact O-N 3.44Å; H248-R251 PolarHBondContact O-N 3.23Å; H248-F252 PolarHBondContact O-N 2.88Å
249	Y	93.9	Very high	90.5	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-39.5	176.3	-178.6	-101.9	0	0	0	111.9	A211 L214 A215 A245 M246 R251 F252 A253 E255	A211-Y249 WeakPolarHBondContact O-CD2 3.4Å; A211-Y249 WeakPolarHBondContact O-CE2 3.23Å; L214-Y249 HydrophobicContact CB-CE2 3.83Å; A215-Y249 HydrophobicContact CB-CE2 4.31Å; A245-Y249 VanDerWaalsContact O-CB 3.3Å; A245-Y249 WeakPolarHBondContact O-CB 3.38Å; A245-Y249 PolarHBondContact O-N 2.95Å; M246-Y249 HydrophobicContact CE-CD1 3.79Å; M246-Y249 HydrophobicContact CE-CG 4.38Å; M246-Y249 PolarHBondContact O-N 3.27Å; Y249-R251 VanDerWaalsContact C-N 3.29Å; Y249-R251 PolarHBondContact O-N 3.44Å; Y249-F252 HydrophobicContact CD2-CD1 4.24Å; Y249-F252 HydrophobicContact CE2-CD1 4.26Å; Y249-F252 PolarHBondContact O-N 3.17Å; Y249-F252 VanDerWaalsContact O-N 3.17Å; Y249-A253 HydrophobicContact CD1-CB 4.47Å; Y249-A253 HydrophobicContact CE1-CB 3.97Å; Y249-A253 HydrophobicContact CE2-CB 4.17Å; Y249-A253 WeakPolarHBondContact O-CB 3.32Å; Y249-A253 PolarHBondContact O-N 3.24Å; Y249-E255 WeakPolarHBondContact CE1-OE1 3.47Å
250	Q	91.6	Very high	90.6	Very high	45 Å²	45	53.7 Å²	53.7	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-44.8	174.3	-166.2	-169.7	-38.2	0	0	112.2	M246 H248 C254 E255 R256 R258	M246-Q250 PolarHBondContact O-N 3.07Å; H248-Q250 VanDerWaalsContact C-N 3.27Å; H248-Q250 PolarHBondContact O-N 3.44Å; Q250-C254 PolarHBondContact O-N 3.26Å; Q250-E255 HydrophobicContact CG-CB 3.96Å; Q250-E255 WeakPolarHBondContact CG-O 3.37Å; Q250-E255 PolarHBondContact NE2-O 3.46Å; Q250-E255 PolarHBondContact O-N 3.4Å; Q250-R256 PolarHBondContact NE2-O 3.17Å; Q250-R256 VanDerWaalsContact NE2-O 3.09Å; Q250-R258 HydrophobicContact CB-CB 4.15Å
251	R	88.8	Confident	90.7	Very high	186 Å²	186	50.1 Å²	50.1	70%	0.702	24%	0.238	S	C	*	.	H	α-helix	trans	-69.3	-39.7	179.2	-62.8	179.2	-176.1	-176.2	1.8	111.4	H248 Y249	H248-R251 PolarHBondContact O-N 3.23Å; Y249-R251 VanDerWaalsContact C-N 3.29Å; Y249-R251 PolarHBondContact O-N 3.44Å
252	F	91.6	Very high	90.9	Very high	103 Å²	103	46.8 Å²	46.8	45%	0.452	22%	0.224	S	C	.	.	H	α-helix	trans	-65.8	-50.8	178.7	173.2	-97.4	0	0	0	112.8	Q212 A215 H248 Y249 C254	Q212-F252 HydrophobicContact CB-CD1 4.25Å; Q212-F252 HydrophobicContact CB-CE1 3.92Å; Q212-F252 HydrophobicContact CB-CE2 4.41Å; Q212-F252 HydrophobicContact CB-CZ 4.01Å; Q212-F252 HydrophobicContact CG-CB 4.36Å; Q212-F252 HydrophobicContact CG-CD1 3.79Å; Q212-F252 HydrophobicContact CG-CD2 3.83Å; Q212-F252 HydrophobicContact CG-CE1 3.92Å; Q212-F252 HydrophobicContact CG-CE2 3.96Å; Q212-F252 HydrophobicContact CG-CG 3.75Å; Q212-F252 HydrophobicContact CG-CZ 4Å; A215-F252 HydrophobicContact CB-CE1 4.01Å; H248-F252 PolarHBondContact O-N 2.88Å; Y249-F252 HydrophobicContact CD2-CD1 4.24Å; Y249-F252 HydrophobicContact CE2-CD1 4.26Å; Y249-F252 PolarHBondContact O-N 3.17Å; Y249-F252 VanDerWaalsContact O-N 3.17Å; F252-C254 PolarHBondContact O-N 3.47Å
253	A	90.4	Very high	90.9	Very high	35 Å²	35	47 Å²	47	29%	0.289	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4	-179.8	0	0	0	0	0	113.7	Y249 E255	Y249-A253 HydrophobicContact CD1-CB 4.47Å; Y249-A253 HydrophobicContact CE1-CB 3.97Å; Y249-A253 HydrophobicContact CE2-CB 4.17Å; Y249-A253 WeakPolarHBondContact O-CB 3.32Å; Y249-A253 PolarHBondContact O-N 3.24Å; A253-E255 HydrophobicContact CB-CG 3.95Å; A253-E255 WeakPolarHBondContact CB-OE1 3.44Å; A253-E255 PolarHBondContact O-N 3.24Å
254	C	88.3	Confident	90.9	Very high	115 Å²	115	50.8 Å²	50.8	78%	0.777	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	31.8	-175.3	-65.7	0	0	0	0	113.9	Q250 F252	Q250-C254 PolarHBondContact O-N 3.26Å; F252-C254 PolarHBondContact O-N 3.47Å
255	E	87	Confident	90.9	Very high	21 Å²	21	48.3 Å²	48.3	10%	0.098	23%	0.234	C	C	.	.			trans	-78.1	147.8	-175.7	-77	178.1	-144.2	0	0	112.7	Y249 Q250 A253 T257 Q260 T261	Y249-E255 WeakPolarHBondContact CE1-OE1 3.47Å; Q250-E255 HydrophobicContact CG-CB 3.96Å; Q250-E255 WeakPolarHBondContact CG-O 3.37Å; Q250-E255 PolarHBondContact NE2-O 3.46Å; Q250-E255 PolarHBondContact O-N 3.4Å; A253-E255 HydrophobicContact CB-CG 3.95Å; A253-E255 WeakPolarHBondContact CB-OE1 3.44Å; A253-E255 PolarHBondContact O-N 3.24Å; E255-T257 VanDerWaalsContact C-N 3.26Å; E255-T257 PolarHBondContact O-N 3.06Å; E255-Q260 HydrophobicContact CB-CB 4.37Å; E255-Q260 HydrophobicContact CG-CB 4.26Å; E255-Q260 WeakPolarHBondContact OE2-CA 3.32Å; E255-Q260 VanDerWaalsContact OE2-CB 3.31Å; E255-Q260 WeakPolarHBondContact OE2-CB 3.46Å; E255-Q260 PolarHBondContact OE2-N 2.82Å; E255-Q260 VanDerWaalsContact OE2-N 3.08Å; E255-T261 VanDerWaalsContact CD-OG1 3.24Å; E255-T261 WeakPolarHBondContact OE1-CB 3.12Å; E255-T261 PolarHBondContact OE1-OG1 3.42Å; E255-T261 PolarHBondContact OE2-N 3.39Å
256	R	82.4	Confident	90.9	Very high	177 Å²	177	48.4 Å²	48.4	67%	0.668	23%	0.234	S	C	*	.	S	Bend	trans	-67.6	-27.9	177.5	-172.8	176.6	175.7	-156.6	-5.6	112.9	Q250	Q250-R256 PolarHBondContact NE2-O 3.17Å; Q250-R256 VanDerWaalsContact NE2-O 3.09Å
257	T	85.4	Confident	90.8	Very high	32 Å²	32	51.6 Å²	51.6	20%	0.196	25%	0.252	C	S	.	.	S	Bend	trans	-154.7	143.3	-176.9	49.1	0	0	0	0	109.5	E255 F259 Q260	E255-T257 VanDerWaalsContact C-N 3.26Å; E255-T257 PolarHBondContact O-N 3.06Å; T257-F259 PolarHBondContact O-N 3.32Å; T257-Q260 PolarHBondContact O-N 3.37Å; T257-Q260 VanDerWaalsContact O-N 3.11Å
258	R	89	Confident	90.8	Very high	6 Å²	6	53.5 Å²	53.5	2%	0.023	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-5.1	-170.1	65.5	177	169.3	-164.7	-7.2	119.3	M246 Q250 E309 D425	M246-R258 HydrophobicContact CB-CB 4.16Å; M246-R258 WeakPolarHBondContact CE-O 3.34Å; M246-R258 WeakPolarHBondContact O-CB 3.15Å; Q250-R258 HydrophobicContact CB-CB 4.15Å; R258-E309 IonicContact CZ-OE1 2.68Å; R258-E309 VanDerWaalsContact CZ-OE1 3.23Å; R258-E309 IonicContact NE-OE1 2.69Å; R258-E309 PolarHBondContact NE-OE1 2.97Å; R258-E309 IonicContact NE-OE2 3.46Å; R258-E309 IonicContact NH2-OE1 3.3Å; R258-E309 PolarHBondContact NH2-OE1 3.15Å; R258-D425 IonicContact CZ-OD1 3.18Å; R258-D425 IonicContact CZ-OD2 2.73Å; R258-D425 IonicContact NH1-OD1 3.76Å; R258-D425 PolarHBondContact NH1-OD1 3.45Å; R258-D425 IonicContact NH1-OD2 2.67Å; R258-D425 PolarHBondContact NH1-OD2 3.26Å; R258-D425 IonicContact NH2-OD1 2.75Å; R258-D425 PolarHBondContact NH2-OD1 2.94Å; R258-D425 IonicContact NH2-OD2 2.65Å; R258-D425 PolarHBondContact NH2-OD2 3.41Å
259	F	94.5	Very high	90.4	Very high	1 Å²	1	52.7 Å²	52.7	0%	0.004	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126	11.1	-180	-55.7	-59.2	0	0	0	113.8	L243 M246 T257 T261 L262 I263 V290 L306 E309 F310 L313	L243-F259 HydrophobicContact CD2-CZ 4.16Å; M246-F259 HydrophobicContact CB-CE1 4.17Å; M246-F259 HydrophobicContact CE-CD1 4.26Å; M246-F259 HydrophobicContact CG-CE1 3.99Å; T257-F259 PolarHBondContact O-N 3.32Å; F259-T261 PolarHBondContact O-N 3.42Å; F259-L262 HydrophobicContact CD1-CD1 4.28Å; F259-L262 PolarHBondContact O-N 3.01Å; F259-I263 PolarHBondContact O-N 3.29Å; F259-V290 HydrophobicContact CZ-CG1 4.31Å; F259-L306 HydrophobicContact CE2-CD1 3.73Å; F259-L306 HydrophobicContact CZ-CD1 4Å; F259-E309 HydrophobicContact CD2-CB 4.37Å; F259-E309 WeakPolarHBondContact CE2-OE1 3.45Å; F259-F310 HydrophobicContact CB-CD1 4.19Å; F259-F310 HydrophobicContact CB-CE1 3.72Å; F259-F310 AromaticContact CD1-CE1 3.87Å; F259-F310 HydrophobicContact CD1-CE1 3.87Å; F259-F310 HydrophobicContact CD1-CZ 4.05Å; F259-F310 HydrophobicContact CD2-CD1 4.21Å; F259-F310 AromaticContact CD2-CE1 3.57Å; F259-F310 HydrophobicContact CD2-CE1 3.57Å; F259-F310 HydrophobicContact CD2-CE2 4.47Å; F259-F310 AromaticContact CD2-CZ 3.72Å; F259-F310 HydrophobicContact CD2-CZ 3.72Å; F259-F310 HydrophobicContact CE1-CE1 4.35Å; F259-F310 HydrophobicContact CE1-CZ 4.05Å; F259-F310 HydrophobicContact CE2-CE1 4.1Å; F259-F310 HydrophobicContact CE2-CE2 4.3Å; F259-F310 AromaticContact CE2-CZ 3.73Å; F259-F310 HydrophobicContact CE2-CZ 3.73Å; F259-F310 HydrophobicContact CG-CD1 4.27Å; F259-F310 AromaticContact CG-CE1 3.45Å; F259-F310 HydrophobicContact CG-CE1 3.45Å; F259-F310 VanDerWaalsContact CG-CE1 3.45Å; F259-F310 AromaticContact CG-CZ 3.89Å; F259-F310 HydrophobicContact CG-CZ 3.89Å; F259-F310 HydrophobicContact CZ-CE1 4.46Å; F259-F310 AromaticContact CZ-CZ 3.91Å; F259-F310 HydrophobicContact CZ-CZ 3.91Å; F259-L313 HydrophobicContact CB-CD1 3.71Å
260	Q	92.8	Very high	89.6	Confident	55 Å²	55	56.9 Å²	56.9	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-62.7	-47.7	-171	179.1	73.5	79.5	0	0	111.9	E255 T257 L262 I263 N264 L313	E255-Q260 HydrophobicContact CB-CB 4.37Å; E255-Q260 HydrophobicContact CG-CB 4.26Å; E255-Q260 WeakPolarHBondContact OE2-CA 3.32Å; E255-Q260 VanDerWaalsContact OE2-CB 3.31Å; E255-Q260 WeakPolarHBondContact OE2-CB 3.46Å; E255-Q260 PolarHBondContact OE2-N 2.82Å; E255-Q260 VanDerWaalsContact OE2-N 3.08Å; T257-Q260 PolarHBondContact O-N 3.37Å; T257-Q260 VanDerWaalsContact O-N 3.11Å; Q260-L262 VanDerWaalsContact C-N 3.35Å; Q260-L262 PolarHBondContact O-N 2.66Å; Q260-I263 PolarHBondContact O-N 2.97Å; Q260-N264 PolarHBondContact NE2-OD1 2.85Å; Q260-N264 PolarHBondContact O-N 3.15Å; Q260-N264 PolarHBondContact O-ND2 3.07Å; Q260-N264 PolarHBondContact O-OD1 2.88Å; Q260-L313 HydrophobicContact CB-CD2 4.26Å
261	T	91.8	Very high	89	Confident	33 Å²	33	58 Å²	58	20%	0.202	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-37.1	178.7	-71.9	0	0	0	0	112.5	E255 F259 I263 N264 E265	E255-T261 VanDerWaalsContact CD-OG1 3.24Å; E255-T261 WeakPolarHBondContact OE1-CB 3.12Å; E255-T261 PolarHBondContact OE1-OG1 3.42Å; E255-T261 PolarHBondContact OE2-N 3.39Å; F259-T261 PolarHBondContact O-N 3.42Å; T261-I263 VanDerWaalsContact C-N 3.34Å; T261-I263 PolarHBondContact O-N 2.85Å; T261-N264 PolarHBondContact O-N 3.42Å; T261-E265 HydrophobicContact CG2-CG 3.99Å; T261-E265 WeakPolarHBondContact O-CB 3.46Å; T261-E265 VanDerWaalsContact O-CG 3.26Å; T261-E265 WeakPolarHBondContact O-CG 3.31Å; T261-E265 PolarHBondContact O-N 2.87Å
262	L	94.3	Very high	88.3	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-40.7	179	-64.6	-178.4	0	0	0	112.2	L214 L226 M246 F259 Q260 L266 I283 F286	L214-L262 HydrophobicContact CD1-CD2 4.19Å; L214-L262 HydrophobicContact CD2-CD2 4.32Å; L226-L262 HydrophobicContact CD2-CD2 3.99Å; M246-L262 HydrophobicContact CE-CD1 3.96Å; M246-L262 HydrophobicContact CE-CG 4.49Å; F259-L262 HydrophobicContact CD1-CD1 4.28Å; F259-L262 PolarHBondContact O-N 3.01Å; Q260-L262 VanDerWaalsContact C-N 3.35Å; Q260-L262 PolarHBondContact O-N 2.66Å; L262-L266 WeakPolarHBondContact O-CB 3.22Å; L262-L266 PolarHBondContact O-N 2.88Å; L262-L266 VanDerWaalsContact O-N 3.08Å; L262-I283 HydrophobicContact CB-CG2 4.44Å; L262-F286 HydrophobicContact CD1-CD1 3.83Å; L262-F286 HydrophobicContact CD1-CE1 3.51Å
263	I	95.2	Very high	87.6	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-75.5	-34.3	176.9	-58.1	-55.4	0	0	0	111.8	F259 Q260 T261 L266 D267 I287 F310 L313 I315	F259-I263 PolarHBondContact O-N 3.29Å; Q260-I263 PolarHBondContact O-N 2.97Å; T261-I263 VanDerWaalsContact C-N 3.34Å; T261-I263 PolarHBondContact O-N 2.85Å; I263-L266 HydrophobicContact CD1-CD2 4.29Å; I263-L266 PolarHBondContact O-N 2.96Å; I263-D267 PolarHBondContact O-N 2.94Å; I263-D267 VanDerWaalsContact O-N 3.11Å; I263-I287 HydrophobicContact CD1-CD1 3.85Å; I263-F310 HydrophobicContact CD1-CD1 4.01Å; I263-F310 HydrophobicContact CG1-CD1 4.3Å; I263-L313 HydrophobicContact CB-CB 4.19Å; I263-L313 HydrophobicContact CG1-CB 3.97Å; I263-L313 HydrophobicContact CG1-CD1 3.93Å; I263-L313 HydrophobicContact CG2-CB 4.13Å; I263-I315 HydrophobicContact CD1-CB 4.27Å; I263-I315 HydrophobicContact CD1-CD1 3.8Å; I263-I315 HydrophobicContact CD1-CG1 3.97Å
264	N	92.6	Very high	86.6	Confident	81 Å²	81	57.7 Å²	57.7	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-59	-48.8	172.2	-66.5	-8.6	0	0	0	111.4	Q260 T261 L266 D267 R268	Q260-N264 PolarHBondContact NE2-OD1 2.85Å; Q260-N264 PolarHBondContact O-N 3.15Å; Q260-N264 PolarHBondContact O-ND2 3.07Å; Q260-N264 PolarHBondContact O-OD1 2.88Å; T261-N264 PolarHBondContact O-N 3.42Å; N264-L266 VanDerWaalsContact C-N 3.32Å; N264-L266 PolarHBondContact O-N 3.4Å; N264-D267 PolarHBondContact O-N 3.41Å; N264-R268 WeakPolarHBondContact O-CB 3.45Å; N264-R268 PolarHBondContact O-N 2.94Å
265	E	91.1	Very high	85.8	Confident	11 Å²	11	57.4 Å²	57.4	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-31.6	179.3	-69.2	-69.9	92.7	0	0	112.8	K222 T261 R268 Y273 K280 I283	K222-E265 IonicContact NZ-OE2 2.62Å; K222-E265 PolarHBondContact NZ-OE2 3.44Å; T261-E265 HydrophobicContact CG2-CG 3.99Å; T261-E265 WeakPolarHBondContact O-CB 3.46Å; T261-E265 VanDerWaalsContact O-CG 3.26Å; T261-E265 WeakPolarHBondContact O-CG 3.31Å; T261-E265 PolarHBondContact O-N 2.87Å; E265-R268 WeakPolarHBondContact OE1-CD 3.37Å; E265-R268 IonicContact OE1-CZ 2.68Å; E265-R268 IonicContact OE1-NE 3.15Å; E265-R268 IonicContact OE1-NH1 2.66Å; E265-R268 PolarHBondContact OE1-NH1 2.96Å; E265-R268 IonicContact OE2-NH1 2.68Å; E265-Y273 WeakPolarHBondContact OE2-CE1 3.45Å; E265-K280 PolarHBondContact O-NZ 3.01Å; E265-I283 HydrophobicContact CB-CD1 3.99Å
266	L	93.1	Very high	85.6	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-45.3	174.6	-168.7	63.7	0	0	0	111.3	L262 I263 N264 K280 I283 M284 I315 V318 L322	L262-L266 WeakPolarHBondContact O-CB 3.22Å; L262-L266 PolarHBondContact O-N 2.88Å; L262-L266 VanDerWaalsContact O-N 3.08Å; I263-L266 HydrophobicContact CD1-CD2 4.29Å; I263-L266 PolarHBondContact O-N 2.96Å; N264-L266 VanDerWaalsContact C-N 3.32Å; N264-L266 PolarHBondContact O-N 3.4Å; L266-K280 HydrophobicContact CD1-CB 4.03Å; L266-K280 HydrophobicContact CD1-CG 4.32Å; L266-K280 PolarHBondContact O-NZ 3.2Å; L266-I283 HydrophobicContact CB-CD1 4.36Å; L266-I283 HydrophobicContact CB-CG2 4.25Å; L266-I283 HydrophobicContact CD1-CB 4.1Å; L266-I283 HydrophobicContact CD1-CD1 4.46Å; L266-I283 HydrophobicContact CD1-CG2 4Å; L266-I283 HydrophobicContact CD2-CG2 4.25Å; L266-I283 HydrophobicContact CG-CG2 4.39Å; L266-M284 HydrophobicContact CD1-CG 4.16Å; L266-M284 HydrophobicContact CD2-CG 4.45Å; L266-M284 HydrophobicContact CD2-SD 3.9Å; L266-I315 HydrophobicContact CD2-CD1 4.38Å; L266-I315 HydrophobicContact CD2-CG1 4.18Å; L266-V318 HydrophobicContact CB-CG1 4.2Å; L266-V318 HydrophobicContact CD2-CG1 4.03Å; L266-V318 HydrophobicContact CG-CG1 3.73Å; L266-L322 HydrophobicContact CD1-CD1 3.71Å; L266-L322 HydrophobicContact CD1-CD2 4.38Å; L266-L322 HydrophobicContact CD2-CD1 4.13Å; L266-L322 HydrophobicContact CG-CD1 3.87Å
267	D	92.1	Very high	85.9	Confident	69 Å²	69	52.9 Å²	52.9	37%	0.369	28%	0.276	S	S	.	.	H	α-helix	trans	-74	-34.1	175.3	-171.5	50.1	0	0	0	113.2	I263 N264 S269 V318 K321	I263-D267 PolarHBondContact O-N 2.94Å; I263-D267 VanDerWaalsContact O-N 3.11Å; N264-D267 PolarHBondContact O-N 3.41Å; D267-S269 PolarHBondContact O-N 2.99Å; D267-V318 HydrophobicContact CB-CG1 3.98Å; D267-V318 HydrophobicContact CB-CG2 3.76Å; D267-K321 PolarHBondContact O-NZ 3.12Å; D267-K321 VanDerWaalsContact OD1-CD 3.22Å; D267-K321 WeakPolarHBondContact OD1-CD 3.28Å; D267-K321 IonicContact OD1-NZ 2.6Å; D267-K321 PolarHBondContact OD1-NZ 2.79Å; D267-K321 IonicContact OD2-NZ 2.79Å
268	R	89.8	Confident	86.1	Confident	69 Å²	69	53.2 Å²	53.2	26%	0.26	28%	0.28	S	S	.	.			trans	-46.9	112.1	-173.7	-167.9	172.7	-178.5	177.5	-3.8	111.4	E217 N264 E265 Y273 K280	E217-R268 VanDerWaalsContact CD-NH2 3.28Å; E217-R268 IonicContact OE1-CZ 2.81Å; E217-R268 VanDerWaalsContact OE1-CZ 3.29Å; E217-R268 IonicContact OE1-NH1 3.43Å; E217-R268 PolarHBondContact OE1-NH1 2.94Å; E217-R268 IonicContact OE1-NH2 2.63Å; E217-R268 PolarHBondContact OE1-NH2 3.28Å; E217-R268 IonicContact OE2-CZ 3.58Å; E217-R268 IonicContact OE2-NH1 2.65Å; E217-R268 PolarHBondContact OE2-NH1 3.07Å; E217-R268 IonicContact OE2-NH2 3.61Å; E217-R268 PolarHBondContact OE2-NH2 3.02Å; N264-R268 WeakPolarHBondContact O-CB 3.45Å; N264-R268 PolarHBondContact O-N 2.94Å; E265-R268 WeakPolarHBondContact OE1-CD 3.37Å; E265-R268 IonicContact OE1-CZ 2.68Å; E265-R268 IonicContact OE1-NE 3.15Å; E265-R268 IonicContact OE1-NH1 2.66Å; E265-R268 PolarHBondContact OE1-NH1 2.96Å; E265-R268 IonicContact OE2-NH1 2.68Å; R268-Y273 HydrophobicContact CG-CD2 4.21Å; R268-Y273 HydrophobicContact CG-CG 4.1Å; R268-K280 PolarHBondContact O-NZ 2.96Å
269	S	82.7	Confident	86.3	Confident	51 Å²	51	53 Å²	53	36%	0.357	28%	0.279	S	S	.	.			trans	-124	33.9	-175.6	62.2	0	0	0	0	112	D267 K321	D267-S269 PolarHBondContact O-N 2.99Å; S269-K321 PolarHBondContact OG-NZ 3.44Å; S269-K321 VanDerWaalsContact OG-NZ 3.09Å
270	T	77.7	Confident	86.2	Confident	92 Å²	92	53.2 Å²	53.2	56%	0.564	28%	0.28	S	S	*	.	S	Bend	trans	-129.8	149.8	-176.8	54.8	0	0	0	0	110.9	Y273	T270-Y273 PolarHBondContact O-N 3.37Å
271	G	77.5	Confident	86.3	Confident	69 Å²	69	50.8 Å²	50.8	71%	0.711	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	58.2	-141.7	-175.3	0	0	0	0	0	112.3	Y273 R274	G271-Y273 PolarHBondContact O-N 3.34Å; G271-Y273 VanDerWaalsContact O-N 3.16Å; G271-R274 PolarHBondContact O-N 2.91Å
272	R	74.1	Confident	86.4	Confident	168 Å²	168	49.4 Å²	49.4	63%	0.634	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-60.5	-23.3	-178.4	-60.1	-168.3	-65.6	-146	5.5	113.8	E217 I219 R274 E276	E217-R272 PolarHBondContact O-NH2 2.98Å; I219-R272 HydrophobicContact CD1-CB 4.08Å; R272-R274 VanDerWaalsContact C-N 3.33Å; R272-R274 PolarHBondContact O-N 2.68Å; R272-E276 VanDerWaalsContact O-CG 3.27Å; R272-E276 WeakPolarHBondContact O-CG 3.29Å
273	Y	77.4	Confident	86.5	Confident	6 Å²	6	49.1 Å²	49.1	2%	0.024	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-80.7	-8.8	-174.8	-59.8	-88.9	0	0	0	114.7	E217 I219 E265 R268 T270 G271 D275 L279 K280	E217-Y273 WeakPolarHBondContact CA-OH 3.33Å; E217-Y273 VanDerWaalsContact CD-OH 3.25Å; E217-Y273 PolarHBondContact O-OH 3.38Å; E217-Y273 WeakPolarHBondContact OE2-CE2 3.35Å; E217-Y273 VanDerWaalsContact OE2-CZ 3.3Å; E217-Y273 PolarHBondContact OE2-OH 3.5Å; I219-Y273 HydrophobicContact CD1-CD1 3.85Å; I219-Y273 HydrophobicContact CD1-CE1 3.82Å; I219-Y273 HydrophobicContact CD1-CG 4.34Å; I219-Y273 HydrophobicContact CG1-CD1 4.15Å; I219-Y273 HydrophobicContact CG1-CE1 3.64Å; E265-Y273 WeakPolarHBondContact OE2-CE1 3.45Å; R268-Y273 HydrophobicContact CG-CD2 4.21Å; R268-Y273 HydrophobicContact CG-CG 4.1Å; T270-Y273 PolarHBondContact O-N 3.37Å; G271-Y273 PolarHBondContact O-N 3.34Å; G271-Y273 VanDerWaalsContact O-N 3.16Å; Y273-D275 PolarHBondContact O-N 3.48Å; Y273-L279 HydrophobicContact CD1-CD2 3.91Å; Y273-L279 HydrophobicContact CE1-CD2 3.87Å; Y273-K280 WeakPolarHBondContact O-CE 3.49Å
274	R	70.5	Confident	86.5	Confident	143 Å²	143	48.9 Å²	48.9	54%	0.54	26%	0.258	S	S	.	.	S	Bend	trans	-62.1	-44.2	-174.4	-178.3	179.6	171.3	-79.7	-7.4	113.1	G271 R272	G271-R274 PolarHBondContact O-N 2.91Å; R272-R274 VanDerWaalsContact C-N 3.33Å; R272-R274 PolarHBondContact O-N 2.68Å
275	D	70.1	Confident	86.7	Confident	108 Å²	108	45.2 Å²	45.2	58%	0.578	24%	0.239	S	C	*	.	S	Bend	trans	-115.4	4.2	-171.3	-55.3	-82.3	0	0	0	112	Y273 V277	Y273-D275 PolarHBondContact O-N 3.48Å; D275-V277 PolarHBondContact O-N 3.33Å
276	E	83.6	Confident	86.9	Confident	77 Å²	77	44.8 Å²	44.8	36%	0.36	24%	0.236	S	C	.	.			trans	-82.7	78.5	-178.8	-84.6	-76.2	-166	0	0	112.4	I219 R272 S278	I219-E276 HydrophobicContact CD1-CB 4.22Å; I219-E276 HydrophobicContact CD1-CG 3.84Å; R272-E276 VanDerWaalsContact O-CG 3.27Å; R272-E276 WeakPolarHBondContact O-CG 3.29Å; E276-S278 PolarHBondContact O-N 3.44Å; E276-S278 PolarHBondContact OE2-OG 2.97Å
277	V	88.3	Confident	87.1	Confident	27 Å²	27	44.7 Å²	44.7	16%	0.164	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-23.1	175.4	-177.4	0	0	0	0	112.2	D275 K280 T281 H325 N327 L330	D275-V277 PolarHBondContact O-N 3.33Å; V277-K280 PolarHBondContact O-N 2.99Å; V277-T281 WeakPolarHBondContact O-CB 3.38Å; V277-T281 PolarHBondContact O-N 3.43Å; V277-T281 PolarHBondContact O-OG1 3.15Å; V277-H325 HydrophobicContact CG2-CB 4.12Å; V277-N327 HydrophobicContact CG1-CB 3.69Å; V277-L330 HydrophobicContact CG1-CB 4.43Å; V277-L330 HydrophobicContact CG1-CD2 4.11Å
278	S	89.8	Confident	87.2	Confident	39 Å²	39	41.4 Å²	41.4	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-54.1	-57.1	179	63.6	0	0	0	0	112.2	E276 T281 A282	E276-S278 PolarHBondContact O-N 3.44Å; E276-S278 PolarHBondContact OE2-OG 2.97Å; S278-T281 PolarHBondContact O-N 3.32Å; S278-A282 PolarHBondContact O-N 2.81Å
279	L	92.8	Very high	87.4	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-40.3	178.7	179.1	59.8	0	0	0	112.2	I219 K222 V223 L226 Y273 T281 A282 I283	I219-L279 HydrophobicContact CG2-CB 4.01Å; I219-L279 HydrophobicContact CG2-CD2 4.32Å; K222-L279 HydrophobicContact CB-CD1 3.61Å; K222-L279 HydrophobicContact CD-CD1 4.37Å; K222-L279 HydrophobicContact CD-CD2 4.23Å; V223-L279 HydrophobicContact CG2-CB 4.14Å; V223-L279 HydrophobicContact CG2-CD1 4.2Å; L226-L279 HydrophobicContact CD1-CD1 3.84Å; Y273-L279 HydrophobicContact CD1-CD2 3.91Å; Y273-L279 HydrophobicContact CE1-CD2 3.87Å; L279-T281 VanDerWaalsContact C-N 3.27Å; L279-T281 PolarHBondContact O-N 3.04Å; L279-A282 PolarHBondContact O-N 3.08Å; L279-I283 HydrophobicContact CD1-CD1 3.99Å; L279-I283 HydrophobicContact CD1-CG1 4.12Å; L279-I283 HydrophobicContact CG-CD1 3.85Å; L279-I283 HydrophobicContact CG-CG1 4.42Å; L279-I283 VanDerWaalsContact O-CG1 3.3Å; L279-I283 WeakPolarHBondContact O-CG1 3.34Å; L279-I283 PolarHBondContact O-N 2.98Å
280	K	93.8	Very high	87.9	Confident	5 Å²	5	35.7 Å²	35.7	2%	0.022	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-34.7	179.3	-61.7	177.2	-174.3	-56.9	0	111.3	E265 L266 R268 Y273 V277 M284 L322	E265-K280 PolarHBondContact O-NZ 3.01Å; L266-K280 HydrophobicContact CD1-CB 4.03Å; L266-K280 HydrophobicContact CD1-CG 4.32Å; L266-K280 PolarHBondContact O-NZ 3.2Å; R268-K280 PolarHBondContact O-NZ 2.96Å; Y273-K280 WeakPolarHBondContact O-CE 3.49Å; V277-K280 PolarHBondContact O-N 2.99Å; K280-M284 PolarHBondContact O-N 3.32Å; K280-M284 VanDerWaalsContact O-N 3.16Å; K280-L322 HydrophobicContact CB-CD2 4.03Å; K280-L322 HydrophobicContact CD-CD2 3.7Å; K280-L322 HydrophobicContact CG-CD2 4.21Å
281	T	94.1	Very high	88.5	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-69.5	-45.8	171.4	-51.6	0	0	0	0	111.6	V277 S278 L279 I283 M284 S285 T329	V277-T281 WeakPolarHBondContact O-CB 3.38Å; V277-T281 PolarHBondContact O-N 3.43Å; V277-T281 PolarHBondContact O-OG1 3.15Å; S278-T281 PolarHBondContact O-N 3.32Å; L279-T281 VanDerWaalsContact C-N 3.27Å; L279-T281 PolarHBondContact O-N 3.04Å; T281-I283 PolarHBondContact O-N 3Å; T281-M284 PolarHBondContact O-N 3Å; T281-S285 WeakPolarHBondContact O-CB 3.43Å; T281-S285 PolarHBondContact O-N 3.5Å; T281-T329 HydrophobicContact CG2-CG2 3.86Å
282	A	94.7	Very high	89	Confident	4 Å²	4	28.5 Å²	28.5	3%	0.033	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-44.2	177.8	0	0	0	0	0	112.4	V223 L226 S278 L279 S285 F286	V223-A282 HydrophobicContact CG1-CB 4.34Å; V223-A282 HydrophobicContact CG2-CB 4.23Å; L226-A282 HydrophobicContact CB-CB 4.06Å; L226-A282 HydrophobicContact CD1-CB 4.11Å; S278-A282 PolarHBondContact O-N 2.81Å; L279-A282 PolarHBondContact O-N 3.08Å; A282-S285 PolarHBondContact O-N 3.35Å; A282-F286 WeakPolarHBondContact O-CB 3.43Å; A282-F286 PolarHBondContact O-N 2.96Å
283	I	96.3	Very high	89.7	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-61.9	-48.2	176	-66.4	165	0	0	0	110.7	L226 L262 E265 L266 L279 T281 S285 F286 I287	L226-I283 HydrophobicContact CD1-CB 4.46Å; L226-I283 HydrophobicContact CD1-CG1 3.52Å; L262-I283 HydrophobicContact CB-CG2 4.44Å; E265-I283 HydrophobicContact CB-CD1 3.99Å; L266-I283 HydrophobicContact CB-CD1 4.36Å; L266-I283 HydrophobicContact CB-CG2 4.25Å; L266-I283 HydrophobicContact CD1-CB 4.1Å; L266-I283 HydrophobicContact CD1-CD1 4.46Å; L266-I283 HydrophobicContact CD1-CG2 4Å; L266-I283 HydrophobicContact CD2-CG2 4.25Å; L266-I283 HydrophobicContact CG-CG2 4.39Å; L279-I283 HydrophobicContact CD1-CD1 3.99Å; L279-I283 HydrophobicContact CD1-CG1 4.12Å; L279-I283 HydrophobicContact CG-CD1 3.85Å; L279-I283 HydrophobicContact CG-CG1 4.42Å; L279-I283 VanDerWaalsContact O-CG1 3.3Å; L279-I283 WeakPolarHBondContact O-CG1 3.34Å; L279-I283 PolarHBondContact O-N 2.98Å; T281-I283 PolarHBondContact O-N 3Å; I283-S285 VanDerWaalsContact C-N 3.3Å; I283-S285 PolarHBondContact O-N 2.85Å; I283-F286 PolarHBondContact O-N 3.17Å; I283-I287 HydrophobicContact CG2-CD1 3.69Å; I283-I287 HydrophobicContact CG2-CG1 4.41Å; I283-I287 VanDerWaalsContact O-CG1 3.28Å; I283-I287 WeakPolarHBondContact O-CG1 3.35Å; I283-I287 PolarHBondContact O-N 3.37Å
284	M	95.4	Very high	90.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.7	-30.1	178.1	-78.4	-56.5	-45.5	0	0	113.2	L266 K280 T281 I287 N288 I315 L322 L330 H333 L334 F337	L266-M284 HydrophobicContact CD1-CG 4.16Å; L266-M284 HydrophobicContact CD2-CG 4.45Å; L266-M284 HydrophobicContact CD2-SD 3.9Å; K280-M284 PolarHBondContact O-N 3.32Å; K280-M284 VanDerWaalsContact O-N 3.16Å; T281-M284 PolarHBondContact O-N 3Å; M284-I287 HydrophobicContact SD-CD1 4.38Å; M284-N288 WeakPolarHBondContact O-CB 3.38Å; M284-N288 VanDerWaalsContact O-CG 3.28Å; M284-N288 PolarHBondContact O-N 3.16Å; M284-N288 PolarHBondContact O-ND2 3.49Å; M284-I315 HydrophobicContact SD-CD1 4.26Å; M284-L322 HydrophobicContact CG-CD1 4.32Å; M284-L330 HydrophobicContact CB-CD1 4.15Å; M284-L330 HydrophobicContact CG-CD1 3.96Å; M284-H333 HydrophobicContact CB-CB 4.02Å; M284-L334 HydrophobicContact CE-CD2 4.07Å; M284-L334 HydrophobicContact CG-CD2 3.89Å; M284-L334 HydrophobicContact SD-CD2 4.07Å; M284-F337 HydrophobicContact CE-CB 3.94Å; M284-F337 HydrophobicContact CE-CD2 4.17Å; M284-F337 HydrophobicContact CE-CG 4.17Å
285	S	94.9	Very high	90.8	Very high	5 Å²	5	18 Å²	18	4%	0.035	11%	0.109	C	C	.	.	H	α-helix	trans	-70.4	-46	174	-167	0	0	0	0	111.4	T281 A282 I283 I287 N288 A289 H333 L1043	T281-S285 WeakPolarHBondContact O-CB 3.43Å; T281-S285 PolarHBondContact O-N 3.5Å; A282-S285 PolarHBondContact O-N 3.35Å; I283-S285 VanDerWaalsContact C-N 3.3Å; I283-S285 PolarHBondContact O-N 2.85Å; S285-I287 PolarHBondContact O-N 3.4Å; S285-N288 PolarHBondContact O-N 3.05Å; S285-A289 PolarHBondContact O-N 3.1Å; S285-H333 VanDerWaalsContact CB-CE1 3.48Å; S285-H333 WeakPolarHBondContact CB-CE1 3.39Å; S285-H333 PolarHBondContact OG-CE1 3.43Å; S285-L1043 WeakPolarHBondContact OG-CD1 3.37Å; S285-L1043 WeakPolarHBondContact OG-CG 3.37Å; S285-L1043 PolarHBondContact OG-O 2.98Å
286	F	96.5	Very high	91.4	Very high	1 Å²	1	12.9 Å²	12.9	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-56.9	-48.7	173.2	173.5	-104.7	0	0	0	112.6	L226 M229 I242 M246 L262 A282 I283 N288 A289 V290	L226-F286 HydrophobicContact CD2-CB 3.86Å; L226-F286 HydrophobicContact CD2-CD1 3.88Å; L226-F286 HydrophobicContact CD2-CD2 4.3Å; L226-F286 HydrophobicContact CD2-CG 3.74Å; M229-F286 HydrophobicContact CB-CD2 3.99Å; M229-F286 HydrophobicContact CB-CE2 3.71Å; M229-F286 HydrophobicContact CE-CE2 4.35Å; M229-F286 HydrophobicContact CE-CZ 4.35Å; I242-F286 HydrophobicContact CG2-CE2 3.69Å; I242-F286 HydrophobicContact CG2-CZ 3.87Å; M246-F286 HydrophobicContact CG-CZ 4.26Å; M246-F286 HydrophobicContact SD-CZ 4.28Å; L262-F286 HydrophobicContact CD1-CD1 3.83Å; L262-F286 HydrophobicContact CD1-CE1 3.51Å; A282-F286 WeakPolarHBondContact O-CB 3.43Å; A282-F286 PolarHBondContact O-N 2.96Å; I283-F286 PolarHBondContact O-N 3.17Å; F286-N288 VanDerWaalsContact C-N 3.29Å; F286-N288 PolarHBondContact O-N 3.19Å; F286-A289 PolarHBondContact O-N 2.67Å; F286-A289 VanDerWaalsContact O-N 3.17Å; F286-V290 HydrophobicContact CD1-CG2 4.38Å; F286-V290 HydrophobicContact CD2-CG2 4.08Å; F286-V290 HydrophobicContact CE1-CG2 3.96Å; F286-V290 HydrophobicContact CE2-CG2 3.61Å; F286-V290 HydrophobicContact CG-CG2 4.45Å; F286-V290 HydrophobicContact CZ-CG2 3.56Å; F286-V290 WeakPolarHBondContact O-CB 3.21Å; F286-V290 WeakPolarHBondContact O-CG2 3.21Å; F286-V290 PolarHBondContact O-N 2.93Å
287	I	96.3	Very high	91.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.2	-42.6	177.5	-71.1	168	0	0	0	111.1	I263 I283 M284 S285 V290 L291 F310 I315 F337	I263-I287 HydrophobicContact CD1-CD1 3.85Å; I283-I287 HydrophobicContact CG2-CD1 3.69Å; I283-I287 HydrophobicContact CG2-CG1 4.41Å; I283-I287 VanDerWaalsContact O-CG1 3.28Å; I283-I287 WeakPolarHBondContact O-CG1 3.35Å; I283-I287 PolarHBondContact O-N 3.37Å; M284-I287 HydrophobicContact SD-CD1 4.38Å; S285-I287 PolarHBondContact O-N 3.4Å; I287-V290 PolarHBondContact O-N 3.47Å; I287-L291 HydrophobicContact CG2-CD1 3.88Å; I287-L291 WeakPolarHBondContact O-CB 3.34Å; I287-L291 VanDerWaalsContact O-CG 3.3Å; I287-L291 WeakPolarHBondContact O-CG 3.34Å; I287-L291 PolarHBondContact O-N 2.97Å; I287-F310 HydrophobicContact CD1-CD1 4.36Å; I287-F310 HydrophobicContact CD1-CE1 4.24Å; I287-F310 HydrophobicContact CG1-CD1 4.4Å; I287-F310 HydrophobicContact CG1-CE1 3.87Å; I287-F310 HydrophobicContact CG1-CZ 4.06Å; I287-F310 HydrophobicContact CG2-CD2 4.19Å; I287-F310 HydrophobicContact CG2-CE1 4.49Å; I287-F310 HydrophobicContact CG2-CE2 4.07Å; I287-F310 HydrophobicContact CG2-CG 4.47Å; I287-F310 HydrophobicContact CG2-CZ 4.23Å; I287-I315 HydrophobicContact CD1-CD1 3.9Å; I287-I315 HydrophobicContact CG2-CD1 4.49Å; I287-F337 HydrophobicContact CG2-CD2 4.09Å; I287-F337 HydrophobicContact CG2-CE2 4.02Å
288	N	94.7	Very high	91.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.6	-36.2	177.9	-76.8	-44.5	0	0	0	112.7	M284 S285 F286 S292 H333 Y336 F337 F1049	M284-N288 WeakPolarHBondContact O-CB 3.38Å; M284-N288 VanDerWaalsContact O-CG 3.28Å; M284-N288 PolarHBondContact O-N 3.16Å; M284-N288 PolarHBondContact O-ND2 3.49Å; S285-N288 PolarHBondContact O-N 3.05Å; F286-N288 VanDerWaalsContact C-N 3.29Å; F286-N288 PolarHBondContact O-N 3.19Å; N288-S292 VanDerWaalsContact O-CB 3.23Å; N288-S292 WeakPolarHBondContact O-CB 3.44Å; N288-S292 PolarHBondContact O-N 3.29Å; N288-S292 PolarHBondContact O-OG 3.35Å; N288-H333 PolarHBondContact ND2-O 3.34Å; N288-Y336 HydrophobicContact CB-CD1 3.96Å; N288-Y336 HydrophobicContact CB-CE1 4.21Å; N288-Y336 WeakPolarHBondContact OD1-CD1 3.44Å; N288-F337 WeakPolarHBondContact OD1-CB 3.36Å; N288-F1049 HydrophobicContact CB-CE1 4.44Å; N288-F1049 HydrophobicContact CB-CE2 4.14Å; N288-F1049 HydrophobicContact CB-CZ 3.84Å
289	A	93.8	Very high	90.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.3	-48.9	172.3	0	0	0	0	0	111.4	C233 L234 S285 F286 L291 S292 Q293 L1043	C233-A289 HydrophobicContact CB-CB 3.99Å; L234-A289 HydrophobicContact CD1-CB 4.25Å; S285-A289 PolarHBondContact O-N 3.1Å; F286-A289 PolarHBondContact O-N 2.67Å; F286-A289 VanDerWaalsContact O-N 3.17Å; A289-L291 VanDerWaalsContact C-N 3.31Å; A289-L291 PolarHBondContact O-N 2.75Å; A289-S292 PolarHBondContact O-N 3.15Å; A289-Q293 WeakPolarHBondContact O-CB 3.39Å; A289-Q293 VanDerWaalsContact O-CG 3.29Å; A289-Q293 WeakPolarHBondContact O-CG 3.36Å; A289-Q293 PolarHBondContact O-N 3.18Å; A289-L1043 HydrophobicContact CB-CD1 4.19Å; A289-L1043 HydrophobicContact CB-CD2 4.36Å
290	V	92.9	Very high	90.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-37	179.2	165.2	0	0	0	0	112.7	H239 I242 L243 F259 F286 I287 L306 F310	H239-V290 PolarHBondContact NE2-O 2.93Å; I242-V290 HydrophobicContact CG2-CG2 4.18Å; L243-V290 HydrophobicContact CD2-CG1 4.11Å; F259-V290 HydrophobicContact CZ-CG1 4.31Å; F286-V290 HydrophobicContact CD1-CG2 4.38Å; F286-V290 HydrophobicContact CD2-CG2 4.08Å; F286-V290 HydrophobicContact CE1-CG2 3.96Å; F286-V290 HydrophobicContact CE2-CG2 3.61Å; F286-V290 HydrophobicContact CG-CG2 4.45Å; F286-V290 HydrophobicContact CZ-CG2 3.56Å; F286-V290 WeakPolarHBondContact O-CB 3.21Å; F286-V290 WeakPolarHBondContact O-CG2 3.21Å; F286-V290 PolarHBondContact O-N 2.93Å; I287-V290 PolarHBondContact O-N 3.47Å; V290-L306 HydrophobicContact CG1-CD1 4.5Å; V290-L306 HydrophobicContact CG1-CD2 3.74Å; V290-L306 HydrophobicContact CG1-CG 4.3Å; V290-L306 WeakPolarHBondContact O-CD2 3.37Å; V290-F310 HydrophobicContact CG1-CZ 4.48Å
291	L	91.8	Very high	90.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-77.7	-24	178.3	-73.4	172.8	0	0	0	114.7	I287 A289 R303 L306 R307 F310 F337 L340	I287-L291 HydrophobicContact CG2-CD1 3.88Å; I287-L291 WeakPolarHBondContact O-CB 3.34Å; I287-L291 VanDerWaalsContact O-CG 3.3Å; I287-L291 WeakPolarHBondContact O-CG 3.34Å; I287-L291 PolarHBondContact O-N 2.97Å; A289-L291 VanDerWaalsContact C-N 3.31Å; A289-L291 PolarHBondContact O-N 2.75Å; L291-R303 WeakPolarHBondContact O-CD 3.18Å; L291-R303 WeakPolarHBondContact O-CG 3.33Å; L291-L306 HydrophobicContact CD2-CB 3.97Å; L291-L306 HydrophobicContact CD2-CD2 4.29Å; L291-L306 HydrophobicContact CD2-CG 3.88Å; L291-R307 HydrophobicContact CD2-CB 3.95Å; L291-F310 HydrophobicContact CD1-CD2 4.29Å; L291-F310 HydrophobicContact CD1-CE2 4.4Å; L291-F310 HydrophobicContact CD2-CD2 4.19Å; L291-F310 HydrophobicContact CD2-CE2 4.05Å; L291-F310 HydrophobicContact CG-CD2 4.4Å; L291-F310 HydrophobicContact CG-CE2 4.1Å; L291-F337 HydrophobicContact CD1-CD2 3.84Å; L291-F337 HydrophobicContact CD1-CE2 3.61Å; L291-L340 HydrophobicContact CB-CD2 4.08Å
292	S	87.6	Confident	89.8	Confident	10 Å²	10	23 Å²	23	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-115.9	-13.3	-164.2	-41.5	0	0	0	0	114.5	N288 A289 Y336 L340	N288-S292 VanDerWaalsContact O-CB 3.23Å; N288-S292 WeakPolarHBondContact O-CB 3.44Å; N288-S292 PolarHBondContact O-N 3.29Å; N288-S292 PolarHBondContact O-OG 3.35Å; A289-S292 PolarHBondContact O-N 3.15Å; S292-Y336 WeakPolarHBondContact CB-OH 3.23Å; S292-Y336 WeakPolarHBondContact OG-CE1 3.28Å; S292-Y336 PolarHBondContact OG-OH 2.97Å; S292-L340 VanDerWaalsContact OG-CD2 3.28Å; S292-L340 WeakPolarHBondContact OG-CD2 3.4Å
293	Q	89.5	Confident	89.6	Confident	42 Å²	42	24.6 Å²	24.6	20%	0.196	14%	0.139	C	C	.	.	S	Bend	trans	-101.4	166	179.5	-58.5	-59.8	-44.1	0	0	111.9	C233 L234 H239 A289 A295 G296	C233-Q293 HydrophobicContact CB-CB 4.29Å; C233-Q293 HydrophobicContact CB-CG 4.32Å; C233-Q293 VanDerWaalsContact O-CB 3.22Å; C233-Q293 WeakPolarHBondContact O-CB 3.42Å; L234-Q293 HydrophobicContact CD1-CG 4.13Å; L234-Q293 HydrophobicContact CG-CG 4.25Å; H239-Q293 PolarHBondContact CD2-O 3.35Å; H239-Q293 PolarHBondContact CE1-O 2.99Å; H239-Q293 PolarHBondContact NE2-O 2.79Å; A289-Q293 WeakPolarHBondContact O-CB 3.39Å; A289-Q293 VanDerWaalsContact O-CG 3.29Å; A289-Q293 WeakPolarHBondContact O-CG 3.36Å; A289-Q293 PolarHBondContact O-N 3.18Å; Q293-A295 PolarHBondContact O-N 3.4Å; Q293-G296 WeakPolarHBondContact O-CA 3.24Å; Q293-G296 PolarHBondContact O-N 2.8Å
294	G	86.6	Confident	89.1	Confident	34 Å²	34	27.2 Å²	27.2	35%	0.351	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-125	172.9	0	0	0	0	0	113.5	G296 E297	G294-G296 PolarHBondContact O-N 2.97Å; G294-E297 PolarHBondContact O-N 3.46Å; G294-E297 VanDerWaalsContact O-N 3.13Å
295	A	83.5	Confident	88.7	Confident	21 Å²	21	28.2 Å²	28.2	17%	0.174	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-25.9	175.7	0	0	0	0	0	112.6	Q293 E297 T298 S299 F302 P424	Q293-A295 PolarHBondContact O-N 3.4Å; A295-E297 VanDerWaalsContact C-N 3.32Å; A295-E297 PolarHBondContact O-N 2.81Å; A295-T298 PolarHBondContact O-N 3.09Å; A295-S299 PolarHBondContact O-N 2.92Å; A295-F302 VanDerWaalsContact C-CD1 3.47Å; A295-F302 HydrophobicContact CB-CD1 3.66Å; A295-F302 HydrophobicContact CB-CD2 4.27Å; A295-F302 HydrophobicContact CB-CE1 3.65Å; A295-F302 HydrophobicContact CB-CE2 4.22Å; A295-F302 HydrophobicContact CB-CG 3.99Å; A295-F302 HydrophobicContact CB-CZ 3.93Å; A295-P424 HydrophobicContact CB-CB 3.74Å
296	G	82.8	Confident	88.4	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-23.9	174.7	0	0	0	0	0	113.9	Q293 G294 R303	Q293-G296 WeakPolarHBondContact O-CA 3.24Å; Q293-G296 PolarHBondContact O-N 2.8Å; G294-G296 PolarHBondContact O-N 2.97Å; G296-R303 WeakPolarHBondContact O-CD 3.25Å; G296-R303 PolarHBondContact O-NH1 3.26Å
297	E	83.2	Confident	88.2	Confident	137 Å²	137	28.3 Å²	28.3	64%	0.64	16%	0.157	S	C	*	.	H	α-helix	trans	-73.1	-46.6	172.7	-173.3	-179.3	-165.4	0	0	110.7	G294 A295 R303	G294-E297 PolarHBondContact O-N 3.46Å; G294-E297 VanDerWaalsContact O-N 3.13Å; A295-E297 VanDerWaalsContact C-N 3.32Å; A295-E297 PolarHBondContact O-N 2.81Å; E297-R303 PolarHBondContact O-NH1 3.33Å
298	T	82.3	Confident	87.7	Confident	119 Å²	119	34.2 Å²	34.2	73%	0.73	18%	0.18	S	C	*	.	H	α-helix	trans	-92.8	-28.6	-164.4	53.7	0	0	0	0	115.2	A295	A295-T298 PolarHBondContact O-N 3.09Å
299	S	85.1	Confident	87.4	Confident	28 Å²	28	35.2 Å²	35.2	20%	0.196	19%	0.185	C	C	.	.			trans	-114.4	120.7	178.3	172.9	0	0	0	0	112.1	A295 E301 F302 R303	A295-S299 PolarHBondContact O-N 2.92Å; S299-E301 VanDerWaalsContact C-N 3.32Å; S299-E301 PolarHBondContact OG-N 3.04Å; S299-E301 PolarHBondContact OG-OE2 2.9Å; S299-F302 PolarHBondContact OG-N 3.24Å; S299-F302 VanDerWaalsContact OG-N 3.12Å; S299-R303 WeakPolarHBondContact O-CB 3.43Å; S299-R303 PolarHBondContact O-N 3.25Å; S299-R303 VanDerWaalsContact O-N 3.1Å
300	L	85.3	Confident	87.3	Confident	18 Å²	18	35.2 Å²	35.2	9%	0.094	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-38	172.8	176.5	64.3	0	0	0	111.1	R303 I304 D344 A347	L300-R303 PolarHBondContact O-N 3Å; L300-I304 HydrophobicContact CD1-CD1 3.79Å; L300-I304 HydrophobicContact CD1-CG1 4.12Å; L300-I304 HydrophobicContact CD2-CD1 4.48Å; L300-I304 HydrophobicContact CG-CD1 3.8Å; L300-I304 HydrophobicContact CG-CG1 4.45Å; L300-I304 WeakPolarHBondContact O-CB 3.32Å; L300-I304 VanDerWaalsContact O-CG1 3.25Å; L300-I304 WeakPolarHBondContact O-CG1 3.24Å; L300-I304 PolarHBondContact O-N 3.08Å; L300-D344 HydrophobicContact CD1-CB 3.86Å; L300-D344 VanDerWaalsContact CD1-CG 3.5Å; L300-D344 WeakPolarHBondContact CD1-OD1 3.48Å; L300-A347 HydrophobicContact CD1-CB 4.09Å; L300-A347 HydrophobicContact CD2-CB 3.73Å
301	E	84.8	Confident	87.1	Confident	63 Å²	63	37.6 Å²	37.6	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-50.2	-179.1	-61.5	71.4	-160.7	0	0	110.8	S299 I304 H305 R351	S299-E301 VanDerWaalsContact C-N 3.32Å; S299-E301 PolarHBondContact OG-N 3.04Å; S299-E301 PolarHBondContact OG-OE2 2.9Å; E301-I304 PolarHBondContact O-N 3.43Å; E301-H305 WeakPolarHBondContact O-CB 2.86Å; E301-H305 PolarHBondContact O-N 3.12Å; E301-R351 IonicContact OE1-CZ 3.93Å; E301-R351 IonicContact OE1-NH1 3.67Å; E301-R351 PolarHBondContact OE1-NH1 3.27Å; E301-R351 IonicContact OE1-NH2 2.67Å; E301-R351 PolarHBondContact OE1-NH2 2.79Å
302	F	87.9	Confident	86.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-45.3	175	174.7	-90.2	0	0	0	111.8	H239 L243 A295 S299 I304 H305 L306 L416 P424 D425	H239-F302 AromaticContact CE1-CE1 3.8Å; H239-F302 AromaticContact CE1-CZ 3.92Å; L243-F302 HydrophobicContact CD1-CE2 4.44Å; L243-F302 HydrophobicContact CD1-CZ 3.73Å; A295-F302 VanDerWaalsContact C-CD1 3.47Å; A295-F302 HydrophobicContact CB-CD1 3.66Å; A295-F302 HydrophobicContact CB-CD2 4.27Å; A295-F302 HydrophobicContact CB-CE1 3.65Å; A295-F302 HydrophobicContact CB-CE2 4.22Å; A295-F302 HydrophobicContact CB-CG 3.99Å; A295-F302 HydrophobicContact CB-CZ 3.93Å; S299-F302 PolarHBondContact OG-N 3.24Å; S299-F302 VanDerWaalsContact OG-N 3.12Å; F302-I304 VanDerWaalsContact C-N 3.35Å; F302-I304 PolarHBondContact O-N 3.01Å; F302-H305 PolarHBondContact O-N 2.91Å; F302-L306 HydrophobicContact CE1-CD2 3.69Å; F302-L306 HydrophobicContact CZ-CD2 3.83Å; F302-L306 WeakPolarHBondContact O-CB 3.47Å; F302-L306 PolarHBondContact O-N 2.95Å; F302-L416 HydrophobicContact CB-CD2 4.3Å; F302-P424 HydrophobicContact CB-CG 4.23Å; F302-P424 HydrophobicContact CD2-CB 3.77Å; F302-P424 HydrophobicContact CD2-CG 3.73Å; F302-P424 HydrophobicContact CE2-CB 4.18Å; F302-P424 HydrophobicContact CG-CB 4.32Å; F302-P424 HydrophobicContact CG-CG 4.26Å; F302-D425 HydrophobicContact CD2-CB 4.26Å; F302-D425 HydrophobicContact CE2-CB 3.81Å
303	R	90.2	Very high	86.8	Confident	37 Å²	37	44.7 Å²	44.7	14%	0.14	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-38.2	178.2	-175.6	169.9	61.6	-121.3	5.7	112.9	L291 G296 E297 S299 L300 R307 D344	L291-R303 WeakPolarHBondContact O-CD 3.18Å; L291-R303 WeakPolarHBondContact O-CG 3.33Å; G296-R303 WeakPolarHBondContact O-CD 3.25Å; G296-R303 PolarHBondContact O-NH1 3.26Å; E297-R303 PolarHBondContact O-NH1 3.33Å; S299-R303 WeakPolarHBondContact O-CB 3.43Å; S299-R303 PolarHBondContact O-N 3.25Å; S299-R303 VanDerWaalsContact O-N 3.1Å; L300-R303 PolarHBondContact O-N 3Å; R303-R307 WeakPolarHBondContact O-CB 3.5Å; R303-R307 PolarHBondContact O-N 3.45Å; R303-R307 VanDerWaalsContact O-N 3.09Å; R303-D344 WeakPolarHBondContact CD-OD2 3.3Å; R303-D344 WeakPolarHBondContact CG-OD2 3.27Å; R303-D344 IonicContact CZ-OD1 2.73Å; R303-D344 VanDerWaalsContact CZ-OD1 3.23Å; R303-D344 IonicContact CZ-OD2 3.23Å; R303-D344 VanDerWaalsContact NE-CG 3.32Å; R303-D344 IonicContact NE-OD1 3.48Å; R303-D344 PolarHBondContact NE-OD1 3.03Å; R303-D344 IonicContact NE-OD2 2.72Å; R303-D344 PolarHBondContact NE-OD2 3.39Å; R303-D344 IonicContact NH2-OD1 2.86Å; R303-D344 PolarHBondContact NH2-OD1 2.86Å
304	I	86.6	Confident	86.8	Confident	56 Å²	56	44.1 Å²	44.1	29%	0.287	24%	0.237	S	C	.	.	H	α-helix	trans	-66.9	-45.2	173.2	-73	172.5	0	0	0	110.8	L300 E301 F302 R307 Y308 D344 L348	L300-I304 HydrophobicContact CD1-CD1 3.79Å; L300-I304 HydrophobicContact CD1-CG1 4.12Å; L300-I304 HydrophobicContact CD2-CD1 4.48Å; L300-I304 HydrophobicContact CG-CD1 3.8Å; L300-I304 HydrophobicContact CG-CG1 4.45Å; L300-I304 WeakPolarHBondContact O-CB 3.32Å; L300-I304 VanDerWaalsContact O-CG1 3.25Å; L300-I304 WeakPolarHBondContact O-CG1 3.24Å; L300-I304 PolarHBondContact O-N 3.08Å; E301-I304 PolarHBondContact O-N 3.43Å; F302-I304 VanDerWaalsContact C-N 3.35Å; F302-I304 PolarHBondContact O-N 3.01Å; I304-R307 PolarHBondContact O-N 3.46Å; I304-Y308 PolarHBondContact O-N 2.94Å; I304-D344 HydrophobicContact CD1-CB 4.44Å; I304-D344 HydrophobicContact CG1-CB 4.13Å; I304-L348 HydrophobicContact CD1-CD1 4.4Å
305	H	87.1	Confident	87.1	Confident	21 Å²	21	42.5 Å²	42.5	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-50.3	177.4	174	63.7	0	0	0	112.1	E301 F302 R307 Y308 E309 L416 D425	E301-H305 WeakPolarHBondContact O-CB 2.86Å; E301-H305 PolarHBondContact O-N 3.12Å; F302-H305 PolarHBondContact O-N 2.91Å; H305-R307 VanDerWaalsContact C-N 3.31Å; H305-R307 PolarHBondContact O-N 3.27Å; H305-Y308 WeakPolarHBondContact O-CA 3.4Å; H305-Y308 VanDerWaalsContact O-CB 3.31Å; H305-Y308 WeakPolarHBondContact O-CB 3.34Å; H305-Y308 PolarHBondContact O-N 2.88Å; H305-E309 PolarHBondContact O-N 3.39Å; H305-L416 HydrophobicContact CB-CD2 3.98Å; H305-D425 IonicContact CD2-OD2 3.77Å; H305-D425 IonicContact NE2-OD2 2.7Å
306	L	88.4	Confident	87.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-34.1	-178.8	-169.7	57.4	0	0	0	111.9	L243 F259 V290 L291 F302 Y308 F310	L243-L306 HydrophobicContact CD2-CD1 4.23Å; L243-L306 HydrophobicContact CD2-CD2 4.41Å; F259-L306 HydrophobicContact CE2-CD1 3.73Å; F259-L306 HydrophobicContact CZ-CD1 4Å; V290-L306 HydrophobicContact CG1-CD1 4.5Å; V290-L306 HydrophobicContact CG1-CD2 3.74Å; V290-L306 HydrophobicContact CG1-CG 4.3Å; V290-L306 WeakPolarHBondContact O-CD2 3.37Å; L291-L306 HydrophobicContact CD2-CB 3.97Å; L291-L306 HydrophobicContact CD2-CD2 4.29Å; L291-L306 HydrophobicContact CD2-CG 3.88Å; F302-L306 HydrophobicContact CE1-CD2 3.69Å; F302-L306 HydrophobicContact CZ-CD2 3.83Å; F302-L306 WeakPolarHBondContact O-CB 3.47Å; F302-L306 PolarHBondContact O-N 2.95Å; L306-Y308 VanDerWaalsContact C-N 3.34Å; L306-F310 HydrophobicContact CG-CE2 4.44Å; L306-F310 WeakPolarHBondContact O-CD2 3.38Å
307	R	91.3	Very high	87.6	Confident	9 Å²	9	47 Å²	47	3%	0.034	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-34.8	170.3	-168.1	-178.4	-61.8	99.7	-1.5	112.4	L291 R303 I304 H305 E309 F310 L311 F337 L340 D344	L291-R307 HydrophobicContact CD2-CB 3.95Å; R303-R307 WeakPolarHBondContact O-CB 3.5Å; R303-R307 PolarHBondContact O-N 3.45Å; R303-R307 VanDerWaalsContact O-N 3.09Å; I304-R307 PolarHBondContact O-N 3.46Å; H305-R307 VanDerWaalsContact C-N 3.31Å; H305-R307 PolarHBondContact O-N 3.27Å; R307-E309 VanDerWaalsContact C-N 3.3Å; R307-E309 PolarHBondContact O-N 2.71Å; R307-F310 PolarHBondContact O-N 3.5Å; R307-L311 HydrophobicContact CG-CD1 4.12Å; R307-L311 HydrophobicContact CG-CG 4.33Å; R307-L311 WeakPolarHBondContact O-CG 3.21Å; R307-L311 PolarHBondContact O-N 2.91Å; R307-F337 HydrophobicContact CG-CE2 4.39Å; R307-F337 HydrophobicContact CG-CZ 4.07Å; R307-L340 PolarHBondContact NH2-O 3.18Å; R307-D344 IonicContact CZ-OD2 2.89Å; R307-D344 IonicContact NH1-OD2 3.27Å; R307-D344 PolarHBondContact NH1-OD2 3.49Å; R307-D344 IonicContact NH2-OD2 3.95Å; R307-D344 PolarHBondContact NH2-OD2 3.28Å
308	Y	86.3	Confident	88.1	Confident	123 Å²	123	41 Å²	41	48%	0.482	22%	0.218	S	C	.	.	H	α-helix	trans	-64.4	-33.8	179.6	-171.3	-105.7	0	0	0	112.1	I304 H305 L306 L311 M312	I304-Y308 PolarHBondContact O-N 2.94Å; H305-Y308 WeakPolarHBondContact O-CA 3.4Å; H305-Y308 VanDerWaalsContact O-CB 3.31Å; H305-Y308 WeakPolarHBondContact O-CB 3.34Å; H305-Y308 PolarHBondContact O-N 2.88Å; L306-Y308 VanDerWaalsContact C-N 3.34Å; Y308-L311 PolarHBondContact O-N 3.21Å; Y308-M312 HydrophobicContact CD1-CG 3.85Å; Y308-M312 HydrophobicContact CD2-CG 4.42Å; Y308-M312 HydrophobicContact CE1-CG 3.48Å; Y308-M312 VanDerWaalsContact CE1-CG 3.48Å; Y308-M312 HydrophobicContact CE1-SD 4.05Å; Y308-M312 HydrophobicContact CE2-CG 4.1Å; Y308-M312 HydrophobicContact CE2-SD 4.16Å; Y308-M312 HydrophobicContact CG-CG 4.31Å; Y308-M312 WeakPolarHBondContact O-CB 3.43Å; Y308-M312 VanDerWaalsContact O-CG 3.31Å; Y308-M312 WeakPolarHBondContact O-CG 3.5Å; Y308-M312 PolarHBondContact O-N 3.33Å; Y308-M312 PolarHBondContact OH-SD 3.05Å
309	E	88.1	Confident	88.5	Confident	21 Å²	21	35.3 Å²	35.3	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-57.2	-50.2	170.7	-68.6	-159.2	-77	0	0	111.9	R258 F259 H305 R307 L311 M312 L313	R258-E309 IonicContact CZ-OE1 2.68Å; R258-E309 VanDerWaalsContact CZ-OE1 3.23Å; R258-E309 IonicContact NE-OE1 2.69Å; R258-E309 PolarHBondContact NE-OE1 2.97Å; R258-E309 IonicContact NE-OE2 3.46Å; R258-E309 IonicContact NH2-OE1 3.3Å; R258-E309 PolarHBondContact NH2-OE1 3.15Å; F259-E309 HydrophobicContact CD2-CB 4.37Å; F259-E309 WeakPolarHBondContact CE2-OE1 3.45Å; H305-E309 PolarHBondContact O-N 3.39Å; R307-E309 VanDerWaalsContact C-N 3.3Å; R307-E309 PolarHBondContact O-N 2.71Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 3.35Å; E309-M312 PolarHBondContact O-N 2.85Å; E309-L313 WeakPolarHBondContact O-CG 3.5Å; E309-L313 PolarHBondContact O-N 3.26Å
310	F	92.9	Very high	88.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-36.9	178	-61.4	-64.5	0	0	0	112.8	F259 I263 I287 V290 L291 L306 R307 L313 G314 I315	F259-F310 HydrophobicContact CB-CD1 4.19Å; F259-F310 HydrophobicContact CB-CE1 3.72Å; F259-F310 AromaticContact CD1-CE1 3.87Å; F259-F310 HydrophobicContact CD1-CE1 3.87Å; F259-F310 HydrophobicContact CD1-CZ 4.05Å; F259-F310 HydrophobicContact CD2-CD1 4.21Å; F259-F310 AromaticContact CD2-CE1 3.57Å; F259-F310 HydrophobicContact CD2-CE1 3.57Å; F259-F310 HydrophobicContact CD2-CE2 4.47Å; F259-F310 AromaticContact CD2-CZ 3.72Å; F259-F310 HydrophobicContact CD2-CZ 3.72Å; F259-F310 HydrophobicContact CE1-CE1 4.35Å; F259-F310 HydrophobicContact CE1-CZ 4.05Å; F259-F310 HydrophobicContact CE2-CE1 4.1Å; F259-F310 HydrophobicContact CE2-CE2 4.3Å; F259-F310 AromaticContact CE2-CZ 3.73Å; F259-F310 HydrophobicContact CE2-CZ 3.73Å; F259-F310 HydrophobicContact CG-CD1 4.27Å; F259-F310 AromaticContact CG-CE1 3.45Å; F259-F310 HydrophobicContact CG-CE1 3.45Å; F259-F310 VanDerWaalsContact CG-CE1 3.45Å; F259-F310 AromaticContact CG-CZ 3.89Å; F259-F310 HydrophobicContact CG-CZ 3.89Å; F259-F310 HydrophobicContact CZ-CE1 4.46Å; F259-F310 AromaticContact CZ-CZ 3.91Å; F259-F310 HydrophobicContact CZ-CZ 3.91Å; I263-F310 HydrophobicContact CD1-CD1 4.01Å; I263-F310 HydrophobicContact CG1-CD1 4.3Å; I287-F310 HydrophobicContact CD1-CD1 4.36Å; I287-F310 HydrophobicContact CD1-CE1 4.24Å; I287-F310 HydrophobicContact CG1-CD1 4.4Å; I287-F310 HydrophobicContact CG1-CE1 3.87Å; I287-F310 HydrophobicContact CG1-CZ 4.06Å; I287-F310 HydrophobicContact CG2-CD2 4.19Å; I287-F310 HydrophobicContact CG2-CE1 4.49Å; I287-F310 HydrophobicContact CG2-CE2 4.07Å; I287-F310 HydrophobicContact CG2-CG 4.47Å; I287-F310 HydrophobicContact CG2-CZ 4.23Å; V290-F310 HydrophobicContact CG1-CZ 4.48Å; L291-F310 HydrophobicContact CD1-CD2 4.29Å; L291-F310 HydrophobicContact CD1-CE2 4.4Å; L291-F310 HydrophobicContact CD2-CD2 4.19Å; L291-F310 HydrophobicContact CD2-CE2 4.05Å; L291-F310 HydrophobicContact CG-CD2 4.4Å; L291-F310 HydrophobicContact CG-CE2 4.1Å; L306-F310 HydrophobicContact CG-CE2 4.44Å; L306-F310 WeakPolarHBondContact O-CD2 3.38Å; R307-F310 PolarHBondContact O-N 3.5Å; F310-L313 PolarHBondContact O-N 3.25Å; F310-G314 PolarHBondContact O-N 3.02Å; F310-I315 HydrophobicContact CB-CB 4.4Å; F310-I315 HydrophobicContact CB-CD1 4.21Å; F310-I315 HydrophobicContact CB-CG2 4.05Å; F310-I315 VanDerWaalsContact O-CB 3.31Å; F310-I315 WeakPolarHBondContact O-CB 3.47Å; F310-I315 VanDerWaalsContact O-CG2 3.25Å; F310-I315 WeakPolarHBondContact O-CG2 3.46Å; F310-I315 PolarHBondContact O-N 2.84Å; F310-I315 VanDerWaalsContact O-N 3.12Å
311	L	87.7	Confident	88.9	Confident	50 Å²	50	40.9 Å²	40.9	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-66.4	-39.7	175.2	-70.7	170.4	0	0	0	112.2	R307 Y308 E309 L313 G314 I315 Q316	R307-L311 HydrophobicContact CG-CD1 4.12Å; R307-L311 HydrophobicContact CG-CG 4.33Å; R307-L311 WeakPolarHBondContact O-CG 3.21Å; R307-L311 PolarHBondContact O-N 2.91Å; Y308-L311 PolarHBondContact O-N 3.21Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 3.35Å; L311-L313 VanDerWaalsContact C-N 3.31Å; L311-L313 PolarHBondContact O-N 2.99Å; L311-G314 PolarHBondContact O-N 3.13Å; L311-I315 HydrophobicContact CD2-CG2 4.11Å; L311-Q316 HydrophobicContact CD2-CB 4.5Å
312	M	84	Confident	89.1	Confident	126 Å²	126	38 Å²	38	62%	0.621	20%	0.195	S	C	*	.	H	α-helix	trans	-70.4	-25.6	175.9	-74	-60.7	-63.3	0	0	113.3	Y308 E309 G314	Y308-M312 HydrophobicContact CD1-CG 3.85Å; Y308-M312 HydrophobicContact CD2-CG 4.42Å; Y308-M312 HydrophobicContact CE1-CG 3.48Å; Y308-M312 VanDerWaalsContact CE1-CG 3.48Å; Y308-M312 HydrophobicContact CE1-SD 4.05Å; Y308-M312 HydrophobicContact CE2-CG 4.1Å; Y308-M312 HydrophobicContact CE2-SD 4.16Å; Y308-M312 HydrophobicContact CG-CG 4.31Å; Y308-M312 WeakPolarHBondContact O-CB 3.43Å; Y308-M312 VanDerWaalsContact O-CG 3.31Å; Y308-M312 WeakPolarHBondContact O-CG 3.5Å; Y308-M312 PolarHBondContact O-N 3.33Å; Y308-M312 PolarHBondContact OH-SD 3.05Å; E309-M312 PolarHBondContact O-N 2.85Å; M312-G314 PolarHBondContact O-N 3.43Å
313	L	89.4	Confident	89.1	Confident	33 Å²	33	42 Å²	42	17%	0.173	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.7	167.5	-71.6	172.1	0	0	0	113.6	F259 Q260 I263 E309 F310 L311	F259-L313 HydrophobicContact CB-CD1 3.71Å; Q260-L313 HydrophobicContact CB-CD2 4.26Å; I263-L313 HydrophobicContact CB-CB 4.19Å; I263-L313 HydrophobicContact CG1-CB 3.97Å; I263-L313 HydrophobicContact CG1-CD1 3.93Å; I263-L313 HydrophobicContact CG2-CB 4.13Å; E309-L313 WeakPolarHBondContact O-CG 3.5Å; E309-L313 PolarHBondContact O-N 3.26Å; F310-L313 PolarHBondContact O-N 3.25Å; L311-L313 VanDerWaalsContact C-N 3.31Å; L311-L313 PolarHBondContact O-N 2.99Å
314	G	88.5	Confident	88.8	Confident	30 Å²	30	44.4 Å²	44.4	31%	0.309	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	22.7	174.1	0	0	0	0	0	115.2	F310 L311 M312 Q316 P317	F310-G314 PolarHBondContact O-N 3.02Å; L311-G314 PolarHBondContact O-N 3.13Å; M312-G314 PolarHBondContact O-N 3.43Å; G314-Q316 PolarHBondContact O-N 2.88Å; G314-Q316 VanDerWaalsContact O-N 3.11Å; G314-P317 WeakPolarHBondContact O-CD 3.45Å
315	I	93.2	Very high	88.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.6	-27.6	-175.7	-161.7	174.7	0	0	0	114.6	I263 L266 M284 I287 F310 L311 V318 I319 F337	I263-I315 HydrophobicContact CD1-CB 4.27Å; I263-I315 HydrophobicContact CD1-CD1 3.8Å; I263-I315 HydrophobicContact CD1-CG1 3.97Å; L266-I315 HydrophobicContact CD2-CD1 4.38Å; L266-I315 HydrophobicContact CD2-CG1 4.18Å; M284-I315 HydrophobicContact SD-CD1 4.26Å; I287-I315 HydrophobicContact CD1-CD1 3.9Å; I287-I315 HydrophobicContact CG2-CD1 4.49Å; F310-I315 HydrophobicContact CB-CB 4.4Å; F310-I315 HydrophobicContact CB-CD1 4.21Å; F310-I315 HydrophobicContact CB-CG2 4.05Å; F310-I315 VanDerWaalsContact O-CB 3.31Å; F310-I315 WeakPolarHBondContact O-CB 3.47Å; F310-I315 VanDerWaalsContact O-CG2 3.25Å; F310-I315 WeakPolarHBondContact O-CG2 3.46Å; F310-I315 PolarHBondContact O-N 2.84Å; F310-I315 VanDerWaalsContact O-N 3.12Å; L311-I315 HydrophobicContact CD2-CG2 4.11Å; I315-V318 CarbonylContact O-C 3.43Å; I315-V318 WeakPolarHBondContact O-CB 3.15Å; I315-V318 PolarHBondContact O-N 3.11Å; I315-I319 HydrophobicContact CD1-CD1 4.3Å; I315-I319 HydrophobicContact CG1-CD1 3.98Å; I315-I319 HydrophobicContact CG1-CG1 4.14Å; I315-I319 HydrophobicContact CG2-CD1 4.43Å; I315-I319 WeakPolarHBondContact O-CG1 3.35Å; I315-I319 PolarHBondContact O-N 3.12Å; I315-F337 HydrophobicContact CD1-CE2 4.2Å; I315-F337 HydrophobicContact CD1-CZ 4.26Å; I315-F337 HydrophobicContact CG2-CE1 4.46Å; I315-F337 HydrophobicContact CG2-CZ 3.98Å
316	Q	89.3	Confident	88.2	Confident	28 Å²	28	52 Å²	52	13%	0.131	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-55.3	-174.5	-179.2	75	67.9	0	0	113.1	L311 G314 V318 I319 D320	L311-Q316 HydrophobicContact CD2-CB 4.5Å; G314-Q316 PolarHBondContact O-N 2.88Å; G314-Q316 VanDerWaalsContact O-N 3.11Å; Q316-V318 PolarHBondContact O-N 2.92Å; Q316-V318 VanDerWaalsContact O-N 3.1Å; Q316-I319 WeakPolarHBondContact O-CB 3.2Å; Q316-I319 PolarHBondContact O-N 2.85Å; Q316-D320 PolarHBondContact NE2-OD1 3.32Å; Q316-D320 PolarHBondContact O-N 3.47Å
317	P	89	Confident	88.2	Confident	89 Å²	89	54.5 Å²	54.5	58%	0.578	28%	0.28	S	S	*	.	H	α-helix	trans	-51.6	-31	170.1	-30.5	33.8	0	0	0	114.6	G314 K321	G314-P317 WeakPolarHBondContact O-CD 3.45Å; P317-K321 WeakPolarHBondContact O-CB 3.26Å; P317-K321 PolarHBondContact O-N 2.96Å; P317-K321 VanDerWaalsContact O-N 3.09Å
318	V	91.9	Very high	88	Confident	9 Å²	9	58.8 Å²	58.8	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-71.4	-45.1	176.3	-172.5	0	0	0	0	110.7	L266 D267 I315 Q316 D320 K321 L322	L266-V318 HydrophobicContact CB-CG1 4.2Å; L266-V318 HydrophobicContact CD2-CG1 4.03Å; L266-V318 HydrophobicContact CG-CG1 3.73Å; D267-V318 HydrophobicContact CB-CG1 3.98Å; D267-V318 HydrophobicContact CB-CG2 3.76Å; I315-V318 CarbonylContact O-C 3.43Å; I315-V318 WeakPolarHBondContact O-CB 3.15Å; I315-V318 PolarHBondContact O-N 3.11Å; Q316-V318 PolarHBondContact O-N 2.92Å; Q316-V318 VanDerWaalsContact O-N 3.1Å; V318-D320 VanDerWaalsContact C-N 3.31Å; V318-D320 PolarHBondContact O-N 3.45Å; V318-K321 CarbonylContact O-C 3.57Å; V318-K321 WeakPolarHBondContact O-CB 3.32Å; V318-K321 PolarHBondContact O-N 2.96Å; V318-L322 HydrophobicContact CG1-CD1 4.28Å; V318-L322 HydrophobicContact CG1-CG 4.33Å; V318-L322 VanDerWaalsContact O-CG 3.24Å; V318-L322 WeakPolarHBondContact O-CG 3.49Å; V318-L322 PolarHBondContact O-N 3.47Å
319	I	91.5	Very high	88	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.9	-45.9	172.5	-70.9	167.1	0	0	0	110.8	I315 Q316 K321 L322 R323 L334 F337	I315-I319 HydrophobicContact CD1-CD1 4.3Å; I315-I319 HydrophobicContact CG1-CD1 3.98Å; I315-I319 HydrophobicContact CG1-CG1 4.14Å; I315-I319 HydrophobicContact CG2-CD1 4.43Å; I315-I319 WeakPolarHBondContact O-CG1 3.35Å; I315-I319 PolarHBondContact O-N 3.12Å; Q316-I319 WeakPolarHBondContact O-CB 3.2Å; Q316-I319 PolarHBondContact O-N 2.85Å; I319-K321 VanDerWaalsContact C-N 3.25Å; I319-K321 PolarHBondContact O-N 2.91Å; I319-L322 PolarHBondContact O-N 2.68Å; I319-L322 VanDerWaalsContact O-N 3.11Å; I319-R323 PolarHBondContact O-N 3.16Å; I319-L334 HydrophobicContact CG1-CD2 4.12Å; I319-L334 HydrophobicContact CG2-CB 4.42Å; I319-L334 HydrophobicContact CG2-CD2 4.2Å; I319-F337 HydrophobicContact CD1-CD1 3.51Å; I319-F337 HydrophobicContact CD1-CE1 3.54Å; I319-F337 HydrophobicContact CD1-CG 4.22Å; I319-F337 HydrophobicContact CD1-CZ 4.25Å
320	D	89.1	Confident	88.1	Confident	94 Å²	94	53.6 Å²	53.6	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-37.2	179.5	-53.8	-23.6	0	0	0	111.2	Q316 V318	Q316-D320 PolarHBondContact NE2-OD1 3.32Å; Q316-D320 PolarHBondContact O-N 3.47Å; V318-D320 VanDerWaalsContact C-N 3.31Å; V318-D320 PolarHBondContact O-N 3.45Å
321	K	89.2	Confident	87.9	Confident	70 Å²	70	55.6 Å²	55.6	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-71.1	-40.4	172.8	-178.1	-168.8	-172.3	-174.4	0	112.8	D267 S269 P317 V318 I319 R323 S324	D267-K321 PolarHBondContact O-NZ 3.12Å; D267-K321 VanDerWaalsContact OD1-CD 3.22Å; D267-K321 WeakPolarHBondContact OD1-CD 3.28Å; D267-K321 IonicContact OD1-NZ 2.6Å; D267-K321 PolarHBondContact OD1-NZ 2.79Å; D267-K321 IonicContact OD2-NZ 2.79Å; S269-K321 PolarHBondContact OG-NZ 3.44Å; S269-K321 VanDerWaalsContact OG-NZ 3.09Å; P317-K321 WeakPolarHBondContact O-CB 3.26Å; P317-K321 PolarHBondContact O-N 2.96Å; P317-K321 VanDerWaalsContact O-N 3.09Å; V318-K321 CarbonylContact O-C 3.57Å; V318-K321 WeakPolarHBondContact O-CB 3.32Å; V318-K321 PolarHBondContact O-N 2.96Å; I319-K321 VanDerWaalsContact C-N 3.25Å; I319-K321 PolarHBondContact O-N 2.91Å; K321-R323 VanDerWaalsContact C-N 3.32Å; K321-R323 PolarHBondContact O-N 2.85Å; K321-S324 WeakPolarHBondContact O-CB 3.42Å; K321-S324 PolarHBondContact O-N 3.24Å; K321-S324 PolarHBondContact O-OG 2.7Å
322	L	89	Confident	88	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-35.1	-178.4	-74.2	172.3	0	0	0	112.6	L266 K280 M284 V318 I319 S324 H325 L330 L334	L266-L322 HydrophobicContact CD1-CD1 3.71Å; L266-L322 HydrophobicContact CD1-CD2 4.38Å; L266-L322 HydrophobicContact CD2-CD1 4.13Å; L266-L322 HydrophobicContact CG-CD1 3.87Å; K280-L322 HydrophobicContact CB-CD2 4.03Å; K280-L322 HydrophobicContact CD-CD2 3.7Å; K280-L322 HydrophobicContact CG-CD2 4.21Å; M284-L322 HydrophobicContact CG-CD1 4.32Å; V318-L322 HydrophobicContact CG1-CD1 4.28Å; V318-L322 HydrophobicContact CG1-CG 4.33Å; V318-L322 VanDerWaalsContact O-CG 3.24Å; V318-L322 WeakPolarHBondContact O-CG 3.49Å; V318-L322 PolarHBondContact O-N 3.47Å; I319-L322 PolarHBondContact O-N 2.68Å; I319-L322 VanDerWaalsContact O-N 3.11Å; L322-S324 PolarHBondContact O-N 2.89Å; L322-H325 WeakPolarHBondContact O-CB 3.47Å; L322-H325 PolarHBondContact O-N 3.37Å; L322-H325 PolarHBondContact O-ND1 2.84Å; L322-L330 HydrophobicContact CB-CD2 4.33Å; L322-L330 HydrophobicContact CD2-CD2 4.29Å; L322-L334 HydrophobicContact CB-CD1 3.92Å; L322-L334 HydrophobicContact CB-CD2 4.42Å; L322-L334 HydrophobicContact CD1-CD2 3.99Å
323	R	89	Confident	88.4	Confident	82 Å²	82	49.1 Å²	49.1	31%	0.309	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-58.8	-9.5	175.7	-69.1	-173.5	175.1	-77.6	16.2	114.5	I319 K321 D331 L334 D335 E338	I319-R323 PolarHBondContact O-N 3.16Å; K321-R323 VanDerWaalsContact C-N 3.32Å; K321-R323 PolarHBondContact O-N 2.85Å; R323-D331 IonicContact NH1-OD1 2.65Å; R323-D331 PolarHBondContact NH1-OD1 3.37Å; R323-L334 HydrophobicContact CG-CD1 3.55Å; R323-D335 IonicContact CZ-OD1 2.73Å; R323-D335 VanDerWaalsContact CZ-OD1 3.27Å; R323-D335 IonicContact NH1-OD1 3.74Å; R323-D335 PolarHBondContact NH1-OD1 3.13Å; R323-D335 IonicContact NH2-OD1 3.61Å; R323-D335 PolarHBondContact NH2-OD1 3.18Å; R323-E338 IonicContact CZ-OE1 2.67Å; R323-E338 IonicContact NE-OE1 3.62Å; R323-E338 PolarHBondContact NE-OE1 3.48Å; R323-E338 IonicContact NH2-OE1 3.91Å; R323-E338 PolarHBondContact NH2-OE1 3.3Å; R323-E338 IonicContact NH2-OE2 3.67Å; R323-E338 PolarHBondContact NH2-OE2 2.87Å
324	S	84.4	Confident	88.5	Confident	89 Å²	89	47.6 Å²	47.6	62%	0.622	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-81.7	-5.2	171.3	67.6	0	0	0	0	115.4	K321 L322	K321-S324 WeakPolarHBondContact O-CB 3.42Å; K321-S324 PolarHBondContact O-N 3.24Å; K321-S324 PolarHBondContact O-OG 2.7Å; L322-S324 PolarHBondContact O-N 2.89Å
325	H	81.2	Confident	88.5	Confident	50 Å²	50	50 Å²	50	23%	0.231	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-90.9	5.7	-173.8	-62	59.8	0	0	0	114.3	V277 L322 N327	V277-H325 HydrophobicContact CG2-CB 4.12Å; L322-H325 WeakPolarHBondContact O-CB 3.47Å; L322-H325 PolarHBondContact O-N 3.37Å; L322-H325 PolarHBondContact O-ND1 2.84Å; H325-N327 VanDerWaalsContact C-N 3.26Å; H325-N327 PolarHBondContact O-N 3.22Å; H325-N327 VanDerWaalsContact O-N 3.08Å
326	E	79.1	Confident	88.4	Confident	187 Å²	187	50.4 Å²	50.4	87%	0.874	27%	0.269	S	S	*	.			trans	47.9	37.2	174.1	-59	-168.6	164.8	0	0	115.4
327	N	88.2	Confident	88.5	Confident	51 Å²	51	49.1 Å²	49.1	27%	0.273	26%	0.263	S	S	.	.			trans	-113.9	112.6	-175.8	-175.1	-72.8	0	0	0	112.4	V277 H325 T329 L330 D331	V277-N327 HydrophobicContact CG1-CB 3.69Å; H325-N327 VanDerWaalsContact C-N 3.26Å; H325-N327 PolarHBondContact O-N 3.22Å; H325-N327 VanDerWaalsContact O-N 3.08Å; N327-T329 VanDerWaalsContact C-N 3.32Å; N327-T329 PolarHBondContact O-N 3.4Å; N327-T329 WeakPolarHBondContact OD1-CB 3.43Å; N327-T329 PolarHBondContact OD1-N 2.93Å; N327-T329 VanDerWaalsContact OD1-N 3.09Å; N327-L330 HydrophobicContact CB-CB 4.07Å; N327-L330 PolarHBondContact O-N 3.37Å; N327-L330 PolarHBondContact OD1-N 2.81Å; N327-D331 WeakPolarHBondContact O-CB 3.3Å; N327-D331 PolarHBondContact O-N 2.78Å
328	S	86.6	Confident	88.5	Confident	99 Å²	99	47.3 Å²	47.3	69%	0.692	25%	0.247	S	C	*	.	H	α-helix	trans	-63.8	-27.5	-174.9	54.8	0	0	0	0	115.4	R332	S328-R332 WeakPolarHBondContact O-CB 3.32Å; S328-R332 PolarHBondContact O-N 2.76Å
329	T	86.8	Confident	88.3	Confident	34 Å²	34	47.3 Å²	47.3	21%	0.209	25%	0.246	C	C	.	.	H	α-helix	trans	-74.8	-46.9	175.9	-53.4	0	0	0	0	110.5	T281 N327 R332 H333 W1044	T281-T329 HydrophobicContact CG2-CG2 3.86Å; N327-T329 VanDerWaalsContact C-N 3.32Å; N327-T329 PolarHBondContact O-N 3.4Å; N327-T329 WeakPolarHBondContact OD1-CB 3.43Å; N327-T329 PolarHBondContact OD1-N 2.93Å; N327-T329 VanDerWaalsContact OD1-N 3.09Å; T329-R332 PolarHBondContact O-N 3.04Å; T329-R332 PolarHBondContact O-NH2 3.2Å; T329-H333 PolarHBondContact O-CD2 2.91Å; T329-H333 VanDerWaalsContact O-CD2 3.26Å; T329-H333 PolarHBondContact O-N 3.19Å; T329-W1044 HydrophobicContact CG2-CE3 4.46Å; T329-W1044 WeakPolarHBondContact CG2-O 3.31Å
330	L	90.1	Very high	88	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-51.5	173.8	177.7	59.1	0	0	0	110.7	V277 M284 L322 N327 R332 H333 L334	V277-L330 HydrophobicContact CG1-CB 4.43Å; V277-L330 HydrophobicContact CG1-CD2 4.11Å; M284-L330 HydrophobicContact CB-CD1 4.15Å; M284-L330 HydrophobicContact CG-CD1 3.96Å; L322-L330 HydrophobicContact CB-CD2 4.33Å; L322-L330 HydrophobicContact CD2-CD2 4.29Å; N327-L330 HydrophobicContact CB-CB 4.07Å; N327-L330 PolarHBondContact O-N 3.37Å; N327-L330 PolarHBondContact OD1-N 2.81Å; L330-R332 VanDerWaalsContact C-N 3.26Å; L330-R332 PolarHBondContact O-N 3.41Å; L330-H333 CarbonylContact O-C 3.25Å; L330-H333 WeakPolarHBondContact O-CA 3.48Å; L330-H333 WeakPolarHBondContact O-CB 3.5Å; L330-H333 PolarHBondContact O-N 3.06Å; L330-L334 HydrophobicContact CD1-CD2 4.17Å; L330-L334 HydrophobicContact CD1-CG 4.33Å; L330-L334 HydrophobicContact CG-CD1 4.28Å; L330-L334 HydrophobicContact CG-CG 4.3Å; L330-L334 WeakPolarHBondContact O-CG 3.32Å; L330-L334 PolarHBondContact O-N 3.45Å
331	D	89	Confident	87.9	Confident	42 Å²	42	45.9 Å²	45.9	23%	0.225	24%	0.235	C	C	.	.	H	α-helix	trans	-55.5	-39	179.1	-82.1	-46.3	0	0	0	112.3	R323 N327 H333 L334 D335	R323-D331 IonicContact NH1-OD1 2.65Å; R323-D331 PolarHBondContact NH1-OD1 3.37Å; N327-D331 WeakPolarHBondContact O-CB 3.3Å; N327-D331 PolarHBondContact O-N 2.78Å; D331-H333 VanDerWaalsContact C-N 3.28Å; D331-H333 PolarHBondContact O-N 2.97Å; D331-L334 PolarHBondContact O-N 2.91Å; D331-D335 WeakPolarHBondContact O-CB 3.5Å; D331-D335 PolarHBondContact O-N 3.42Å
332	R	88.8	Confident	87.7	Confident	41 Å²	41	46.5 Å²	46.5	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-28.4	175.3	-169.5	-157.2	48	35.1	23.9	112.4	S328 T329 L330 Y336 S1045 G1046 L1053	S328-R332 WeakPolarHBondContact O-CB 3.32Å; S328-R332 PolarHBondContact O-N 2.76Å; T329-R332 PolarHBondContact O-N 3.04Å; T329-R332 PolarHBondContact O-NH2 3.2Å; L330-R332 VanDerWaalsContact C-N 3.26Å; L330-R332 PolarHBondContact O-N 3.41Å; R332-Y336 WeakPolarHBondContact O-CB 3.48Å; R332-Y336 PolarHBondContact O-N 3.11Å; R332-Y336 VanDerWaalsContact O-N 3.16Å; R332-S1045 PolarHBondContact NE-O 2.88Å; R332-S1045 PolarHBondContact NH2-O 3.46Å; R332-G1046 VanDerWaalsContact CZ-CA 3.41Å; R332-G1046 VanDerWaalsContact NH2-CA 3.3Å; R332-L1053 HydrophobicContact CG-CD1 3.91Å
333	H	92.4	Very high	87.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-77.6	-33.8	170.1	-74.1	-70.4	0	0	0	113.4	M284 S285 N288 T329 L330 D331 F337 L1043 W1044 F1049	M284-H333 HydrophobicContact CB-CB 4.02Å; S285-H333 VanDerWaalsContact CB-CE1 3.48Å; S285-H333 WeakPolarHBondContact CB-CE1 3.39Å; S285-H333 PolarHBondContact OG-CE1 3.43Å; N288-H333 PolarHBondContact ND2-O 3.34Å; T329-H333 PolarHBondContact O-CD2 2.91Å; T329-H333 VanDerWaalsContact O-CD2 3.26Å; T329-H333 PolarHBondContact O-N 3.19Å; L330-H333 CarbonylContact O-C 3.25Å; L330-H333 WeakPolarHBondContact O-CA 3.48Å; L330-H333 WeakPolarHBondContact O-CB 3.5Å; L330-H333 PolarHBondContact O-N 3.06Å; D331-H333 VanDerWaalsContact C-N 3.28Å; D331-H333 PolarHBondContact O-N 2.97Å; H333-F337 PolarHBondContact O-N 3.15Å; H333-L1043 PolarHBondContact CE1-O 3.27Å; H333-L1043 VanDerWaalsContact CE1-O 3.25Å; H333-L1043 PolarHBondContact NE2-O 3.19Å; H333-W1044 PolarHBondContact NE2-O 3.07Å; H333-F1049 AromaticContact CE1-CE2 3.78Å; H333-F1049 AromaticContact ND1-CE2 3.93Å
334	L	92.8	Very high	87.3	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-47.9	173	-55.8	-177.8	0	0	0	110.5	M284 I319 L322 R323 L330 D331 Y336 F337 E338	M284-L334 HydrophobicContact CE-CD2 4.07Å; M284-L334 HydrophobicContact CG-CD2 3.89Å; M284-L334 HydrophobicContact SD-CD2 4.07Å; I319-L334 HydrophobicContact CG1-CD2 4.12Å; I319-L334 HydrophobicContact CG2-CB 4.42Å; I319-L334 HydrophobicContact CG2-CD2 4.2Å; L322-L334 HydrophobicContact CB-CD1 3.92Å; L322-L334 HydrophobicContact CB-CD2 4.42Å; L322-L334 HydrophobicContact CD1-CD2 3.99Å; R323-L334 HydrophobicContact CG-CD1 3.55Å; L330-L334 HydrophobicContact CD1-CD2 4.17Å; L330-L334 HydrophobicContact CD1-CG 4.33Å; L330-L334 HydrophobicContact CG-CD1 4.28Å; L330-L334 HydrophobicContact CG-CG 4.3Å; L330-L334 WeakPolarHBondContact O-CG 3.32Å; L330-L334 PolarHBondContact O-N 3.45Å; D331-L334 PolarHBondContact O-N 2.91Å; L334-Y336 VanDerWaalsContact C-N 3.3Å; L334-Y336 PolarHBondContact O-N 3.39Å; L334-F337 PolarHBondContact O-N 3.39Å; L334-E338 PolarHBondContact O-N 2.96Å
335	D	89	Confident	87	Confident	80 Å²	80	43 Å²	43	43%	0.428	22%	0.221	S	C	.	.	H	α-helix	trans	-60.4	-36.1	175.7	-79.7	14.5	0	0	0	112.4	R323 D331 M339	R323-D335 IonicContact CZ-OD1 2.73Å; R323-D335 VanDerWaalsContact CZ-OD1 3.27Å; R323-D335 IonicContact NH1-OD1 3.74Å; R323-D335 PolarHBondContact NH1-OD1 3.13Å; R323-D335 IonicContact NH2-OD1 3.61Å; R323-D335 PolarHBondContact NH2-OD1 3.18Å; D331-D335 WeakPolarHBondContact O-CB 3.5Å; D331-D335 PolarHBondContact O-N 3.42Å; D335-M339 VanDerWaalsContact O-CB 3.23Å; D335-M339 WeakPolarHBondContact O-CB 3.43Å; D335-M339 PolarHBondContact O-N 3.33Å
336	Y	89.7	Confident	86.9	Confident	9 Å²	9	44.4 Å²	44.4	4%	0.035	23%	0.23	C	C	.	.	H	α-helix	trans	-71.3	-42.1	175.3	-177.4	-96.4	0	0	0	112.4	N288 S292 R332 L334 E338 M339 L340 F1049 D1052 L1053	N288-Y336 HydrophobicContact CB-CD1 3.96Å; N288-Y336 HydrophobicContact CB-CE1 4.21Å; N288-Y336 WeakPolarHBondContact OD1-CD1 3.44Å; S292-Y336 WeakPolarHBondContact CB-OH 3.23Å; S292-Y336 WeakPolarHBondContact OG-CE1 3.28Å; S292-Y336 PolarHBondContact OG-OH 2.97Å; R332-Y336 WeakPolarHBondContact O-CB 3.48Å; R332-Y336 PolarHBondContact O-N 3.11Å; R332-Y336 VanDerWaalsContact O-N 3.16Å; L334-Y336 VanDerWaalsContact C-N 3.3Å; L334-Y336 PolarHBondContact O-N 3.39Å; Y336-E338 VanDerWaalsContact C-N 3.33Å; Y336-E338 PolarHBondContact O-N 3.16Å; Y336-M339 HydrophobicContact CD2-CE 3.46Å; Y336-M339 VanDerWaalsContact CD2-CE 3.46Å; Y336-M339 HydrophobicContact CE2-CE 3.39Å; Y336-M339 PolarHBondContact O-N 3.12Å; Y336-L340 HydrophobicContact CE1-CD2 4.28Å; Y336-L340 WeakPolarHBondContact O-CB 3.34Å; Y336-L340 PolarHBondContact O-N 2.64Å; Y336-F1049 HydrophobicContact CD1-CD1 4.05Å; Y336-F1049 HydrophobicContact CD1-CE1 4.38Å; Y336-F1049 HydrophobicContact CD1-CG 4.15Å; Y336-F1049 HydrophobicContact CD2-CB 3.63Å; Y336-F1049 HydrophobicContact CD2-CD1 4.27Å; Y336-F1049 HydrophobicContact CD2-CG 4.09Å; Y336-F1049 AromaticContact CE1-CD1 3.48Å; Y336-F1049 HydrophobicContact CE1-CD1 3.48Å; Y336-F1049 VanDerWaalsContact CE1-CD1 3.48Å; Y336-F1049 AromaticContact CE1-CE1 3.71Å; Y336-F1049 HydrophobicContact CE1-CE1 3.71Å; Y336-F1049 HydrophobicContact CE1-CG 4.04Å; Y336-F1049 HydrophobicContact CE1-CZ 4.45Å; Y336-F1049 HydrophobicContact CE2-CB 3.66Å; Y336-F1049 AromaticContact CE2-CD1 3.72Å; Y336-F1049 HydrophobicContact CE2-CD1 3.72Å; Y336-F1049 AromaticContact CE2-CG 3.97Å; Y336-F1049 HydrophobicContact CE2-CG 3.97Å; Y336-F1049 HydrophobicContact CG-CB 4.09Å; Y336-F1049 HydrophobicContact CG-CD1 4.4Å; Y336-F1049 HydrophobicContact CG-CG 4.16Å; Y336-F1049 AromaticContact CZ-CD1 3.28Å; Y336-F1049 AromaticContact CZ-CE1 3.89Å; Y336-F1049 AromaticContact CZ-CG 3.94Å; Y336-F1049 WeakPolarHBondContact OH-CD1 3.4Å; Y336-D1052 HydrophobicContact CE2-CB 4.33Å; Y336-L1053 HydrophobicContact CD2-CD1 4.43Å; Y336-L1053 HydrophobicContact CD2-CD2 4.22Å; Y336-L1053 HydrophobicContact CD2-CG 4.08Å
337	F	91.9	Very high	87	Confident	1 Å²	1	37 Å²	37	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-45.5	174.4	-179.7	-86.7	0	0	0	111.1	M284 I287 N288 L291 R307 I315 I319 H333 L334 R341	M284-F337 HydrophobicContact CE-CB 3.94Å; M284-F337 HydrophobicContact CE-CD2 4.17Å; M284-F337 HydrophobicContact CE-CG 4.17Å; I287-F337 HydrophobicContact CG2-CD2 4.09Å; I287-F337 HydrophobicContact CG2-CE2 4.02Å; N288-F337 WeakPolarHBondContact OD1-CB 3.36Å; L291-F337 HydrophobicContact CD1-CD2 3.84Å; L291-F337 HydrophobicContact CD1-CE2 3.61Å; R307-F337 HydrophobicContact CG-CE2 4.39Å; R307-F337 HydrophobicContact CG-CZ 4.07Å; I315-F337 HydrophobicContact CD1-CE2 4.2Å; I315-F337 HydrophobicContact CD1-CZ 4.26Å; I315-F337 HydrophobicContact CG2-CE1 4.46Å; I315-F337 HydrophobicContact CG2-CZ 3.98Å; I319-F337 HydrophobicContact CD1-CD1 3.51Å; I319-F337 HydrophobicContact CD1-CE1 3.54Å; I319-F337 HydrophobicContact CD1-CG 4.22Å; I319-F337 HydrophobicContact CD1-CZ 4.25Å; H333-F337 PolarHBondContact O-N 3.15Å; L334-F337 PolarHBondContact O-N 3.39Å; F337-R341 WeakPolarHBondContact O-CB 3.43Å; F337-R341 PolarHBondContact O-N 2.79Å
338	E	89.6	Confident	86.5	Confident	52 Å²	52	36.3 Å²	36.3	24%	0.243	20%	0.197	C	C	.	.	H	α-helix	trans	-65	-43	174.5	-76	178.6	-148.8	0	0	112.2	R323 L334 Y336 R341 N342	R323-E338 IonicContact CZ-OE1 2.67Å; R323-E338 IonicContact NE-OE1 3.62Å; R323-E338 PolarHBondContact NE-OE1 3.48Å; R323-E338 IonicContact NH2-OE1 3.91Å; R323-E338 PolarHBondContact NH2-OE1 3.3Å; R323-E338 IonicContact NH2-OE2 3.67Å; R323-E338 PolarHBondContact NH2-OE2 2.87Å; L334-E338 PolarHBondContact O-N 2.96Å; Y336-E338 VanDerWaalsContact C-N 3.33Å; Y336-E338 PolarHBondContact O-N 3.16Å; E338-R341 PolarHBondContact O-N 3.03Å; E338-N342 WeakPolarHBondContact O-CB 3.12Å; E338-N342 PolarHBondContact O-N 3.28Å; E338-N342 PolarHBondContact O-ND2 3.23Å
339	M	87.4	Confident	85.9	Confident	9 Å²	9	32.4 Å²	32.4	4%	0.044	17%	0.17	C	C	.	.	H	α-helix	trans	-56.6	-52.7	175.2	-179.9	-167.4	80.3	0	0	110.8	D335 Y336 R341 N342 D343 D1052 L1053 M1056	D335-M339 VanDerWaalsContact O-CB 3.23Å; D335-M339 WeakPolarHBondContact O-CB 3.43Å; D335-M339 PolarHBondContact O-N 3.33Å; Y336-M339 HydrophobicContact CD2-CE 3.46Å; Y336-M339 VanDerWaalsContact CD2-CE 3.46Å; Y336-M339 HydrophobicContact CE2-CE 3.39Å; Y336-M339 PolarHBondContact O-N 3.12Å; M339-R341 VanDerWaalsContact C-N 3.29Å; M339-R341 PolarHBondContact O-N 3.21Å; M339-N342 PolarHBondContact O-N 3.46Å; M339-N342 VanDerWaalsContact O-N 3.15Å; M339-D343 PolarHBondContact O-N 3.22Å; M339-D1052 HydrophobicContact CE-CB 4.01Å; M339-L1053 HydrophobicContact SD-CD2 3.78Å; M339-L1053 HydrophobicContact SD-CG 4.33Å; M339-M1056 HydrophobicContact CB-CE 4.44Å; M339-M1056 HydrophobicContact CG-CB 4.45Å; M339-M1056 HydrophobicContact CG-CE 3.86Å; M339-M1056 HydrophobicContact CG-CG 4.08Å; M339-M1056 HydrophobicContact CG-SD 3.85Å; M339-M1056 HydrophobicContact SD-CB 3.78Å; M339-M1056 HydrophobicContact SD-CG 4.08Å; M339-M1056 HydrophobicContact SD-SD 4.15Å
340	L	85.1	Confident	85.4	Confident	18 Å²	18	38 Å²	38	9%	0.094	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-35.6	-178	-165	74.5	0	0	0	111.7	L291 S292 R307 Y336 D344	L291-L340 HydrophobicContact CB-CD2 4.08Å; S292-L340 VanDerWaalsContact OG-CD2 3.28Å; S292-L340 WeakPolarHBondContact OG-CD2 3.4Å; R307-L340 PolarHBondContact NH2-O 3.18Å; Y336-L340 HydrophobicContact CE1-CD2 4.28Å; Y336-L340 WeakPolarHBondContact O-CB 3.34Å; Y336-L340 PolarHBondContact O-N 2.64Å; L340-D344 WeakPolarHBondContact O-CB 3.26Å; L340-D344 VanDerWaalsContact O-CG 3.22Å; L340-D344 PolarHBondContact O-N 2.85Å; L340-D344 VanDerWaalsContact O-N 3.12Å
341	R	86.9	Confident	84.6	Confident	45 Å²	45	44.8 Å²	44.8	17%	0.17	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-46.8	171.6	179.4	179.7	161.5	-128.6	-31.5	112	F337 E338 M339 D344 E345	F337-R341 WeakPolarHBondContact O-CB 3.43Å; F337-R341 PolarHBondContact O-N 2.79Å; E338-R341 PolarHBondContact O-N 3.03Å; M339-R341 VanDerWaalsContact C-N 3.29Å; M339-R341 PolarHBondContact O-N 3.21Å; R341-D344 PolarHBondContact O-N 2.82Å; R341-E345 WeakPolarHBondContact CG-OE1 3.17Å; R341-E345 IonicContact CZ-OE1 3.48Å; R341-E345 IonicContact NE-OE1 3.82Å; R341-E345 PolarHBondContact NE-OE1 2.94Å; R341-E345 IonicContact NH2-OE1 2.74Å; R341-E345 PolarHBondContact NH2-OE1 3.37Å; R341-E345 IonicContact NH2-OE2 3.49Å; R341-E345 WeakPolarHBondContact O-CG 3.48Å; R341-E345 PolarHBondContact O-N 3.32Å
342	N	84.3	Confident	83.5	Confident	83 Å²	83	45.4 Å²	45.4	44%	0.444	22%	0.218	S	C	.	.	H	α-helix	trans	-65.3	-40.3	179.3	-79	-74.2	0	0	0	112.1	E338 M339 D344 E345 L346	E338-N342 WeakPolarHBondContact O-CB 3.12Å; E338-N342 PolarHBondContact O-N 3.28Å; E338-N342 PolarHBondContact O-ND2 3.23Å; M339-N342 PolarHBondContact O-N 3.46Å; M339-N342 VanDerWaalsContact O-N 3.15Å; N342-D344 VanDerWaalsContact C-N 3.31Å; N342-D344 PolarHBondContact O-N 3.33Å; N342-E345 PolarHBondContact O-N 3.44Å; N342-L346 VanDerWaalsContact O-CB 3.26Å; N342-L346 WeakPolarHBondContact O-CB 3.45Å; N342-L346 PolarHBondContact O-N 2.89Å
343	D	83.8	Confident	82.3	Confident	70 Å²	70	52.3 Å²	52.3	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-67	-32.7	176.2	-83.6	-20.8	0	0	0	111.7	M339 L346 A347	M339-D343 PolarHBondContact O-N 3.22Å; D343-L346 PolarHBondContact O-N 2.83Å; D343-A347 VanDerWaalsContact O-CB 3.28Å; D343-A347 WeakPolarHBondContact O-CB 3.28Å; D343-A347 PolarHBondContact O-N 3.24Å
344	D	85.3	Confident	80.6	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-73.2	-41.3	173.3	-74.8	-9.8	0	0	0	112.8	L300 R303 I304 R307 L340 R341 N342 L346 A347 L348	L300-D344 HydrophobicContact CD1-CB 3.86Å; L300-D344 VanDerWaalsContact CD1-CG 3.5Å; L300-D344 WeakPolarHBondContact CD1-OD1 3.48Å; R303-D344 WeakPolarHBondContact CD-OD2 3.3Å; R303-D344 WeakPolarHBondContact CG-OD2 3.27Å; R303-D344 IonicContact CZ-OD1 2.73Å; R303-D344 VanDerWaalsContact CZ-OD1 3.23Å; R303-D344 IonicContact CZ-OD2 3.23Å; R303-D344 VanDerWaalsContact NE-CG 3.32Å; R303-D344 IonicContact NE-OD1 3.48Å; R303-D344 PolarHBondContact NE-OD1 3.03Å; R303-D344 IonicContact NE-OD2 2.72Å; R303-D344 PolarHBondContact NE-OD2 3.39Å; R303-D344 IonicContact NH2-OD1 2.86Å; R303-D344 PolarHBondContact NH2-OD1 2.86Å; I304-D344 HydrophobicContact CD1-CB 4.44Å; I304-D344 HydrophobicContact CG1-CB 4.13Å; R307-D344 IonicContact CZ-OD2 2.89Å; R307-D344 IonicContact NH1-OD2 3.27Å; R307-D344 PolarHBondContact NH1-OD2 3.49Å; R307-D344 IonicContact NH2-OD2 3.95Å; R307-D344 PolarHBondContact NH2-OD2 3.28Å; L340-D344 WeakPolarHBondContact O-CB 3.26Å; L340-D344 VanDerWaalsContact O-CG 3.22Å; L340-D344 PolarHBondContact O-N 2.85Å; L340-D344 VanDerWaalsContact O-N 3.12Å; R341-D344 PolarHBondContact O-N 2.82Å; N342-D344 VanDerWaalsContact C-N 3.31Å; N342-D344 PolarHBondContact O-N 3.33Å; D344-L346 VanDerWaalsContact C-N 3.26Å; D344-L346 PolarHBondContact O-N 3.36Å; D344-A347 PolarHBondContact O-N 3.24Å; D344-L348 VanDerWaalsContact O-CB 3.28Å; D344-L348 WeakPolarHBondContact O-CB 3.28Å; D344-L348 PolarHBondContact O-N 3.41Å
345	E	79.9	Confident	78.8	Confident	27 Å²	27	60.7 Å²	60.7	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-35.1	171.1	-74.3	175.4	-158.2	0	0	111.3	R341 N342 S349 H356	R341-E345 WeakPolarHBondContact CG-OE1 3.17Å; R341-E345 IonicContact CZ-OE1 3.48Å; R341-E345 IonicContact NE-OE1 3.82Å; R341-E345 PolarHBondContact NE-OE1 2.94Å; R341-E345 IonicContact NH2-OE1 2.74Å; R341-E345 PolarHBondContact NH2-OE1 3.37Å; R341-E345 IonicContact NH2-OE2 3.49Å; R341-E345 WeakPolarHBondContact O-CG 3.48Å; R341-E345 PolarHBondContact O-N 3.32Å; N342-E345 PolarHBondContact O-N 3.44Å; E345-S349 WeakPolarHBondContact O-CB 3.37Å; E345-S349 PolarHBondContact O-N 2.97Å; E345-S349 PolarHBondContact O-OG 3.34Å; E345-H356 IonicContact OE2-CE1 3.84Å
346	L	78.9	Confident	77.4	Confident	79 Å²	79	62.6 Å²	62.6	41%	0.414	31%	0.309	S	S	.	.	H	α-helix	trans	-72.3	-38.6	173.5	-177.7	60.8	0	0	0	112.7	N342 D343 D344 S349 K350	N342-L346 VanDerWaalsContact O-CB 3.26Å; N342-L346 WeakPolarHBondContact O-CB 3.45Å; N342-L346 PolarHBondContact O-N 2.89Å; D343-L346 PolarHBondContact O-N 2.83Å; D344-L346 VanDerWaalsContact C-N 3.26Å; D344-L346 PolarHBondContact O-N 3.36Å; L346-S349 WeakPolarHBondContact CA-OG 3.45Å; L346-S349 PolarHBondContact O-OG 2.96Å; L346-K350 WeakPolarHBondContact O-CB 3.35Å; L346-K350 WeakPolarHBondContact O-CD 3.48Å; L346-K350 WeakPolarHBondContact O-CG 3.48Å; L346-K350 PolarHBondContact O-N 3.5Å
347	A	81.2	Confident	76.1	Confident	32 Å²	32	62.6 Å²	62.6	26%	0.264	31%	0.31	S	S	.	.	H	α-helix	trans	-68.4	-36.9	175.1	0	0	0	0	0	111.7	L300 D343 D344	L300-A347 HydrophobicContact CD1-CB 4.09Å; L300-A347 HydrophobicContact CD2-CB 3.73Å; D343-A347 VanDerWaalsContact O-CB 3.28Å; D343-A347 WeakPolarHBondContact O-CB 3.28Å; D343-A347 PolarHBondContact O-N 3.24Å; D344-A347 PolarHBondContact O-N 3.24Å
348	L	77.4	Confident	74.8	Confident	37 Å²	37	64.9 Å²	64.9	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-68.4	-51.9	175.2	-170.1	68	0	0	0	111.2	I304 D344 K350 R351 F352 I357 T359	I304-L348 HydrophobicContact CD1-CD1 4.4Å; D344-L348 VanDerWaalsContact O-CB 3.28Å; D344-L348 WeakPolarHBondContact O-CB 3.28Å; D344-L348 PolarHBondContact O-N 3.41Å; L348-K350 VanDerWaalsContact C-N 3.29Å; L348-K350 PolarHBondContact O-N 2.81Å; L348-R351 WeakPolarHBondContact O-CB 3.44Å; L348-R351 PolarHBondContact O-N 2.83Å; L348-F352 HydrophobicContact CD1-CD2 4.47Å; L348-F352 HydrophobicContact CD1-CE2 3.91Å; L348-F352 HydrophobicContact CG-CD2 4.39Å; L348-F352 HydrophobicContact CG-CE2 4.25Å; L348-F352 WeakPolarHBondContact O-CD2 3.14Å; L348-I357 HydrophobicContact CD2-CD1 4.19Å; L348-I357 HydrophobicContact CG-CD1 4.01Å; L348-T359 HydrophobicContact CD2-CG2 4.5Å
349	S	73.3	Confident	73.6	Confident	16 Å²	16	65.6 Å²	65.6	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-33.3	-179.7	49.8	0	0	0	0	113.7	E345 L346 R351 F352 E353	E345-S349 WeakPolarHBondContact O-CB 3.37Å; E345-S349 PolarHBondContact O-N 2.97Å; E345-S349 PolarHBondContact O-OG 3.34Å; L346-S349 WeakPolarHBondContact CA-OG 3.45Å; L346-S349 PolarHBondContact O-OG 2.96Å; S349-R351 PolarHBondContact O-N 3.48Å; S349-F352 PolarHBondContact O-N 2.75Å; S349-E353 PolarHBondContact O-N 3.4Å
350	K	76.9	Confident	72.5	Confident	151 Å²	151	72 Å²	72	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-58.5	-26.7	170	-78.4	167.8	-176.4	166.7	0	114.1	L346 L348 F352	L346-K350 WeakPolarHBondContact O-CB 3.35Å; L346-K350 WeakPolarHBondContact O-CD 3.48Å; L346-K350 WeakPolarHBondContact O-CG 3.48Å; L346-K350 PolarHBondContact O-N 3.5Å; L348-K350 VanDerWaalsContact C-N 3.29Å; L348-K350 PolarHBondContact O-N 2.81Å; K350-F352 VanDerWaalsContact C-N 3.34Å
351	R	73.1	Confident	72.1	Confident	145 Å²	145	72.6 Å²	72.6	55%	0.547	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-7.7	176.3	-63.4	177.1	173.3	-168.2	1.6	113.9	E301 L348 S349	E301-R351 IonicContact OE1-CZ 3.93Å; E301-R351 IonicContact OE1-NH1 3.67Å; E301-R351 PolarHBondContact OE1-NH1 3.27Å; E301-R351 IonicContact OE1-NH2 2.67Å; E301-R351 PolarHBondContact OE1-NH2 2.79Å; L348-R351 WeakPolarHBondContact O-CB 3.44Å; L348-R351 PolarHBondContact O-N 2.83Å; S349-R351 PolarHBondContact O-N 3.48Å
352	F	65.5	Low	71.5	Confident	55 Å²	55	74.3 Å²	74.3	24%	0.241	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	3.1	-172.5	-73.9	-73.4	0	0	0	114.6	L348 S349 K350 S354 I357 K372	L348-F352 HydrophobicContact CD1-CD2 4.47Å; L348-F352 HydrophobicContact CD1-CE2 3.91Å; L348-F352 HydrophobicContact CG-CD2 4.39Å; L348-F352 HydrophobicContact CG-CE2 4.25Å; L348-F352 WeakPolarHBondContact O-CD2 3.14Å; S349-F352 PolarHBondContact O-N 2.75Å; K350-F352 VanDerWaalsContact C-N 3.34Å; F352-S354 PolarHBondContact O-N 3.36Å; F352-S354 VanDerWaalsContact O-N 3.08Å; F352-I357 HydrophobicContact CB-CD1 4.31Å; F352-I357 HydrophobicContact CD2-CD1 3.8Å; F352-I357 HydrophobicContact CG-CD1 4.35Å; F352-K372 HydrophobicContact CE1-CB 4.28Å; F352-K372 HydrophobicContact CE1-CD 3.88Å; F352-K372 HydrophobicContact CE1-CG 4.03Å; F352-K372 HydrophobicContact CZ-CD 4.42Å
353	E	63.3	Low	71.2	Confident	185 Å²	185	75 Å²	75	86%	0.864	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	25.8	-178.8	-54.5	-176.6	154.6	0	0	113.4	S349	S349-E353 PolarHBondContact O-N 3.4Å
354	S	57.3	Low	70.9	Confident	28 Å²	28	75.5 Å²	75.5	20%	0.196	40%	0.395	C	S	.	.			trans	-113.6	133	-167.3	58.8	0	0	0	0	112.3	F352 H356 I357	F352-S354 PolarHBondContact O-N 3.36Å; F352-S354 VanDerWaalsContact O-N 3.08Å; S354-H356 PolarHBondContact O-N 3.11Å; S354-I357 WeakPolarHBondContact OG-CG1 3.26Å
355	V	55.6	Low	70.6	Confident	148 Å²	148	77.9 Å²	77.9	90%	0.897	41%	0.409	S	S	*	.	S	Bend	trans	-67.7	118.5	167.3	179.1	0	0	0	0	109
356	H	59.2	Low	70.8	Confident	120 Å²	120	80.5 Å²	80.5	56%	0.556	42%	0.421	S	S	*	.			trans	40.2	107.9	175.8	-171.6	61.4	0	0	0	117.2	E345 S354 D358	E345-H356 IonicContact OE2-CE1 3.84Å; S354-H356 PolarHBondContact O-N 3.11Å; H356-D358 PolarHBondContact O-N 3.19Å
357	I	62.9	Low	70.9	Confident	10 Å²	10	79.7 Å²	79.7	5%	0.051	42%	0.416	C	S	.	.			trans	-84.1	110.5	172.8	-59.2	176	0	0	0	109.2	L348 F352 S354 T359 L368	L348-I357 HydrophobicContact CD2-CD1 4.19Å; L348-I357 HydrophobicContact CG-CD1 4.01Å; F352-I357 HydrophobicContact CB-CD1 4.31Å; F352-I357 HydrophobicContact CD2-CD1 3.8Å; F352-I357 HydrophobicContact CG-CD1 4.35Å; S354-I357 WeakPolarHBondContact OG-CG1 3.26Å; I357-T359 HydrophobicContact CG2-CG2 3.99Å; I357-T359 PolarHBondContact O-N 3.28Å; I357-L368 HydrophobicContact CB-CD1 4.16Å; I357-L368 HydrophobicContact CD1-CD1 4.16Å; I357-L368 HydrophobicContact CG1-CD1 3.79Å; I357-L368 HydrophobicContact CG2-CD1 3.54Å
358	D	64.6	Low	70.8	Confident	49 Å²	49	79.6 Å²	79.6	26%	0.262	41%	0.412	S	S	.	.			trans	-79.2	97	165.1	177.4	20.8	0	0	0	110.3	H356 K360 S361	H356-D358 PolarHBondContact O-N 3.19Å; D358-K360 PolarHBondContact O-N 2.83Å; D358-K360 VanDerWaalsContact O-N 3.14Å; D358-K360 WeakPolarHBondContact OD1-CA 3.31Å; D358-K360 VanDerWaalsContact OD1-CB 3.22Å; D358-K360 WeakPolarHBondContact OD1-CB 3.48Å; D358-K360 PolarHBondContact OD1-N 2.96Å; D358-S361 PolarHBondContact O-N 3.48Å; D358-S361 VanDerWaalsContact OD2-CB 3.26Å; D358-S361 WeakPolarHBondContact OD2-CB 3.41Å; D358-S361 PolarHBondContact OD2-N 3.27Å
359	T	64.4	Low	71.1	Confident	66 Å²	66	81 Å²	81	41%	0.405	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-5.7	176.6	62.5	0	0	0	0	113.5	L348 I357	L348-T359 HydrophobicContact CD2-CG2 4.5Å; I357-T359 HydrophobicContact CG2-CG2 3.99Å; I357-T359 PolarHBondContact O-N 3.28Å
360	K	64.4	Low	71.5	Confident	144 Å²	144	86 Å²	86	63%	0.626	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-21.7	175.3	-52.9	179.4	-179.4	-178.9	0	112.2	D358 A362	D358-K360 PolarHBondContact O-N 2.83Å; D358-K360 VanDerWaalsContact O-N 3.14Å; D358-K360 WeakPolarHBondContact OD1-CA 3.31Å; D358-K360 VanDerWaalsContact OD1-CB 3.22Å; D358-K360 WeakPolarHBondContact OD1-CB 3.48Å; D358-K360 PolarHBondContact OD1-N 2.96Å; K360-A362 PolarHBondContact O-N 3Å
361	S	76.3	Confident	71.8	Confident	30 Å²	30	85.3 Å²	85.3	21%	0.21	43%	0.432	C	S	.	.			trans	-85.5	105	176.5	179.6	0	0	0	0	110.9	D358 T363 Q364 V365	D358-S361 PolarHBondContact O-N 3.48Å; D358-S361 VanDerWaalsContact OD2-CB 3.26Å; D358-S361 WeakPolarHBondContact OD2-CB 3.41Å; D358-S361 PolarHBondContact OD2-N 3.27Å; S361-T363 PolarHBondContact O-N 2.78Å; S361-T363 VanDerWaalsContact O-N 3.16Å; S361-Q364 PolarHBondContact O-N 2.98Å; S361-Q364 PolarHBondContact OG-N 2.88Å; S361-V365 WeakPolarHBondContact O-CG2 3.37Å; S361-V365 PolarHBondContact O-N 3.4Å
362	A	74.1	Confident	72.1	Confident	82 Å²	82	85.2 Å²	85.2	68%	0.678	44%	0.435	S	S	*	.	H	α-helix	trans	-53.5	-34.7	174.5	0	0	0	0	0	112.3	K360 F366	K360-A362 PolarHBondContact O-N 3Å; A362-F366 WeakPolarHBondContact O-CB 3.18Å; A362-F366 PolarHBondContact O-N 2.67Å
363	T	77.5	Confident	72.8	Confident	97 Å²	97	84.6 Å²	84.6	60%	0.595	43%	0.434	S	S	*	.	H	α-helix	trans	-65.9	-47.2	175.5	-46.1	0	0	0	0	111.9	S361 F366 D367	S361-T363 PolarHBondContact O-N 2.78Å; S361-T363 VanDerWaalsContact O-N 3.16Å; T363-F366 PolarHBondContact O-N 3.26Å; T363-D367 WeakPolarHBondContact O-CB 3.48Å; T363-D367 PolarHBondContact O-N 3.31Å
364	Q	78.3	Confident	73.5	Confident	81 Å²	81	80 Å²	80	38%	0.379	42%	0.415	S	S	.	.	H	α-helix	trans	-66.3	-41.1	178.3	-68.5	-172.8	31.6	0	0	112.1	S361 F366 D367 L368	S361-Q364 PolarHBondContact O-N 2.98Å; S361-Q364 PolarHBondContact OG-N 2.88Å; Q364-F366 VanDerWaalsContact C-N 3.34Å; Q364-D367 PolarHBondContact O-N 3.1Å; Q364-L368 WeakPolarHBondContact O-CB 3.46Å; Q364-L368 VanDerWaalsContact O-CG 3.3Å; Q364-L368 WeakPolarHBondContact O-CG 3.2Å; Q364-L368 PolarHBondContact O-N 2.86Å
365	V	78	Confident	74.5	Confident	53 Å²	53	86.7 Å²	86.7	32%	0.321	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-44.7	174.9	174.4	0	0	0	0	110.4	S361 L368 I369	S361-V365 WeakPolarHBondContact O-CG2 3.37Å; S361-V365 PolarHBondContact O-N 3.4Å; V365-L368 PolarHBondContact O-N 3.38Å; V365-I369 HydrophobicContact CG1-CD1 3.93Å; V365-I369 WeakPolarHBondContact O-CD1 3.38Å; V365-I369 VanDerWaalsContact O-CG1 3.26Å; V365-I369 WeakPolarHBondContact O-CG1 3.41Å; V365-I369 PolarHBondContact O-N 3.22Å
366	F	83.8	Confident	75.9	Confident	83 Å²	83	82.4 Å²	82.4	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-43.8	174.6	-176.6	-91	0	0	0	112.3	A362 T363 Q364 I369 R370 F382 L386	A362-F366 WeakPolarHBondContact O-CB 3.18Å; A362-F366 PolarHBondContact O-N 2.67Å; T363-F366 PolarHBondContact O-N 3.26Å; Q364-F366 VanDerWaalsContact C-N 3.34Å; F366-I369 PolarHBondContact O-N 3.48Å; F366-R370 VanDerWaalsContact O-CB 3.22Å; F366-R370 WeakPolarHBondContact O-CB 3.47Å; F366-R370 PolarHBondContact O-N 2.95Å; F366-F382 HydrophobicContact CD2-CZ 4.39Å; F366-F382 HydrophobicContact CE2-CE1 4.47Å; F366-F382 HydrophobicContact CE2-CZ 4.08Å; F366-L386 HydrophobicContact CD2-CD2 4.48Å; F366-L386 HydrophobicContact CE2-CD1 3.54Å; F366-L386 HydrophobicContact CE2-CD2 3.82Å; F366-L386 HydrophobicContact CE2-CG 4.34Å; F366-L386 HydrophobicContact CZ-CD1 3.86Å
367	D	81.6	Confident	77	Confident	61 Å²	61	84.2 Å²	84.2	33%	0.326	44%	0.436	S	S	.	.	H	α-helix	trans	-68.3	-35.2	179.6	-83.8	-33.5	0	0	0	113.5	T363 Q364 R370 K371	T363-D367 WeakPolarHBondContact O-CB 3.48Å; T363-D367 PolarHBondContact O-N 3.31Å; Q364-D367 PolarHBondContact O-N 3.1Å; D367-R370 PolarHBondContact O-N 3.18Å; D367-R370 IonicContact OD1-CZ 3.74Å; D367-R370 IonicContact OD1-NE 2.61Å; D367-R370 PolarHBondContact OD1-NE 2.59Å; D367-R370 IonicContact OD1-NH2 3.67Å; D367-R370 PolarHBondContact OD1-NH2 3.47Å; D367-K371 VanDerWaalsContact O-CB 3.25Å; D367-K371 WeakPolarHBondContact O-CB 3.24Å; D367-K371 PolarHBondContact O-N 2.88Å
368	L	79.2	Confident	77.9	Confident	31 Å²	31	85.8 Å²	85.8	16%	0.162	45%	0.45	C	S	.	.	H	α-helix	trans	-67.9	-41.8	172.9	-72.5	164.3	0	0	0	111.6	I357 Q364 V365 K371 K372	I357-L368 HydrophobicContact CB-CD1 4.16Å; I357-L368 HydrophobicContact CD1-CD1 4.16Å; I357-L368 HydrophobicContact CG1-CD1 3.79Å; I357-L368 HydrophobicContact CG2-CD1 3.54Å; Q364-L368 WeakPolarHBondContact O-CB 3.46Å; Q364-L368 VanDerWaalsContact O-CG 3.3Å; Q364-L368 WeakPolarHBondContact O-CG 3.2Å; Q364-L368 PolarHBondContact O-N 2.86Å; V365-L368 PolarHBondContact O-N 3.38Å; L368-K371 PolarHBondContact O-N 3.14Å; L368-K372 VanDerWaalsContact O-CB 3.3Å; L368-K372 WeakPolarHBondContact O-CB 3.47Å; L368-K372 PolarHBondContact O-N 2.75Å
369	I	83.5	Confident	78.9	Confident	65 Å²	65	87.1 Å²	87.1	33%	0.333	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-47.9	173.3	-64.5	164.4	0	0	0	110	V365 F366 K371 K372 M373 F382	V365-I369 HydrophobicContact CG1-CD1 3.93Å; V365-I369 WeakPolarHBondContact O-CD1 3.38Å; V365-I369 VanDerWaalsContact O-CG1 3.26Å; V365-I369 WeakPolarHBondContact O-CG1 3.41Å; V365-I369 PolarHBondContact O-N 3.22Å; F366-I369 PolarHBondContact O-N 3.48Å; I369-K371 PolarHBondContact O-N 3.19Å; I369-K372 PolarHBondContact O-N 3.3Å; I369-K372 VanDerWaalsContact O-N 3.16Å; I369-M373 HydrophobicContact CG2-CG 4.19Å; I369-M373 HydrophobicContact CG2-SD 3.71Å; I369-M373 WeakPolarHBondContact O-CB 3.31Å; I369-M373 WeakPolarHBondContact O-CG 3.41Å; I369-M373 PolarHBondContact O-N 3.03Å; I369-F382 HydrophobicContact CB-CZ 4.29Å; I369-F382 HydrophobicContact CG2-CD2 4.19Å; I369-F382 HydrophobicContact CG2-CE1 4.03Å; I369-F382 HydrophobicContact CG2-CE2 3.56Å; I369-F382 HydrophobicContact CG2-CZ 3.46Å; I369-F382 VanDerWaalsContact CG2-CZ 3.46Å
370	R	82.9	Confident	79.9	Confident	123 Å²	123	88 Å²	88	46%	0.464	46%	0.459	S	S	.	.	H	α-helix	trans	-55.7	-47.3	176.2	-178.8	169.3	70.9	126.5	-4.1	111.5	F366 D367 M373 N374	F366-R370 VanDerWaalsContact O-CB 3.22Å; F366-R370 WeakPolarHBondContact O-CB 3.47Å; F366-R370 PolarHBondContact O-N 2.95Å; D367-R370 PolarHBondContact O-N 3.18Å; D367-R370 IonicContact OD1-CZ 3.74Å; D367-R370 IonicContact OD1-NE 2.61Å; D367-R370 PolarHBondContact OD1-NE 2.59Å; D367-R370 IonicContact OD1-NH2 3.67Å; D367-R370 PolarHBondContact OD1-NH2 3.47Å; R370-M373 PolarHBondContact O-N 2.97Å; R370-N374 WeakPolarHBondContact O-CB 3.29Å; R370-N374 PolarHBondContact O-N 3.11Å
371	K	82.3	Confident	80.8	Confident	135 Å²	135	87.8 Å²	87.8	59%	0.587	46%	0.46	S	S	*	.	H	α-helix	trans	-63	-42.1	176.3	-173.1	-171.2	175.2	-163	0	111.9	D367 L368 I369	D367-K371 VanDerWaalsContact O-CB 3.25Å; D367-K371 WeakPolarHBondContact O-CB 3.24Å; D367-K371 PolarHBondContact O-N 2.88Å; L368-K371 PolarHBondContact O-N 3.14Å; I369-K371 PolarHBondContact O-N 3.19Å
372	K	78.6	Confident	81.4	Confident	143 Å²	143	87.8 Å²	87.8	62%	0.622	46%	0.456	S	S	*	.	H	α-helix	trans	-67.6	-35.8	179.2	-164.8	-155.3	-171.4	-177	0	112.8	F352 L368 I369	F352-K372 HydrophobicContact CE1-CB 4.28Å; F352-K372 HydrophobicContact CE1-CD 3.88Å; F352-K372 HydrophobicContact CE1-CG 4.03Å; F352-K372 HydrophobicContact CZ-CD 4.42Å; L368-K372 VanDerWaalsContact O-CB 3.3Å; L368-K372 WeakPolarHBondContact O-CB 3.47Å; L368-K372 PolarHBondContact O-N 2.75Å; I369-K372 PolarHBondContact O-N 3.3Å; I369-K372 VanDerWaalsContact O-N 3.16Å
373	M	81.2	Confident	82	Confident	42 Å²	42	86.9 Å²	86.9	21%	0.207	44%	0.439	C	S	.	.	H	α-helix	trans	-94	-18.1	-174.6	-62	-168.3	77.7	0	0	113.3	I369 R370 L375 T376 A378 Y379 F382	I369-M373 HydrophobicContact CG2-CG 4.19Å; I369-M373 HydrophobicContact CG2-SD 3.71Å; I369-M373 WeakPolarHBondContact O-CB 3.31Å; I369-M373 WeakPolarHBondContact O-CG 3.41Å; I369-M373 PolarHBondContact O-N 3.03Å; R370-M373 PolarHBondContact O-N 2.97Å; M373-L375 PolarHBondContact O-N 2.95Å; M373-T376 WeakPolarHBondContact O-CB 3.35Å; M373-T376 PolarHBondContact O-N 3.42Å; M373-T376 VanDerWaalsContact O-N 3.08Å; M373-T376 PolarHBondContact O-OG1 3.23Å; M373-A378 HydrophobicContact CE-CB 3.4Å; M373-Y379 HydrophobicContact CB-CD2 4.18Å; M373-Y379 WeakPolarHBondContact O-CB 3.15Å; M373-F382 HydrophobicContact CE-CB 3.66Å; M373-F382 HydrophobicContact CE-CG 4.28Å; M373-F382 HydrophobicContact SD-CB 3.75Å; M373-F382 HydrophobicContact SD-CD1 4.16Å; M373-F382 HydrophobicContact SD-CD2 3.88Å; M373-F382 HydrophobicContact SD-CG 3.67Å
374	N	77.9	Confident	82.5	Confident	90 Å²	90	84.6 Å²	84.6	48%	0.481	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	139.8	173.1	-170	23.1	0	0	0	110.7	R370 T376	R370-N374 WeakPolarHBondContact O-CB 3.29Å; R370-N374 PolarHBondContact O-N 3.11Å; N374-T376 PolarHBondContact O-N 2.98Å
375	L	78	Confident	83.1	Confident	167 Å²	167	84.4 Å²	84.4	87%	0.874	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	18.8	-173.7	-48	177.7	0	0	0	115.5	M373	M373-L375 PolarHBondContact O-N 2.95Å
376	T	85.8	Confident	83.6	Confident	59 Å²	59	83.8 Å²	83.8	36%	0.362	43%	0.426	S	S	.	.	S	Bend	trans	-111.5	150.8	171.4	74.1	0	0	0	0	111.9	M373 N374 A378 Y379	M373-T376 WeakPolarHBondContact O-CB 3.35Å; M373-T376 PolarHBondContact O-N 3.42Å; M373-T376 VanDerWaalsContact O-N 3.08Å; M373-T376 PolarHBondContact O-OG1 3.23Å; N374-T376 PolarHBondContact O-N 2.98Å; T376-A378 PolarHBondContact O-N 3.21Å; T376-A378 PolarHBondContact OG1-N 2.93Å; T376-Y379 VanDerWaalsContact O-CB 3.28Å; T376-Y379 WeakPolarHBondContact O-CB 3.47Å; T376-Y379 PolarHBondContact O-N 2.93Å
377	D	81	Confident	83.7	Confident	157 Å²	157	84.9 Å²	84.9	84%	0.84	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.1	174.8	-58.3	-51.9	0	0	0	113.3	Y379 P380 H381	D377-Y379 VanDerWaalsContact C-N 3.33Å; D377-P380 WeakPolarHBondContact O-CD 3.38Å; D377-H381 PolarHBondContact O-CD2 3.02Å
378	A	83	Confident	84	Confident	43 Å²	43	87.6 Å²	87.6	36%	0.355	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-13.1	173.9	0	0	0	0	0	113.5	M373 T376 H381 F382	M373-A378 HydrophobicContact CE-CB 3.4Å; T376-A378 PolarHBondContact O-N 3.21Å; T376-A378 PolarHBondContact OG1-N 2.93Å; A378-H381 PolarHBondContact O-N 3.12Å; A378-F382 PolarHBondContact O-N 3.29Å
379	Y	85.3	Confident	84.4	Confident	78 Å²	78	87.7 Å²	87.7	31%	0.306	45%	0.445	S	S	.	.	H	α-helix	trans	-61.2	-45.2	-177.3	-168.2	-100.7	0	0	0	114.4	M373 T376 D377 H381 F382 M383	M373-Y379 HydrophobicContact CB-CD2 4.18Å; M373-Y379 WeakPolarHBondContact O-CB 3.15Å; T376-Y379 VanDerWaalsContact O-CB 3.28Å; T376-Y379 WeakPolarHBondContact O-CB 3.47Å; T376-Y379 PolarHBondContact O-N 2.93Å; D377-Y379 VanDerWaalsContact C-N 3.33Å; Y379-H381 VanDerWaalsContact C-N 3.29Å; Y379-H381 PolarHBondContact O-N 2.94Å; Y379-F382 PolarHBondContact O-N 2.84Å; Y379-M383 HydrophobicContact CD1-CG 4.24Å; Y379-M383 HydrophobicContact CE1-CG 3.86Å; Y379-M383 HydrophobicContact CE1-SD 4.47Å; Y379-M383 PolarHBondContact O-N 2.94Å
380	P	84.3	Confident	84.5	Confident	85 Å²	85	91.3 Å²	91.3	55%	0.552	46%	0.464	S	S	*	.	H	α-helix	trans	-64.9	-34.7	176.5	-19.8	34.4	0	0	0	112	D377 S384	D377-P380 WeakPolarHBondContact O-CD 3.38Å; P380-S384 WeakPolarHBondContact O-CB 3.24Å; P380-S384 PolarHBondContact O-N 3.37Å
381	H	84.5	Confident	84.6	Confident	138 Å²	138	92.3 Å²	92.3	64%	0.639	48%	0.478	S	S	*	.	H	α-helix	trans	-67.9	-40.3	175.2	-62.6	-68.9	0	0	0	111.7	D377 A378 Y379 S384 V385	D377-H381 PolarHBondContact O-CD2 3.02Å; A378-H381 PolarHBondContact O-N 3.12Å; Y379-H381 VanDerWaalsContact C-N 3.29Å; Y379-H381 PolarHBondContact O-N 2.94Å; H381-S384 WeakPolarHBondContact O-CB 3.43Å; H381-S384 PolarHBondContact O-N 3.06Å; H381-V385 WeakPolarHBondContact O-CG2 3.36Å; H381-V385 PolarHBondContact O-N 3.3Å
382	F	88	Confident	84.7	Confident	31 Å²	31	87.8 Å²	87.8	14%	0.136	46%	0.459	C	S	.	.	H	α-helix	trans	-61.9	-47.7	172.6	175.4	-120	0	0	0	112.2	F366 I369 M373 A378 Y379 S384 V385 L386	F366-F382 HydrophobicContact CD2-CZ 4.39Å; F366-F382 HydrophobicContact CE2-CE1 4.47Å; F366-F382 HydrophobicContact CE2-CZ 4.08Å; I369-F382 HydrophobicContact CB-CZ 4.29Å; I369-F382 HydrophobicContact CG2-CD2 4.19Å; I369-F382 HydrophobicContact CG2-CE1 4.03Å; I369-F382 HydrophobicContact CG2-CE2 3.56Å; I369-F382 HydrophobicContact CG2-CZ 3.46Å; I369-F382 VanDerWaalsContact CG2-CZ 3.46Å; M373-F382 HydrophobicContact CE-CB 3.66Å; M373-F382 HydrophobicContact CE-CG 4.28Å; M373-F382 HydrophobicContact SD-CB 3.75Å; M373-F382 HydrophobicContact SD-CD1 4.16Å; M373-F382 HydrophobicContact SD-CD2 3.88Å; M373-F382 HydrophobicContact SD-CG 3.67Å; A378-F382 PolarHBondContact O-N 3.29Å; Y379-F382 PolarHBondContact O-N 2.84Å; F382-S384 VanDerWaalsContact C-N 3.27Å; F382-S384 PolarHBondContact O-N 3.09Å; F382-V385 PolarHBondContact O-N 3.08Å; F382-V385 VanDerWaalsContact O-N 3.12Å; F382-L386 HydrophobicContact CD1-CD1 4.11Å; F382-L386 HydrophobicContact CD2-CG 4.39Å; F382-L386 HydrophobicContact CE1-CD1 3.69Å; F382-L386 HydrophobicContact CE1-CG 4.45Å; F382-L386 HydrophobicContact CE2-CD1 4.17Å; F382-L386 HydrophobicContact CE2-CD2 4.07Å; F382-L386 HydrophobicContact CE2-CG 4.08Å; F382-L386 HydrophobicContact CZ-CD1 3.72Å; F382-L386 HydrophobicContact CZ-CD2 4.14Å; F382-L386 HydrophobicContact CZ-CG 4.12Å; F382-L386 WeakPolarHBondContact O-CG 3.42Å; F382-L386 PolarHBondContact O-N 3.02Å
383	M	86.9	Confident	84.8	Confident	62 Å²	62	84.1 Å²	84.1	31%	0.305	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-38.5	174.3	-71.4	-57.8	-52.9	0	0	112.2	Y379 L386 H387	Y379-M383 HydrophobicContact CD1-CG 4.24Å; Y379-M383 HydrophobicContact CE1-CG 3.86Å; Y379-M383 HydrophobicContact CE1-SD 4.47Å; Y379-M383 PolarHBondContact O-N 2.94Å; M383-L386 PolarHBondContact O-N 3.46Å; M383-L386 HydrophobicContact SD-CD1 4.03Å; M383-H387 VanDerWaalsContact O-CG 3.29Å; M383-H387 PolarHBondContact O-N 3.44Å
384	S	88.9	Confident	84.6	Confident	50 Å²	50	88.9 Å²	88.9	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-45.9	172.7	-171.9	0	0	0	0	112.2	P380 H381 F382 L386 H387 H388	P380-S384 WeakPolarHBondContact O-CB 3.24Å; P380-S384 PolarHBondContact O-N 3.37Å; H381-S384 WeakPolarHBondContact O-CB 3.43Å; H381-S384 PolarHBondContact O-N 3.06Å; F382-S384 VanDerWaalsContact C-N 3.27Å; F382-S384 PolarHBondContact O-N 3.09Å; S384-L386 VanDerWaalsContact C-N 3.33Å; S384-L386 PolarHBondContact O-N 3.42Å; S384-H387 PolarHBondContact O-N 3.35Å; S384-H388 PolarHBondContact O-N 2.68Å; S384-H388 PolarHBondContact O-ND1 3.38Å; S384-H388 PolarHBondContact OG-CE1 3.42Å
385	V	89.8	Confident	84.3	Confident	76 Å²	76	92.3 Å²	92.3	46%	0.461	48%	0.482	S	S	.	.	H	α-helix	trans	-58.5	-44.1	175.3	169.2	0	0	0	0	111	H381 F382 H387 H388 C389	H381-V385 WeakPolarHBondContact O-CG2 3.36Å; H381-V385 PolarHBondContact O-N 3.3Å; F382-V385 PolarHBondContact O-N 3.08Å; F382-V385 VanDerWaalsContact O-N 3.12Å; V385-H387 PolarHBondContact O-N 2.89Å; V385-H388 PolarHBondContact O-N 2.99Å; V385-C389 PolarHBondContact O-N 3.17Å; V385-C389 PolarHBondContact O-SG 3.5Å
386	L	89.2	Confident	83.2	Confident	41 Å²	41	96.7 Å²	96.7	22%	0.215	49%	0.488	C	S	.	.	H	α-helix	trans	-60.5	-42.6	176.1	-66.4	173.9	0	0	0	112.5	F366 F382 M383 S384 H388 C389 L390	F366-L386 HydrophobicContact CD2-CD2 4.48Å; F366-L386 HydrophobicContact CE2-CD1 3.54Å; F366-L386 HydrophobicContact CE2-CD2 3.82Å; F366-L386 HydrophobicContact CE2-CG 4.34Å; F366-L386 HydrophobicContact CZ-CD1 3.86Å; F382-L386 HydrophobicContact CD1-CD1 4.11Å; F382-L386 HydrophobicContact CD2-CG 4.39Å; F382-L386 HydrophobicContact CE1-CD1 3.69Å; F382-L386 HydrophobicContact CE1-CG 4.45Å; F382-L386 HydrophobicContact CE2-CD1 4.17Å; F382-L386 HydrophobicContact CE2-CD2 4.07Å; F382-L386 HydrophobicContact CE2-CG 4.08Å; F382-L386 HydrophobicContact CZ-CD1 3.72Å; F382-L386 HydrophobicContact CZ-CD2 4.14Å; F382-L386 HydrophobicContact CZ-CG 4.12Å; F382-L386 WeakPolarHBondContact O-CG 3.42Å; F382-L386 PolarHBondContact O-N 3.02Å; M383-L386 PolarHBondContact O-N 3.46Å; M383-L386 HydrophobicContact SD-CD1 4.03Å; S384-L386 VanDerWaalsContact C-N 3.33Å; S384-L386 PolarHBondContact O-N 3.42Å; L386-H388 VanDerWaalsContact C-N 3.35Å; L386-H388 PolarHBondContact O-N 2.93Å; L386-C389 PolarHBondContact O-N 3.37Å; L386-L390 WeakPolarHBondContact O-CG 3.31Å; L386-L390 PolarHBondContact O-N 2.92Å
387	H	85.6	Confident	81.8	Confident	106 Å²	106	97.6 Å²	97.6	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-40.2	174.9	-65.9	167	0	0	0	112.1	M383 S384 V385 L390 L391	M383-H387 VanDerWaalsContact O-CG 3.29Å; M383-H387 PolarHBondContact O-N 3.44Å; S384-H387 PolarHBondContact O-N 3.35Å; V385-H387 PolarHBondContact O-N 2.89Å; H387-L390 PolarHBondContact O-N 3.2Å; H387-L391 WeakPolarHBondContact O-CG 3.3Å; H387-L391 PolarHBondContact O-N 2.95Å
388	H	88.4	Confident	80.9	Confident	117 Å²	117	93.5 Å²	93.5	54%	0.542	49%	0.491	S	S	.	.	H	α-helix	trans	-67.9	-38.1	175.2	-69.2	91.3	0	0	0	112.2	S384 V385 L386 L390 L391 M392	S384-H388 PolarHBondContact O-N 2.68Å; S384-H388 PolarHBondContact O-ND1 3.38Å; S384-H388 PolarHBondContact OG-CE1 3.42Å; V385-H388 PolarHBondContact O-N 2.99Å; L386-H388 VanDerWaalsContact C-N 3.35Å; L386-H388 PolarHBondContact O-N 2.93Å; H388-L390 VanDerWaalsContact C-N 3.33Å; H388-L390 PolarHBondContact O-N 2.88Å; H388-L391 PolarHBondContact O-N 3.01Å; H388-L391 VanDerWaalsContact O-N 3.11Å; H388-M392 VanDerWaalsContact O-CG 3.29Å; H388-M392 WeakPolarHBondContact O-CG 3.49Å; H388-M392 PolarHBondContact O-N 2.95Å; H388-M392 VanDerWaalsContact O-N 3.08Å
389	C	87.8	Confident	79.9	Confident	33 Å²	33	97 Å²	97	22%	0.223	50%	0.504	C	S	.	.	H	α-helix	trans	-60.7	-38.5	172.5	-70.8	0	0	0	0	112.7	V385 L386 L391 M392 W404	V385-C389 PolarHBondContact O-N 3.17Å; V385-C389 PolarHBondContact O-SG 3.5Å; L386-C389 PolarHBondContact O-N 3.37Å; C389-L391 VanDerWaalsContact C-N 3.26Å; C389-L391 PolarHBondContact O-N 3.46Å; C389-M392 PolarHBondContact O-N 2.69Å; C389-W404 HydrophobicContact CB-CH2 4.24Å; C389-W404 HydrophobicContact CB-CZ3 4.45Å; C389-W404 WeakPolarHBondContact O-CH2 3.47Å
390	L	85.9	Confident	79.5	Confident	141 Å²	141	93.9 Å²	93.9	74%	0.738	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-28.5	174.1	-72.3	170.6	0	0	0	113.1	L386 H387 H388	L386-L390 WeakPolarHBondContact O-CG 3.31Å; L386-L390 PolarHBondContact O-N 2.92Å; H387-L390 PolarHBondContact O-N 3.2Å; H388-L390 VanDerWaalsContact C-N 3.33Å; H388-L390 PolarHBondContact O-N 2.88Å
391	L	85.4	Confident	79	Confident	144 Å²	144	93.3 Å²	93.3	75%	0.754	49%	0.488	S	S	*	.	H	α-helix	trans	-87.1	-12.5	177.9	-65.4	173.6	0	0	0	113.5	H387 H388 C389	H387-L391 WeakPolarHBondContact O-CG 3.3Å; H387-L391 PolarHBondContact O-N 2.95Å; H388-L391 PolarHBondContact O-N 3.01Å; H388-L391 VanDerWaalsContact O-N 3.11Å; C389-L391 VanDerWaalsContact C-N 3.26Å; C389-L391 PolarHBondContact O-N 3.46Å
392	M	83.3	Confident	78.8	Confident	40 Å²	40	92.3 Å²	92.3	20%	0.197	48%	0.483	C	S	.	.	S	Bend	trans	-67.6	142.1	-178.4	-72.5	-139.1	-61.8	0	0	112.1	H388 C389 H394 W404 L407	H388-M392 VanDerWaalsContact O-CG 3.29Å; H388-M392 WeakPolarHBondContact O-CG 3.49Å; H388-M392 PolarHBondContact O-N 2.95Å; H388-M392 VanDerWaalsContact O-N 3.08Å; C389-M392 PolarHBondContact O-N 2.69Å; M392-H394 PolarHBondContact O-N 3.31Å; M392-W404 HydrophobicContact CB-CH2 4.18Å; M392-W404 HydrophobicContact CB-CZ2 3.6Å; M392-W404 HydrophobicContact CE-CD2 3.55Å; M392-W404 HydrophobicContact CE-CE3 3.5Å; M392-W404 HydrophobicContact CE-CG 4.19Å; M392-W404 HydrophobicContact CE-CH2 3.87Å; M392-W404 HydrophobicContact CE-CZ2 3.91Å; M392-W404 HydrophobicContact CE-CZ3 3.66Å; M392-L407 HydrophobicContact CE-CB 4.32Å; M392-L407 HydrophobicContact CE-CD2 3.6Å
393	P	80.6	Confident	78.4	Confident	67 Å²	67	97 Å²	97	44%	0.435	50%	0.501	S	S	.	.			trans	-57.3	136.1	176.7	-24.8	34.7	0	0	0	111.9	T400 W404	P393-T400 VanDerWaalsContact C-CG2 3.44Å; P393-T400 HydrophobicContact CB-CG2 3.97Å; P393-T400 WeakPolarHBondContact O-CG2 3.39Å; P393-W404 PolarHBondContact O-NE1 3.15Å
394	H	76.2	Confident	78.2	Confident	141 Å²	141	98.9 Å²	98.9	65%	0.653	51%	0.505	S	S	*	.			trans	-129.8	-7.4	-179.9	57.2	-96.8	0	0	0	113.7	M392	M392-H394 PolarHBondContact O-N 3.31Å
395	K	71.6	Confident	77.6	Confident	162 Å²	162	99.3 Å²	99.3	70%	0.704	50%	0.503	S	S	*	.	S	Bend	trans	-71.9	138.9	178.4	-67.2	-176.9	178.1	179.4	0	110.8	S397 T400	K395-S397 VanDerWaalsContact C-N 3.3Å; K395-S397 PolarHBondContact O-N 2.88Å; K395-T400 WeakPolarHBondContact O-CB 3.3Å; K395-T400 VanDerWaalsContact O-CG2 3.27Å; K395-T400 WeakPolarHBondContact O-CG2 3.44Å; K395-T400 PolarHBondContact O-OG1 3.44Å
396	R	56.1	Low	77.2	Confident	260 Å²	260	99.9 Å²	99.9	98%	0.981	50%	0.503	S	S	*	.			trans	-66	80.6	176.3	-72.4	-176.1	175.9	177.8	-1.8	112.2
397	S	55.8	Low	77	Confident	77 Å²	77	100.5 Å²	100.5	54%	0.538	51%	0.506	S	S	.	.	S	Bend	trans	-119.1	158.3	155.9	67.5	0	0	0	0	108.7	K395 N399 T400	K395-S397 VanDerWaalsContact C-N 3.3Å; K395-S397 PolarHBondContact O-N 2.88Å; S397-N399 VanDerWaalsContact C-N 3.27Å; S397-N399 PolarHBondContact O-N 3Å; S397-T400 PolarHBondContact O-N 3.33Å; S397-T400 VanDerWaalsContact O-N 3.09Å; S397-T400 PolarHBondContact O-OG1 3.27Å; S397-T400 PolarHBondContact OG-OG1 3.08Å; S397-T400 VanDerWaalsContact OG-OG1 3.12Å
398	G	61.6	Low	76.7	Confident	71 Å²	71	98.5 Å²	98.5	73%	0.732	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.2	-160	0	0	0	0	0	116.1
399	N	63	Low	76.2	Confident	118 Å²	118	96.1 Å²	96.1	63%	0.631	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-7.9	-174	-63.5	0.9	0	0	0	113.9	S397 V401 Q402	S397-N399 VanDerWaalsContact C-N 3.27Å; S397-N399 PolarHBondContact O-N 3Å; N399-V401 VanDerWaalsContact C-N 3.29Å; N399-V401 PolarHBondContact O-N 2.65Å; N399-Q402 WeakPolarHBondContact O-CB 3.36Å; N399-Q402 PolarHBondContact O-N 2.98Å
400	T	75.8	Confident	76	Confident	12 Å²	12	97.2 Å²	97.2	7%	0.074	49%	0.488	C	S	.	.	H	α-helix	trans	-57.9	-39.7	-175.6	-66.3	0	0	0	0	113	P393 K395 S397 Q402 Y403	P393-T400 VanDerWaalsContact C-CG2 3.44Å; P393-T400 HydrophobicContact CB-CG2 3.97Å; P393-T400 WeakPolarHBondContact O-CG2 3.39Å; K395-T400 WeakPolarHBondContact O-CB 3.3Å; K395-T400 VanDerWaalsContact O-CG2 3.27Å; K395-T400 WeakPolarHBondContact O-CG2 3.44Å; K395-T400 PolarHBondContact O-OG1 3.44Å; S397-T400 PolarHBondContact O-N 3.33Å; S397-T400 VanDerWaalsContact O-N 3.09Å; S397-T400 PolarHBondContact O-OG1 3.27Å; S397-T400 PolarHBondContact OG-OG1 3.08Å; S397-T400 VanDerWaalsContact OG-OG1 3.12Å; T400-Q402 PolarHBondContact O-N 3.48Å; T400-Y403 PolarHBondContact O-N 3.39Å
401	V	75.8	Confident	75.9	Confident	73 Å²	73	94 Å²	94	44%	0.442	47%	0.474	S	S	.	.	H	α-helix	trans	-67.3	-25.4	-178.7	-177.4	0	0	0	0	111.8	N399 Y403 W404 L405	N399-V401 VanDerWaalsContact C-N 3.29Å; N399-V401 PolarHBondContact O-N 2.65Å; V401-Y403 VanDerWaalsContact C-N 3.32Å; V401-Y403 PolarHBondContact O-N 3.2Å; V401-W404 PolarHBondContact O-N 2.78Å; V401-L405 HydrophobicContact CG1-CD1 3.94Å; V401-L405 HydrophobicContact CG1-CG 4.15Å; V401-L405 WeakPolarHBondContact O-CG 3.35Å; V401-L405 PolarHBondContact O-N 3.46Å
402	Q	78.6	Confident	75.6	Confident	116 Å²	116	88.2 Å²	88.2	54%	0.542	44%	0.443	S	S	.	.	H	α-helix	trans	-67.1	-31.6	-177.5	-56	-66	9.2	0	0	112.6	N399 T400 L405 L406	N399-Q402 WeakPolarHBondContact O-CB 3.36Å; N399-Q402 PolarHBondContact O-N 2.98Å; T400-Q402 PolarHBondContact O-N 3.48Å; Q402-L405 PolarHBondContact O-N 3.39Å; Q402-L406 WeakPolarHBondContact O-CB 3.2Å; Q402-L406 PolarHBondContact O-N 2.83Å
403	Y	80.4	Confident	75.3	Confident	131 Å²	131	86.8 Å²	86.8	51%	0.514	44%	0.436	S	S	.	.	H	α-helix	trans	-65.6	-40.7	175.2	-62.1	-78.1	0	0	0	112.1	T400 V401 L406 L407	T400-Y403 PolarHBondContact O-N 3.39Å; V401-Y403 VanDerWaalsContact C-N 3.32Å; V401-Y403 PolarHBondContact O-N 3.2Å; Y403-L406 PolarHBondContact O-N 2.89Å; Y403-L407 PolarHBondContact O-N 3.14Å
404	W	82.8	Confident	75.3	Confident	100 Å²	100	89.6 Å²	89.6	38%	0.379	45%	0.445	S	S	.	.	H	α-helix	trans	-70.7	-38.1	176.3	-66.7	93.6	0	0	0	112.2	C389 M392 P393 V401 L407 D408	C389-W404 HydrophobicContact CB-CH2 4.24Å; C389-W404 HydrophobicContact CB-CZ3 4.45Å; C389-W404 WeakPolarHBondContact O-CH2 3.47Å; M392-W404 HydrophobicContact CB-CH2 4.18Å; M392-W404 HydrophobicContact CB-CZ2 3.6Å; M392-W404 HydrophobicContact CE-CD2 3.55Å; M392-W404 HydrophobicContact CE-CE3 3.5Å; M392-W404 HydrophobicContact CE-CG 4.19Å; M392-W404 HydrophobicContact CE-CH2 3.87Å; M392-W404 HydrophobicContact CE-CZ2 3.91Å; M392-W404 HydrophobicContact CE-CZ3 3.66Å; P393-W404 PolarHBondContact O-NE1 3.15Å; V401-W404 PolarHBondContact O-N 2.78Å; W404-L407 HydrophobicContact CE3-CD2 4.46Å; W404-L407 PolarHBondContact O-N 3.12Å; W404-D408 WeakPolarHBondContact O-CB 3.47Å; W404-D408 PolarHBondContact O-N 3.14Å
405	L	76.8	Confident	75.6	Confident	59 Å²	59	87.1 Å²	87.1	31%	0.309	44%	0.44	S	S	.	.	H	α-helix	trans	-65.2	-38.9	172.8	-70.3	170.6	0	0	0	111.9	V401 Q402 D408 R409	V401-L405 HydrophobicContact CG1-CD1 3.94Å; V401-L405 HydrophobicContact CG1-CG 4.15Å; V401-L405 WeakPolarHBondContact O-CG 3.35Å; V401-L405 PolarHBondContact O-N 3.46Å; Q402-L405 PolarHBondContact O-N 3.39Å; L405-D408 PolarHBondContact O-N 2.76Å; L405-R409 WeakPolarHBondContact O-CG 3.42Å; L405-R409 PolarHBondContact O-N 3.29Å
406	L	80.8	Confident	76	Confident	89 Å²	89	80 Å²	80	47%	0.466	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-43.9	175.3	179.5	60.1	0	0	0	111.5	Q402 Y403 R409 I410 L429	Q402-L406 WeakPolarHBondContact O-CB 3.2Å; Q402-L406 PolarHBondContact O-N 2.83Å; Y403-L406 PolarHBondContact O-N 2.89Å; L406-R409 PolarHBondContact O-N 3.44Å; L406-I410 HydrophobicContact CD1-CD1 3.95Å; L406-I410 HydrophobicContact CD1-CG1 4.26Å; L406-I410 HydrophobicContact CG-CD1 3.9Å; L406-I410 VanDerWaalsContact O-CG1 3.29Å; L406-I410 WeakPolarHBondContact O-CG1 3.45Å; L406-I410 PolarHBondContact O-N 2.98Å; L406-L429 HydrophobicContact CD1-CD2 4.4Å
407	L	84.5	Confident	77.2	Confident	54 Å²	54	69.2 Å²	69.2	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-47	174.5	177.6	61.2	0	0	0	111.5	M392 Y403 W404 I410 V411	M392-L407 HydrophobicContact CE-CB 4.32Å; M392-L407 HydrophobicContact CE-CD2 3.6Å; Y403-L407 PolarHBondContact O-N 3.14Å; W404-L407 HydrophobicContact CE3-CD2 4.46Å; W404-L407 PolarHBondContact O-N 3.12Å; L407-I410 PolarHBondContact O-N 3.41Å; L407-V411 HydrophobicContact CD1-CG2 4.16Å; L407-V411 WeakPolarHBondContact O-CG2 3.48Å; L407-V411 PolarHBondContact O-N 3.46Å
408	D	79.6	Confident	78.1	Confident	64 Å²	64	69.1 Å²	69.1	34%	0.342	36%	0.363	S	S	.	.	H	α-helix	trans	-57.2	-48.4	176	175.4	54.6	0	0	0	112	W404 L405 I410 V411 Q412	W404-D408 WeakPolarHBondContact O-CB 3.47Å; W404-D408 PolarHBondContact O-N 3.14Å; L405-D408 PolarHBondContact O-N 2.76Å; D408-I410 PolarHBondContact O-N 3.18Å; D408-V411 PolarHBondContact O-N 2.96Å; D408-Q412 WeakPolarHBondContact O-CG 3.42Å; D408-Q412 PolarHBondContact O-N 3.24Å; D408-Q412 PolarHBondContact OD1-NE2 3.39Å; D408-Q412 PolarHBondContact OD2-NE2 3.39Å
409	R	78.5	Confident	78.3	Confident	67 Å²	67	72.4 Å²	72.4	25%	0.253	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-38.8	176.2	-65.7	-46	-173.9	-174.1	-0.4	113	L405 L406 Q412 Q413 L429	L405-R409 WeakPolarHBondContact O-CG 3.42Å; L405-R409 PolarHBondContact O-N 3.29Å; L406-R409 PolarHBondContact O-N 3.44Å; R409-Q412 PolarHBondContact O-N 3.3Å; R409-Q413 WeakPolarHBondContact O-CG 3.46Å; R409-Q413 PolarHBondContact O-N 3.2Å; R409-L429 HydrophobicContact CB-CD1 3.89Å
410	I	82.3	Confident	78.5	Confident	56 Å²	56	75 Å²	75	29%	0.287	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-43.1	176	-69.4	166.6	0	0	0	111	L406 L407 D408 Q412 Q413 M414 L429 F432	L406-I410 HydrophobicContact CD1-CD1 3.95Å; L406-I410 HydrophobicContact CD1-CG1 4.26Å; L406-I410 HydrophobicContact CG-CD1 3.9Å; L406-I410 VanDerWaalsContact O-CG1 3.29Å; L406-I410 WeakPolarHBondContact O-CG1 3.45Å; L406-I410 PolarHBondContact O-N 2.98Å; L407-I410 PolarHBondContact O-N 3.41Å; D408-I410 PolarHBondContact O-N 3.18Å; I410-Q412 VanDerWaalsContact C-N 3.32Å; I410-Q412 PolarHBondContact O-N 2.99Å; I410-Q413 WeakPolarHBondContact O-CB 3.46Å; I410-Q413 PolarHBondContact O-N 3.49Å; I410-M414 HydrophobicContact CG2-SD 4.34Å; I410-M414 WeakPolarHBondContact O-CG 3.45Å; I410-M414 PolarHBondContact O-N 2.89Å; I410-M414 VanDerWaalsContact O-N 3.08Å; I410-L429 HydrophobicContact CG1-CD1 4.11Å; I410-F432 HydrophobicContact CG2-CZ 4.29Å
411	V	85.4	Confident	78.1	Confident	73 Å²	73	74.8 Å²	74.8	44%	0.442	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-38.4	176.8	171.3	0	0	0	0	111.2	L407 D408 M414 V415	L407-V411 HydrophobicContact CD1-CG2 4.16Å; L407-V411 WeakPolarHBondContact O-CG2 3.48Å; L407-V411 PolarHBondContact O-N 3.46Å; D408-V411 PolarHBondContact O-N 2.96Å; V411-M414 PolarHBondContact O-N 3.09Å; V411-V415 WeakPolarHBondContact O-CG2 3.29Å; V411-V415 PolarHBondContact O-N 3.39Å
412	Q	77.8	Confident	77.9	Confident	23 Å²	23	77.2 Å²	77.2	11%	0.107	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-45.8	173.4	-70.1	160.9	14.3	0	0	111.7	D408 R409 I410 M414 V415 L416	D408-Q412 WeakPolarHBondContact O-CG 3.42Å; D408-Q412 PolarHBondContact O-N 3.24Å; D408-Q412 PolarHBondContact OD1-NE2 3.39Å; D408-Q412 PolarHBondContact OD2-NE2 3.39Å; R409-Q412 PolarHBondContact O-N 3.3Å; I410-Q412 VanDerWaalsContact C-N 3.32Å; I410-Q412 PolarHBondContact O-N 2.99Å; Q412-M414 VanDerWaalsContact C-N 3.27Å; Q412-M414 PolarHBondContact O-N 3.44Å; Q412-V415 PolarHBondContact O-N 2.99Å; Q412-L416 HydrophobicContact CB-CD1 4.44Å; Q412-L416 WeakPolarHBondContact O-CG 3.42Å; Q412-L416 PolarHBondContact O-N 3.16Å
413	Q	77.8	Confident	77.6	Confident	10 Å²	10	73.3 Å²	73.3	5%	0.047	36%	0.36	C	S	.	.	H	α-helix	trans	-57.6	-38.4	174.3	-69.4	-54.4	-74	0	0	112.9	R409 I410 V415 Q417 D423 L429 F432 V434	R409-Q413 WeakPolarHBondContact O-CG 3.46Å; R409-Q413 PolarHBondContact O-N 3.2Å; I410-Q413 WeakPolarHBondContact O-CB 3.46Å; I410-Q413 PolarHBondContact O-N 3.49Å; Q413-V415 PolarHBondContact O-N 3.08Å; Q413-Q417 WeakPolarHBondContact O-CG 3.45Å; Q413-D423 PolarHBondContact NE2-OD2 3.27Å; Q413-D423 PolarHBondContact OE1-OD2 3.37Å; Q413-L429 HydrophobicContact CG-CB 4.4Å; Q413-L429 HydrophobicContact CG-CD1 3.95Å; Q413-F432 HydrophobicContact CB-CD1 3.68Å; Q413-F432 HydrophobicContact CB-CE1 3.77Å; Q413-F432 HydrophobicContact CG-CD1 3.79Å; Q413-F432 HydrophobicContact CG-CE1 4.31Å; Q413-V434 HydrophobicContact CB-CG2 4.27Å
414	M	79.4	Confident	77.2	Confident	126 Å²	126	68.8 Å²	68.8	62%	0.621	35%	0.346	S	S	*	.	H	α-helix	trans	-70.5	-16.1	177.1	-68.2	178.2	67.2	0	0	114.3	I410 V411 Q412 V434	I410-M414 HydrophobicContact CG2-SD 4.34Å; I410-M414 WeakPolarHBondContact O-CG 3.45Å; I410-M414 PolarHBondContact O-N 2.89Å; I410-M414 VanDerWaalsContact O-N 3.08Å; V411-M414 PolarHBondContact O-N 3.09Å; Q412-M414 VanDerWaalsContact C-N 3.27Å; Q412-M414 PolarHBondContact O-N 3.44Å; M414-V434 HydrophobicContact CG-CG1 4.37Å; M414-V434 HydrophobicContact CG-CG2 4.21Å
415	V	82.6	Confident	76.7	Confident	89 Å²	89	64.5 Å²	64.5	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-104.7	-34.9	-177.2	171.4	0	0	0	0	112.7	V411 Q412 Q413	V411-V415 WeakPolarHBondContact O-CG2 3.29Å; V411-V415 PolarHBondContact O-N 3.39Å; Q412-V415 PolarHBondContact O-N 2.99Å; Q413-V415 PolarHBondContact O-N 3.08Å
416	L	81.4	Confident	76.2	Confident	13 Å²	13	64.3 Å²	64.3	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-90.9	-29.4	-171.8	-62.5	174.8	0	0	0	114.2	F302 H305 Q412 N418 D423 P424 D425	F302-L416 HydrophobicContact CB-CD2 4.3Å; H305-L416 HydrophobicContact CB-CD2 3.98Å; Q412-L416 HydrophobicContact CB-CD1 4.44Å; Q412-L416 WeakPolarHBondContact O-CG 3.42Å; Q412-L416 PolarHBondContact O-N 3.16Å; L416-N418 PolarHBondContact O-N 3.21Å; L416-D423 VanDerWaalsContact CB-OD1 3.29Å; L416-D423 WeakPolarHBondContact CB-OD1 3.46Å; L416-P424 HydrophobicContact CB-CG 4.49Å; L416-P424 WeakPolarHBondContact O-CD 3.39Å; L416-D425 HydrophobicContact CD1-CB 4.33Å
417	Q	80.2	Confident	75.2	Confident	32 Å²	32	61.3 Å²	61.3	15%	0.15	32%	0.318	C	S	.	.			trans	-62.8	124.9	-174.1	-74.5	-175.8	17.6	0	0	112.9	Q413 D423 F432	Q413-Q417 WeakPolarHBondContact O-CG 3.45Å; Q417-D423 HydrophobicContact CG-CB 4.11Å; Q417-F432 PolarHBondContact NE2-O 2.86Å
418	N	74.5	Confident	73.8	Confident	75 Å²	75	62.5 Å²	62.5	40%	0.401	33%	0.329	S	S	.	.			trans	-75.4	-176.8	-177.2	74.1	25.2	0	0	0	113.1	L416 K420 G421 H422	L416-N418 PolarHBondContact O-N 3.21Å; N418-K420 PolarHBondContact O-N 3.14Å; N418-K420 WeakPolarHBondContact OD1-CA 3.44Å; N418-K420 PolarHBondContact OD1-N 2.79Å; N418-G421 WeakPolarHBondContact O-CA 3.48Å; N418-G421 PolarHBondContact O-N 3.38Å; N418-G421 PolarHBondContact OD1-N 3.22Å; N418-H422 PolarHBondContact N-O 3.07Å; N418-H422 PolarHBondContact ND2-O 2.74Å; N418-H422 PolarHBondContact OD1-N 3.46Å; N418-H422 PolarHBondContact OD1-O 2.71Å
419	D	67.4	Low	73.1	Confident	141 Å²	141	61.8 Å²	61.8	75%	0.754	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-17.5	-175	-98.6	-46	0	0	0	115.6	K435	D419-K435 VanDerWaalsContact CA-NZ 3.33Å; D419-K435 WeakPolarHBondContact O-CD 3.23Å; D419-K435 WeakPolarHBondContact O-CE 3.49Å; D419-K435 PolarHBondContact O-NZ 3Å; D419-K435 IonicContact OD1-NZ 3.45Å; D419-K435 PolarHBondContact OD1-NZ 3.29Å
420	K	66.9	Low	72.1	Confident	171 Å²	171	65.7 Å²	65.7	74%	0.743	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	10.3	173.8	-58.4	-177.8	-177	178.2	0	112.5	N418 H422	N418-K420 PolarHBondContact O-N 3.14Å; N418-K420 WeakPolarHBondContact OD1-CA 3.44Å; N418-K420 PolarHBondContact OD1-N 2.79Å; K420-H422 PolarHBondContact O-N 3.01Å; K420-H422 PolarHBondContact O-ND1 2.98Å
421	G	67.2	Low	71.1	Confident	9 Å²	9	70.8 Å²	70.8	9%	0.093	37%	0.373	C	S	.	.	S	Bend	trans	63.2	26.9	-176.7	0	0	0	0	0	113.6	N418 N433	N418-G421 WeakPolarHBondContact O-CA 3.48Å; N418-G421 PolarHBondContact O-N 3.38Å; N418-G421 PolarHBondContact OD1-N 3.22Å; G421-N433 PolarHBondContact O-ND2 2.6Å
422	H	71.3	Confident	70.3	Confident	124 Å²	124	70.7 Å²	70.7	57%	0.574	37%	0.367	S	S	*	.			trans	-99	134.1	171.5	-65.5	46.4	0	0	0	108.3	N418 K420	N418-H422 PolarHBondContact N-O 3.07Å; N418-H422 PolarHBondContact ND2-O 2.74Å; N418-H422 PolarHBondContact OD1-N 3.46Å; N418-H422 PolarHBondContact OD1-O 2.71Å; K420-H422 PolarHBondContact O-N 3.01Å; K420-H422 PolarHBondContact O-ND1 2.98Å
423	D	72.1	Confident	70.1	Confident	34 Å²	34	71.5 Å²	71.5	18%	0.182	37%	0.372	C	S	.	.			trans	-83	131.2	172.3	-162.1	-28.4	0	0	0	109.8	Q413 L416 Q417 D425	Q413-D423 PolarHBondContact NE2-OD2 3.27Å; Q413-D423 PolarHBondContact OE1-OD2 3.37Å; L416-D423 VanDerWaalsContact CB-OD1 3.29Å; L416-D423 WeakPolarHBondContact CB-OD1 3.46Å; Q417-D423 HydrophobicContact CG-CB 4.11Å; D423-D425 VanDerWaalsContact CB-O 3.3Å; D423-D425 WeakPolarHBondContact CB-O 3.33Å; D423-D425 PolarHBondContact OD1-N 3.42Å
424	P	72.4	Confident	70.2	Confident	35 Å²	35	72.2 Å²	72.2	23%	0.227	38%	0.377	C	S	.	.	S	Bend	trans	-65.1	-21.3	167.3	25.6	-34.1	0	0	0	113.9	A295 F302 L416	A295-P424 HydrophobicContact CB-CB 3.74Å; F302-P424 HydrophobicContact CB-CG 4.23Å; F302-P424 HydrophobicContact CD2-CB 3.77Å; F302-P424 HydrophobicContact CD2-CG 3.73Å; F302-P424 HydrophobicContact CE2-CB 4.18Å; F302-P424 HydrophobicContact CG-CB 4.32Å; F302-P424 HydrophobicContact CG-CG 4.26Å; L416-P424 HydrophobicContact CB-CG 4.49Å; L416-P424 WeakPolarHBondContact O-CD 3.39Å
425	D	71.1	Confident	70	Confident	11 Å²	11	70.3 Å²	70.3	6%	0.059	37%	0.365	C	S	.	.	S	Bend	trans	-99.1	146.9	170	-157.6	2.5	0	0	0	112	R258 F302 H305 L416 D423 A427	R258-D425 IonicContact CZ-OD1 3.18Å; R258-D425 IonicContact CZ-OD2 2.73Å; R258-D425 IonicContact NH1-OD1 3.76Å; R258-D425 PolarHBondContact NH1-OD1 3.45Å; R258-D425 IonicContact NH1-OD2 2.67Å; R258-D425 PolarHBondContact NH1-OD2 3.26Å; R258-D425 IonicContact NH2-OD1 2.75Å; R258-D425 PolarHBondContact NH2-OD1 2.94Å; R258-D425 IonicContact NH2-OD2 2.65Å; R258-D425 PolarHBondContact NH2-OD2 3.41Å; F302-D425 HydrophobicContact CD2-CB 4.26Å; F302-D425 HydrophobicContact CE2-CB 3.81Å; H305-D425 IonicContact CD2-OD2 3.77Å; H305-D425 IonicContact NE2-OD2 2.7Å; L416-D425 HydrophobicContact CD1-CB 4.33Å; D423-D425 VanDerWaalsContact CB-O 3.3Å; D423-D425 WeakPolarHBondContact CB-O 3.33Å; D423-D425 PolarHBondContact OD1-N 3.42Å; D425-A427 VanDerWaalsContact C-N 3.32Å; D425-A427 PolarHBondContact O-N 3.17Å
426	I	67.6	Low	69.7	Low	55 Å²	55	69.6 Å²	69.6	28%	0.282	36%	0.358	S	S	.	.			trans	-88.8	74.4	-178.9	-54.6	84.3	0	0	0	108.9	K240 L243 E244 L247	K240-I426 HydrophobicContact CG-CD1 3.95Å; L243-I426 HydrophobicContact CB-CD1 4.23Å; E244-I426 HydrophobicContact CG-CB 4.44Å; E244-I426 HydrophobicContact CG-CD1 3.73Å; E244-I426 HydrophobicContact CG-CG1 3.74Å; L247-I426 HydrophobicContact CD1-CB 3.84Å; L247-I426 HydrophobicContact CD1-CG2 4.38Å; L247-I426 WeakPolarHBondContact CD1-O 3.28Å
427	A	58.2	Low	69.5	Low	26 Å²	26	72 Å²	72	22%	0.215	37%	0.374	C	S	.	.			trans	-72.9	149.6	-175.1	0	0	0	0	0	113.6	D425 L429	D425-A427 VanDerWaalsContact C-N 3.32Å; D425-A427 PolarHBondContact O-N 3.17Å; A427-L429 PolarHBondContact O-N 3.05Å
428	P	56.7	Low	69.3	Low	79 Å²	79	74.1 Å²	74.1	51%	0.513	39%	0.389	S	S	.	.	S	Bend	trans	-68.5	-1.6	-180	-21.6	34	0	0	0	116.7	E430	P428-E430 VanDerWaalsContact C-N 3.29Å; P428-E430 PolarHBondContact O-N 2.86Å
429	L	64	Low	69.3	Low	49 Å²	49	77.5 Å²	77.5	26%	0.257	40%	0.396	S	S	.	.			trans	-91.5	60.7	179.1	-69.4	175.9	0	0	0	110.8	L406 R409 I410 Q413 A427 N431 F432	L406-L429 HydrophobicContact CD1-CD2 4.4Å; R409-L429 HydrophobicContact CB-CD1 3.89Å; I410-L429 HydrophobicContact CG1-CD1 4.11Å; Q413-L429 HydrophobicContact CG-CB 4.4Å; Q413-L429 HydrophobicContact CG-CD1 3.95Å; A427-L429 PolarHBondContact O-N 3.05Å; L429-N431 PolarHBondContact O-N 3.45Å; L429-F432 HydrophobicContact CB-CB 4.06Å; L429-F432 WeakPolarHBondContact O-CB 3.42Å; L429-F432 PolarHBondContact O-N 3.24Å; L429-F432 VanDerWaalsContact O-N 3.1Å
430	E	57.3	Low	69.3	Low	148 Å²	148	77.3 Å²	77.3	69%	0.692	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	130.5	178.8	-66.9	176.6	-159	0	0	111.1	P428 F432	P428-E430 VanDerWaalsContact C-N 3.29Å; P428-E430 PolarHBondContact O-N 2.86Å; E430-F432 PolarHBondContact O-N 2.93Å
431	N	61.5	Low	69.5	Low	163 Å²	163	73.8 Å²	73.8	87%	0.872	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	3.1	-177.4	-46.1	-75.7	0	0	0	117.6	L429 N433	L429-N431 PolarHBondContact O-N 3.45Å; N431-N433 PolarHBondContact O-N 3.44Å; N431-N433 VanDerWaalsContact O-N 3.09Å
432	F	69.8	Low	69.6	Low	72 Å²	72	76.6 Å²	76.6	32%	0.316	40%	0.396	S	S	.	.			trans	-78.5	90.1	175.2	-174.2	-100.7	0	0	0	112.4	I410 Q413 Q417 L429 E430 V434	I410-F432 HydrophobicContact CG2-CZ 4.29Å; Q413-F432 HydrophobicContact CB-CD1 3.68Å; Q413-F432 HydrophobicContact CB-CE1 3.77Å; Q413-F432 HydrophobicContact CG-CD1 3.79Å; Q413-F432 HydrophobicContact CG-CE1 4.31Å; Q417-F432 PolarHBondContact NE2-O 2.86Å; L429-F432 HydrophobicContact CB-CB 4.06Å; L429-F432 WeakPolarHBondContact O-CB 3.42Å; L429-F432 PolarHBondContact O-N 3.24Å; L429-F432 VanDerWaalsContact O-N 3.1Å; E430-F432 PolarHBondContact O-N 2.93Å; F432-V434 HydrophobicContact CD1-CG2 4.08Å; F432-V434 HydrophobicContact CE1-CG2 3.59Å; F432-V434 HydrophobicContact CZ-CG2 4.45Å
433	N	73.5	Confident	69.5	Low	40 Å²	40	74.8 Å²	74.8	21%	0.214	39%	0.391	C	S	.	.			trans	-96.7	110.6	178.8	-175.3	-75.6	0	0	0	112.2	G421 N431 K435 N436 V437	G421-N433 PolarHBondContact O-ND2 2.6Å; N431-N433 PolarHBondContact O-N 3.44Å; N431-N433 VanDerWaalsContact O-N 3.09Å; N433-K435 PolarHBondContact O-N 3.27Å; N433-K435 PolarHBondContact OD1-N 3.32Å; N433-N436 HydrophobicContact CB-CB 4.24Å; N433-N436 PolarHBondContact O-N 3.36Å; N433-N436 VanDerWaalsContact OD1-CG 3.3Å; N433-N436 PolarHBondContact OD1-N 3.04Å; N433-N436 PolarHBondContact OD1-ND2 3.12Å; N433-V437 PolarHBondContact O-N 3.24Å
434	V	79	Confident	69	Low	24 Å²	24	79.5 Å²	79.5	15%	0.145	41%	0.412	C	S	.	.	H	α-helix	trans	-64.3	-39.5	-174.6	175.7	0	0	0	0	112	Q413 M414 F432 N436 V437 V438	Q413-V434 HydrophobicContact CB-CG2 4.27Å; M414-V434 HydrophobicContact CG-CG1 4.37Å; M414-V434 HydrophobicContact CG-CG2 4.21Å; F432-V434 HydrophobicContact CD1-CG2 4.08Å; F432-V434 HydrophobicContact CE1-CG2 3.59Å; F432-V434 HydrophobicContact CZ-CG2 4.45Å; V434-N436 VanDerWaalsContact C-N 3.34Å; V434-N436 PolarHBondContact O-N 2.92Å; V434-V437 PolarHBondContact O-N 2.85Å; V434-V438 HydrophobicContact CG1-CG2 4.18Å; V434-V438 WeakPolarHBondContact O-CG2 3.43Å; V434-V438 PolarHBondContact O-N 3Å
435	K	75.6	Confident	68.7	Low	87 Å²	87	82.7 Å²	82.7	38%	0.378	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-35.6	-179.7	-69.9	-159.3	169	-157.2	0	113	D419 N433 R439	D419-K435 VanDerWaalsContact CA-NZ 3.33Å; D419-K435 WeakPolarHBondContact O-CD 3.23Å; D419-K435 WeakPolarHBondContact O-CE 3.49Å; D419-K435 PolarHBondContact O-NZ 3Å; D419-K435 IonicContact OD1-NZ 3.45Å; D419-K435 PolarHBondContact OD1-NZ 3.29Å; N433-K435 PolarHBondContact O-N 3.27Å; N433-K435 PolarHBondContact OD1-N 3.32Å; K435-R439 WeakPolarHBondContact O-CB 3.43Å; K435-R439 PolarHBondContact O-N 2.99Å; K435-R439 VanDerWaalsContact O-N 3.07Å
436	N	76.6	Confident	68.7	Low	73 Å²	73	86.8 Å²	86.8	39%	0.39	45%	0.445	S	S	.	.	H	α-helix	trans	-64.9	-42.5	173.6	-73.9	-24.6	0	0	0	111.6	N433 V434 R439 M440	N433-N436 HydrophobicContact CB-CB 4.24Å; N433-N436 PolarHBondContact O-N 3.36Å; N433-N436 VanDerWaalsContact OD1-CG 3.3Å; N433-N436 PolarHBondContact OD1-N 3.04Å; N433-N436 PolarHBondContact OD1-ND2 3.12Å; V434-N436 VanDerWaalsContact C-N 3.34Å; V434-N436 PolarHBondContact O-N 2.92Å; N436-R439 PolarHBondContact O-N 3.06Å; N436-R439 PolarHBondContact OD1-NH1 3.14Å; N436-R439 PolarHBondContact OD1-NH2 3.49Å; N436-M440 PolarHBondContact O-N 3.2Å
437	V	76.4	Confident	68.7	Low	65 Å²	65	87.7 Å²	87.7	39%	0.394	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-46.9	177.2	177.3	0	0	0	0	111.4	N433 V434 R439 M440 L441	N433-V437 PolarHBondContact O-N 3.24Å; V434-V437 PolarHBondContact O-N 2.85Å; V437-R439 VanDerWaalsContact C-N 3.31Å; V437-R439 PolarHBondContact O-N 3.25Å; V437-M440 WeakPolarHBondContact O-CB 3.37Å; V437-M440 PolarHBondContact O-N 3.26Å; V437-M440 VanDerWaalsContact O-N 3.12Å; V437-L441 HydrophobicContact CG1-CD1 4.25Å; V437-L441 PolarHBondContact O-N 3.46Å
438	V	75.8	Confident	69.4	Low	76 Å²	76	91.9 Å²	91.9	46%	0.461	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-41.3	177.7	171.9	0	0	0	0	111.3	V434 M440 L441 V442	V434-V438 HydrophobicContact CG1-CG2 4.18Å; V434-V438 WeakPolarHBondContact O-CG2 3.43Å; V434-V438 PolarHBondContact O-N 3Å; V438-M440 VanDerWaalsContact C-N 3.3Å; V438-M440 PolarHBondContact O-N 2.86Å; V438-L441 PolarHBondContact O-N 3.23Å; V438-V442 HydrophobicContact CG1-CG2 4.32Å; V438-V442 WeakPolarHBondContact O-CG2 3.37Å; V438-V442 PolarHBondContact O-N 2.59Å
439	R	74.8	Confident	70.1	Confident	145 Å²	145	94.4 Å²	94.4	55%	0.547	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-35.6	176.4	-174.1	175.4	63	-125.9	-11.1	112.7	K435 N436 V437 N443	K435-R439 WeakPolarHBondContact O-CB 3.43Å; K435-R439 PolarHBondContact O-N 2.99Å; K435-R439 VanDerWaalsContact O-N 3.07Å; N436-R439 PolarHBondContact O-N 3.06Å; N436-R439 PolarHBondContact OD1-NH1 3.14Å; N436-R439 PolarHBondContact OD1-NH2 3.49Å; V437-R439 VanDerWaalsContact C-N 3.31Å; V437-R439 PolarHBondContact O-N 3.25Å; R439-N443 PolarHBondContact O-N 2.62Å; R439-N443 PolarHBondContact O-OD1 2.81Å; R439-N443 VanDerWaalsContact O-OD1 3.12Å
440	M	67	Low	70.3	Confident	137 Å²	137	100.5 Å²	100.5	68%	0.675	49%	0.491	S	S	*	.	H	α-helix	trans	-65.9	-43.3	174.4	-69.1	174.4	61.1	0	0	111.9	N436 V437 V438 N443 E444	N436-M440 PolarHBondContact O-N 3.2Å; V437-M440 WeakPolarHBondContact O-CB 3.37Å; V437-M440 PolarHBondContact O-N 3.26Å; V437-M440 VanDerWaalsContact O-N 3.12Å; V438-M440 VanDerWaalsContact C-N 3.3Å; V438-M440 PolarHBondContact O-N 2.86Å; M440-N443 PolarHBondContact O-N 3.23Å; M440-E444 PolarHBondContact O-N 3.47Å
441	L	71.8	Confident	71.1	Confident	97 Å²	97	100.2 Å²	100.2	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-67.6	-37.1	-179.9	-65.9	170.1	0	0	0	113	V437 V438 E444 N445	V437-L441 HydrophobicContact CG1-CD1 4.25Å; V437-L441 PolarHBondContact O-N 3.46Å; V438-L441 PolarHBondContact O-N 3.23Å; L441-E444 PolarHBondContact O-N 3.23Å; L441-N445 PolarHBondContact O-N 3.36Å; L441-N445 VanDerWaalsContact O-N 3.11Å
442	V	70.1	Confident	71.9	Confident	68 Å²	68	97.6 Å²	97.6	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-63.2	-49.1	174.1	172.1	0	0	0	0	110.4	V438 E444 N445 E446	V438-V442 HydrophobicContact CG1-CG2 4.32Å; V438-V442 WeakPolarHBondContact O-CG2 3.37Å; V438-V442 PolarHBondContact O-N 2.59Å; V442-E444 VanDerWaalsContact C-N 3.27Å; V442-E444 PolarHBondContact O-N 2.89Å; V442-N445 PolarHBondContact O-N 2.96Å; V442-N445 VanDerWaalsContact O-N 3.15Å; V442-E446 PolarHBondContact O-N 2.8Å
443	N	68	Low	72.2	Confident	87 Å²	87	99.7 Å²	99.7	47%	0.465	48%	0.481	S	S	.	.	H	α-helix	trans	-59	-37.1	177.7	-68.8	12	0	0	0	112.3	R439 M440 V447	R439-N443 PolarHBondContact O-N 2.62Å; R439-N443 PolarHBondContact O-OD1 2.81Å; R439-N443 VanDerWaalsContact O-OD1 3.12Å; M440-N443 PolarHBondContact O-N 3.23Å; N443-V447 WeakPolarHBondContact O-CB 3.31Å; N443-V447 VanDerWaalsContact O-CG2 3.24Å; N443-V447 WeakPolarHBondContact O-CG2 3.49Å; N443-V447 PolarHBondContact O-N 2.99Å
444	E	62.4	Low	72.2	Confident	133 Å²	133	99.9 Å²	99.9	62%	0.621	49%	0.488	S	S	*	.	H	α-helix	trans	-66.5	-42.4	176.4	-172.4	173.7	-175.4	0	0	112.3	M440 L441 V442 V447 K448	M440-E444 PolarHBondContact O-N 3.47Å; L441-E444 PolarHBondContact O-N 3.23Å; V442-E444 VanDerWaalsContact C-N 3.27Å; V442-E444 PolarHBondContact O-N 2.89Å; E444-V447 PolarHBondContact O-N 2.8Å; E444-K448 WeakPolarHBondContact O-CB 3.38Å; E444-K448 PolarHBondContact O-N 3.26Å
445	N	65.6	Low	72.5	Confident	102 Å²	102	103.4 Å²	103.4	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-41.8	175.2	-96.4	-15.6	0	0	0	112.6	L441 V442 K448 Q449	L441-N445 PolarHBondContact O-N 3.36Å; L441-N445 VanDerWaalsContact O-N 3.11Å; V442-N445 PolarHBondContact O-N 2.96Å; V442-N445 VanDerWaalsContact O-N 3.15Å; N445-K448 WeakPolarHBondContact O-CB 3.3Å; N445-K448 PolarHBondContact O-N 3.07Å; N445-Q449 WeakPolarHBondContact O-CG 3.37Å; N445-Q449 PolarHBondContact O-N 3.12Å
446	E	72.2	Confident	73	Confident	96 Å²	96	105.1 Å²	105.1	45%	0.449	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-50.5	173.1	-72.2	-178.3	-174.5	0	0	110.8	V442 K448 Q449 W450	V442-E446 PolarHBondContact O-N 2.8Å; E446-K448 PolarHBondContact O-N 3.28Å; E446-Q449 PolarHBondContact O-N 3.15Å; E446-Q449 VanDerWaalsContact O-N 3.11Å; E446-W450 PolarHBondContact O-N 3.11Å
447	V	67	Low	73	Confident	75 Å²	75	107.2 Å²	107.2	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-57.8	-33.1	176.7	165.5	0	0	0	0	112	N443 E444 K451	N443-V447 WeakPolarHBondContact O-CB 3.31Å; N443-V447 VanDerWaalsContact O-CG2 3.24Å; N443-V447 WeakPolarHBondContact O-CG2 3.49Å; N443-V447 PolarHBondContact O-N 2.99Å; E444-V447 PolarHBondContact O-N 2.8Å; V447-K451 HydrophobicContact CG1-CD 4.25Å; V447-K451 WeakPolarHBondContact O-CB 3.32Å; V447-K451 WeakPolarHBondContact O-CD 3.36Å; V447-K451 VanDerWaalsContact O-CG 3.23Å; V447-K451 WeakPolarHBondContact O-CG 3.41Å; V447-K451 PolarHBondContact O-N 3.06Å
448	K	71.7	Confident	73.4	Confident	113 Å²	113	112.8 Å²	112.8	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-69.8	-47.3	173.8	-175.7	178.7	169.1	-175.7	0	112.2	E444 N445 E446 W450 K451 E452	E444-K448 WeakPolarHBondContact O-CB 3.38Å; E444-K448 PolarHBondContact O-N 3.26Å; N445-K448 WeakPolarHBondContact O-CB 3.3Å; N445-K448 PolarHBondContact O-N 3.07Å; E446-K448 PolarHBondContact O-N 3.28Å; K448-W450 PolarHBondContact O-N 3.29Å; K448-K451 WeakPolarHBondContact O-CB 3.44Å; K448-K451 PolarHBondContact O-N 3.42Å; K448-K451 VanDerWaalsContact O-N 3.15Å; K448-E452 WeakPolarHBondContact CE-OE1 3.08Å; K448-E452 IonicContact NZ-OE1 2.75Å; K448-E452 PolarHBondContact O-N 3.22Å
449	Q	71.6	Confident	73.9	Confident	132 Å²	132	114.8 Å²	114.8	62%	0.617	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-45	177.2	-70.9	179.7	5.2	0	0	111.8	N445 E446 K451 E452 Q453	N445-Q449 WeakPolarHBondContact O-CG 3.37Å; N445-Q449 PolarHBondContact O-N 3.12Å; E446-Q449 PolarHBondContact O-N 3.15Å; E446-Q449 VanDerWaalsContact O-N 3.11Å; Q449-K451 VanDerWaalsContact C-N 3.3Å; Q449-K451 PolarHBondContact O-N 3.41Å; Q449-E452 PolarHBondContact O-N 2.97Å; Q449-Q453 WeakPolarHBondContact O-CB 3.47Å; Q449-Q453 PolarHBondContact O-N 3.38Å
450	W	69.4	Low	74.4	Confident	177 Å²	177	112.1 Å²	112.1	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-60.7	-36.2	175.2	-71	116.7	0	0	0	112.7	E446 K448 A454	E446-W450 PolarHBondContact O-N 3.11Å; K448-W450 PolarHBondContact O-N 3.29Å; W450-A454 VanDerWaalsContact O-CB 3.24Å; W450-A454 WeakPolarHBondContact O-CB 3.39Å; W450-A454 PolarHBondContact O-N 3.01Å
451	K	72.8	Confident	75.3	Confident	143 Å²	143	111.4 Å²	111.4	62%	0.622	52%	0.524	S	S	*	.	H	α-helix	trans	-67.1	-48	174.3	-78.2	168.7	-178.8	173.5	0	112.3	V447 K448 Q449 A454 E455	V447-K451 HydrophobicContact CG1-CD 4.25Å; V447-K451 WeakPolarHBondContact O-CB 3.32Å; V447-K451 WeakPolarHBondContact O-CD 3.36Å; V447-K451 VanDerWaalsContact O-CG 3.23Å; V447-K451 WeakPolarHBondContact O-CG 3.41Å; V447-K451 PolarHBondContact O-N 3.06Å; K448-K451 WeakPolarHBondContact O-CB 3.44Å; K448-K451 PolarHBondContact O-N 3.42Å; K448-K451 VanDerWaalsContact O-N 3.15Å; Q449-K451 VanDerWaalsContact C-N 3.3Å; Q449-K451 PolarHBondContact O-N 3.41Å; K451-A454 PolarHBondContact O-N 2.89Å; K451-E455 PolarHBondContact O-N 3.26Å
452	E	79.4	Confident	76	Confident	108 Å²	108	112.5 Å²	112.5	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-41.2	-179.7	-71.7	176.2	-177.6	0	0	111.3	K448 Q449 E455 K456	K448-E452 WeakPolarHBondContact CE-OE1 3.08Å; K448-E452 IonicContact NZ-OE1 2.75Å; K448-E452 PolarHBondContact O-N 3.22Å; Q449-E452 PolarHBondContact O-N 2.97Å; E452-E455 PolarHBondContact O-N 3.5Å; E452-K456 PolarHBondContact O-N 2.97Å
453	Q	75.1	Confident	76.8	Confident	116 Å²	116	114.4 Å²	114.4	54%	0.542	53%	0.531	S	S	.	.	H	α-helix	trans	-66.1	-39.5	174.9	-169.9	167.6	-1.4	0	0	112.1	Q449 K456 M457	Q449-Q453 WeakPolarHBondContact O-CB 3.47Å; Q449-Q453 PolarHBondContact O-N 3.38Å; Q453-K456 PolarHBondContact O-N 3.27Å; Q453-M457 WeakPolarHBondContact O-CG 3.34Å; Q453-M457 PolarHBondContact O-N 3.41Å
454	A	74.9	Confident	77.7	Confident	43 Å²	43	116 Å²	116	36%	0.355	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-34.3	173.8	0	0	0	0	0	113	W450 K451 R458	W450-A454 VanDerWaalsContact O-CB 3.24Å; W450-A454 WeakPolarHBondContact O-CB 3.39Å; W450-A454 PolarHBondContact O-N 3.01Å; K451-A454 PolarHBondContact O-N 2.89Å; A454-R458 WeakPolarHBondContact O-CG 3.3Å; A454-R458 PolarHBondContact O-N 2.94Å; A454-R458 VanDerWaalsContact O-N 3.11Å
455	E	83.8	Confident	78.7	Confident	98 Å²	98	113.7 Å²	113.7	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-70	-40.1	174.1	-155.8	-159.9	153.1	0	0	111.8	K451 E452 R458 K459	K451-E455 PolarHBondContact O-N 3.26Å; E452-E455 PolarHBondContact O-N 3.5Å; E455-R458 PolarHBondContact O-N 3.28Å; E455-K459 PolarHBondContact O-N 3.3Å; E455-K459 WeakPolarHBondContact OE1-CE 3.5Å; E455-K459 IonicContact OE1-NZ 3.94Å; E455-K459 PolarHBondContact OE1-NZ 2.87Å
456	K	86.6	Confident	79.7	Confident	124 Å²	124	113.9 Å²	113.9	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-60.1	-49.3	173.9	-173.8	175.1	-176.4	-79.7	0	111.6	E452 Q453 R458 K459 E460	E452-K456 PolarHBondContact O-N 2.97Å; Q453-K456 PolarHBondContact O-N 3.27Å; K456-R458 VanDerWaalsContact C-N 3.27Å; K456-R458 PolarHBondContact O-N 3.34Å; K456-K459 PolarHBondContact O-N 3.45Å; K456-K459 VanDerWaalsContact O-N 3.1Å; K456-E460 WeakPolarHBondContact CE-OE1 3.48Å; K456-E460 IonicContact NZ-OE1 2.58Å; K456-E460 PolarHBondContact NZ-OE1 3.41Å; K456-E460 IonicContact NZ-OE2 3.87Å; K456-E460 PolarHBondContact O-N 3.16Å
457	M	77.1	Confident	80.4	Confident	116 Å²	116	114.8 Å²	114.8	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-58.5	-37.1	175.9	-71.1	-63.7	-63	0	0	112.4	Q453 H461	Q453-M457 WeakPolarHBondContact O-CG 3.34Å; Q453-M457 PolarHBondContact O-N 3.41Å; M457-H461 WeakPolarHBondContact O-CB 3.43Å; M457-H461 PolarHBondContact O-N 3.48Å
458	R	83.8	Confident	81.2	Confident	182 Å²	182	117.4 Å²	117.4	69%	0.687	53%	0.534	S	S	*	.	H	α-helix	trans	-65.5	-41.8	174	-78.6	174.6	176.5	140.8	-0.6	112.7	A454 E455 K456 H462	A454-R458 WeakPolarHBondContact O-CG 3.3Å; A454-R458 PolarHBondContact O-N 2.94Å; A454-R458 VanDerWaalsContact O-N 3.11Å; E455-R458 PolarHBondContact O-N 3.28Å; K456-R458 VanDerWaalsContact C-N 3.27Å; K456-R458 PolarHBondContact O-N 3.34Å; R458-H462 WeakPolarHBondContact O-CB 3.14Å; R458-H462 PolarHBondContact O-N 2.79Å
459	K	87.5	Confident	81.8	Confident	118 Å²	118	114.9 Å²	114.9	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-45.5	176.8	-71.9	171.8	-175.6	165.8	0	111.4	E455 K456 H461 H462 E463	E455-K459 PolarHBondContact O-N 3.3Å; E455-K459 WeakPolarHBondContact OE1-CE 3.5Å; E455-K459 IonicContact OE1-NZ 3.94Å; E455-K459 PolarHBondContact OE1-NZ 2.87Å; K456-K459 PolarHBondContact O-N 3.45Å; K456-K459 VanDerWaalsContact O-N 3.1Å; K459-H461 PolarHBondContact O-N 2.81Å; K459-H462 PolarHBondContact O-N 3.42Å; K459-H462 VanDerWaalsContact O-N 3.15Å; K459-E463 PolarHBondContact O-N 3.33Å
460	E	85.8	Confident	82.5	Confident	89 Å²	89	115.7 Å²	115.7	42%	0.416	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-42.6	176.9	-71.3	174.4	-179.7	0	0	112.2	K456 L464	K456-E460 WeakPolarHBondContact CE-OE1 3.48Å; K456-E460 IonicContact NZ-OE1 2.58Å; K456-E460 PolarHBondContact NZ-OE1 3.41Å; K456-E460 IonicContact NZ-OE2 3.87Å; K456-E460 PolarHBondContact O-N 3.16Å; E460-L464 WeakPolarHBondContact O-CB 3.45Å; E460-L464 PolarHBondContact O-N 2.92Å
461	H	85.6	Confident	83.3	Confident	123 Å²	123	113.1 Å²	113.1	57%	0.569	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-41	172.6	-173.8	-44.8	0	0	0	112	M457 K459 L464 Q465	M457-H461 WeakPolarHBondContact O-CB 3.43Å; M457-H461 PolarHBondContact O-N 3.48Å; K459-H461 PolarHBondContact O-N 2.81Å; H461-L464 PolarHBondContact O-N 3.5Å; H461-Q465 WeakPolarHBondContact O-CB 3.16Å; H461-Q465 PolarHBondContact O-N 2.78Å
462	H	85.4	Confident	83.8	Confident	119 Å²	119	111.1 Å²	111.1	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-69.4	-39.4	-178.4	-158.8	79.8	0	0	0	111.8	R458 K459 Q465 Q466	R458-H462 WeakPolarHBondContact O-CB 3.14Å; R458-H462 PolarHBondContact O-N 2.79Å; K459-H462 PolarHBondContact O-N 3.42Å; K459-H462 VanDerWaalsContact O-N 3.15Å; H462-Q465 PolarHBondContact O-N 3.44Å; H462-Q466 PolarHBondContact CD2-NE2 3.08Å; H462-Q466 PolarHBondContact NE2-NE2 2.65Å; H462-Q466 WeakPolarHBondContact O-CG 3.49Å; H462-Q466 PolarHBondContact O-N 2.59Å; H462-Q466 VanDerWaalsContact O-N 3.09Å
463	E	87.8	Confident	84	Confident	108 Å²	108	113.2 Å²	113.2	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-41.8	169.6	-82	-167	-143.5	0	0	112.8	K459 Q465 Q466 K467	K459-E463 PolarHBondContact O-N 3.33Å; E463-Q465 VanDerWaalsContact C-N 3.35Å; E463-Q466 PolarHBondContact O-N 3.06Å; E463-K467 WeakPolarHBondContact O-CD 3.21Å; E463-K467 VanDerWaalsContact O-CG 3.23Å; E463-K467 WeakPolarHBondContact O-CG 3.41Å; E463-K467 PolarHBondContact O-N 2.94Å; E463-K467 IonicContact OE2-NZ 2.69Å; E463-K467 PolarHBondContact OE2-NZ 2.95Å
464	L	86.6	Confident	84.3	Confident	122 Å²	122	110.9 Å²	110.9	64%	0.639	50%	0.504	S	S	*	.	H	α-helix	trans	-67.1	-38.5	179.8	-168.7	64.5	0	0	0	111.3	E460 H461 K467 F468	E460-L464 WeakPolarHBondContact O-CB 3.45Å; E460-L464 PolarHBondContact O-N 2.92Å; H461-L464 PolarHBondContact O-N 3.5Å; L464-K467 PolarHBondContact O-N 2.99Å; L464-F468 PolarHBondContact O-N 2.95Å
465	Q	82.6	Confident	84.4	Confident	83 Å²	83	112.5 Å²	112.5	39%	0.388	51%	0.512	S	S	.	.	H	α-helix	trans	-60	-48.2	173.1	-171.4	65.7	30.3	0	0	111.5	H461 H462 E463 K467 F468 E469	H461-Q465 WeakPolarHBondContact O-CB 3.16Å; H461-Q465 PolarHBondContact O-N 2.78Å; H462-Q465 PolarHBondContact O-N 3.44Å; E463-Q465 VanDerWaalsContact C-N 3.35Å; Q465-K467 VanDerWaalsContact C-N 3.3Å; Q465-K467 PolarHBondContact O-N 3Å; Q465-F468 WeakPolarHBondContact O-CB 3.42Å; Q465-F468 PolarHBondContact O-N 3.16Å; Q465-F468 VanDerWaalsContact O-N 3.1Å; Q465-E469 PolarHBondContact O-N 3.29Å
466	Q	87	Confident	84.4	Confident	106 Å²	106	112.5 Å²	112.5	50%	0.495	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-34.7	176.9	-69.6	178.7	11.9	0	0	112.6	H462 E463 K470	H462-Q466 PolarHBondContact CD2-NE2 3.08Å; H462-Q466 PolarHBondContact NE2-NE2 2.65Å; H462-Q466 WeakPolarHBondContact O-CG 3.49Å; H462-Q466 PolarHBondContact O-N 2.59Å; H462-Q466 VanDerWaalsContact O-N 3.09Å; E463-Q466 PolarHBondContact O-N 3.06Å; Q466-K470 WeakPolarHBondContact O-CB 3.3Å; Q466-K470 PolarHBondContact O-N 3.3Å; Q466-K470 VanDerWaalsContact O-N 3.09Å
467	K	87.3	Confident	84.3	Confident	116 Å²	116	108.8 Å²	108.8	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-68.2	-35.8	173.4	-70.6	160.3	-166.7	162.8	0	111.7	E463 L464 Q465 K471	E463-K467 WeakPolarHBondContact O-CD 3.21Å; E463-K467 VanDerWaalsContact O-CG 3.23Å; E463-K467 WeakPolarHBondContact O-CG 3.41Å; E463-K467 PolarHBondContact O-N 2.94Å; E463-K467 IonicContact OE2-NZ 2.69Å; E463-K467 PolarHBondContact OE2-NZ 2.95Å; L464-K467 PolarHBondContact O-N 2.99Å; Q465-K467 VanDerWaalsContact C-N 3.3Å; Q465-K467 PolarHBondContact O-N 3Å; K467-K471 PolarHBondContact O-N 2.85Å
468	F	82.9	Confident	84.6	Confident	129 Å²	129	108.7 Å²	108.7	57%	0.566	50%	0.504	S	S	*	.	H	α-helix	trans	-67.4	-54.1	174.6	-171.3	-86.8	0	0	0	111.6	L464 Q465 K470 K471 E472	L464-F468 PolarHBondContact O-N 2.95Å; Q465-F468 WeakPolarHBondContact O-CB 3.42Å; Q465-F468 PolarHBondContact O-N 3.16Å; Q465-F468 VanDerWaalsContact O-N 3.1Å; F468-K470 PolarHBondContact O-N 3.04Å; F468-K471 CarbonylContact O-C 3.48Å; F468-K471 WeakPolarHBondContact O-CA 3.35Å; F468-K471 WeakPolarHBondContact O-CB 3.19Å; F468-K471 PolarHBondContact O-N 3.15Å; F468-E472 PolarHBondContact O-N 3.14Å
469	E	85.4	Confident	84.4	Confident	60 Å²	60	103.2 Å²	103.2	28%	0.28	49%	0.491	S	S	.	.	H	α-helix	trans	-55.1	-37.6	176.3	-73	177.6	-148.9	0	0	112.7	Q465 K471 R473	Q465-E469 PolarHBondContact O-N 3.29Å; E469-K471 VanDerWaalsContact C-N 3.32Å; E469-R473 WeakPolarHBondContact O-CG 3.45Å; E469-R473 PolarHBondContact O-N 3Å; E469-R473 VanDerWaalsContact O-N 3.12Å; E469-R473 IonicContact OE2-CZ 2.96Å; E469-R473 IonicContact OE2-NH1 3.65Å; E469-R473 IonicContact OE2-NH2 2.7Å; E469-R473 PolarHBondContact OE2-NH2 3.28Å
470	K	86.6	Confident	84.1	Confident	149 Å²	149	103.2 Å²	103.2	65%	0.648	49%	0.493	S	S	*	.	H	α-helix	trans	-66.4	-34.5	175.5	-176.8	172.3	179.5	177.1	0	112	Q466 F468 E474	Q466-K470 WeakPolarHBondContact O-CB 3.3Å; Q466-K470 PolarHBondContact O-N 3.3Å; Q466-K470 VanDerWaalsContact O-N 3.09Å; F468-K470 PolarHBondContact O-N 3.04Å; K470-E474 WeakPolarHBondContact O-CB 3.48Å; K470-E474 PolarHBondContact O-N 2.85Å
471	K	84.4	Confident	84	Confident	124 Å²	124	105 Å²	105	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-78.4	-32.1	177.1	-85.3	-70.6	175	-162.2	0	113.3	K467 F468 E469 E474 C475	K467-K471 PolarHBondContact O-N 2.85Å; F468-K471 CarbonylContact O-C 3.48Å; F468-K471 WeakPolarHBondContact O-CA 3.35Å; F468-K471 WeakPolarHBondContact O-CB 3.19Å; F468-K471 PolarHBondContact O-N 3.15Å; E469-K471 VanDerWaalsContact C-N 3.32Å; K471-E474 WeakPolarHBondContact CE-OE2 3.46Å; K471-E474 IonicContact NZ-OE1 2.74Å; K471-E474 PolarHBondContact NZ-OE1 3.28Å; K471-E474 IonicContact NZ-OE2 3.98Å; K471-E474 PolarHBondContact NZ-OE2 3.47Å; K471-E474 PolarHBondContact O-N 2.6Å; K471-C475 WeakPolarHBondContact O-CB 3.34Å; K471-C475 PolarHBondContact O-N 3.09Å
472	E	83.5	Confident	83.7	Confident	101 Å²	101	106.3 Å²	106.3	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-59	-56.1	170.5	-169.6	167.6	-142	0	0	110	F468 E474 C475 D476	F468-E472 PolarHBondContact O-N 3.14Å; E472-E474 VanDerWaalsContact C-N 3.26Å; E472-E474 PolarHBondContact O-N 3.19Å; E472-C475 WeakPolarHBondContact O-CA 3.43Å; E472-C475 VanDerWaalsContact O-CB 3.24Å; E472-C475 WeakPolarHBondContact O-CB 3.17Å; E472-C475 PolarHBondContact O-N 2.63Å; E472-D476 PolarHBondContact O-N 2.65Å
473	R	83.6	Confident	83.6	Confident	151 Å²	151	105.8 Å²	105.8	57%	0.57	50%	0.503	S	S	*	.	H	α-helix	trans	-58.1	-33	175.6	-64.9	169.7	-165	133	12.2	113.8	E469 C475 A477	E469-R473 WeakPolarHBondContact O-CG 3.45Å; E469-R473 PolarHBondContact O-N 3Å; E469-R473 VanDerWaalsContact O-N 3.12Å; E469-R473 IonicContact OE2-CZ 2.96Å; E469-R473 IonicContact OE2-NH1 3.65Å; E469-R473 IonicContact OE2-NH2 2.7Å; E469-R473 PolarHBondContact OE2-NH2 3.28Å; R473-C475 VanDerWaalsContact C-N 3.35Å; R473-A477 WeakPolarHBondContact O-CB 3.03Å; R473-A477 PolarHBondContact O-N 2.98Å; R473-A477 VanDerWaalsContact O-N 3.13Å
474	E	81.9	Confident	83.5	Confident	67 Å²	67	105.7 Å²	105.7	31%	0.313	50%	0.502	S	S	.	.	H	α-helix	trans	-72.4	-27.9	174.9	-162.9	-163.4	125.6	0	0	112.4	K470 K471 E472 K478	K470-E474 WeakPolarHBondContact O-CB 3.48Å; K470-E474 PolarHBondContact O-N 2.85Å; K471-E474 WeakPolarHBondContact CE-OE2 3.46Å; K471-E474 IonicContact NZ-OE1 2.74Å; K471-E474 PolarHBondContact NZ-OE1 3.28Å; K471-E474 IonicContact NZ-OE2 3.98Å; K471-E474 PolarHBondContact NZ-OE2 3.47Å; K471-E474 PolarHBondContact O-N 2.6Å; E472-E474 VanDerWaalsContact C-N 3.26Å; E472-E474 PolarHBondContact O-N 3.19Å; E474-K478 WeakPolarHBondContact O-CD 3.3Å; E474-K478 WeakPolarHBondContact O-CG 3.39Å; E474-K478 PolarHBondContact O-N 3.44Å; E474-K478 IonicContact OE1-NZ 3.69Å; E474-K478 PolarHBondContact OE1-NZ 3.11Å
475	C	78.1	Confident	83.3	Confident	77 Å²	77	106.4 Å²	106.4	52%	0.52	50%	0.504	S	S	.	.	H	α-helix	trans	-77.2	-42.4	174.6	-159.7	0	0	0	0	111.2	K471 E472 R473 K478 T479	K471-C475 WeakPolarHBondContact O-CB 3.34Å; K471-C475 PolarHBondContact O-N 3.09Å; E472-C475 WeakPolarHBondContact O-CA 3.43Å; E472-C475 VanDerWaalsContact O-CB 3.24Å; E472-C475 WeakPolarHBondContact O-CB 3.17Å; E472-C475 PolarHBondContact O-N 2.63Å; R473-C475 VanDerWaalsContact C-N 3.35Å; C475-K478 PolarHBondContact O-N 3.28Å; C475-T479 WeakPolarHBondContact O-CB 3.46Å; C475-T479 PolarHBondContact O-N 3.27Å; C475-T479 PolarHBondContact O-OG1 3Å
476	D	82.7	Confident	83	Confident	98 Å²	98	107.7 Å²	107.7	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-60.5	-48.4	176.5	-61.1	-29.5	0	0	0	110.9	E472 K478 T479 Q480	E472-D476 PolarHBondContact O-N 2.65Å; D476-K478 VanDerWaalsContact C-N 3.35Å; D476-K478 PolarHBondContact O-N 2.86Å; D476-T479 WeakPolarHBondContact O-CA 3.47Å; D476-T479 WeakPolarHBondContact O-CB 3.37Å; D476-T479 PolarHBondContact O-N 3.45Å; D476-Q480 PolarHBondContact O-N 3.15Å
477	A	83.9	Confident	82.8	Confident	47 Å²	47	107.7 Å²	107.7	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-56.6	-45.8	176.6	0	0	0	0	0	112.3	R473 T479 Q480 E481	R473-A477 WeakPolarHBondContact O-CB 3.03Å; R473-A477 PolarHBondContact O-N 2.98Å; R473-A477 VanDerWaalsContact O-N 3.13Å; A477-T479 VanDerWaalsContact C-N 3.28Å; A477-T479 PolarHBondContact O-N 2.86Å; A477-Q480 PolarHBondContact O-N 3.46Å; A477-E481 WeakPolarHBondContact O-CG 3.3Å; A477-E481 PolarHBondContact O-N 2.94Å
478	K	83.4	Confident	82.4	Confident	113 Å²	113	106.5 Å²	106.5	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-26.9	176.8	-73.8	170.3	-180	170.2	0	113.2	E474 C475 D476 K482	E474-K478 WeakPolarHBondContact O-CD 3.3Å; E474-K478 WeakPolarHBondContact O-CG 3.39Å; E474-K478 PolarHBondContact O-N 3.44Å; E474-K478 IonicContact OE1-NZ 3.69Å; E474-K478 PolarHBondContact OE1-NZ 3.11Å; C475-K478 PolarHBondContact O-N 3.28Å; D476-K478 VanDerWaalsContact C-N 3.35Å; D476-K478 PolarHBondContact O-N 2.86Å; K478-K482 WeakPolarHBondContact O-CB 3.49Å; K478-K482 PolarHBondContact O-N 3.33Å
479	T	79.7	Confident	82.2	Confident	68 Å²	68	106 Å²	106	42%	0.417	52%	0.516	S	S	.	.	H	α-helix	trans	-72.1	-42.6	173.4	-57.7	0	0	0	0	110.2	C475 D476 A477 K482 E483	C475-T479 WeakPolarHBondContact O-CB 3.46Å; C475-T479 PolarHBondContact O-N 3.27Å; C475-T479 PolarHBondContact O-OG1 3Å; D476-T479 WeakPolarHBondContact O-CA 3.47Å; D476-T479 WeakPolarHBondContact O-CB 3.37Å; D476-T479 PolarHBondContact O-N 3.45Å; A477-T479 VanDerWaalsContact C-N 3.28Å; A477-T479 PolarHBondContact O-N 2.86Å; T479-K482 WeakPolarHBondContact O-CB 3.46Å; T479-K482 PolarHBondContact O-N 3.33Å; T479-E483 PolarHBondContact O-N 2.9Å
480	Q	81.9	Confident	82	Confident	118 Å²	118	106.9 Å²	106.9	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-65.8	-44.6	175.4	-171.2	173	-19.2	0	0	112.5	D476 A477 K482 E483 E484	D476-Q480 PolarHBondContact O-N 3.15Å; A477-Q480 PolarHBondContact O-N 3.46Å; Q480-K482 PolarHBondContact O-N 2.85Å; Q480-E483 PolarHBondContact O-N 3.16Å; Q480-E483 VanDerWaalsContact O-N 3.09Å; Q480-E484 PolarHBondContact NE2-OE1 2.92Å; Q480-E484 PolarHBondContact O-N 3.22Å
481	E	83.8	Confident	81.8	Confident	126 Å²	126	105.6 Å²	105.6	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-54.1	-41.1	172	-74.9	174.8	172.4	0	0	111.9	A477 M485	A477-E481 WeakPolarHBondContact O-CG 3.3Å; A477-E481 PolarHBondContact O-N 2.94Å; E481-M485 WeakPolarHBondContact O-CB 3.48Å; E481-M485 PolarHBondContact O-N 2.73Å
482	K	78.9	Confident	81.6	Confident	151 Å²	151	106.3 Å²	106.3	66%	0.657	53%	0.525	S	S	*	.	H	α-helix	trans	-68	-38.2	177.3	-179.6	-171.2	173	-166.5	0	112.2	K478 T479 Q480 M486	K478-K482 WeakPolarHBondContact O-CB 3.49Å; K478-K482 PolarHBondContact O-N 3.33Å; T479-K482 WeakPolarHBondContact O-CB 3.46Å; T479-K482 PolarHBondContact O-N 3.33Å; Q480-K482 PolarHBondContact O-N 2.85Å; K482-M486 WeakPolarHBondContact O-CB 3.27Å; K482-M486 PolarHBondContact O-N 3.37Å
483	E	84.3	Confident	81.5	Confident	108 Å²	108	106.7 Å²	106.7	51%	0.505	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-43	175.3	-73.1	-172.9	176.2	0	0	112.1	T479 Q480 M485 M486 Q487	T479-E483 PolarHBondContact O-N 2.9Å; Q480-E483 PolarHBondContact O-N 3.16Å; Q480-E483 VanDerWaalsContact O-N 3.09Å; E483-M485 VanDerWaalsContact C-N 3.34Å; E483-M485 PolarHBondContact O-N 3.25Å; E483-M486 PolarHBondContact O-N 3.12Å; E483-Q487 WeakPolarHBondContact O-CG 3.44Å; E483-Q487 PolarHBondContact O-N 3.07Å
484	E	85.6	Confident	81.4	Confident	105 Å²	105	105.6 Å²	105.6	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-40.1	175	-70.3	179.9	-165.6	0	0	111.8	Q480 Q487 T488	Q480-E484 PolarHBondContact NE2-OE1 2.92Å; Q480-E484 PolarHBondContact O-N 3.22Å; E484-Q487 PolarHBondContact O-N 3.37Å; E484-T488 WeakPolarHBondContact O-CB 3.31Å; E484-T488 PolarHBondContact O-N 3.19Å; E484-T488 PolarHBondContact O-OG1 2.92Å
485	M	81.3	Confident	81.4	Confident	138 Å²	138	109.4 Å²	109.4	68%	0.68	54%	0.542	S	S	*	.	H	α-helix	trans	-62.9	-42.5	172.2	-171.7	179.4	-65	0	0	111.8	E481 E483 T488 L489	E481-M485 WeakPolarHBondContact O-CB 3.48Å; E481-M485 PolarHBondContact O-N 2.73Å; E483-M485 VanDerWaalsContact C-N 3.34Å; E483-M485 PolarHBondContact O-N 3.25Å; M485-T488 WeakPolarHBondContact O-CB 3.34Å; M485-T488 PolarHBondContact O-N 3.18Å; M485-L489 PolarHBondContact O-N 2.65Å
486	M	77.5	Confident	81.5	Confident	109 Å²	109	111.3 Å²	111.3	54%	0.537	55%	0.546	S	S	.	.	H	α-helix	trans	-67.2	-39.8	177.9	-171.6	174.4	68.5	0	0	112.5	K482 E483 T488 L489 N490	K482-M486 WeakPolarHBondContact O-CB 3.27Å; K482-M486 PolarHBondContact O-N 3.37Å; E483-M486 PolarHBondContact O-N 3.12Å; M486-T488 VanDerWaalsContact C-N 3.3Å; M486-T488 PolarHBondContact O-N 3.02Å; M486-L489 PolarHBondContact O-N 3.46Å; M486-N490 PolarHBondContact O-N 2.76Å
487	Q	81.5	Confident	81.3	Confident	106 Å²	106	111.2 Å²	111.2	50%	0.495	54%	0.542	S	S	.	.	H	α-helix	trans	-61.8	-39.4	172	-71.8	-175.4	34.1	0	0	111.8	E483 E484 N490 K491	E483-Q487 WeakPolarHBondContact O-CG 3.44Å; E483-Q487 PolarHBondContact O-N 3.07Å; E484-Q487 PolarHBondContact O-N 3.37Å; Q487-N490 PolarHBondContact O-N 2.89Å; Q487-K491 WeakPolarHBondContact O-CG 3.5Å; Q487-K491 PolarHBondContact O-N 3.21Å
488	T	80.4	Confident	81.3	Confident	91 Å²	91	115.2 Å²	115.2	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-65.8	-42.5	176.6	-57.9	0	0	0	0	111.1	E484 M485 M486 N490 K491 M492	E484-T488 WeakPolarHBondContact O-CB 3.31Å; E484-T488 PolarHBondContact O-N 3.19Å; E484-T488 PolarHBondContact O-OG1 2.92Å; M485-T488 WeakPolarHBondContact O-CB 3.34Å; M485-T488 PolarHBondContact O-N 3.18Å; M486-T488 VanDerWaalsContact C-N 3.3Å; M486-T488 PolarHBondContact O-N 3.02Å; T488-N490 PolarHBondContact O-N 3.12Å; T488-K491 PolarHBondContact O-N 3.02Å; T488-M492 PolarHBondContact O-N 3.44Å
489	L	78.4	Confident	81	Confident	118 Å²	118	115.4 Å²	115.4	62%	0.618	55%	0.554	S	S	*	*	H	α-helix	trans	-60.9	-43	174.9	-154.8	85	0	0	0	111.9	M485 M486 M492 K493	M485-L489 PolarHBondContact O-N 2.65Å; M486-L489 PolarHBondContact O-N 3.46Å; L489-M492 WeakPolarHBondContact O-CB 3.45Å; L489-M492 PolarHBondContact O-N 2.82Å; L489-K493 PolarHBondContact O-N 3.44Å
490	N	79.9	Confident	80.9	Confident	80 Å²	80	114.8 Å²	114.8	43%	0.428	55%	0.552	S	S	.	*	H	α-helix	trans	-64.1	-45.2	177.4	-74.7	-19.3	0	0	0	112.2	M486 Q487 T488 M492 K493 E494	M486-N490 PolarHBondContact O-N 2.76Å; Q487-N490 PolarHBondContact O-N 2.89Å; T488-N490 PolarHBondContact O-N 3.12Å; N490-M492 PolarHBondContact O-N 3.41Å; N490-K493 WeakPolarHBondContact O-CB 3.4Å; N490-K493 PolarHBondContact O-N 3.4Å; N490-K493 VanDerWaalsContact O-N 3.1Å; N490-E494 WeakPolarHBondContact O-CG 3.45Å; N490-E494 PolarHBondContact O-N 3Å
491	K	84.1	Confident	80.7	Confident	121 Å²	121	113 Å²	113	53%	0.526	55%	0.546	S	S	.	.	H	α-helix	trans	-59.6	-33	173.3	-73.8	166.2	179.3	164	0	112.5	Q487 T488 K495	Q487-K491 WeakPolarHBondContact O-CG 3.5Å; Q487-K491 PolarHBondContact O-N 3.21Å; T488-K491 PolarHBondContact O-N 3.02Å; K491-K495 PolarHBondContact O-N 2.67Å
492	M	79.1	Confident	80.5	Confident	140 Å²	140	111.5 Å²	111.5	69%	0.69	54%	0.539	S	S	*	.	H	α-helix	trans	-73	-38.3	175.5	-155.1	171.2	-163.9	0	0	111.8	T488 L489 N490 K495 L496	T488-M492 PolarHBondContact O-N 3.44Å; L489-M492 WeakPolarHBondContact O-CB 3.45Å; L489-M492 PolarHBondContact O-N 2.82Å; N490-M492 PolarHBondContact O-N 3.41Å; M492-K495 PolarHBondContact O-N 3.03Å; M492-L496 WeakPolarHBondContact O-CB 3.49Å; M492-L496 PolarHBondContact O-N 3.36Å
493	K	80.8	Confident	80.4	Confident	109 Å²	109	110.5 Å²	110.5	47%	0.474	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-45	171.7	-178.9	-177.6	175.6	-75	0	112.1	L489 N490 K495 L496 E497	L489-K493 PolarHBondContact O-N 3.44Å; N490-K493 WeakPolarHBondContact O-CB 3.4Å; N490-K493 PolarHBondContact O-N 3.4Å; N490-K493 VanDerWaalsContact O-N 3.1Å; K493-K495 VanDerWaalsContact C-N 3.34Å; K493-K495 PolarHBondContact O-N 2.93Å; K493-L496 PolarHBondContact O-N 3Å; K493-L496 VanDerWaalsContact O-N 3.16Å; K493-E497 WeakPolarHBondContact CE-OE1 3.32Å; K493-E497 IonicContact NZ-OE1 2.95Å; K493-E497 PolarHBondContact NZ-OE1 2.97Å; K493-E497 IonicContact NZ-OE2 3.15Å; K493-E497 PolarHBondContact NZ-OE2 3.28Å; K493-E497 PolarHBondContact O-N 3.24Å
494	E	82.3	Confident	80.2	Confident	127 Å²	127	110.7 Å²	110.7	59%	0.593	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-42.5	177.3	-72.5	174.5	161	0	0	112	N490 E497 K498	N490-E494 WeakPolarHBondContact O-CG 3.45Å; N490-E494 PolarHBondContact O-N 3Å; E494-E497 PolarHBondContact O-N 3.28Å; E494-K498 WeakPolarHBondContact O-CB 3.42Å; E494-K498 PolarHBondContact O-N 2.85Å
495	K	81.1	Confident	79.8	Confident	148 Å²	148	110.4 Å²	110.4	64%	0.643	54%	0.538	S	S	*	.	H	α-helix	trans	-60.3	-46.2	171.9	-78.7	-173	173.5	-171.6	0	112	K491 M492 K493 E497 K498 E499	K491-K495 PolarHBondContact O-N 2.67Å; M492-K495 PolarHBondContact O-N 3.03Å; K493-K495 VanDerWaalsContact C-N 3.34Å; K493-K495 PolarHBondContact O-N 2.93Å; K495-E497 PolarHBondContact O-N 3.44Å; K495-K498 WeakPolarHBondContact O-CB 3.42Å; K495-K498 PolarHBondContact O-N 3.33Å; K495-E499 PolarHBondContact O-N 2.91Å
496	L	80.6	Confident	79.7	Confident	116 Å²	116	107.7 Å²	107.7	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-36.1	-179	-167.2	69.4	0	0	0	112.4	M492 K493 S500	M492-L496 WeakPolarHBondContact O-CB 3.49Å; M492-L496 PolarHBondContact O-N 3.36Å; K493-L496 PolarHBondContact O-N 3Å; K493-L496 VanDerWaalsContact O-N 3.16Å; L496-S500 WeakPolarHBondContact O-CB 3.47Å; L496-S500 PolarHBondContact O-N 2.91Å
497	E	79.9	Confident	79.7	Confident	96 Å²	96	109.3 Å²	109.3	45%	0.449	53%	0.533	S	S	.	.	H	α-helix	trans	-68.1	-37	172.4	-76.9	179.5	160.8	0	0	111.8	K493 E494 K495 S500 N501	K493-E497 WeakPolarHBondContact CE-OE1 3.32Å; K493-E497 IonicContact NZ-OE1 2.95Å; K493-E497 PolarHBondContact NZ-OE1 2.97Å; K493-E497 IonicContact NZ-OE2 3.15Å; K493-E497 PolarHBondContact NZ-OE2 3.28Å; K493-E497 PolarHBondContact O-N 3.24Å; E494-E497 PolarHBondContact O-N 3.28Å; K495-E497 PolarHBondContact O-N 3.44Å; E497-S500 PolarHBondContact O-N 2.9Å; E497-N501 WeakPolarHBondContact O-CB 3.37Å; E497-N501 VanDerWaalsContact O-CG 3.26Å; E497-N501 PolarHBondContact O-N 2.73Å; E497-N501 PolarHBondContact O-ND2 3.33Å
498	K	81.9	Confident	79.4	Confident	131 Å²	131	110.7 Å²	110.7	57%	0.57	54%	0.539	S	S	*	.	H	α-helix	trans	-64.6	-51.5	173.1	-175.4	178	168.5	-177.3	0	111.7	E494 K495 S500 N501 E502	E494-K498 WeakPolarHBondContact O-CB 3.42Å; E494-K498 PolarHBondContact O-N 2.85Å; K495-K498 WeakPolarHBondContact O-CB 3.42Å; K495-K498 PolarHBondContact O-N 3.33Å; K498-S500 VanDerWaalsContact C-N 3.28Å; K498-S500 PolarHBondContact O-N 3.23Å; K498-N501 PolarHBondContact O-N 2.95Å; K498-N501 VanDerWaalsContact O-N 3.1Å; K498-E502 WeakPolarHBondContact CE-OE1 3.27Å; K498-E502 IonicContact NZ-OE1 3.28Å; K498-E502 PolarHBondContact O-N 3.38Å
499	E	78.8	Confident	79.1	Confident	117 Å²	117	112 Å²	112	55%	0.547	54%	0.539	S	S	.	.	H	α-helix	trans	-59.6	-38.1	175.7	-73.3	175.6	-175.6	0	0	111.7	K495 N501 E502 H503	K495-E499 PolarHBondContact O-N 2.91Å; E499-N501 PolarHBondContact O-N 3.18Å; E499-E502 PolarHBondContact O-N 2.91Å; E499-H503 VanDerWaalsContact O-CB 3.26Å; E499-H503 WeakPolarHBondContact O-CB 3.21Å; E499-H503 PolarHBondContact O-N 3.05Å
500	S	77.7	Confident	79	Confident	56 Å²	56	110.3 Å²	110.3	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-39.1	174.3	-173.9	0	0	0	0	112.5	L496 E497 K498 K504	L496-S500 WeakPolarHBondContact O-CB 3.47Å; L496-S500 PolarHBondContact O-N 2.91Å; E497-S500 PolarHBondContact O-N 2.9Å; K498-S500 VanDerWaalsContact C-N 3.28Å; K498-S500 PolarHBondContact O-N 3.23Å; S500-K504 VanDerWaalsContact O-CG 3.31Å; S500-K504 WeakPolarHBondContact O-CG 3.32Å; S500-K504 PolarHBondContact O-N 2.91Å
501	N	77.8	Confident	78.7	Confident	79 Å²	79	109.2 Å²	109.2	42%	0.422	54%	0.536	S	S	.	.	H	α-helix	trans	-75.2	-36.9	177.3	-70.1	-27.1	0	0	0	112.3	E497 K498 E499 H503 K504 N505	E497-N501 WeakPolarHBondContact O-CB 3.37Å; E497-N501 VanDerWaalsContact O-CG 3.26Å; E497-N501 PolarHBondContact O-N 2.73Å; E497-N501 PolarHBondContact O-ND2 3.33Å; K498-N501 PolarHBondContact O-N 2.95Å; K498-N501 VanDerWaalsContact O-N 3.1Å; E499-N501 PolarHBondContact O-N 3.18Å; N501-H503 VanDerWaalsContact C-N 3.34Å; N501-K504 WeakPolarHBondContact O-CB 3.17Å; N501-K504 PolarHBondContact O-N 3.37Å; N501-K504 PolarHBondContact OD1-NZ 2.89Å; N501-N505 VanDerWaalsContact O-CG 3.25Å; N501-N505 PolarHBondContact O-N 3.33Å; N501-N505 PolarHBondContact O-OD1 3.4Å
502	E	78.8	Confident	78.2	Confident	96 Å²	96	109.4 Å²	109.4	45%	0.449	54%	0.538	S	S	.	.	H	α-helix	trans	-62.1	-42	169.9	-72	175.9	180	0	0	110.9	K498 E499 K504 N505 V506	K498-E502 WeakPolarHBondContact CE-OE1 3.27Å; K498-E502 IonicContact NZ-OE1 3.28Å; K498-E502 PolarHBondContact O-N 3.38Å; E499-E502 PolarHBondContact O-N 2.91Å; E502-K504 PolarHBondContact O-N 2.85Å; E502-N505 PolarHBondContact O-N 3.27Å; E502-V506 WeakPolarHBondContact O-CG2 3.31Å; E502-V506 PolarHBondContact O-N 3.5Å
503	H	76.9	Confident	77.7	Confident	130 Å²	130	107.7 Å²	107.7	60%	0.602	53%	0.531	S	S	*	.	H	α-helix	trans	-64.1	-36.8	173.9	-172.6	86.5	0	0	0	112.9	E499 N501 K507	E499-H503 VanDerWaalsContact O-CB 3.26Å; E499-H503 WeakPolarHBondContact O-CB 3.21Å; E499-H503 PolarHBondContact O-N 3.05Å; N501-H503 VanDerWaalsContact C-N 3.34Å; H503-K507 WeakPolarHBondContact O-CB 3.28Å; H503-K507 PolarHBondContact O-N 3.21Å
504	K	79.1	Confident	77.1	Confident	111 Å²	111	106.3 Å²	106.3	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-62	-45.6	170.9	-72.9	167.6	-158.8	162	0	111.3	S500 N501 E502 K507 Q508	S500-K504 VanDerWaalsContact O-CG 3.31Å; S500-K504 WeakPolarHBondContact O-CG 3.32Å; S500-K504 PolarHBondContact O-N 2.91Å; N501-K504 WeakPolarHBondContact O-CB 3.17Å; N501-K504 PolarHBondContact O-N 3.37Å; N501-K504 PolarHBondContact OD1-NZ 2.89Å; E502-K504 PolarHBondContact O-N 2.85Å; K504-K507 CarbonylContact O-C 3.58Å; K504-K507 PolarHBondContact O-N 3.04Å; K504-Q508 WeakPolarHBondContact O-CB 3.36Å; K504-Q508 PolarHBondContact O-N 3.15Å
505	N	78	Confident	76.3	Confident	99 Å²	99	103 Å²	103	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-44.6	179.6	-66.3	-10.5	0	0	0	111.5	N501 E502 Q508 Q509	N501-N505 VanDerWaalsContact O-CG 3.25Å; N501-N505 PolarHBondContact O-N 3.33Å; N501-N505 PolarHBondContact O-OD1 3.4Å; E502-N505 PolarHBondContact O-N 3.27Å; N505-Q508 PolarHBondContact O-N 3.46Å; N505-Q509 PolarHBondContact O-N 3.47Å
506	V	78.7	Confident	75.4	Confident	81 Å²	81	101.2 Å²	101.2	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-44.2	173.3	172	0	0	0	0	110.9	E502 Q508 Q509 V510	E502-V506 WeakPolarHBondContact O-CG2 3.31Å; E502-V506 PolarHBondContact O-N 3.5Å; V506-Q508 VanDerWaalsContact C-N 3.25Å; V506-Q508 PolarHBondContact O-N 3.17Å; V506-Q509 PolarHBondContact O-N 2.83Å; V506-V510 WeakPolarHBondContact O-CG2 3.45Å; V506-V510 PolarHBondContact O-N 2.84Å
507	K	77.2	Confident	74.4	Confident	143 Å²	143	101.6 Å²	101.6	62%	0.622	52%	0.523	S	S	*	.	H	α-helix	trans	-63.8	-30.8	176.9	-171.2	170.8	-176.7	174.1	0	112.6	H503 K504 A511	H503-K507 WeakPolarHBondContact O-CB 3.28Å; H503-K507 PolarHBondContact O-N 3.21Å; K504-K507 CarbonylContact O-C 3.58Å; K504-K507 PolarHBondContact O-N 3.04Å; K507-A511 WeakPolarHBondContact O-CB 3.37Å; K507-A511 PolarHBondContact O-N 3.4Å
508	Q	75.9	Confident	73.4	Confident	135 Å²	135	103.1 Å²	103.1	63%	0.631	53%	0.529	S	S	*	.	H	α-helix	trans	-73.7	-42.6	175.2	-167.2	165.6	-1.5	0	0	111.6	K504 N505 V506 V510 A511 E512	K504-Q508 WeakPolarHBondContact O-CB 3.36Å; K504-Q508 PolarHBondContact O-N 3.15Å; N505-Q508 PolarHBondContact O-N 3.46Å; V506-Q508 VanDerWaalsContact C-N 3.25Å; V506-Q508 PolarHBondContact O-N 3.17Å; Q508-V510 VanDerWaalsContact C-N 3.33Å; Q508-V510 PolarHBondContact O-N 2.99Å; Q508-A511 WeakPolarHBondContact O-CB 3.33Å; Q508-A511 PolarHBondContact O-N 2.91Å; Q508-E512 WeakPolarHBondContact O-CB 3.4Å; Q508-E512 PolarHBondContact O-N 3.02Å
509	Q	74.6	Confident	72.1	Confident	120 Å²	120	104.1 Å²	104.1	56%	0.561	54%	0.536	S	S	*	.	H	α-helix	trans	-60.6	-40.4	170.3	-72.3	179.3	-18.2	0	0	112.3	N505 V506 E512 L513	N505-Q509 PolarHBondContact O-N 3.47Å; V506-Q509 PolarHBondContact O-N 2.83Å; Q509-E512 PolarHBondContact O-N 3.43Å; Q509-L513 WeakPolarHBondContact O-CB 3.24Å; Q509-L513 WeakPolarHBondContact O-CG 3.36Å; Q509-L513 PolarHBondContact O-N 3.02Å
510	V	75.1	Confident	70.9	Confident	82 Å²	82	105.7 Å²	105.7	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-63.6	-40.4	174.1	169.4	0	0	0	0	111.2	V506 Q508 T514	V506-V510 WeakPolarHBondContact O-CG2 3.45Å; V506-V510 PolarHBondContact O-N 2.84Å; Q508-V510 VanDerWaalsContact C-N 3.33Å; Q508-V510 PolarHBondContact O-N 2.99Å; V510-T514 VanDerWaalsContact O-CB 3.31Å; V510-T514 WeakPolarHBondContact O-CB 3.42Å; V510-T514 PolarHBondContact O-N 2.83Å; V510-T514 PolarHBondContact O-OG1 2.95Å
511	A	73.6	Confident	69.5	Low	57 Å²	57	107.1 Å²	107.1	47%	0.471	56%	0.557	S	S	.	*	H	α-helix	trans	-65.5	-37.9	174.5	0	0	0	0	0	112.4	K507 Q508 T514 A515	K507-A511 WeakPolarHBondContact O-CB 3.37Å; K507-A511 PolarHBondContact O-N 3.4Å; Q508-A511 WeakPolarHBondContact O-CB 3.33Å; Q508-A511 PolarHBondContact O-N 2.91Å; A511-T514 WeakPolarHBondContact O-CB 3.33Å; A511-T514 PolarHBondContact O-N 3.32Å; A511-A515 PolarHBondContact O-N 2.74Å
512	E	73.4	Confident	68.1	Low	124 Å²	124	108.4 Å²	108.4	58%	0.579	57%	0.568	S	S	*	*	H	α-helix	trans	-68.7	-43.2	178.7	-165.9	164.6	-129.4	0	0	112	Q508 Q509 T514 A515 Q516	Q508-E512 WeakPolarHBondContact O-CB 3.4Å; Q508-E512 PolarHBondContact O-N 3.02Å; Q509-E512 PolarHBondContact O-N 3.43Å; E512-T514 VanDerWaalsContact C-N 3.33Å; E512-T514 PolarHBondContact O-N 3.28Å; E512-A515 WeakPolarHBondContact O-CB 3.42Å; E512-A515 PolarHBondContact O-N 2.69Å; E512-Q516 WeakPolarHBondContact O-CG 3.33Å; E512-Q516 PolarHBondContact O-N 3.44Å
513	L	69.1	Low	66.4	Low	104 Å²	104	115.1 Å²	115.1	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-63.9	-36.2	169.8	-72.7	166.2	0	0	0	112.4	Q509 Q516 L517	Q509-L513 WeakPolarHBondContact O-CB 3.24Å; Q509-L513 WeakPolarHBondContact O-CG 3.36Å; Q509-L513 PolarHBondContact O-N 3.02Å; L513-Q516 PolarHBondContact O-N 3.34Å; L513-L517 PolarHBondContact O-N 3.2Å
514	T	67.8	Low	64.5	Low	81 Å²	81	117.7 Å²	117.7	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-67	-37.7	174.8	-56.4	0	0	0	0	111.1	V510 A511 E512 L517 H518	V510-T514 VanDerWaalsContact O-CB 3.31Å; V510-T514 WeakPolarHBondContact O-CB 3.42Å; V510-T514 PolarHBondContact O-N 2.83Å; V510-T514 PolarHBondContact O-OG1 2.95Å; A511-T514 WeakPolarHBondContact O-CB 3.33Å; A511-T514 PolarHBondContact O-N 3.32Å; E512-T514 VanDerWaalsContact C-N 3.33Å; E512-T514 PolarHBondContact O-N 3.28Å; T514-L517 PolarHBondContact O-N 3.48Å; T514-H518 PolarHBondContact O-N 2.89Å
515	A	66.4	Low	62.2	Low	58 Å²	58	117.4 Å²	117.4	48%	0.479	62%	0.621	S	S	.	*	H	α-helix	trans	-64.7	-42.4	175	0	0	0	0	0	111.8	A511 E512 L517 H518 E519	A511-A515 PolarHBondContact O-N 2.74Å; E512-A515 WeakPolarHBondContact O-CB 3.42Å; E512-A515 PolarHBondContact O-N 2.69Å; A515-L517 PolarHBondContact O-N 2.77Å; A515-H518 CarbonylContact O-C 3.51Å; A515-H518 WeakPolarHBondContact O-CB 3.42Å; A515-H518 PolarHBondContact O-N 3.33Å; A515-E519 PolarHBondContact O-N 2.92Å
516	Q	62.5	Low	59.9	Low	109 Å²	109	117.7 Å²	117.7	51%	0.509	64%	0.636	S	S	.	*	H	α-helix	trans	-63	-38.7	175	-68.6	172.2	11.2	0	0	112.4	E512 L513 H518 E519 L520	E512-Q516 WeakPolarHBondContact O-CG 3.33Å; E512-Q516 PolarHBondContact O-N 3.44Å; L513-Q516 PolarHBondContact O-N 3.34Å; Q516-H518 VanDerWaalsContact C-N 3.31Å; Q516-H518 PolarHBondContact O-N 3.41Å; Q516-E519 PolarHBondContact O-N 3.03Å; Q516-L520 PolarHBondContact O-N 3.02Å
517	L	58.2	Low	57.5	Low	125 Å²	125	118.2 Å²	118.2	65%	0.654	65%	0.649	S	S	*	*	H	α-helix	trans	-64.7	-33.4	170.9	-81.9	165.7	0	0	0	112.7	L513 T514 A515 S521	L513-L517 PolarHBondContact O-N 3.2Å; T514-L517 PolarHBondContact O-N 3.48Å; A515-L517 PolarHBondContact O-N 2.77Å; L517-S521 PolarHBondContact O-N 2.88Å
518	H	59.7	Low	55.2	Low	127 Å²	127	117.8 Å²	117.8	59%	0.588	66%	0.659	S	S	*	*	H	α-helix	trans	-75.6	-35.3	177.8	-144.4	25.2	0	0	0	112.4	T514 A515 Q516 L520 S521 T522	T514-H518 PolarHBondContact O-N 2.89Å; A515-H518 CarbonylContact O-C 3.51Å; A515-H518 WeakPolarHBondContact O-CB 3.42Å; A515-H518 PolarHBondContact O-N 3.33Å; Q516-H518 VanDerWaalsContact C-N 3.31Å; Q516-H518 PolarHBondContact O-N 3.41Å; H518-L520 PolarHBondContact O-N 3.23Å; H518-S521 PolarHBondContact O-N 3.3Å; H518-S521 VanDerWaalsContact O-N 3.07Å; H518-T522 PolarHBondContact O-N 3.44Å; H518-T522 PolarHBondContact O-OG1 3.08Å
519	E	55.6	Low	52.9	Low	153 Å²	153	117.6 Å²	117.6	72%	0.715	67%	0.666	S	S	*	*	H	α-helix	trans	-62.7	-40.2	176.4	-168.6	169.6	-142.2	0	0	112.1	A515 Q516 S521	A515-E519 PolarHBondContact O-N 2.92Å; Q516-E519 PolarHBondContact O-N 3.03Å; E519-S521 VanDerWaalsContact C-N 3.3Å; E519-S521 PolarHBondContact O-N 3.37Å
520	L	52.1	Low	51.6	Low	150 Å²	150	117.6 Å²	117.6	79%	0.785	68%	0.677	S	S	*	*	H	α-helix	trans	-64.6	-31.2	171.2	-78.1	167.6	0	0	0	113.5	Q516 H518	Q516-L520 PolarHBondContact O-N 3.02Å; H518-L520 PolarHBondContact O-N 3.23Å
521	S	49.9	Very low	49.4	Very low	85 Å²	85	117.7 Å²	117.7	59%	0.594	69%	0.694	S	S	*	*	H	α-helix	trans	-81.7	-26.8	-177.4	-164.5	0	0	0	0	113.3	L517 H518 E519 R523	L517-S521 PolarHBondContact O-N 2.88Å; H518-S521 PolarHBondContact O-N 3.3Å; H518-S521 VanDerWaalsContact O-N 3.07Å; E519-S521 VanDerWaalsContact C-N 3.3Å; E519-S521 PolarHBondContact O-N 3.37Å; S521-R523 PolarHBondContact O-N 3.11Å; S521-R523 VanDerWaalsContact O-N 3.1Å
522	T	46.4	Very low	47.3	Very low	107 Å²	107	118.7 Å²	118.7	66%	0.656	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	22.7	-167.8	-47.7	0	0	0	0	113.8	H518	H518-T522 PolarHBondContact O-N 3.44Å; H518-T522 PolarHBondContact O-OG1 3.08Å
523	R	44.9	Very low	46.3	Very low	236 Å²	236	118.7 Å²	118.7	89%	0.891	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	8.4	-179.5	-141.2	178.6	-177.9	-172.8	0.4	115.9	S521	S521-R523 PolarHBondContact O-N 3.11Å; S521-R523 VanDerWaalsContact O-N 3.1Å
524	Q	36.3	Very low	45.5	Very low	184 Å²	184	118.5 Å²	118.5	86%	0.86	73%	0.725	S	S	*	*	S	Bend	trans	-129.8	107.9	169.4	-77.9	-170.6	-25.9	0	0	113.4
525	A	31.4	Very low	43.7	Very low	106 Å²	106	122.2 Å²	122.2	88%	0.876	74%	0.742	S	S	*	*			trans	44.3	133.1	145.9	0	0	0	0	0	121.9
526	A	28	Very low	43.2	Very low	104 Å²	104	124.7 Å²	124.7	86%	0.86	75%	0.753	S	S	*	*			trans	-62.5	148.6	171.5	0	0	0	0	0	115.4
527	A	28.9	Very low	42.7	Very low	93 Å²	93	125.3 Å²	125.3	77%	0.769	77%	0.766	S	S	*	*			trans	-167.9	125.8	141.2	0	0	0	0	0	115.1
528	V	29.3	Very low	41.5	Very low	134 Å²	134	122.9 Å²	122.9	81%	0.812	77%	0.772	S	S	*	*				62.5	97.4	129.6	-176	0	0	0	0	122.2
529	V	28.2	Very low	41.1	Very low	130 Å²	130	122.7 Å²	122.7	79%	0.788	78%	0.781	S	S	*	*			trans	61	-162.7	131.6	-140.4	0	0	0	0	118.7
530	P	46.6	Very low	41	Very low	121 Å²	121	121.6 Å²	121.6	79%	0.786	79%	0.788	S	S	*	*				-126.3	162.7	-117.1	41.7	-25.3	0	0	0	120.6
531	G	28.7	Very low	40	Very low	84 Å²	84	118.5 Å²	118.5	87%	0.866	79%	0.792	S	S	*	*			trans	101.4	160.3	133.4	0	0	0	0	0	119.5
532	G	29.1	Very low	39.3	Very low	77 Å²	77	119.9 Å²	119.9	79%	0.794	80%	0.802	S	S	*	*			trans	119.7	137.8	163.9	0	0	0	0	0	117.8
533	P	53.7	Low	39.2	Very low	125 Å²	125	120.8 Å²	120.8	81%	0.812	81%	0.81	S	S	*	*			trans	-115.8	-148.2	166.1	46	-34.4	0	0	0	109.4
534	P	52.4	Low	38.4	Very low	99 Å²	99	117.6 Å²	117.6	64%	0.643	81%	0.809	S	S	*	*			cis	-135.5	-179.6	-25.3	42.2	-25.7	0	0	0	115.6
535	L	29.1	Very low	39.3	Very low	160 Å²	160	114.3 Å²	114.3	84%	0.838	80%	0.804	S	S	*	*			trans	70.3	-163.6	148.8	-69.6	160.4	0	0	0	118.9
536	P	55.7	Low	40.3	Very low	109 Å²	109	114.9 Å²	114.9	71%	0.708	80%	0.799	S	S	*	*				-134.1	-135.5	-110.1	44.8	-21.4	0	0	0	112.1
537	P	53.5	Low	41.4	Very low	122 Å²	122	115.1 Å²	115.1	79%	0.792	79%	0.791	S	S	*	*			cis	-126.5	-171.6	-35.7	39.6	-23.2	0	0	0	113.4
538	G	31.1	Very low	42.3	Very low	75 Å²	75	116.5 Å²	116.5	77%	0.773	79%	0.793	S	S	*	*			trans	177.8	111.3	166	0	0	0	0	0	117.1
539	P	51.6	Low	42.8	Very low	122 Å²	122	118.4 Å²	118.4	79%	0.792	80%	0.795	S	S	*	*			trans	-121.4	-158	179.5	38.7	-21.8	0	0	0	113.2
540	P	53.9	Low	43.7	Very low	130 Å²	130	117.3 Å²	117.3	84%	0.844	79%	0.79	S	S	*	*				-126.5	178.7	-78.7	40.9	-25.8	0	0	0	113.9
541	G	32.4	Very low	43	Very low	85 Å²	85	116.7 Å²	116.7	88%	0.876	79%	0.788	S	S	*	*			trans	175.5	148	166.2	0	0	0	0	0	117.8
542	S	34.2	Very low	43.3	Very low	115 Å²	115	120 Å²	120	80%	0.804	79%	0.786	S	S	*	*			trans	-112.3	164.8	170	61	0	0	0	0	110.6
543	P	44.2	Very low	43.4	Very low	126 Å²	126	121 Å²	121	82%	0.818	79%	0.786	S	S	*	*				-155.6	-139	88.6	42.1	-19.4	0	0	0	115.3
544	L	28.4	Very low	42.5	Very low	169 Å²	169	118.5 Å²	118.5	89%	0.885	78%	0.783	S	S	*	*			trans	-113.7	-136.5	-157.4	-62.8	159.2	0	0	0	115.8
545	P	55.8	Low	41.6	Very low	115 Å²	115	122.4 Å²	122.4	75%	0.747	80%	0.795	S	S	*	*			trans	-120.7	-141.8	-132.8	39.3	-14.5	0	0	0	112.9
546	P	52	Low	41.8	Very low	118 Å²	118	120.7 Å²	120.7	77%	0.766	80%	0.795	S	S	*	*			cis	-125.7	-84.6	-13.4	20.4	5.7	0	0	0	123
547	P	51.5	Low	42.1	Very low	109 Å²	109	121.1 Å²	121.1	71%	0.708	80%	0.798	S	S	*	*			trans	-122.1	-156.9	-146.6	45.6	-27.2	0	0	0	114
548	P	47.1	Very low	42.7	Very low	122 Å²	122	120.5 Å²	120.5	79%	0.792	79%	0.794	S	S	*	*			cis	-143.2	-165.4	3	43.3	-20.5	0	0	0	118.4
549	M	40.4	Very low	43.7	Very low	174 Å²	174	122.9 Å²	122.9	86%	0.857	80%	0.796	S	S	*	*			trans	-83.2	178.8	161.3	-78.6	-162.6	-66	0	0	111.7
550	P	46.9	Very low	43.8	Very low	107 Å²	107	122.4 Å²	122.4	70%	0.695	79%	0.793	S	S	*	*			cis	-156.4	173.7	28.6	44.8	-22.5	0	0	0	122.3
551	S	32.1	Very low	44.1	Very low	107 Å²	107	122.1 Å²	122.1	75%	0.748	79%	0.791	S	S	*	*			trans	65.9	164.2	149.9	71.3	0	0	0	0	119.7
552	L	33.9	Very low	45.7	Very low	154 Å²	154	123.3 Å²	123.3	81%	0.806	78%	0.783	S	S	*	*			cis	-163.4	154.3	18.3	-144.6	152.7	0	0	0	112.2
553	A	31.8	Very low	46.6	Very low	98 Å²	98	124.2 Å²	124.2	81%	0.81	79%	0.786	S	S	*	*			trans	66.3	147.4	165.3	0	0	0	0	0	120.4
554	G	34.4	Very low	46.3	Very low	72 Å²	72	122.1 Å²	122.1	74%	0.742	79%	0.787	S	S	*	*			cis	176.2	-176.8	-6.6	0	0	0	0	0	115.3
555	M	34.4	Very low	46.7	Very low	181 Å²	181	118 Å²	118	89%	0.892	79%	0.785	S	S	*	*			trans	93.4	92.5	165.9	-55.4	-173.8	71.1	0	0	123.1
556	C	32.9	Very low	45.8	Very low	124 Å²	124	117.4 Å²	117.4	84%	0.838	79%	0.791	S	S	*	*				73.5	157.9	124.6	-64.6	0	0	0	0	125.7
557	P	61.3	Low	45.3	Very low	118 Å²	118	120.5 Å²	120.5	77%	0.766	80%	0.797	S	S	*	*			trans	-135.4	-149.4	-155.7	44.9	-24.7	0	0	0	114.6
558	P	65.9	Low	45.2	Very low	110 Å²	110	120.7 Å²	120.7	71%	0.714	80%	0.799	S	S	*	*			cis	-118.2	171.8	-44.9	38.4	-24.2	0	0	0	113.4
559	P	53.1	Low	45.2	Very low	124 Å²	124	120.8 Å²	120.8	81%	0.805	80%	0.799	S	S	*	*				-148.3	-128.8	103.1	30.4	-4.1	0	0	0	116.8
560	P	53.2	Low	45.9	Very low	113 Å²	113	118 Å²	118	73%	0.734	79%	0.794	S	S	*	*				-117.8	176.7	-107.4	39.1	-22	0	0	0	118.1
561	P	59.2	Low	46.4	Very low	123 Å²	123	118.5 Å²	118.5	80%	0.799	80%	0.797	S	S	*	*			trans	-130	-134.8	-156.5	37	-12.4	0	0	0	117.2
562	P	66.2	Low	47.5	Very low	110 Å²	110	119.2 Å²	119.2	71%	0.714	80%	0.799	S	S	*	*				-133.2	170.3	-112.5	43.2	-23.9	0	0	0	117.9
563	P	53.1	Low	48.7	Very low	134 Å²	134	117.4 Å²	117.4	87%	0.87	80%	0.797	S	S	*	*				-144.8	171.5	129.1	38.6	-25.1	0	0	0	114.1
564	G	38.8	Very low	49.8	Very low	82 Å²	82	118.2 Å²	118.2	85%	0.845	79%	0.794	S	S	*	*			cis	144	93.3	-13.6	0	0	0	0	0	116.3
565	G	35.5	Very low	50.8	Low	82 Å²	82	120.4 Å²	120.4	85%	0.845	80%	0.795	S	S	*	*			trans	152.3	144.6	166.4	0	0	0	0	0	114.8
566	A	38.3	Very low	51.3	Low	104 Å²	104	118.2 Å²	118.2	86%	0.86	79%	0.794	S	S	*	*			cis	-153.1	167.5	-6.7	0	0	0	0	0	111.5
567	M	41.2	Very low	51.6	Low	182 Å²	182	115.9 Å²	115.9	90%	0.897	79%	0.791	S	S	*	*			trans	-134.9	165.9	-174.7	-94.3	-156.9	-57.8	0	0	112.9
568	P	48.4	Very low	51	Low	114 Å²	114	113.5 Å²	113.5	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.6	166.5	-178.1	29.4	-36.9	0	0	0	115.1
569	P	47.1	Very low	49.9	Very low	123 Å²	123	114.1 Å²	114.1	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-83.7	152.3	-168.1	32.7	-37	0	0	0	115.9
570	P	55.7	Low	49.2	Very low	117 Å²	117	113.7 Å²	113.7	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-92.5	166.5	177.9	37	-36.1	0	0	0	114.9
571	P	57.3	Low	48.4	Very low	117 Å²	117	113.8 Å²	113.8	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80	167.7	-178.5	32.9	-37.5	0	0	0	115.2
572	P	56	Low	47.4	Very low	121 Å²	121	113.3 Å²	113.3	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73.8	155.9	-178.1	30.2	-36.9	0	0	0	114.8
573	P	59.7	Low	46.2	Very low	117 Å²	117	113.8 Å²	113.8	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-85.2	157.7	-175.9	34.5	-36.7	0	0	0	114.6
574	P	54.4	Low	45.2	Very low	115 Å²	115	111 Å²	111	75%	0.747	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.7	162.1	172.2	33.1	-36.1	0	0	0	112.9
575	P	54.9	Low	44.9	Very low	117 Å²	117	116.3 Å²	116.3	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.9	158.3	-178.3	29.5	-36.1	0	0	0	113.5	G577	P575-G577 PolarHBondContact O-N 3.19Å
576	P	44.8	Very low	44.6	Very low	136 Å²	136	116.5 Å²	116.5	88%	0.883	78%	0.781	S	S	*	*			trans	-70	115.1	-175.7	-17.6	32.1	0	0	0	112.9
577	G	40	Very low	44.6	Very low	74 Å²	74	117.6 Å²	117.6	76%	0.763	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-70.5	137.2	165.7	0	0	0	0	0	111.3	P575	P575-G577 PolarHBondContact O-N 3.19Å
578	G	47.4	Very low	44.1	Very low	68 Å²	68	117.3 Å²	117.3	70%	0.701	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68.9	164.8	172.5	0	0	0	0	0	112.8
579	P	43.2	Very low	43.7	Very low	123 Å²	123	115.9 Å²	115.9	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-63.1	147.4	175.5	28.3	-35	0	0	0	111.2
580	P	38.6	Very low	42.9	Very low	115 Å²	115	112.6 Å²	112.6	75%	0.747	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.9	149.5	176.2	28.5	-35	0	0	0	111.2
581	P	37.2	Very low	42	Very low	115 Å²	115	114.5 Å²	114.5	75%	0.747	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67	148.9	-179.9	28.4	-35.1	0	0	0	111.8
582	P	37.4	Very low	40.9	Very low	113 Å²	113	114.4 Å²	114.4	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.7	147.5	173.6	28.9	-34.8	0	0	0	110.8	G584	P582-G584 PolarHBondContact O-N 3.49Å
583	P	41.6	Very low	40.1	Very low	121 Å²	121	114.2 Å²	114.2	79%	0.786	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.2	127.1	175.8	-25.8	35.2	0	0	0	112.3
584	G	31.5	Very low	39	Very low	76 Å²	76	114 Å²	114	78%	0.784	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.6	139.8	177.7	0	0	0	0	0	112	P582 A586	P582-G584 PolarHBondContact O-N 3.49Å; G584-A586 PolarHBondContact O-N 3.31Å
585	H	32.4	Very low	38.3	Very low	192 Å²	192	115.2 Å²	115.2	89%	0.889	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.4	117.7	174	-72.4	47.8	0	0	0	109.7
586	A	30.5	Very low	38	Very low	86 Å²	86	113.4 Å²	113.4	71%	0.711	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77	140.7	168.9	0	0	0	0	0	110.3	G584 M588	G584-A586 PolarHBondContact O-N 3.31Å; A586-M588 PolarHBondContact O-N 3.26Å
587	P	38.2	Very low	37.5	Very low	128 Å²	128	111.1 Å²	111.1	83%	0.831	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-75.3	123.4	179.2	30.1	-33.4	0	0	0	110.9
588	M	29	Very low	37.5	Very low	176 Å²	176	113.7 Å²	113.7	87%	0.867	78%	0.778	S	S	*	*			trans	-107.3	85.6	174.6	-100.1	-65.9	-175.2	0	0	111.6	A586	A586-M588 PolarHBondContact O-N 3.26Å
589	G	41.3	Very low	37.2	Very low	83 Å²	83	118.9 Å²	118.9	86%	0.856	79%	0.789	S	S	*	*			trans	-106.2	107.8	150.6	0	0	0	0	0	108.1
590	G	30	Very low	37.1	Very low	54 Å²	54	115.7 Å²	115.7	56%	0.557	78%	0.778	S	S	*	*			trans	174.9	106.6	-178.2	0	0	0	0	0	115.4
591	I	35.9	Very low	37.4	Very low	158 Å²	158	116.4 Å²	116.4	81%	0.81	78%	0.783	S	S	*	*			trans	49.5	123.5	144	-50.3	176.8	0	0	0	118.2
592	P	35.6	Very low	37.6	Very low	114 Å²	114	116.4 Å²	116.4	74%	0.74	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.2	140.8	172.9	30.1	-35.1	0	0	0	111.9
593	P	37.6	Very low	38.5	Very low	117 Å²	117	116.9 Å²	116.9	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.1	151.8	-179.7	30	-35.4	0	0	0	112.5
594	P	38.4	Very low	39.1	Very low	114 Å²	114	120.5 Å²	120.5	74%	0.74	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.6	153.3	178.6	30.9	-35.7	0	0	0	112.4	G596	P594-G596 PolarHBondContact O-N 3.4Å
595	P	39.6	Very low	40	Very low	139 Å²	139	126.7 Å²	126.7	90%	0.903	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	122	176.5	29.4	-33.4	0	0	0	111
596	G	47.9	Very low	41.5	Very low	79 Å²	79	123.6 Å²	123.6	81%	0.814	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.4	-7.5	173.5	0	0	0	0	0	118.1	P594	P594-G596 PolarHBondContact O-N 3.4Å
597	A	34.2	Very low	42.9	Very low	89 Å²	89	126.3 Å²	126.3	74%	0.736	78%	0.782	S	S	*	*			trans	-78.8	141.6	177.5	0	0	0	0	0	112.2
598	P	40.3	Very low	44.8	Very low	128 Å²	128	123.5 Å²	123.5	83%	0.831	76%	0.759	S	S	*	*			trans	-66.4	138.5	178.4	-20.4	32.8	0	0	0	113	G600	P598-G600 PolarHBondContact O-N 3.35Å
599	L	40.3	Very low	47.2	Very low	177 Å²	177	118.5 Å²	118.5	93%	0.927	74%	0.74	S	S	*	*			trans	-69.7	115.4	164.9	-80.4	147.8	0	0	0	109.3
600	G	41.9	Very low	48.9	Very low	56 Å²	56	121.9 Å²	121.9	58%	0.577	73%	0.733	S	S	*	*			trans	-61.5	155	166.7	0	0	0	0	0	111.4	P598 S602	P598-G600 PolarHBondContact O-N 3.35Å; G600-S602 PolarHBondContact O-N 2.72Å; G600-S602 VanDerWaalsContact O-N 3.09Å
601	P	43.6	Very low	51.3	Low	130 Å²	130	122.3 Å²	122.3	84%	0.844	73%	0.726	S	S	*	*			trans	-66.4	111.7	-173.8	27	-34.3	0	0	0	111.2	L603	P601-L603 PolarHBondContact O-N 3.03Å
602	S	43.3	Very low	53.4	Low	114 Å²	114	120.7 Å²	120.7	80%	0.797	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-67	118.4	171.4	44	0	0	0	0	110.1	G600 K604	G600-S602 PolarHBondContact O-N 2.72Å; G600-S602 VanDerWaalsContact O-N 3.09Å; S602-K604 PolarHBondContact O-N 3.16Å
603	L	55.3	Low	55.3	Low	123 Å²	123	119 Å²	119	64%	0.644	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-60.7	130.5	177.5	-70.6	171.8	0	0	0	109.8	P601 K605	P601-L603 PolarHBondContact O-N 3.03Å; L603-K605 PolarHBondContact O-N 2.83Å
604	K	55	Low	57.2	Low	197 Å²	197	115.5 Å²	115.5	86%	0.857	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-65.2	124.7	-178	-68.8	-178.9	179.5	177.5	0	109.7	S602 K606	S602-K604 PolarHBondContact O-N 3.16Å; K604-K606 PolarHBondContact O-N 3.4Å
605	K	48.9	Very low	59.3	Low	207 Å²	207	112.2 Å²	112.2	90%	0.9	66%	0.662	S	S	*	*			trans	-54.9	110.6	179.1	-164	175.3	-172.9	179.5	0	110.1	L603	L603-K605 PolarHBondContact O-N 2.83Å
606	K	65.8	Low	61.1	Low	126 Å²	126	108.1 Å²	108.1	55%	0.548	63%	0.63	S	S	.	*			trans	-60	140.4	-175.3	-71.1	-174.1	173.4	-176.7	0	111.5	K604 I608 D638	K604-K606 PolarHBondContact O-N 3.4Å; K606-I608 HydrophobicContact CB-CD1 4.24Å; K606-I608 HydrophobicContact CB-CG1 4.04Å; K606-D638 IonicContact NZ-OD1 2.69Å; K606-D638 PolarHBondContact NZ-OD1 2.89Å
607	T	59	Low	62.4	Low	143 Å²	143	106.1 Å²	106.1	88%	0.877	60%	0.604	S	S	*	*			trans	-94.5	102.1	173.3	-46.8	0	0	0	0	108.9
608	I	78.6	Confident	64.5	Low	70 Å²	70	109.2 Å²	109.2	36%	0.359	60%	0.601	S	S	.	*			trans	-111.3	132.3	-174.5	-57.3	175.2	0	0	0	108.8	K606 Q610 F642	K606-I608 HydrophobicContact CB-CD1 4.24Å; K606-I608 HydrophobicContact CB-CG1 4.04Å; I608-Q610 PolarHBondContact O-N 3.06Å; I608-Q610 PolarHBondContact O-NE2 2.81Å; I608-F642 HydrophobicContact CG2-CE1 4.44Å; I608-F642 HydrophobicContact CG2-CE2 3.79Å; I608-F642 HydrophobicContact CG2-CZ 3.72Å
609	P	78.6	Confident	66.1	Low	71 Å²	71	107.3 Å²	107.3	46%	0.461	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-55.8	135.9	173.1	-23	33.6	0	0	0	111.4	F642 L647	P609-F642 HydrophobicContact CG-CB 4.49Å; P609-L647 HydrophobicContact CB-CD1 4.23Å
610	Q	77.5	Confident	68	Low	153 Å²	153	106.5 Å²	106.5	72%	0.715	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-101	141.6	175.1	-58.9	-53.5	-61.2	0	0	109.6	I608	I608-Q610 PolarHBondContact O-N 3.06Å; I608-Q610 PolarHBondContact O-NE2 2.81Å
611	P	80.4	Confident	69.7	Low	63 Å²	63	109.8 Å²	109.8	41%	0.409	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-70.8	151.6	179.4	31.7	-35.9	0	0	0	111.2	L615 E651	P611-L615 HydrophobicContact CB-CD1 3.96Å; P611-L615 HydrophobicContact CB-CG 4.16Å; P611-L615 HydrophobicContact CG-CD1 4.25Å; P611-L615 HydrophobicContact CG-CG 4.27Å; P611-E651 HydrophobicContact CB-CG 3.84Å
612	T	79.6	Confident	71.6	Confident	124 Å²	124	111.9 Å²	111.9	76%	0.761	58%	0.578	S	S	*	*	S	Bend	trans	-74.4	-29.7	178.8	-34.6	0	0	0	0	111.8	E651	T612-E651 WeakPolarHBondContact CB-OE1 3.29Å; T612-E651 WeakPolarHBondContact CB-OE2 3.48Å; T612-E651 PolarHBondContact N-OE1 3.46Å; T612-E651 PolarHBondContact N-OE2 3.37Å; T612-E651 PolarHBondContact OG1-OE1 2.76Å
613	N	76.4	Confident	73.4	Confident	79 Å²	79	110.2 Å²	110.2	42%	0.422	56%	0.56	S	S	.	*	S	Bend	trans	-122.6	148.5	177.5	-58.3	-96.9	0	0	0	110.7	L615 E651	N613-L615 WeakPolarHBondContact O-CD2 3.22Å; N613-E651 PolarHBondContact N-OE2 3.38Å; N613-E651 PolarHBondContact ND2-OE2 2.87Å
614	P	76.6	Confident	74.8	Confident	44 Å²	44	106.7 Å²	106.7	29%	0.286	55%	0.549	S	S	.	.			trans	-61.2	138.9	173.5	-22.3	33.7	0	0	0	113	A656 Y657 H749	P614-A656 HydrophobicContact CB-CB 4.18Å; P614-A656 WeakPolarHBondContact O-CB 3.22Å; P614-A656 PolarHBondContact O-N 3.25Å; P614-Y657 HydrophobicContact CG-CE2 4.24Å; P614-H749 WeakPolarHBondContact CB-CE1 3.3Å
615	L	82.9	Confident	76	Confident	44 Å²	44	104.6 Å²	104.6	23%	0.23	54%	0.542	C	S	.	.	B	Isolated β-bridge	trans	-118.5	157.5	-175.5	-52.8	-173.6	0	0	0	111.7	P611 N613 S617 E651 F654 V689	P611-L615 HydrophobicContact CB-CD1 3.96Å; P611-L615 HydrophobicContact CB-CG 4.16Å; P611-L615 HydrophobicContact CG-CD1 4.25Å; P611-L615 HydrophobicContact CG-CG 4.27Å; N613-L615 WeakPolarHBondContact O-CD2 3.22Å; L615-S617 PolarHBondContact O-N 3.49Å; L615-E651 HydrophobicContact CD1-CG 4.32Å; L615-E651 HydrophobicContact CD2-CB 4.2Å; L615-E651 HydrophobicContact CD2-CG 4.13Å; L615-E651 WeakPolarHBondContact CD2-O 3.48Å; L615-F654 CarbonylContact C-O 3.59Å; L615-F654 WeakPolarHBondContact CA-O 3.42Å; L615-V689 WeakPolarHBondContact O-CG1 3.47Å
616	K	76.3	Confident	77.6	Confident	53 Å²	53	101.5 Å²	101.5	23%	0.23	54%	0.535	C	S	.	.			trans	-54.6	132.3	169	-70.6	-92	175.1	-179.5	0	109.8	F654 S688	K616-F654 PolarHBondContact N-O 3.05Å; K616-S688 VanDerWaalsContact CD-O 3.26Å; K616-S688 WeakPolarHBondContact CD-O 3.36Å; K616-S688 WeakPolarHBondContact CE-O 3.3Å; K616-S688 VanDerWaalsContact NZ-CB 3.29Å; K616-S688 PolarHBondContact NZ-O 2.94Å; K616-S688 PolarHBondContact NZ-OG 3.41Å
617	S	76.9	Confident	78.5	Confident	38 Å²	38	102.1 Å²	102.1	27%	0.266	54%	0.538	S	S	.	.			trans	-70.4	146.9	178.1	66.3	0	0	0	0	112.1	L615 V689	L615-S617 PolarHBondContact O-N 3.49Å; S617-V689 VanDerWaalsContact CB-O 3.28Å; S617-V689 WeakPolarHBondContact CB-O 3.45Å; S617-V689 PolarHBondContact N-O 3.22Å; S617-V689 PolarHBondContact OG-O 3.44Å
618	F	78.4	Confident	79.7	Confident	153 Å²	153	97.2 Å²	97.2	67%	0.671	51%	0.506	S	S	*	.			trans	-95.2	113.1	166.9	179.6	-138.2	0	0	0	108.6	W620	F618-W620 VanDerWaalsContact C-N 3.3Å; F618-W620 HydrophobicContact CD1-CB 3.77Å; F618-W620 AromaticContact CD1-CD2 3.73Å; F618-W620 HydrophobicContact CD1-CD2 3.73Å; F618-W620 AromaticContact CD1-CE3 3.97Å; F618-W620 HydrophobicContact CD1-CE3 3.97Å; F618-W620 AromaticContact CD1-CG 3.67Å; F618-W620 HydrophobicContact CD1-CG 3.67Å; F618-W620 HydrophobicContact CE1-CB 3.66Å; F618-W620 AromaticContact CE1-CD2 3.95Å; F618-W620 HydrophobicContact CE1-CD2 3.95Å; F618-W620 AromaticContact CE1-CE3 3.8Å; F618-W620 HydrophobicContact CE1-CE3 3.8Å; F618-W620 AromaticContact CE1-CG 3.95Å; F618-W620 HydrophobicContact CE1-CG 3.95Å; F618-W620 HydrophobicContact CG-CB 4.38Å; F618-W620 HydrophobicContact CG-CG 4.41Å; F618-W620 HydrophobicContact CZ-CB 4.17Å; F618-W620 PolarHBondContact O-N 2.89Å
619	N	73.8	Confident	79.9	Confident	89 Å²	89	102.5 Å²	102.5	48%	0.476	53%	0.529	S	S	.	.			trans	-78	79.5	-178	-168.8	-8.3	0	0	0	110.9	D691	N619-D691 HydrophobicContact CB-CB 4.08Å; N619-D691 PolarHBondContact ND2-OD2 2.73Å
620	W	80	Confident	80.1	Confident	159 Å²	159	103.1 Å²	103.1	60%	0.602	55%	0.549	S	S	*	.			trans	-116.5	140	-178.6	67.1	-22.6	0	0	0	113.2	F618 K622	F618-W620 VanDerWaalsContact C-N 3.3Å; F618-W620 HydrophobicContact CD1-CB 3.77Å; F618-W620 AromaticContact CD1-CD2 3.73Å; F618-W620 HydrophobicContact CD1-CD2 3.73Å; F618-W620 AromaticContact CD1-CE3 3.97Å; F618-W620 HydrophobicContact CD1-CE3 3.97Å; F618-W620 AromaticContact CD1-CG 3.67Å; F618-W620 HydrophobicContact CD1-CG 3.67Å; F618-W620 HydrophobicContact CE1-CB 3.66Å; F618-W620 AromaticContact CE1-CD2 3.95Å; F618-W620 HydrophobicContact CE1-CD2 3.95Å; F618-W620 AromaticContact CE1-CE3 3.8Å; F618-W620 HydrophobicContact CE1-CE3 3.8Å; F618-W620 AromaticContact CE1-CG 3.95Å; F618-W620 HydrophobicContact CE1-CG 3.95Å; F618-W620 HydrophobicContact CG-CB 4.38Å; F618-W620 HydrophobicContact CG-CG 4.41Å; F618-W620 HydrophobicContact CZ-CB 4.17Å; F618-W620 PolarHBondContact O-N 2.89Å; W620-K622 PolarHBondContact O-N 2.92Å
621	S	76.6	Confident	80.7	Confident	125 Å²	125	98 Å²	98	87%	0.874	53%	0.528	S	S	*	.			trans	-83.1	104.4	174.4	-49.7	0	0	0	0	110.6	L623	S621-L623 PolarHBondContact O-N 3.44Å
622	K	83.4	Confident	81	Confident	174 Å²	174	99.4 Å²	99.4	76%	0.757	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-63.1	132.1	176.8	-65.4	177.8	-178.2	173.4	0	110.9	W620	W620-K622 PolarHBondContact O-N 2.92Å
623	L	81.2	Confident	81.3	Confident	79 Å²	79	100.5 Å²	100.5	41%	0.414	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-72.6	134.5	171.3	-156.4	76.5	0	0	0	109.5	S621 K627 L628	S621-L623 PolarHBondContact O-N 3.44Å; L623-K627 HydrophobicContact CD2-CB 4.27Å; L623-K627 WeakPolarHBondContact CD2-O 3.25Å; L623-K627 HydrophobicContact CG-CB 4.12Å; L623-L628 HydrophobicContact CB-CD1 4.16Å; L623-L628 HydrophobicContact CD2-CD1 4Å; L623-L628 HydrophobicContact CD2-CG 4.12Å; L623-L628 HydrophobicContact CG-CD1 4.38Å
624	A	84.3	Confident	81.7	Confident	49 Å²	49	102.3 Å²	102.3	41%	0.405	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-68.7	142.5	175.6	0	0	0	0	0	110.8	N626 K627	A624-N626 WeakPolarHBondContact CB-OD1 3.43Å; A624-N626 PolarHBondContact O-N 3.21Å; A624-K627 WeakPolarHBondContact O-CA 3.47Å; A624-K627 WeakPolarHBondContact O-CB 3.21Å; A624-K627 PolarHBondContact O-N 3.32Å
625	E	81.5	Confident	82.1	Confident	154 Å²	154	106.5 Å²	106.5	72%	0.72	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-57.3	-36.6	-172.5	-64.8	179.9	-175.7	0	0	112.9	K627 L628	E625-K627 PolarHBondContact O-N 2.89Å; E625-L628 PolarHBondContact O-N 3.14Å
626	N	81.8	Confident	82.2	Confident	141 Å²	141	107.9 Å²	107.9	75%	0.754	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-70.7	7.5	174.6	70.5	-21.3	0	0	0	115.1	A624	A624-N626 WeakPolarHBondContact CB-OD1 3.43Å; A624-N626 PolarHBondContact O-N 3.21Å
627	K	84.2	Confident	82.5	Confident	139 Å²	139	108 Å²	108	60%	0.604	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-124.4	3.1	174.6	-62.4	-174.4	179.5	-176.7	0	113.4	L623 A624 E625 T631	L623-K627 HydrophobicContact CD2-CB 4.27Å; L623-K627 WeakPolarHBondContact CD2-O 3.25Å; L623-K627 HydrophobicContact CG-CB 4.12Å; A624-K627 WeakPolarHBondContact O-CA 3.47Å; A624-K627 WeakPolarHBondContact O-CB 3.21Å; A624-K627 PolarHBondContact O-N 3.32Å; E625-K627 PolarHBondContact O-N 2.89Å; K627-T631 VanDerWaalsContact O-CG2 3.26Å; K627-T631 WeakPolarHBondContact O-CG2 3.5Å
628	L	83.9	Confident	82.7	Confident	41 Å²	41	108.4 Å²	108.4	22%	0.215	57%	0.565	C	S	.	*			trans	-77.5	-29	177.7	-95.8	90	0	0	0	113.4	L623 E625 G630 T631 W633 M634	L623-L628 HydrophobicContact CB-CD1 4.16Å; L623-L628 HydrophobicContact CD2-CD1 4Å; L623-L628 HydrophobicContact CD2-CG 4.12Å; L623-L628 HydrophobicContact CG-CD1 4.38Å; E625-L628 PolarHBondContact O-N 3.14Å; L628-G630 PolarHBondContact O-N 3.47Å; L628-T631 WeakPolarHBondContact O-CB 3.33Å; L628-T631 PolarHBondContact O-N 2.76Å; L628-T631 PolarHBondContact O-OG1 3.21Å; L628-W633 HydrophobicContact CD2-CB 3.78Å; L628-W633 HydrophobicContact CG-CB 4.08Å; L628-M634 HydrophobicContact CB-SD 4.45Å; L628-M634 WeakPolarHBondContact O-CG 3.22Å
629	E	84	Confident	82.9	Confident	181 Å²	181	103.3 Å²	103.3	85%	0.846	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	133.2	-176.6	-169.9	168	-156.9	0	0	111.6	T631	E629-T631 PolarHBondContact O-N 3.28Å
630	G	82.4	Confident	83.4	Confident	84 Å²	84	106.1 Å²	106.1	87%	0.866	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	73	6.5	-174.3	0	0	0	0	0	115.5	L628	L628-G630 PolarHBondContact O-N 3.47Å
631	T	90.3	Very high	83.5	Confident	45 Å²	45	102.1 Å²	102.1	28%	0.276	55%	0.548	S	S	.	.	S	Bend	trans	-104.5	159.4	176.3	76	0	0	0	0	112.6	K627 L628 E629 W633 M634	K627-T631 VanDerWaalsContact O-CG2 3.26Å; K627-T631 WeakPolarHBondContact O-CG2 3.5Å; L628-T631 WeakPolarHBondContact O-CB 3.33Å; L628-T631 PolarHBondContact O-N 2.76Å; L628-T631 PolarHBondContact O-OG1 3.21Å; E629-T631 PolarHBondContact O-N 3.28Å; T631-W633 PolarHBondContact O-N 3.24Å; T631-M634 WeakPolarHBondContact O-CB 3.23Å; T631-M634 PolarHBondContact O-N 3.2Å
632	V	85.8	Confident	83.8	Confident	93 Å²	93	99.5 Å²	99.5	56%	0.564	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-52.5	-22.8	176.2	67.6	0	0	0	0	114.1	M634 D635 V636	V632-M634 PolarHBondContact O-N 2.89Å; V632-D635 PolarHBondContact O-N 3.33Å; V632-D635 VanDerWaalsContact O-N 3.13Å; V632-V636 HydrophobicContact CG2-CG2 4.37Å; V632-V636 WeakPolarHBondContact O-CG2 3.46Å; V632-V636 PolarHBondContact O-N 2.58Å
633	W	87.8	Confident	83.8	Confident	147 Å²	147	99.7 Å²	99.7	56%	0.557	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-68.1	-9.8	178.3	-55.2	112	0	0	0	114	L628 T631	L628-W633 HydrophobicContact CD2-CB 3.78Å; L628-W633 HydrophobicContact CG-CB 4.08Å; T631-W633 PolarHBondContact O-N 3.24Å
634	M	84.3	Confident	83.9	Confident	116 Å²	116	102 Å²	102	57%	0.571	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-76.9	-29.6	170.9	-65.1	-62.9	-66	0	0	112.9	L628 T631 V632	L628-M634 HydrophobicContact CB-SD 4.45Å; L628-M634 WeakPolarHBondContact O-CG 3.22Å; T631-M634 WeakPolarHBondContact O-CB 3.23Å; T631-M634 PolarHBondContact O-N 3.2Å; V632-M634 PolarHBondContact O-N 2.89Å
635	D	84.1	Confident	83.9	Confident	132 Å²	132	103.5 Å²	103.5	71%	0.706	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-15.5	-178.2	-57.6	-56.3	0	0	0	112.9	V632 R640	V632-D635 PolarHBondContact O-N 3.33Å; V632-D635 VanDerWaalsContact O-N 3.13Å; D635-R640 PolarHBondContact O-NH2 3.39Å
636	V	84.8	Confident	84.1	Confident	74 Å²	74	101.1 Å²	101.1	45%	0.448	53%	0.532	S	S	.	.			trans	-90.4	129.1	-179	175.7	0	0	0	0	110.5	V632	V632-V636 HydrophobicContact CG2-CG2 4.37Å; V632-V636 WeakPolarHBondContact O-CG2 3.46Å; V632-V636 PolarHBondContact O-N 2.58Å
637	D	83.1	Confident	84.3	Confident	56 Å²	56	97.1 Å²	97.1	30%	0.299	51%	0.51	S	S	.	.			trans	-130.6	115.9	174.4	167.5	44	0	0	0	110.7	A639 R640	D637-A639 VanDerWaalsContact C-N 3.35Å; D637-A639 VanDerWaalsContact OD1-CB 3.29Å; D637-A639 WeakPolarHBondContact OD1-CB 3.48Å; D637-A639 PolarHBondContact OD1-N 2.8Å; D637-R640 WeakPolarHBondContact OD2-CG 3.39Å; D637-R640 PolarHBondContact OD2-N 3.35Å; D637-R640 IonicContact OD2-NE 2.63Å
638	D	82.1	Confident	84.3	Confident	45 Å²	45	94.4 Å²	94.4	24%	0.241	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-69.2	-26.4	177.6	52.3	-57.2	0	0	0	113	K606 R640 V641 F642	K606-D638 IonicContact NZ-OD1 2.69Å; K606-D638 PolarHBondContact NZ-OD1 2.89Å; D638-R640 PolarHBondContact O-N 3.45Å; D638-V641 WeakPolarHBondContact O-CB 3.19Å; D638-V641 PolarHBondContact O-N 2.84Å; D638-F642 HydrophobicContact CB-CD2 4.42Å; D638-F642 HydrophobicContact CB-CE2 3.94Å; D638-F642 WeakPolarHBondContact O-CD2 3.24Å; D638-F642 PolarHBondContact O-N 3.27Å
639	A	81.8	Confident	84.4	Confident	46 Å²	46	96.7 Å²	96.7	38%	0.38	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-66.7	-17.4	178.9	0	0	0	0	0	113.6	D637 K643	D637-A639 VanDerWaalsContact C-N 3.35Å; D637-A639 VanDerWaalsContact OD1-CB 3.29Å; D637-A639 WeakPolarHBondContact OD1-CB 3.48Å; D637-A639 PolarHBondContact OD1-N 2.8Å; A639-K643 WeakPolarHBondContact O-CE 3.35Å
640	R	83.2	Confident	84.3	Confident	149 Å²	149	90.8 Å²	90.8	56%	0.562	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-74.1	-36.6	166.9	-73.8	177.6	-71.3	-175.4	-3.2	112.5	D635 D637 D638	D635-R640 PolarHBondContact O-NH2 3.39Å; D637-R640 WeakPolarHBondContact OD2-CG 3.39Å; D637-R640 PolarHBondContact OD2-N 3.35Å; D637-R640 IonicContact OD2-NE 2.63Å; D638-R640 PolarHBondContact O-N 3.45Å
641	V	82.5	Confident	84.3	Confident	75 Å²	75	87.9 Å²	87.9	46%	0.455	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-76.5	-41.1	-172.7	-173.5	0	0	0	0	111.5	D638 K643 V644 L645	D638-V641 WeakPolarHBondContact O-CB 3.19Å; D638-V641 PolarHBondContact O-N 2.84Å; V641-K643 PolarHBondContact O-N 2.92Å; V641-V644 PolarHBondContact O-N 3.41Å; V641-L645 HydrophobicContact CG1-CD1 3.74Å; V641-L645 HydrophobicContact CG1-CG 3.96Å; V641-L645 PolarHBondContact O-N 2.94Å
642	F	83.4	Confident	83.9	Confident	70 Å²	70	92.8 Å²	92.8	31%	0.307	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-60.8	-11.2	176.3	-68.4	-65.4	0	0	0	114.8	I608 P609 D638 L647	I608-F642 HydrophobicContact CG2-CE1 4.44Å; I608-F642 HydrophobicContact CG2-CE2 3.79Å; I608-F642 HydrophobicContact CG2-CZ 3.72Å; P609-F642 HydrophobicContact CG-CB 4.49Å; D638-F642 HydrophobicContact CB-CD2 4.42Å; D638-F642 HydrophobicContact CB-CE2 3.94Å; D638-F642 WeakPolarHBondContact O-CD2 3.24Å; D638-F642 PolarHBondContact O-N 3.27Å; F642-L647 HydrophobicContact CD1-CD2 4.1Å
643	K	82.5	Confident	83.8	Confident	177 Å²	177	92.3 Å²	92.3	77%	0.77	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-90.9	-8	175.9	-62.7	178	-175.4	177.6	0	113.9	A639 V641	A639-K643 WeakPolarHBondContact O-CE 3.35Å; V641-K643 PolarHBondContact O-N 2.92Å
644	V	84.7	Confident	83.6	Confident	127 Å²	127	90.9 Å²	90.9	77%	0.77	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	-28.6	-174.5	-176.1	0	0	0	0	111.7	V641	V641-V644 PolarHBondContact O-N 3.41Å
645	L	84.1	Confident	83.6	Confident	82 Å²	82	86.4 Å²	86.4	43%	0.429	45%	0.448	S	S	.	.	S	Bend	trans	-73.8	137.5	176.1	-66.6	178.1	0	0	0	112.3	V641 L647 I650	V641-L645 HydrophobicContact CG1-CD1 3.74Å; V641-L645 HydrophobicContact CG1-CG 3.96Å; V641-L645 PolarHBondContact O-N 2.94Å; L645-L647 HydrophobicContact CB-CD2 3.97Å; L645-L647 PolarHBondContact O-N 2.6Å; L645-L647 VanDerWaalsContact O-N 3.1Å; L645-I650 HydrophobicContact CB-CD1 4Å; L645-I650 HydrophobicContact CD1-CD1 3.95Å; L645-I650 HydrophobicContact CD2-CD1 4.43Å; L645-I650 HydrophobicContact CG-CD1 4.36Å
646	D	86.1	Confident	83.1	Confident	103 Å²	103	80.1 Å²	80.1	55%	0.551	42%	0.415	S	S	*	.			trans	-73.7	97.2	163.3	-172.6	-21.2	0	0	0	109.3	V648 D649 I650	D646-V648 PolarHBondContact O-N 3.06Å; D646-V648 WeakPolarHBondContact OD1-CA 3.43Å; D646-V648 WeakPolarHBondContact OD1-CB 3.3Å; D646-V648 PolarHBondContact OD1-N 3.28Å; D646-D649 HydrophobicContact CB-CB 4.09Å; D646-D649 PolarHBondContact O-N 3.44Å; D646-D649 PolarHBondContact OD1-N 3.41Å; D646-I650 WeakPolarHBondContact O-CG1 3.35Å; D646-I650 PolarHBondContact O-N 2.83Å; D646-I650 VanDerWaalsContact O-N 3.16Å
647	L	85.3	Confident	82.8	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.304	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-24	178.7	-52.2	-175.8	0	0	0	112.2	P609 F642 L645 E651	P609-L647 HydrophobicContact CB-CD1 4.23Å; F642-L647 HydrophobicContact CD1-CD2 4.1Å; L645-L647 HydrophobicContact CB-CD2 3.97Å; L645-L647 PolarHBondContact O-N 2.6Å; L645-L647 VanDerWaalsContact O-N 3.1Å; L647-E651 WeakPolarHBondContact O-CB 3.41Å; L647-E651 WeakPolarHBondContact O-CG 3.45Å; L647-E651 PolarHBondContact O-N 3.09Å
648	V	83.7	Confident	82	Confident	82 Å²	82	80.1 Å²	80.1	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-78.9	-35	-179.4	-177	0	0	0	0	110.9	D646 K652	D646-V648 PolarHBondContact O-N 3.06Å; D646-V648 WeakPolarHBondContact OD1-CA 3.43Å; D646-V648 WeakPolarHBondContact OD1-CB 3.3Å; D646-V648 PolarHBondContact OD1-N 3.28Å; V648-K652 HydrophobicContact CG1-CD 4.46Å; V648-K652 WeakPolarHBondContact O-CD 3.44Å; V648-K652 VanDerWaalsContact O-CG 3.25Å; V648-K652 WeakPolarHBondContact O-CG 3.48Å; V648-K652 PolarHBondContact O-N 2.93Å; V648-K652 VanDerWaalsContact O-N 3.14Å
649	D	85.4	Confident	81.1	Confident	88 Å²	88	88.9 Å²	88.9	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-41.4	170.2	-171.1	61.7	0	0	0	111.8	D646 E651 K652 T653	D646-D649 HydrophobicContact CB-CB 4.09Å; D646-D649 PolarHBondContact O-N 3.44Å; D646-D649 PolarHBondContact OD1-N 3.41Å; D649-E651 PolarHBondContact O-N 3.33Å; D649-K652 PolarHBondContact O-N 3.21Å; D649-T653 VanDerWaalsContact O-CB 3.27Å; D649-T653 WeakPolarHBondContact O-CB 3.4Å; D649-T653 PolarHBondContact O-N 3.3Å; D649-T653 PolarHBondContact O-OG1 3.08Å; D649-T653 VanDerWaalsContact O-OG1 3.08Å
650	I	81.9	Confident	79.8	Confident	57 Å²	57	91.7 Å²	91.7	29%	0.292	44%	0.441	S	S	.	.	H	α-helix	trans	-60.2	-45	173.1	-68	169.3	0	0	0	110.8	L645 D646 K652 T653 F654	L645-I650 HydrophobicContact CB-CD1 4Å; L645-I650 HydrophobicContact CD1-CD1 3.95Å; L645-I650 HydrophobicContact CD2-CD1 4.43Å; L645-I650 HydrophobicContact CG-CD1 4.36Å; D646-I650 WeakPolarHBondContact O-CG1 3.35Å; D646-I650 PolarHBondContact O-N 2.83Å; D646-I650 VanDerWaalsContact O-N 3.16Å; I650-K652 VanDerWaalsContact C-N 3.33Å; I650-K652 PolarHBondContact O-N 3.27Å; I650-T653 PolarHBondContact O-N 3.23Å; I650-F654 HydrophobicContact CG2-CD2 4.22Å; I650-F654 PolarHBondContact O-N 3.26Å
651	E	84.1	Confident	78.5	Confident	23 Å²	23	90.7 Å²	90.7	11%	0.107	44%	0.443	C	S	.	.	H	α-helix	trans	-59.4	-40.8	176.3	-86.3	-160.9	-130.3	0	0	112.7	P611 T612 N613 L615 L647 D649 S655	P611-E651 HydrophobicContact CB-CG 3.84Å; T612-E651 WeakPolarHBondContact CB-OE1 3.29Å; T612-E651 WeakPolarHBondContact CB-OE2 3.48Å; T612-E651 PolarHBondContact N-OE1 3.46Å; T612-E651 PolarHBondContact N-OE2 3.37Å; T612-E651 PolarHBondContact OG1-OE1 2.76Å; N613-E651 PolarHBondContact N-OE2 3.38Å; N613-E651 PolarHBondContact ND2-OE2 2.87Å; L615-E651 HydrophobicContact CD1-CG 4.32Å; L615-E651 HydrophobicContact CD2-CB 4.2Å; L615-E651 HydrophobicContact CD2-CG 4.13Å; L615-E651 WeakPolarHBondContact CD2-O 3.48Å; L647-E651 WeakPolarHBondContact O-CB 3.41Å; L647-E651 WeakPolarHBondContact O-CG 3.45Å; L647-E651 PolarHBondContact O-N 3.09Å; D649-E651 PolarHBondContact O-N 3.33Å; E651-S655 WeakPolarHBondContact O-CB 3.46Å; E651-S655 PolarHBondContact O-N 3.46Å
652	K	81.9	Confident	76.6	Confident	149 Å²	149	93.3 Å²	93.3	65%	0.648	45%	0.454	S	S	*	.	H	α-helix	trans	-70.9	-46.2	178.5	-72.3	163.7	-174	162.9	0	112.1	V648 D649 I650	V648-K652 HydrophobicContact CG1-CD 4.46Å; V648-K652 WeakPolarHBondContact O-CD 3.44Å; V648-K652 VanDerWaalsContact O-CG 3.25Å; V648-K652 WeakPolarHBondContact O-CG 3.48Å; V648-K652 PolarHBondContact O-N 2.93Å; V648-K652 VanDerWaalsContact O-N 3.14Å; D649-K652 PolarHBondContact O-N 3.21Å; I650-K652 VanDerWaalsContact C-N 3.33Å; I650-K652 PolarHBondContact O-N 3.27Å
653	T	82.8	Confident	75.1	Confident	82 Å²	82	98.5 Å²	98.5	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-73.1	-35.8	-172.5	-66	0	0	0	0	112.1	D649 I650	D649-T653 VanDerWaalsContact O-CB 3.27Å; D649-T653 WeakPolarHBondContact O-CB 3.4Å; D649-T653 PolarHBondContact O-N 3.3Å; D649-T653 PolarHBondContact O-OG1 3.08Å; D649-T653 VanDerWaalsContact O-OG1 3.08Å; I650-T653 PolarHBondContact O-N 3.23Å
654	F	83.6	Confident	73.1	Confident	117 Å²	117	97.9 Å²	97.9	51%	0.513	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	22.7	-178.2	-60.5	-77.7	0	0	0	113.8	L615 K616 I650 A656	L615-F654 CarbonylContact C-O 3.59Å; L615-F654 WeakPolarHBondContact CA-O 3.42Å; K616-F654 PolarHBondContact N-O 3.05Å; I650-F654 HydrophobicContact CG2-CD2 4.22Å; I650-F654 PolarHBondContact O-N 3.26Å; F654-A656 PolarHBondContact O-N 2.95Å
655	S	83.6	Confident	71	Confident	23 Å²	23	100.6 Å²	100.6	16%	0.161	49%	0.487	C	S	.	.	B	Isolated β-bridge	trans	-55	135.4	176.1	-168.4	0	0	0	0	112.2	E651 Y657	E651-S655 WeakPolarHBondContact O-CB 3.46Å; E651-S655 PolarHBondContact O-N 3.46Å; S655-Y657 PolarHBondContact O-N 2.92Å; S655-Y657 PolarHBondContact OG-N 3.31Å
656	A	75.1	Confident	68.8	Low	0 Å²	0	104.4 Å²	104.4	0%	0	51%	0.506	C	S	.	.	S	Bend	trans	-66.3	-25.2	173	0	0	0	0	0	112	P614 F654 Q658 L687 S688 V689	P614-A656 HydrophobicContact CB-CB 4.18Å; P614-A656 WeakPolarHBondContact O-CB 3.22Å; P614-A656 PolarHBondContact O-N 3.25Å; F654-A656 PolarHBondContact O-N 2.95Å; A656-Q658 PolarHBondContact O-N 3.45Å; A656-L687 HydrophobicContact CB-CD1 3.67Å; A656-L687 WeakPolarHBondContact O-CA 3.41Å; A656-S688 PolarHBondContact O-N 2.87Å; A656-V689 HydrophobicContact CB-CG2 4.33Å
657	Y	77.6	Confident	66.3	Low	59 Å²	59	106.5 Å²	106.5	23%	0.231	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	105.1	176.6	-64.6	-66.9	0	0	0	111.6	P614 S655 K685 E686 L687 E752	P614-Y657 HydrophobicContact CG-CE2 4.24Å; S655-Y657 PolarHBondContact O-N 2.92Å; S655-Y657 PolarHBondContact OG-N 3.31Å; Y657-K685 HydrophobicContact CD1-CB 4.43Å; Y657-E686 CarbonylContact C-O 3.55Å; Y657-E686 WeakPolarHBondContact CA-O 3.39Å; Y657-L687 HydrophobicContact CD1-CB 4.37Å; Y657-L687 HydrophobicContact CD1-CD1 4.01Å; Y657-L687 HydrophobicContact CE1-CB 4.46Å; Y657-L687 HydrophobicContact CE1-CD1 3.89Å; Y657-E752 WeakPolarHBondContact CE1-OE2 3.44Å; Y657-E752 PolarHBondContact OH-OE1 3.28Å; Y657-E752 PolarHBondContact OH-OE2 2.95Å
658	Q	67	Low	63.7	Low	70 Å²	70	111.2 Å²	111.2	33%	0.327	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	170.2	-178.3	-50.5	-150.7	-74.7	0	0	111.9	A656 K685 E686	A656-Q658 PolarHBondContact O-N 3.45Å; Q658-K685 WeakPolarHBondContact O-CA 3.49Å; Q658-E686 PolarHBondContact N-O 3.43Å; Q658-E686 PolarHBondContact O-N 2.97Å
659	R	62.8	Low	61.2	Low	229 Å²	229	113 Å²	113	86%	0.864	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.6	136.3	164.3	-60.2	-178	-166.5	167.8	6.1	107.8	Q661	R659-Q661 PolarHBondContact O-N 3.42Å
660	Q	54.8	Low	58.8	Low	105 Å²	105	118.6 Å²	118.6	49%	0.491	58%	0.58	S	S	.	*			trans	-46	124.3	-179.4	-169.8	167.1	-15.7	0	0	112.3	D662 E686	Q660-D662 PolarHBondContact O-N 3.3Å; Q660-E686 WeakPolarHBondContact CA-OE2 3.26Å
661	Q	55.4	Low	56.5	Low	129 Å²	129	124 Å²	124	60%	0.603	60%	0.604	S	S	*	*			trans	-90.5	82	-178.6	-72.7	-164.8	-6.3	0	0	111.9	R659 F663 E686	R659-Q661 PolarHBondContact O-N 3.42Å; Q661-F663 VanDerWaalsContact C-N 3.32Å; Q661-F663 PolarHBondContact O-N 2.94Å; Q661-E686 PolarHBondContact N-OE2 3.12Å
662	D	43.1	Very low	54	Low	129 Å²	129	131.7 Å²	131.7	69%	0.69	64%	0.637	S	S	*	*			trans	-70.5	82.6	177.6	-69.9	-40.4	0	0	0	112.4	Q660 L664	Q660-D662 PolarHBondContact O-N 3.3Å; D662-L664 PolarHBondContact O-N 2.99Å
663	F	51	Low	51.5	Low	179 Å²	179	133.9 Å²	133.9	79%	0.785	65%	0.649	S	S	*	*			trans	-82.3	36.8	-170	-140.3	-87.6	0	0	0	114.6	Q661	Q661-F663 VanDerWaalsContact C-N 3.32Å; Q661-F663 PolarHBondContact O-N 2.94Å
664	L	41.6	Very low	49.4	Very low	164 Å²	164	134.1 Å²	134.1	86%	0.859	66%	0.66	S	S	*	*			trans	-136.9	32.1	-171.5	-79.3	178.2	0	0	0	116	D662	D662-L664 PolarHBondContact O-N 2.99Å
665	M	39.4	Very low	47	Very low	185 Å²	185	137.7 Å²	137.7	91%	0.911	68%	0.678	S	S	*	*			trans	-136.3	62.4	167.2	-78.1	-158.9	169.6	0	0	114.4
666	I	38.2	Very low	44.5	Very low	161 Å²	161	144.2 Å²	144.2	83%	0.826	71%	0.711	S	S	*	*	S	Bend	trans	-133.8	72.5	158.4	-50.2	-179.4	0	0	0	110
667	N	33.7	Very low	42.6	Very low	147 Å²	147	150.8 Å²	150.8	79%	0.786	75%	0.746	S	S	*	*	S	Bend	trans	177.1	138.2	140.7	-93	-31.2	0	0	0	110.4
668	N	30.8	Very low	40.7	Very low	157 Å²	157	153.4 Å²	153.4	84%	0.84	77%	0.769	S	S	*	*			trans	52.2	103.5	175.4	-58.6	-19	0	0	0	115
669	S	31.9	Very low	39.2	Very low	121 Å²	121	158.3 Å²	158.3	85%	0.846	80%	0.796	S	S	*	*				-162.6	164.7	57.1	52.8	0	0	0	0	113.1
670	K	35.3	Very low	38.3	Very low	204 Å²	204	153.1 Å²	153.1	89%	0.887	80%	0.795	S	S	*	*			trans	-95.3	118	166.6	-72.3	-178.4	178.4	-179.9	0	109.7
671	Q	33.2	Very low	37.3	Very low	172 Å²	172	153 Å²	153	80%	0.804	81%	0.806	S	S	*	*				176.4	147.2	120.7	-100.1	-176.4	17.6	0	0	111.5
672	K	32.3	Very low	36.5	Very low	184 Å²	184	156.3 Å²	156.3	80%	0.8	82%	0.818	S	S	*	*			trans	50	118.1	164	-65.5	-177.3	176.2	-174.7	0	117.6
673	E	29	Very low	36.6	Very low	195 Å²	195	159.7 Å²	159.7	91%	0.911	83%	0.826	S	S	*	*				-150.8	153.1	106.1	-113.2	157.4	-153.3	0	0	110.1
674	A	37.6	Very low	36.8	Very low	87 Å²	87	155.2 Å²	155.2	72%	0.719	81%	0.814	S	S	*	*			trans	-151.4	117.4	171.2	0	0	0	0	0	105.8
675	E	33.9	Very low	37.9	Very low	192 Å²	192	153.6 Å²	153.6	90%	0.897	80%	0.8	S	S	*	*			trans	63.9	130	-175	-56.7	170.3	152.8	0	0	112
676	D	29.8	Very low	39.8	Very low	160 Å²	160	147 Å²	147	86%	0.856	77%	0.767	S	S	*	*			cis	-137.6	172.8	42.5	-161.8	4.9	0	0	0	113.4
677	D	37.1	Very low	41.9	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	73%	0.728	S	S	*	*			trans	-95.4	-177	179.5	-159.7	-7.8	0	0	0	111.8
678	T	37.6	Very low	44.5	Very low	115 Å²	115	133 Å²	133	71%	0.706	69%	0.694	S	S	*	*			trans	78.2	98.3	171.5	75.5	0	0	0	0	117.2
679	L	35.4	Very low	47.1	Very low	172 Å²	172	125.6 Å²	125.6	90%	0.901	66%	0.655	S	S	*	*				-167.5	127.7	114.9	-101.7	168.5	0	0	0	110.6	S681	L679-S681 PolarHBondContact O-N 3.43Å
680	S	42.2	Very low	49.7	Very low	121 Å²	121	119.9 Å²	119.9	85%	0.846	62%	0.615	S	S	*	*			trans	-83.4	79.1	-168.7	52	0	0	0	0	113.8
681	S	34.2	Very low	52.1	Low	102 Å²	102	111.8 Å²	111.8	71%	0.713	58%	0.581	S	S	*	*			trans	-66.6	137.5	164.1	74.3	0	0	0	0	110.7	L679 K683	L679-S681 PolarHBondContact O-N 3.43Å; S681-K683 PolarHBondContact O-N 3.43Å; S681-K683 VanDerWaalsContact O-N 3.12Å
682	K	39.8	Very low	54.5	Low	198 Å²	198	106.1 Å²	106.1	86%	0.861	57%	0.569	S	S	*	*			trans	-71.3	107.6	177.8	-72.5	177.7	179.4	173.6	0	108.8	V684	K682-V684 PolarHBondContact O-N 3.1Å
683	K	45.4	Very low	57.1	Low	200 Å²	200	106.7 Å²	106.7	87%	0.87	57%	0.566	S	S	*	*			trans	-54.8	104.3	177.3	-66.2	178.3	-179.6	175.8	0	110.3	S681	S681-K683 PolarHBondContact O-N 3.43Å; S681-K683 VanDerWaalsContact O-N 3.12Å
684	V	55.2	Low	59.8	Low	85 Å²	85	98.5 Å²	98.5	52%	0.515	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-70	140.5	178.8	-175.5	0	0	0	0	108.7	K682	K682-V684 PolarHBondContact O-N 3.1Å
685	K	63.7	Low	62.2	Low	131 Å²	131	94.7 Å²	94.7	57%	0.57	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.3	171.6	-61.3	-171.9	-174	-179.9	0	109.1	Y657 Q658	Y657-K685 HydrophobicContact CD1-CB 4.43Å; Q658-K685 WeakPolarHBondContact O-CA 3.49Å
686	E	80.1	Confident	64.7	Low	47 Å²	47	91.2 Å²	91.2	22%	0.22	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131	177.1	-175.9	175.4	-163.7	0	0	108.6	Y657 Q658 Q660 Q661 A757	Y657-E686 CarbonylContact C-O 3.55Å; Y657-E686 WeakPolarHBondContact CA-O 3.39Å; Q658-E686 PolarHBondContact N-O 3.43Å; Q658-E686 PolarHBondContact O-N 2.97Å; Q660-E686 WeakPolarHBondContact CA-OE2 3.26Å; Q661-E686 PolarHBondContact N-OE2 3.12Å; E686-A757 HydrophobicContact CG-CB 3.93Å; E686-A757 WeakPolarHBondContact OE1-CA 3.46Å; E686-A757 WeakPolarHBondContact OE1-CB 3.39Å
687	L	82.6	Confident	67.6	Low	1 Å²	1	86.6 Å²	86.6	1%	0.005	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.4	178.8	177.6	80.9	0	0	0	109.6	A656 Y657 V689 H749 E752 R755 M756 A757	A656-L687 HydrophobicContact CB-CD1 3.67Å; A656-L687 WeakPolarHBondContact O-CA 3.41Å; Y657-L687 HydrophobicContact CD1-CB 4.37Å; Y657-L687 HydrophobicContact CD1-CD1 4.01Å; Y657-L687 HydrophobicContact CE1-CB 4.46Å; Y657-L687 HydrophobicContact CE1-CD1 3.89Å; L687-V689 HydrophobicContact CD1-CG2 4.14Å; L687-V689 HydrophobicContact CD2-CG2 4.2Å; L687-V689 HydrophobicContact CG-CG2 3.96Å; L687-H749 HydrophobicContact CD2-CB 3.71Å; L687-H749 VanDerWaalsContact CD2-ND1 3.33Å; L687-H749 WeakPolarHBondContact CD2-ND1 3.35Å; L687-E752 HydrophobicContact CD2-CG 4.13Å; L687-R755 PolarHBondContact N-O 3.36Å; L687-M756 HydrophobicContact CD2-CG 4.06Å; L687-M756 CarbonylContact O-C 3.57Å; L687-M756 WeakPolarHBondContact O-CA 3.37Å; L687-A757 PolarHBondContact O-N 2.82Å
688	S	87.3	Confident	70.1	Confident	12 Å²	12	80.1 Å²	80.1	8%	0.084	42%	0.42	C	S	.	.			trans	-135.9	114.6	173.7	171.5	0	0	0	0	110	K616 A656	K616-S688 VanDerWaalsContact CD-O 3.26Å; K616-S688 WeakPolarHBondContact CD-O 3.36Å; K616-S688 WeakPolarHBondContact CE-O 3.3Å; K616-S688 VanDerWaalsContact NZ-CB 3.29Å; K616-S688 PolarHBondContact NZ-O 2.94Å; K616-S688 PolarHBondContact NZ-OG 3.41Å; A656-S688 PolarHBondContact O-N 2.87Å
689	V	84.9	Confident	72.6	Confident	1 Å²	1	78 Å²	78	1%	0.006	40%	0.404	C	S	.	.			trans	-111	-31.1	-173.3	-150.4	0	0	0	0	111.1	L615 S617 A656 L687 L745 D760	L615-V689 WeakPolarHBondContact O-CG1 3.47Å; S617-V689 VanDerWaalsContact CB-O 3.28Å; S617-V689 WeakPolarHBondContact CB-O 3.45Å; S617-V689 PolarHBondContact N-O 3.22Å; S617-V689 PolarHBondContact OG-O 3.44Å; A656-V689 HydrophobicContact CB-CG2 4.33Å; L687-V689 HydrophobicContact CD1-CG2 4.14Å; L687-V689 HydrophobicContact CD2-CG2 4.2Å; L687-V689 HydrophobicContact CG-CG2 3.96Å; V689-L745 HydrophobicContact CB-CD2 4.22Å; V689-L745 HydrophobicContact CB-CG 4.43Å; V689-L745 HydrophobicContact CG1-CD1 3.77Å; V689-L745 HydrophobicContact CG1-CD2 3.87Å; V689-L745 HydrophobicContact CG1-CG 3.87Å; V689-D760 PolarHBondContact N-OD1 2.73Å
690	I	87.9	Confident	75.2	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.01	38%	0.379	C	S	.	.	S	Bend	trans	-65	148.1	175	-61.8	-67.6	0	0	0	111	R694 A695 D742 L745 L746 D760 L763	I690-R694 HydrophobicContact CG2-CB 4.19Å; I690-R694 HydrophobicContact CG2-CG 4.39Å; I690-A695 HydrophobicContact CG2-CB 4.3Å; I690-D742 HydrophobicContact CD1-CB 3.98Å; I690-L745 HydrophobicContact CD1-CD2 4.44Å; I690-L746 HydrophobicContact CD1-CD1 4.24Å; I690-L746 HydrophobicContact CD1-CG 4.46Å; I690-L746 HydrophobicContact CG1-CD2 4.39Å; I690-D760 HydrophobicContact CG1-CB 4.39Å; I690-D760 WeakPolarHBondContact CG1-OD1 3.29Å; I690-D760 PolarHBondContact N-OD1 2.72Å; I690-L763 HydrophobicContact CD1-CD1 4.03Å; I690-L763 HydrophobicContact CG1-CD1 4.12Å; I690-L763 HydrophobicContact CG2-CD1 4.33Å
691	D	85.6	Confident	77.5	Confident	34 Å²	34	67.8 Å²	67.8	18%	0.182	34%	0.34	C	S	.	.			trans	-62.1	145.4	-178.9	87.6	73.6	0	0	0	112.6	N619 R693 R694 A695	N619-D691 HydrophobicContact CB-CB 4.08Å; N619-D691 PolarHBondContact ND2-OD2 2.73Å; D691-R693 VanDerWaalsContact C-N 3.26Å; D691-R693 PolarHBondContact O-N 2.69Å; D691-R693 WeakPolarHBondContact OD1-CA 3.22Å; D691-R693 WeakPolarHBondContact OD1-CB 3.48Å; D691-R693 PolarHBondContact OD1-N 2.92Å; D691-R694 PolarHBondContact O-N 3.37Å; D691-R694 PolarHBondContact OD1-N 2.92Å; D691-R694 VanDerWaalsContact OD2-CB 3.25Å; D691-R694 WeakPolarHBondContact OD2-CB 3.38Å; D691-A695 WeakPolarHBondContact O-CB 3.19Å; D691-A695 PolarHBondContact O-N 2.71Å
692	G	83.1	Confident	80.2	Confident	52 Å²	52	64.2 Å²	64.2	54%	0.536	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-28.7	-172.5	0	0	0	0	0	114.8	Q696	G692-Q696 WeakPolarHBondContact O-CB 3.37Å; G692-Q696 PolarHBondContact O-N 2.72Å
693	R	86.3	Confident	82.6	Confident	196 Å²	196	58.5 Å²	58.5	74%	0.74	30%	0.298	S	S	*	.	H	α-helix	trans	-77.6	-44.2	-179.5	-172.9	-177.1	-175.7	-170.3	1.3	110.7	D691 N697	D691-R693 VanDerWaalsContact C-N 3.26Å; D691-R693 PolarHBondContact O-N 2.69Å; D691-R693 WeakPolarHBondContact OD1-CA 3.22Å; D691-R693 WeakPolarHBondContact OD1-CB 3.48Å; D691-R693 PolarHBondContact OD1-N 2.92Å; R693-N697 VanDerWaalsContact O-CG 3.23Å; R693-N697 PolarHBondContact O-N 2.64Å; R693-N697 PolarHBondContact O-ND2 3.12Å
694	R	86.7	Confident	84.7	Confident	23 Å²	23	57 Å²	57	9%	0.087	29%	0.287	C	S	.	.	H	α-helix	trans	-67.9	-43	175.2	-168.6	168.7	179.2	-166.9	-8.4	111	I690 D691 Q696 N697 C698 V737 E739 D742	I690-R694 HydrophobicContact CG2-CB 4.19Å; I690-R694 HydrophobicContact CG2-CG 4.39Å; D691-R694 PolarHBondContact O-N 3.37Å; D691-R694 PolarHBondContact OD1-N 2.92Å; D691-R694 VanDerWaalsContact OD2-CB 3.25Å; D691-R694 WeakPolarHBondContact OD2-CB 3.38Å; R694-Q696 PolarHBondContact O-N 3.29Å; R694-N697 PolarHBondContact O-N 3.37Å; R694-C698 WeakPolarHBondContact O-CB 3.36Å; R694-C698 PolarHBondContact O-N 2.81Å; R694-C698 PolarHBondContact O-SG 2.85Å; R694-C698 VanDerWaalsContact O-SG 3.33Å; R694-V737 PolarHBondContact NH2-O 3.23Å; R694-E739 IonicContact CZ-OE1 2.92Å; R694-E739 VanDerWaalsContact CZ-OE1 3.3Å; R694-E739 IonicContact NH1-OE1 3.93Å; R694-E739 PolarHBondContact NH1-OE1 3.03Å; R694-E739 IonicContact NH2-OE1 2.73Å; R694-E739 PolarHBondContact NH2-OE1 3.46Å; R694-D742 IonicContact CZ-OD1 3.53Å; R694-D742 IonicContact CZ-OD2 3.18Å; R694-D742 VanDerWaalsContact NH1-CG 3.3Å; R694-D742 IonicContact NH1-OD1 2.6Å; R694-D742 PolarHBondContact NH1-OD1 2.84Å; R694-D742 IonicContact NH1-OD2 3.62Å; R694-D742 PolarHBondContact NH1-OD2 3.5Å; R694-D742 IonicContact NH2-OD2 2.72Å; R694-D742 PolarHBondContact NH2-OD2 3.46Å
695	A	87.6	Confident	86.3	Confident	8 Å²	8	53.8 Å²	53.8	7%	0.066	27%	0.266	C	S	.	.	H	α-helix	trans	-58.6	-44.8	173.7	0	0	0	0	0	112.4	I690 D691 C698 N699 P759	I690-A695 HydrophobicContact CG2-CB 4.3Å; D691-A695 WeakPolarHBondContact O-CB 3.19Å; D691-A695 PolarHBondContact O-N 2.71Å; A695-C698 PolarHBondContact O-N 3.03Å; A695-N699 PolarHBondContact O-N 3.31Å; A695-P759 HydrophobicContact CB-CB 4.01Å; A695-P759 HydrophobicContact CB-CG 3.97Å; A695-P759 WeakPolarHBondContact O-CG 3.47Å
696	Q	86.8	Confident	87.6	Confident	119 Å²	119	56 Å²	56	56%	0.556	28%	0.276	S	S	*	.	H	α-helix	trans	-62	-44.6	175.2	-175.1	178.1	24.8	0	0	112.1	G692 R694 N699 I700	G692-Q696 WeakPolarHBondContact O-CB 3.37Å; G692-Q696 PolarHBondContact O-N 2.72Å; R694-Q696 PolarHBondContact O-N 3.29Å; Q696-N699 WeakPolarHBondContact O-CB 3.34Å; Q696-N699 PolarHBondContact O-N 2.98Å; Q696-I700 HydrophobicContact CG-CD1 4.24Å; Q696-I700 WeakPolarHBondContact O-CG1 3.43Å; Q696-I700 PolarHBondContact O-N 3.35Å
697	N	89.3	Confident	88.2	Confident	62 Å²	62	55.3 Å²	55.3	33%	0.332	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-41.4	177.9	-70.7	-22.7	0	0	0	112.4	R693 R694 I700 L701 F736	R693-N697 VanDerWaalsContact O-CG 3.23Å; R693-N697 PolarHBondContact O-N 2.64Å; R693-N697 PolarHBondContact O-ND2 3.12Å; R694-N697 PolarHBondContact O-N 3.37Å; N697-I700 PolarHBondContact O-N 2.75Å; N697-L701 PolarHBondContact O-N 2.72Å; N697-F736 HydrophobicContact CB-CE1 3.5Å; N697-F736 HydrophobicContact CB-CZ 3.57Å
698	C	90.5	Very high	88.7	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-43.1	172.5	-71.1	0	0	0	0	111.7	R694 A695 I700 L701 L702 P759	R694-C698 WeakPolarHBondContact O-CB 3.36Å; R694-C698 PolarHBondContact O-N 2.81Å; R694-C698 PolarHBondContact O-SG 2.85Å; R694-C698 VanDerWaalsContact O-SG 3.33Å; A695-C698 PolarHBondContact O-N 3.03Å; C698-I700 VanDerWaalsContact C-N 3.33Å; C698-I700 PolarHBondContact O-N 2.96Å; C698-L701 PolarHBondContact O-N 2.88Å; C698-L702 VanDerWaalsContact O-CG 3.3Å; C698-L702 WeakPolarHBondContact O-CG 3.48Å; C698-L702 PolarHBondContact O-N 3.2Å; C698-P759 HydrophobicContact CB-CB 3.85Å; C698-P759 HydrophobicContact CB-CG 4.34Å
699	N	89.9	Confident	89	Confident	70 Å²	70	59 Å²	59	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-59.9	-40.3	174.2	-86.2	-33.8	0	0	0	112.4	A695 Q696 L702 S703 P759	A695-N699 PolarHBondContact O-N 3.31Å; Q696-N699 WeakPolarHBondContact O-CB 3.34Å; Q696-N699 PolarHBondContact O-N 2.98Å; N699-L702 PolarHBondContact O-N 3.15Å; N699-S703 WeakPolarHBondContact O-CB 3.45Å; N699-S703 PolarHBondContact O-N 2.75Å; N699-S703 PolarHBondContact O-OG 2.88Å; N699-P759 WeakPolarHBondContact ND2-CG 3.28Å; N699-P759 WeakPolarHBondContact OD1-CD 3.49Å; N699-P759 WeakPolarHBondContact OD1-CG 3.37Å
700	I	89.6	Confident	89.3	Confident	73 Å²	73	63.1 Å²	63.1	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-38.6	175.8	-68	164.1	0	0	0	111.5	Q696 N697 C698 S703 R704	Q696-I700 HydrophobicContact CG-CD1 4.24Å; Q696-I700 WeakPolarHBondContact O-CG1 3.43Å; Q696-I700 PolarHBondContact O-N 3.35Å; N697-I700 PolarHBondContact O-N 2.75Å; C698-I700 VanDerWaalsContact C-N 3.33Å; C698-I700 PolarHBondContact O-N 2.96Å; I700-S703 PolarHBondContact O-OG 3.45Å; I700-R704 WeakPolarHBondContact O-CG 3.47Å; I700-R704 PolarHBondContact O-N 3.2Å
701	L	90.8	Very high	89.6	Confident	7 Å²	7	66.3 Å²	66.3	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-53.4	173.8	174	53.5	0	0	0	111	N697 C698 S703 R704 L705 M729 Q732 L733 F736	N697-L701 PolarHBondContact O-N 2.72Å; C698-L701 PolarHBondContact O-N 2.88Å; L701-S703 VanDerWaalsContact C-N 3.29Å; L701-S703 PolarHBondContact O-N 2.95Å; L701-R704 PolarHBondContact O-N 2.67Å; L701-L705 WeakPolarHBondContact O-CB 3.49Å; L701-L705 PolarHBondContact O-N 2.75Å; L701-M729 HydrophobicContact CD1-SD 4.04Å; L701-Q732 HydrophobicContact CD1-CB 3.63Å; L701-Q732 HydrophobicContact CD1-CG 4.39Å; L701-Q732 HydrophobicContact CD2-CB 4.14Å; L701-Q732 HydrophobicContact CG-CB 4.49Å; L701-L733 HydrophobicContact CD2-CD2 3.92Å; L701-L733 HydrophobicContact CD2-CG 4.16Å; L701-F736 HydrophobicContact CD2-CB 4.45Å; L701-F736 HydrophobicContact CD2-CD2 3.73Å; L701-F736 HydrophobicContact CD2-CG 4.45Å
702	L	90.4	Very high	90	Very high	26 Å²	26	64.7 Å²	64.7	14%	0.136	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-36.5	-178.4	-66.8	169.9	0	0	0	112.3	C698 N699 R704 L705 K706 I712 F762	C698-L702 VanDerWaalsContact O-CG 3.3Å; C698-L702 WeakPolarHBondContact O-CG 3.48Å; C698-L702 PolarHBondContact O-N 3.2Å; N699-L702 PolarHBondContact O-N 3.15Å; L702-R704 VanDerWaalsContact C-N 3.25Å; L702-R704 PolarHBondContact O-N 2.88Å; L702-L705 PolarHBondContact O-N 3.49Å; L702-K706 PolarHBondContact O-N 3.34Å; L702-I712 HydrophobicContact CD2-CD1 4.15Å; L702-F762 HydrophobicContact CD1-CB 3.88Å; L702-F762 HydrophobicContact CD1-CD1 4.49Å; L702-F762 HydrophobicContact CD1-CG 4.07Å; L702-F762 HydrophobicContact CD2-CD2 3.72Å; L702-F762 HydrophobicContact CD2-CE2 4.07Å; L702-F762 HydrophobicContact CD2-CG 4.03Å
703	S	90.1	Very high	90.5	Very high	79 Å²	79	64.5 Å²	64.5	55%	0.552	31%	0.307	S	S	*	.	H	α-helix	trans	-67.4	-23.3	176.5	72.9	0	0	0	0	114	N699 I700 L701	N699-S703 WeakPolarHBondContact O-CB 3.45Å; N699-S703 PolarHBondContact O-N 2.75Å; N699-S703 PolarHBondContact O-OG 2.88Å; I700-S703 PolarHBondContact O-OG 3.45Å; L701-S703 VanDerWaalsContact C-N 3.29Å; L701-S703 PolarHBondContact O-N 2.95Å
704	R	89.6	Confident	90.9	Very high	169 Å²	169	61.6 Å²	61.6	64%	0.638	30%	0.296	S	S	*	.	H	α-helix	trans	-88.3	-42	174.3	-68.1	174.8	-176.2	-164.3	1.1	111.7	I700 L701 L702 M729	I700-R704 WeakPolarHBondContact O-CG 3.47Å; I700-R704 PolarHBondContact O-N 3.2Å; L701-R704 PolarHBondContact O-N 2.67Å; L702-R704 VanDerWaalsContact C-N 3.25Å; L702-R704 PolarHBondContact O-N 2.88Å; R704-M729 HydrophobicContact CB-SD 4.24Å
705	L	89.8	Confident	91.3	Very high	16 Å²	16	60.6 Å²	60.6	8%	0.084	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-39.9	-178.6	-164.7	73	0	0	0	112	L701 L702 L707 I712 L725 M729 L733	L701-L705 WeakPolarHBondContact O-CB 3.49Å; L701-L705 PolarHBondContact O-N 2.75Å; L702-L705 PolarHBondContact O-N 3.49Å; L705-L707 HydrophobicContact CD2-CB 4.48Å; L705-L707 HydrophobicContact CG-CB 4.34Å; L705-L707 HydrophobicContact CG-CD1 4.2Å; L705-L707 HydrophobicContact CG-CG 4.24Å; L705-L707 PolarHBondContact O-N 3.44Å; L705-I712 HydrophobicContact CD2-CD1 3.52Å; L705-I712 HydrophobicContact CD2-CG1 3.78Å; L705-L725 HydrophobicContact CD1-CD2 4Å; L705-M729 HydrophobicContact CD1-CB 3.73Å; L705-M729 HydrophobicContact CD1-CG 3.89Å; L705-M729 HydrophobicContact CD1-SD 4.09Å; L705-L733 HydrophobicContact CD1-CD1 4.38Å; L705-L733 HydrophobicContact CD2-CD1 4.45Å; L705-L733 HydrophobicContact CD2-CD2 4.24Å
706	K	91	Very high	91.7	Very high	177 Å²	177	60.3 Å²	60.3	77%	0.77	29%	0.29	S	S	*	.			trans	58.8	6.7	177.5	-59.6	-176.8	-178.7	179.7	0	116.9	L702	L702-K706 PolarHBondContact O-N 3.34Å
707	L	91.7	Very high	92	Very high	33 Å²	33	56.7 Å²	56.7	17%	0.173	27%	0.274	C	S	.	.			trans	-85.6	145.8	171.2	-58.7	177.4	0	0	0	111.1	L705 E711 I712 D724 L725	L705-L707 HydrophobicContact CD2-CB 4.48Å; L705-L707 HydrophobicContact CG-CB 4.34Å; L705-L707 HydrophobicContact CG-CD1 4.2Å; L705-L707 HydrophobicContact CG-CG 4.24Å; L705-L707 PolarHBondContact O-N 3.44Å; L707-E711 HydrophobicContact CB-CB 4.01Å; L707-E711 HydrophobicContact CD2-CB 4.21Å; L707-I712 HydrophobicContact CB-CD1 4.35Å; L707-I712 HydrophobicContact CB-CG1 3.65Å; L707-I712 HydrophobicContact CD1-CG1 4.15Å; L707-D724 HydrophobicContact CD1-CB 3.96Å; L707-D724 HydrophobicContact CD2-CB 4.27Å; L707-L725 HydrophobicContact CD1-CD2 3.66Å
708	S	93.6	Very high	92.3	Very high	56 Å²	56	54.7 Å²	54.7	39%	0.392	27%	0.265	S	S	.	.			trans	-74	160.8	165.7	67.9	0	0	0	0	111.7	E710 E711 I712	S708-E710 PolarHBondContact O-N 3.43Å; S708-E710 VanDerWaalsContact O-N 3.16Å; S708-E711 WeakPolarHBondContact CB-OE2 3.48Å; S708-E711 PolarHBondContact N-OE2 3.46Å; S708-E711 WeakPolarHBondContact O-CB 3.42Å; S708-E711 PolarHBondContact O-N 3.47Å; S708-E711 VanDerWaalsContact OG-CD 3.23Å; S708-E711 WeakPolarHBondContact OG-CG 3.4Å; S708-E711 PolarHBondContact OG-N 2.81Å; S708-E711 PolarHBondContact OG-OE2 2.79Å; S708-I712 WeakPolarHBondContact O-CG1 3.03Å; S708-I712 PolarHBondContact O-N 3.32Å
709	N	93.1	Very high	92.5	Very high	34 Å²	34	54.8 Å²	54.8	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-56.6	-34.9	-179.5	-64.9	-4.6	0	0	0	112.9	K713 R761 E765 M766	N709-K713 WeakPolarHBondContact O-CB 3.28Å; N709-K713 PolarHBondContact O-N 3.1Å; N709-R761 PolarHBondContact ND2-O 2.89Å; N709-E765 HydrophobicContact CB-CB 4.06Å; N709-E765 HydrophobicContact CB-CG 4.05Å; N709-M766 HydrophobicContact CB-CE 4.32Å
710	E	92.1	Very high	92.7	Very high	88 Å²	88	51.8 Å²	51.8	41%	0.411	25%	0.249	S	C	.	.	H	α-helix	trans	-77.1	-20.4	176.6	-69.8	-59.3	151	0	0	113.8	S708 K713 R714	S708-E710 PolarHBondContact O-N 3.43Å; S708-E710 VanDerWaalsContact O-N 3.16Å; E710-K713 IonicContact OE1-NZ 2.67Å; E710-K713 PolarHBondContact OE1-NZ 3.49Å; E710-K713 WeakPolarHBondContact OE2-CD 3.39Å; E710-K713 WeakPolarHBondContact OE2-CE 3.48Å; E710-K713 IonicContact OE2-NZ 2.81Å; E710-K713 PolarHBondContact OE2-NZ 3.05Å; E710-R714 WeakPolarHBondContact O-CB 3.36Å; E710-R714 WeakPolarHBondContact O-CG 3.49Å; E710-R714 PolarHBondContact O-N 2.93Å; E710-R714 VanDerWaalsContact O-N 3.15Å; E710-R714 PolarHBondContact O-NE 3.32Å
711	E	94.3	Very high	92.9	Very high	70 Å²	70	53.3 Å²	53.3	33%	0.327	25%	0.254	S	S	.	.	H	α-helix	trans	-76.9	-46.7	169	-74.8	155.5	153.2	0	0	110.4	L707 S708 K713 R714 A715	L707-E711 HydrophobicContact CB-CB 4.01Å; L707-E711 HydrophobicContact CD2-CB 4.21Å; S708-E711 WeakPolarHBondContact CB-OE2 3.48Å; S708-E711 PolarHBondContact N-OE2 3.46Å; S708-E711 WeakPolarHBondContact O-CB 3.42Å; S708-E711 PolarHBondContact O-N 3.47Å; S708-E711 VanDerWaalsContact OG-CD 3.23Å; S708-E711 WeakPolarHBondContact OG-CG 3.4Å; S708-E711 PolarHBondContact OG-N 2.81Å; S708-E711 PolarHBondContact OG-OE2 2.79Å; E711-K713 VanDerWaalsContact C-N 3.31Å; E711-K713 PolarHBondContact O-N 3.49Å; E711-R714 PolarHBondContact O-N 2.68Å; E711-A715 WeakPolarHBondContact O-CB 3.34Å; E711-A715 PolarHBondContact O-N 2.81Å
712	I	94.5	Very high	92.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.2	-45.2	175.6	-56.4	166.6	0	0	0	110.7	L702 L705 L707 S708 A715 I716 F762 M766	L702-I712 HydrophobicContact CD2-CD1 4.15Å; L705-I712 HydrophobicContact CD2-CD1 3.52Å; L705-I712 HydrophobicContact CD2-CG1 3.78Å; L707-I712 HydrophobicContact CB-CD1 4.35Å; L707-I712 HydrophobicContact CB-CG1 3.65Å; L707-I712 HydrophobicContact CD1-CG1 4.15Å; S708-I712 WeakPolarHBondContact O-CG1 3.03Å; S708-I712 PolarHBondContact O-N 3.32Å; I712-A715 PolarHBondContact O-N 2.88Å; I712-I716 HydrophobicContact CG2-CD1 3.89Å; I712-I716 WeakPolarHBondContact O-CG1 3.41Å; I712-I716 PolarHBondContact O-N 2.94Å; I712-F762 HydrophobicContact CD1-CD2 4.11Å; I712-F762 HydrophobicContact CD1-CE2 3.86Å; I712-M766 HydrophobicContact CB-CE 4.21Å; I712-M766 HydrophobicContact CB-SD 4.37Å; I712-M766 HydrophobicContact CG2-CE 4.14Å; I712-M766 HydrophobicContact CG2-SD 3.64Å
713	K	93.9	Very high	93.1	Very high	48 Å²	48	64.8 Å²	64.8	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-45.9	177.8	176.9	167.3	162.6	-169.3	0	112.1	N709 E710 E711 I716 L717 E765 I769	N709-K713 WeakPolarHBondContact O-CB 3.28Å; N709-K713 PolarHBondContact O-N 3.1Å; E710-K713 IonicContact OE1-NZ 2.67Å; E710-K713 PolarHBondContact OE1-NZ 3.49Å; E710-K713 WeakPolarHBondContact OE2-CD 3.39Å; E710-K713 WeakPolarHBondContact OE2-CE 3.48Å; E710-K713 IonicContact OE2-NZ 2.81Å; E710-K713 PolarHBondContact OE2-NZ 3.05Å; E711-K713 VanDerWaalsContact C-N 3.31Å; E711-K713 PolarHBondContact O-N 3.49Å; K713-I716 PolarHBondContact O-N 3.04Å; K713-L717 HydrophobicContact CG-CD1 4.32Å; K713-L717 WeakPolarHBondContact O-CB 3.42Å; K713-L717 VanDerWaalsContact O-CG 3.3Å; K713-L717 WeakPolarHBondContact O-CG 3.48Å; K713-L717 PolarHBondContact O-N 3.34Å; K713-L717 VanDerWaalsContact O-N 3.08Å; K713-E765 IonicContact NZ-OE2 2.62Å; K713-E765 PolarHBondContact NZ-OE2 3.44Å; K713-E765 VanDerWaalsContact NZ-OE2 3.11Å; K713-I769 HydrophobicContact CB-CD1 3.93Å; K713-I769 HydrophobicContact CG-CD1 3.92Å; K713-I769 HydrophobicContact CG-CG1 4.11Å
714	R	93.8	Very high	93.2	Very high	134 Å²	134	64.1 Å²	64.1	51%	0.506	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-48.8	173.3	-78.4	-177.7	-64.6	146.4	-4.6	111.8	E710 E711 I716 L717 T718	E710-R714 WeakPolarHBondContact O-CB 3.36Å; E710-R714 WeakPolarHBondContact O-CG 3.49Å; E710-R714 PolarHBondContact O-N 2.93Å; E710-R714 VanDerWaalsContact O-N 3.15Å; E710-R714 PolarHBondContact O-NE 3.32Å; E711-R714 PolarHBondContact O-N 2.68Å; R714-I716 VanDerWaalsContact C-N 3.31Å; R714-I716 PolarHBondContact O-N 3.44Å; R714-L717 PolarHBondContact O-N 3.45Å; R714-L717 VanDerWaalsContact O-N 3.14Å; R714-T718 WeakPolarHBondContact O-CG2 3.29Å; R714-T718 PolarHBondContact O-N 3.44Å; R714-T718 PolarHBondContact O-OG1 3Å; R714-T718 VanDerWaalsContact O-OG1 3.09Å
715	A	95.5	Very high	93.4	Very high	3 Å²	3	56 Å²	56	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-58.6	-39.8	179.7	0	0	0	0	0	112.6	E711 I712 T718 M719 D720 D724 L725	E711-A715 WeakPolarHBondContact O-CB 3.34Å; E711-A715 PolarHBondContact O-N 2.81Å; I712-A715 PolarHBondContact O-N 2.88Å; A715-T718 PolarHBondContact O-OG1 3.4Å; A715-M719 PolarHBondContact O-N 3.26Å; A715-D720 WeakPolarHBondContact O-CA 3.48Å; A715-D720 PolarHBondContact O-N 3.38Å; A715-D724 HydrophobicContact CB-CB 4.45Å; A715-L725 HydrophobicContact CB-CD1 3.7Å; A715-L725 HydrophobicContact CB-CG 3.96Å
716	I	95.1	Very high	93.6	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-71.2	-35.3	177.2	-68.2	170.1	0	0	0	112.1	I712 K713 R714 L725 I769 Y772 R775 L776	I712-I716 HydrophobicContact CG2-CD1 3.89Å; I712-I716 WeakPolarHBondContact O-CG1 3.41Å; I712-I716 PolarHBondContact O-N 2.94Å; K713-I716 PolarHBondContact O-N 3.04Å; R714-I716 VanDerWaalsContact C-N 3.31Å; R714-I716 PolarHBondContact O-N 3.44Å; I716-L725 HydrophobicContact CG1-CD1 3.87Å; I716-I769 HydrophobicContact CG2-CG2 4.42Å; I716-Y772 HydrophobicContact CD1-CD2 4.17Å; I716-Y772 HydrophobicContact CD1-CE2 3.41Å; I716-Y772 VanDerWaalsContact CD1-CE2 3.41Å; I716-R775 HydrophobicContact CG2-CB 4.02Å; I716-L776 HydrophobicContact CD1-CD1 4.04Å; I716-L776 HydrophobicContact CG1-CD1 4.4Å
717	L	93.8	Very high	93.7	Very high	43 Å²	43	53.8 Å²	53.8	23%	0.225	26%	0.262	C	S	.	.	H	α-helix	trans	-74.3	-33	175.6	-68.5	172.5	0	0	0	113	K713 R714 M719 I769 K925	K713-L717 HydrophobicContact CG-CD1 4.32Å; K713-L717 WeakPolarHBondContact O-CB 3.42Å; K713-L717 VanDerWaalsContact O-CG 3.3Å; K713-L717 WeakPolarHBondContact O-CG 3.48Å; K713-L717 PolarHBondContact O-N 3.34Å; K713-L717 VanDerWaalsContact O-N 3.08Å; R714-L717 PolarHBondContact O-N 3.45Å; R714-L717 VanDerWaalsContact O-N 3.14Å; L717-M719 VanDerWaalsContact C-N 3.32Å; L717-I769 HydrophobicContact CD2-CG2 4.45Å; L717-K925 PolarHBondContact O-N 2.87Å
718	T	94.6	Very high	93.7	Very high	21 Å²	21	56.2 Å²	56.2	13%	0.129	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.2	177	62.4	0	0	0	0	114	R714 A715 D720 K925	R714-T718 WeakPolarHBondContact O-CG2 3.29Å; R714-T718 PolarHBondContact O-N 3.44Å; R714-T718 PolarHBondContact O-OG1 3Å; R714-T718 VanDerWaalsContact O-OG1 3.09Å; A715-T718 PolarHBondContact O-OG1 3.4Å; T718-D720 PolarHBondContact O-N 3.47Å; T718-K925 HydrophobicContact CG2-CD 4.32Å
719	M	94.6	Very high	93.7	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.015	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	36.8	-171.1	-70.5	-67.4	-65.4	0	0	113.8	A715 L717 L779 K782 F926 V929 V930	A715-M719 PolarHBondContact O-N 3.26Å; L717-M719 VanDerWaalsContact C-N 3.32Å; M719-L779 HydrophobicContact CE-CB 3.93Å; M719-L779 HydrophobicContact CE-CD1 4.08Å; M719-L779 WeakPolarHBondContact O-CD1 3.35Å; M719-L779 HydrophobicContact SD-CB 4.14Å; M719-K782 HydrophobicContact CE-CD 4Å; M719-F926 HydrophobicContact CE-CE2 4.44Å; M719-F926 HydrophobicContact CG-CB 4.47Å; M719-F926 HydrophobicContact CG-CD2 4.04Å; M719-F926 HydrophobicContact SD-CD2 3.43Å; M719-F926 WeakPolarHBondContact SD-CD2 3.27Å; M719-F926 HydrophobicContact SD-CE2 3.76Å; M719-F926 HydrophobicContact SD-CG 4.48Å; M719-V929 HydrophobicContact CB-CB 3.96Å; M719-V929 HydrophobicContact CB-CG1 3.74Å; M719-V929 HydrophobicContact CB-CG2 4.25Å; M719-V929 HydrophobicContact CG-CB 4.18Å; M719-V929 HydrophobicContact CG-CG1 4.3Å; M719-V930 HydrophobicContact CE-CG2 3.62Å; M719-V930 HydrophobicContact CG-CG2 4.35Å; M719-V930 HydrophobicContact SD-CG2 4.17Å
720	D	95.8	Very high	93.8	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.032	25%	0.252	C	S	.	.	S	Bend	trans	59.4	54.8	176.2	-162.8	34.5	0	0	0	114.7	A715 T718 H722 E723 D724 L725 L779 K783	A715-D720 WeakPolarHBondContact O-CA 3.48Å; A715-D720 PolarHBondContact O-N 3.38Å; T718-D720 PolarHBondContact O-N 3.47Å; D720-H722 PolarHBondContact O-N 3.39Å; D720-E723 PolarHBondContact O-N 3.32Å; D720-E723 WeakPolarHBondContact OD2-CA 3.4Å; D720-D724 PolarHBondContact OD1-N 2.8Å; D720-L725 PolarHBondContact OD1-N 2.79Å; D720-L725 WeakPolarHBondContact OD2-CA 3.28Å; D720-L725 WeakPolarHBondContact OD2-CB 3.16Å; D720-L725 PolarHBondContact OD2-N 3.49Å; D720-L779 HydrophobicContact CB-CD1 3.85Å; D720-L779 HydrophobicContact CB-CD2 3.95Å; D720-K783 VanDerWaalsContact OD2-CE 3.24Å; D720-K783 WeakPolarHBondContact OD2-CE 3.47Å; D720-K783 IonicContact OD2-NZ 2.67Å; D720-K783 PolarHBondContact OD2-NZ 2.84Å
721	E	92.1	Very high	93.8	Very high	106 Å²	106	51.6 Å²	51.6	50%	0.495	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21	179.9	-176.4	172.9	-126.1	0	0	114.6	K925	E721-K925 IonicContact OE1-NZ 2.76Å; E721-K925 PolarHBondContact OE1-NZ 3.48Å; E721-K925 IonicContact OE2-NZ 3.12Å; E721-K925 PolarHBondContact OE2-NZ 3.44Å
722	H	92.4	Very high	93.8	Very high	124 Å²	124	50.9 Å²	50.9	57%	0.574	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-1.8	177.9	-59.3	-35.2	0	0	0	113.4	D720 D724	D720-H722 PolarHBondContact O-N 3.39Å; H722-D724 WeakPolarHBondContact CB-OD2 3.38Å; H722-D724 IonicContact CD2-OD2 3.49Å; H722-D724 PolarHBondContact O-N 2.8Å
723	E	93.1	Very high	93.7	Very high	149 Å²	149	50.9 Å²	50.9	70%	0.696	24%	0.243	S	C	*	.			trans	60	24.2	-173.2	-52.8	-148	103.8	0	0	115.7	D720 L725	D720-E723 PolarHBondContact O-N 3.32Å; D720-E723 WeakPolarHBondContact OD2-CA 3.4Å; E723-L725 PolarHBondContact O-N 3.13Å; E723-L725 VanDerWaalsContact O-N 3.14Å
724	D	92.4	Very high	93.7	Very high	65 Å²	65	50.4 Å²	50.4	35%	0.348	24%	0.243	S	C	.	.			trans	-61.8	-18.6	178.5	-67.1	-42	0	0	0	113.3	L707 A715 D720 H722 P726	L707-D724 HydrophobicContact CD1-CB 3.96Å; L707-D724 HydrophobicContact CD2-CB 4.27Å; A715-D724 HydrophobicContact CB-CB 4.45Å; D720-D724 PolarHBondContact OD1-N 2.8Å; H722-D724 WeakPolarHBondContact CB-OD2 3.38Å; H722-D724 IonicContact CD2-OD2 3.49Å; H722-D724 PolarHBondContact O-N 2.8Å; D724-P726 VanDerWaalsContact O-CD 3.22Å; D724-P726 WeakPolarHBondContact O-CD 3.28Å
725	L	94.6	Very high	93.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-113	93	-177.9	-59.5	177.2	0	0	0	112.8	L705 L707 A715 I716 D720 E723 L730 L733 L779 K783	L705-L725 HydrophobicContact CD1-CD2 4Å; L707-L725 HydrophobicContact CD1-CD2 3.66Å; A715-L725 HydrophobicContact CB-CD1 3.7Å; A715-L725 HydrophobicContact CB-CG 3.96Å; I716-L725 HydrophobicContact CG1-CD1 3.87Å; D720-L725 PolarHBondContact OD1-N 2.79Å; D720-L725 WeakPolarHBondContact OD2-CA 3.28Å; D720-L725 WeakPolarHBondContact OD2-CB 3.16Å; D720-L725 PolarHBondContact OD2-N 3.49Å; E723-L725 PolarHBondContact O-N 3.13Å; E723-L725 VanDerWaalsContact O-N 3.14Å; L725-L730 HydrophobicContact CB-CD1 4.42Å; L725-L730 HydrophobicContact CB-CD2 3.78Å; L725-L730 HydrophobicContact CB-CG 3.96Å; L725-L730 HydrophobicContact CD1-CD2 3.94Å; L725-L730 HydrophobicContact CG-CD2 4.44Å; L725-L733 HydrophobicContact CD2-CD1 4.04Å; L725-L779 HydrophobicContact CD1-CD2 4.02Å; L725-K783 PolarHBondContact O-NZ 3.26Å
726	P	94.1	Very high	93.5	Very high	59 Å²	59	50.8 Å²	50.8	38%	0.383	25%	0.247	S	C	.	.			trans	-56.4	155.1	170.1	-29.7	36.5	0	0	0	114.7	D724 D728 M729 L730	D724-P726 VanDerWaalsContact O-CD 3.22Å; D724-P726 WeakPolarHBondContact O-CD 3.28Å; P726-D728 VanDerWaalsContact C-N 3.32Å; P726-D728 VanDerWaalsContact CB-OD1 3.23Å; P726-D728 WeakPolarHBondContact CB-OD1 3.26Å; P726-D728 PolarHBondContact O-N 3.34Å; P726-M729 HydrophobicContact CB-CB 4.21Å; P726-M729 HydrophobicContact CB-CG 4.12Å; P726-M729 HydrophobicContact CG-CG 4.22Å; P726-M729 PolarHBondContact O-N 3.48Å; P726-M729 VanDerWaalsContact O-N 3.17Å; P726-L730 WeakPolarHBondContact O-CG 3.48Å; P726-L730 PolarHBondContact O-N 2.88Å
727	K	93	Very high	93.4	Very high	86 Å²	86	51.6 Å²	51.6	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-59.2	-38.9	-176.2	-66.2	176.3	-176.6	-179.6	0	113.4	E731 Y780 K783 K784 E787	K727-E731 PolarHBondContact O-N 2.9Å; K727-E731 VanDerWaalsContact O-N 3.15Å; K727-Y780 WeakPolarHBondContact O-CE2 3.4Å; K727-K783 WeakPolarHBondContact CE-O 3.47Å; K727-K783 HydrophobicContact CG-CB 4.1Å; K727-K783 HydrophobicContact CG-CD 4.48Å; K727-K784 HydrophobicContact CD-CG 4.44Å; K727-E787 WeakPolarHBondContact CD-OE2 3.08Å; K727-E787 WeakPolarHBondContact CE-OE2 3.23Å; K727-E787 IonicContact NZ-OE2 3.5Å; K727-E787 PolarHBondContact NZ-OE2 2.84Å
728	D	92.1	Very high	93.3	Very high	84 Å²	84	50.4 Å²	50.4	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-76.7	-33	178.5	65.8	-53.8	0	0	0	112.4	P726 E731 Q732	P726-D728 VanDerWaalsContact C-N 3.32Å; P726-D728 VanDerWaalsContact CB-OD1 3.23Å; P726-D728 WeakPolarHBondContact CB-OD1 3.26Å; P726-D728 PolarHBondContact O-N 3.34Å; D728-E731 WeakPolarHBondContact O-CB 3.48Å; D728-E731 PolarHBondContact O-N 3.38Å; D728-Q732 WeakPolarHBondContact O-CG 3.37Å; D728-Q732 PolarHBondContact O-N 3.27Å; D728-Q732 PolarHBondContact O-NE2 3.38Å
729	M	93.3	Very high	93.1	Very high	19 Å²	19	54.4 Å²	54.4	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-68.7	-43	172.3	-71.1	-59.7	103.4	0	0	111.7	L701 R704 L705 P726 E731 Q732 L733	L701-M729 HydrophobicContact CD1-SD 4.04Å; R704-M729 HydrophobicContact CB-SD 4.24Å; L705-M729 HydrophobicContact CD1-CB 3.73Å; L705-M729 HydrophobicContact CD1-CG 3.89Å; L705-M729 HydrophobicContact CD1-SD 4.09Å; P726-M729 HydrophobicContact CB-CB 4.21Å; P726-M729 HydrophobicContact CB-CG 4.12Å; P726-M729 HydrophobicContact CG-CG 4.22Å; P726-M729 PolarHBondContact O-N 3.48Å; P726-M729 VanDerWaalsContact O-N 3.17Å; M729-E731 VanDerWaalsContact C-N 3.28Å; M729-E731 PolarHBondContact O-N 3.24Å; M729-Q732 HydrophobicContact CE-CG 4.46Å; M729-Q732 PolarHBondContact O-N 3.44Å; M729-Q732 VanDerWaalsContact O-N 3.13Å; M729-L733 WeakPolarHBondContact O-CG 3.22Å; M729-L733 PolarHBondContact O-N 3.45Å
730	L	94.4	Very high	92.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.3	-42.4	169.8	-71	169.6	0	0	0	111.4	L725 P726 Q732 L733 L734 L776 L779 Y780 K783	L725-L730 HydrophobicContact CB-CD1 4.42Å; L725-L730 HydrophobicContact CB-CD2 3.78Å; L725-L730 HydrophobicContact CB-CG 3.96Å; L725-L730 HydrophobicContact CD1-CD2 3.94Å; L725-L730 HydrophobicContact CG-CD2 4.44Å; P726-L730 WeakPolarHBondContact O-CG 3.48Å; P726-L730 PolarHBondContact O-N 2.88Å; L730-Q732 VanDerWaalsContact C-N 3.31Å; L730-Q732 PolarHBondContact O-N 2.99Å; L730-L733 PolarHBondContact O-N 3.21Å; L730-L734 WeakPolarHBondContact O-CG 3.26Å; L730-L734 PolarHBondContact O-N 3.24Å; L730-L776 HydrophobicContact CD2-CD1 3.54Å; L730-L779 HydrophobicContact CD1-CD2 4.49Å; L730-L779 HydrophobicContact CD1-CG 4.09Å; L730-L779 HydrophobicContact CD2-CD2 3.73Å; L730-L779 HydrophobicContact CD2-CG 4.06Å; L730-Y780 HydrophobicContact CB-CD2 3.83Å; L730-Y780 HydrophobicContact CB-CG 4.47Å; L730-K783 HydrophobicContact CD1-CD 3.95Å; L730-K783 HydrophobicContact CD1-CG 4.37Å
731	E	93.2	Very high	92.3	Very high	63 Å²	63	64.6 Å²	64.6	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-30.8	176.1	-160.5	-168.5	111.2	0	0	113.2	K727 D728 M729 K735 Y780 K784	K727-E731 PolarHBondContact O-N 2.9Å; K727-E731 VanDerWaalsContact O-N 3.15Å; D728-E731 WeakPolarHBondContact O-CB 3.48Å; D728-E731 PolarHBondContact O-N 3.38Å; M729-E731 VanDerWaalsContact C-N 3.28Å; M729-E731 PolarHBondContact O-N 3.24Å; E731-K735 WeakPolarHBondContact O-CE 3.36Å; E731-K735 IonicContact OE1-NZ 2.6Å; E731-K735 PolarHBondContact OE1-NZ 3.31Å; E731-Y780 HydrophobicContact CB-CE2 3.78Å; E731-Y780 HydrophobicContact CG-CE2 4.14Å; E731-Y780 WeakPolarHBondContact CG-OH 3.38Å; E731-Y780 PolarHBondContact OE2-OH 3.23Å; E731-Y780 VanDerWaalsContact OE2-OH 3.12Å; E731-K784 IonicContact OE2-NZ 2.6Å; E731-K784 PolarHBondContact OE2-NZ 3.43Å
732	Q	92.9	Very high	92.1	Very high	54 Å²	54	60 Å²	60	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-76.9	-42.9	172.1	-60.9	-22.2	-72.3	0	0	111.8	L701 D728 M729 L730 L734 K735 F736	L701-Q732 HydrophobicContact CD1-CB 3.63Å; L701-Q732 HydrophobicContact CD1-CG 4.39Å; L701-Q732 HydrophobicContact CD2-CB 4.14Å; L701-Q732 HydrophobicContact CG-CB 4.49Å; D728-Q732 WeakPolarHBondContact O-CG 3.37Å; D728-Q732 PolarHBondContact O-N 3.27Å; D728-Q732 PolarHBondContact O-NE2 3.38Å; M729-Q732 HydrophobicContact CE-CG 4.46Å; M729-Q732 PolarHBondContact O-N 3.44Å; M729-Q732 VanDerWaalsContact O-N 3.13Å; L730-Q732 VanDerWaalsContact C-N 3.31Å; L730-Q732 PolarHBondContact O-N 2.99Å; Q732-L734 PolarHBondContact O-N 3.37Å; Q732-K735 WeakPolarHBondContact O-CA 3.4Å; Q732-K735 WeakPolarHBondContact O-CB 3.43Å; Q732-K735 PolarHBondContact O-N 3.09Å; Q732-F736 VanDerWaalsContact O-CD2 3.26Å; Q732-F736 WeakPolarHBondContact O-CD2 3.2Å
733	L	93.4	Very high	91.9	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.7	-38.4	176.3	-74.9	162.6	0	0	0	111.3	L701 L705 L725 M729 L730 K735 F736 V737 F762 L776	L701-L733 HydrophobicContact CD2-CD2 3.92Å; L701-L733 HydrophobicContact CD2-CG 4.16Å; L705-L733 HydrophobicContact CD1-CD1 4.38Å; L705-L733 HydrophobicContact CD2-CD1 4.45Å; L705-L733 HydrophobicContact CD2-CD2 4.24Å; L725-L733 HydrophobicContact CD2-CD1 4.04Å; M729-L733 WeakPolarHBondContact O-CG 3.22Å; M729-L733 PolarHBondContact O-N 3.45Å; L730-L733 PolarHBondContact O-N 3.21Å; L733-K735 PolarHBondContact O-N 2.96Å; L733-K735 VanDerWaalsContact O-N 3.13Å; L733-F736 CarbonylContact O-C 3.59Å; L733-F736 PolarHBondContact O-N 2.87Å; L733-V737 PolarHBondContact O-N 2.99Å; L733-F762 HydrophobicContact CD2-CE2 4.21Å; L733-F762 HydrophobicContact CD2-CZ 3.75Å; L733-L776 HydrophobicContact CB-CD1 4.18Å; L733-L776 HydrophobicContact CB-CD2 3.73Å; L733-L776 HydrophobicContact CD1-CD1 4.36Å
734	L	93.9	Very high	91.7	Very high	39 Å²	39	53.2 Å²	53.2	20%	0.204	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.2	174.8	-76.8	169	0	0	0	114.7	L730 Q732 L776 Q777 Y780	L730-L734 WeakPolarHBondContact O-CG 3.26Å; L730-L734 PolarHBondContact O-N 3.24Å; Q732-L734 PolarHBondContact O-N 3.37Å; L734-L776 HydrophobicContact CD2-CB 4.22Å; L734-L776 HydrophobicContact CD2-CD2 3.75Å; L734-L776 HydrophobicContact CD2-CG 3.8Å; L734-L776 HydrophobicContact CG-CD2 3.87Å; L734-L776 HydrophobicContact CG-CG 3.97Å; L734-Q777 HydrophobicContact CD2-CB 4.37Å; L734-Q777 HydrophobicContact CD2-CG 3.46Å; L734-Q777 VanDerWaalsContact CD2-CG 3.46Å; L734-Y780 HydrophobicContact CD1-CD1 3.46Å; L734-Y780 VanDerWaalsContact CD1-CD1 3.46Å; L734-Y780 HydrophobicContact CD1-CD2 4.31Å; L734-Y780 HydrophobicContact CD1-CE1 4.02Å; L734-Y780 HydrophobicContact CD1-CG 3.62Å
735	K	92.6	Very high	91.5	Very high	111 Å²	111	52 Å²	52	48%	0.483	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-10.6	175.7	-58.6	164.8	-166.7	165.2	0	112.7	E731 Q732 L733	E731-K735 WeakPolarHBondContact O-CE 3.36Å; E731-K735 IonicContact OE1-NZ 2.6Å; E731-K735 PolarHBondContact OE1-NZ 3.31Å; Q732-K735 WeakPolarHBondContact O-CA 3.4Å; Q732-K735 WeakPolarHBondContact O-CB 3.43Å; Q732-K735 PolarHBondContact O-N 3.09Å; L733-K735 PolarHBondContact O-N 2.96Å; L733-K735 VanDerWaalsContact O-N 3.13Å
736	F	91.4	Very high	91.3	Very high	33 Å²	33	52 Å²	52	15%	0.145	26%	0.263	C	S	.	.	S	Bend	trans	-127.1	34.5	-178.6	-58.5	-73	0	0	0	112.1	N697 L701 Q732 L733 L763	N697-F736 HydrophobicContact CB-CE1 3.5Å; N697-F736 HydrophobicContact CB-CZ 3.57Å; L701-F736 HydrophobicContact CD2-CB 4.45Å; L701-F736 HydrophobicContact CD2-CD2 3.73Å; L701-F736 HydrophobicContact CD2-CG 4.45Å; Q732-F736 VanDerWaalsContact O-CD2 3.26Å; Q732-F736 WeakPolarHBondContact O-CD2 3.2Å; L733-F736 CarbonylContact O-C 3.59Å; L733-F736 PolarHBondContact O-N 2.87Å; F736-L763 VanDerWaalsContact O-CD2 3.23Å; F736-L763 WeakPolarHBondContact O-CD2 3.35Å
737	V	93.3	Very high	91.1	Very high	18 Å²	18	51.9 Å²	51.9	11%	0.109	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-59.2	140.5	165.5	171.4	0	0	0	0	109.4	R694 L733 E739 Y772 Q773 L776	R694-V737 PolarHBondContact NH2-O 3.23Å; L733-V737 PolarHBondContact O-N 2.99Å; V737-E739 PolarHBondContact O-N 3.31Å; V737-Y772 HydrophobicContact CG1-CD1 4.29Å; V737-Y772 HydrophobicContact CG2-CD1 4.36Å; V737-Y772 HydrophobicContact CG2-CE1 4.1Å; V737-Q773 HydrophobicContact CG1-CB 3.9Å; V737-Q773 HydrophobicContact CG1-CG 4.12Å; V737-Q773 HydrophobicContact CG2-CB 4.39Å; V737-Q773 HydrophobicContact CG2-CG 4.16Å; V737-L776 HydrophobicContact CG2-CD2 4.47Å
738	P	92.3	Very high	90.8	Very high	18 Å²	18	54.5 Å²	54.5	12%	0.117	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-65	120.1	168.9	-19.1	32.1	0	0	0	110.6	V743 L763 M766	P738-V743 HydrophobicContact CB-CG2 3.93Å; P738-L763 HydrophobicContact CB-CD2 4.45Å; P738-L763 HydrophobicContact CG-CB 4.36Å; P738-L763 HydrophobicContact CG-CD2 3.99Å; P738-L763 WeakPolarHBondContact CG-O 3.49Å; P738-M766 HydrophobicContact CG-CB 3.87Å
739	E	90.1	Very high	90.5	Very high	106 Å²	106	50.9 Å²	50.9	50%	0.495	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-82.3	158.3	172.1	-64.9	174.3	-116.9	0	0	109.5	R694 V737 S741 D742 V743	R694-E739 IonicContact CZ-OE1 2.92Å; R694-E739 VanDerWaalsContact CZ-OE1 3.3Å; R694-E739 IonicContact NH1-OE1 3.93Å; R694-E739 PolarHBondContact NH1-OE1 3.03Å; R694-E739 IonicContact NH2-OE1 2.73Å; R694-E739 PolarHBondContact NH2-OE1 3.46Å; V737-E739 PolarHBondContact O-N 3.31Å; E739-S741 PolarHBondContact O-N 3.09Å; E739-S741 VanDerWaalsContact O-N 3.13Å; E739-D742 WeakPolarHBondContact CA-OD2 3.19Å; E739-D742 WeakPolarHBondContact CB-OD2 3.49Å; E739-D742 PolarHBondContact N-OD2 2.95Å; E739-D742 WeakPolarHBondContact O-CB 3.28Å; E739-D742 PolarHBondContact O-N 3.26Å; E739-V743 PolarHBondContact O-N 2.82Å; E739-V743 VanDerWaalsContact O-N 3.09Å
740	K	87.7	Confident	90.2	Very high	158 Å²	158	55 Å²	55	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-54.8	-38	-177.1	-179.6	170.4	178.6	176.5	0	113	D742 V743 D744	K740-D742 VanDerWaalsContact C-N 3.28Å; K740-D742 PolarHBondContact O-N 3.26Å; K740-V743 PolarHBondContact O-N 2.75Å; K740-D744 VanDerWaalsContact CE-OD2 3.29Å; K740-D744 WeakPolarHBondContact CE-OD2 3.29Å; K740-D744 WeakPolarHBondContact O-CB 3.35Å; K740-D744 VanDerWaalsContact O-CG 3.23Å; K740-D744 PolarHBondContact O-N 2.92Å
741	S	86.4	Confident	89.8	Confident	65 Å²	65	62 Å²	62	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-59.7	-35.1	175	45.9	0	0	0	0	113.6	E739 L745	E739-S741 PolarHBondContact O-N 3.09Å; E739-S741 VanDerWaalsContact O-N 3.13Å; S741-L745 WeakPolarHBondContact O-CB 3.44Å; S741-L745 PolarHBondContact O-N 2.88Å
742	D	87.8	Confident	89.4	Confident	10 Å²	10	59.9 Å²	59.9	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-76.6	-38.5	178.5	-39.6	-46	0	0	0	110.5	I690 R694 E739 K740 L745 L746	I690-D742 HydrophobicContact CD1-CB 3.98Å; R694-D742 IonicContact CZ-OD1 3.53Å; R694-D742 IonicContact CZ-OD2 3.18Å; R694-D742 VanDerWaalsContact NH1-CG 3.3Å; R694-D742 IonicContact NH1-OD1 2.6Å; R694-D742 PolarHBondContact NH1-OD1 2.84Å; R694-D742 IonicContact NH1-OD2 3.62Å; R694-D742 PolarHBondContact NH1-OD2 3.5Å; R694-D742 IonicContact NH2-OD2 2.72Å; R694-D742 PolarHBondContact NH2-OD2 3.46Å; E739-D742 WeakPolarHBondContact CA-OD2 3.19Å; E739-D742 WeakPolarHBondContact CB-OD2 3.49Å; E739-D742 PolarHBondContact N-OD2 2.95Å; E739-D742 WeakPolarHBondContact O-CB 3.28Å; E739-D742 PolarHBondContact O-N 3.26Å; K740-D742 VanDerWaalsContact C-N 3.28Å; K740-D742 PolarHBondContact O-N 3.26Å; D742-L745 PolarHBondContact O-N 3.23Å; D742-L746 HydrophobicContact CB-CD1 4.49Å; D742-L746 VanDerWaalsContact O-CB 3.26Å; D742-L746 WeakPolarHBondContact O-CB 3.11Å; D742-L746 WeakPolarHBondContact O-CD1 3.41Å; D742-L746 WeakPolarHBondContact O-CG 3.36Å; D742-L746 PolarHBondContact O-N 2.67Å
743	V	89.1	Confident	89.1	Confident	38 Å²	38	59 Å²	59	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-49.4	177.4	-176.3	0	0	0	0	110.4	P738 E739 K740 L745 L746 E747	P738-V743 HydrophobicContact CB-CG2 3.93Å; E739-V743 PolarHBondContact O-N 2.82Å; E739-V743 VanDerWaalsContact O-N 3.09Å; K740-V743 PolarHBondContact O-N 2.75Å; V743-L745 VanDerWaalsContact C-N 3.3Å; V743-L745 PolarHBondContact O-N 2.75Å; V743-L746 PolarHBondContact O-N 2.86Å; V743-E747 VanDerWaalsContact O-CB 3.31Å; V743-E747 WeakPolarHBondContact O-CB 3.48Å; V743-E747 PolarHBondContact O-N 3.5Å
744	D	88.8	Confident	88.6	Confident	91 Å²	91	66.7 Å²	66.7	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-42.8	177.2	-67.4	-18.4	0	0	0	110.6	K740	K740-D744 VanDerWaalsContact CE-OD2 3.29Å; K740-D744 WeakPolarHBondContact CE-OD2 3.29Å; K740-D744 WeakPolarHBondContact O-CB 3.35Å; K740-D744 VanDerWaalsContact O-CG 3.23Å; K740-D744 PolarHBondContact O-N 2.92Å
745	L	87.9	Confident	88.1	Confident	39 Å²	39	71.3 Å²	71.3	20%	0.204	34%	0.344	C	S	.	.	H	α-helix	trans	-69	-45.7	179.4	179.7	72	0	0	0	113.9	V689 I690 S741 D742 V743 E747	V689-L745 HydrophobicContact CB-CD2 4.22Å; V689-L745 HydrophobicContact CB-CG 4.43Å; V689-L745 HydrophobicContact CG1-CD1 3.77Å; V689-L745 HydrophobicContact CG1-CD2 3.87Å; V689-L745 HydrophobicContact CG1-CG 3.87Å; I690-L745 HydrophobicContact CD1-CD2 4.44Å; S741-L745 WeakPolarHBondContact O-CB 3.44Å; S741-L745 PolarHBondContact O-N 2.88Å; D742-L745 PolarHBondContact O-N 3.23Å; V743-L745 VanDerWaalsContact C-N 3.3Å; V743-L745 PolarHBondContact O-N 2.75Å; L745-E747 VanDerWaalsContact C-N 3.31Å; L745-E747 PolarHBondContact O-N 3.18Å
746	L	89.5	Confident	87.9	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-75.3	-21.6	-177.5	-67.2	167.5	0	0	0	112.2	I690 D742 V743 E748 H749 M756 D760 L763 Y764	I690-L746 HydrophobicContact CD1-CD1 4.24Å; I690-L746 HydrophobicContact CD1-CG 4.46Å; I690-L746 HydrophobicContact CG1-CD2 4.39Å; D742-L746 HydrophobicContact CB-CD1 4.49Å; D742-L746 VanDerWaalsContact O-CB 3.26Å; D742-L746 WeakPolarHBondContact O-CB 3.11Å; D742-L746 WeakPolarHBondContact O-CD1 3.41Å; D742-L746 WeakPolarHBondContact O-CG 3.36Å; D742-L746 PolarHBondContact O-N 2.67Å; V743-L746 PolarHBondContact O-N 2.86Å; L746-E748 VanDerWaalsContact C-N 3.29Å; L746-E748 PolarHBondContact O-N 3.46Å; L746-H749 PolarHBondContact O-N 3.19Å; L746-H749 VanDerWaalsContact O-N 3.17Å; L746-M756 HydrophobicContact CD2-CE 4.38Å; L746-D760 HydrophobicContact CD2-CB 3.93Å; L746-L763 HydrophobicContact CD1-CB 3.91Å; L746-Y764 HydrophobicContact CB-CD2 4.03Å
747	E	89.4	Confident	87.8	Confident	57 Å²	57	65.5 Å²	65.5	27%	0.266	32%	0.32	S	S	.	.	H	α-helix	trans	-65	-30.4	176.3	-167.2	66.7	-162.9	0	0	112.9	V743 L745 H749 K750 R768	V743-E747 VanDerWaalsContact O-CB 3.31Å; V743-E747 WeakPolarHBondContact O-CB 3.48Å; V743-E747 PolarHBondContact O-N 3.5Å; L745-E747 VanDerWaalsContact C-N 3.31Å; L745-E747 PolarHBondContact O-N 3.18Å; E747-H749 PolarHBondContact O-N 2.9Å; E747-K750 HydrophobicContact CG-CD 4.21Å; E747-K750 VanDerWaalsContact O-CD 3.29Å; E747-K750 WeakPolarHBondContact O-CD 3.43Å; E747-K750 VanDerWaalsContact O-CG 3.29Å; E747-K750 WeakPolarHBondContact O-CG 3.49Å; E747-K750 PolarHBondContact O-N 2.82Å; E747-K750 WeakPolarHBondContact OE1-CD 3.37Å; E747-K750 WeakPolarHBondContact OE1-CE 3.35Å; E747-K750 IonicContact OE1-NZ 2.75Å; E747-K750 PolarHBondContact OE1-NZ 3.4Å; E747-R768 IonicContact OE1-NH1 2.64Å; E747-R768 IonicContact OE2-CZ 2.92Å; E747-R768 IonicContact OE2-NH1 2.69Å; E747-R768 PolarHBondContact OE2-NH1 3.32Å; E747-R768 IonicContact OE2-NH2 3.23Å; E747-R768 PolarHBondContact OE2-NH2 2.83Å
748	E	86.4	Confident	87.6	Confident	140 Å²	140	71.8 Å²	71.8	65%	0.654	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.8	174.7	-60.1	-174.5	-178.9	0	0	111.3	L746 H751	L746-E748 VanDerWaalsContact C-N 3.29Å; L746-E748 PolarHBondContact O-N 3.46Å; E748-H751 PolarHBondContact O-CE1 2.62Å; E748-H751 PolarHBondContact O-ND1 2.93Å
749	H	87.4	Confident	87.5	Confident	9 Å²	9	71.1 Å²	71.1	4%	0.042	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	7.3	-175.1	-70.6	-79.2	0	0	0	115.3	P614 L687 L746 E747 H751 E752 M756	P614-H749 WeakPolarHBondContact CB-CE1 3.3Å; L687-H749 HydrophobicContact CD2-CB 3.71Å; L687-H749 VanDerWaalsContact CD2-ND1 3.33Å; L687-H749 WeakPolarHBondContact CD2-ND1 3.35Å; L746-H749 PolarHBondContact O-N 3.19Å; L746-H749 VanDerWaalsContact O-N 3.17Å; E747-H749 PolarHBondContact O-N 2.9Å; H749-H751 PolarHBondContact O-N 2.84Å; H749-E752 HydrophobicContact CB-CG 4.47Å; H749-E752 IonicContact CE1-OE1 2.95Å; H749-E752 IonicContact CG-OE1 3.73Å; H749-E752 IonicContact ND1-OE1 3.92Å; H749-E752 PolarHBondContact ND1-OE1 3.06Å; H749-E752 WeakPolarHBondContact O-CG 3.25Å; H749-E752 PolarHBondContact O-N 3.06Å; H749-M756 HydrophobicContact CB-CE 3.54Å
750	K	86.5	Confident	87.6	Confident	106 Å²	106	66.1 Å²	66.1	46%	0.461	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-6.5	-175.7	71.9	-168.7	174	-160.2	0	116.7	E747 L753 Y764	E747-K750 HydrophobicContact CG-CD 4.21Å; E747-K750 VanDerWaalsContact O-CD 3.29Å; E747-K750 WeakPolarHBondContact O-CD 3.43Å; E747-K750 VanDerWaalsContact O-CG 3.29Å; E747-K750 WeakPolarHBondContact O-CG 3.49Å; E747-K750 PolarHBondContact O-N 2.82Å; E747-K750 WeakPolarHBondContact OE1-CD 3.37Å; E747-K750 WeakPolarHBondContact OE1-CE 3.35Å; E747-K750 IonicContact OE1-NZ 2.75Å; E747-K750 PolarHBondContact OE1-NZ 3.4Å; K750-L753 WeakPolarHBondContact O-CG 3.22Å; K750-Y764 HydrophobicContact CB-CE2 4.02Å
751	H	86.1	Confident	87.8	Confident	147 Å²	147	61.3 Å²	61.3	68%	0.681	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-6.7	179.4	64.8	-85.2	0	0	0	113.3	E748 H749	E748-H751 PolarHBondContact O-CE1 2.62Å; E748-H751 PolarHBondContact O-ND1 2.93Å; H749-H751 PolarHBondContact O-N 2.84Å
752	E	85.3	Confident	88.2	Confident	17 Å²	17	58.2 Å²	58.2	8%	0.079	27%	0.274	C	S	.	.			trans	-132.4	33.2	-178.1	59.8	174.4	163.7	0	0	113.3	Y657 L687 H749 D754 R755	Y657-E752 WeakPolarHBondContact CE1-OE2 3.44Å; Y657-E752 PolarHBondContact OH-OE1 3.28Å; Y657-E752 PolarHBondContact OH-OE2 2.95Å; L687-E752 HydrophobicContact CD2-CG 4.13Å; H749-E752 HydrophobicContact CB-CG 4.47Å; H749-E752 IonicContact CE1-OE1 2.95Å; H749-E752 IonicContact CG-OE1 3.73Å; H749-E752 IonicContact ND1-OE1 3.92Å; H749-E752 PolarHBondContact ND1-OE1 3.06Å; H749-E752 WeakPolarHBondContact O-CG 3.25Å; H749-E752 PolarHBondContact O-N 3.06Å; E752-D754 PolarHBondContact O-N 3.23Å; E752-D754 VanDerWaalsContact O-N 3.08Å; E752-R755 PolarHBondContact O-N 2.6Å
753	L	85.3	Confident	88.5	Confident	35 Å²	35	57.8 Å²	57.8	18%	0.183	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-48.9	-38.5	-176.8	-61.1	-180	0	0	0	113.9	K750 R755 M756 R761 Y764	K750-L753 WeakPolarHBondContact O-CG 3.22Å; L753-R755 PolarHBondContact O-N 3.12Å; L753-R755 VanDerWaalsContact O-N 3.09Å; L753-M756 HydrophobicContact CD2-CE 3.68Å; L753-M756 HydrophobicContact CD2-SD 3.63Å; L753-M756 WeakPolarHBondContact O-CB 3.44Å; L753-M756 PolarHBondContact O-N 3.49Å; L753-M756 VanDerWaalsContact O-N 3.09Å; L753-R761 WeakPolarHBondContact O-CD 3.35Å; L753-R761 PolarHBondContact O-NE 3.25Å; L753-Y764 HydrophobicContact CD1-CE1 3.86Å; L753-Y764 HydrophobicContact CD2-CD1 3.72Å; L753-Y764 HydrophobicContact CD2-CD2 4.45Å; L753-Y764 HydrophobicContact CD2-CE1 3.56Å; L753-Y764 HydrophobicContact CD2-CE2 4.32Å; L753-Y764 HydrophobicContact CD2-CG 4.16Å; L753-Y764 HydrophobicContact CG-CE1 4.39Å
754	D	83.3	Confident	88.7	Confident	162 Å²	162	57 Å²	57	87%	0.866	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-67	-8.2	-179.4	-55.9	-43.3	0	0	0	114.2	E752	E752-D754 PolarHBondContact O-N 3.23Å; E752-D754 VanDerWaalsContact O-N 3.08Å
755	R	84.3	Confident	88.9	Confident	137 Å²	137	53.5 Å²	53.5	52%	0.517	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-106.9	-7	175.4	-60.9	-178	-176.8	159.6	3.1	113.5	L687 E752 L753	L687-R755 PolarHBondContact N-O 3.36Å; E752-R755 PolarHBondContact O-N 2.6Å; L753-R755 PolarHBondContact O-N 3.12Å; L753-R755 VanDerWaalsContact O-N 3.09Å
756	M	88.1	Confident	89.3	Confident	15 Å²	15	51.6 Å²	51.6	7%	0.074	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-64.9	135.7	178.3	-73.9	179.5	169.2	0	0	111.4	L687 L746 H749 L753 D760 R761	L687-M756 HydrophobicContact CD2-CG 4.06Å; L687-M756 CarbonylContact O-C 3.57Å; L687-M756 WeakPolarHBondContact O-CA 3.37Å; L746-M756 HydrophobicContact CD2-CE 4.38Å; H749-M756 HydrophobicContact CB-CE 3.54Å; L753-M756 HydrophobicContact CD2-CE 3.68Å; L753-M756 HydrophobicContact CD2-SD 3.63Å; L753-M756 WeakPolarHBondContact O-CB 3.44Å; L753-M756 PolarHBondContact O-N 3.49Å; L753-M756 VanDerWaalsContact O-N 3.09Å; M756-D760 HydrophobicContact CB-CB 4.4Å; M756-R761 HydrophobicContact CB-CB 3.92Å
757	A	88.8	Confident	89.5	Confident	7 Å²	7	53 Å²	53	6%	0.058	25%	0.245	C	C	.	.			trans	-58.8	152.4	168.1	0	0	0	0	0	110.9	E686 L687 D760 R761	E686-A757 HydrophobicContact CG-CB 3.93Å; E686-A757 WeakPolarHBondContact OE1-CA 3.46Å; E686-A757 WeakPolarHBondContact OE1-CB 3.39Å; L687-A757 PolarHBondContact O-N 2.82Å; A757-D760 PolarHBondContact O-N 3.42Å; A757-D760 VanDerWaalsContact O-N 3.12Å; A757-R761 WeakPolarHBondContact O-CB 3.16Å; A757-R761 PolarHBondContact O-N 3.09Å
758	K	89.6	Confident	89.6	Confident	150 Å²	150	54.8 Å²	54.8	65%	0.652	25%	0.25	S	C	*	.	H	α-helix	trans	-53.2	-42.1	-172.1	-65.6	175.6	-177.6	173.4	0	114.6	F762	K758-F762 VanDerWaalsContact O-CB 3.31Å; K758-F762 WeakPolarHBondContact O-CB 3.24Å; K758-F762 PolarHBondContact O-N 3.03Å
759	P	90.8	Very high	89.9	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.019	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-46.7	175.9	-25.5	38.7	0	0	0	113.5	A695 C698 N699 F762 L763	A695-P759 HydrophobicContact CB-CB 4.01Å; A695-P759 HydrophobicContact CB-CG 3.97Å; A695-P759 WeakPolarHBondContact O-CG 3.47Å; C698-P759 HydrophobicContact CB-CB 3.85Å; C698-P759 HydrophobicContact CB-CG 4.34Å; N699-P759 WeakPolarHBondContact ND2-CG 3.28Å; N699-P759 WeakPolarHBondContact OD1-CD 3.49Å; N699-P759 WeakPolarHBondContact OD1-CG 3.37Å; P759-F762 PolarHBondContact O-N 3.18Å; P759-L763 WeakPolarHBondContact O-CG 3.41Å; P759-L763 PolarHBondContact O-N 3.22Å
760	D	91.9	Very high	90.1	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-46.1	179.3	-55.3	-117.1	0	0	0	110.3	V689 I690 L746 M756 A757 F762 L763 Y764	V689-D760 PolarHBondContact N-OD1 2.73Å; I690-D760 HydrophobicContact CG1-CB 4.39Å; I690-D760 WeakPolarHBondContact CG1-OD1 3.29Å; I690-D760 PolarHBondContact N-OD1 2.72Å; L746-D760 HydrophobicContact CD2-CB 3.93Å; M756-D760 HydrophobicContact CB-CB 4.4Å; A757-D760 PolarHBondContact O-N 3.42Å; A757-D760 VanDerWaalsContact O-N 3.12Å; D760-F762 PolarHBondContact O-N 2.7Å; D760-L763 PolarHBondContact O-N 3.49Å; D760-Y764 WeakPolarHBondContact O-CB 3.44Å; D760-Y764 PolarHBondContact O-N 3.39Å
761	R	92.1	Very high	90.4	Very high	58 Å²	58	48.5 Å²	48.5	22%	0.219	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-40.9	175	-168.2	81.4	-171.8	83.2	9.1	112.2	N709 L753 M756 A757 E765	N709-R761 PolarHBondContact ND2-O 2.89Å; L753-R761 WeakPolarHBondContact O-CD 3.35Å; L753-R761 PolarHBondContact O-NE 3.25Å; M756-R761 HydrophobicContact CB-CB 3.92Å; A757-R761 WeakPolarHBondContact O-CB 3.16Å; A757-R761 PolarHBondContact O-N 3.09Å; R761-E765 IonicContact CZ-OE1 3.73Å; R761-E765 VanDerWaalsContact CZ-OE1 3.22Å; R761-E765 IonicContact NH1-OE1 3.18Å; R761-E765 PolarHBondContact NH1-OE1 2.89Å; R761-E765 IonicContact NH2-OE1 2.67Å; R761-E765 PolarHBondContact NH2-OE1 2.65Å; R761-E765 PolarHBondContact O-N 3.46Å
762	F	94.8	Very high	90.8	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-53	176	164.6	-101.7	0	0	0	111.7	L702 I712 L733 K758 P759 D760 Y764 E765 M766	L702-F762 HydrophobicContact CD1-CB 3.88Å; L702-F762 HydrophobicContact CD1-CD1 4.49Å; L702-F762 HydrophobicContact CD1-CG 4.07Å; L702-F762 HydrophobicContact CD2-CD2 3.72Å; L702-F762 HydrophobicContact CD2-CE2 4.07Å; L702-F762 HydrophobicContact CD2-CG 4.03Å; I712-F762 HydrophobicContact CD1-CD2 4.11Å; I712-F762 HydrophobicContact CD1-CE2 3.86Å; L733-F762 HydrophobicContact CD2-CE2 4.21Å; L733-F762 HydrophobicContact CD2-CZ 3.75Å; K758-F762 VanDerWaalsContact O-CB 3.31Å; K758-F762 WeakPolarHBondContact O-CB 3.24Å; K758-F762 PolarHBondContact O-N 3.03Å; P759-F762 PolarHBondContact O-N 3.18Å; D760-F762 PolarHBondContact O-N 2.7Å; F762-Y764 VanDerWaalsContact C-N 3.27Å; F762-Y764 PolarHBondContact O-N 2.8Å; F762-E765 PolarHBondContact O-N 2.86Å; F762-M766 HydrophobicContact CD2-CE 4.27Å; F762-M766 HydrophobicContact CD2-CG 3.76Å; F762-M766 HydrophobicContact CD2-SD 4.31Å; F762-M766 HydrophobicContact CE1-CG 4.19Å; F762-M766 HydrophobicContact CE2-CE 4.23Å; F762-M766 HydrophobicContact CE2-CG 3.32Å; F762-M766 HydrophobicContact CE2-SD 3.72Å; F762-M766 HydrophobicContact CG-CG 4.36Å; F762-M766 HydrophobicContact CZ-CG 3.56Å; F762-M766 HydrophobicContact CZ-SD 4.34Å; F762-M766 WeakPolarHBondContact O-CG 3.36Å; F762-M766 PolarHBondContact O-N 3.06Å
763	L	93.7	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-37.6	179.8	-69.3	175	0	0	0	111.5	I690 F736 P738 L746 P759 D760 S767	I690-L763 HydrophobicContact CD1-CD1 4.03Å; I690-L763 HydrophobicContact CG1-CD1 4.12Å; I690-L763 HydrophobicContact CG2-CD1 4.33Å; F736-L763 VanDerWaalsContact O-CD2 3.23Å; F736-L763 WeakPolarHBondContact O-CD2 3.35Å; P738-L763 HydrophobicContact CB-CD2 4.45Å; P738-L763 HydrophobicContact CG-CB 4.36Å; P738-L763 HydrophobicContact CG-CD2 3.99Å; P738-L763 WeakPolarHBondContact CG-O 3.49Å; L746-L763 HydrophobicContact CD1-CB 3.91Å; P759-L763 WeakPolarHBondContact O-CG 3.41Å; P759-L763 PolarHBondContact O-N 3.22Å; D760-L763 PolarHBondContact O-N 3.49Å; L763-S767 WeakPolarHBondContact O-CB 3.38Å; L763-S767 PolarHBondContact O-N 3.34Å
764	Y	93.6	Very high	91.7	Very high	22 Å²	22	46.2 Å²	46.2	9%	0.086	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-53.2	172.6	-179.5	-91.5	0	0	0	112.1	L746 K750 L753 D760 F762 M766 S767 R768	L746-Y764 HydrophobicContact CB-CD2 4.03Å; K750-Y764 HydrophobicContact CB-CE2 4.02Å; L753-Y764 HydrophobicContact CD1-CE1 3.86Å; L753-Y764 HydrophobicContact CD2-CD1 3.72Å; L753-Y764 HydrophobicContact CD2-CD2 4.45Å; L753-Y764 HydrophobicContact CD2-CE1 3.56Å; L753-Y764 HydrophobicContact CD2-CE2 4.32Å; L753-Y764 HydrophobicContact CD2-CG 4.16Å; L753-Y764 HydrophobicContact CG-CE1 4.39Å; D760-Y764 WeakPolarHBondContact O-CB 3.44Å; D760-Y764 PolarHBondContact O-N 3.39Å; F762-Y764 VanDerWaalsContact C-N 3.27Å; F762-Y764 PolarHBondContact O-N 2.8Å; Y764-M766 PolarHBondContact O-N 3.17Å; Y764-S767 WeakPolarHBondContact O-CB 3.33Å; Y764-S767 PolarHBondContact O-N 2.92Å; Y764-S767 VanDerWaalsContact O-N 3.12Å; Y764-S767 PolarHBondContact O-OG 3.38Å; Y764-R768 HydrophobicContact CE1-CG 4.17Å; Y764-R768 PolarHBondContact O-N 2.99Å
765	E	93.2	Very high	92.3	Very high	17 Å²	17	38.8 Å²	38.8	8%	0.079	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-41	179.5	-76.2	-58.4	145.7	0	0	112.7	N709 K713 R761 F762 S767 R768	N709-E765 HydrophobicContact CB-CB 4.06Å; N709-E765 HydrophobicContact CB-CG 4.05Å; K713-E765 IonicContact NZ-OE2 2.62Å; K713-E765 PolarHBondContact NZ-OE2 3.44Å; K713-E765 VanDerWaalsContact NZ-OE2 3.11Å; R761-E765 IonicContact CZ-OE1 3.73Å; R761-E765 VanDerWaalsContact CZ-OE1 3.22Å; R761-E765 IonicContact NH1-OE1 3.18Å; R761-E765 PolarHBondContact NH1-OE1 2.89Å; R761-E765 IonicContact NH2-OE1 2.67Å; R761-E765 PolarHBondContact NH2-OE1 2.65Å; R761-E765 PolarHBondContact O-N 3.46Å; F762-E765 PolarHBondContact O-N 2.86Å; E765-S767 VanDerWaalsContact C-N 3.26Å; E765-S767 PolarHBondContact O-N 3.36Å; E765-R768 WeakPolarHBondContact O-CB 3.27Å; E765-R768 PolarHBondContact O-N 3.01Å; E765-R768 VanDerWaalsContact O-N 3.1Å
766	M	95.1	Very high	92.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-33.4	176.3	-63.4	-52.3	99.1	0	0	111.6	N709 I712 P738 F762 Y764 R768 I769 Y772	N709-M766 HydrophobicContact CB-CE 4.32Å; I712-M766 HydrophobicContact CB-CE 4.21Å; I712-M766 HydrophobicContact CB-SD 4.37Å; I712-M766 HydrophobicContact CG2-CE 4.14Å; I712-M766 HydrophobicContact CG2-SD 3.64Å; P738-M766 HydrophobicContact CG-CB 3.87Å; F762-M766 HydrophobicContact CD2-CE 4.27Å; F762-M766 HydrophobicContact CD2-CG 3.76Å; F762-M766 HydrophobicContact CD2-SD 4.31Å; F762-M766 HydrophobicContact CE1-CG 4.19Å; F762-M766 HydrophobicContact CE2-CE 4.23Å; F762-M766 HydrophobicContact CE2-CG 3.32Å; F762-M766 HydrophobicContact CE2-SD 3.72Å; F762-M766 HydrophobicContact CG-CG 4.36Å; F762-M766 HydrophobicContact CZ-CG 3.56Å; F762-M766 HydrophobicContact CZ-SD 4.34Å; F762-M766 WeakPolarHBondContact O-CG 3.36Å; F762-M766 PolarHBondContact O-N 3.06Å; Y764-M766 PolarHBondContact O-N 3.17Å; M766-R768 PolarHBondContact O-N 3.29Å; M766-I769 HydrophobicContact CE-CD1 4.23Å; M766-I769 WeakPolarHBondContact O-CB 3.33Å; M766-I769 PolarHBondContact O-N 3.12Å; M766-I769 VanDerWaalsContact O-N 3.17Å; M766-I769 HydrophobicContact SD-CD1 4.02Å; M766-Y772 HydrophobicContact CB-CD1 4.38Å; M766-Y772 HydrophobicContact CB-CD2 4Å; M766-Y772 HydrophobicContact CB-CE1 4.13Å; M766-Y772 HydrophobicContact CB-CE2 3.7Å; M766-Y772 HydrophobicContact CB-CG 4.32Å; M766-Y772 HydrophobicContact CG-CE1 4.5Å; M766-Y772 HydrophobicContact CG-CE2 3.76Å; M766-Y772 HydrophobicContact SD-CD2 4.24Å; M766-Y772 HydrophobicContact SD-CE2 3.35Å; M766-Y772 WeakPolarHBondContact SD-CE2 3.37Å
767	S	93.4	Very high	93.3	Very high	29 Å²	29	35.4 Å²	35.4	20%	0.203	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-20.5	175.1	80.5	0	0	0	0	114	L763 Y764 E765 I769	L763-S767 WeakPolarHBondContact O-CB 3.38Å; L763-S767 PolarHBondContact O-N 3.34Å; Y764-S767 WeakPolarHBondContact O-CB 3.33Å; Y764-S767 PolarHBondContact O-N 2.92Å; Y764-S767 VanDerWaalsContact O-N 3.12Å; Y764-S767 PolarHBondContact O-OG 3.38Å; E765-S767 VanDerWaalsContact C-N 3.26Å; E765-S767 PolarHBondContact O-N 3.36Å; S767-I769 VanDerWaalsContact C-N 3.29Å
768	R	92.6	Very high	93.6	Very high	96 Å²	96	35.2 Å²	35.2	36%	0.362	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-14.1	176.6	-58.5	-55.7	94.4	156.5	13	112.8	E747 Y764 E765 M766 N770	E747-R768 IonicContact OE1-NH1 2.64Å; E747-R768 IonicContact OE2-CZ 2.92Å; E747-R768 IonicContact OE2-NH1 2.69Å; E747-R768 PolarHBondContact OE2-NH1 3.32Å; E747-R768 IonicContact OE2-NH2 3.23Å; E747-R768 PolarHBondContact OE2-NH2 2.83Å; Y764-R768 HydrophobicContact CE1-CG 4.17Å; Y764-R768 PolarHBondContact O-N 2.99Å; E765-R768 WeakPolarHBondContact O-CB 3.27Å; E765-R768 PolarHBondContact O-N 3.01Å; E765-R768 VanDerWaalsContact O-N 3.1Å; M766-R768 PolarHBondContact O-N 3.29Å; R768-N770 PolarHBondContact O-N 3.5Å
769	I	92.4	Very high	94	Very high	12 Å²	12	28 Å²	28	6%	0.062	13%	0.129	C	C	.	.	S	Bend	trans	-81.6	113.7	179.5	-58.9	171.2	0	0	0	108.7	K713 I716 L717 M766 S767 H771 Y772	K713-I769 HydrophobicContact CB-CD1 3.93Å; K713-I769 HydrophobicContact CG-CD1 3.92Å; K713-I769 HydrophobicContact CG-CG1 4.11Å; I716-I769 HydrophobicContact CG2-CG2 4.42Å; L717-I769 HydrophobicContact CD2-CG2 4.45Å; M766-I769 HydrophobicContact CE-CD1 4.23Å; M766-I769 WeakPolarHBondContact O-CB 3.33Å; M766-I769 PolarHBondContact O-N 3.12Å; M766-I769 VanDerWaalsContact O-N 3.17Å; M766-I769 HydrophobicContact SD-CD1 4.02Å; S767-I769 VanDerWaalsContact C-N 3.29Å; I769-H771 PolarHBondContact O-N 2.82Å; I769-H771 VanDerWaalsContact O-N 3.15Å; I769-Y772 HydrophobicContact CB-CD2 4.04Å; I769-Y772 HydrophobicContact CD1-CD2 3.83Å; I769-Y772 HydrophobicContact CD1-CE2 4.16Å; I769-Y772 HydrophobicContact CG1-CD2 4.47Å; I769-Y772 HydrophobicContact CG2-CD2 4.28Å; I769-Y772 WeakPolarHBondContact O-CB 3.12Å; I769-Y772 PolarHBondContact O-N 3.18Å
770	N	91.1	Very high	94.2	Very high	46 Å²	46	29.7 Å²	29.7	25%	0.246	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	118.1	178.3	173.1	49.5	0	0	0	111.3	R768 Y772 R775 Q915 R918	R768-N770 PolarHBondContact O-N 3.5Å; N770-Y772 VanDerWaalsContact C-N 3.33Å; N770-Y772 PolarHBondContact O-N 3.11Å; N770-R775 VanDerWaalsContact O-CD 3.26Å; N770-R775 WeakPolarHBondContact O-CD 3.37Å; N770-R775 PolarHBondContact O-NE 3.47Å; N770-Q915 PolarHBondContact ND2-NE2 2.93Å; N770-Q915 PolarHBondContact ND2-OE1 3.01Å; N770-R918 WeakPolarHBondContact ND2-CD 3.32Å; N770-R918 PolarHBondContact ND2-NE 3.23Å
771	H	93.6	Very high	94.5	Very high	64 Å²	64	30.2 Å²	30.2	30%	0.296	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	41.2	-175.6	-80.8	-148	0	0	0	113.8	I769 Q773 Q774 R775 E911 F914	I769-H771 PolarHBondContact O-N 2.82Å; I769-H771 VanDerWaalsContact O-N 3.15Å; H771-Q773 VanDerWaalsContact C-N 3.28Å; H771-Q773 PolarHBondContact O-N 3.18Å; H771-Q773 VanDerWaalsContact O-N 3.16Å; H771-Q774 HydrophobicContact CB-CB 4.26Å; H771-Q774 PolarHBondContact O-N 3.06Å; H771-Q774 VanDerWaalsContact O-N 3.1Å; H771-Q774 PolarHBondContact O-OE1 3.37Å; H771-R775 WeakPolarHBondContact O-CG 3.42Å; H771-R775 PolarHBondContact O-N 2.94Å; H771-E911 WeakPolarHBondContact CB-OE1 3.49Å; H771-E911 IonicContact CE1-OE2 2.73Å; H771-E911 IonicContact CG-OE1 2.58Å; H771-E911 IonicContact CG-OE2 2.59Å; H771-E911 IonicContact ND1-OE1 2.68Å; H771-E911 PolarHBondContact ND1-OE1 2.95Å; H771-E911 IonicContact ND1-OE2 3.68Å; H771-E911 PolarHBondContact ND1-OE2 3.23Å; H771-F914 HydrophobicContact CB-CE1 4.39Å; H771-F914 AromaticContact CD2-CE1 3.55Å; H771-F914 AromaticContact CD2-CZ 3.74Å; H771-F914 AromaticContact CE1-CD1 3.47Å; H771-F914 VanDerWaalsContact CE1-CD1 3.47Å; H771-F914 WeakPolarHBondContact CE1-CD1 3.29Å; H771-F914 AromaticContact CE1-CD2 3.97Å; H771-F914 AromaticContact CE1-CE1 3.22Å; H771-F914 WeakPolarHBondContact CE1-CE1 3.37Å; H771-F914 AromaticContact CE1-CE2 3.73Å; H771-F914 AromaticContact CE1-CG 3.83Å; H771-F914 AromaticContact CE1-CZ 3.34Å; H771-F914 WeakPolarHBondContact CE1-CZ 3.34Å; H771-F914 AromaticContact CG-CD1 3.99Å; H771-F914 AromaticContact CG-CE1 3.51Å; H771-F914 AromaticContact ND1-CD1 3.38Å; H771-F914 WeakPolarHBondContact ND1-CD1 3.42Å; H771-F914 AromaticContact ND1-CE1 3.31Å; H771-F914 VanDerWaalsContact ND1-CE1 3.31Å; H771-F914 WeakPolarHBondContact ND1-CE1 3.3Å; H771-F914 AromaticContact ND1-CZ 3.92Å; H771-F914 AromaticContact NE2-CE1 3.39Å; H771-F914 WeakPolarHBondContact NE2-CE1 3.49Å; H771-F914 AromaticContact NE2-CE2 3.85Å; H771-F914 AromaticContact NE2-CZ 3.2Å; H771-F914 WeakPolarHBondContact NE2-CZ 3.48Å
772	Y	94.8	Very high	94.7	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.039	14%	0.139	C	C	.	.	H	α-helix	trans	-41	-51.4	176.6	177.9	-103.3	0	0	0	113.9	I716 V737 M766 I769 N770 L776	I716-Y772 HydrophobicContact CD1-CD2 4.17Å; I716-Y772 HydrophobicContact CD1-CE2 3.41Å; I716-Y772 VanDerWaalsContact CD1-CE2 3.41Å; V737-Y772 HydrophobicContact CG1-CD1 4.29Å; V737-Y772 HydrophobicContact CG2-CD1 4.36Å; V737-Y772 HydrophobicContact CG2-CE1 4.1Å; M766-Y772 HydrophobicContact CB-CD1 4.38Å; M766-Y772 HydrophobicContact CB-CD2 4Å; M766-Y772 HydrophobicContact CB-CE1 4.13Å; M766-Y772 HydrophobicContact CB-CE2 3.7Å; M766-Y772 HydrophobicContact CB-CG 4.32Å; M766-Y772 HydrophobicContact CG-CE1 4.5Å; M766-Y772 HydrophobicContact CG-CE2 3.76Å; M766-Y772 HydrophobicContact SD-CD2 4.24Å; M766-Y772 HydrophobicContact SD-CE2 3.35Å; M766-Y772 WeakPolarHBondContact SD-CE2 3.37Å; I769-Y772 HydrophobicContact CB-CD2 4.04Å; I769-Y772 HydrophobicContact CD1-CD2 3.83Å; I769-Y772 HydrophobicContact CD1-CE2 4.16Å; I769-Y772 HydrophobicContact CG1-CD2 4.47Å; I769-Y772 HydrophobicContact CG2-CD2 4.28Å; I769-Y772 WeakPolarHBondContact O-CB 3.12Å; I769-Y772 PolarHBondContact O-N 3.18Å; N770-Y772 VanDerWaalsContact C-N 3.33Å; N770-Y772 PolarHBondContact O-N 3.11Å; Y772-L776 HydrophobicContact CE1-CD2 3.99Å; Y772-L776 WeakPolarHBondContact O-CB 3.27Å; Y772-L776 PolarHBondContact O-N 3.05Å
773	Q	94.4	Very high	94.7	Very high	80 Å²	80	32 Å²	32	37%	0.374	15%	0.146	S	C	.	.	H	α-helix	trans	-62.8	-46.4	-176.8	-176.2	175.7	21.3	0	0	111.8	V737 H771 L776 Q777	V737-Q773 HydrophobicContact CG1-CB 3.9Å; V737-Q773 HydrophobicContact CG1-CG 4.12Å; V737-Q773 HydrophobicContact CG2-CB 4.39Å; V737-Q773 HydrophobicContact CG2-CG 4.16Å; H771-Q773 VanDerWaalsContact C-N 3.28Å; H771-Q773 PolarHBondContact O-N 3.18Å; H771-Q773 VanDerWaalsContact O-N 3.16Å; Q773-L776 PolarHBondContact O-N 2.98Å; Q773-Q777 WeakPolarHBondContact O-CB 3.34Å; Q773-Q777 WeakPolarHBondContact O-CG 3.37Å; Q773-Q777 PolarHBondContact O-N 3.31Å
774	Q	95.1	Very high	94.8	Very high	62 Å²	62	33.4 Å²	33.4	29%	0.29	15%	0.152	S	C	.	.	H	α-helix	trans	-71.9	-38.3	-176.2	-62.4	71.5	14.6	0	0	111	H771 Q777 S778 E911	H771-Q774 HydrophobicContact CB-CB 4.26Å; H771-Q774 PolarHBondContact O-N 3.06Å; H771-Q774 VanDerWaalsContact O-N 3.1Å; H771-Q774 PolarHBondContact O-OE1 3.37Å; Q774-Q777 PolarHBondContact O-N 3.04Å; Q774-S778 VanDerWaalsContact O-CB 3.3Å; Q774-S778 WeakPolarHBondContact O-CB 3.31Å; Q774-S778 PolarHBondContact O-N 3.23Å; Q774-S778 PolarHBondContact O-OG 3.16Å; Q774-E911 HydrophobicContact CB-CB 4.29Å; Q774-E911 VanDerWaalsContact CB-CD 3.4Å; Q774-E911 HydrophobicContact CB-CG 3.75Å; Q774-E911 VanDerWaalsContact CB-OE2 3.23Å; Q774-E911 WeakPolarHBondContact CB-OE2 3.44Å
775	R	95.6	Very high	94.9	Very high	5 Å²	5	33.1 Å²	33.1	2%	0.019	15%	0.151	C	C	.	.	H	α-helix	trans	-62	-47.4	171.9	-71	179	174.2	-109.2	0.3	111.6	I716 N770 H771 S778 L779 D924 F926	I716-R775 HydrophobicContact CG2-CB 4.02Å; N770-R775 VanDerWaalsContact O-CD 3.26Å; N770-R775 WeakPolarHBondContact O-CD 3.37Å; N770-R775 PolarHBondContact O-NE 3.47Å; H771-R775 WeakPolarHBondContact O-CG 3.42Å; H771-R775 PolarHBondContact O-N 2.94Å; R775-S778 WeakPolarHBondContact O-CB 3.47Å; R775-S778 PolarHBondContact O-N 3.37Å; R775-L779 WeakPolarHBondContact O-CB 3.37Å; R775-L779 PolarHBondContact O-N 3.03Å; R775-D924 IonicContact CZ-OD1 2.92Å; R775-D924 IonicContact CZ-OD2 3.73Å; R775-D924 IonicContact NH1-OD1 2.93Å; R775-D924 PolarHBondContact NH1-OD1 3.18Å; R775-D924 IonicContact NH1-OD2 3.36Å; R775-D924 PolarHBondContact NH1-OD2 2.87Å; R775-D924 VanDerWaalsContact NH1-OD2 3.12Å; R775-D924 IonicContact NH2-OD1 3.3Å; R775-D924 IonicContact NH2-OD2 2.92Å; R775-D924 PolarHBondContact NH2-OD2 3.33Å; R775-F926 HydrophobicContact CB-CD2 4.4Å; R775-F926 HydrophobicContact CB-CE2 4.2Å; R775-F926 HydrophobicContact CG-CD2 3.93Å; R775-F926 HydrophobicContact CG-CE2 3.9Å
776	L	95.9	Very high	94.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-41.4	177.8	-174.5	69	0	0	0	112.1	I716 L730 L733 L734 V737 Y772 Q773 L779 Y780	I716-L776 HydrophobicContact CD1-CD1 4.04Å; I716-L776 HydrophobicContact CG1-CD1 4.4Å; L730-L776 HydrophobicContact CD2-CD1 3.54Å; L733-L776 HydrophobicContact CB-CD1 4.18Å; L733-L776 HydrophobicContact CB-CD2 3.73Å; L733-L776 HydrophobicContact CD1-CD1 4.36Å; L734-L776 HydrophobicContact CD2-CB 4.22Å; L734-L776 HydrophobicContact CD2-CD2 3.75Å; L734-L776 HydrophobicContact CD2-CG 3.8Å; L734-L776 HydrophobicContact CG-CD2 3.87Å; L734-L776 HydrophobicContact CG-CG 3.97Å; V737-L776 HydrophobicContact CG2-CD2 4.47Å; Y772-L776 HydrophobicContact CE1-CD2 3.99Å; Y772-L776 WeakPolarHBondContact O-CB 3.27Å; Y772-L776 PolarHBondContact O-N 3.05Å; Q773-L776 PolarHBondContact O-N 2.98Å; L776-L779 PolarHBondContact O-N 2.95Å; L776-Y780 VanDerWaalsContact O-CB 3.3Å; L776-Y780 WeakPolarHBondContact O-CB 3.35Å; L776-Y780 PolarHBondContact O-N 3.18Å
777	Q	96.3	Very high	94.9	Very high	81 Å²	81	39.4 Å²	39.4	38%	0.379	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-42.6	172.5	-77.3	172.6	-12.6	0	0	111.7	L734 Q773 Q774 Y780 F781	L734-Q777 HydrophobicContact CD2-CB 4.37Å; L734-Q777 HydrophobicContact CD2-CG 3.46Å; L734-Q777 VanDerWaalsContact CD2-CG 3.46Å; Q773-Q777 WeakPolarHBondContact O-CB 3.34Å; Q773-Q777 WeakPolarHBondContact O-CG 3.37Å; Q773-Q777 PolarHBondContact O-N 3.31Å; Q774-Q777 PolarHBondContact O-N 3.04Å; Q777-Y780 PolarHBondContact O-N 2.73Å; Q777-F781 VanDerWaalsContact O-CB 3.32Å; Q777-F781 WeakPolarHBondContact O-CB 3.48Å; Q777-F781 PolarHBondContact O-N 3.21Å
778	S	96.6	Very high	94.9	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-41.8	178.7	-61.1	0	0	0	0	112.5	Q774 R775 F781 K782	Q774-S778 VanDerWaalsContact O-CB 3.3Å; Q774-S778 WeakPolarHBondContact O-CB 3.31Å; Q774-S778 PolarHBondContact O-N 3.23Å; Q774-S778 PolarHBondContact O-OG 3.16Å; R775-S778 WeakPolarHBondContact O-CB 3.47Å; R775-S778 PolarHBondContact O-N 3.37Å; S778-F781 PolarHBondContact O-N 3.48Å; S778-K782 WeakPolarHBondContact O-CB 3.23Å; S778-K782 PolarHBondContact O-N 3Å
779	L	96.8	Very high	95	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-45.5	174.6	175.9	57.1	0	0	0	111.9	M719 D720 L725 L730 R775 L776 K782 K783	M719-L779 HydrophobicContact CE-CB 3.93Å; M719-L779 HydrophobicContact CE-CD1 4.08Å; M719-L779 WeakPolarHBondContact O-CD1 3.35Å; M719-L779 HydrophobicContact SD-CB 4.14Å; D720-L779 HydrophobicContact CB-CD1 3.85Å; D720-L779 HydrophobicContact CB-CD2 3.95Å; L725-L779 HydrophobicContact CD1-CD2 4.02Å; L730-L779 HydrophobicContact CD1-CD2 4.49Å; L730-L779 HydrophobicContact CD1-CG 4.09Å; L730-L779 HydrophobicContact CD2-CD2 3.73Å; L730-L779 HydrophobicContact CD2-CG 4.06Å; R775-L779 WeakPolarHBondContact O-CB 3.37Å; R775-L779 PolarHBondContact O-N 3.03Å; L776-L779 PolarHBondContact O-N 2.95Å; L779-K782 PolarHBondContact O-N 3.1Å; L779-K783 PolarHBondContact O-N 2.86Å
780	Y	96.4	Very high	95.1	Very high	37 Å²	37	40.1 Å²	40.1	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-44.3	175.4	176.4	-114.6	0	0	0	112.3	K727 L730 E731 L734 L776 Q777 K783 K784	K727-Y780 WeakPolarHBondContact O-CE2 3.4Å; L730-Y780 HydrophobicContact CB-CD2 3.83Å; L730-Y780 HydrophobicContact CB-CG 4.47Å; E731-Y780 HydrophobicContact CB-CE2 3.78Å; E731-Y780 HydrophobicContact CG-CE2 4.14Å; E731-Y780 WeakPolarHBondContact CG-OH 3.38Å; E731-Y780 PolarHBondContact OE2-OH 3.23Å; E731-Y780 VanDerWaalsContact OE2-OH 3.12Å; L734-Y780 HydrophobicContact CD1-CD1 3.46Å; L734-Y780 VanDerWaalsContact CD1-CD1 3.46Å; L734-Y780 HydrophobicContact CD1-CD2 4.31Å; L734-Y780 HydrophobicContact CD1-CE1 4.02Å; L734-Y780 HydrophobicContact CD1-CG 3.62Å; L776-Y780 VanDerWaalsContact O-CB 3.3Å; L776-Y780 WeakPolarHBondContact O-CB 3.35Å; L776-Y780 PolarHBondContact O-N 3.18Å; Q777-Y780 PolarHBondContact O-N 2.73Å; Y780-K783 PolarHBondContact O-N 2.86Å; Y780-K784 HydrophobicContact CD2-CD 4.41Å; Y780-K784 HydrophobicContact CD2-CG 4.4Å; Y780-K784 HydrophobicContact CE1-CD 4.44Å; Y780-K784 HydrophobicContact CE2-CD 3.58Å; Y780-K784 VanDerWaalsContact CE2-CE 3.45Å; Y780-K784 HydrophobicContact CE2-CG 4.04Å; Y780-K784 PolarHBondContact O-N 2.81Å; Y780-K784 WeakPolarHBondContact OH-CE 3.31Å; Y780-K784 PolarHBondContact OH-NZ 3.39Å
781	F	96.7	Very high	95.3	Very high	12 Å²	12	43 Å²	43	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-46.7	175.2	-174.3	-98	0	0	0	111.5	Q777 S778 K783 K784 F785 L901 L905 V908 F933	Q777-F781 VanDerWaalsContact O-CB 3.32Å; Q777-F781 WeakPolarHBondContact O-CB 3.48Å; Q777-F781 PolarHBondContact O-N 3.21Å; S778-F781 PolarHBondContact O-N 3.48Å; F781-K783 VanDerWaalsContact C-N 3.34Å; F781-K783 PolarHBondContact O-N 3.47Å; F781-K784 CarbonylContact O-C 3.58Å; F781-K784 PolarHBondContact O-N 3.18Å; F781-K784 VanDerWaalsContact O-N 3.16Å; F781-F785 AromaticContact CE1-CD2 3.78Å; F781-F785 HydrophobicContact CE1-CD2 3.78Å; F781-F785 HydrophobicContact CE1-CE2 4.44Å; F781-F785 AromaticContact CZ-CD2 3.81Å; F781-F785 HydrophobicContact CZ-CD2 3.81Å; F781-F785 HydrophobicContact CZ-CE2 4.36Å; F781-F785 WeakPolarHBondContact O-CB 3.42Å; F781-F785 PolarHBondContact O-N 3.17Å; F781-L901 HydrophobicContact CE2-CD2 3.98Å; F781-L901 HydrophobicContact CZ-CD2 3.98Å; F781-L905 HydrophobicContact CE1-CB 4.04Å; F781-L905 HydrophobicContact CE1-CD1 4.29Å; F781-L905 HydrophobicContact CZ-CB 3.99Å; F781-L905 VanDerWaalsContact CZ-N 3.29Å; F781-V908 HydrophobicContact CB-CG2 4.15Å; F781-V908 HydrophobicContact CD1-CG2 3.79Å; F781-V908 HydrophobicContact CG-CG2 4.18Å; F781-F933 AromaticContact CD1-CE1 3.86Å; F781-F933 HydrophobicContact CD1-CE1 3.86Å; F781-F933 AromaticContact CD1-CZ 3.82Å; F781-F933 HydrophobicContact CD1-CZ 3.82Å; F781-F933 HydrophobicContact CE1-CE1 4.08Å; F781-F933 AromaticContact CE1-CZ 3.9Å; F781-F933 HydrophobicContact CE1-CZ 3.9Å
782	K	95.9	Very high	95.3	Very high	63 Å²	63	40.1 Å²	40.1	27%	0.274	20%	0.204	S	C	.	.	H	α-helix	trans	-53.2	-47.5	173.3	168.6	172.9	171.6	-89.4	0	111.9	M719 S778 L779 V929 F933	M719-K782 HydrophobicContact CE-CD 4Å; S778-K782 WeakPolarHBondContact O-CB 3.23Å; S778-K782 PolarHBondContact O-N 3Å; L779-K782 PolarHBondContact O-N 3.1Å; K782-V929 HydrophobicContact CD-CG1 4.1Å; K782-F933 HydrophobicContact CB-CD1 4.39Å; K782-F933 HydrophobicContact CB-CD2 4.2Å; K782-F933 HydrophobicContact CB-CE1 4.37Å; K782-F933 HydrophobicContact CB-CE2 4.16Å; K782-F933 HydrophobicContact CB-CG 4.31Å; K782-F933 HydrophobicContact CB-CZ 4.26Å; K782-F933 HydrophobicContact CD-CB 4.39Å; K782-F933 HydrophobicContact CD-CD2 4.46Å; K782-F933 HydrophobicContact CD-CG 4.35Å; K782-F933 HydrophobicContact CG-CD2 3.92Å; K782-F933 HydrophobicContact CG-CE2 4.24Å; K782-F933 HydrophobicContact CG-CG 4.21Å
783	K	95.5	Very high	95.4	Very high	32 Å²	32	43.3 Å²	43.3	14%	0.139	22%	0.218	C	C	.	.	H	α-helix	trans	-70.7	-29.1	179	-70.9	-152.5	179.1	-171	0	113.9	D720 L725 K727 L730 L779 Y780 F781	D720-K783 VanDerWaalsContact OD2-CE 3.24Å; D720-K783 WeakPolarHBondContact OD2-CE 3.47Å; D720-K783 IonicContact OD2-NZ 2.67Å; D720-K783 PolarHBondContact OD2-NZ 2.84Å; L725-K783 PolarHBondContact O-NZ 3.26Å; K727-K783 WeakPolarHBondContact CE-O 3.47Å; K727-K783 HydrophobicContact CG-CB 4.1Å; K727-K783 HydrophobicContact CG-CD 4.48Å; L730-K783 HydrophobicContact CD1-CD 3.95Å; L730-K783 HydrophobicContact CD1-CG 4.37Å; L779-K783 PolarHBondContact O-N 2.86Å; Y780-K783 PolarHBondContact O-N 2.86Å; F781-K783 VanDerWaalsContact C-N 3.34Å; F781-K783 PolarHBondContact O-N 3.47Å
784	K	95.4	Very high	95.5	Very high	31 Å²	31	43 Å²	43	14%	0.135	22%	0.223	C	C	.	.	H	α-helix	trans	-96.8	0.9	177.8	-68.1	-155.3	168.7	172	0	115.2	K727 E731 Y780 F781 E787 R788	K727-K784 HydrophobicContact CD-CG 4.44Å; E731-K784 IonicContact OE2-NZ 2.6Å; E731-K784 PolarHBondContact OE2-NZ 3.43Å; Y780-K784 HydrophobicContact CD2-CD 4.41Å; Y780-K784 HydrophobicContact CD2-CG 4.4Å; Y780-K784 HydrophobicContact CE1-CD 4.44Å; Y780-K784 HydrophobicContact CE2-CD 3.58Å; Y780-K784 VanDerWaalsContact CE2-CE 3.45Å; Y780-K784 HydrophobicContact CE2-CG 4.04Å; Y780-K784 PolarHBondContact O-N 2.81Å; Y780-K784 WeakPolarHBondContact OH-CE 3.31Å; Y780-K784 PolarHBondContact OH-NZ 3.39Å; F781-K784 CarbonylContact O-C 3.58Å; F781-K784 PolarHBondContact O-N 3.18Å; F781-K784 VanDerWaalsContact O-N 3.16Å; K784-E787 HydrophobicContact CB-CG 4.25Å; K784-E787 WeakPolarHBondContact CB-OE1 3.34Å; K784-E787 WeakPolarHBondContact CD-OE1 3.47Å; K784-E787 WeakPolarHBondContact CG-OE1 3.36Å; K784-E787 WeakPolarHBondContact O-CG 3.28Å; K784-R788 WeakPolarHBondContact O-CD 3.12Å; K784-R788 VanDerWaalsContact O-CG 3.28Å; K784-R788 WeakPolarHBondContact O-CG 3.17Å; K784-R788 PolarHBondContact O-N 2.81Å
785	F	96.1	Very high	95.5	Very high	15 Å²	15	42 Å²	42	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-51.2	-178.9	-176.4	-98.9	0	0	0	112.5	F781 E787 R788 I789 L901 F933 A937 F941	F781-F785 AromaticContact CE1-CD2 3.78Å; F781-F785 HydrophobicContact CE1-CD2 3.78Å; F781-F785 HydrophobicContact CE1-CE2 4.44Å; F781-F785 AromaticContact CZ-CD2 3.81Å; F781-F785 HydrophobicContact CZ-CD2 3.81Å; F781-F785 HydrophobicContact CZ-CE2 4.36Å; F781-F785 WeakPolarHBondContact O-CB 3.42Å; F781-F785 PolarHBondContact O-N 3.17Å; F785-E787 PolarHBondContact O-N 3.47Å; F785-R788 PolarHBondContact O-N 3.07Å; F785-I789 HydrophobicContact CD1-CG1 4.1Å; F785-I789 HydrophobicContact CD2-CG1 4.49Å; F785-I789 HydrophobicContact CE1-CD1 4.27Å; F785-I789 HydrophobicContact CE1-CG1 3.68Å; F785-I789 HydrophobicContact CE2-CD1 4.16Å; F785-I789 HydrophobicContact CE2-CG1 4.11Å; F785-I789 HydrophobicContact CG-CG1 4.49Å; F785-I789 HydrophobicContact CZ-CD1 3.78Å; F785-I789 HydrophobicContact CZ-CG1 3.68Å; F785-I789 WeakPolarHBondContact O-CG1 3.35Å; F785-I789 PolarHBondContact O-N 2.88Å; F785-L901 HydrophobicContact CD2-CD2 3.87Å; F785-L901 HydrophobicContact CE2-CD2 4.11Å; F785-F933 HydrophobicContact CB-CE2 3.87Å; F785-F933 HydrophobicContact CB-CZ 3.88Å; F785-F933 HydrophobicContact CD1-CE2 4.16Å; F785-F933 HydrophobicContact CD1-CZ 4.49Å; F785-F933 HydrophobicContact CD2-CZ 4.2Å; F785-F933 AromaticContact CG-CE2 3.98Å; F785-F933 HydrophobicContact CG-CE2 3.98Å; F785-F933 AromaticContact CG-CZ 3.94Å; F785-F933 HydrophobicContact CG-CZ 3.94Å; F785-A937 HydrophobicContact CD1-CB 4.24Å; F785-A937 HydrophobicContact CD2-CB 4.39Å; F785-A937 HydrophobicContact CE1-CB 3.82Å; F785-A937 HydrophobicContact CE2-CB 3.98Å; F785-A937 HydrophobicContact CZ-CB 3.69Å; F785-A937 WeakPolarHBondContact CZ-O 3.4Å; F785-F941 HydrophobicContact CZ-CB 4.3Å
786	A	93.8	Very high	95.6	Very high	72 Å²	72	42 Å²	42	60%	0.595	22%	0.218	S	C	*	.	H	α-helix	trans	-64.3	-38.7	-174.5	0	0	0	0	0	113.4	A790	A786-A790 VanDerWaalsContact O-CB 3.3Å; A786-A790 WeakPolarHBondContact O-CB 3.48Å; A786-A790 PolarHBondContact O-N 3.24Å
787	E	93.9	Very high	95.7	Very high	77 Å²	77	46.8 Å²	46.8	36%	0.36	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-42.2	176.5	59.2	-172.5	-142.9	0	0	111.9	K727 K784 F785 A790 E791	K727-E787 WeakPolarHBondContact CD-OE2 3.08Å; K727-E787 WeakPolarHBondContact CE-OE2 3.23Å; K727-E787 IonicContact NZ-OE2 3.5Å; K727-E787 PolarHBondContact NZ-OE2 2.84Å; K784-E787 HydrophobicContact CB-CG 4.25Å; K784-E787 WeakPolarHBondContact CB-OE1 3.34Å; K784-E787 WeakPolarHBondContact CD-OE1 3.47Å; K784-E787 WeakPolarHBondContact CG-OE1 3.36Å; K784-E787 WeakPolarHBondContact O-CG 3.28Å; F785-E787 PolarHBondContact O-N 3.47Å; E787-A790 PolarHBondContact O-N 3.2Å; E787-E791 PolarHBondContact O-N 3.3Å
788	R	94.1	Very high	95.7	Very high	74 Å²	74	43.5 Å²	43.5	28%	0.279	23%	0.227	S	C	.	.	H	α-helix	trans	-65.4	-44	177.9	-70.4	171.6	178.5	-166.2	-4	112.2	K784 F785 A790 E791 I792 L901	K784-R788 WeakPolarHBondContact O-CD 3.12Å; K784-R788 VanDerWaalsContact O-CG 3.28Å; K784-R788 WeakPolarHBondContact O-CG 3.17Å; K784-R788 PolarHBondContact O-N 2.81Å; F785-R788 PolarHBondContact O-N 3.07Å; R788-A790 VanDerWaalsContact C-N 3.32Å; R788-A790 PolarHBondContact O-N 2.96Å; R788-E791 PolarHBondContact O-N 2.64Å; R788-I792 VanDerWaalsContact O-CB 3.31Å; R788-I792 WeakPolarHBondContact O-CB 3.15Å; R788-I792 WeakPolarHBondContact O-CD1 3.36Å; R788-I792 VanDerWaalsContact O-CG1 3.26Å; R788-I792 WeakPolarHBondContact O-CG1 3.15Å; R788-I792 PolarHBondContact O-N 2.88Å; R788-L901 HydrophobicContact CB-CD1 4.35Å; R788-L901 HydrophobicContact CB-CD2 3.99Å; R788-L901 HydrophobicContact CB-CG 4.43Å
789	I	95.6	Very high	95.8	Very high	13 Å²	13	43.4 Å²	43.4	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-41.5	175.3	-65.5	-71.6	0	0	0	110.8	F785 E791 I792 K793 L901 F941 V944	F785-I789 HydrophobicContact CD1-CG1 4.1Å; F785-I789 HydrophobicContact CD2-CG1 4.49Å; F785-I789 HydrophobicContact CE1-CD1 4.27Å; F785-I789 HydrophobicContact CE1-CG1 3.68Å; F785-I789 HydrophobicContact CE2-CD1 4.16Å; F785-I789 HydrophobicContact CE2-CG1 4.11Å; F785-I789 HydrophobicContact CG-CG1 4.49Å; F785-I789 HydrophobicContact CZ-CD1 3.78Å; F785-I789 HydrophobicContact CZ-CG1 3.68Å; F785-I789 WeakPolarHBondContact O-CG1 3.35Å; F785-I789 PolarHBondContact O-N 2.88Å; I789-E791 VanDerWaalsContact C-N 3.32Å; I789-E791 PolarHBondContact O-N 3.24Å; I789-I792 PolarHBondContact O-N 3.36Å; I789-K793 HydrophobicContact CG2-CD 4.04Å; I789-K793 HydrophobicContact CG2-CG 4.23Å; I789-K793 WeakPolarHBondContact O-CB 3.17Å; I789-K793 WeakPolarHBondContact O-CG 3.4Å; I789-K793 PolarHBondContact O-N 3.38Å; I789-L901 HydrophobicContact CD1-CD1 3.72Å; I789-L901 HydrophobicContact CG1-CD1 4.37Å; I789-F941 HydrophobicContact CD1-CD2 4.34Å; I789-V944 HydrophobicContact CD1-CG2 4.06Å; I789-V944 HydrophobicContact CG2-CG2 4.36Å
790	A	94.4	Very high	95.8	Very high	65 Å²	65	44.2 Å²	44.2	54%	0.537	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-28.5	178.1	0	0	0	0	0	113.6	A786 E787 R788 P794	A786-A790 VanDerWaalsContact O-CB 3.3Å; A786-A790 WeakPolarHBondContact O-CB 3.48Å; A786-A790 PolarHBondContact O-N 3.24Å; E787-A790 PolarHBondContact O-N 3.2Å; R788-A790 VanDerWaalsContact C-N 3.32Å; R788-A790 PolarHBondContact O-N 2.96Å; A790-P794 WeakPolarHBondContact O-CD 3.22Å; A790-P794 WeakPolarHBondContact O-CG 3.19Å
791	E	93.8	Very high	95.9	Very high	107 Å²	107	46.8 Å²	46.8	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-79.5	-36.6	173.8	-159.3	-161.6	133.4	0	0	112.6	E787 R788 I789 K795	E787-E791 PolarHBondContact O-N 3.3Å; R788-E791 PolarHBondContact O-N 2.64Å; I789-E791 VanDerWaalsContact C-N 3.32Å; I789-E791 PolarHBondContact O-N 3.24Å; E791-K795 WeakPolarHBondContact O-CG 3.41Å; E791-K795 WeakPolarHBondContact OE1-CE 3.29Å; E791-K795 IonicContact OE1-NZ 3.1Å; E791-K795 PolarHBondContact OE1-NZ 3.2Å
792	I	95.3	Very high	95.9	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-75.6	-43	-177.2	-76.4	168.5	0	0	0	112.4	R788 I789 K795 I796 L894 D897 I898 L901 V944	R788-I792 VanDerWaalsContact O-CB 3.31Å; R788-I792 WeakPolarHBondContact O-CB 3.15Å; R788-I792 WeakPolarHBondContact O-CD1 3.36Å; R788-I792 VanDerWaalsContact O-CG1 3.26Å; R788-I792 WeakPolarHBondContact O-CG1 3.15Å; R788-I792 PolarHBondContact O-N 2.88Å; I789-I792 PolarHBondContact O-N 3.36Å; I792-K795 WeakPolarHBondContact O-CB 3.41Å; I792-K795 PolarHBondContact O-N 3.23Å; I792-K795 VanDerWaalsContact O-N 3.16Å; I792-I796 HydrophobicContact CG2-CD1 3.58Å; I792-I796 HydrophobicContact CG2-CG1 4.29Å; I792-I796 PolarHBondContact O-N 2.96Å; I792-I796 VanDerWaalsContact O-N 3.15Å; I792-L894 HydrophobicContact CB-CD1 4.48Å; I792-L894 HydrophobicContact CG1-CD1 4.32Å; I792-L894 HydrophobicContact CG2-CD1 4.03Å; I792-D897 HydrophobicContact CD1-CB 3.99Å; I792-D897 HydrophobicContact CG1-CB 4.45Å; I792-I898 HydrophobicContact CD1-CD1 4.42Å; I792-I898 HydrophobicContact CG2-CD1 3.74Å; I792-I898 HydrophobicContact CG2-CG1 4.41Å; I792-L901 HydrophobicContact CD1-CD1 3.53Å; I792-L901 HydrophobicContact CD1-CG 4.42Å; I792-V944 HydrophobicContact CG2-CG1 3.71Å
793	K	95.6	Very high	96	Very high	77 Å²	77	43.2 Å²	43.2	34%	0.335	23%	0.228	S	C	.	.	H	α-helix	trans	-57.5	-46.5	-174.6	-82.3	-169.4	169.8	-160.8	0	113.8	I789 K795 I796 E797 D943 V944	I789-K793 HydrophobicContact CG2-CD 4.04Å; I789-K793 HydrophobicContact CG2-CG 4.23Å; I789-K793 WeakPolarHBondContact O-CB 3.17Å; I789-K793 WeakPolarHBondContact O-CG 3.4Å; I789-K793 PolarHBondContact O-N 3.38Å; K793-K795 VanDerWaalsContact C-N 3.33Å; K793-K795 PolarHBondContact O-N 3.02Å; K793-I796 PolarHBondContact O-N 3.32Å; K793-E797 WeakPolarHBondContact O-CB 3.3Å; K793-E797 PolarHBondContact O-N 3.37Å; K793-D943 VanDerWaalsContact CE-OD2 3.31Å; K793-D943 WeakPolarHBondContact CE-OD2 3.44Å; K793-D943 IonicContact NZ-OD2 2.79Å; K793-D943 PolarHBondContact NZ-OD2 3.03Å; K793-V944 HydrophobicContact CD-CG2 4.14Å; K793-V944 HydrophobicContact CG-CG2 3.76Å
794	P	96.4	Very high	96.1	Very high	74 Å²	74	45.2 Å²	45.2	48%	0.481	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-36.5	176.5	-24.6	35.4	0	0	0	113.6	A790 I796 E797 A798	A790-P794 WeakPolarHBondContact O-CD 3.22Å; A790-P794 WeakPolarHBondContact O-CG 3.19Å; P794-I796 PolarHBondContact O-N 2.91Å; P794-E797 PolarHBondContact O-N 3.38Å; P794-A798 WeakPolarHBondContact O-CB 3.21Å; P794-A798 PolarHBondContact O-N 3.09Å
795	K	96.5	Very high	96.2	Very high	41 Å²	41	45.8 Å²	45.8	18%	0.178	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-44.4	176.1	-62.9	177	-171	-179.2	0	110.7	E791 I792 K793 L799 V889 L894	E791-K795 WeakPolarHBondContact O-CG 3.41Å; E791-K795 WeakPolarHBondContact OE1-CE 3.29Å; E791-K795 IonicContact OE1-NZ 3.1Å; E791-K795 PolarHBondContact OE1-NZ 3.2Å; I792-K795 WeakPolarHBondContact O-CB 3.41Å; I792-K795 PolarHBondContact O-N 3.23Å; I792-K795 VanDerWaalsContact O-N 3.16Å; K793-K795 VanDerWaalsContact C-N 3.33Å; K793-K795 PolarHBondContact O-N 3.02Å; K795-L799 WeakPolarHBondContact O-CG 3.31Å; K795-L799 PolarHBondContact O-N 3.25Å; K795-V889 HydrophobicContact CB-CG1 3.96Å; K795-V889 HydrophobicContact CB-CG2 4.07Å; K795-V889 HydrophobicContact CG-CG2 4.42Å; K795-L894 HydrophobicContact CB-CD1 4.03Å; K795-L894 HydrophobicContact CB-CD2 4.37Å; K795-L894 HydrophobicContact CD-CD1 4.19Å
796	I	97.4	Very high	96.2	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-67.7	-45.2	176.3	-63	170.2	0	0	0	111.3	I792 K793 P794 A798 L799 T800 L894 I898 V944 S947 L948 A951	I792-I796 HydrophobicContact CG2-CD1 3.58Å; I792-I796 HydrophobicContact CG2-CG1 4.29Å; I792-I796 PolarHBondContact O-N 2.96Å; I792-I796 VanDerWaalsContact O-N 3.15Å; K793-I796 PolarHBondContact O-N 3.32Å; P794-I796 PolarHBondContact O-N 2.91Å; I796-A798 VanDerWaalsContact C-N 3.35Å; I796-A798 PolarHBondContact O-N 2.93Å; I796-L799 PolarHBondContact O-N 3.43Å; I796-T800 PolarHBondContact O-N 2.87Å; I796-T800 PolarHBondContact O-OG1 3Å; I796-L894 HydrophobicContact CG1-CD1 4.23Å; I796-L894 HydrophobicContact CG1-CD2 4.09Å; I796-I898 HydrophobicContact CD1-CD1 4.39Å; I796-V944 HydrophobicContact CD1-CG1 3.85Å; I796-S947 WeakPolarHBondContact CG2-O 3.37Å; I796-L948 HydrophobicContact CD1-CB 4Å; I796-L948 HydrophobicContact CD1-CD1 4.24Å; I796-L948 HydrophobicContact CG1-CB 4.49Å; I796-L948 HydrophobicContact CG1-CD1 4Å; I796-A951 HydrophobicContact CG2-CB 3.97Å
797	E	96.9	Very high	96.3	Very high	101 Å²	101	43 Å²	43	47%	0.472	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-41	-177.9	-165.5	-174.2	154.2	0	0	111.9	K793 P794 T800 K801	K793-E797 WeakPolarHBondContact O-CB 3.3Å; K793-E797 PolarHBondContact O-N 3.37Å; P794-E797 PolarHBondContact O-N 3.38Å; E797-T800 PolarHBondContact O-N 3.08Å; E797-K801 HydrophobicContact CG-CD 4.15Å; E797-K801 WeakPolarHBondContact O-CB 3.42Å; E797-K801 WeakPolarHBondContact O-CG 3.45Å; E797-K801 PolarHBondContact O-N 3.11Å; E797-K801 WeakPolarHBondContact OE1-CE 3.37Å; E797-K801 IonicContact OE1-NZ 3.41Å; E797-K801 PolarHBondContact OE1-NZ 3.15Å
798	A	97.4	Very high	96.3	Very high	12 Å²	12	45.4 Å²	45.4	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-47.5	174.5	0	0	0	0	0	111.9	P794 I796 T800 K801 A802 E885	P794-A798 WeakPolarHBondContact O-CB 3.21Å; P794-A798 PolarHBondContact O-N 3.09Å; I796-A798 VanDerWaalsContact C-N 3.35Å; I796-A798 PolarHBondContact O-N 2.93Å; A798-T800 PolarHBondContact O-N 3.15Å; A798-K801 PolarHBondContact O-N 3.27Å; A798-A802 VanDerWaalsContact O-CB 3.29Å; A798-A802 WeakPolarHBondContact O-CB 3.25Å; A798-A802 PolarHBondContact O-N 3.02Å; A798-E885 HydrophobicContact CB-CB 3.98Å
799	L	97.3	Very high	96.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-47.6	175.4	-71.3	175.4	0	0	0	112.1	K795 I796 S803 A886 V889 M891 L894 A951 P971 F975	K795-L799 WeakPolarHBondContact O-CG 3.31Å; K795-L799 PolarHBondContact O-N 3.25Å; I796-L799 PolarHBondContact O-N 3.43Å; L799-S803 WeakPolarHBondContact O-CB 3.38Å; L799-S803 PolarHBondContact O-N 3.28Å; L799-S803 PolarHBondContact O-OG 2.95Å; L799-A886 HydrophobicContact CD2-CB 4.45Å; L799-V889 HydrophobicContact CD1-CB 4.45Å; L799-V889 HydrophobicContact CD1-CG1 3.68Å; L799-V889 HydrophobicContact CD2-CB 4.07Å; L799-V889 HydrophobicContact CD2-CG1 4.19Å; L799-V889 HydrophobicContact CG-CB 4.14Å; L799-V889 HydrophobicContact CG-CG1 3.89Å; L799-V889 HydrophobicContact CG-CG2 4.44Å; L799-M891 HydrophobicContact CD1-CE 3.65Å; L799-L894 HydrophobicContact CD1-CD2 3.86Å; L799-A951 HydrophobicContact CB-CB 4.28Å; L799-P971 HydrophobicContact CD2-CB 3.37Å; L799-P971 HydrophobicContact CD2-CG 3.83Å; L799-F975 HydrophobicContact CD2-CD2 4.36Å; L799-F975 HydrophobicContact CD2-CE2 3.93Å
800	T	97.7	Very high	96.4	Very high	17 Å²	17	52.1 Å²	52.1	10%	0.104	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-44.2	179.3	-73	0	0	0	0	111.7	I796 E797 A798 K804 A951 L954	I796-T800 PolarHBondContact O-N 2.87Å; I796-T800 PolarHBondContact O-OG1 3Å; E797-T800 PolarHBondContact O-N 3.08Å; A798-T800 PolarHBondContact O-N 3.15Å; T800-K804 HydrophobicContact CG2-CD 3.93Å; T800-K804 WeakPolarHBondContact O-CB 3.43Å; T800-K804 WeakPolarHBondContact O-CD 3.49Å; T800-K804 VanDerWaalsContact O-CG 3.3Å; T800-K804 WeakPolarHBondContact O-CG 3.49Å; T800-K804 PolarHBondContact O-N 3.25Å; T800-K804 VanDerWaalsContact O-N 3.1Å; T800-A951 WeakPolarHBondContact OG1-CA 3.48Å; T800-A951 WeakPolarHBondContact OG1-CB 3.48Å; T800-L954 HydrophobicContact CG2-CD1 3.95Å
801	K	97.8	Very high	96.4	Very high	92 Å²	92	50.7 Å²	50.7	40%	0.4	24%	0.236	S	C	.	.	H	α-helix	trans	-66.8	-55	177.8	-76.4	174.7	166.1	171.3	0	111.9	E797 A798 S803 K804 E805 S882	E797-K801 HydrophobicContact CG-CD 4.15Å; E797-K801 WeakPolarHBondContact O-CB 3.42Å; E797-K801 WeakPolarHBondContact O-CG 3.45Å; E797-K801 PolarHBondContact O-N 3.11Å; E797-K801 WeakPolarHBondContact OE1-CE 3.37Å; E797-K801 IonicContact OE1-NZ 3.41Å; E797-K801 PolarHBondContact OE1-NZ 3.15Å; A798-K801 PolarHBondContact O-N 3.27Å; K801-S803 VanDerWaalsContact C-N 3.27Å; K801-S803 PolarHBondContact O-N 3.44Å; K801-K804 CarbonylContact O-C 3.22Å; K801-K804 WeakPolarHBondContact O-CA 3.41Å; K801-K804 WeakPolarHBondContact O-CB 3.36Å; K801-K804 PolarHBondContact O-N 3.08Å; K801-E805 WeakPolarHBondContact O-CB 3.46Å; K801-E805 VanDerWaalsContact O-CG 3.3Å; K801-E805 WeakPolarHBondContact O-CG 3.43Å; K801-E805 PolarHBondContact O-N 2.85Å; K801-S882 VanDerWaalsContact CB-OG 3.27Å; K801-S882 WeakPolarHBondContact CB-OG 3.45Å
802	A	97.9	Very high	96.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-37.2	-179	0	0	0	0	0	112.4	A798 I806 V883 A886 F975	A798-A802 VanDerWaalsContact O-CB 3.29Å; A798-A802 WeakPolarHBondContact O-CB 3.25Å; A798-A802 PolarHBondContact O-N 3.02Å; A802-I806 WeakPolarHBondContact O-CB 3.32Å; A802-I806 PolarHBondContact O-N 3.36Å; A802-V883 HydrophobicContact CB-CG2 4.2Å; A802-A886 HydrophobicContact CB-CB 3.35Å; A802-F975 HydrophobicContact CB-CD1 3.89Å; A802-F975 HydrophobicContact CB-CE1 3.56Å; A802-F975 HydrophobicContact CB-CG 4.5Å; A802-F975 HydrophobicContact CB-CZ 3.91Å
803	S	97.9	Very high	96.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-44.5	172.6	-58.2	0	0	0	0	112	L799 K801 L807 F955	L799-S803 WeakPolarHBondContact O-CB 3.38Å; L799-S803 PolarHBondContact O-N 3.28Å; L799-S803 PolarHBondContact O-OG 2.95Å; K801-S803 VanDerWaalsContact C-N 3.27Å; K801-S803 PolarHBondContact O-N 3.44Å; S803-L807 VanDerWaalsContact O-CB 3.25Å; S803-L807 WeakPolarHBondContact O-CB 3.37Å; S803-L807 WeakPolarHBondContact O-CD1 3.25Å; S803-L807 VanDerWaalsContact O-CG 3.24Å; S803-L807 WeakPolarHBondContact O-CG 3.05Å; S803-L807 PolarHBondContact O-N 3.47Å; S803-L807 VanDerWaalsContact O-N 3.1Å; S803-F955 WeakPolarHBondContact OG-CA 3.31Å; S803-F955 PolarHBondContact OG-N 2.82Å
804	K	97.3	Very high	96.5	Very high	74 Å²	74	51.7 Å²	51.7	32%	0.322	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-42.9	176.9	-77.9	165.6	173	156	0	111.5	T800 K801 H808 E950 L954	T800-K804 HydrophobicContact CG2-CD 3.93Å; T800-K804 WeakPolarHBondContact O-CB 3.43Å; T800-K804 WeakPolarHBondContact O-CD 3.49Å; T800-K804 VanDerWaalsContact O-CG 3.3Å; T800-K804 WeakPolarHBondContact O-CG 3.49Å; T800-K804 PolarHBondContact O-N 3.25Å; T800-K804 VanDerWaalsContact O-N 3.1Å; K801-K804 CarbonylContact O-C 3.22Å; K801-K804 WeakPolarHBondContact O-CA 3.41Å; K801-K804 WeakPolarHBondContact O-CB 3.36Å; K801-K804 PolarHBondContact O-N 3.08Å; K804-H808 WeakPolarHBondContact O-CB 3.41Å; K804-H808 PolarHBondContact O-N 3.04Å; K804-H808 PolarHBondContact O-ND1 3.34Å; K804-E950 WeakPolarHBondContact CE-OE1 3.32Å; K804-E950 VanDerWaalsContact NZ-CD 3.34Å; K804-E950 IonicContact NZ-OE1 3.39Å; K804-E950 PolarHBondContact NZ-OE1 2.91Å; K804-E950 IonicContact NZ-OE2 2.65Å; K804-E950 PolarHBondContact NZ-OE2 2.87Å; K804-L954 HydrophobicContact CD-CD1 4.17Å; K804-L954 VanDerWaalsContact CE-CD1 3.45Å; K804-L954 HydrophobicContact CG-CD1 4.15Å; K804-L954 HydrophobicContact CG-CD2 4.27Å
805	E	97.3	Very high	96.5	Very high	42 Å²	42	48.2 Å²	48.2	20%	0.196	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-57.4	176.5	-75.4	168.5	-161.8	0	0	111.5	K801 L807 H808 S809 D879 L880 Q881 S882	K801-E805 WeakPolarHBondContact O-CB 3.46Å; K801-E805 VanDerWaalsContact O-CG 3.3Å; K801-E805 WeakPolarHBondContact O-CG 3.43Å; K801-E805 PolarHBondContact O-N 2.85Å; E805-L807 VanDerWaalsContact C-N 3.32Å; E805-L807 PolarHBondContact O-N 2.79Å; E805-H808 PolarHBondContact O-N 3.22Å; E805-H808 VanDerWaalsContact O-N 3.14Å; E805-S809 WeakPolarHBondContact O-CB 3.24Å; E805-S809 PolarHBondContact O-N 2.94Å; E805-D879 VanDerWaalsContact CB-O 3.31Å; E805-D879 WeakPolarHBondContact CB-O 3.38Å; E805-D879 WeakPolarHBondContact CG-O 3.26Å; E805-L880 HydrophobicContact CB-CD2 4.11Å; E805-L880 WeakPolarHBondContact OE2-CA 3.46Å; E805-Q881 PolarHBondContact OE2-N 3.39Å; E805-S882 WeakPolarHBondContact OE1-CB 3.34Å; E805-S882 PolarHBondContact OE1-N 2.89Å; E805-S882 PolarHBondContact OE1-OG 2.85Å; E805-S882 WeakPolarHBondContact OE2-CB 3.45Å; E805-S882 PolarHBondContact OE2-N 3.17Å
806	I	96	Very high	96.4	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-34.4	-179	-75.7	-172	0	0	0	112.4	A802 L812 L880 V883 F962 F975 F978	A802-I806 WeakPolarHBondContact O-CB 3.32Å; A802-I806 PolarHBondContact O-N 3.36Å; I806-L812 HydrophobicContact CG1-CD2 4.36Å; I806-L812 HydrophobicContact CG2-CD2 4.3Å; I806-L880 HydrophobicContact CB-CD2 4.48Å; I806-L880 HydrophobicContact CG1-CD2 3.62Å; I806-V883 HydrophobicContact CD1-CG2 3.82Å; I806-V883 HydrophobicContact CG1-CG2 3.97Å; I806-F962 HydrophobicContact CG2-CD2 3.94Å; I806-F962 HydrophobicContact CG2-CE2 3.23Å; I806-F962 HydrophobicContact CG2-CZ 3.62Å; I806-F975 HydrophobicContact CD1-CD1 3.74Å; I806-F975 HydrophobicContact CD1-CE1 3.87Å; I806-F978 HydrophobicContact CD1-CB 4.15Å; I806-F978 HydrophobicContact CD1-CD1 4.12Å; I806-F978 HydrophobicContact CD1-CD2 3.52Å; I806-F978 HydrophobicContact CD1-CE1 4.36Å; I806-F978 HydrophobicContact CD1-CE2 3.81Å; I806-F978 HydrophobicContact CD1-CG 3.68Å; I806-F978 HydrophobicContact CD1-CZ 4.21Å; I806-F978 HydrophobicContact CG2-CE2 4.46Å; I806-F978 HydrophobicContact CG2-CZ 4.23Å
807	L	95.2	Very high	96.3	Very high	25 Å²	25	52.6 Å²	52.6	13%	0.131	24%	0.238	C	C	.	.	H	α-helix	trans	-71.7	-23.9	175.9	-80.2	170.8	0	0	0	114.5	S803 E805 R957 A958 H961	S803-L807 VanDerWaalsContact O-CB 3.25Å; S803-L807 WeakPolarHBondContact O-CB 3.37Å; S803-L807 WeakPolarHBondContact O-CD1 3.25Å; S803-L807 VanDerWaalsContact O-CG 3.24Å; S803-L807 WeakPolarHBondContact O-CG 3.05Å; S803-L807 PolarHBondContact O-N 3.47Å; S803-L807 VanDerWaalsContact O-N 3.1Å; E805-L807 VanDerWaalsContact C-N 3.32Å; E805-L807 PolarHBondContact O-N 2.79Å; L807-R957 HydrophobicContact CD1-CB 4.4Å; L807-R957 HydrophobicContact CD1-CG 4.01Å; L807-R957 HydrophobicContact CD2-CG 4.31Å; L807-A958 HydrophobicContact CD1-CB 4.27Å; L807-A958 HydrophobicContact CD2-CB 4.4Å; L807-A958 HydrophobicContact CG-CB 4.03Å; L807-H961 HydrophobicContact CD2-CB 3.65Å
808	H	94.9	Very high	96.2	Very high	129 Å²	129	48.1 Å²	48.1	60%	0.597	22%	0.218	S	C	*	.	H	α-helix	trans	-116.3	-12.6	-172.3	-62.1	93.1	0	0	0	114.6	K804 E805 R810	K804-H808 WeakPolarHBondContact O-CB 3.41Å; K804-H808 PolarHBondContact O-N 3.04Å; K804-H808 PolarHBondContact O-ND1 3.34Å; E805-H808 PolarHBondContact O-N 3.22Å; E805-H808 VanDerWaalsContact O-N 3.14Å; H808-R810 PolarHBondContact O-N 2.93Å
809	S	96.2	Very high	96	Very high	11 Å²	11	48.3 Å²	48.3	8%	0.077	22%	0.218	C	C	.	.			trans	-61	105	176.7	176	0	0	0	0	111.7	E805 N811 L812 K813 D879	E805-S809 WeakPolarHBondContact O-CB 3.24Å; E805-S809 PolarHBondContact O-N 2.94Å; S809-N811 PolarHBondContact O-N 2.85Å; S809-L812 VanDerWaalsContact OG-CB 3.29Å; S809-L812 WeakPolarHBondContact OG-CB 3.41Å; S809-L812 PolarHBondContact OG-N 3.26Å; S809-K813 PolarHBondContact O-N 3.49Å; S809-D879 WeakPolarHBondContact CB-OD2 3.35Å; S809-D879 WeakPolarHBondContact OG-CB 3.47Å; S809-D879 PolarHBondContact OG-OD2 3.48Å
810	R	94.9	Very high	95.7	Very high	217 Å²	217	50.2 Å²	50.2	82%	0.819	23%	0.228	S	C	*	.	H	α-helix	trans	-69	-28.4	173.7	-59.7	-177	-175	-175.7	1.9	111.2	H808 Q814	H808-R810 PolarHBondContact O-N 2.93Å; R810-Q814 WeakPolarHBondContact O-CB 3.41Å; R810-Q814 PolarHBondContact O-N 3.25Å
811	N	95.3	Very high	95.4	Very high	35 Å²	35	52.2 Å²	52.2	19%	0.187	25%	0.246	C	C	.	.	H	α-helix	trans	-71.1	-46.5	177.9	-61.1	-55	0	0	0	110.7	S809 K813 Q814 L815 K872 V873 F876 D879	S809-N811 PolarHBondContact O-N 2.85Å; N811-K813 VanDerWaalsContact C-N 3.31Å; N811-K813 PolarHBondContact O-N 2.88Å; N811-Q814 PolarHBondContact O-N 3.35Å; N811-L815 WeakPolarHBondContact O-CB 3.33Å; N811-L815 PolarHBondContact O-N 3.41Å; N811-K872 PolarHBondContact OD1-O 3.1Å; N811-V873 WeakPolarHBondContact O-CG1 3.48Å; N811-F876 HydrophobicContact CB-CB 3.52Å; N811-D879 WeakPolarHBondContact CB-OD2 3.4Å; N811-D879 PolarHBondContact ND2-OD1 3.01Å; N811-D879 PolarHBondContact ND2-OD2 3.39Å
812	L	95.7	Very high	95.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-56.8	-44	172.7	178	62.1	0	0	0	111.6	I806 S809 Q814 L815 L816 F876 L880 F962 F978	I806-L812 HydrophobicContact CG1-CD2 4.36Å; I806-L812 HydrophobicContact CG2-CD2 4.3Å; S809-L812 VanDerWaalsContact OG-CB 3.29Å; S809-L812 WeakPolarHBondContact OG-CB 3.41Å; S809-L812 PolarHBondContact OG-N 3.26Å; L812-Q814 PolarHBondContact O-N 3.32Å; L812-L815 WeakPolarHBondContact O-CB 3.44Å; L812-L815 PolarHBondContact O-N 2.85Å; L812-L816 HydrophobicContact CD1-CD1 4.46Å; L812-L816 HydrophobicContact CG-CD1 4.33Å; L812-L816 WeakPolarHBondContact O-CG 3.36Å; L812-L816 PolarHBondContact O-N 3.47Å; L812-F876 HydrophobicContact CD1-CD2 4.25Å; L812-L880 HydrophobicContact CD1-CD1 4.41Å; L812-L880 HydrophobicContact CD2-CD1 4.19Å; L812-L880 HydrophobicContact CD2-CD2 4.38Å; L812-F962 HydrophobicContact CD2-CE1 4.24Å; L812-F962 HydrophobicContact CD2-CZ 4.01Å; L812-F978 HydrophobicContact CD1-CD1 4.44Å; L812-F978 HydrophobicContact CD1-CE1 4.25Å; L812-F978 HydrophobicContact CD2-CD1 4.39Å; L812-F978 HydrophobicContact CD2-CE1 3.94Å
813	K	95.1	Very high	94.5	Very high	149 Å²	149	51 Å²	51	65%	0.648	25%	0.249	S	C	*	.	H	α-helix	trans	-60.4	-45.7	175.8	-175.2	176.4	178.2	178.9	0	112.5	S809 N811 L815 L816 E817	S809-K813 PolarHBondContact O-N 3.49Å; N811-K813 VanDerWaalsContact C-N 3.31Å; N811-K813 PolarHBondContact O-N 2.88Å; K813-L815 VanDerWaalsContact C-N 3.33Å; K813-L815 PolarHBondContact O-N 2.99Å; K813-L816 PolarHBondContact O-N 3.25Å; K813-E817 PolarHBondContact O-N 3.21Å; K813-E817 VanDerWaalsContact O-N 3.16Å
814	Q	95.5	Very high	94	Very high	59 Å²	59	53.2 Å²	53.2	28%	0.276	26%	0.26	S	S	.	.	H	α-helix	trans	-68.2	-32.5	179.1	-174	65	84.9	0	0	112.2	R810 N811 L812 E817 V818 Y870 V873	R810-Q814 WeakPolarHBondContact O-CB 3.41Å; R810-Q814 PolarHBondContact O-N 3.25Å; N811-Q814 PolarHBondContact O-N 3.35Å; L812-Q814 PolarHBondContact O-N 3.32Å; Q814-E817 PolarHBondContact NE2-OE1 2.92Å; Q814-E817 PolarHBondContact O-N 3.14Å; Q814-V818 WeakPolarHBondContact O-CG2 3.26Å; Q814-V818 PolarHBondContact O-N 3.41Å; Q814-Y870 HydrophobicContact CG-CD1 4.16Å; Q814-Y870 HydrophobicContact CG-CE1 4.5Å; Q814-V873 HydrophobicContact CB-CG2 3.72Å; Q814-V873 HydrophobicContact CG-CG2 3.46Å; Q814-V873 VanDerWaalsContact CG-CG2 3.46Å
815	L	96.2	Very high	93.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-48	172.5	178.3	59.5	0	0	0	111.3	N811 L812 K813 E817 V818 V819 L862 L866 V873 F876 F981	N811-L815 WeakPolarHBondContact O-CB 3.33Å; N811-L815 PolarHBondContact O-N 3.41Å; L812-L815 WeakPolarHBondContact O-CB 3.44Å; L812-L815 PolarHBondContact O-N 2.85Å; K813-L815 VanDerWaalsContact C-N 3.33Å; K813-L815 PolarHBondContact O-N 2.99Å; L815-E817 VanDerWaalsContact C-N 3.28Å; L815-E817 PolarHBondContact O-N 3.36Å; L815-V818 PolarHBondContact O-N 3.32Å; L815-V819 WeakPolarHBondContact O-CG2 3.41Å; L815-V819 PolarHBondContact O-N 3.32Å; L815-L862 HydrophobicContact CD1-CD1 4.43Å; L815-L862 HydrophobicContact CD1-CD2 4.04Å; L815-L862 HydrophobicContact CD1-CG 4.39Å; L815-L866 HydrophobicContact CD1-CD1 3.52Å; L815-L866 HydrophobicContact CD1-CD2 4.18Å; L815-L866 HydrophobicContact CD1-CG 4.44Å; L815-V873 HydrophobicContact CB-CG1 3.78Å; L815-V873 HydrophobicContact CD1-CG1 4.47Å; L815-F876 HydrophobicContact CD2-CD1 3.94Å; L815-F876 HydrophobicContact CD2-CD2 3.85Å; L815-F876 HydrophobicContact CD2-CE1 3.85Å; L815-F876 HydrophobicContact CD2-CE2 3.74Å; L815-F876 HydrophobicContact CD2-CG 3.95Å; L815-F876 HydrophobicContact CD2-CZ 3.74Å; L815-F981 HydrophobicContact CD2-CE1 3.71Å; L815-F981 HydrophobicContact CD2-CZ 4.03Å
816	L	95.5	Very high	93.1	Very high	27 Å²	27	60.2 Å²	60.2	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-34.8	177.6	-68.5	168.7	0	0	0	112.5	L812 K813 V819 L820 F837 L842 F962	L812-L816 HydrophobicContact CD1-CD1 4.46Å; L812-L816 HydrophobicContact CG-CD1 4.33Å; L812-L816 WeakPolarHBondContact O-CG 3.36Å; L812-L816 PolarHBondContact O-N 3.47Å; K813-L816 PolarHBondContact O-N 3.25Å; L816-V819 PolarHBondContact O-N 3.16Å; L816-L820 WeakPolarHBondContact O-CB 3.29Å; L816-L820 PolarHBondContact O-N 3.26Å; L816-F837 HydrophobicContact CB-CZ 4.39Å; L816-F837 HydrophobicContact CD2-CE2 3.63Å; L816-F837 HydrophobicContact CD2-CZ 3.5Å; L816-F837 VanDerWaalsContact CD2-CZ 3.5Å; L816-L842 HydrophobicContact CD2-CD1 4.21Å; L816-L842 HydrophobicContact CD2-CD2 3.73Å; L816-L842 HydrophobicContact CD2-CG 4.24Å; L816-F962 HydrophobicContact CD1-CD1 4.19Å; L816-F962 HydrophobicContact CD1-CE1 3.65Å
817	E	94.2	Very high	92.5	Very high	111 Å²	111	63.5 Å²	63.5	52%	0.519	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-42.4	173.8	-169.7	-179.7	97.4	0	0	112.3	K813 Q814 L815 L820 A821	K813-E817 PolarHBondContact O-N 3.21Å; K813-E817 VanDerWaalsContact O-N 3.16Å; Q814-E817 PolarHBondContact NE2-OE1 2.92Å; Q814-E817 PolarHBondContact O-N 3.14Å; L815-E817 VanDerWaalsContact C-N 3.28Å; L815-E817 PolarHBondContact O-N 3.36Å; E817-L820 PolarHBondContact O-N 3.43Å; E817-A821 PolarHBondContact O-N 2.89Å
818	V	94.4	Very high	91.8	Very high	7 Å²	7	69.8 Å²	69.8	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-41	175.4	178.6	0	0	0	0	111.1	Q814 L815 L820 A821 F822 L862 Y870	Q814-V818 WeakPolarHBondContact O-CG2 3.26Å; Q814-V818 PolarHBondContact O-N 3.41Å; L815-V818 PolarHBondContact O-N 3.32Å; V818-L820 VanDerWaalsContact C-N 3.35Å; V818-L820 PolarHBondContact O-N 2.84Å; V818-A821 PolarHBondContact O-N 3.05Å; V818-F822 HydrophobicContact CG1-CD1 4.39Å; V818-F822 HydrophobicContact CG1-CE1 4.02Å; V818-F822 HydrophobicContact CG1-CZ 4.16Å; V818-F822 PolarHBondContact O-N 3.36Å; V818-L862 HydrophobicContact CB-CD1 4.31Å; V818-L862 HydrophobicContact CG1-CD1 3.54Å; V818-Y870 HydrophobicContact CG2-CD2 4.11Å; V818-Y870 HydrophobicContact CG2-CE1 4.29Å; V818-Y870 HydrophobicContact CG2-CE2 3.77Å
819	V	94.3	Very high	90.8	Very high	17 Å²	17	66.3 Å²	66.3	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-40.6	174.4	174.1	0	0	0	0	111.3	L815 L816 F822 G823 F837 I845 L862	L815-V819 WeakPolarHBondContact O-CG2 3.41Å; L815-V819 PolarHBondContact O-N 3.32Å; L816-V819 PolarHBondContact O-N 3.16Å; V819-F822 PolarHBondContact O-N 2.64Å; V819-G823 PolarHBondContact O-N 2.8Å; V819-F837 HydrophobicContact CB-CE1 4.14Å; V819-F837 HydrophobicContact CB-CZ 3.82Å; V819-F837 HydrophobicContact CG1-CE1 3.72Å; V819-F837 HydrophobicContact CG1-CE2 4.15Å; V819-F837 HydrophobicContact CG1-CZ 3.4Å; V819-I845 HydrophobicContact CB-CD1 4.45Å; V819-I845 HydrophobicContact CG1-CD1 3.74Å; V819-I845 HydrophobicContact CG1-CG1 4.39Å; V819-I845 HydrophobicContact CG2-CD1 3.74Å; V819-L862 HydrophobicContact CG2-CD1 4.44Å; V819-L862 HydrophobicContact CG2-CD2 3.63Å
820	L	90.9	Very high	89.8	Confident	40 Å²	40	75.3 Å²	75.3	21%	0.209	37%	0.372	C	S	.	.	H	α-helix	trans	-63.3	-42.6	176.5	-173.2	65.7	0	0	0	111.4	L816 E817 V818 G823 N824 A834 F837	L816-L820 WeakPolarHBondContact O-CB 3.29Å; L816-L820 PolarHBondContact O-N 3.26Å; E817-L820 PolarHBondContact O-N 3.43Å; V818-L820 VanDerWaalsContact C-N 3.35Å; V818-L820 PolarHBondContact O-N 2.84Å; L820-G823 PolarHBondContact O-N 2.76Å; L820-N824 WeakPolarHBondContact O-CB 3.4Å; L820-N824 PolarHBondContact O-N 3.46Å; L820-N824 PolarHBondContact O-ND2 3.46Å; L820-A834 HydrophobicContact CD1-CB 4.18Å; L820-A834 WeakPolarHBondContact CD1-O 3.23Å; L820-F837 HydrophobicContact CB-CD1 4.49Å; L820-F837 HydrophobicContact CB-CE1 4.01Å; L820-F837 HydrophobicContact CD1-CD1 3.86Å; L820-F837 HydrophobicContact CD1-CE1 4.24Å
821	A	91.8	Very high	88.8	Confident	58 Å²	58	74.9 Å²	74.9	48%	0.479	37%	0.371	S	S	.	.	H	α-helix	trans	-62.3	-43.4	175.8	0	0	0	0	0	112.1	E817 V818 Y825	E817-A821 PolarHBondContact O-N 2.89Å; V818-A821 PolarHBondContact O-N 3.05Å; A821-Y825 WeakPolarHBondContact O-CB 3.04Å; A821-Y825 PolarHBondContact O-N 3.26Å
822	F	90.5	Very high	88.1	Confident	41 Å²	41	73.9 Å²	73.9	18%	0.18	37%	0.369	C	S	.	.	H	α-helix	trans	-62.5	-49.3	174.1	-76.2	12.4	0	0	0	111.2	V818 V819 N824 Y825 M826 L858 Y861 L862 I865	V818-F822 HydrophobicContact CG1-CD1 4.39Å; V818-F822 HydrophobicContact CG1-CE1 4.02Å; V818-F822 HydrophobicContact CG1-CZ 4.16Å; V818-F822 PolarHBondContact O-N 3.36Å; V819-F822 PolarHBondContact O-N 2.64Å; F822-N824 VanDerWaalsContact C-N 3.35Å; F822-N824 PolarHBondContact O-N 3.45Å; F822-Y825 PolarHBondContact O-N 3.13Å; F822-M826 WeakPolarHBondContact O-CB 3.36Å; F822-M826 VanDerWaalsContact O-CG 3.27Å; F822-M826 WeakPolarHBondContact O-CG 3.48Å; F822-M826 PolarHBondContact O-N 2.82Å; F822-L858 HydrophobicContact CD2-CD1 3.81Å; F822-L858 HydrophobicContact CD2-CG 4.4Å; F822-L858 HydrophobicContact CE2-CD1 4.26Å; F822-Y861 AromaticContact CE2-CD1 3.86Å; F822-Y861 HydrophobicContact CE2-CD1 3.86Å; F822-Y861 HydrophobicContact CE2-CE1 4.21Å; F822-Y861 HydrophobicContact CZ-CD1 4.06Å; F822-Y861 AromaticContact CZ-CE1 3.96Å; F822-Y861 HydrophobicContact CZ-CE1 3.96Å; F822-L862 HydrophobicContact CD2-CD1 4.25Å; F822-L862 HydrophobicContact CE2-CB 3.99Å; F822-L862 HydrophobicContact CE2-CD1 3.79Å; F822-L862 HydrophobicContact CZ-CD1 4.27Å; F822-I865 HydrophobicContact CZ-CB 4.31Å; F822-I865 HydrophobicContact CZ-CG1 4.23Å; F822-I865 HydrophobicContact CZ-CG2 4.27Å
823	G	85.4	Confident	87.5	Confident	27 Å²	27	80.3 Å²	80.3	28%	0.278	40%	0.403	S	S	.	.	H	α-helix	trans	-56.3	-45.9	179.2	0	0	0	0	0	112.7	V819 L820 N827	V819-G823 PolarHBondContact O-N 2.8Å; L820-G823 PolarHBondContact O-N 2.76Å; G823-N827 VanDerWaalsContact O-CB 3.32Å; G823-N827 WeakPolarHBondContact O-CB 3.46Å; G823-N827 PolarHBondContact O-N 3.18Å; G823-N827 PolarHBondContact O-ND2 3.42Å
824	N	86.8	Confident	87.2	Confident	46 Å²	46	75.1 Å²	75.1	25%	0.246	39%	0.388	C	S	.	.	H	α-helix	trans	-70.3	-35.8	178.2	-79.4	-30.5	0	0	0	113.6	L820 F822 N833 A834	L820-N824 WeakPolarHBondContact O-CB 3.4Å; L820-N824 PolarHBondContact O-N 3.46Å; L820-N824 PolarHBondContact O-ND2 3.46Å; F822-N824 VanDerWaalsContact C-N 3.35Å; F822-N824 PolarHBondContact O-N 3.45Å; N824-N833 PolarHBondContact OD1-N 2.95Å; N824-A834 PolarHBondContact ND2-O 3Å; N824-A834 PolarHBondContact OD1-N 2.96Å
825	Y	87.9	Confident	86.9	Confident	171 Å²	171	83.1 Å²	83.1	67%	0.671	42%	0.417	S	S	*	.	H	α-helix	trans	-71.6	-37	177.9	-174.5	-92.8	0	0	0	112.6	A821 F822 K828	A821-Y825 WeakPolarHBondContact O-CB 3.04Å; A821-Y825 PolarHBondContact O-N 3.26Å; F822-Y825 PolarHBondContact O-N 3.13Å; Y825-K828 WeakPolarHBondContact O-CE 3.19Å; Y825-K828 WeakPolarHBondContact O-CG 3.42Å
826	M	88.3	Confident	86.6	Confident	92 Å²	92	85.4 Å²	85.4	45%	0.453	44%	0.441	S	S	.	.	H	α-helix	trans	-80.4	-47.1	-177.5	-66.4	175	67.4	0	0	112.2	F822 K828 T848 L858	F822-M826 WeakPolarHBondContact O-CB 3.36Å; F822-M826 VanDerWaalsContact O-CG 3.27Å; F822-M826 WeakPolarHBondContact O-CG 3.48Å; F822-M826 PolarHBondContact O-N 2.82Å; M826-K828 VanDerWaalsContact C-N 3.29Å; M826-K828 PolarHBondContact O-N 3.09Å; M826-T848 HydrophobicContact CE-CG2 3.81Å; M826-L858 HydrophobicContact CE-CD1 4.25Å; M826-L858 HydrophobicContact CE-CD2 4.03Å; M826-L858 HydrophobicContact SD-CD1 3.78Å; M826-L858 HydrophobicContact SD-CD2 3.77Å; M826-L858 HydrophobicContact SD-CG 4.45Å
827	N	84.3	Confident	86.5	Confident	72 Å²	72	87.1 Å²	87.1	39%	0.385	45%	0.447	S	S	.	.	S	Bend	trans	-85.2	61.1	-176.4	-62.4	-74.2	0	0	0	112.2	G823 R831 G832	G823-N827 VanDerWaalsContact O-CB 3.32Å; G823-N827 WeakPolarHBondContact O-CB 3.46Å; G823-N827 PolarHBondContact O-N 3.18Å; G823-N827 PolarHBondContact O-ND2 3.42Å; N827-R831 HydrophobicContact CB-CB 4.02Å; N827-R831 VanDerWaalsContact CB-O 3.26Å; N827-R831 WeakPolarHBondContact CB-O 3.46Å; N827-R831 CarbonylContact O-C 3.6Å; N827-G832 WeakPolarHBondContact O-CA 3.26Å; N827-G832 PolarHBondContact O-N 2.85Å
828	K	79.2	Confident	86.5	Confident	157 Å²	157	87.5 Å²	87.5	68%	0.683	45%	0.447	S	S	*	.			trans	-59.4	148.5	-175.9	-63.3	-177.7	-179.4	176.6	0	113.1	Y825 M826	Y825-K828 WeakPolarHBondContact O-CE 3.19Å; Y825-K828 WeakPolarHBondContact O-CG 3.42Å; M826-K828 VanDerWaalsContact C-N 3.29Å; M826-K828 PolarHBondContact O-N 3.09Å
829	G	74.1	Confident	86.5	Confident	55 Å²	55	87.3 Å²	87.3	57%	0.567	45%	0.446	S	S	*	.	S	Bend	trans	85.1	-148.3	-177.8	0	0	0	0	0	112.7	R831 G832	G829-R831 PolarHBondContact O-N 3.27Å; G829-G832 PolarHBondContact O-N 3.09Å
830	Q	76.6	Confident	86.5	Confident	200 Å²	200	88.5 Å²	88.5	94%	0.935	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-4.8	-175.4	-65.3	-67.8	-7.7	0	0	115
831	R	72.9	Confident	86.7	Confident	209 Å²	209	88.6 Å²	88.6	79%	0.789	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	1	174.9	-65.3	-177.7	64.8	161.5	-0.6	113.3	N827 G829	N827-R831 HydrophobicContact CB-CB 4.02Å; N827-R831 VanDerWaalsContact CB-O 3.26Å; N827-R831 WeakPolarHBondContact CB-O 3.46Å; N827-R831 CarbonylContact O-C 3.6Å; G829-R831 PolarHBondContact O-N 3.27Å
832	G	79.7	Confident	86.8	Confident	14 Å²	14	85.9 Å²	85.9	14%	0.144	44%	0.437	C	S	.	.			trans	-115.9	-154.5	176.4	0	0	0	0	0	110.8	N827 G829 A834	N827-G832 WeakPolarHBondContact O-CA 3.26Å; N827-G832 PolarHBondContact O-N 2.85Å; G829-G832 PolarHBondContact O-N 3.09Å; G832-A834 PolarHBondContact O-N 3.25Å; G832-A834 VanDerWaalsContact O-N 3.15Å
833	N	83.9	Confident	87.1	Confident	134 Å²	134	85.9 Å²	85.9	72%	0.717	44%	0.438	S	S	*	.			trans	53.4	27.9	-173.9	-59.5	-19.7	0	0	0	113.6	N824	N824-N833 PolarHBondContact OD1-N 2.95Å
834	A	88.6	Confident	87.6	Confident	40 Å²	40	90.6 Å²	90.6	33%	0.331	45%	0.451	S	S	.	.			trans	-72.7	139.3	175.2	0	0	0	0	0	110.6	L820 N824 G832	L820-A834 HydrophobicContact CD1-CB 4.18Å; L820-A834 WeakPolarHBondContact CD1-O 3.23Å; N824-A834 PolarHBondContact ND2-O 3Å; N824-A834 PolarHBondContact OD1-N 2.96Å; G832-A834 PolarHBondContact O-N 3.25Å; G832-A834 VanDerWaalsContact O-N 3.15Å
835	Y	90.1	Very high	87.9	Confident	228 Å²	228	89 Å²	89	89%	0.894	44%	0.443	S	S	*	.	S	Bend	trans	-93.1	-5.8	172.8	-62.6	-83.9	0	0	0	112.9
836	G	89.1	Confident	88.1	Confident	48 Å²	48	82.1 Å²	82.1	50%	0.495	42%	0.421	S	S	.	.			trans	178.2	173.8	-179.8	0	0	0	0	0	110.7
837	F	94.3	Very high	88.2	Confident	63 Å²	63	82.9 Å²	82.9	28%	0.276	43%	0.427	S	S	.	.			trans	-146.7	154.3	178.4	53.4	-96.6	0	0	0	110.8	L816 V819 L820 L842	L816-F837 HydrophobicContact CB-CZ 4.39Å; L816-F837 HydrophobicContact CD2-CE2 3.63Å; L816-F837 HydrophobicContact CD2-CZ 3.5Å; L816-F837 VanDerWaalsContact CD2-CZ 3.5Å; V819-F837 HydrophobicContact CB-CE1 4.14Å; V819-F837 HydrophobicContact CB-CZ 3.82Å; V819-F837 HydrophobicContact CG1-CE1 3.72Å; V819-F837 HydrophobicContact CG1-CE2 4.15Å; V819-F837 HydrophobicContact CG1-CZ 3.4Å; L820-F837 HydrophobicContact CB-CD1 4.49Å; L820-F837 HydrophobicContact CB-CE1 4.01Å; L820-F837 HydrophobicContact CD1-CD1 3.86Å; L820-F837 HydrophobicContact CD1-CE1 4.24Å; F837-L842 HydrophobicContact CE2-CD2 4.28Å; F837-L842 HydrophobicContact CE2-CG 4.44Å
838	K	94.3	Very high	88.5	Confident	118 Å²	118	82.3 Å²	82.3	51%	0.513	43%	0.426	S	S	.	.			trans	-60.4	135.9	172.7	-80.6	-179.8	160.1	-81.7	0	110.7	S840 S841 E964	K838-S840 PolarHBondContact O-N 3.41Å; K838-S840 VanDerWaalsContact O-N 3.15Å; K838-S841 WeakPolarHBondContact O-CB 3.28Å; K838-S841 PolarHBondContact O-N 3.18Å; K838-S841 PolarHBondContact O-OG 2.64Å; K838-E964 WeakPolarHBondContact CB-OE1 3.46Å; K838-E964 WeakPolarHBondContact CG-OE1 3.48Å; K838-E964 IonicContact NZ-OE1 2.64Å; K838-E964 IonicContact NZ-OE2 2.72Å; K838-E964 PolarHBondContact NZ-OE2 3.46Å
839	V	94.1	Very high	89.1	Confident	3 Å²	3	80.4 Å²	80.4	2%	0.018	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-60.8	-28.6	-174	-75.6	0	0	0	0	113.7	S841 L842 F962 E964 I977 F978	V839-S841 PolarHBondContact O-N 3.11Å; V839-L842 VanDerWaalsContact O-CB 3.28Å; V839-L842 WeakPolarHBondContact O-CB 3.18Å; V839-L842 WeakPolarHBondContact O-CG 3.41Å; V839-L842 PolarHBondContact O-N 3.21Å; V839-F962 HydrophobicContact CG1-CB 3.78Å; V839-F962 HydrophobicContact CG1-CD1 3.55Å; V839-F962 HydrophobicContact CG1-CG 4Å; V839-E964 HydrophobicContact CG2-CG 3.96Å; V839-E964 PolarHBondContact N-OE1 2.93Å; V839-I977 HydrophobicContact CB-CG2 4.07Å; V839-I977 HydrophobicContact CG2-CD1 4.35Å; V839-I977 HydrophobicContact CG2-CG2 4.05Å; V839-F978 HydrophobicContact CB-CE2 4.5Å; V839-F978 HydrophobicContact CB-CZ 4.11Å; V839-F978 HydrophobicContact CG1-CE1 4.24Å; V839-F978 HydrophobicContact CG1-CZ 3.75Å; V839-F978 HydrophobicContact CG2-CE2 4.39Å; V839-F978 HydrophobicContact CG2-CZ 4.41Å
840	S	93.5	Very high	89.8	Confident	42 Å²	42	79.6 Å²	79.6	29%	0.294	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-59.7	-10.1	171.2	52.7	0	0	0	0	114.7	K838 L842	K838-S840 PolarHBondContact O-N 3.41Å; K838-S840 VanDerWaalsContact O-N 3.15Å; S840-L842 VanDerWaalsContact C-N 3.33Å
841	S	94.9	Very high	90.3	Very high	43 Å²	43	76.1 Å²	76.1	30%	0.301	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-74.1	-20.7	171	-45	0	0	0	0	113.1	K838 V839 N843 K844	K838-S841 WeakPolarHBondContact O-CB 3.28Å; K838-S841 PolarHBondContact O-N 3.18Å; K838-S841 PolarHBondContact O-OG 2.64Å; V839-S841 PolarHBondContact O-N 3.11Å; S841-N843 VanDerWaalsContact C-N 3.32Å; S841-N843 PolarHBondContact O-N 3.31Å; S841-K844 WeakPolarHBondContact O-CB 3.49Å; S841-K844 PolarHBondContact O-N 3.16Å
842	L	95.4	Very high	90.8	Very high	1 Å²	1	73.8 Å²	73.8	1%	0.005	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-57.4	-45.4	177.7	-74.9	171.3	0	0	0	111.6	L816 F837 V839 S840 K844 I845 F978 F981	L816-L842 HydrophobicContact CD2-CD1 4.21Å; L816-L842 HydrophobicContact CD2-CD2 3.73Å; L816-L842 HydrophobicContact CD2-CG 4.24Å; F837-L842 HydrophobicContact CE2-CD2 4.28Å; F837-L842 HydrophobicContact CE2-CG 4.44Å; V839-L842 VanDerWaalsContact O-CB 3.28Å; V839-L842 WeakPolarHBondContact O-CB 3.18Å; V839-L842 WeakPolarHBondContact O-CG 3.41Å; V839-L842 PolarHBondContact O-N 3.21Å; S840-L842 VanDerWaalsContact C-N 3.33Å; L842-K844 PolarHBondContact O-N 3.1Å; L842-I845 HydrophobicContact CD2-CD1 3.98Å; L842-I845 WeakPolarHBondContact O-CB 3.41Å; L842-I845 WeakPolarHBondContact O-CD1 3.48Å; L842-I845 WeakPolarHBondContact O-CG1 3.31Å; L842-I845 PolarHBondContact O-N 2.76Å; L842-I845 VanDerWaalsContact O-N 3.15Å; L842-F978 HydrophobicContact CD1-CD1 4.33Å; L842-F978 HydrophobicContact CD1-CE1 4.3Å; L842-F981 HydrophobicContact CB-CB 4.2Å; L842-F981 HydrophobicContact CB-CD1 4.36Å; L842-F981 HydrophobicContact CB-CD2 3.66Å; L842-F981 HydrophobicContact CB-CE2 4.09Å; L842-F981 HydrophobicContact CB-CG 3.8Å; L842-F981 HydrophobicContact CD1-CD1 4.08Å; L842-F981 HydrophobicContact CD1-CE1 4.45Å; L842-F981 HydrophobicContact CD1-CG 4.27Å; L842-F981 HydrophobicContact CD2-CE1 4.19Å; L842-F981 HydrophobicContact CD2-CE2 4.19Å; L842-F981 HydrophobicContact CD2-CZ 4.01Å; L842-F981 HydrophobicContact CG-CG 4.47Å
843	N	96.1	Very high	90.9	Very high	40 Å²	40	76 Å²	76	21%	0.214	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-65.7	-18.4	178.6	-66	-39.9	0	0	0	113.2	S841 I977 F981	S841-N843 VanDerWaalsContact C-N 3.32Å; S841-N843 PolarHBondContact O-N 3.31Å; N843-I977 PolarHBondContact ND2-O 3.47Å; N843-F981 WeakPolarHBondContact OD1-CA 3.37Å; N843-F981 VanDerWaalsContact OD1-CB 3.28Å; N843-F981 WeakPolarHBondContact OD1-CB 3.07Å; N843-F981 PolarHBondContact OD1-N 3.4Å
844	K	94.7	Very high	90.9	Very high	127 Å²	127	78 Å²	78	55%	0.552	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-89.6	-4	178.7	-57.1	-178.6	-177.2	177.6	0	113.5	S841 L842 A846 D847	S841-K844 WeakPolarHBondContact O-CB 3.49Å; S841-K844 PolarHBondContact O-N 3.16Å; L842-K844 PolarHBondContact O-N 3.1Å; K844-A846 PolarHBondContact O-N 2.94Å; K844-D847 WeakPolarHBondContact CA-OD2 3.42Å; K844-D847 WeakPolarHBondContact CB-OD2 3.32Å; K844-D847 WeakPolarHBondContact O-CB 3.38Å; K844-D847 PolarHBondContact O-N 3.49Å
845	I	93.7	Very high	90.6	Very high	13 Å²	13	81.7 Å²	81.7	7%	0.067	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.2	173.9	-58.3	170.2	0	0	0	109.9	V819 L842 D847 L858 L859 L862 F981	V819-I845 HydrophobicContact CB-CD1 4.45Å; V819-I845 HydrophobicContact CG1-CD1 3.74Å; V819-I845 HydrophobicContact CG1-CG1 4.39Å; V819-I845 HydrophobicContact CG2-CD1 3.74Å; L842-I845 HydrophobicContact CD2-CD1 3.98Å; L842-I845 WeakPolarHBondContact O-CB 3.41Å; L842-I845 WeakPolarHBondContact O-CD1 3.48Å; L842-I845 WeakPolarHBondContact O-CG1 3.31Å; L842-I845 PolarHBondContact O-N 2.76Å; L842-I845 VanDerWaalsContact O-N 3.15Å; I845-D847 VanDerWaalsContact C-N 3.31Å; I845-D847 PolarHBondContact O-N 3.22Å; I845-L858 HydrophobicContact CG2-CB 4.07Å; I845-L858 HydrophobicContact CG2-CD2 4.21Å; I845-L858 HydrophobicContact CG2-CG 3.96Å; I845-L859 HydrophobicContact CB-CB 4.5Å; I845-L859 HydrophobicContact CG2-CB 3.93Å; I845-L859 HydrophobicContact CG2-CD1 4.37Å; I845-L862 HydrophobicContact CD1-CD2 4.38Å; I845-F981 HydrophobicContact CD1-CE2 4.21Å
846	A	91.6	Very high	90.6	Very high	25 Å²	25	73.1 Å²	73.1	21%	0.207	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-23.2	177.3	0	0	0	0	0	113.9	K844 T848 K849 T857 L859	K844-A846 PolarHBondContact O-N 2.94Å; A846-T848 VanDerWaalsContact C-N 3.33Å; A846-T848 PolarHBondContact O-N 2.83Å; A846-K849 WeakPolarHBondContact O-CE 3.5Å; A846-K849 PolarHBondContact O-NZ 3.43Å; A846-T857 WeakPolarHBondContact O-CB 3.24Å; A846-T857 VanDerWaalsContact O-CG2 3.3Å; A846-T857 WeakPolarHBondContact O-CG2 3.39Å; A846-L859 HydrophobicContact CB-CD2 4.34Å
847	D	92.1	Very high	90.9	Very high	108 Å²	108	71.2 Å²	71.2	58%	0.578	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-36.1	-179.9	-62.1	-27.9	0	0	0	112	K844 I845 K849	K844-D847 WeakPolarHBondContact CA-OD2 3.42Å; K844-D847 WeakPolarHBondContact CB-OD2 3.32Å; K844-D847 WeakPolarHBondContact O-CB 3.38Å; K844-D847 PolarHBondContact O-N 3.49Å; I845-D847 VanDerWaalsContact C-N 3.31Å; I845-D847 PolarHBondContact O-N 3.22Å; D847-K849 PolarHBondContact O-N 2.95Å
848	T	90.8	Very high	90.8	Very high	61 Å²	61	69.6 Å²	69.6	37%	0.374	37%	0.37	S	S	.	.			trans	-74.2	107.9	-178	-59.4	0	0	0	0	109.9	M826 A846 T857 L858	M826-T848 HydrophobicContact CE-CG2 3.81Å; A846-T848 VanDerWaalsContact C-N 3.33Å; A846-T848 PolarHBondContact O-N 2.83Å; T848-T857 CarbonylContact O-C 3.58Å; T848-T857 WeakPolarHBondContact O-CA 3.39Å; T848-L858 HydrophobicContact CG2-CB 4.07Å; T848-L858 HydrophobicContact CG2-CD2 4.24Å; T848-L858 PolarHBondContact O-N 3.11Å
849	K	91.1	Very high	90.9	Very high	117 Å²	117	64.1 Å²	64.1	51%	0.509	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-90.8	151	179.2	-47.7	-53.2	179	-176	0	111.7	A846 D847 T857	A846-K849 WeakPolarHBondContact O-CE 3.5Å; A846-K849 PolarHBondContact O-NZ 3.43Å; D847-K849 PolarHBondContact O-N 2.95Å; K849-T857 HydrophobicContact CD-CG2 3.8Å
850	S	89.5	Confident	91	Very high	37 Å²	37	64.3 Å²	64.3	26%	0.259	35%	0.347	S	S	.	.			trans	-72.1	146.6	174.1	173.4	0	0	0	0	111.4	I852 D853 I856	S850-I852 VanDerWaalsContact C-N 3.3Å; S850-I852 PolarHBondContact OG-N 2.86Å; S850-D853 WeakPolarHBondContact CB-O 3.11Å; S850-D853 CarbonylContact O-C 3.56Å; S850-I856 VanDerWaalsContact CB-O 3.27Å; S850-I856 WeakPolarHBondContact CB-O 3.21Å; S850-I856 PolarHBondContact N-O 3.33Å
851	S	86.8	Confident	91	Very high	127 Å²	127	68.3 Å²	68.3	89%	0.888	36%	0.356	S	S	*	.	S	Bend	trans	-78.3	-14	173.3	53	0	0	0	0	113.6
852	I	83.4	Confident	91	Very high	161 Å²	161	66.3 Å²	66.3	83%	0.826	34%	0.342	S	S	*	.	S	Bend	trans	-89.2	-40.2	-179.9	-55.6	175.8	0	0	0	110.6	S850	S850-I852 VanDerWaalsContact C-N 3.3Å; S850-I852 PolarHBondContact OG-N 2.86Å
853	D	81.5	Confident	91	Very high	59 Å²	59	66.3 Å²	66.3	32%	0.316	34%	0.342	S	S	.	.			trans	-145.7	120.7	175.1	179.5	-2.6	0	0	0	108.4	S850 N855 I856	S850-D853 WeakPolarHBondContact CB-O 3.11Å; S850-D853 CarbonylContact O-C 3.56Å; D853-N855 PolarHBondContact O-N 3.05Å; D853-N855 WeakPolarHBondContact OD1-CB 3.44Å; D853-N855 PolarHBondContact OD1-N 3.33Å; D853-N855 PolarHBondContact OD1-ND2 3.05Å; D853-I856 HydrophobicContact CB-CB 4.44Å; D853-I856 HydrophobicContact CB-CD1 4.04Å; D853-I856 HydrophobicContact CB-CG1 4.06Å; D853-I856 PolarHBondContact O-N 3.14Å; D853-I856 VanDerWaalsContact O-N 3.16Å
854	K	83.3	Confident	90.9	Very high	176 Å²	176	65.9 Å²	65.9	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.2	-177	-64.5	-178.3	-179.3	178.7	0	113.3
855	N	83.5	Confident	90.8	Very high	119 Å²	119	61.6 Å²	61.6	64%	0.636	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-34.9	175.7	-54.1	-64.3	0	0	0	111	D853 T857	D853-N855 PolarHBondContact O-N 3.05Å; D853-N855 WeakPolarHBondContact OD1-CB 3.44Å; D853-N855 PolarHBondContact OD1-N 3.33Å; D853-N855 PolarHBondContact OD1-ND2 3.05Å; N855-T857 PolarHBondContact O-N 3.34Å
856	I	89.8	Confident	90.8	Very high	47 Å²	47	61 Å²	61	24%	0.241	32%	0.321	C	S	.	.			trans	-75.8	120.8	179.4	-60	179.9	0	0	0	109.5	S850 D853 H860 I995	S850-I856 VanDerWaalsContact CB-O 3.27Å; S850-I856 WeakPolarHBondContact CB-O 3.21Å; S850-I856 PolarHBondContact N-O 3.33Å; D853-I856 HydrophobicContact CB-CB 4.44Å; D853-I856 HydrophobicContact CB-CD1 4.04Å; D853-I856 HydrophobicContact CB-CG1 4.06Å; D853-I856 PolarHBondContact O-N 3.14Å; D853-I856 VanDerWaalsContact O-N 3.16Å; I856-H860 HydrophobicContact CG2-CB 3.92Å; I856-I995 HydrophobicContact CG1-CD1 4.34Å
857	T	95.1	Very high	90.8	Very high	9 Å²	9	62.1 Å²	62.1	6%	0.055	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-95.9	168.8	177.3	73.5	0	0	0	0	112.1	A846 T848 K849 N855 L859 H860 Y861	A846-T857 WeakPolarHBondContact O-CB 3.24Å; A846-T857 VanDerWaalsContact O-CG2 3.3Å; A846-T857 WeakPolarHBondContact O-CG2 3.39Å; T848-T857 CarbonylContact O-C 3.58Å; T848-T857 WeakPolarHBondContact O-CA 3.39Å; K849-T857 HydrophobicContact CD-CG2 3.8Å; N855-T857 PolarHBondContact O-N 3.34Å; T857-L859 PolarHBondContact O-N 3.48Å; T857-L859 WeakPolarHBondContact OG1-CB 3.45Å; T857-L859 PolarHBondContact OG1-N 3.1Å; T857-H860 PolarHBondContact N-ND1 3.31Å; T857-H860 WeakPolarHBondContact O-CB 3.38Å; T857-H860 PolarHBondContact O-N 2.74Å; T857-H860 PolarHBondContact OG1-N 2.57Å; T857-H860 PolarHBondContact OG1-ND1 3.21Å; T857-Y861 PolarHBondContact O-N 3.46Å
858	L	92.6	Very high	90.8	Very high	28 Å²	28	63.7 Å²	63.7	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-61.5	-26.4	170.2	-176.7	62.9	0	0	0	111.7	F822 M826 I845 T848 Y861 L862	F822-L858 HydrophobicContact CD2-CD1 3.81Å; F822-L858 HydrophobicContact CD2-CG 4.4Å; F822-L858 HydrophobicContact CE2-CD1 4.26Å; M826-L858 HydrophobicContact CE-CD1 4.25Å; M826-L858 HydrophobicContact CE-CD2 4.03Å; M826-L858 HydrophobicContact SD-CD1 3.78Å; M826-L858 HydrophobicContact SD-CD2 3.77Å; M826-L858 HydrophobicContact SD-CG 4.45Å; I845-L858 HydrophobicContact CG2-CB 4.07Å; I845-L858 HydrophobicContact CG2-CD2 4.21Å; I845-L858 HydrophobicContact CG2-CG 3.96Å; T848-L858 HydrophobicContact CG2-CB 4.07Å; T848-L858 HydrophobicContact CG2-CD2 4.24Å; T848-L858 PolarHBondContact O-N 3.11Å; L858-Y861 HydrophobicContact CD1-CD1 4.43Å; L858-Y861 PolarHBondContact O-N 3.13Å; L858-L862 VanDerWaalsContact O-CB 3.24Å; L858-L862 WeakPolarHBondContact O-CB 3.41Å; L858-L862 PolarHBondContact O-N 3.42Å
859	L	95.9	Very high	91	Very high	3 Å²	3	68.2 Å²	68.2	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-69.8	-44.5	174.1	-175.2	56.6	0	0	0	111.3	I845 A846 T857 Y861 L862 I863 F981 S984 F985 A988	I845-L859 HydrophobicContact CB-CB 4.5Å; I845-L859 HydrophobicContact CG2-CB 3.93Å; I845-L859 HydrophobicContact CG2-CD1 4.37Å; A846-L859 HydrophobicContact CB-CD2 4.34Å; T857-L859 PolarHBondContact O-N 3.48Å; T857-L859 WeakPolarHBondContact OG1-CB 3.45Å; T857-L859 PolarHBondContact OG1-N 3.1Å; L859-Y861 VanDerWaalsContact C-N 3.32Å; L859-Y861 PolarHBondContact O-N 3.47Å; L859-L862 HydrophobicContact CD1-CD2 4.22Å; L859-L862 WeakPolarHBondContact O-CB 3.44Å; L859-L862 PolarHBondContact O-N 2.79Å; L859-I863 HydrophobicContact CD1-CD1 4.35Å; L859-I863 HydrophobicContact CG-CD1 4.14Å; L859-I863 WeakPolarHBondContact O-CD1 3.47Å; L859-I863 VanDerWaalsContact O-CG1 3.3Å; L859-I863 WeakPolarHBondContact O-CG1 3.44Å; L859-I863 PolarHBondContact O-N 2.89Å; L859-F981 HydrophobicContact CD1-CE2 3.87Å; L859-F981 HydrophobicContact CD1-CZ 4.32Å; L859-S984 WeakPolarHBondContact CD2-O 3.26Å; L859-F985 HydrophobicContact CD1-CD2 4.04Å; L859-A988 HydrophobicContact CD2-CB 4.09Å; L859-A988 HydrophobicContact CG-CB 4.01Å
860	H	95	Very high	91.1	Very high	8 Å²	8	66.8 Å²	66.8	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-57.5	-44.4	171.4	-73	92.9	0	0	0	112.1	I856 T857 T864 A988 E991 N992	I856-H860 HydrophobicContact CG2-CB 3.92Å; T857-H860 PolarHBondContact N-ND1 3.31Å; T857-H860 WeakPolarHBondContact O-CB 3.38Å; T857-H860 PolarHBondContact O-N 2.74Å; T857-H860 PolarHBondContact OG1-N 2.57Å; T857-H860 PolarHBondContact OG1-ND1 3.21Å; H860-T864 WeakPolarHBondContact O-CB 3.47Å; H860-T864 PolarHBondContact O-N 2.55Å; H860-T864 PolarHBondContact O-OG1 3.23Å; H860-A988 PolarHBondContact CD2-O 2.93Å; H860-A988 PolarHBondContact NE2-O 3.13Å; H860-E991 IonicContact CE1-OE2 3.63Å; H860-E991 PolarHBondContact CE1-OE2 3.49Å; H860-E991 WeakPolarHBondContact NE2-CB 3.45Å; H860-E991 IonicContact NE2-OE2 3.17Å; H860-E991 PolarHBondContact NE2-OE2 2.67Å; H860-N992 PolarHBondContact CD2-OD1 2.83Å; H860-N992 PolarHBondContact O-ND2 3.28Å
861	Y	94.8	Very high	91.2	Very high	126 Å²	126	68.9 Å²	68.9	49%	0.494	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-42.1	177	-174.6	-100.6	0	0	0	112.2	F822 T857 L858 L859 T864 I865	F822-Y861 AromaticContact CE2-CD1 3.86Å; F822-Y861 HydrophobicContact CE2-CD1 3.86Å; F822-Y861 HydrophobicContact CE2-CE1 4.21Å; F822-Y861 HydrophobicContact CZ-CD1 4.06Å; F822-Y861 AromaticContact CZ-CE1 3.96Å; F822-Y861 HydrophobicContact CZ-CE1 3.96Å; T857-Y861 PolarHBondContact O-N 3.46Å; L858-Y861 HydrophobicContact CD1-CD1 4.43Å; L858-Y861 PolarHBondContact O-N 3.13Å; L859-Y861 VanDerWaalsContact C-N 3.32Å; L859-Y861 PolarHBondContact O-N 3.47Å; Y861-T864 WeakPolarHBondContact O-CB 3.32Å; Y861-T864 PolarHBondContact O-N 3.14Å; Y861-I865 HydrophobicContact CD1-CG1 4.2Å; Y861-I865 HydrophobicContact CE1-CD1 4.36Å; Y861-I865 HydrophobicContact CE1-CG1 3.76Å; Y861-I865 HydrophobicContact CE2-CG1 4.42Å; Y861-I865 WeakPolarHBondContact O-CG1 3.46Å; Y861-I865 PolarHBondContact O-N 3.3Å
862	L	94.9	Very high	91.3	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-56.6	-52.6	174.3	176	62.8	0	0	0	111	L815 V818 V819 F822 I845 L858 L859 T864 I865 L866	L815-L862 HydrophobicContact CD1-CD1 4.43Å; L815-L862 HydrophobicContact CD1-CD2 4.04Å; L815-L862 HydrophobicContact CD1-CG 4.39Å; V818-L862 HydrophobicContact CB-CD1 4.31Å; V818-L862 HydrophobicContact CG1-CD1 3.54Å; V819-L862 HydrophobicContact CG2-CD1 4.44Å; V819-L862 HydrophobicContact CG2-CD2 3.63Å; F822-L862 HydrophobicContact CD2-CD1 4.25Å; F822-L862 HydrophobicContact CE2-CB 3.99Å; F822-L862 HydrophobicContact CE2-CD1 3.79Å; F822-L862 HydrophobicContact CZ-CD1 4.27Å; I845-L862 HydrophobicContact CD1-CD2 4.38Å; L858-L862 VanDerWaalsContact O-CB 3.24Å; L858-L862 WeakPolarHBondContact O-CB 3.41Å; L858-L862 PolarHBondContact O-N 3.42Å; L859-L862 HydrophobicContact CD1-CD2 4.22Å; L859-L862 WeakPolarHBondContact O-CB 3.44Å; L859-L862 PolarHBondContact O-N 2.79Å; L862-T864 VanDerWaalsContact C-N 3.32Å; L862-T864 PolarHBondContact O-N 2.84Å; L862-I865 CarbonylContact O-C 3.55Å; L862-I865 WeakPolarHBondContact O-CA 3.47Å; L862-I865 PolarHBondContact O-N 2.88Å; L862-L866 HydrophobicContact CD1-CD1 4.32Å; L862-L866 HydrophobicContact CD1-CD2 4.49Å; L862-L866 HydrophobicContact CD1-CG 4.24Å; L862-L866 HydrophobicContact CG-CD1 4.06Å; L862-L866 HydrophobicContact CG-CG 4.41Å; L862-L866 WeakPolarHBondContact O-CG 3.22Å; L862-L866 PolarHBondContact O-N 2.87Å
863	I	95.7	Very high	91.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-55.3	-47.1	176.9	-67.2	161.9	0	0	0	110.9	L859 I865 L866 E867 L874 F985 A988 Q989 N992	L859-I863 HydrophobicContact CD1-CD1 4.35Å; L859-I863 HydrophobicContact CG-CD1 4.14Å; L859-I863 WeakPolarHBondContact O-CD1 3.47Å; L859-I863 VanDerWaalsContact O-CG1 3.3Å; L859-I863 WeakPolarHBondContact O-CG1 3.44Å; L859-I863 PolarHBondContact O-N 2.89Å; I863-I865 PolarHBondContact O-N 3.26Å; I863-L866 PolarHBondContact O-N 3.38Å; I863-L866 VanDerWaalsContact O-N 3.12Å; I863-E867 WeakPolarHBondContact O-CG 3.33Å; I863-E867 PolarHBondContact O-N 2.9Å; I863-L874 HydrophobicContact CG2-CD1 4.15Å; I863-F985 HydrophobicContact CD1-CD1 4.29Å; I863-F985 HydrophobicContact CD1-CD2 4.18Å; I863-F985 HydrophobicContact CD1-CE1 4.38Å; I863-F985 HydrophobicContact CD1-CE2 4.28Å; I863-F985 HydrophobicContact CD1-CG 4.19Å; I863-F985 HydrophobicContact CD1-CZ 4.39Å; I863-F985 WeakPolarHBondContact CD1-O 3.4Å; I863-F985 HydrophobicContact CG1-CD1 4.38Å; I863-F985 HydrophobicContact CG1-CD2 3.97Å; I863-F985 HydrophobicContact CG1-CE1 4.03Å; I863-F985 HydrophobicContact CG1-CE2 3.58Å; I863-F985 HydrophobicContact CG1-CG 4.36Å; I863-F985 HydrophobicContact CG1-CZ 3.63Å; I863-A988 HydrophobicContact CD1-CB 3.59Å; I863-Q989 HydrophobicContact CD1-CB 4.28Å; I863-Q989 HydrophobicContact CG2-CB 4.24Å; I863-Q989 HydrophobicContact CG2-CG 4.15Å; I863-N992 WeakPolarHBondContact CB-ND2 3.23Å; I863-N992 WeakPolarHBondContact CG2-ND2 3.47Å
864	T	92.9	Very high	92.2	Very high	31 Å²	31	62.3 Å²	62.3	19%	0.19	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-32.5	176.6	-63.4	0	0	0	0	113.1	H860 Y861 L862 K868	H860-T864 WeakPolarHBondContact O-CB 3.47Å; H860-T864 PolarHBondContact O-N 2.55Å; H860-T864 PolarHBondContact O-OG1 3.23Å; Y861-T864 WeakPolarHBondContact O-CB 3.32Å; Y861-T864 PolarHBondContact O-N 3.14Å; L862-T864 VanDerWaalsContact C-N 3.32Å; L862-T864 PolarHBondContact O-N 2.84Å; T864-K868 HydrophobicContact CG2-CD 4.22Å; T864-K868 VanDerWaalsContact O-CD 3.32Å; T864-K868 WeakPolarHBondContact O-CD 3.49Å; T864-K868 VanDerWaalsContact O-CG 3.31Å; T864-K868 WeakPolarHBondContact O-CG 3.5Å
865	I	93.3	Very high	92.5	Very high	38 Å²	38	59.7 Å²	59.7	20%	0.195	28%	0.28	C	S	.	.	H	α-helix	trans	-80.2	-37.1	175.9	-67.8	-62.5	0	0	0	111.4	F822 Y861 L862 I863 K868 K869	F822-I865 HydrophobicContact CZ-CB 4.31Å; F822-I865 HydrophobicContact CZ-CG1 4.23Å; F822-I865 HydrophobicContact CZ-CG2 4.27Å; Y861-I865 HydrophobicContact CD1-CG1 4.2Å; Y861-I865 HydrophobicContact CE1-CD1 4.36Å; Y861-I865 HydrophobicContact CE1-CG1 3.76Å; Y861-I865 HydrophobicContact CE2-CG1 4.42Å; Y861-I865 WeakPolarHBondContact O-CG1 3.46Å; Y861-I865 PolarHBondContact O-N 3.3Å; L862-I865 CarbonylContact O-C 3.55Å; L862-I865 WeakPolarHBondContact O-CA 3.47Å; L862-I865 PolarHBondContact O-N 2.88Å; I863-I865 PolarHBondContact O-N 3.26Å; I865-K868 PolarHBondContact O-N 3.37Å; I865-K869 HydrophobicContact CG2-CG 4.44Å; I865-K869 WeakPolarHBondContact O-CB 3.32Å; I865-K869 PolarHBondContact O-N 3.18Å
866	L	94.1	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-47.7	174.2	-64.8	170.4	0	0	0	111	L815 L862 I863 K868 K869 Y870 P871 V873 L874 F985	L815-L866 HydrophobicContact CD1-CD1 3.52Å; L815-L866 HydrophobicContact CD1-CD2 4.18Å; L815-L866 HydrophobicContact CD1-CG 4.44Å; L862-L866 HydrophobicContact CD1-CD1 4.32Å; L862-L866 HydrophobicContact CD1-CD2 4.49Å; L862-L866 HydrophobicContact CD1-CG 4.24Å; L862-L866 HydrophobicContact CG-CD1 4.06Å; L862-L866 HydrophobicContact CG-CG 4.41Å; L862-L866 WeakPolarHBondContact O-CG 3.22Å; L862-L866 PolarHBondContact O-N 2.87Å; I863-L866 PolarHBondContact O-N 3.38Å; I863-L866 VanDerWaalsContact O-N 3.12Å; L866-K868 PolarHBondContact O-N 3.34Å; L866-K869 PolarHBondContact O-N 2.99Å; L866-Y870 HydrophobicContact CD2-CD2 4.28Å; L866-Y870 HydrophobicContact CD2-CG 4.4Å; L866-Y870 CarbonylContact O-C 3.58Å; L866-Y870 VanDerWaalsContact O-CA 3.28Å; L866-Y870 WeakPolarHBondContact O-CA 3.43Å; L866-Y870 PolarHBondContact O-N 3.19Å; L866-P871 VanDerWaalsContact O-N 3.14Å; L866-V873 HydrophobicContact CD2-CB 4.15Å; L866-V873 HydrophobicContact CD2-CG1 3.8Å; L866-L874 HydrophobicContact CB-CD1 4.38Å; L866-F985 HydrophobicContact CD1-CE2 3.83Å; L866-F985 HydrophobicContact CD1-CZ 3.9Å
867	E	91.9	Very high	93.2	Very high	49 Å²	49	54 Å²	54	23%	0.229	25%	0.248	C	C	.	.	H	α-helix	trans	-50.5	-44.1	172.7	-74.2	173.3	-174.5	0	0	112.6	I863 L874	I863-E867 WeakPolarHBondContact O-CG 3.33Å; I863-E867 PolarHBondContact O-N 2.9Å; E867-L874 HydrophobicContact CG-CD1 3.97Å; E867-L874 HydrophobicContact CG-CD2 3.78Å
868	K	91.8	Very high	93.1	Very high	140 Å²	140	57.5 Å²	57.5	61%	0.609	27%	0.267	S	S	*	.	H	α-helix	trans	-90.9	-18	-170.2	-68.8	171.9	-173	166.3	0	115	T864 I865 L866	T864-K868 HydrophobicContact CG2-CD 4.22Å; T864-K868 VanDerWaalsContact O-CD 3.32Å; T864-K868 WeakPolarHBondContact O-CD 3.49Å; T864-K868 VanDerWaalsContact O-CG 3.31Å; T864-K868 WeakPolarHBondContact O-CG 3.5Å; I865-K868 PolarHBondContact O-N 3.37Å; L866-K868 PolarHBondContact O-N 3.34Å
869	K	93.6	Very high	93.1	Very high	156 Å²	156	58.8 Å²	58.8	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-132.6	-27.1	-173	-62.6	-64.5	179.7	-176.3	0	114.2	I865 L866 P871	I865-K869 HydrophobicContact CG2-CG 4.44Å; I865-K869 WeakPolarHBondContact O-CB 3.32Å; I865-K869 PolarHBondContact O-N 3.18Å; L866-K869 PolarHBondContact O-N 2.99Å; K869-P871 VanDerWaalsContact C-CD 3.5Å
870	Y	93.3	Very high	93.1	Very high	88 Å²	88	58.8 Å²	58.8	35%	0.345	27%	0.274	S	S	.	.			trans	-134.5	52.8	-176.7	-56.6	-89.4	0	0	0	111.9	Q814 V818 L866 K872 V873 L874	Q814-Y870 HydrophobicContact CG-CD1 4.16Å; Q814-Y870 HydrophobicContact CG-CE1 4.5Å; V818-Y870 HydrophobicContact CG2-CD2 4.11Å; V818-Y870 HydrophobicContact CG2-CE1 4.29Å; V818-Y870 HydrophobicContact CG2-CE2 3.77Å; L866-Y870 HydrophobicContact CD2-CD2 4.28Å; L866-Y870 HydrophobicContact CD2-CG 4.4Å; L866-Y870 CarbonylContact O-C 3.58Å; L866-Y870 VanDerWaalsContact O-CA 3.28Å; L866-Y870 WeakPolarHBondContact O-CA 3.43Å; L866-Y870 PolarHBondContact O-N 3.19Å; Y870-K872 PolarHBondContact O-N 2.92Å; Y870-V873 WeakPolarHBondContact O-CA 3.3Å; Y870-V873 WeakPolarHBondContact O-CB 3.13Å; Y870-V873 PolarHBondContact O-N 2.97Å; Y870-L874 PolarHBondContact O-N 3.43Å
871	P	91.6	Very high	93.1	Very high	81 Å²	81	65.4 Å²	65.4	53%	0.526	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.8	-169.8	24.9	-35.8	0	0	0	114.7	L866 K869	L866-P871 VanDerWaalsContact O-N 3.14Å; K869-P871 VanDerWaalsContact C-CD 3.5Å
872	K	90.3	Very high	93.2	Very high	169 Å²	169	60.4 Å²	60.4	74%	0.735	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-37.4	168.8	-64.1	-175.7	178.3	-177.7	0	112.3	N811 Y870 L874 K875	N811-K872 PolarHBondContact OD1-O 3.1Å; Y870-K872 PolarHBondContact O-N 2.92Å; K872-L874 VanDerWaalsContact C-N 3.33Å; K872-K875 WeakPolarHBondContact O-CB 3.44Å; K872-K875 PolarHBondContact O-N 2.85Å
873	V	93.1	Very high	93.3	Very high	7 Å²	7	60.3 Å²	60.3	4%	0.042	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-72.3	-28.2	-178.2	-178.8	0	0	0	0	111.9	N811 Q814 L815 L866 Y870 K875 F876	N811-V873 WeakPolarHBondContact O-CG1 3.48Å; Q814-V873 HydrophobicContact CB-CG2 3.72Å; Q814-V873 HydrophobicContact CG-CG2 3.46Å; Q814-V873 VanDerWaalsContact CG-CG2 3.46Å; L815-V873 HydrophobicContact CB-CG1 3.78Å; L815-V873 HydrophobicContact CD1-CG1 4.47Å; L866-V873 HydrophobicContact CD2-CB 4.15Å; L866-V873 HydrophobicContact CD2-CG1 3.8Å; Y870-V873 WeakPolarHBondContact O-CA 3.3Å; Y870-V873 WeakPolarHBondContact O-CB 3.13Å; Y870-V873 PolarHBondContact O-N 2.97Å; V873-K875 PolarHBondContact O-N 3.16Å; V873-F876 WeakPolarHBondContact O-CB 3.15Å; V873-F876 WeakPolarHBondContact O-CD1 3.46Å; V873-F876 PolarHBondContact O-N 3.15Å
874	L	90.8	Very high	93.3	Very high	33 Å²	33	62 Å²	62	17%	0.173	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-52.5	-28.9	171	-169.7	69.6	0	0	0	112.3	I863 L866 E867 Y870 K872 F985	I863-L874 HydrophobicContact CG2-CD1 4.15Å; L866-L874 HydrophobicContact CB-CD1 4.38Å; E867-L874 HydrophobicContact CG-CD1 3.97Å; E867-L874 HydrophobicContact CG-CD2 3.78Å; Y870-L874 PolarHBondContact O-N 3.43Å; K872-L874 VanDerWaalsContact C-N 3.33Å; L874-F985 HydrophobicContact CD1-CE1 4.26Å; L874-F985 HydrophobicContact CD1-CZ 4.14Å
875	K	89.8	Confident	93.5	Very high	120 Å²	120	65 Å²	65	52%	0.522	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-90.1	15.9	178.3	-68.5	179.7	144.9	-83.6	0	114.5	K872 V873 Q877 D878	K872-K875 WeakPolarHBondContact O-CB 3.44Å; K872-K875 PolarHBondContact O-N 2.85Å; V873-K875 PolarHBondContact O-N 3.16Å; K875-Q877 PolarHBondContact O-N 2.93Å; K875-D878 WeakPolarHBondContact CB-OD2 3.28Å; K875-D878 IonicContact NZ-OD2 2.7Å; K875-D878 PolarHBondContact NZ-OD2 3.25Å; K875-D878 VanDerWaalsContact O-CB 3.29Å; K875-D878 WeakPolarHBondContact O-CB 3.16Å; K875-D878 PolarHBondContact O-N 2.88Å
876	F	94.1	Very high	93.7	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-58	-23.3	177.6	83	-71.5	0	0	0	113.4	N811 L812 L815 V873 D878 D879 L880 F981 L982 F985	N811-F876 HydrophobicContact CB-CB 3.52Å; L812-F876 HydrophobicContact CD1-CD2 4.25Å; L815-F876 HydrophobicContact CD2-CD1 3.94Å; L815-F876 HydrophobicContact CD2-CD2 3.85Å; L815-F876 HydrophobicContact CD2-CE1 3.85Å; L815-F876 HydrophobicContact CD2-CE2 3.74Å; L815-F876 HydrophobicContact CD2-CG 3.95Å; L815-F876 HydrophobicContact CD2-CZ 3.74Å; V873-F876 WeakPolarHBondContact O-CB 3.15Å; V873-F876 WeakPolarHBondContact O-CD1 3.46Å; V873-F876 PolarHBondContact O-N 3.15Å; F876-D878 VanDerWaalsContact C-N 3.3Å; F876-D878 PolarHBondContact O-N 2.92Å; F876-D879 WeakPolarHBondContact O-CB 3.28Å; F876-D879 PolarHBondContact O-N 3.25Å; F876-L880 HydrophobicContact CD2-CD1 3.79Å; F876-L880 HydrophobicContact CE2-CD1 4.14Å; F876-L880 WeakPolarHBondContact O-CG 3.26Å; F876-F981 HydrophobicContact CE2-CD1 4.22Å; F876-F981 AromaticContact CE2-CE1 3.87Å; F876-F981 HydrophobicContact CE2-CE1 3.87Å; F876-F981 HydrophobicContact CZ-CD1 4.2Å; F876-F981 AromaticContact CZ-CE1 3.66Å; F876-F981 HydrophobicContact CZ-CE1 3.66Å; F876-L982 HydrophobicContact CD2-CD2 4.39Å; F876-L982 HydrophobicContact CE2-CD2 3.61Å; F876-L982 HydrophobicContact CZ-CD2 3.83Å; F876-F985 HydrophobicContact CD1-CE2 4.45Å; F876-F985 HydrophobicContact CD1-CZ 4.27Å; F876-F985 AromaticContact CE1-CD1 3.86Å; F876-F985 HydrophobicContact CE1-CD1 3.86Å; F876-F985 AromaticContact CE1-CD2 3.69Å; F876-F985 HydrophobicContact CE1-CD2 3.69Å; F876-F985 AromaticContact CE1-CE1 3.76Å; F876-F985 HydrophobicContact CE1-CE1 3.76Å; F876-F985 AromaticContact CE1-CE2 3.58Å; F876-F985 HydrophobicContact CE1-CE2 3.58Å; F876-F985 AromaticContact CE1-CG 3.83Å; F876-F985 HydrophobicContact CE1-CG 3.83Å; F876-F985 AromaticContact CE1-CZ 3.61Å; F876-F985 HydrophobicContact CE1-CZ 3.61Å; F876-F985 HydrophobicContact CZ-CB 4.42Å; F876-F985 HydrophobicContact CZ-CD1 4.41Å; F876-F985 AromaticContact CZ-CD2 3.92Å; F876-F985 HydrophobicContact CZ-CD2 3.92Å; F876-F985 HydrophobicContact CZ-CE2 4.23Å; F876-F985 HydrophobicContact CZ-CG 4.02Å
877	Q	92.8	Very high	93.8	Very high	46 Å²	46	64.1 Å²	64.1	22%	0.215	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-63.8	-34.1	172.9	-49.9	-171.6	-50.8	0	0	112.2	K875 D879 L880 L982 T986	K875-Q877 PolarHBondContact O-N 2.93Å; Q877-D879 PolarHBondContact O-N 3.42Å; Q877-L880 PolarHBondContact O-N 2.84Å; Q877-L880 VanDerWaalsContact O-N 3.14Å; Q877-L982 HydrophobicContact CB-CD2 4.07Å; Q877-L982 HydrophobicContact CG-CD2 3.71Å; Q877-L982 PolarHBondContact NE2-O 3.21Å; Q877-T986 PolarHBondContact NE2-OG1 3.44Å
878	D	93	Very high	94.1	Very high	83 Å²	83	68.1 Å²	68.1	44%	0.444	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62.6	-26.1	176	-64.2	-19.4	0	0	0	111.2	K875 F876 Q881	K875-D878 WeakPolarHBondContact CB-OD2 3.28Å; K875-D878 IonicContact NZ-OD2 2.7Å; K875-D878 PolarHBondContact NZ-OD2 3.25Å; K875-D878 VanDerWaalsContact O-CB 3.29Å; K875-D878 WeakPolarHBondContact O-CB 3.16Å; K875-D878 PolarHBondContact O-N 2.88Å; F876-D878 VanDerWaalsContact C-N 3.3Å; F876-D878 PolarHBondContact O-N 2.92Å; D878-Q881 PolarHBondContact O-NE2 3.44Å; D878-Q881 VanDerWaalsContact O-NE2 3.16Å
879	D	93.8	Very high	94.3	Very high	54 Å²	54	61.8 Å²	61.8	29%	0.289	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-82.2	-12.6	178.4	-61.4	-15.1	0	0	0	113.7	E805 S809 N811 F876 Q877	E805-D879 VanDerWaalsContact CB-O 3.31Å; E805-D879 WeakPolarHBondContact CB-O 3.38Å; E805-D879 WeakPolarHBondContact CG-O 3.26Å; S809-D879 WeakPolarHBondContact CB-OD2 3.35Å; S809-D879 WeakPolarHBondContact OG-CB 3.47Å; S809-D879 PolarHBondContact OG-OD2 3.48Å; N811-D879 WeakPolarHBondContact CB-OD2 3.4Å; N811-D879 PolarHBondContact ND2-OD1 3.01Å; N811-D879 PolarHBondContact ND2-OD2 3.39Å; F876-D879 WeakPolarHBondContact O-CB 3.28Å; F876-D879 PolarHBondContact O-N 3.25Å; Q877-D879 PolarHBondContact O-N 3.42Å
880	L	95.6	Very high	94.3	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	28%	0.282	C	S	.	.			trans	-125.2	29.9	-161.7	-63.5	-177	0	0	0	113.9	E805 I806 L812 F876 Q877 S882 V883 L982	E805-L880 HydrophobicContact CB-CD2 4.11Å; E805-L880 WeakPolarHBondContact OE2-CA 3.46Å; I806-L880 HydrophobicContact CB-CD2 4.48Å; I806-L880 HydrophobicContact CG1-CD2 3.62Å; L812-L880 HydrophobicContact CD1-CD1 4.41Å; L812-L880 HydrophobicContact CD2-CD1 4.19Å; L812-L880 HydrophobicContact CD2-CD2 4.38Å; F876-L880 HydrophobicContact CD2-CD1 3.79Å; F876-L880 HydrophobicContact CE2-CD1 4.14Å; F876-L880 WeakPolarHBondContact O-CG 3.26Å; Q877-L880 PolarHBondContact O-N 2.84Å; Q877-L880 VanDerWaalsContact O-N 3.14Å; L880-S882 VanDerWaalsContact C-N 3.3Å; L880-S882 PolarHBondContact O-N 3.45Å; L880-V883 HydrophobicContact CB-CG2 3.95Å; L880-V883 HydrophobicContact CD2-CG2 4.38Å; L880-V883 WeakPolarHBondContact O-CB 3.31Å; L880-V883 WeakPolarHBondContact O-CG2 3.14Å; L880-V883 PolarHBondContact O-N 2.78Å; L880-L982 HydrophobicContact CB-CD1 4.22Å; L880-L982 HydrophobicContact CD1-CD2 4.33Å
881	Q	95	Very high	94.4	Very high	147 Å²	147	53.7 Å²	53.7	69%	0.687	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.1	-168.4	-60.9	-178.4	13	0	0	114.5	E805 D878	E805-Q881 PolarHBondContact OE2-N 3.39Å; D878-Q881 PolarHBondContact O-NE2 3.44Å; D878-Q881 VanDerWaalsContact O-NE2 3.16Å
882	S	96.3	Very high	94.4	Very high	20 Å²	20	54 Å²	54	14%	0.14	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.1	-177.8	-53.4	0	0	0	0	113.5	K801 E805 L880 S884 E885 A886	K801-S882 VanDerWaalsContact CB-OG 3.27Å; K801-S882 WeakPolarHBondContact CB-OG 3.45Å; E805-S882 WeakPolarHBondContact OE1-CB 3.34Å; E805-S882 PolarHBondContact OE1-N 2.89Å; E805-S882 PolarHBondContact OE1-OG 2.85Å; E805-S882 WeakPolarHBondContact OE2-CB 3.45Å; E805-S882 PolarHBondContact OE2-N 3.17Å; L880-S882 VanDerWaalsContact C-N 3.3Å; L880-S882 PolarHBondContact O-N 3.45Å; S882-S884 PolarHBondContact O-N 3.49Å; S882-E885 PolarHBondContact O-N 2.69Å; S882-A886 PolarHBondContact O-N 2.82Å
883	V	97.1	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-40.1	-174.1	175.2	0	0	0	0	112.4	A802 I806 L880 E885 A886 A887 F975 F978 D979 L982	A802-V883 HydrophobicContact CB-CG2 4.2Å; I806-V883 HydrophobicContact CD1-CG2 3.82Å; I806-V883 HydrophobicContact CG1-CG2 3.97Å; L880-V883 HydrophobicContact CB-CG2 3.95Å; L880-V883 HydrophobicContact CD2-CG2 4.38Å; L880-V883 WeakPolarHBondContact O-CB 3.31Å; L880-V883 WeakPolarHBondContact O-CG2 3.14Å; L880-V883 PolarHBondContact O-N 2.78Å; V883-E885 VanDerWaalsContact C-N 3.32Å; V883-E885 PolarHBondContact O-N 2.81Å; V883-A886 PolarHBondContact O-N 3.32Å; V883-A887 WeakPolarHBondContact O-CB 3.06Å; V883-A887 PolarHBondContact O-N 3.33Å; V883-F975 HydrophobicContact CG1-CB 4.22Å; V883-F975 HydrophobicContact CG1-CD1 4.4Å; V883-F978 HydrophobicContact CG1-CB 3.79Å; V883-D979 HydrophobicContact CG1-CB 4.29Å; V883-L982 HydrophobicContact CB-CD1 4.23Å; V883-L982 HydrophobicContact CG1-CD1 4.24Å
884	S	95.8	Very high	94.6	Very high	36 Å²	36	50.4 Å²	50.4	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-55.3	-44.5	174.4	156.4	0	0	0	0	112.1	S882 K888 D979	S882-S884 PolarHBondContact O-N 3.49Å; S884-K888 WeakPolarHBondContact O-CE 3.46Å; S884-K888 WeakPolarHBondContact O-CG 3.18Å; S884-K888 PolarHBondContact OG-NZ 3.38Å; S884-K888 VanDerWaalsContact OG-NZ 3.14Å; S884-D979 WeakPolarHBondContact CA-OD1 3.39Å; S884-D979 WeakPolarHBondContact CB-OD1 3.24Å
885	E	96.1	Very high	94.8	Very high	94 Å²	94	53.2 Å²	53.2	44%	0.439	27%	0.267	S	S	.	.	H	α-helix	trans	-77.3	-37	-177.9	-55.1	-39	114	0	0	111.6	A798 S882 V883 A887 K888	A798-E885 HydrophobicContact CB-CB 3.98Å; S882-E885 PolarHBondContact O-N 2.69Å; V883-E885 VanDerWaalsContact C-N 3.32Å; V883-E885 PolarHBondContact O-N 2.81Å; E885-A887 VanDerWaalsContact C-N 3.3Å; E885-A887 PolarHBondContact O-N 3.46Å; E885-K888 WeakPolarHBondContact O-CB 3.19Å; E885-K888 PolarHBondContact O-N 2.88Å; E885-K888 VanDerWaalsContact O-N 3.11Å; E885-K888 IonicContact OE1-NZ 2.66Å; E885-K888 PolarHBondContact OE1-NZ 3.11Å; E885-K888 IonicContact OE2-NZ 3.76Å; E885-K888 PolarHBondContact OE2-NZ 3.34Å
886	A	97.4	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-32.7	174.9	0	0	0	0	0	112.9	L799 A802 S882 V883 K888 V889 F975	L799-A886 HydrophobicContact CD2-CB 4.45Å; A802-A886 HydrophobicContact CB-CB 3.35Å; S882-A886 PolarHBondContact O-N 2.82Å; V883-A886 PolarHBondContact O-N 3.32Å; A886-K888 PolarHBondContact O-N 3.01Å; A886-V889 PolarHBondContact O-N 3.35Å; A886-V889 VanDerWaalsContact O-N 3.13Å; A886-F975 HydrophobicContact CB-CB 4.2Å; A886-F975 HydrophobicContact CB-CD1 4.29Å; A886-F975 HydrophobicContact CB-CD2 3.56Å; A886-F975 HydrophobicContact CB-CE2 3.97Å; A886-F975 HydrophobicContact CB-CG 3.76Å; A886-F975 HydrophobicContact CB-CZ 4.49Å
887	A	97.4	Very high	94.9	Very high	18 Å²	18	55.8 Å²	55.8	15%	0.149	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.5	173.7	0	0	0	0	0	113.9	V883 E885 D972 F975 D979	V883-A887 WeakPolarHBondContact O-CB 3.06Å; V883-A887 PolarHBondContact O-N 3.33Å; E885-A887 VanDerWaalsContact C-N 3.3Å; E885-A887 PolarHBondContact O-N 3.46Å; A887-D972 WeakPolarHBondContact O-CA 3.47Å; A887-D972 WeakPolarHBondContact O-CB 3.47Å; A887-F975 HydrophobicContact CB-CB 3.92Å; A887-D979 HydrophobicContact CB-CB 4.14Å
888	K	96.8	Very high	95	Very high	133 Å²	133	53.9 Å²	53.9	58%	0.578	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-5	176.7	-58.8	162.9	-162.6	165.2	0	112.8	S884 E885 A886 N890	S884-K888 WeakPolarHBondContact O-CE 3.46Å; S884-K888 WeakPolarHBondContact O-CG 3.18Å; S884-K888 PolarHBondContact OG-NZ 3.38Å; S884-K888 VanDerWaalsContact OG-NZ 3.14Å; E885-K888 WeakPolarHBondContact O-CB 3.19Å; E885-K888 PolarHBondContact O-N 2.88Å; E885-K888 VanDerWaalsContact O-N 3.11Å; E885-K888 IonicContact OE1-NZ 2.66Å; E885-K888 PolarHBondContact OE1-NZ 3.11Å; E885-K888 IonicContact OE2-NZ 3.76Å; E885-K888 PolarHBondContact OE2-NZ 3.34Å; A886-K888 PolarHBondContact O-N 3.01Å; K888-N890 PolarHBondContact O-N 3.19Å
889	V	96.9	Very high	95.1	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.042	27%	0.267	C	S	.	.			trans	-92.4	101.2	-173.1	-178	0	0	0	0	111.4	K795 L799 A886 M891 L894	K795-V889 HydrophobicContact CB-CG1 3.96Å; K795-V889 HydrophobicContact CB-CG2 4.07Å; K795-V889 HydrophobicContact CG-CG2 4.42Å; L799-V889 HydrophobicContact CD1-CB 4.45Å; L799-V889 HydrophobicContact CD1-CG1 3.68Å; L799-V889 HydrophobicContact CD2-CB 4.07Å; L799-V889 HydrophobicContact CD2-CG1 4.19Å; L799-V889 HydrophobicContact CG-CB 4.14Å; L799-V889 HydrophobicContact CG-CG1 3.89Å; L799-V889 HydrophobicContact CG-CG2 4.44Å; A886-V889 PolarHBondContact O-N 3.35Å; A886-V889 VanDerWaalsContact O-N 3.13Å; V889-M891 PolarHBondContact O-N 3.08Å; V889-L894 HydrophobicContact CG1-CD2 3.95Å
890	N	94.1	Very high	95.1	Very high	61 Å²	61	52 Å²	52	33%	0.326	27%	0.27	S	S	.	.			trans	-72.5	117.6	169.4	-172.3	-82.1	0	0	0	110.9	K888 T892 E893 L894	K888-N890 PolarHBondContact O-N 3.19Å; N890-T892 WeakPolarHBondContact OD1-CB 3.41Å; N890-T892 PolarHBondContact OD1-N 3.21Å; N890-T892 VanDerWaalsContact OD1-N 3.08Å; N890-E893 HydrophobicContact CB-CB 4.25Å; N890-E893 PolarHBondContact OD1-N 2.86Å; N890-L894 WeakPolarHBondContact O-CB 3.32Å; N890-L894 PolarHBondContact O-N 2.74Å; N890-L894 VanDerWaalsContact O-N 3.17Å
891	M	93.9	Very high	95	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.069	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-36.3	-178.2	-175.7	61.7	70.5	0	0	112.8	L799 V889 L894 E895 K952 P971	L799-M891 HydrophobicContact CD1-CE 3.65Å; V889-M891 PolarHBondContact O-N 3.08Å; M891-L894 PolarHBondContact O-N 2.9Å; M891-L894 HydrophobicContact SD-CD2 4.4Å; M891-E895 HydrophobicContact CG-CG 4.27Å; M891-E895 WeakPolarHBondContact O-CB 3.33Å; M891-E895 WeakPolarHBondContact O-CG 3.32Å; M891-E895 PolarHBondContact O-N 3.46Å; M891-E895 HydrophobicContact SD-CG 4.18Å; M891-K952 HydrophobicContact CE-CG 3.93Å; M891-K952 HydrophobicContact SD-CD 4.41Å; M891-K952 WeakPolarHBondContact SD-CE 3.37Å; M891-K952 HydrophobicContact SD-CG 4.19Å; M891-P971 HydrophobicContact CB-CG 4Å; M891-P971 HydrophobicContact CE-CG 3.88Å
892	T	92.8	Very high	95.1	Very high	88 Å²	88	51.9 Å²	51.9	54%	0.54	26%	0.262	S	S	.	.	H	α-helix	trans	-66.9	-38.4	-178.5	-53.9	0	0	0	0	112.1	N890 K896	N890-T892 WeakPolarHBondContact OD1-CB 3.41Å; N890-T892 PolarHBondContact OD1-N 3.21Å; N890-T892 VanDerWaalsContact OD1-N 3.08Å; T892-K896 VanDerWaalsContact O-CB 3.3Å; T892-K896 WeakPolarHBondContact O-CB 3.26Å; T892-K896 PolarHBondContact O-N 2.82Å; T892-K896 VanDerWaalsContact O-N 3.12Å
893	E	93.5	Very high	95	Very high	99 Å²	99	54.2 Å²	54.2	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-46.4	172.5	-174.1	171.3	-124.4	0	0	111.4	N890 E895 K896 D897	N890-E893 HydrophobicContact CB-CB 4.25Å; N890-E893 PolarHBondContact OD1-N 2.86Å; E893-E895 PolarHBondContact O-N 2.77Å; E893-K896 WeakPolarHBondContact O-CB 3.43Å; E893-K896 PolarHBondContact O-N 2.83Å; E893-K896 VanDerWaalsContact O-N 3.14Å; E893-D897 PolarHBondContact O-N 3Å
894	L	94.8	Very high	94.9	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-44.2	177.7	-176.4	60.6	0	0	0	112.4	I792 K795 I796 L799 V889 N890 M891 D897 I898 L948	I792-L894 HydrophobicContact CB-CD1 4.48Å; I792-L894 HydrophobicContact CG1-CD1 4.32Å; I792-L894 HydrophobicContact CG2-CD1 4.03Å; K795-L894 HydrophobicContact CB-CD1 4.03Å; K795-L894 HydrophobicContact CB-CD2 4.37Å; K795-L894 HydrophobicContact CD-CD1 4.19Å; I796-L894 HydrophobicContact CG1-CD1 4.23Å; I796-L894 HydrophobicContact CG1-CD2 4.09Å; L799-L894 HydrophobicContact CD1-CD2 3.86Å; V889-L894 HydrophobicContact CG1-CD2 3.95Å; N890-L894 WeakPolarHBondContact O-CB 3.32Å; N890-L894 PolarHBondContact O-N 2.74Å; N890-L894 VanDerWaalsContact O-N 3.17Å; M891-L894 PolarHBondContact O-N 2.9Å; M891-L894 HydrophobicContact SD-CD2 4.4Å; L894-D897 PolarHBondContact O-N 2.95Å; L894-I898 WeakPolarHBondContact O-CB 3.42Å; L894-I898 WeakPolarHBondContact O-CG1 3.24Å; L894-I898 PolarHBondContact O-N 3.36Å; L894-L948 HydrophobicContact CD2-CD1 3.77Å; L894-L948 HydrophobicContact CG-CD1 4.09Å
895	E	93.4	Very high	94.8	Very high	92 Å²	92	53.6 Å²	53.6	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-40.2	174.5	-76.3	-171.3	152.5	0	0	112.8	M891 E893 G899 K952	M891-E895 HydrophobicContact CG-CG 4.27Å; M891-E895 WeakPolarHBondContact O-CB 3.33Å; M891-E895 WeakPolarHBondContact O-CG 3.32Å; M891-E895 PolarHBondContact O-N 3.46Å; M891-E895 HydrophobicContact SD-CG 4.18Å; E893-E895 PolarHBondContact O-N 2.77Å; E895-G899 PolarHBondContact O-N 2.73Å; E895-K952 WeakPolarHBondContact OE1-CE 3.38Å; E895-K952 IonicContact OE1-NZ 3.16Å; E895-K952 PolarHBondContact OE1-NZ 3.36Å
896	K	94.2	Very high	94.8	Very high	134 Å²	134	55.6 Å²	55.6	58%	0.583	28%	0.283	S	S	*	.	H	α-helix	trans	-64.4	-41.8	177.7	175.6	-170.3	170.4	-159.1	0	111.5	T892 E893 G899 N900	T892-K896 VanDerWaalsContact O-CB 3.3Å; T892-K896 WeakPolarHBondContact O-CB 3.26Å; T892-K896 PolarHBondContact O-N 2.82Å; T892-K896 VanDerWaalsContact O-N 3.12Å; E893-K896 WeakPolarHBondContact O-CB 3.43Å; E893-K896 PolarHBondContact O-N 2.83Å; E893-K896 VanDerWaalsContact O-N 3.14Å; K896-G899 CarbonylContact O-C 3.58Å; K896-G899 WeakPolarHBondContact O-CA 3.48Å; K896-G899 PolarHBondContact O-N 2.66Å; K896-N900 PolarHBondContact O-N 2.73Å; K896-N900 PolarHBondContact O-ND2 3.09Å; K896-N900 VanDerWaalsContact O-ND2 3.16Å
897	D	93.4	Very high	94.7	Very high	40 Å²	40	58.9 Å²	58.9	21%	0.214	31%	0.306	C	S	.	.	H	α-helix	trans	-74.9	-33.4	-179.5	-69.5	-30.3	0	0	0	113.4	I792 E893 L894 G899 N900 L901	I792-D897 HydrophobicContact CD1-CB 3.99Å; I792-D897 HydrophobicContact CG1-CB 4.45Å; E893-D897 PolarHBondContact O-N 3Å; L894-D897 PolarHBondContact O-N 2.95Å; D897-G899 VanDerWaalsContact C-N 3.33Å; D897-N900 WeakPolarHBondContact O-CB 3.15Å; D897-N900 PolarHBondContact O-N 3.36Å; D897-N900 PolarHBondContact OD1-ND2 3.28Å; D897-N900 VanDerWaalsContact OD1-ND2 3.1Å; D897-L901 PolarHBondContact O-N 2.94Å
898	I	94.9	Very high	94.6	Very high	7 Å²	7	58.1 Å²	58.1	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-44.2	165.7	-66.8	-83.9	0	0	0	110.3	I792 I796 L894 N900 L901 R902 F941 V944 L948	I792-I898 HydrophobicContact CD1-CD1 4.42Å; I792-I898 HydrophobicContact CG2-CD1 3.74Å; I792-I898 HydrophobicContact CG2-CG1 4.41Å; I796-I898 HydrophobicContact CD1-CD1 4.39Å; L894-I898 WeakPolarHBondContact O-CB 3.42Å; L894-I898 WeakPolarHBondContact O-CG1 3.24Å; L894-I898 PolarHBondContact O-N 3.36Å; I898-N900 PolarHBondContact O-N 3.05Å; I898-L901 PolarHBondContact O-N 3.4Å; I898-R902 PolarHBondContact O-N 3.08Å; I898-F941 HydrophobicContact CG2-CE2 4.48Å; I898-F941 HydrophobicContact CG2-CZ 4.26Å; I898-V944 HydrophobicContact CD1-CG1 3.38Å; I898-L948 HydrophobicContact CB-CD2 4.3Å; I898-L948 HydrophobicContact CD1-CD2 4.11Å; I898-L948 HydrophobicContact CG1-CD2 3.82Å; I898-L948 HydrophobicContact CG2-CD2 4.03Å
899	G	94.1	Very high	94.5	Very high	33 Å²	33	55.2 Å²	55.2	34%	0.34	29%	0.288	S	S	.	.	H	α-helix	trans	-58.4	-45.1	173.2	0	0	0	0	0	112.8	E895 K896 D897 L901 R902 S903	E895-G899 PolarHBondContact O-N 2.73Å; K896-G899 CarbonylContact O-C 3.58Å; K896-G899 WeakPolarHBondContact O-CA 3.48Å; K896-G899 PolarHBondContact O-N 2.66Å; D897-G899 VanDerWaalsContact C-N 3.33Å; G899-L901 VanDerWaalsContact C-N 3.32Å; G899-L901 PolarHBondContact O-N 3.41Å; G899-R902 PolarHBondContact O-N 2.84Å; G899-S903 PolarHBondContact O-N 3Å; G899-S903 PolarHBondContact O-OG 3.44Å; G899-S903 VanDerWaalsContact O-OG 3.08Å
900	N	92.8	Very high	94.5	Very high	65 Å²	65	58.2 Å²	58.2	35%	0.348	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-36.3	176.3	-69.6	-36.3	0	0	0	112.4	K896 D897 I898 S903 G904	K896-N900 PolarHBondContact O-N 2.73Å; K896-N900 PolarHBondContact O-ND2 3.09Å; K896-N900 VanDerWaalsContact O-ND2 3.16Å; D897-N900 WeakPolarHBondContact O-CB 3.15Å; D897-N900 PolarHBondContact O-N 3.36Å; D897-N900 PolarHBondContact OD1-ND2 3.28Å; D897-N900 VanDerWaalsContact OD1-ND2 3.1Å; I898-N900 PolarHBondContact O-N 3.05Å; N900-S903 PolarHBondContact O-OG 2.83Å; N900-G904 PolarHBondContact O-N 2.59Å; N900-G904 VanDerWaalsContact O-N 3.1Å
901	L	95	Very high	94.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-69.8	-48.3	172.7	-77.3	177.9	0	0	0	111.6	F781 F785 R788 I789 I792 D897 I898 G899 S903 G904 L905 F941	F781-L901 HydrophobicContact CE2-CD2 3.98Å; F781-L901 HydrophobicContact CZ-CD2 3.98Å; F785-L901 HydrophobicContact CD2-CD2 3.87Å; F785-L901 HydrophobicContact CE2-CD2 4.11Å; R788-L901 HydrophobicContact CB-CD1 4.35Å; R788-L901 HydrophobicContact CB-CD2 3.99Å; R788-L901 HydrophobicContact CB-CG 4.43Å; I789-L901 HydrophobicContact CD1-CD1 3.72Å; I789-L901 HydrophobicContact CG1-CD1 4.37Å; I792-L901 HydrophobicContact CD1-CD1 3.53Å; I792-L901 HydrophobicContact CD1-CG 4.42Å; D897-L901 PolarHBondContact O-N 2.94Å; I898-L901 PolarHBondContact O-N 3.4Å; G899-L901 VanDerWaalsContact C-N 3.32Å; G899-L901 PolarHBondContact O-N 3.41Å; L901-S903 PolarHBondContact O-N 3.37Å; L901-G904 PolarHBondContact O-N 3.17Å; L901-L905 WeakPolarHBondContact O-CB 3.3Å; L901-L905 PolarHBondContact O-N 2.93Å; L901-F941 HydrophobicContact CB-CD2 3.96Å; L901-F941 HydrophobicContact CB-CE2 3.41Å; L901-F941 VanDerWaalsContact CB-CE2 3.41Å; L901-F941 HydrophobicContact CB-CZ 3.96Å; L901-F941 HydrophobicContact CD1-CD2 4.09Å; L901-F941 HydrophobicContact CD1-CE2 3.94Å; L901-F941 HydrophobicContact CG-CE2 4.34Å
902	R	95.8	Very high	94.5	Very high	148 Å²	148	55.3 Å²	55.3	56%	0.558	29%	0.294	S	S	*	.	H	α-helix	trans	-58.3	-47.8	178.9	-168.9	-174.1	-73.5	-170.2	-5.6	111.9	I898 G899 K906 F941 E945	I898-R902 PolarHBondContact O-N 3.08Å; G899-R902 PolarHBondContact O-N 2.84Å; R902-K906 WeakPolarHBondContact O-CB 3.07Å; R902-K906 PolarHBondContact O-N 3.14Å; R902-K906 VanDerWaalsContact O-N 3.14Å; R902-F941 HydrophobicContact CB-CE1 3.78Å; R902-F941 HydrophobicContact CB-CZ 3.74Å; R902-F941 HydrophobicContact CG-CE1 4.1Å; R902-F941 HydrophobicContact CG-CZ 4.48Å; R902-E945 IonicContact CZ-OE1 3.66Å; R902-E945 IonicContact CZ-OE2 2.67Å; R902-E945 IonicContact NE-OE1 3.12Å; R902-E945 PolarHBondContact NE-OE1 3.21Å; R902-E945 IonicContact NE-OE2 2.75Å; R902-E945 VanDerWaalsContact NH2-CD 3.31Å; R902-E945 IonicContact NH2-OE1 2.72Å; R902-E945 PolarHBondContact NH2-OE1 3.3Å; R902-E945 IonicContact NH2-OE2 3.69Å; R902-E945 PolarHBondContact NH2-OE2 3.37Å
903	S	95	Very high	94.6	Very high	69 Å²	69	55 Å²	55	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-69.5	-36.4	178.5	62.9	0	0	0	0	112.4	G899 N900 L901 S907	G899-S903 PolarHBondContact O-N 3Å; G899-S903 PolarHBondContact O-OG 3.44Å; G899-S903 VanDerWaalsContact O-OG 3.08Å; N900-S903 PolarHBondContact O-OG 2.83Å; L901-S903 PolarHBondContact O-N 3.37Å; S903-S907 WeakPolarHBondContact O-CB 3.22Å; S903-S907 PolarHBondContact O-N 3.17Å; S903-S907 VanDerWaalsContact O-N 3.11Å; S903-S907 PolarHBondContact O-OG 3.41Å
904	G	94	Very high	94.6	Very high	14 Å²	14	53.5 Å²	53.5	14%	0.144	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-52.5	176.4	0	0	0	0	0	111.8	N900 L901 K906 S907 V908	N900-G904 PolarHBondContact O-N 2.59Å; N900-G904 VanDerWaalsContact O-N 3.1Å; L901-G904 PolarHBondContact O-N 3.17Å; G904-K906 PolarHBondContact O-N 3.15Å; G904-S907 WeakPolarHBondContact O-CA 3.39Å; G904-S907 WeakPolarHBondContact O-CB 3.48Å; G904-S907 PolarHBondContact O-N 3.21Å; G904-V908 WeakPolarHBondContact O-CG2 3.3Å; G904-V908 PolarHBondContact O-N 2.73Å
905	L	95.5	Very high	94.4	Very high	8 Å²	8	54 Å²	54	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-57.8	-47.5	179.4	-177	61.6	0	0	0	111.4	F781 L901 S907 V908 E909 I934 A937 F941	F781-L905 HydrophobicContact CE1-CB 4.04Å; F781-L905 HydrophobicContact CE1-CD1 4.29Å; F781-L905 HydrophobicContact CZ-CB 3.99Å; F781-L905 VanDerWaalsContact CZ-N 3.29Å; L901-L905 WeakPolarHBondContact O-CB 3.3Å; L901-L905 PolarHBondContact O-N 2.93Å; L905-S907 PolarHBondContact O-N 2.96Å; L905-V908 PolarHBondContact O-N 2.92Å; L905-E909 WeakPolarHBondContact O-CG 3.35Å; L905-E909 PolarHBondContact O-N 2.92Å; L905-I934 HydrophobicContact CD1-CG1 4.32Å; L905-A937 HydrophobicContact CD1-CB 3.93Å; L905-F941 HydrophobicContact CD2-CB 4.15Å; L905-F941 HydrophobicContact CD2-CD1 3.92Å; L905-F941 HydrophobicContact CD2-CG 4.27Å
906	K	95.1	Very high	94.3	Very high	137 Å²	137	54.6 Å²	54.6	60%	0.596	28%	0.284	S	S	*	.	H	α-helix	trans	-60.5	-31.1	175.3	-176.3	170.4	-179.2	173.9	0	113.6	R902 G904 E909 S910	R902-K906 WeakPolarHBondContact O-CB 3.07Å; R902-K906 PolarHBondContact O-N 3.14Å; R902-K906 VanDerWaalsContact O-N 3.14Å; G904-K906 PolarHBondContact O-N 3.15Å; K906-E909 WeakPolarHBondContact CA-OE2 3.34Å; K906-S910 WeakPolarHBondContact O-CB 3.48Å; K906-S910 PolarHBondContact O-N 3.05Å; K906-S910 PolarHBondContact O-OG 3.01Å
907	S	95.1	Very high	94	Very high	68 Å²	68	55.1 Å²	55.1	48%	0.476	29%	0.293	S	S	.	.	H	α-helix	trans	-70.4	-38.7	174.7	-56.8	0	0	0	0	111.4	S903 G904 L905 S910 E911	S903-S907 WeakPolarHBondContact O-CB 3.22Å; S903-S907 PolarHBondContact O-N 3.17Å; S903-S907 VanDerWaalsContact O-N 3.11Å; S903-S907 PolarHBondContact O-OG 3.41Å; G904-S907 WeakPolarHBondContact O-CA 3.39Å; G904-S907 WeakPolarHBondContact O-CB 3.48Å; G904-S907 PolarHBondContact O-N 3.21Å; L905-S907 PolarHBondContact O-N 2.96Å; S907-S910 PolarHBondContact O-N 3.07Å; S907-E911 PolarHBondContact O-N 3.2Å
908	V	96.1	Very high	93.6	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	30%	0.304	C	S	.	.	H	α-helix	trans	-70.4	-36.6	175.2	-174.4	0	0	0	0	111.6	F781 G904 L905 L912 V930 F933 I934	F781-V908 HydrophobicContact CB-CG2 4.15Å; F781-V908 HydrophobicContact CD1-CG2 3.79Å; F781-V908 HydrophobicContact CG-CG2 4.18Å; G904-V908 WeakPolarHBondContact O-CG2 3.3Å; G904-V908 PolarHBondContact O-N 2.73Å; L905-V908 PolarHBondContact O-N 2.92Å; V908-L912 WeakPolarHBondContact O-CB 3.49Å; V908-L912 PolarHBondContact O-N 2.95Å; V908-V930 HydrophobicContact CG1-CG1 3.42Å; V908-V930 VanDerWaalsContact CG1-CG1 3.42Å; V908-F933 HydrophobicContact CG1-CD1 4.39Å; V908-F933 HydrophobicContact CG1-CE1 4.42Å; V908-I934 HydrophobicContact CG1-CD1 4.04Å; V908-I934 HydrophobicContact CG1-CG1 4.28Å
909	E	95.1	Very high	93	Very high	72 Å²	72	64 Å²	64	34%	0.336	34%	0.339	S	S	.	.	H	α-helix	trans	-60.7	-47.6	170.9	-71.4	170.1	164.3	0	0	111.5	L905 K906 E911 L912 D913 I934 S938	L905-E909 WeakPolarHBondContact O-CG 3.35Å; L905-E909 PolarHBondContact O-N 2.92Å; K906-E909 WeakPolarHBondContact CA-OE2 3.34Å; E909-E911 VanDerWaalsContact C-N 3.34Å; E909-E911 PolarHBondContact O-N 2.9Å; E909-L912 PolarHBondContact O-N 3.2Å; E909-D913 PolarHBondContact O-N 3.39Å; E909-I934 HydrophobicContact CB-CD1 4.32Å; E909-I934 HydrophobicContact CG-CD1 3.77Å; E909-I934 HydrophobicContact CG-CG1 4.31Å; E909-I934 HydrophobicContact CG-CG2 4.13Å; E909-S938 PolarHBondContact OE1-OG 3.38Å
910	S	95.4	Very high	92	Very high	71 Å²	71	69.5 Å²	69.5	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-40.2	179.3	-56.6	0	0	0	0	112.3	K906 S907 F914	K906-S910 WeakPolarHBondContact O-CB 3.48Å; K906-S910 PolarHBondContact O-N 3.05Å; K906-S910 PolarHBondContact O-OG 3.01Å; S907-S910 PolarHBondContact O-N 3.07Å; S910-F914 PolarHBondContact O-N 3.1Å; S910-F914 VanDerWaalsContact O-N 3.12Å
911	E	94.6	Very high	91.4	Very high	9 Å²	9	72.4 Å²	72.4	4%	0.042	37%	0.367	C	S	.	.	H	α-helix	trans	-72.6	-36.8	175.8	-178.5	59.7	-161.5	0	0	112.1	H771 Q774 S907 E909 D913 F914 Q915 F926	H771-E911 WeakPolarHBondContact CB-OE1 3.49Å; H771-E911 IonicContact CE1-OE2 2.73Å; H771-E911 IonicContact CG-OE1 2.58Å; H771-E911 IonicContact CG-OE2 2.59Å; H771-E911 IonicContact ND1-OE1 2.68Å; H771-E911 PolarHBondContact ND1-OE1 2.95Å; H771-E911 IonicContact ND1-OE2 3.68Å; H771-E911 PolarHBondContact ND1-OE2 3.23Å; Q774-E911 HydrophobicContact CB-CB 4.29Å; Q774-E911 VanDerWaalsContact CB-CD 3.4Å; Q774-E911 HydrophobicContact CB-CG 3.75Å; Q774-E911 VanDerWaalsContact CB-OE2 3.23Å; Q774-E911 WeakPolarHBondContact CB-OE2 3.44Å; S907-E911 PolarHBondContact O-N 3.2Å; E909-E911 VanDerWaalsContact C-N 3.34Å; E909-E911 PolarHBondContact O-N 2.9Å; E911-D913 VanDerWaalsContact C-N 3.35Å; E911-D913 PolarHBondContact O-N 3.38Å; E911-F914 PolarHBondContact O-N 2.96Å; E911-Q915 HydrophobicContact CG-CG 4.44Å; E911-Q915 WeakPolarHBondContact O-CG 3.38Å; E911-Q915 PolarHBondContact O-N 3.44Å; E911-Q915 WeakPolarHBondContact OE1-CG 3.29Å; E911-Q915 PolarHBondContact OE1-NE2 2.95Å; E911-F926 HydrophobicContact CB-CZ 4.33Å; E911-F926 HydrophobicContact CG-CE1 3.89Å; E911-F926 HydrophobicContact CG-CE2 4.49Å; E911-F926 HydrophobicContact CG-CZ 3.55Å
912	L	94.6	Very high	90.6	Very high	5 Å²	5	80.1 Å²	80.1	3%	0.026	41%	0.414	C	S	.	.	H	α-helix	trans	-59.7	-46.2	173.3	175.9	61.6	0	0	0	111.1	V908 E909 F914 Q915 K916 V927 V930 I934	V908-L912 WeakPolarHBondContact O-CB 3.49Å; V908-L912 PolarHBondContact O-N 2.95Å; E909-L912 PolarHBondContact O-N 3.2Å; L912-F914 VanDerWaalsContact C-N 3.33Å; L912-F914 PolarHBondContact O-N 3.26Å; L912-Q915 PolarHBondContact O-N 3.15Å; L912-K916 HydrophobicContact CD1-CG 4.17Å; L912-K916 HydrophobicContact CG-CD 4.25Å; L912-K916 HydrophobicContact CG-CG 4.35Å; L912-K916 WeakPolarHBondContact O-CB 3.38Å; L912-K916 VanDerWaalsContact O-CG 3.31Å; L912-K916 WeakPolarHBondContact O-CG 3.47Å; L912-K916 PolarHBondContact O-N 3.47Å; L912-V927 HydrophobicContact CD1-CB 4.27Å; L912-V927 HydrophobicContact CD1-CG1 4.02Å; L912-V927 HydrophobicContact CD1-CG2 4.4Å; L912-V930 HydrophobicContact CB-CG1 3.99Å; L912-V930 HydrophobicContact CD1-CB 4.28Å; L912-V930 HydrophobicContact CD1-CG1 4.24Å; L912-V930 HydrophobicContact CD2-CG1 4.35Å; L912-V930 HydrophobicContact CG-CG1 4.4Å; L912-I934 HydrophobicContact CB-CD1 4.03Å; L912-I934 HydrophobicContact CD2-CD1 3.64Å; L912-I934 HydrophobicContact CG-CD1 4.46Å
913	D	93.9	Very high	90	Very high	82 Å²	82	75.2 Å²	75.2	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-69.4	-30.3	179.5	-73.5	-11.1	0	0	0	112.4	E909 E911 K916 N917	E909-D913 PolarHBondContact O-N 3.39Å; E911-D913 VanDerWaalsContact C-N 3.35Å; E911-D913 PolarHBondContact O-N 3.38Å; D913-K916 WeakPolarHBondContact OD1-CD 3.49Å; D913-K916 IonicContact OD1-NZ 3.23Å; D913-K916 PolarHBondContact OD1-NZ 3.31Å; D913-N917 PolarHBondContact O-ND2 2.81Å
914	F	94	Very high	89.8	Confident	67 Å²	67	72.8 Å²	72.8	29%	0.294	39%	0.391	S	S	.	.	H	α-helix	trans	-63.6	-47.7	168.1	175.8	-99.5	0	0	0	112.3	H771 S910 E911 L912 N917 R918	H771-F914 HydrophobicContact CB-CE1 4.39Å; H771-F914 AromaticContact CD2-CE1 3.55Å; H771-F914 AromaticContact CD2-CZ 3.74Å; H771-F914 AromaticContact CE1-CD1 3.47Å; H771-F914 VanDerWaalsContact CE1-CD1 3.47Å; H771-F914 WeakPolarHBondContact CE1-CD1 3.29Å; H771-F914 AromaticContact CE1-CD2 3.97Å; H771-F914 AromaticContact CE1-CE1 3.22Å; H771-F914 WeakPolarHBondContact CE1-CE1 3.37Å; H771-F914 AromaticContact CE1-CE2 3.73Å; H771-F914 AromaticContact CE1-CG 3.83Å; H771-F914 AromaticContact CE1-CZ 3.34Å; H771-F914 WeakPolarHBondContact CE1-CZ 3.34Å; H771-F914 AromaticContact CG-CD1 3.99Å; H771-F914 AromaticContact CG-CE1 3.51Å; H771-F914 AromaticContact ND1-CD1 3.38Å; H771-F914 WeakPolarHBondContact ND1-CD1 3.42Å; H771-F914 AromaticContact ND1-CE1 3.31Å; H771-F914 VanDerWaalsContact ND1-CE1 3.31Å; H771-F914 WeakPolarHBondContact ND1-CE1 3.3Å; H771-F914 AromaticContact ND1-CZ 3.92Å; H771-F914 AromaticContact NE2-CE1 3.39Å; H771-F914 WeakPolarHBondContact NE2-CE1 3.49Å; H771-F914 AromaticContact NE2-CE2 3.85Å; H771-F914 AromaticContact NE2-CZ 3.2Å; H771-F914 WeakPolarHBondContact NE2-CZ 3.48Å; S910-F914 PolarHBondContact O-N 3.1Å; S910-F914 VanDerWaalsContact O-N 3.12Å; E911-F914 PolarHBondContact O-N 2.96Å; L912-F914 VanDerWaalsContact C-N 3.33Å; L912-F914 PolarHBondContact O-N 3.26Å; F914-N917 PolarHBondContact O-N 3.04Å; F914-R918 VanDerWaalsContact CZ-NE 3.32Å
915	Q	91.4	Very high	89.8	Confident	10 Å²	10	75.6 Å²	75.6	5%	0.047	40%	0.399	C	S	.	.	H	α-helix	trans	-73.4	-31.5	-177.1	-61.5	-66.1	-9	0	0	112.8	N770 E911 L912 N917 R918 F926 V927	N770-Q915 PolarHBondContact ND2-NE2 2.93Å; N770-Q915 PolarHBondContact ND2-OE1 3.01Å; E911-Q915 HydrophobicContact CG-CG 4.44Å; E911-Q915 WeakPolarHBondContact O-CG 3.38Å; E911-Q915 PolarHBondContact O-N 3.44Å; E911-Q915 WeakPolarHBondContact OE1-CG 3.29Å; E911-Q915 PolarHBondContact OE1-NE2 2.95Å; L912-Q915 PolarHBondContact O-N 3.15Å; Q915-N917 PolarHBondContact O-N 3.3Å; Q915-R918 PolarHBondContact O-N 2.65Å; Q915-F926 HydrophobicContact CB-CD1 3.94Å; Q915-F926 HydrophobicContact CB-CE1 4.29Å; Q915-F926 HydrophobicContact CG-CD1 3.8Å; Q915-F926 HydrophobicContact CG-CE1 3.92Å; Q915-V927 HydrophobicContact CB-CG2 3.81Å
916	K	90.3	Very high	89.8	Confident	106 Å²	106	75.2 Å²	75.2	46%	0.461	40%	0.397	S	S	.	.	H	α-helix	trans	-57.4	-31.9	171	-80.3	174	-172.7	152.2	0	113.1	L912 D913 R918 V927	L912-K916 HydrophobicContact CD1-CG 4.17Å; L912-K916 HydrophobicContact CG-CD 4.25Å; L912-K916 HydrophobicContact CG-CG 4.35Å; L912-K916 WeakPolarHBondContact O-CB 3.38Å; L912-K916 VanDerWaalsContact O-CG 3.31Å; L912-K916 WeakPolarHBondContact O-CG 3.47Å; L912-K916 PolarHBondContact O-N 3.47Å; D913-K916 WeakPolarHBondContact OD1-CD 3.49Å; D913-K916 IonicContact OD1-NZ 3.23Å; D913-K916 PolarHBondContact OD1-NZ 3.31Å; K916-R918 VanDerWaalsContact C-N 3.28Å; K916-R918 PolarHBondContact O-N 3.03Å; K916-V927 HydrophobicContact CG-CG1 3.85Å
917	N	88.4	Confident	89.7	Confident	144 Å²	144	70.5 Å²	70.5	77%	0.77	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	11.3	-176.8	-76.9	-64.6	0	0	0	113.6	D913 F914 Q915	D913-N917 PolarHBondContact O-ND2 2.81Å; F914-N917 PolarHBondContact O-N 3.04Å; Q915-N917 PolarHBondContact O-N 3.3Å
918	R	85.3	Confident	89.6	Confident	115 Å²	115	71 Å²	71	43%	0.434	38%	0.383	S	S	.	.	S	Bend	trans	-111.5	156.4	175.4	-75.8	-178.6	168.9	-99.8	-1	111.9	N770 F914 Q915 K916 Q920	N770-R918 WeakPolarHBondContact ND2-CD 3.32Å; N770-R918 PolarHBondContact ND2-NE 3.23Å; F914-R918 VanDerWaalsContact CZ-NE 3.32Å; Q915-R918 PolarHBondContact O-N 2.65Å; K916-R918 VanDerWaalsContact C-N 3.28Å; K916-R918 PolarHBondContact O-N 3.03Å; R918-Q920 PolarHBondContact O-N 2.9Å
919	P	81.6	Confident	89.6	Confident	118 Å²	118	72.6 Å²	72.6	77%	0.766	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-56.7	134.9	166	-20.6	32.9	0	0	0	110.4	E921	P919-E921 PolarHBondContact O-N 2.82Å
920	Q	73.4	Confident	89.6	Confident	150 Å²	150	69.2 Å²	69.2	70%	0.701	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-77.8	118.6	-177.9	-171	171.4	6.6	0	0	111	R918	R918-Q920 PolarHBondContact O-N 2.9Å
921	E	80.8	Confident	89.6	Confident	126 Å²	126	67.7 Å²	67.7	59%	0.589	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-83.3	145.8	-179.6	-66.5	-179.1	-172.1	0	0	112	P919 G923 D924	P919-E921 PolarHBondContact O-N 2.82Å; E921-G923 PolarHBondContact O-N 3.49Å; E921-G923 VanDerWaalsContact O-N 3.14Å; E921-D924 HydrophobicContact CB-CB 4.43Å; E921-D924 PolarHBondContact O-N 3.31Å; E921-D924 VanDerWaalsContact O-N 3.12Å
922	V	78.1	Confident	89.6	Confident	162 Å²	162	74 Å²	74	98%	0.982	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	112.2	-177.6	-179.6	0	0	0	0	110
923	G	81.3	Confident	89.7	Confident	44 Å²	44	75.1 Å²	75.1	45%	0.454	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.7	-13.3	-177.1	0	0	0	0	0	114.1	E921 K925	E921-G923 PolarHBondContact O-N 3.49Å; E921-G923 VanDerWaalsContact O-N 3.14Å; G923-K925 PolarHBondContact O-N 3.29Å
924	D	91.9	Very high	89.8	Confident	18 Å²	18	72.2 Å²	72.2	10%	0.096	39%	0.385	C	S	.	.			trans	-79.6	112.4	173.6	-172.9	8.7	0	0	0	111.2	R775 E921 F926	R775-D924 IonicContact CZ-OD1 2.92Å; R775-D924 IonicContact CZ-OD2 3.73Å; R775-D924 IonicContact NH1-OD1 2.93Å; R775-D924 PolarHBondContact NH1-OD1 3.18Å; R775-D924 IonicContact NH1-OD2 3.36Å; R775-D924 PolarHBondContact NH1-OD2 2.87Å; R775-D924 VanDerWaalsContact NH1-OD2 3.12Å; R775-D924 IonicContact NH2-OD1 3.3Å; R775-D924 IonicContact NH2-OD2 2.92Å; R775-D924 PolarHBondContact NH2-OD2 3.33Å; E921-D924 HydrophobicContact CB-CB 4.43Å; E921-D924 PolarHBondContact O-N 3.31Å; E921-D924 VanDerWaalsContact O-N 3.12Å; D924-F926 WeakPolarHBondContact OD1-CB 3.41Å; D924-F926 PolarHBondContact OD1-N 3.45Å
925	K	94	Very high	89.8	Confident	74 Å²	74	74 Å²	74	32%	0.322	40%	0.401	S	S	.	.			trans	-100.7	1.4	177.2	-61.1	-176.1	171.7	176.8	0	112.7	L717 T718 E721 G923 V927 S928 V929	L717-K925 PolarHBondContact O-N 2.87Å; T718-K925 HydrophobicContact CG2-CD 4.32Å; E721-K925 IonicContact OE1-NZ 2.76Å; E721-K925 PolarHBondContact OE1-NZ 3.48Å; E721-K925 IonicContact OE2-NZ 3.12Å; E721-K925 PolarHBondContact OE2-NZ 3.44Å; G923-K925 PolarHBondContact O-N 3.29Å; K925-V927 PolarHBondContact O-N 3.27Å; K925-S928 PolarHBondContact O-N 2.88Å; K925-V929 HydrophobicContact CB-CG2 4.17Å; K925-V929 PolarHBondContact O-N 2.76Å
926	F	94.9	Very high	90	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-52.2	-57.5	-173.1	-172.6	-88.8	0	0	0	112.7	M719 R775 E911 Q915 D924 S928 V929 V930	M719-F926 HydrophobicContact CE-CE2 4.44Å; M719-F926 HydrophobicContact CG-CB 4.47Å; M719-F926 HydrophobicContact CG-CD2 4.04Å; M719-F926 HydrophobicContact SD-CD2 3.43Å; M719-F926 WeakPolarHBondContact SD-CD2 3.27Å; M719-F926 HydrophobicContact SD-CE2 3.76Å; M719-F926 HydrophobicContact SD-CG 4.48Å; R775-F926 HydrophobicContact CB-CD2 4.4Å; R775-F926 HydrophobicContact CB-CE2 4.2Å; R775-F926 HydrophobicContact CG-CD2 3.93Å; R775-F926 HydrophobicContact CG-CE2 3.9Å; E911-F926 HydrophobicContact CB-CZ 4.33Å; E911-F926 HydrophobicContact CG-CE1 3.89Å; E911-F926 HydrophobicContact CG-CE2 4.49Å; E911-F926 HydrophobicContact CG-CZ 3.55Å; Q915-F926 HydrophobicContact CB-CD1 3.94Å; Q915-F926 HydrophobicContact CB-CE1 4.29Å; Q915-F926 HydrophobicContact CG-CD1 3.8Å; Q915-F926 HydrophobicContact CG-CE1 3.92Å; D924-F926 WeakPolarHBondContact OD1-CB 3.41Å; D924-F926 PolarHBondContact OD1-N 3.45Å; F926-S928 VanDerWaalsContact C-N 3.25Å; F926-S928 PolarHBondContact O-N 3.02Å; F926-V929 PolarHBondContact O-N 3.28Å; F926-V930 HydrophobicContact CD1-CB 4.4Å; F926-V930 HydrophobicContact CD1-CG2 4.13Å; F926-V930 HydrophobicContact CD2-CG2 3.95Å; F926-V930 HydrophobicContact CE1-CB 4.21Å; F926-V930 HydrophobicContact CE1-CG1 4.26Å; F926-V930 HydrophobicContact CE1-CG2 3.97Å; F926-V930 HydrophobicContact CE2-CG2 3.77Å; F926-V930 HydrophobicContact CG-CG2 4.11Å; F926-V930 HydrophobicContact CZ-CB 4.42Å; F926-V930 HydrophobicContact CZ-CG1 4.35Å; F926-V930 HydrophobicContact CZ-CG2 3.78Å; F926-V930 WeakPolarHBondContact O-CB 3.25Å; F926-V930 VanDerWaalsContact O-CG2 3.26Å; F926-V930 WeakPolarHBondContact O-CG2 3.41Å; F926-V930 PolarHBondContact O-N 3.3Å
927	V	94.1	Very high	90.2	Very high	37 Å²	37	73.1 Å²	73.1	22%	0.224	41%	0.406	C	S	.	.	H	α-helix	trans	-59.1	-37.2	-176.8	178	0	0	0	0	111.9	L912 Q915 K916 K925 S931	L912-V927 HydrophobicContact CD1-CB 4.27Å; L912-V927 HydrophobicContact CD1-CG1 4.02Å; L912-V927 HydrophobicContact CD1-CG2 4.4Å; Q915-V927 HydrophobicContact CB-CG2 3.81Å; K916-V927 HydrophobicContact CG-CG1 3.85Å; K925-V927 PolarHBondContact O-N 3.27Å; V927-S931 WeakPolarHBondContact O-CB 3.43Å; V927-S931 PolarHBondContact O-N 3.29Å; V927-S931 VanDerWaalsContact O-N 3.12Å; V927-S931 PolarHBondContact O-OG 2.96Å
928	S	92.3	Very high	90.5	Very high	80 Å²	80	68 Å²	68	56%	0.559	38%	0.381	S	S	*	.	H	α-helix	trans	-67.4	-58.4	178.3	-176.3	0	0	0	0	111.7	K925 F926 V930 S931 Q932	K925-S928 PolarHBondContact O-N 2.88Å; F926-S928 VanDerWaalsContact C-N 3.25Å; F926-S928 PolarHBondContact O-N 3.02Å; S928-V930 PolarHBondContact O-N 3.11Å; S928-S931 PolarHBondContact O-N 3.18Å; S928-Q932 PolarHBondContact O-N 3.39Å
929	V	95.8	Very high	90.9	Very high	34 Å²	34	70.4 Å²	70.4	21%	0.206	40%	0.395	C	S	.	.	H	α-helix	trans	-66.9	-37.1	-175.5	176.2	0	0	0	0	111.7	M719 K782 K925 F926 F933	M719-V929 HydrophobicContact CB-CB 3.96Å; M719-V929 HydrophobicContact CB-CG1 3.74Å; M719-V929 HydrophobicContact CB-CG2 4.25Å; M719-V929 HydrophobicContact CG-CB 4.18Å; M719-V929 HydrophobicContact CG-CG1 4.3Å; K782-V929 HydrophobicContact CD-CG1 4.1Å; K925-V929 HydrophobicContact CB-CG2 4.17Å; K925-V929 PolarHBondContact O-N 2.76Å; F926-V929 PolarHBondContact O-N 3.28Å; V929-F933 WeakPolarHBondContact O-CB 3.25Å; V929-F933 PolarHBondContact O-N 2.87Å
930	V	95.9	Very high	91.6	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-77.3	-34.3	-178.1	177.8	0	0	0	0	112.1	M719 V908 L912 F926 S928 F933 I934	M719-V930 HydrophobicContact CE-CG2 3.62Å; M719-V930 HydrophobicContact CG-CG2 4.35Å; M719-V930 HydrophobicContact SD-CG2 4.17Å; V908-V930 HydrophobicContact CG1-CG1 3.42Å; V908-V930 VanDerWaalsContact CG1-CG1 3.42Å; L912-V930 HydrophobicContact CB-CG1 3.99Å; L912-V930 HydrophobicContact CD1-CB 4.28Å; L912-V930 HydrophobicContact CD1-CG1 4.24Å; L912-V930 HydrophobicContact CD2-CG1 4.35Å; L912-V930 HydrophobicContact CG-CG1 4.4Å; F926-V930 HydrophobicContact CD1-CB 4.4Å; F926-V930 HydrophobicContact CD1-CG2 4.13Å; F926-V930 HydrophobicContact CD2-CG2 3.95Å; F926-V930 HydrophobicContact CE1-CB 4.21Å; F926-V930 HydrophobicContact CE1-CG1 4.26Å; F926-V930 HydrophobicContact CE1-CG2 3.97Å; F926-V930 HydrophobicContact CE2-CG2 3.77Å; F926-V930 HydrophobicContact CG-CG2 4.11Å; F926-V930 HydrophobicContact CZ-CB 4.42Å; F926-V930 HydrophobicContact CZ-CG1 4.35Å; F926-V930 HydrophobicContact CZ-CG2 3.78Å; F926-V930 WeakPolarHBondContact O-CB 3.25Å; F926-V930 VanDerWaalsContact O-CG2 3.26Å; F926-V930 WeakPolarHBondContact O-CG2 3.41Å; F926-V930 PolarHBondContact O-N 3.3Å; S928-V930 PolarHBondContact O-N 3.11Å; V930-F933 PolarHBondContact O-N 3.03Å; V930-I934 HydrophobicContact CG1-CD1 3.81Å; V930-I934 HydrophobicContact CG1-CG1 4.29Å; V930-I934 WeakPolarHBondContact O-CB 3.25Å; V930-I934 WeakPolarHBondContact O-CG1 3.38Å; V930-I934 PolarHBondContact O-N 3.18Å
931	S	94.5	Very high	92.6	Very high	39 Å²	39	59.4 Å²	59.4	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-43	172.2	-61.6	0	0	0	0	111.7	V927 S928 T935	V927-S931 WeakPolarHBondContact O-CB 3.43Å; V927-S931 PolarHBondContact O-N 3.29Å; V927-S931 VanDerWaalsContact O-N 3.12Å; V927-S931 PolarHBondContact O-OG 2.96Å; S928-S931 PolarHBondContact O-N 3.18Å; S931-T935 PolarHBondContact O-N 3.17Å; S931-T935 VanDerWaalsContact O-N 3.11Å; S931-T935 PolarHBondContact O-OG1 3.26Å
932	Q	94.8	Very high	93.3	Very high	142 Å²	142	56.1 Å²	56.1	66%	0.664	33%	0.327	S	S	*	.	H	α-helix	trans	-65.1	-43.7	175.3	-170.2	-176.9	15.9	0	0	111.4	S928 T935 V936	S928-Q932 PolarHBondContact O-N 3.39Å; Q932-T935 PolarHBondContact O-N 3.3Å; Q932-V936 PolarHBondContact O-N 3.02Å
933	F	96.9	Very high	94.1	Very high	28 Å²	28	51.6 Å²	51.6	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-51.5	176.7	168.9	-106.1	0	0	0	112.1	F781 K782 F785 V908 V929 V930 T935 V936 A937	F781-F933 AromaticContact CD1-CE1 3.86Å; F781-F933 HydrophobicContact CD1-CE1 3.86Å; F781-F933 AromaticContact CD1-CZ 3.82Å; F781-F933 HydrophobicContact CD1-CZ 3.82Å; F781-F933 HydrophobicContact CE1-CE1 4.08Å; F781-F933 AromaticContact CE1-CZ 3.9Å; F781-F933 HydrophobicContact CE1-CZ 3.9Å; K782-F933 HydrophobicContact CB-CD1 4.39Å; K782-F933 HydrophobicContact CB-CD2 4.2Å; K782-F933 HydrophobicContact CB-CE1 4.37Å; K782-F933 HydrophobicContact CB-CE2 4.16Å; K782-F933 HydrophobicContact CB-CG 4.31Å; K782-F933 HydrophobicContact CB-CZ 4.26Å; K782-F933 HydrophobicContact CD-CB 4.39Å; K782-F933 HydrophobicContact CD-CD2 4.46Å; K782-F933 HydrophobicContact CD-CG 4.35Å; K782-F933 HydrophobicContact CG-CD2 3.92Å; K782-F933 HydrophobicContact CG-CE2 4.24Å; K782-F933 HydrophobicContact CG-CG 4.21Å; F785-F933 HydrophobicContact CB-CE2 3.87Å; F785-F933 HydrophobicContact CB-CZ 3.88Å; F785-F933 HydrophobicContact CD1-CE2 4.16Å; F785-F933 HydrophobicContact CD1-CZ 4.49Å; F785-F933 HydrophobicContact CD2-CZ 4.2Å; F785-F933 AromaticContact CG-CE2 3.98Å; F785-F933 HydrophobicContact CG-CE2 3.98Å; F785-F933 AromaticContact CG-CZ 3.94Å; F785-F933 HydrophobicContact CG-CZ 3.94Å; V908-F933 HydrophobicContact CG1-CD1 4.39Å; V908-F933 HydrophobicContact CG1-CE1 4.42Å; V929-F933 WeakPolarHBondContact O-CB 3.25Å; V929-F933 PolarHBondContact O-N 2.87Å; V930-F933 PolarHBondContact O-N 3.03Å; F933-T935 VanDerWaalsContact C-N 3.3Å; F933-T935 PolarHBondContact O-N 3.14Å; F933-V936 PolarHBondContact O-N 3.3Å; F933-A937 HydrophobicContact CD2-CB 4.28Å; F933-A937 HydrophobicContact CE1-CB 4.08Å; F933-A937 HydrophobicContact CE2-CB 3.84Å; F933-A937 HydrophobicContact CZ-CB 3.72Å; F933-A937 WeakPolarHBondContact O-CB 3.39Å; F933-A937 PolarHBondContact O-N 2.96Å
934	I	96.1	Very high	94.8	Very high	21 Å²	21	49.5 Å²	49.5	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-41.2	179.1	-76.2	170.2	0	0	0	111.1	L905 V908 E909 L912 V930 V936 A937 S938	L905-I934 HydrophobicContact CD1-CG1 4.32Å; V908-I934 HydrophobicContact CG1-CD1 4.04Å; V908-I934 HydrophobicContact CG1-CG1 4.28Å; E909-I934 HydrophobicContact CB-CD1 4.32Å; E909-I934 HydrophobicContact CG-CD1 3.77Å; E909-I934 HydrophobicContact CG-CG1 4.31Å; E909-I934 HydrophobicContact CG-CG2 4.13Å; L912-I934 HydrophobicContact CB-CD1 4.03Å; L912-I934 HydrophobicContact CD2-CD1 3.64Å; L912-I934 HydrophobicContact CG-CD1 4.46Å; V930-I934 HydrophobicContact CG1-CD1 3.81Å; V930-I934 HydrophobicContact CG1-CG1 4.29Å; V930-I934 WeakPolarHBondContact O-CB 3.25Å; V930-I934 WeakPolarHBondContact O-CG1 3.38Å; V930-I934 PolarHBondContact O-N 3.18Å; I934-V936 VanDerWaalsContact C-N 3.29Å; I934-V936 PolarHBondContact O-N 3.05Å; I934-A937 PolarHBondContact O-N 3.2Å; I934-S938 WeakPolarHBondContact O-CB 3.3Å; I934-S938 PolarHBondContact O-N 2.91Å; I934-S938 PolarHBondContact O-OG 2.82Å; I934-S938 VanDerWaalsContact O-OG 3.07Å
935	T	94.1	Very high	95	Very high	105 Å²	105	50.9 Å²	50.9	64%	0.644	28%	0.282	S	S	*	.	H	α-helix	trans	-56.4	-42.2	178.3	-56	0	0	0	0	112.3	S931 Q932 F933	S931-T935 PolarHBondContact O-N 3.17Å; S931-T935 VanDerWaalsContact O-N 3.11Å; S931-T935 PolarHBondContact O-OG1 3.26Å; Q932-T935 PolarHBondContact O-N 3.3Å; F933-T935 VanDerWaalsContact C-N 3.3Å; F933-T935 PolarHBondContact O-N 3.14Å
936	V	95	Very high	95.1	Very high	97 Å²	97	52 Å²	52	59%	0.588	29%	0.291	S	S	*	.	H	α-helix	trans	-80.5	-40.4	177.9	-179.8	0	0	0	0	111.6	Q932 F933 I934 S940	Q932-V936 PolarHBondContact O-N 3.02Å; F933-V936 PolarHBondContact O-N 3.3Å; I934-V936 VanDerWaalsContact C-N 3.29Å; I934-V936 PolarHBondContact O-N 3.05Å; V936-S940 WeakPolarHBondContact O-CB 3.11Å; V936-S940 PolarHBondContact O-N 2.67Å
937	A	95.3	Very high	95.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-45.9	-175.8	0	0	0	0	0	112.2	F785 L905 F933 I934 F939 S940 F941	F785-A937 HydrophobicContact CD1-CB 4.24Å; F785-A937 HydrophobicContact CD2-CB 4.39Å; F785-A937 HydrophobicContact CE1-CB 3.82Å; F785-A937 HydrophobicContact CE2-CB 3.98Å; F785-A937 HydrophobicContact CZ-CB 3.69Å; F785-A937 WeakPolarHBondContact CZ-O 3.4Å; L905-A937 HydrophobicContact CD1-CB 3.93Å; F933-A937 HydrophobicContact CD2-CB 4.28Å; F933-A937 HydrophobicContact CE1-CB 4.08Å; F933-A937 HydrophobicContact CE2-CB 3.84Å; F933-A937 HydrophobicContact CZ-CB 3.72Å; F933-A937 WeakPolarHBondContact O-CB 3.39Å; F933-A937 PolarHBondContact O-N 2.96Å; I934-A937 PolarHBondContact O-N 3.2Å; A937-F939 PolarHBondContact O-N 3.49Å; A937-S940 CarbonylContact O-C 3.58Å; A937-S940 PolarHBondContact O-N 2.95Å; A937-F941 WeakPolarHBondContact O-CB 3.45Å; A937-F941 PolarHBondContact O-N 3.18Å
938	S	94.5	Very high	95.2	Very high	36 Å²	36	52.8 Å²	52.8	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-37.6	179.5	-52.9	0	0	0	0	111.8	E909 I934 F941 S942	E909-S938 PolarHBondContact OE1-OG 3.38Å; I934-S938 WeakPolarHBondContact O-CB 3.3Å; I934-S938 PolarHBondContact O-N 2.91Å; I934-S938 PolarHBondContact O-OG 2.82Å; I934-S938 VanDerWaalsContact O-OG 3.07Å; S938-F941 PolarHBondContact O-N 2.75Å; S938-S942 PolarHBondContact O-N 2.61Å
939	F	94.1	Very high	95.4	Very high	165 Å²	165	51.8 Å²	51.8	72%	0.724	29%	0.294	S	S	*	.	H	α-helix	trans	-63.2	-51.5	171.6	179.8	-96.9	0	0	0	111.8	A937 F941 S942 D943	A937-F939 PolarHBondContact O-N 3.49Å; F939-F941 PolarHBondContact O-N 3.41Å; F939-S942 PolarHBondContact O-N 3.3Å; F939-D943 PolarHBondContact O-N 3.37Å
940	S	94.8	Very high	95.5	Very high	28 Å²	28	54.5 Å²	54.5	20%	0.196	31%	0.305	C	S	.	.	H	α-helix	trans	-67.7	-16.9	178.7	-175.6	0	0	0	0	113.8	V936 A937 V944	V936-S940 WeakPolarHBondContact O-CB 3.11Å; V936-S940 PolarHBondContact O-N 2.67Å; A937-S940 CarbonylContact O-C 3.58Å; A937-S940 PolarHBondContact O-N 2.95Å; S940-V944 WeakPolarHBondContact O-CG2 3.24Å
941	F	96.1	Very high	95.5	Very high	9 Å²	9	54.5 Å²	54.5	4%	0.039	30%	0.304	C	S	.	.	H	α-helix	trans	-88.9	-41.7	176.2	-173.6	-117	0	0	0	111.5	F785 I789 I898 L901 R902 L905 A937 S938 F939 D943 V944 E945	F785-F941 HydrophobicContact CZ-CB 4.3Å; I789-F941 HydrophobicContact CD1-CD2 4.34Å; I898-F941 HydrophobicContact CG2-CE2 4.48Å; I898-F941 HydrophobicContact CG2-CZ 4.26Å; L901-F941 HydrophobicContact CB-CD2 3.96Å; L901-F941 HydrophobicContact CB-CE2 3.41Å; L901-F941 VanDerWaalsContact CB-CE2 3.41Å; L901-F941 HydrophobicContact CB-CZ 3.96Å; L901-F941 HydrophobicContact CD1-CD2 4.09Å; L901-F941 HydrophobicContact CD1-CE2 3.94Å; L901-F941 HydrophobicContact CG-CE2 4.34Å; R902-F941 HydrophobicContact CB-CE1 3.78Å; R902-F941 HydrophobicContact CB-CZ 3.74Å; R902-F941 HydrophobicContact CG-CE1 4.1Å; R902-F941 HydrophobicContact CG-CZ 4.48Å; L905-F941 HydrophobicContact CD2-CB 4.15Å; L905-F941 HydrophobicContact CD2-CD1 3.92Å; L905-F941 HydrophobicContact CD2-CG 4.27Å; A937-F941 WeakPolarHBondContact O-CB 3.45Å; A937-F941 PolarHBondContact O-N 3.18Å; S938-F941 PolarHBondContact O-N 2.75Å; F939-F941 PolarHBondContact O-N 3.41Å; F941-D943 VanDerWaalsContact C-N 3.33Å; F941-D943 PolarHBondContact O-N 3.04Å; F941-V944 CarbonylContact O-C 2.92Å; F941-V944 WeakPolarHBondContact O-CA 3.26Å; F941-V944 WeakPolarHBondContact O-CB 3.39Å; F941-V944 PolarHBondContact O-N 2.73Å; F941-E945 HydrophobicContact CD1-CG 4.05Å; F941-E945 HydrophobicContact CD2-CG 4.37Å; F941-E945 HydrophobicContact CE1-CG 3.61Å; F941-E945 VanDerWaalsContact CE1-OE1 3.29Å; F941-E945 WeakPolarHBondContact CE1-OE1 3.46Å; F941-E945 WeakPolarHBondContact CE1-OE2 3.43Å; F941-E945 HydrophobicContact CE2-CG 3.96Å; F941-E945 HydrophobicContact CG-CG 4.4Å; F941-E945 HydrophobicContact CZ-CG 3.55Å; F941-E945 WeakPolarHBondContact CZ-OE1 3.15Å; F941-E945 WeakPolarHBondContact O-CG 3.33Å; F941-E945 PolarHBondContact O-N 3.04Å
942	S	95.3	Very high	95.6	Very high	58 Å²	58	55 Å²	55	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-54.5	-50.6	172.6	-166.4	0	0	0	0	110.9	S938 F939 V944 E945 D946	S938-S942 PolarHBondContact O-N 2.61Å; F939-S942 PolarHBondContact O-N 3.3Å; S942-V944 PolarHBondContact O-N 3.44Å; S942-V944 VanDerWaalsContact O-N 3.08Å; S942-E945 PolarHBondContact O-N 3.03Å; S942-D946 WeakPolarHBondContact O-CB 3.22Å; S942-D946 VanDerWaalsContact O-CG 3.29Å; S942-D946 PolarHBondContact O-N 3.19Å; S942-D946 PolarHBondContact OG-OD2 2.6Å
943	D	95.1	Very high	95.6	Very high	66 Å²	66	54.7 Å²	54.7	35%	0.353	30%	0.3	S	S	.	.	H	α-helix	trans	-51.3	-33.8	174.7	169.4	72.4	0	0	0	113.4	K793 F939 F941 S947	K793-D943 VanDerWaalsContact CE-OD2 3.31Å; K793-D943 WeakPolarHBondContact CE-OD2 3.44Å; K793-D943 IonicContact NZ-OD2 2.79Å; K793-D943 PolarHBondContact NZ-OD2 3.03Å; F939-D943 PolarHBondContact O-N 3.37Å; F941-D943 VanDerWaalsContact C-N 3.33Å; F941-D943 PolarHBondContact O-N 3.04Å; D943-S947 WeakPolarHBondContact O-CB 3.31Å; D943-S947 PolarHBondContact O-N 2.67Å; D943-S947 VanDerWaalsContact O-N 3.15Å; D943-S947 PolarHBondContact O-OG 2.92Å
944	V	96	Very high	95.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-79.9	-39.1	175.7	165.7	0	0	0	0	112.6	I789 I792 K793 I796 I898 S940 F941 S942 L948	I789-V944 HydrophobicContact CD1-CG2 4.06Å; I789-V944 HydrophobicContact CG2-CG2 4.36Å; I792-V944 HydrophobicContact CG2-CG1 3.71Å; K793-V944 HydrophobicContact CD-CG2 4.14Å; K793-V944 HydrophobicContact CG-CG2 3.76Å; I796-V944 HydrophobicContact CD1-CG1 3.85Å; I898-V944 HydrophobicContact CD1-CG1 3.38Å; S940-V944 WeakPolarHBondContact O-CG2 3.24Å; F941-V944 CarbonylContact O-C 2.92Å; F941-V944 WeakPolarHBondContact O-CA 3.26Å; F941-V944 WeakPolarHBondContact O-CB 3.39Å; F941-V944 PolarHBondContact O-N 2.73Å; S942-V944 PolarHBondContact O-N 3.44Å; S942-V944 VanDerWaalsContact O-N 3.08Å; V944-L948 WeakPolarHBondContact O-CB 3.27Å; V944-L948 PolarHBondContact O-N 3.49Å
945	E	95.1	Very high	95.7	Very high	47 Å²	47	53.9 Å²	53.9	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-69.1	-41.4	176.6	-60.1	-151.7	116.1	0	0	111.9	R902 F941 S942 L948 A949	R902-E945 IonicContact CZ-OE1 3.66Å; R902-E945 IonicContact CZ-OE2 2.67Å; R902-E945 IonicContact NE-OE1 3.12Å; R902-E945 PolarHBondContact NE-OE1 3.21Å; R902-E945 IonicContact NE-OE2 2.75Å; R902-E945 VanDerWaalsContact NH2-CD 3.31Å; R902-E945 IonicContact NH2-OE1 2.72Å; R902-E945 PolarHBondContact NH2-OE1 3.3Å; R902-E945 IonicContact NH2-OE2 3.69Å; R902-E945 PolarHBondContact NH2-OE2 3.37Å; F941-E945 HydrophobicContact CD1-CG 4.05Å; F941-E945 HydrophobicContact CD2-CG 4.37Å; F941-E945 HydrophobicContact CE1-CG 3.61Å; F941-E945 VanDerWaalsContact CE1-OE1 3.29Å; F941-E945 WeakPolarHBondContact CE1-OE1 3.46Å; F941-E945 WeakPolarHBondContact CE1-OE2 3.43Å; F941-E945 HydrophobicContact CE2-CG 3.96Å; F941-E945 HydrophobicContact CG-CG 4.4Å; F941-E945 HydrophobicContact CZ-CG 3.55Å; F941-E945 WeakPolarHBondContact CZ-OE1 3.15Å; F941-E945 WeakPolarHBondContact O-CG 3.33Å; F941-E945 PolarHBondContact O-N 3.04Å; S942-E945 PolarHBondContact O-N 3.03Å; E945-L948 PolarHBondContact O-N 3.03Å; E945-A949 PolarHBondContact O-N 3.33Å
946	D	96.3	Very high	95.8	Very high	99 Å²	99	52.6 Å²	52.6	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-64.1	-45.3	174.9	-66.8	-47.3	0	0	0	110.8	S942 L948 A949 E950	S942-D946 WeakPolarHBondContact O-CB 3.22Å; S942-D946 VanDerWaalsContact O-CG 3.29Å; S942-D946 PolarHBondContact O-N 3.19Å; S942-D946 PolarHBondContact OG-OD2 2.6Å; D946-L948 VanDerWaalsContact C-N 3.33Å; D946-L948 PolarHBondContact O-N 3.06Å; D946-A949 WeakPolarHBondContact O-CB 3.16Å; D946-A949 PolarHBondContact O-N 3.16Å; D946-E950 PolarHBondContact O-N 3.16Å
947	S	96.1	Very high	95.8	Very high	44 Å²	44	55 Å²	55	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-37.6	174.1	-65.4	0	0	0	0	112.8	I796 D943 A951	I796-S947 WeakPolarHBondContact CG2-O 3.37Å; D943-S947 WeakPolarHBondContact O-CB 3.31Å; D943-S947 PolarHBondContact O-N 2.67Å; D943-S947 VanDerWaalsContact O-N 3.15Å; D943-S947 PolarHBondContact O-OG 2.92Å; S947-A951 WeakPolarHBondContact O-CB 3.01Å; S947-A951 PolarHBondContact O-N 2.95Å
948	L	95.7	Very high	95.9	Very high	9 Å²	9	55 Å²	55	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-36.9	175.3	-178.1	70.3	0	0	0	111.8	I796 L894 I898 V944 E945 D946 A951 K952	I796-L948 HydrophobicContact CD1-CB 4Å; I796-L948 HydrophobicContact CD1-CD1 4.24Å; I796-L948 HydrophobicContact CG1-CB 4.49Å; I796-L948 HydrophobicContact CG1-CD1 4Å; L894-L948 HydrophobicContact CD2-CD1 3.77Å; L894-L948 HydrophobicContact CG-CD1 4.09Å; I898-L948 HydrophobicContact CB-CD2 4.3Å; I898-L948 HydrophobicContact CD1-CD2 4.11Å; I898-L948 HydrophobicContact CG1-CD2 3.82Å; I898-L948 HydrophobicContact CG2-CD2 4.03Å; V944-L948 WeakPolarHBondContact O-CB 3.27Å; V944-L948 PolarHBondContact O-N 3.49Å; E945-L948 PolarHBondContact O-N 3.03Å; D946-L948 VanDerWaalsContact C-N 3.33Å; D946-L948 PolarHBondContact O-N 3.06Å; L948-A951 PolarHBondContact O-N 3.39Å; L948-K952 HydrophobicContact CG-CD 4.35Å; L948-K952 WeakPolarHBondContact O-CG 3.35Å; L948-K952 PolarHBondContact O-N 2.91Å
949	A	96.3	Very high	96	Very high	59 Å²	59	53.2 Å²	53.2	49%	0.488	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-46.1	175.6	0	0	0	0	0	111.2	E945 D946 A951 K952 E953	E945-A949 PolarHBondContact O-N 3.33Å; D946-A949 WeakPolarHBondContact O-CB 3.16Å; D946-A949 PolarHBondContact O-N 3.16Å; A949-A951 PolarHBondContact O-N 2.85Å; A949-K952 PolarHBondContact O-N 3.39Å; A949-E953 PolarHBondContact O-N 3.43Å
950	E	96.8	Very high	96	Very high	91 Å²	91	53.2 Å²	53.2	43%	0.425	27%	0.271	S	S	.	.	H	α-helix	trans	-59.2	-47.5	173.6	-158.9	-152.9	172	0	0	111	K804 D946 K952 E953 L954	K804-E950 WeakPolarHBondContact CE-OE1 3.32Å; K804-E950 VanDerWaalsContact NZ-CD 3.34Å; K804-E950 IonicContact NZ-OE1 3.39Å; K804-E950 PolarHBondContact NZ-OE1 2.91Å; K804-E950 IonicContact NZ-OE2 2.65Å; K804-E950 PolarHBondContact NZ-OE2 2.87Å; D946-E950 PolarHBondContact O-N 3.16Å; E950-K952 VanDerWaalsContact C-N 3.31Å; E950-K952 PolarHBondContact O-N 2.92Å; E950-E953 PolarHBondContact O-N 3.24Å; E950-L954 HydrophobicContact CG-CD1 3.81Å; E950-L954 HydrophobicContact CG-CG 4.38Å; E950-L954 WeakPolarHBondContact O-CB 3.39Å; E950-L954 WeakPolarHBondContact O-CD1 3.3Å; E950-L954 VanDerWaalsContact O-CG 3.23Å; E950-L954 WeakPolarHBondContact O-CG 3.37Å; E950-L954 PolarHBondContact O-N 2.92Å
951	A	96.9	Very high	95.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.5	-43.6	179.4	0	0	0	0	0	112.4	I796 L799 T800 S947 L948 A949 F955	I796-A951 HydrophobicContact CG2-CB 3.97Å; L799-A951 HydrophobicContact CB-CB 4.28Å; T800-A951 WeakPolarHBondContact OG1-CA 3.48Å; T800-A951 WeakPolarHBondContact OG1-CB 3.48Å; S947-A951 WeakPolarHBondContact O-CB 3.01Å; S947-A951 PolarHBondContact O-N 2.95Å; L948-A951 PolarHBondContact O-N 3.39Å; A949-A951 PolarHBondContact O-N 2.85Å; A951-F955 VanDerWaalsContact O-CB 3.24Å; A951-F955 WeakPolarHBondContact O-CB 3.3Å; A951-F955 PolarHBondContact O-N 3.41Å
952	K	95.7	Very high	95.9	Very high	51 Å²	51	58.4 Å²	58.4	22%	0.222	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-43	178.3	-74.5	176.9	-174.7	179.3	0	112.7	M891 E895 L948 A949 E950 L954 F955 L956	M891-K952 HydrophobicContact CE-CG 3.93Å; M891-K952 HydrophobicContact SD-CD 4.41Å; M891-K952 WeakPolarHBondContact SD-CE 3.37Å; M891-K952 HydrophobicContact SD-CG 4.19Å; E895-K952 WeakPolarHBondContact OE1-CE 3.38Å; E895-K952 IonicContact OE1-NZ 3.16Å; E895-K952 PolarHBondContact OE1-NZ 3.36Å; L948-K952 HydrophobicContact CG-CD 4.35Å; L948-K952 WeakPolarHBondContact O-CG 3.35Å; L948-K952 PolarHBondContact O-N 2.91Å; A949-K952 PolarHBondContact O-N 3.39Å; E950-K952 VanDerWaalsContact C-N 3.31Å; E950-K952 PolarHBondContact O-N 2.92Å; K952-L954 VanDerWaalsContact C-N 3.35Å; K952-F955 PolarHBondContact O-N 3.04Å; K952-L956 WeakPolarHBondContact O-CB 3.5Å; K952-L956 VanDerWaalsContact O-CG 3.25Å; K952-L956 WeakPolarHBondContact O-CG 3.34Å; K952-L956 PolarHBondContact O-N 3.27Å
953	E	96.1	Very high	95.7	Very high	135 Å²	135	58.6 Å²	58.6	63%	0.631	30%	0.303	S	S	*	.	H	α-helix	trans	-62.6	-45.1	177.2	-165.4	-166.5	139.6	0	0	110.8	A949 E950 F955 L956 R957	A949-E953 PolarHBondContact O-N 3.43Å; E950-E953 PolarHBondContact O-N 3.24Å; E953-F955 PolarHBondContact O-N 3.37Å; E953-L956 PolarHBondContact O-N 2.98Å; E953-R957 WeakPolarHBondContact O-CB 3.41Å; E953-R957 PolarHBondContact O-N 3.32Å
954	L	96.7	Very high	95.7	Very high	21 Å²	21	56.3 Å²	56.3	11%	0.11	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-42.6	176.6	-69.2	166.1	0	0	0	112.2	T800 K804 E950 K952 R957 A958	T800-L954 HydrophobicContact CG2-CD1 3.95Å; K804-L954 HydrophobicContact CD-CD1 4.17Å; K804-L954 VanDerWaalsContact CE-CD1 3.45Å; K804-L954 HydrophobicContact CG-CD1 4.15Å; K804-L954 HydrophobicContact CG-CD2 4.27Å; E950-L954 HydrophobicContact CG-CD1 3.81Å; E950-L954 HydrophobicContact CG-CG 4.38Å; E950-L954 WeakPolarHBondContact O-CB 3.39Å; E950-L954 WeakPolarHBondContact O-CD1 3.3Å; E950-L954 VanDerWaalsContact O-CG 3.23Å; E950-L954 WeakPolarHBondContact O-CG 3.37Å; E950-L954 PolarHBondContact O-N 2.92Å; K952-L954 VanDerWaalsContact C-N 3.35Å; L954-R957 PolarHBondContact O-N 2.94Å; L954-A958 WeakPolarHBondContact O-CB 3.47Å; L954-A958 PolarHBondContact O-N 3.22Å
955	F	97.4	Very high	95.4	Very high	10 Å²	10	59.7 Å²	59.7	4%	0.044	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-51.9	176.3	171.5	-111.5	0	0	0	111.7	S803 A951 K952 E953 R957 A958 V959 M969 P971 F974 F975	S803-F955 WeakPolarHBondContact OG-CA 3.31Å; S803-F955 PolarHBondContact OG-N 2.82Å; A951-F955 VanDerWaalsContact O-CB 3.24Å; A951-F955 WeakPolarHBondContact O-CB 3.3Å; A951-F955 PolarHBondContact O-N 3.41Å; K952-F955 PolarHBondContact O-N 3.04Å; E953-F955 PolarHBondContact O-N 3.37Å; F955-R957 PolarHBondContact O-N 3.44Å; F955-A958 WeakPolarHBondContact O-CA 3.42Å; F955-A958 WeakPolarHBondContact O-CB 3.46Å; F955-A958 PolarHBondContact O-N 3.27Å; F955-V959 HydrophobicContact CD1-CG2 4.44Å; F955-V959 HydrophobicContact CD2-CG2 4.04Å; F955-V959 HydrophobicContact CE1-CG2 3.93Å; F955-V959 HydrophobicContact CE2-CG2 3.45Å; F955-V959 VanDerWaalsContact CE2-CG2 3.45Å; F955-V959 HydrophobicContact CG-CG2 4.49Å; F955-V959 HydrophobicContact CZ-CG2 3.39Å; F955-V959 WeakPolarHBondContact O-CG2 2.99Å; F955-V959 PolarHBondContact O-N 3.16Å; F955-M969 HydrophobicContact CZ-CG 4.49Å; F955-P971 HydrophobicContact CD1-CG 4.27Å; F955-P971 HydrophobicContact CD2-CB 4.3Å; F955-P971 HydrophobicContact CD2-CG 4.33Å; F955-P971 HydrophobicContact CE1-CG 3.96Å; F955-P971 HydrophobicContact CE2-CB 3.92Å; F955-P971 HydrophobicContact CE2-CG 4.03Å; F955-P971 HydrophobicContact CG-CG 4.45Å; F955-P971 HydrophobicContact CZ-CB 4.14Å; F955-P971 HydrophobicContact CZ-CG 3.83Å; F955-F974 HydrophobicContact CD2-CD1 4.45Å; F955-F974 HydrophobicContact CE2-CB 3.85Å; F955-F974 AromaticContact CE2-CD1 3.88Å; F955-F974 HydrophobicContact CE2-CD1 3.88Å; F955-F974 HydrophobicContact CE2-CG 4.06Å; F955-F974 HydrophobicContact CZ-CB 4.26Å; F955-F975 AromaticContact CD2-CE2 3.68Å; F955-F975 HydrophobicContact CD2-CE2 3.68Å; F955-F975 HydrophobicContact CD2-CZ 4Å; F955-F975 AromaticContact CE2-CE2 3.98Å; F955-F975 HydrophobicContact CE2-CE2 3.98Å
956	L	95.8	Very high	95.1	Very high	79 Å²	79	59.4 Å²	59.4	41%	0.414	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-34.9	178.6	-66.9	169.5	0	0	0	111.7	K952 E953 K960 A966	K952-L956 WeakPolarHBondContact O-CB 3.5Å; K952-L956 VanDerWaalsContact O-CG 3.25Å; K952-L956 WeakPolarHBondContact O-CG 3.34Å; K952-L956 PolarHBondContact O-N 3.27Å; E953-L956 PolarHBondContact O-N 2.98Å; L956-K960 VanDerWaalsContact O-CB 3.28Å; L956-K960 WeakPolarHBondContact O-CB 3.49Å; L956-K960 PolarHBondContact O-N 3.38Å; L956-A966 HydrophobicContact CD2-CB 4.05Å; L956-A966 WeakPolarHBondContact CD2-O 3.38Å
957	R	96.5	Very high	94.5	Very high	147 Å²	147	59.2 Å²	59.2	56%	0.555	32%	0.321	S	S	*	.	H	α-helix	trans	-65.8	-39.4	171.6	-179.3	176.4	174.1	168.3	-3.6	112.2	L807 E953 L954 F955 H961	L807-R957 HydrophobicContact CD1-CB 4.4Å; L807-R957 HydrophobicContact CD1-CG 4.01Å; L807-R957 HydrophobicContact CD2-CG 4.31Å; E953-R957 WeakPolarHBondContact O-CB 3.41Å; E953-R957 PolarHBondContact O-N 3.32Å; L954-R957 PolarHBondContact O-N 2.94Å; F955-R957 PolarHBondContact O-N 3.44Å; R957-H961 WeakPolarHBondContact O-CB 3.16Å; R957-H961 PolarHBondContact O-N 3.43Å
958	A	96.1	Very high	94.1	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-52.3	174.5	0	0	0	0	0	111.4	L807 L954 F955 K960 H961 F962 F974	L807-A958 HydrophobicContact CD1-CB 4.27Å; L807-A958 HydrophobicContact CD2-CB 4.4Å; L807-A958 HydrophobicContact CG-CB 4.03Å; L954-A958 WeakPolarHBondContact O-CB 3.47Å; L954-A958 PolarHBondContact O-N 3.22Å; F955-A958 WeakPolarHBondContact O-CA 3.42Å; F955-A958 WeakPolarHBondContact O-CB 3.46Å; F955-A958 PolarHBondContact O-N 3.27Å; A958-K960 VanDerWaalsContact C-N 3.27Å; A958-K960 PolarHBondContact O-N 3.41Å; A958-H961 WeakPolarHBondContact O-CB 3.08Å; A958-H961 PolarHBondContact O-N 3.42Å; A958-F962 WeakPolarHBondContact O-CD2 3.29Å; A958-F962 PolarHBondContact O-N 3.49Å; A958-F974 HydrophobicContact CB-CE1 4.02Å; A958-F974 HydrophobicContact CB-CZ 4.38Å
959	V	96.1	Very high	93.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-51.5	-47.4	176.1	174.9	0	0	0	0	111.2	F955 H961 F962 G963 E964 A966 M969 F974	F955-V959 HydrophobicContact CD1-CG2 4.44Å; F955-V959 HydrophobicContact CD2-CG2 4.04Å; F955-V959 HydrophobicContact CE1-CG2 3.93Å; F955-V959 HydrophobicContact CE2-CG2 3.45Å; F955-V959 VanDerWaalsContact CE2-CG2 3.45Å; F955-V959 HydrophobicContact CG-CG2 4.49Å; F955-V959 HydrophobicContact CZ-CG2 3.39Å; F955-V959 WeakPolarHBondContact O-CG2 2.99Å; F955-V959 PolarHBondContact O-N 3.16Å; V959-H961 PolarHBondContact O-N 3.5Å; V959-F962 PolarHBondContact O-N 2.79Å; V959-G963 PolarHBondContact O-N 3.33Å; V959-E964 HydrophobicContact CG1-CB 3.88Å; V959-E964 PolarHBondContact O-N 2.85Å; V959-E964 VanDerWaalsContact O-N 3.11Å; V959-A966 HydrophobicContact CB-CB 4.5Å; V959-A966 HydrophobicContact CG1-CB 4.05Å; V959-M969 HydrophobicContact CG1-CB 3.83Å; V959-M969 HydrophobicContact CG1-CG 3.95Å; V959-M969 HydrophobicContact CG2-CB 4.38Å; V959-M969 HydrophobicContact CG2-CG 3.92Å; V959-F974 HydrophobicContact CB-CE2 4.42Å; V959-F974 HydrophobicContact CG2-CB 4.49Å; V959-F974 HydrophobicContact CG2-CD1 4.21Å; V959-F974 HydrophobicContact CG2-CD2 3.91Å; V959-F974 HydrophobicContact CG2-CE1 4.42Å; V959-F974 HydrophobicContact CG2-CE2 4.15Å; V959-F974 HydrophobicContact CG2-CG 3.94Å; V959-F974 HydrophobicContact CG2-CZ 4.39Å
960	K	94.7	Very high	93.9	Very high	164 Å²	164	64.4 Å²	64.4	71%	0.713	33%	0.328	S	S	*	.	H	α-helix	trans	-66.5	-34.3	176.8	-174.6	173.7	179.7	176.9	0	113.5	L956 A958 F962 G963	L956-K960 VanDerWaalsContact O-CB 3.28Å; L956-K960 WeakPolarHBondContact O-CB 3.49Å; L956-K960 PolarHBondContact O-N 3.38Å; A958-K960 VanDerWaalsContact C-N 3.27Å; A958-K960 PolarHBondContact O-N 3.41Å; K960-F962 VanDerWaalsContact C-N 3.28Å; K960-F962 PolarHBondContact O-N 3.12Å; K960-G963 PolarHBondContact O-N 2.95Å
961	H	94.1	Very high	93.8	Very high	118 Å²	118	60.1 Å²	60.1	55%	0.546	31%	0.308	S	S	.	.	H	α-helix	trans	-64.5	-33	178.5	-168	89	0	0	0	112.4	L807 R957 A958 V959	L807-H961 HydrophobicContact CD2-CB 3.65Å; R957-H961 WeakPolarHBondContact O-CB 3.16Å; R957-H961 PolarHBondContact O-N 3.43Å; A958-H961 WeakPolarHBondContact O-CB 3.08Å; A958-H961 PolarHBondContact O-N 3.42Å; V959-H961 PolarHBondContact O-N 3.5Å
962	F	94.8	Very high	93.8	Very high	29 Å²	29	62.8 Å²	62.8	13%	0.127	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	9.3	179	-69.8	-90.1	0	0	0	113.7	I806 L812 L816 V839 A958 V959 K960 F974 F978	I806-F962 HydrophobicContact CG2-CD2 3.94Å; I806-F962 HydrophobicContact CG2-CE2 3.23Å; I806-F962 HydrophobicContact CG2-CZ 3.62Å; L812-F962 HydrophobicContact CD2-CE1 4.24Å; L812-F962 HydrophobicContact CD2-CZ 4.01Å; L816-F962 HydrophobicContact CD1-CD1 4.19Å; L816-F962 HydrophobicContact CD1-CE1 3.65Å; V839-F962 HydrophobicContact CG1-CB 3.78Å; V839-F962 HydrophobicContact CG1-CD1 3.55Å; V839-F962 HydrophobicContact CG1-CG 4Å; A958-F962 WeakPolarHBondContact O-CD2 3.29Å; A958-F962 PolarHBondContact O-N 3.49Å; V959-F962 PolarHBondContact O-N 2.79Å; K960-F962 VanDerWaalsContact C-N 3.28Å; K960-F962 PolarHBondContact O-N 3.12Å; F962-F974 HydrophobicContact CB-CE2 4.29Å; F962-F974 HydrophobicContact CB-CZ 4.3Å; F962-F974 HydrophobicContact CD2-CZ 4.12Å; F962-F974 HydrophobicContact CG-CZ 4.44Å; F962-F978 AromaticContact CD1-CZ 3.96Å; F962-F978 HydrophobicContact CD1-CZ 3.96Å; F962-F978 HydrophobicContact CD2-CZ 4.5Å; F962-F978 HydrophobicContact CE1-CE1 4.38Å; F962-F978 HydrophobicContact CE1-CZ 4.14Å; F962-F978 HydrophobicContact CG-CZ 4.15Å
963	G	91.9	Very high	93.8	Very high	61 Å²	61	65.6 Å²	65.6	63%	0.629	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	18.8	171.3	0	0	0	0	0	115.4	V959 K960	V959-G963 PolarHBondContact O-N 3.33Å; K960-G963 PolarHBondContact O-N 2.95Å
964	E	93.8	Very high	93.9	Very high	18 Å²	18	59.1 Å²	59.1	8%	0.084	31%	0.306	C	S	.	.			trans	-95.2	164.2	178	-62.6	-63.2	172.7	0	0	112.2	K838 V839 V959 A966 M969	K838-E964 WeakPolarHBondContact CB-OE1 3.46Å; K838-E964 WeakPolarHBondContact CG-OE1 3.48Å; K838-E964 IonicContact NZ-OE1 2.64Å; K838-E964 IonicContact NZ-OE2 2.72Å; K838-E964 PolarHBondContact NZ-OE2 3.46Å; V839-E964 HydrophobicContact CG2-CG 3.96Å; V839-E964 PolarHBondContact N-OE1 2.93Å; V959-E964 HydrophobicContact CG1-CB 3.88Å; V959-E964 PolarHBondContact O-N 2.85Å; V959-E964 VanDerWaalsContact O-N 3.11Å; E964-A966 PolarHBondContact O-N 2.91Å; E964-M969 HydrophobicContact CB-CE 3.97Å; E964-M969 HydrophobicContact CG-CE 4.1Å
965	D	90.6	Very high	94	Very high	71 Å²	71	58.1 Å²	58.1	38%	0.38	30%	0.3	S	S	.	.			trans	-82.8	98	-172.6	-173.5	-10.1	0	0	0	112.3	S967 K968 M969	D965-S967 VanDerWaalsContact CG-OG 3.32Å; D965-S967 PolarHBondContact O-N 3.27Å; D965-S967 WeakPolarHBondContact OD1-CB 3.48Å; D965-S967 PolarHBondContact OD1-N 2.98Å; D965-S967 PolarHBondContact OD1-OG 3.33Å; D965-S967 PolarHBondContact OD2-OG 2.93Å; D965-K968 PolarHBondContact O-N 3.4Å; D965-K968 IonicContact OD2-NZ 3.07Å; D965-K968 PolarHBondContact OD2-NZ 3.36Å; D965-M969 WeakPolarHBondContact O-CB 3.48Å; D965-M969 PolarHBondContact O-N 3.2Å
966	A	87.8	Confident	94	Very high	42 Å²	42	58.9 Å²	58.9	35%	0.347	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-6.3	177.9	0	0	0	0	0	115.3	L956 V959 E964	L956-A966 HydrophobicContact CD2-CB 4.05Å; L956-A966 WeakPolarHBondContact CD2-O 3.38Å; V959-A966 HydrophobicContact CB-CB 4.5Å; V959-A966 HydrophobicContact CG1-CB 4.05Å; E964-A966 PolarHBondContact O-N 2.91Å
967	S	84.6	Confident	94.1	Very high	95 Å²	95	56 Å²	56	66%	0.664	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.4	171.7	71	0	0	0	0	114.2	D965	D965-S967 VanDerWaalsContact CG-OG 3.32Å; D965-S967 PolarHBondContact O-N 3.27Å; D965-S967 WeakPolarHBondContact OD1-CB 3.48Å; D965-S967 PolarHBondContact OD1-N 2.98Å; D965-S967 PolarHBondContact OD1-OG 3.33Å; D965-S967 PolarHBondContact OD2-OG 2.93Å
968	K	87.7	Confident	94.1	Very high	138 Å²	138	49.1 Å²	49.1	60%	0.6	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	-44	-174.9	-57.9	-172	-175.8	69.2	0	113.3	D965 Q970	D965-K968 PolarHBondContact O-N 3.4Å; D965-K968 IonicContact OD2-NZ 3.07Å; D965-K968 PolarHBondContact OD2-NZ 3.36Å; K968-Q970 PolarHBondContact O-N 3.17Å; K968-Q970 PolarHBondContact O-NE2 3.22Å; K968-Q970 VanDerWaalsContact O-NE2 3.12Å
969	M	92.4	Very high	94.2	Very high	17 Å²	17	50.5 Å²	50.5	8%	0.084	28%	0.277	C	S	.	.			trans	-58.2	122.2	-172.6	-177.3	62	67.8	0	0	112	F955 V959 E964 D965 E973 F974	F955-M969 HydrophobicContact CZ-CG 4.49Å; V959-M969 HydrophobicContact CG1-CB 3.83Å; V959-M969 HydrophobicContact CG1-CG 3.95Å; V959-M969 HydrophobicContact CG2-CB 4.38Å; V959-M969 HydrophobicContact CG2-CG 3.92Å; E964-M969 HydrophobicContact CB-CE 3.97Å; E964-M969 HydrophobicContact CG-CE 4.1Å; D965-M969 WeakPolarHBondContact O-CB 3.48Å; D965-M969 PolarHBondContact O-N 3.2Å; M969-E973 HydrophobicContact CE-CG 4.45Å; M969-E973 HydrophobicContact SD-CB 3.86Å; M969-E973 HydrophobicContact SD-CG 3.71Å; M969-F974 HydrophobicContact CG-CB 3.7Å; M969-F974 HydrophobicContact CG-CD2 3.94Å; M969-F974 HydrophobicContact CG-CG 4.19Å; M969-F974 HydrophobicContact SD-CB 3.76Å; M969-F974 HydrophobicContact SD-CD2 4.23Å
970	Q	95.4	Very high	94.3	Very high	66 Å²	66	54.9 Å²	54.9	31%	0.308	30%	0.297	S	S	.	.			trans	-91.8	159.8	173.5	-61	-55.3	-65.2	0	0	111.3	K968 D972 E973 F974	K968-Q970 PolarHBondContact O-N 3.17Å; K968-Q970 PolarHBondContact O-NE2 3.22Å; K968-Q970 VanDerWaalsContact O-NE2 3.12Å; Q970-D972 VanDerWaalsContact CB-OD1 3.32Å; Q970-D972 WeakPolarHBondContact CB-OD1 3.36Å; Q970-E973 PolarHBondContact O-N 3.38Å; Q970-F974 WeakPolarHBondContact O-CB 3.19Å; Q970-F974 PolarHBondContact O-N 3.43Å
971	P	95.4	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-38.7	-179.1	-19.2	31.6	0	0	0	113.6	L799 M891 F955 F974 F975	L799-P971 HydrophobicContact CD2-CB 3.37Å; L799-P971 HydrophobicContact CD2-CG 3.83Å; M891-P971 HydrophobicContact CB-CG 4Å; M891-P971 HydrophobicContact CE-CG 3.88Å; F955-P971 HydrophobicContact CD1-CG 4.27Å; F955-P971 HydrophobicContact CD2-CB 4.3Å; F955-P971 HydrophobicContact CD2-CG 4.33Å; F955-P971 HydrophobicContact CE1-CG 3.96Å; F955-P971 HydrophobicContact CE2-CB 3.92Å; F955-P971 HydrophobicContact CE2-CG 4.03Å; F955-P971 HydrophobicContact CG-CG 4.45Å; F955-P971 HydrophobicContact CZ-CB 4.14Å; F955-P971 HydrophobicContact CZ-CG 3.83Å; P971-F974 PolarHBondContact O-N 2.73Å; P971-F975 HydrophobicContact CB-CD2 3.9Å; P971-F975 HydrophobicContact CB-CE2 4.04Å; P971-F975 WeakPolarHBondContact O-CB 3.33Å; P971-F975 VanDerWaalsContact O-CD2 3.23Å; P971-F975 WeakPolarHBondContact O-CD2 3.31Å; P971-F975 PolarHBondContact O-N 3.29Å
972	D	96	Very high	94.6	Very high	56 Å²	56	42.5 Å²	42.5	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-61	-42.4	176.1	48.2	-62.2	0	0	0	111.9	A887 Q970 G976	A887-D972 WeakPolarHBondContact O-CA 3.47Å; A887-D972 WeakPolarHBondContact O-CB 3.47Å; Q970-D972 VanDerWaalsContact CB-OD1 3.32Å; Q970-D972 WeakPolarHBondContact CB-OD1 3.36Å; D972-G976 VanDerWaalsContact O-CA 3.32Å; D972-G976 WeakPolarHBondContact O-CA 3.29Å; D972-G976 PolarHBondContact O-N 2.88Å
973	E	96.2	Very high	94.7	Very high	110 Å²	110	45.4 Å²	45.4	51%	0.514	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-48.4	171.5	-172.1	-175.8	-178.8	0	0	111.8	M969 Q970 I977	M969-E973 HydrophobicContact CE-CG 4.45Å; M969-E973 HydrophobicContact SD-CB 3.86Å; M969-E973 HydrophobicContact SD-CG 3.71Å; Q970-E973 PolarHBondContact O-N 3.38Å; E973-I977 WeakPolarHBondContact O-CG1 3.48Å; E973-I977 PolarHBondContact O-N 2.79Å; E973-I977 VanDerWaalsContact O-N 3.15Å
974	F	97.8	Very high	94.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-53.7	-173.9	-174.8	-109.1	0	0	0	112.9	F955 A958 V959 F962 M969 Q970 P971 G976 I977 F978	F955-F974 HydrophobicContact CD2-CD1 4.45Å; F955-F974 HydrophobicContact CE2-CB 3.85Å; F955-F974 AromaticContact CE2-CD1 3.88Å; F955-F974 HydrophobicContact CE2-CD1 3.88Å; F955-F974 HydrophobicContact CE2-CG 4.06Å; F955-F974 HydrophobicContact CZ-CB 4.26Å; A958-F974 HydrophobicContact CB-CE1 4.02Å; A958-F974 HydrophobicContact CB-CZ 4.38Å; V959-F974 HydrophobicContact CB-CE2 4.42Å; V959-F974 HydrophobicContact CG2-CB 4.49Å; V959-F974 HydrophobicContact CG2-CD1 4.21Å; V959-F974 HydrophobicContact CG2-CD2 3.91Å; V959-F974 HydrophobicContact CG2-CE1 4.42Å; V959-F974 HydrophobicContact CG2-CE2 4.15Å; V959-F974 HydrophobicContact CG2-CG 3.94Å; V959-F974 HydrophobicContact CG2-CZ 4.39Å; F962-F974 HydrophobicContact CB-CE2 4.29Å; F962-F974 HydrophobicContact CB-CZ 4.3Å; F962-F974 HydrophobicContact CD2-CZ 4.12Å; F962-F974 HydrophobicContact CG-CZ 4.44Å; M969-F974 HydrophobicContact CG-CB 3.7Å; M969-F974 HydrophobicContact CG-CD2 3.94Å; M969-F974 HydrophobicContact CG-CG 4.19Å; M969-F974 HydrophobicContact SD-CB 3.76Å; M969-F974 HydrophobicContact SD-CD2 4.23Å; Q970-F974 WeakPolarHBondContact O-CB 3.19Å; Q970-F974 PolarHBondContact O-N 3.43Å; P971-F974 PolarHBondContact O-N 2.73Å; F974-G976 VanDerWaalsContact C-N 3.34Å; F974-I977 WeakPolarHBondContact O-CB 3.29Å; F974-I977 PolarHBondContact O-N 3.12Å; F974-F978 HydrophobicContact CD1-CE2 4.46Å; F974-F978 AromaticContact CE1-CE2 3.96Å; F974-F978 HydrophobicContact CE1-CE2 3.96Å; F974-F978 HydrophobicContact CE2-CE2 4.08Å; F974-F978 AromaticContact CZ-CE2 3.76Å; F974-F978 HydrophobicContact CZ-CE2 3.76Å; F974-F978 HydrophobicContact CZ-CZ 4.41Å; F974-F978 VanDerWaalsContact O-CD2 3.29Å; F974-F978 WeakPolarHBondContact O-CD2 3.47Å
975	F	98.2	Very high	95	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-72.4	-31.4	179	-65.3	-64.8	0	0	0	110.8	L799 A802 I806 V883 A886 A887 F955 P971 I977 F978 D979	L799-F975 HydrophobicContact CD2-CD2 4.36Å; L799-F975 HydrophobicContact CD2-CE2 3.93Å; A802-F975 HydrophobicContact CB-CD1 3.89Å; A802-F975 HydrophobicContact CB-CE1 3.56Å; A802-F975 HydrophobicContact CB-CG 4.5Å; A802-F975 HydrophobicContact CB-CZ 3.91Å; I806-F975 HydrophobicContact CD1-CD1 3.74Å; I806-F975 HydrophobicContact CD1-CE1 3.87Å; V883-F975 HydrophobicContact CG1-CB 4.22Å; V883-F975 HydrophobicContact CG1-CD1 4.4Å; A886-F975 HydrophobicContact CB-CB 4.2Å; A886-F975 HydrophobicContact CB-CD1 4.29Å; A886-F975 HydrophobicContact CB-CD2 3.56Å; A886-F975 HydrophobicContact CB-CE2 3.97Å; A886-F975 HydrophobicContact CB-CG 3.76Å; A886-F975 HydrophobicContact CB-CZ 4.49Å; A887-F975 HydrophobicContact CB-CB 3.92Å; F955-F975 AromaticContact CD2-CE2 3.68Å; F955-F975 HydrophobicContact CD2-CE2 3.68Å; F955-F975 HydrophobicContact CD2-CZ 4Å; F955-F975 AromaticContact CE2-CE2 3.98Å; F955-F975 HydrophobicContact CE2-CE2 3.98Å; P971-F975 HydrophobicContact CB-CD2 3.9Å; P971-F975 HydrophobicContact CB-CE2 4.04Å; P971-F975 WeakPolarHBondContact O-CB 3.33Å; P971-F975 VanDerWaalsContact O-CD2 3.23Å; P971-F975 WeakPolarHBondContact O-CD2 3.31Å; P971-F975 PolarHBondContact O-N 3.29Å; F975-I977 VanDerWaalsContact C-N 3.27Å; F975-I977 PolarHBondContact O-N 3.3Å; F975-F978 CarbonylContact O-C 3.58Å; F975-F978 PolarHBondContact O-N 2.95Å; F975-D979 PolarHBondContact O-N 3.05Å
976	G	97.8	Very high	95.2	Very high	25 Å²	25	42.7 Å²	42.7	26%	0.258	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-33.1	172.9	0	0	0	0	0	113.9	D972 F974 F978 Q980	D972-G976 VanDerWaalsContact O-CA 3.32Å; D972-G976 WeakPolarHBondContact O-CA 3.29Å; D972-G976 PolarHBondContact O-N 2.88Å; F974-G976 VanDerWaalsContact C-N 3.34Å; G976-F978 VanDerWaalsContact C-N 3.32Å; G976-F978 PolarHBondContact O-N 3.13Å; G976-Q980 VanDerWaalsContact O-CB 3.28Å; G976-Q980 WeakPolarHBondContact O-CB 3.3Å; G976-Q980 PolarHBondContact O-N 3.29Å
977	I	97.6	Very high	95.6	Very high	19 Å²	19	46.3 Å²	46.3	10%	0.097	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-43.4	171.3	-72.8	161.2	0	0	0	111.5	V839 N843 E973 F974 F975 F981	V839-I977 HydrophobicContact CB-CG2 4.07Å; V839-I977 HydrophobicContact CG2-CD1 4.35Å; V839-I977 HydrophobicContact CG2-CG2 4.05Å; N843-I977 PolarHBondContact ND2-O 3.47Å; E973-I977 WeakPolarHBondContact O-CG1 3.48Å; E973-I977 PolarHBondContact O-N 2.79Å; E973-I977 VanDerWaalsContact O-N 3.15Å; F974-I977 WeakPolarHBondContact O-CB 3.29Å; F974-I977 PolarHBondContact O-N 3.12Å; F975-I977 VanDerWaalsContact C-N 3.27Å; F975-I977 PolarHBondContact O-N 3.3Å; I977-F981 PolarHBondContact O-N 2.88Å
978	F	97.9	Very high	96.1	Very high	2 Å²	2	42 Å²	42	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-77.6	-38.5	180	-68	-85.1	0	0	0	112.2	I806 L812 V839 L842 V883 F962 F974 F975 G976 F981 L982	I806-F978 HydrophobicContact CD1-CB 4.15Å; I806-F978 HydrophobicContact CD1-CD1 4.12Å; I806-F978 HydrophobicContact CD1-CD2 3.52Å; I806-F978 HydrophobicContact CD1-CE1 4.36Å; I806-F978 HydrophobicContact CD1-CE2 3.81Å; I806-F978 HydrophobicContact CD1-CG 3.68Å; I806-F978 HydrophobicContact CD1-CZ 4.21Å; I806-F978 HydrophobicContact CG2-CE2 4.46Å; I806-F978 HydrophobicContact CG2-CZ 4.23Å; L812-F978 HydrophobicContact CD1-CD1 4.44Å; L812-F978 HydrophobicContact CD1-CE1 4.25Å; L812-F978 HydrophobicContact CD2-CD1 4.39Å; L812-F978 HydrophobicContact CD2-CE1 3.94Å; V839-F978 HydrophobicContact CB-CE2 4.5Å; V839-F978 HydrophobicContact CB-CZ 4.11Å; V839-F978 HydrophobicContact CG1-CE1 4.24Å; V839-F978 HydrophobicContact CG1-CZ 3.75Å; V839-F978 HydrophobicContact CG2-CE2 4.39Å; V839-F978 HydrophobicContact CG2-CZ 4.41Å; L842-F978 HydrophobicContact CD1-CD1 4.33Å; L842-F978 HydrophobicContact CD1-CE1 4.3Å; V883-F978 HydrophobicContact CG1-CB 3.79Å; F962-F978 AromaticContact CD1-CZ 3.96Å; F962-F978 HydrophobicContact CD1-CZ 3.96Å; F962-F978 HydrophobicContact CD2-CZ 4.5Å; F962-F978 HydrophobicContact CE1-CE1 4.38Å; F962-F978 HydrophobicContact CE1-CZ 4.14Å; F962-F978 HydrophobicContact CG-CZ 4.15Å; F974-F978 HydrophobicContact CD1-CE2 4.46Å; F974-F978 AromaticContact CE1-CE2 3.96Å; F974-F978 HydrophobicContact CE1-CE2 3.96Å; F974-F978 HydrophobicContact CE2-CE2 4.08Å; F974-F978 AromaticContact CZ-CE2 3.76Å; F974-F978 HydrophobicContact CZ-CE2 3.76Å; F974-F978 HydrophobicContact CZ-CZ 4.41Å; F974-F978 VanDerWaalsContact O-CD2 3.29Å; F974-F978 WeakPolarHBondContact O-CD2 3.47Å; F975-F978 CarbonylContact O-C 3.58Å; F975-F978 PolarHBondContact O-N 2.95Å; G976-F978 VanDerWaalsContact C-N 3.32Å; G976-F978 PolarHBondContact O-N 3.13Å; F978-F981 WeakPolarHBondContact O-CB 3.43Å; F978-F981 PolarHBondContact O-N 3.16Å; F978-L982 VanDerWaalsContact O-CG 3.31Å; F978-L982 WeakPolarHBondContact O-CG 3.46Å; F978-L982 PolarHBondContact O-N 3.04Å
979	D	98.1	Very high	96.4	Very high	30 Å²	30	37.7 Å²	37.7	16%	0.16	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-47.6	177.3	-171.6	65	0	0	0	111.6	V883 S884 A887 F975 F981 L982 Q983	V883-D979 HydrophobicContact CG1-CB 4.29Å; S884-D979 WeakPolarHBondContact CA-OD1 3.39Å; S884-D979 WeakPolarHBondContact CB-OD1 3.24Å; A887-D979 HydrophobicContact CB-CB 4.14Å; F975-D979 PolarHBondContact O-N 3.05Å; D979-F981 PolarHBondContact O-N 3.41Å; D979-L982 WeakPolarHBondContact O-CB 3.48Å; D979-L982 PolarHBondContact O-N 3.45Å; D979-Q983 WeakPolarHBondContact O-CG 3.49Å; D979-Q983 PolarHBondContact O-N 3.18Å; D979-Q983 PolarHBondContact OD2-NE2 3.21Å
980	Q	97.5	Very high	96.4	Very high	91 Å²	91	41.8 Å²	41.8	43%	0.425	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-34.3	174.1	-177.6	62.8	90.7	0	0	112.3	G976 S984	G976-Q980 VanDerWaalsContact O-CB 3.28Å; G976-Q980 WeakPolarHBondContact O-CB 3.3Å; G976-Q980 PolarHBondContact O-N 3.29Å; Q980-S984 WeakPolarHBondContact O-CB 3.19Å; Q980-S984 PolarHBondContact O-N 2.63Å; Q980-S984 PolarHBondContact O-OG 2.94Å
981	F	97.6	Very high	96.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-73.8	-39.6	176.3	177.5	-111	0	0	0	112	L815 L842 N843 I845 L859 F876 I977 F978 D979 S984 F985	L815-F981 HydrophobicContact CD2-CE1 3.71Å; L815-F981 HydrophobicContact CD2-CZ 4.03Å; L842-F981 HydrophobicContact CB-CB 4.2Å; L842-F981 HydrophobicContact CB-CD1 4.36Å; L842-F981 HydrophobicContact CB-CD2 3.66Å; L842-F981 HydrophobicContact CB-CE2 4.09Å; L842-F981 HydrophobicContact CB-CG 3.8Å; L842-F981 HydrophobicContact CD1-CD1 4.08Å; L842-F981 HydrophobicContact CD1-CE1 4.45Å; L842-F981 HydrophobicContact CD1-CG 4.27Å; L842-F981 HydrophobicContact CD2-CE1 4.19Å; L842-F981 HydrophobicContact CD2-CE2 4.19Å; L842-F981 HydrophobicContact CD2-CZ 4.01Å; L842-F981 HydrophobicContact CG-CG 4.47Å; N843-F981 WeakPolarHBondContact OD1-CA 3.37Å; N843-F981 VanDerWaalsContact OD1-CB 3.28Å; N843-F981 WeakPolarHBondContact OD1-CB 3.07Å; N843-F981 PolarHBondContact OD1-N 3.4Å; I845-F981 HydrophobicContact CD1-CE2 4.21Å; L859-F981 HydrophobicContact CD1-CE2 3.87Å; L859-F981 HydrophobicContact CD1-CZ 4.32Å; F876-F981 HydrophobicContact CE2-CD1 4.22Å; F876-F981 AromaticContact CE2-CE1 3.87Å; F876-F981 HydrophobicContact CE2-CE1 3.87Å; F876-F981 HydrophobicContact CZ-CD1 4.2Å; F876-F981 AromaticContact CZ-CE1 3.66Å; F876-F981 HydrophobicContact CZ-CE1 3.66Å; I977-F981 PolarHBondContact O-N 2.88Å; F978-F981 WeakPolarHBondContact O-CB 3.43Å; F978-F981 PolarHBondContact O-N 3.16Å; D979-F981 PolarHBondContact O-N 3.41Å; F981-S984 PolarHBondContact O-N 3.13Å; F981-F985 HydrophobicContact CE1-CD2 4.39Å; F981-F985 HydrophobicContact CZ-CD2 4Å; F981-F985 VanDerWaalsContact O-CB 3.24Å; F981-F985 WeakPolarHBondContact O-CB 3.42Å; F981-F985 PolarHBondContact O-N 3.01Å
982	L	97	Very high	96.1	Very high	20 Å²	20	44 Å²	44	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-44.4	174.1	-73.9	168.3	0	0	0	111	F876 Q877 L880 V883 F978 D979 F985 T986	F876-L982 HydrophobicContact CD2-CD2 4.39Å; F876-L982 HydrophobicContact CE2-CD2 3.61Å; F876-L982 HydrophobicContact CZ-CD2 3.83Å; Q877-L982 HydrophobicContact CB-CD2 4.07Å; Q877-L982 HydrophobicContact CG-CD2 3.71Å; Q877-L982 PolarHBondContact NE2-O 3.21Å; L880-L982 HydrophobicContact CB-CD1 4.22Å; L880-L982 HydrophobicContact CD1-CD2 4.33Å; V883-L982 HydrophobicContact CB-CD1 4.23Å; V883-L982 HydrophobicContact CG1-CD1 4.24Å; F978-L982 VanDerWaalsContact O-CG 3.31Å; F978-L982 WeakPolarHBondContact O-CG 3.46Å; F978-L982 PolarHBondContact O-N 3.04Å; D979-L982 WeakPolarHBondContact O-CB 3.48Å; D979-L982 PolarHBondContact O-N 3.45Å; L982-F985 PolarHBondContact O-N 3.17Å; L982-T986 PolarHBondContact O-N 3.43Å; L982-T986 PolarHBondContact O-OG1 3.22Å
983	Q	96.6	Very high	95.9	Very high	90 Å²	90	43.7 Å²	43.7	42%	0.421	22%	0.222	S	C	.	.	H	α-helix	trans	-57.8	-56.7	173.1	-65.9	175.8	32	0	0	110.8	D979 F985 T986 E987	D979-Q983 WeakPolarHBondContact O-CG 3.49Å; D979-Q983 PolarHBondContact O-N 3.18Å; D979-Q983 PolarHBondContact OD2-NE2 3.21Å; Q983-F985 PolarHBondContact O-N 2.9Å; Q983-T986 WeakPolarHBondContact O-CB 3.28Å; Q983-T986 PolarHBondContact O-N 3.27Å; Q983-T986 VanDerWaalsContact O-N 3.08Å; Q983-E987 WeakPolarHBondContact O-CG 3.44Å; Q983-E987 PolarHBondContact O-N 3.43Å
984	S	96.5	Very high	95.5	Very high	22 Å²	22	41.7 Å²	41.7	15%	0.154	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-31.4	-178.6	-52.8	0	0	0	0	113.3	L859 Q980 F981 A988	L859-S984 WeakPolarHBondContact CD2-O 3.26Å; Q980-S984 WeakPolarHBondContact O-CB 3.19Å; Q980-S984 PolarHBondContact O-N 2.63Å; Q980-S984 PolarHBondContact O-OG 2.94Å; F981-S984 PolarHBondContact O-N 3.13Å; S984-A988 VanDerWaalsContact O-CB 3.3Å; S984-A988 WeakPolarHBondContact O-CB 3.43Å; S984-A988 PolarHBondContact O-N 3.13Å; S984-A988 VanDerWaalsContact O-N 3.09Å
985	F	96.6	Very high	95	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-70.8	-44.6	175.4	-170.6	-76.1	0	0	0	111.3	L859 I863 L866 L874 F876 F981 L982 Q983 A988 Q989	L859-F985 HydrophobicContact CD1-CD2 4.04Å; I863-F985 HydrophobicContact CD1-CD1 4.29Å; I863-F985 HydrophobicContact CD1-CD2 4.18Å; I863-F985 HydrophobicContact CD1-CE1 4.38Å; I863-F985 HydrophobicContact CD1-CE2 4.28Å; I863-F985 HydrophobicContact CD1-CG 4.19Å; I863-F985 HydrophobicContact CD1-CZ 4.39Å; I863-F985 WeakPolarHBondContact CD1-O 3.4Å; I863-F985 HydrophobicContact CG1-CD1 4.38Å; I863-F985 HydrophobicContact CG1-CD2 3.97Å; I863-F985 HydrophobicContact CG1-CE1 4.03Å; I863-F985 HydrophobicContact CG1-CE2 3.58Å; I863-F985 HydrophobicContact CG1-CG 4.36Å; I863-F985 HydrophobicContact CG1-CZ 3.63Å; L866-F985 HydrophobicContact CD1-CE2 3.83Å; L866-F985 HydrophobicContact CD1-CZ 3.9Å; L874-F985 HydrophobicContact CD1-CE1 4.26Å; L874-F985 HydrophobicContact CD1-CZ 4.14Å; F876-F985 HydrophobicContact CD1-CE2 4.45Å; F876-F985 HydrophobicContact CD1-CZ 4.27Å; F876-F985 AromaticContact CE1-CD1 3.86Å; F876-F985 HydrophobicContact CE1-CD1 3.86Å; F876-F985 AromaticContact CE1-CD2 3.69Å; F876-F985 HydrophobicContact CE1-CD2 3.69Å; F876-F985 AromaticContact CE1-CE1 3.76Å; F876-F985 HydrophobicContact CE1-CE1 3.76Å; F876-F985 AromaticContact CE1-CE2 3.58Å; F876-F985 HydrophobicContact CE1-CE2 3.58Å; F876-F985 AromaticContact CE1-CG 3.83Å; F876-F985 HydrophobicContact CE1-CG 3.83Å; F876-F985 AromaticContact CE1-CZ 3.61Å; F876-F985 HydrophobicContact CE1-CZ 3.61Å; F876-F985 HydrophobicContact CZ-CB 4.42Å; F876-F985 HydrophobicContact CZ-CD1 4.41Å; F876-F985 AromaticContact CZ-CD2 3.92Å; F876-F985 HydrophobicContact CZ-CD2 3.92Å; F876-F985 HydrophobicContact CZ-CE2 4.23Å; F876-F985 HydrophobicContact CZ-CG 4.02Å; F981-F985 HydrophobicContact CE1-CD2 4.39Å; F981-F985 HydrophobicContact CZ-CD2 4Å; F981-F985 VanDerWaalsContact O-CB 3.24Å; F981-F985 WeakPolarHBondContact O-CB 3.42Å; F981-F985 PolarHBondContact O-N 3.01Å; L982-F985 PolarHBondContact O-N 3.17Å; Q983-F985 PolarHBondContact O-N 2.9Å; F985-A988 PolarHBondContact O-N 3Å; F985-Q989 VanDerWaalsContact O-CB 3.27Å; F985-Q989 WeakPolarHBondContact O-CB 3.41Å; F985-Q989 PolarHBondContact O-N 3.49Å
986	T	95.3	Very high	94.5	Very high	71 Å²	71	49 Å²	49	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-44.4	176.5	-56.8	0	0	0	0	111.4	Q877 L982 Q983 Q989 Q990	Q877-T986 PolarHBondContact NE2-OG1 3.44Å; L982-T986 PolarHBondContact O-N 3.43Å; L982-T986 PolarHBondContact O-OG1 3.22Å; Q983-T986 WeakPolarHBondContact O-CB 3.28Å; Q983-T986 PolarHBondContact O-N 3.27Å; Q983-T986 VanDerWaalsContact O-N 3.08Å; T986-Q989 PolarHBondContact O-N 3.32Å; T986-Q990 WeakPolarHBondContact O-CB 3.48Å; T986-Q990 PolarHBondContact O-N 2.86Å
987	E	95.4	Very high	93.9	Very high	118 Å²	118	52.5 Å²	52.5	55%	0.551	25%	0.254	S	S	*	.	H	α-helix	trans	-59.7	-53.6	175.6	-69.5	175.1	158	0	0	111.2	Q983 Q989 Q990 E991	Q983-E987 WeakPolarHBondContact O-CG 3.44Å; Q983-E987 PolarHBondContact O-N 3.43Å; E987-Q989 PolarHBondContact O-N 3Å; E987-Q990 PolarHBondContact O-N 3.19Å; E987-Q990 VanDerWaalsContact O-N 3.11Å; E987-E991 PolarHBondContact O-N 3.49Å
988	A	95.1	Very high	93.1	Very high	5 Å²	5	59.9 Å²	59.9	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-65.3	-25.3	178.9	0	0	0	0	0	113.5	L859 H860 I863 S984 F985 N992	L859-A988 HydrophobicContact CD2-CB 4.09Å; L859-A988 HydrophobicContact CG-CB 4.01Å; H860-A988 PolarHBondContact CD2-O 2.93Å; H860-A988 PolarHBondContact NE2-O 3.13Å; I863-A988 HydrophobicContact CD1-CB 3.59Å; S984-A988 VanDerWaalsContact O-CB 3.3Å; S984-A988 WeakPolarHBondContact O-CB 3.43Å; S984-A988 PolarHBondContact O-N 3.13Å; S984-A988 VanDerWaalsContact O-N 3.09Å; F985-A988 PolarHBondContact O-N 3Å; A988-N992 WeakPolarHBondContact O-CB 3.37Å; A988-N992 PolarHBondContact O-N 3.02Å; A988-N992 PolarHBondContact O-ND2 2.66Å
989	Q	93.8	Very high	92.3	Very high	48 Å²	48	66.5 Å²	66.5	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-72.9	-42.7	172	-172.8	176.5	20.7	0	0	111.1	I863 F985 T986 E987 N992 E993	I863-Q989 HydrophobicContact CD1-CB 4.28Å; I863-Q989 HydrophobicContact CG2-CB 4.24Å; I863-Q989 HydrophobicContact CG2-CG 4.15Å; F985-Q989 VanDerWaalsContact O-CB 3.27Å; F985-Q989 WeakPolarHBondContact O-CB 3.41Å; F985-Q989 PolarHBondContact O-N 3.49Å; T986-Q989 PolarHBondContact O-N 3.32Å; E987-Q989 PolarHBondContact O-N 3Å; Q989-N992 WeakPolarHBondContact O-CB 2.72Å; Q989-N992 PolarHBondContact O-N 2.89Å; Q989-E993 PolarHBondContact O-N 3.4Å
990	Q	93.8	Very high	91.5	Very high	103 Å²	103	69 Å²	69	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-67.5	-36.3	176.3	-175.2	54.1	87.5	0	0	111.8	T986 E987 E993 N994	T986-Q990 WeakPolarHBondContact O-CB 3.48Å; T986-Q990 PolarHBondContact O-N 2.86Å; E987-Q990 PolarHBondContact O-N 3.19Å; E987-Q990 VanDerWaalsContact O-N 3.11Å; Q990-E993 PolarHBondContact O-N 2.87Å; Q990-N994 PolarHBondContact NE2-OD1 3.26Å; Q990-N994 WeakPolarHBondContact O-CB 3.5Å; Q990-N994 PolarHBondContact O-N 3.12Å; Q990-N994 PolarHBondContact O-ND2 2.91Å; Q990-N994 VanDerWaalsContact O-ND2 3.15Å
991	E	92.4	Very high	90.4	Very high	98 Å²	98	68.2 Å²	68.2	46%	0.458	32%	0.316	S	S	.	.	H	α-helix	trans	-65.4	-43.8	170.8	-77.1	-173.4	-159.5	0	0	112.1	H860 E987 E993 N994 I995	H860-E991 IonicContact CE1-OE2 3.63Å; H860-E991 PolarHBondContact CE1-OE2 3.49Å; H860-E991 WeakPolarHBondContact NE2-CB 3.45Å; H860-E991 IonicContact NE2-OE2 3.17Å; H860-E991 PolarHBondContact NE2-OE2 2.67Å; E987-E991 PolarHBondContact O-N 3.49Å; E991-E993 PolarHBondContact O-N 3.04Å; E991-N994 WeakPolarHBondContact O-CB 3.16Å; E991-N994 PolarHBondContact O-N 3.49Å; E991-N994 VanDerWaalsContact O-N 3.15Å; E991-I995 VanDerWaalsContact O-CG1 3.3Å; E991-I995 WeakPolarHBondContact O-CG1 3.27Å; E991-I995 PolarHBondContact O-N 3.46Å
992	N	91.8	Very high	89.3	Confident	15 Å²	15	73.4 Å²	73.4	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-57.8	-45.4	171.9	-89.9	-24.2	0	0	0	112.7	H860 I863 A988 Q989 N994 I995 R996	H860-N992 PolarHBondContact CD2-OD1 2.83Å; H860-N992 PolarHBondContact O-ND2 3.28Å; I863-N992 WeakPolarHBondContact CB-ND2 3.23Å; I863-N992 WeakPolarHBondContact CG2-ND2 3.47Å; A988-N992 WeakPolarHBondContact O-CB 3.37Å; A988-N992 PolarHBondContact O-N 3.02Å; A988-N992 PolarHBondContact O-ND2 2.66Å; Q989-N992 WeakPolarHBondContact O-CB 2.72Å; Q989-N992 PolarHBondContact O-N 2.89Å; N992-N994 VanDerWaalsContact C-N 3.3Å; N992-N994 PolarHBondContact O-N 3.27Å; N992-I995 PolarHBondContact O-N 3.07Å; N992-R996 WeakPolarHBondContact O-CB 3.33Å; N992-R996 PolarHBondContact O-N 2.83Å
993	E	90.3	Very high	88.4	Confident	49 Å²	49	77.3 Å²	77.3	23%	0.229	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-42.5	173.9	-90.3	-73	140.1	0	0	111.6	Q989 Q990 E991 R996 K997	Q989-E993 PolarHBondContact O-N 3.4Å; Q990-E993 PolarHBondContact O-N 2.87Å; E991-E993 PolarHBondContact O-N 3.04Å; E993-R996 VanDerWaalsContact CD-NH2 3.33Å; E993-R996 PolarHBondContact O-N 3.42Å; E993-R996 IonicContact OE1-CZ 3.64Å; E993-R996 IonicContact OE1-NH1 2.66Å; E993-R996 PolarHBondContact OE1-NH1 3.25Å; E993-R996 IonicContact OE1-NH2 3.92Å; E993-R996 PolarHBondContact OE1-NH2 2.88Å; E993-R996 IonicContact OE2-NH2 3.39Å; E993-R996 PolarHBondContact OE2-NH2 2.97Å; E993-K997 WeakPolarHBondContact O-CB 3.3Å; E993-K997 VanDerWaalsContact O-CG 3.28Å; E993-K997 WeakPolarHBondContact O-CG 3.38Å; E993-K997 PolarHBondContact O-N 3.15Å; E993-K997 WeakPolarHBondContact OE2-CE 3.27Å; E993-K997 IonicContact OE2-NZ 3.5Å; E993-K997 PolarHBondContact OE2-NZ 3.25Å
994	N	89.6	Confident	87.5	Confident	67 Å²	67	79.4 Å²	79.4	36%	0.358	36%	0.362	S	S	.	.	H	α-helix	trans	-68.3	-40.9	178.4	-68.8	-22	0	0	0	112	Q990 E991 N992 R998	Q990-N994 PolarHBondContact NE2-OD1 3.26Å; Q990-N994 WeakPolarHBondContact O-CB 3.5Å; Q990-N994 PolarHBondContact O-N 3.12Å; Q990-N994 PolarHBondContact O-ND2 2.91Å; Q990-N994 VanDerWaalsContact O-ND2 3.15Å; E991-N994 WeakPolarHBondContact O-CB 3.16Å; E991-N994 PolarHBondContact O-N 3.49Å; E991-N994 VanDerWaalsContact O-N 3.15Å; N992-N994 VanDerWaalsContact C-N 3.3Å; N992-N994 PolarHBondContact O-N 3.27Å; N994-R998 WeakPolarHBondContact O-CB 3.35Å; N994-R998 VanDerWaalsContact O-CG 3.28Å; N994-R998 WeakPolarHBondContact O-CG 3.5Å; N994-R998 PolarHBondContact O-N 3.01Å
995	I	87.3	Confident	86.5	Confident	57 Å²	57	84.4 Å²	84.4	29%	0.292	38%	0.378	S	S	.	.	H	α-helix	trans	-62.6	-43.6	173.4	-68.6	163.9	0	0	0	110.4	I856 E991 N992 K999	I856-I995 HydrophobicContact CG1-CD1 4.34Å; E991-I995 VanDerWaalsContact O-CG1 3.3Å; E991-I995 WeakPolarHBondContact O-CG1 3.27Å; E991-I995 PolarHBondContact O-N 3.46Å; N992-I995 PolarHBondContact O-N 3.07Å; I995-K999 WeakPolarHBondContact O-CB 3.35Å; I995-K999 PolarHBondContact O-N 3.43Å
996	R	85.9	Confident	85.5	Confident	96 Å²	96	87 Å²	87	36%	0.362	40%	0.399	S	S	.	.	H	α-helix	trans	-65.7	-46.4	179.1	-158.3	-175.3	70.4	-118.5	-10	111.5	N992 E993 R998 K999 E1000	N992-R996 WeakPolarHBondContact O-CB 3.33Å; N992-R996 PolarHBondContact O-N 2.83Å; E993-R996 VanDerWaalsContact CD-NH2 3.33Å; E993-R996 PolarHBondContact O-N 3.42Å; E993-R996 IonicContact OE1-CZ 3.64Å; E993-R996 IonicContact OE1-NH1 2.66Å; E993-R996 PolarHBondContact OE1-NH1 3.25Å; E993-R996 IonicContact OE1-NH2 3.92Å; E993-R996 PolarHBondContact OE1-NH2 2.88Å; E993-R996 IonicContact OE2-NH2 3.39Å; E993-R996 PolarHBondContact OE2-NH2 2.97Å; R996-R998 PolarHBondContact O-N 2.89Å; R996-K999 PolarHBondContact O-N 3.47Å; R996-K999 VanDerWaalsContact O-N 3.17Å; R996-E1000 WeakPolarHBondContact CD-OE1 3.41Å; R996-E1000 HydrophobicContact CG-CG 4.5Å; R996-E1000 WeakPolarHBondContact CG-OE1 3.46Å; R996-E1000 IonicContact CZ-OE1 2.83Å; R996-E1000 IonicContact NE-OE1 2.62Å; R996-E1000 PolarHBondContact NE-OE1 3.29Å; R996-E1000 WeakPolarHBondContact O-CB 3.25Å; R996-E1000 WeakPolarHBondContact O-CG 3.23Å; R996-E1000 PolarHBondContact O-N 3.11Å
997	K	85	Confident	84.5	Confident	99 Å²	99	89.3 Å²	89.3	43%	0.43	40%	0.403	S	S	.	.	H	α-helix	trans	-58.8	-45.9	176	-75.1	165.1	-174.1	153.5	0	112.3	E993 K999 E1000 E1001	E993-K997 WeakPolarHBondContact O-CB 3.3Å; E993-K997 VanDerWaalsContact O-CG 3.28Å; E993-K997 WeakPolarHBondContact O-CG 3.38Å; E993-K997 PolarHBondContact O-N 3.15Å; E993-K997 WeakPolarHBondContact OE2-CE 3.27Å; E993-K997 IonicContact OE2-NZ 3.5Å; E993-K997 PolarHBondContact OE2-NZ 3.25Å; K997-K999 VanDerWaalsContact C-N 3.35Å; K997-K999 PolarHBondContact O-N 2.86Å; K997-E1000 PolarHBondContact O-N 3.46Å; K997-E1001 WeakPolarHBondContact O-CB 3.47Å; K997-E1001 PolarHBondContact O-N 2.77Å
998	R	81.3	Confident	83.5	Confident	175 Å²	175	89.5 Å²	89.5	66%	0.66	41%	0.405	S	S	*	.	H	α-helix	trans	-57.7	-46.8	173.9	-74.8	172.7	-179.5	175.7	1.9	111.3	N994 R996 E1001 E1002	N994-R998 WeakPolarHBondContact O-CB 3.35Å; N994-R998 VanDerWaalsContact O-CG 3.28Å; N994-R998 WeakPolarHBondContact O-CG 3.5Å; N994-R998 PolarHBondContact O-N 3.01Å; R996-R998 PolarHBondContact O-N 2.89Å; R998-E1001 PolarHBondContact O-N 3.24Å; R998-E1002 WeakPolarHBondContact O-CB 3.31Å; R998-E1002 WeakPolarHBondContact O-CG 3.41Å; R998-E1002 PolarHBondContact O-N 3.26Å
999	K	82	Confident	82.5	Confident	140 Å²	140	92.6 Å²	92.6	61%	0.609	42%	0.419	S	S	*	.	H	α-helix	trans	-66.4	-41.1	179.5	-172.6	170.7	-176.7	170.3	0	113.5	I995 R996 K997 E1001 E1002 E1003	I995-K999 WeakPolarHBondContact O-CB 3.35Å; I995-K999 PolarHBondContact O-N 3.43Å; R996-K999 PolarHBondContact O-N 3.47Å; R996-K999 VanDerWaalsContact O-N 3.17Å; K997-K999 VanDerWaalsContact C-N 3.35Å; K997-K999 PolarHBondContact O-N 2.86Å; K999-E1001 VanDerWaalsContact C-N 3.31Å; K999-E1002 PolarHBondContact O-N 3.38Å; K999-E1003 WeakPolarHBondContact O-CB 3.27Å; K999-E1003 PolarHBondContact O-N 3.5Å
1000	E	81.3	Confident	81.6	Confident	83 Å²	83	93.2 Å²	93.2	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-38.1	173.5	-73	172.4	-150.4	0	0	111.4	R996 K997 R1004	R996-E1000 WeakPolarHBondContact CD-OE1 3.41Å; R996-E1000 HydrophobicContact CG-CG 4.5Å; R996-E1000 WeakPolarHBondContact CG-OE1 3.46Å; R996-E1000 IonicContact CZ-OE1 2.83Å; R996-E1000 IonicContact NE-OE1 2.62Å; R996-E1000 PolarHBondContact NE-OE1 3.29Å; R996-E1000 WeakPolarHBondContact O-CB 3.25Å; R996-E1000 WeakPolarHBondContact O-CG 3.23Å; R996-E1000 PolarHBondContact O-N 3.11Å; K997-E1000 PolarHBondContact O-N 3.46Å; E1000-R1004 VanDerWaalsContact O-CB 3.28Å; E1000-R1004 WeakPolarHBondContact O-CB 3.5Å; E1000-R1004 PolarHBondContact O-N 3.22Å
1001	E	74.4	Confident	80.6	Confident	74 Å²	74	94.4 Å²	94.4	35%	0.346	44%	0.438	S	S	.	.	H	α-helix	trans	-70.5	-39.9	175.4	-163.7	-164.6	142.4	0	0	112.3	K997 R998 K999 R1004 R1005	K997-E1001 WeakPolarHBondContact O-CB 3.47Å; K997-E1001 PolarHBondContact O-N 2.77Å; R998-E1001 PolarHBondContact O-N 3.24Å; K999-E1001 VanDerWaalsContact C-N 3.31Å; E1001-R1004 PolarHBondContact O-N 2.66Å; E1001-R1005 WeakPolarHBondContact O-CB 3.43Å; E1001-R1005 VanDerWaalsContact O-CG 3.27Å; E1001-R1005 WeakPolarHBondContact O-CG 3.42Å; E1001-R1005 PolarHBondContact O-N 3.37Å; E1001-R1005 IonicContact OE1-CZ 3.26Å; E1001-R1005 IonicContact OE1-NE 2.92Å; E1001-R1005 PolarHBondContact OE1-NE 3.15Å; E1001-R1005 IonicContact OE1-NH2 3.11Å; E1001-R1005 PolarHBondContact OE1-NH2 2.94Å
1002	E	74.8	Confident	79.7	Confident	111 Å²	111	93.3 Å²	93.3	52%	0.519	44%	0.435	S	S	.	.	H	α-helix	trans	-63.7	-41.5	172.7	-75	179.2	156.6	0	0	112	R998 K999 R1005 A1006	R998-E1002 WeakPolarHBondContact O-CB 3.31Å; R998-E1002 WeakPolarHBondContact O-CG 3.41Å; R998-E1002 PolarHBondContact O-N 3.26Å; K999-E1002 PolarHBondContact O-N 3.38Å; E1002-R1005 PolarHBondContact O-N 2.96Å; E1002-A1006 WeakPolarHBondContact O-CB 3.18Å; E1002-A1006 PolarHBondContact O-N 3.15Å
1003	E	77.4	Confident	78.9	Confident	102 Å²	102	98.3 Å²	98.3	48%	0.477	46%	0.456	S	S	.	.	H	α-helix	trans	-65.9	-38.3	174.5	-164.5	-176.2	139.1	0	0	111.6	K999 A1006 K1007	K999-E1003 WeakPolarHBondContact O-CB 3.27Å; K999-E1003 PolarHBondContact O-N 3.5Å; E1003-A1006 PolarHBondContact O-N 3Å; E1003-K1007 HydrophobicContact CG-CD 4.45Å; E1003-K1007 WeakPolarHBondContact O-CB 3.38Å; E1003-K1007 VanDerWaalsContact O-CG 3.32Å; E1003-K1007 WeakPolarHBondContact O-CG 3.39Å; E1003-K1007 PolarHBondContact O-N 2.95Å; E1003-K1007 WeakPolarHBondContact OE1-CE 3.31Å; E1003-K1007 IonicContact OE1-NZ 2.73Å; E1003-K1007 PolarHBondContact OE1-NZ 2.91Å
1004	R	77.4	Confident	78.2	Confident	135 Å²	135	101.2 Å²	101.2	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-65.3	-47.5	174.3	-166.3	-174.1	-50.5	111.9	10.5	111.6	E1000 E1001 A1006 K1007 M1008	E1000-R1004 VanDerWaalsContact O-CB 3.28Å; E1000-R1004 WeakPolarHBondContact O-CB 3.5Å; E1000-R1004 PolarHBondContact O-N 3.22Å; E1001-R1004 PolarHBondContact O-N 2.66Å; R1004-A1006 VanDerWaalsContact C-N 3.32Å; R1004-A1006 PolarHBondContact O-N 2.84Å; R1004-K1007 PolarHBondContact O-N 3.34Å; R1004-M1008 WeakPolarHBondContact O-CG 3.41Å; R1004-M1008 PolarHBondContact O-N 3.22Å
1005	R	75.8	Confident	77.2	Confident	127 Å²	127	102.9 Å²	102.9	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-40.6	174.2	-74.1	176.3	-176.3	-113.7	11.8	110.9	E1001 E1002 M1008 E1009	E1001-R1005 WeakPolarHBondContact O-CB 3.43Å; E1001-R1005 VanDerWaalsContact O-CG 3.27Å; E1001-R1005 WeakPolarHBondContact O-CG 3.42Å; E1001-R1005 PolarHBondContact O-N 3.37Å; E1001-R1005 IonicContact OE1-CZ 3.26Å; E1001-R1005 IonicContact OE1-NE 2.92Å; E1001-R1005 PolarHBondContact OE1-NE 3.15Å; E1001-R1005 IonicContact OE1-NH2 3.11Å; E1001-R1005 PolarHBondContact OE1-NH2 2.94Å; E1002-R1005 PolarHBondContact O-N 2.96Å; R1005-M1008 PolarHBondContact O-N 2.99Å; R1005-E1009 WeakPolarHBondContact O-CB 3.25Å; R1005-E1009 PolarHBondContact O-N 2.68Å
1006	A	74.6	Confident	76.3	Confident	54 Å²	54	106.2 Å²	106.2	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-68.3	-39.5	177.1	0	0	0	0	0	112.8	E1002 E1003 R1004 E1009 A1010	E1002-A1006 WeakPolarHBondContact O-CB 3.18Å; E1002-A1006 PolarHBondContact O-N 3.15Å; E1003-A1006 PolarHBondContact O-N 3Å; R1004-A1006 VanDerWaalsContact C-N 3.32Å; R1004-A1006 PolarHBondContact O-N 2.84Å; A1006-E1009 PolarHBondContact O-N 3.3Å; A1006-A1010 WeakPolarHBondContact O-CB 3.39Å; A1006-A1010 PolarHBondContact O-N 3.09Å
1007	K	76.1	Confident	75.4	Confident	119 Å²	119	104.5 Å²	104.5	52%	0.517	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-44.3	173	-76.8	171.1	-178.3	170.1	0	111.6	E1003 R1004 A1010 Q1011	E1003-K1007 HydrophobicContact CG-CD 4.45Å; E1003-K1007 WeakPolarHBondContact O-CB 3.38Å; E1003-K1007 VanDerWaalsContact O-CG 3.32Å; E1003-K1007 WeakPolarHBondContact O-CG 3.39Å; E1003-K1007 PolarHBondContact O-N 2.95Å; E1003-K1007 WeakPolarHBondContact OE1-CE 3.31Å; E1003-K1007 IonicContact OE1-NZ 2.73Å; E1003-K1007 PolarHBondContact OE1-NZ 2.91Å; R1004-K1007 PolarHBondContact O-N 3.34Å; K1007-A1010 PolarHBondContact O-N 2.89Å; K1007-Q1011 WeakPolarHBondContact O-CB 3.38Å; K1007-Q1011 WeakPolarHBondContact O-CG 3.36Å; K1007-Q1011 PolarHBondContact O-N 2.97Å
1008	M	72.6	Confident	74.6	Confident	122 Å²	122	106 Å²	106	60%	0.601	49%	0.486	S	S	*	.	H	α-helix	trans	-67.2	-38.3	174.8	-64.1	-136.3	-59.2	0	0	112.4	R1004 R1005 A1010 Q1011 L1012	R1004-M1008 WeakPolarHBondContact O-CG 3.41Å; R1004-M1008 PolarHBondContact O-N 3.22Å; R1005-M1008 PolarHBondContact O-N 2.99Å; M1008-A1010 VanDerWaalsContact C-N 3.34Å; M1008-A1010 PolarHBondContact O-N 3Å; M1008-Q1011 PolarHBondContact O-N 2.66Å; M1008-L1012 WeakPolarHBondContact O-CB 3.32Å; M1008-L1012 PolarHBondContact O-N 3.46Å
1009	E	74.6	Confident	73.5	Confident	71 Å²	71	101.4 Å²	101.4	33%	0.332	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-38.5	173.7	-162.4	-162.8	135.4	0	0	111.3	R1005 A1006 K1013 K1061	R1005-E1009 WeakPolarHBondContact O-CB 3.25Å; R1005-E1009 PolarHBondContact O-N 2.68Å; A1006-E1009 PolarHBondContact O-N 3.3Å; E1009-K1013 WeakPolarHBondContact O-CB 3.45Å; E1009-K1013 PolarHBondContact O-N 3.21Å; E1009-K1061 IonicContact OE1-NZ 2.71Å; E1009-K1061 PolarHBondContact OE1-NZ 3.02Å; E1009-K1061 IonicContact OE2-NZ 3.22Å
1010	A	74.6	Confident	72.4	Confident	61 Å²	61	102 Å²	102	50%	0.504	47%	0.471	S	S	.	.	H	α-helix	trans	-65.1	-47.9	175.5	0	0	0	0	0	111.9	A1006 K1007 M1008 K1013 E1014	A1006-A1010 WeakPolarHBondContact O-CB 3.39Å; A1006-A1010 PolarHBondContact O-N 3.09Å; K1007-A1010 PolarHBondContact O-N 2.89Å; M1008-A1010 VanDerWaalsContact C-N 3.34Å; M1008-A1010 PolarHBondContact O-N 3Å; A1010-K1013 PolarHBondContact O-N 3.04Å; A1010-E1014 PolarHBondContact O-N 3.27Å
1011	Q	73.8	Confident	71.3	Confident	127 Å²	127	105.3 Å²	105.3	59%	0.593	48%	0.484	S	S	*	.	H	α-helix	trans	-61.3	-48.4	175.9	-73.9	172.1	-27.6	0	0	111.6	K1007 M1008 K1013 E1014 Q1015	K1007-Q1011 WeakPolarHBondContact O-CB 3.38Å; K1007-Q1011 WeakPolarHBondContact O-CG 3.36Å; K1007-Q1011 PolarHBondContact O-N 2.97Å; M1008-Q1011 PolarHBondContact O-N 2.66Å; Q1011-K1013 VanDerWaalsContact C-N 3.3Å; Q1011-K1013 PolarHBondContact O-N 3.13Å; Q1011-E1014 PolarHBondContact O-N 3.3Å; Q1011-Q1015 WeakPolarHBondContact O-CB 3.47Å; Q1011-Q1015 PolarHBondContact O-N 2.73Å
1012	L	74.2	Confident	70.4	Confident	76 Å²	76	104.7 Å²	104.7	40%	0.398	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-31.9	178	-172.8	65.5	0	0	0	111.9	M1008 R1016	M1008-L1012 WeakPolarHBondContact O-CB 3.32Å; M1008-L1012 PolarHBondContact O-N 3.46Å; L1012-R1016 HydrophobicContact CG-CG 4.49Å; L1012-R1016 VanDerWaalsContact O-CB 3.24Å; L1012-R1016 WeakPolarHBondContact O-CB 3.3Å; L1012-R1016 VanDerWaalsContact O-CG 3.25Å; L1012-R1016 WeakPolarHBondContact O-CG 3.49Å; L1012-R1016 PolarHBondContact O-N 3.03Å
1013	K	74.5	Confident	69.3	Low	120 Å²	120	108.4 Å²	108.4	52%	0.522	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-43.1	172	-178.1	-178.9	176.4	-62	0	111.2	E1009 A1010 Q1011 R1016 E1017	E1009-K1013 WeakPolarHBondContact O-CB 3.45Å; E1009-K1013 PolarHBondContact O-N 3.21Å; A1010-K1013 PolarHBondContact O-N 3.04Å; Q1011-K1013 VanDerWaalsContact C-N 3.3Å; Q1011-K1013 PolarHBondContact O-N 3.13Å; K1013-R1016 PolarHBondContact O-N 3.02Å; K1013-E1017 IonicContact NZ-OE2 3.37Å; K1013-E1017 PolarHBondContact NZ-OE2 2.57Å; K1013-E1017 WeakPolarHBondContact O-CB 3.4Å; K1013-E1017 PolarHBondContact O-N 3.18Å
1014	E	75	Confident	67.9	Low	109 Å²	109	112.3 Å²	112.3	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-41	176.2	-163.9	-166.9	140.8	0	0	111.4	A1010 Q1011 E1017 K1018	A1010-E1014 PolarHBondContact O-N 3.27Å; Q1011-E1014 PolarHBondContact O-N 3.3Å; E1014-E1017 PolarHBondContact O-N 3.37Å; E1014-K1018 WeakPolarHBondContact O-CG 3.42Å; E1014-K1018 PolarHBondContact O-N 2.66Å; E1014-K1018 WeakPolarHBondContact OE1-CE 3.32Å; E1014-K1018 IonicContact OE1-NZ 2.66Å; E1014-K1018 PolarHBondContact OE1-NZ 2.68Å
1015	Q	68.8	Low	66.4	Low	102 Å²	102	110 Å²	110	48%	0.477	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-52.4	173.6	179.7	173.9	-10.5	0	0	111.5	Q1011 E1017 K1018 E1019	Q1011-Q1015 WeakPolarHBondContact O-CB 3.47Å; Q1011-Q1015 PolarHBondContact O-N 2.73Å; Q1015-E1017 PolarHBondContact O-N 3.15Å; Q1015-K1018 WeakPolarHBondContact O-CB 3.36Å; Q1015-K1018 PolarHBondContact O-N 3.43Å; Q1015-K1018 VanDerWaalsContact O-N 3.07Å; Q1015-E1019 HydrophobicContact CG-CG 4.39Å; Q1015-E1019 WeakPolarHBondContact CG-OE1 3.39Å; Q1015-E1019 PolarHBondContact NE2-OE1 3.09Å; Q1015-E1019 WeakPolarHBondContact O-CB 3.38Å; Q1015-E1019 WeakPolarHBondContact O-CG 3.22Å; Q1015-E1019 PolarHBondContact O-N 2.81Å
1016	R	68.5	Low	65	Low	127 Å²	127	112.8 Å²	112.8	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-27.9	174.5	-75	179.2	176.2	-143.4	-2	112.6	L1012 K1013 R1020	L1012-R1016 HydrophobicContact CG-CG 4.49Å; L1012-R1016 VanDerWaalsContact O-CB 3.24Å; L1012-R1016 WeakPolarHBondContact O-CB 3.3Å; L1012-R1016 VanDerWaalsContact O-CG 3.25Å; L1012-R1016 WeakPolarHBondContact O-CG 3.49Å; L1012-R1016 PolarHBondContact O-N 3.03Å; K1013-R1016 PolarHBondContact O-N 3.02Å; R1016-R1020 WeakPolarHBondContact O-CB 3.46Å; R1016-R1020 PolarHBondContact O-N 2.96Å
1017	E	65.8	Low	63.3	Low	61 Å²	61	114.3 Å²	114.3	29%	0.285	55%	0.554	S	S	.	*	H	α-helix	trans	-74.5	-37.2	175	-171.1	114.3	-120.2	0	0	112	K1013 E1014 Q1015 R1020 K1021	K1013-E1017 IonicContact NZ-OE2 3.37Å; K1013-E1017 PolarHBondContact NZ-OE2 2.57Å; K1013-E1017 WeakPolarHBondContact O-CB 3.4Å; K1013-E1017 PolarHBondContact O-N 3.18Å; E1014-E1017 PolarHBondContact O-N 3.37Å; Q1015-E1017 PolarHBondContact O-N 3.15Å; E1017-R1020 IonicContact OE1-CZ 3.83Å; E1017-R1020 IonicContact OE1-NH2 3.12Å; E1017-R1020 PolarHBondContact OE1-NH2 3.5Å; E1017-K1021 WeakPolarHBondContact O-CG 3.34Å; E1017-K1021 PolarHBondContact O-N 3.36Å; E1017-K1021 VanDerWaalsContact O-N 3.17Å
1018	K	68.8	Low	61.3	Low	129 Å²	129	116.6 Å²	116.6	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-67.5	-47.7	170	-70.2	167.7	-174.7	169.9	0	111.3	E1014 Q1015 R1020 K1021 A1022	E1014-K1018 WeakPolarHBondContact O-CG 3.42Å; E1014-K1018 PolarHBondContact O-N 2.66Å; E1014-K1018 WeakPolarHBondContact OE1-CE 3.32Å; E1014-K1018 IonicContact OE1-NZ 2.66Å; E1014-K1018 PolarHBondContact OE1-NZ 2.68Å; Q1015-K1018 WeakPolarHBondContact O-CB 3.36Å; Q1015-K1018 PolarHBondContact O-N 3.43Å; Q1015-K1018 VanDerWaalsContact O-N 3.07Å; K1018-R1020 PolarHBondContact O-N 3.35Å; K1018-K1021 WeakPolarHBondContact O-CB 3.45Å; K1018-K1021 PolarHBondContact O-N 3.27Å; K1018-A1022 PolarHBondContact O-N 3.44Å
1019	E	59.3	Low	59.2	Low	80 Å²	80	114 Å²	114	37%	0.374	58%	0.576	S	S	.	*	H	α-helix	trans	-62.8	-39.3	176.4	-71.5	169.4	-174.9	0	0	112.1	Q1015 K1021 A1022 R1023	Q1015-E1019 HydrophobicContact CG-CG 4.39Å; Q1015-E1019 WeakPolarHBondContact CG-OE1 3.39Å; Q1015-E1019 PolarHBondContact NE2-OE1 3.09Å; Q1015-E1019 WeakPolarHBondContact O-CB 3.38Å; Q1015-E1019 WeakPolarHBondContact O-CG 3.22Å; Q1015-E1019 PolarHBondContact O-N 2.81Å; E1019-K1021 VanDerWaalsContact C-N 3.33Å; E1019-K1021 PolarHBondContact O-N 2.8Å; E1019-A1022 PolarHBondContact O-N 3.32Å; E1019-R1023 WeakPolarHBondContact O-CB 3.25Å; E1019-R1023 WeakPolarHBondContact O-CG 3.38Å; E1019-R1023 PolarHBondContact O-N 3.07Å
1020	R	57.3	Low	57.3	Low	151 Å²	151	119.8 Å²	119.8	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-64.4	-36.2	174	-178	174.8	70.7	150.5	0.7	112.3	R1016 E1017 K1018 K1024	R1016-R1020 WeakPolarHBondContact O-CB 3.46Å; R1016-R1020 PolarHBondContact O-N 2.96Å; E1017-R1020 IonicContact OE1-CZ 3.83Å; E1017-R1020 IonicContact OE1-NH2 3.12Å; E1017-R1020 PolarHBondContact OE1-NH2 3.5Å; K1018-R1020 PolarHBondContact O-N 3.35Å; R1020-K1024 WeakPolarHBondContact O-CB 3.39Å; R1020-K1024 PolarHBondContact O-N 3.5Å
1021	K	59.5	Low	55.3	Low	153 Å²	153	124.6 Å²	124.6	67%	0.665	62%	0.621	S	S	*	*	H	α-helix	trans	-67	-41	172.3	-74.7	173.3	178.2	-177.3	0	111.3	E1017 K1018 E1019 A1025	E1017-K1021 WeakPolarHBondContact O-CG 3.34Å; E1017-K1021 PolarHBondContact O-N 3.36Å; E1017-K1021 VanDerWaalsContact O-N 3.17Å; K1018-K1021 WeakPolarHBondContact O-CB 3.45Å; K1018-K1021 PolarHBondContact O-N 3.27Å; E1019-K1021 VanDerWaalsContact C-N 3.33Å; E1019-K1021 PolarHBondContact O-N 2.8Å; K1021-A1025 PolarHBondContact O-N 3.29Å
1022	A	54.1	Low	53.7	Low	61 Å²	61	126.6 Å²	126.6	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-67.6	-43	175.5	0	0	0	0	0	113.2	K1018 E1019 A1025 K1026	K1018-A1022 PolarHBondContact O-N 3.44Å; E1019-A1022 PolarHBondContact O-N 3.32Å; A1022-A1025 PolarHBondContact O-N 2.87Å; A1022-A1025 VanDerWaalsContact O-N 3.1Å; A1022-K1026 PolarHBondContact O-N 3.41Å
1023	R	52.9	Low	52	Low	190 Å²	190	125.2 Å²	125.2	72%	0.717	64%	0.64	S	S	*	*	H	α-helix	trans	-66.9	-35.6	176.1	-72.8	-171.5	-177.8	-158.4	1.9	112.1	E1019 A1025 K1026 A1027	E1019-R1023 WeakPolarHBondContact O-CB 3.25Å; E1019-R1023 WeakPolarHBondContact O-CG 3.38Å; E1019-R1023 PolarHBondContact O-N 3.07Å; R1023-A1025 PolarHBondContact O-N 3.37Å; R1023-A1025 VanDerWaalsContact O-N 3.16Å; R1023-K1026 CarbonylContact O-C 3.59Å; R1023-K1026 PolarHBondContact O-N 3.09Å; R1023-A1027 PolarHBondContact O-N 3.33Å
1024	K	48.5	Very low	51	Low	184 Å²	184	120.5 Å²	120.5	80%	0.8	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-16	170.6	-89.7	-156.5	166.7	-154.8	0	114.4	R1020	R1020-K1024 WeakPolarHBondContact O-CB 3.39Å; R1020-K1024 PolarHBondContact O-N 3.5Å
1025	A	46.3	Very low	50.6	Low	86 Å²	86	119.4 Å²	119.4	71%	0.711	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	5.9	172.1	0	0	0	0	0	113.5	K1021 A1022 R1023	K1021-A1025 PolarHBondContact O-N 3.29Å; A1022-A1025 PolarHBondContact O-N 2.87Å; A1022-A1025 VanDerWaalsContact O-N 3.1Å; R1023-A1025 PolarHBondContact O-N 3.37Å; R1023-A1025 VanDerWaalsContact O-N 3.16Å
1026	K	44.6	Very low	51.1	Low	186 Å²	186	114.6 Å²	114.6	81%	0.809	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	-9.3	179.7	-76.1	-163.4	169.7	-165.4	0	115.2	A1022 R1023 N1028	A1022-K1026 PolarHBondContact O-N 3.41Å; R1023-K1026 CarbonylContact O-C 3.59Å; R1023-K1026 PolarHBondContact O-N 3.09Å; K1026-N1028 PolarHBondContact O-N 3.17Å
1027	A	39.2	Very low	51.7	Low	85 Å²	85	110.2 Å²	110.2	70%	0.702	58%	0.584	S	S	*	*			trans	-79.8	68.9	177.1	0	0	0	0	0	111.4	R1023	R1023-A1027 PolarHBondContact O-N 3.33Å
1028	N	34.4	Very low	52.5	Low	167 Å²	167	111.2 Å²	111.2	89%	0.893	59%	0.591	S	S	*	*			trans	-150	89.9	168.6	-129.7	55	0	0	0	106.8	K1026	K1026-N1028 PolarHBondContact O-N 3.17Å
1029	G	29.4	Very low	53.1	Low	68 Å²	68	107.8 Å²	107.8	70%	0.701	58%	0.578	S	S	*	*	S	Bend	trans	177.7	147.2	-174.4	0	0	0	0	0	108.7
1030	E	33.9	Very low	54.3	Low	192 Å²	192	104.2 Å²	104.2	90%	0.897	56%	0.562	S	S	*	*			trans	-65.8	158.2	-166.1	-65.6	93.4	161.2	0	0	115
1031	D	32.7	Very low	55.7	Low	162 Å²	162	100.3 Å²	100.3	87%	0.866	56%	0.558	S	S	*	*			trans	-130.9	117.8	177.7	-155.8	10.6	0	0	0	106.8
1032	D	39.5	Very low	56.9	Low	170 Å²	170	94.4 Å²	94.4	91%	0.909	54%	0.538	S	S	*	.			trans	-135.8	89.5	-176.4	-177	36.5	0	0	0	108.4
1033	G	38.5	Very low	58.4	Low	47 Å²	47	91.8 Å²	91.8	49%	0.485	52%	0.515	S	S	.	.			trans	-146.5	146.4	-174.7	0	0	0	0	0	109.9
1034	G	53.7	Low	59.9	Low	21 Å²	21	87.6 Å²	87.6	22%	0.216	50%	0.499	C	S	.	.			trans	-107	159	179.8	0	0	0	0	0	112.1	N192 F1036 D1037 D1038	N192-G1034 PolarHBondContact OD1-O 3.33Å; G1034-F1036 PolarHBondContact O-N 3.29Å; G1034-D1037 PolarHBondContact O-N 3.42Å; G1034-D1037 VanDerWaalsContact O-N 3.1Å; G1034-D1038 WeakPolarHBondContact O-CB 3.46Å; G1034-D1038 PolarHBondContact O-N 3.26Å
1035	E	67.6	Low	61.5	Low	86 Å²	86	80.6 Å²	80.6	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-51.7	-30.2	-166.9	-59.7	-171.6	135.3	0	0	115.6	T69 R197 L1039	T69-E1035 WeakPolarHBondContact CG2-OE1 3.5Å; R197-E1035 IonicContact CZ-OE2 2.73Å; R197-E1035 IonicContact NH1-OE2 2.88Å; R197-E1035 IonicContact NH2-OE2 3.29Å; R197-E1035 PolarHBondContact NH2-OE2 2.95Å; E1035-L1039 VanDerWaalsContact O-CG 3.26Å; E1035-L1039 WeakPolarHBondContact O-CG 3.33Å; E1035-L1039 PolarHBondContact O-N 2.98Å
1036	F	79.2	Confident	63.1	Low	0 Å²	0	76.5 Å²	76.5	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-91	-39.1	-179.1	-166.2	-106.6	0	0	0	112.7	M191 N192 A231 V232 G1034 D1038 L1039 V1040	M191-F1036 HydrophobicContact CB-CD1 3.77Å; M191-F1036 HydrophobicContact CB-CE1 3.76Å; M191-F1036 HydrophobicContact CB-CG 4.21Å; M191-F1036 HydrophobicContact CB-CZ 4.19Å; M191-F1036 HydrophobicContact CE-CE1 4.32Å; M191-F1036 HydrophobicContact CE-CE2 3.99Å; M191-F1036 HydrophobicContact CE-CZ 3.67Å; M191-F1036 WeakPolarHBondContact O-CB 3.35Å; M191-F1036 WeakPolarHBondContact O-CG 3.43Å; M191-F1036 HydrophobicContact SD-CE1 4.33Å; M191-F1036 HydrophobicContact SD-CZ 4.21Å; N192-F1036 HydrophobicContact CB-CB 4.4Å; N192-F1036 PolarHBondContact OD1-N 3.42Å; N192-F1036 VanDerWaalsContact OD1-N 3.15Å; A231-F1036 HydrophobicContact CB-CD2 4.37Å; A231-F1036 HydrophobicContact CB-CE1 4.27Å; A231-F1036 HydrophobicContact CB-CE2 3.6Å; A231-F1036 HydrophobicContact CB-CZ 3.53Å; V232-F1036 HydrophobicContact CG2-CZ 4.41Å; G1034-F1036 PolarHBondContact O-N 3.29Å; F1036-D1038 PolarHBondContact O-N 3.23Å; F1036-L1039 HydrophobicContact CD2-CD1 4.46Å; F1036-L1039 PolarHBondContact O-N 3.42Å; F1036-L1039 VanDerWaalsContact O-N 3.16Å; F1036-V1040 HydrophobicContact CD1-CG2 4.25Å; F1036-V1040 HydrophobicContact CE1-CG2 4.07Å; F1036-V1040 WeakPolarHBondContact O-CG2 3.43Å; F1036-V1040 PolarHBondContact O-N 2.65Å
1037	D	80.6	Confident	64.8	Low	35 Å²	35	73.8 Å²	73.8	19%	0.187	43%	0.43	C	S	.	.	H	α-helix	trans	-65.1	-29.2	170.5	-94.9	-30.3	0	0	0	110.8	K188 N192 G1034 S1041	K188-D1037 WeakPolarHBondContact CE-OD1 3.48Å; K188-D1037 IonicContact NZ-OD1 2.88Å; K188-D1037 PolarHBondContact NZ-OD1 3.44Å; N192-D1037 PolarHBondContact OD1-N 3.27Å; G1034-D1037 PolarHBondContact O-N 3.42Å; G1034-D1037 VanDerWaalsContact O-N 3.1Å; D1037-S1041 WeakPolarHBondContact O-CB 3.39Å; D1037-S1041 PolarHBondContact O-N 3.2Å; D1037-S1041 PolarHBondContact O-OG 2.97Å
1038	D	82.1	Confident	66.6	Low	83 Å²	83	71.6 Å²	71.6	44%	0.444	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-47.1	167.2	-74.2	-7.2	0	0	0	111.9	G1034 F1036 V1040 S1041 A1042	G1034-D1038 WeakPolarHBondContact O-CB 3.46Å; G1034-D1038 PolarHBondContact O-N 3.26Å; F1036-D1038 PolarHBondContact O-N 3.23Å; D1038-V1040 PolarHBondContact O-N 2.63Å; D1038-S1041 PolarHBondContact O-N 2.87Å; D1038-A1042 WeakPolarHBondContact O-CB 3.46Å; D1038-A1042 PolarHBondContact O-N 3.06Å
1039	L	82.5	Confident	68.7	Low	56 Å²	56	63.8 Å²	63.8	29%	0.293	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-41.7	176.1	-77.1	168.5	0	0	0	111.8	L234 E1035 F1036 L1043	L234-L1039 HydrophobicContact CD2-CD2 3.89Å; E1035-L1039 VanDerWaalsContact O-CG 3.26Å; E1035-L1039 WeakPolarHBondContact O-CG 3.33Å; E1035-L1039 PolarHBondContact O-N 2.98Å; F1036-L1039 HydrophobicContact CD2-CD1 4.46Å; F1036-L1039 PolarHBondContact O-N 3.42Å; F1036-L1039 VanDerWaalsContact O-N 3.16Å; L1039-L1043 WeakPolarHBondContact O-CB 3.07Å; L1039-L1043 PolarHBondContact O-N 3.02Å
1040	V	83.9	Confident	70.7	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-47	174.3	172.2	0	0	0	0	110.4	E227 A231 F1036 D1038 L1043 W1044	E227-V1040 HydrophobicContact CB-CG1 3.76Å; E227-V1040 HydrophobicContact CG-CG1 3.76Å; A231-V1040 HydrophobicContact CB-CG2 3.6Å; F1036-V1040 HydrophobicContact CD1-CG2 4.25Å; F1036-V1040 HydrophobicContact CE1-CG2 4.07Å; F1036-V1040 WeakPolarHBondContact O-CG2 3.43Å; F1036-V1040 PolarHBondContact O-N 2.65Å; D1038-V1040 PolarHBondContact O-N 2.63Å; V1040-L1043 PolarHBondContact O-N 3.32Å; V1040-W1044 VanDerWaalsContact O-CB 3.3Å; V1040-W1044 WeakPolarHBondContact O-CB 3.28Å; V1040-W1044 PolarHBondContact O-N 3.3Å
1041	S	86.1	Confident	72.2	Confident	70 Å²	70	61.3 Å²	61.3	49%	0.49	34%	0.335	S	S	.	.	H	α-helix	trans	-64.9	-45.3	-178.7	-62.8	0	0	0	0	111.8	D1037 D1038 L1043 W1044 S1045	D1037-S1041 WeakPolarHBondContact O-CB 3.39Å; D1037-S1041 PolarHBondContact O-N 3.2Å; D1037-S1041 PolarHBondContact O-OG 2.97Å; D1038-S1041 PolarHBondContact O-N 2.87Å; S1041-L1043 VanDerWaalsContact C-N 3.28Å; S1041-L1043 PolarHBondContact O-N 3.26Å; S1041-W1044 PolarHBondContact O-N 3.28Å; S1041-S1045 WeakPolarHBondContact O-CB 3.35Å; S1041-S1045 PolarHBondContact O-N 2.76Å; S1041-S1045 PolarHBondContact O-OG 2.91Å; S1041-S1045 VanDerWaalsContact O-OG 3.13Å
1042	A	84.4	Confident	73.6	Confident	29 Å²	29	56.1 Å²	56.1	24%	0.24	31%	0.308	C	S	.	.	H	α-helix	trans	-70.3	-22.1	176.7	0	0	0	0	0	113.1	D1038 S1045 G1046 E1047 V1048	D1038-A1042 WeakPolarHBondContact O-CB 3.46Å; D1038-A1042 PolarHBondContact O-N 3.06Å; A1042-S1045 WeakPolarHBondContact CA-OG 3.42Å; A1042-S1045 PolarHBondContact O-OG 2.89Å; A1042-G1046 CarbonylContact O-C 3.6Å; A1042-G1046 VanDerWaalsContact O-C 3.25Å; A1042-G1046 WeakPolarHBondContact O-CA 3.42Å; A1042-G1046 PolarHBondContact O-N 3.42Å; A1042-E1047 PolarHBondContact O-N 2.99Å; A1042-V1048 HydrophobicContact CB-CG2 3.94Å; A1042-V1048 WeakPolarHBondContact O-CG2 3.31Å; A1042-V1048 PolarHBondContact O-N 2.9Å
1043	L	85.9	Confident	74.7	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-82.4	-36.8	172.3	178.3	60.5	0	0	0	111.9	L234 S285 A289 H333 L1039 V1040 S1041 G1046 V1048 F1049	L234-L1043 HydrophobicContact CD1-CD1 4.37Å; L234-L1043 HydrophobicContact CD1-CD2 4.02Å; S285-L1043 WeakPolarHBondContact OG-CD1 3.37Å; S285-L1043 WeakPolarHBondContact OG-CG 3.37Å; S285-L1043 PolarHBondContact OG-O 2.98Å; A289-L1043 HydrophobicContact CB-CD1 4.19Å; A289-L1043 HydrophobicContact CB-CD2 4.36Å; H333-L1043 PolarHBondContact CE1-O 3.27Å; H333-L1043 VanDerWaalsContact CE1-O 3.25Å; H333-L1043 PolarHBondContact NE2-O 3.19Å; L1039-L1043 WeakPolarHBondContact O-CB 3.07Å; L1039-L1043 PolarHBondContact O-N 3.02Å; V1040-L1043 PolarHBondContact O-N 3.32Å; S1041-L1043 VanDerWaalsContact C-N 3.28Å; S1041-L1043 PolarHBondContact O-N 3.26Å; L1043-G1046 VanDerWaalsContact O-CA 3.31Å; L1043-G1046 WeakPolarHBondContact O-CA 3.46Å; L1043-G1046 PolarHBondContact O-N 3.44Å; L1043-V1048 HydrophobicContact CB-CG2 4.45Å; L1043-F1049 HydrophobicContact CD1-CE2 3.6Å; L1043-F1049 HydrophobicContact CD1-CZ 3.62Å
1044	W	84.4	Confident	75.5	Confident	102 Å²	102	48.5 Å²	48.5	39%	0.386	26%	0.259	S	S	.	.	H	α-helix	trans	-78.1	-42.2	178.4	-161.4	97.8	0	0	0	112	T329 H333 V1040 S1041 G1046	T329-W1044 HydrophobicContact CG2-CE3 4.46Å; T329-W1044 WeakPolarHBondContact CG2-O 3.31Å; H333-W1044 PolarHBondContact NE2-O 3.07Å; V1040-W1044 VanDerWaalsContact O-CB 3.3Å; V1040-W1044 WeakPolarHBondContact O-CB 3.28Å; V1040-W1044 PolarHBondContact O-N 3.3Å; S1041-W1044 PolarHBondContact O-N 3.28Å; W1044-G1046 PolarHBondContact O-N 3.09Å
1045	S	83.5	Confident	75.6	Confident	37 Å²	37	53 Å²	53	26%	0.259	27%	0.273	S	S	.	.	S	Bend	trans	-63.1	-25.7	162.1	82.5	0	0	0	0	111.4	R332 S1041 A1042 E1047	R332-S1045 PolarHBondContact NE-O 2.88Å; R332-S1045 PolarHBondContact NH2-O 3.46Å; S1041-S1045 WeakPolarHBondContact O-CB 3.35Å; S1041-S1045 PolarHBondContact O-N 2.76Å; S1041-S1045 PolarHBondContact O-OG 2.91Å; S1041-S1045 VanDerWaalsContact O-OG 3.13Å; A1042-S1045 WeakPolarHBondContact CA-OG 3.42Å; A1042-S1045 PolarHBondContact O-OG 2.89Å; S1045-E1047 VanDerWaalsContact C-N 3.25Å; S1045-E1047 WeakPolarHBondContact CB-OE2 3.48Å; S1045-E1047 PolarHBondContact O-N 3.1Å; S1045-E1047 WeakPolarHBondContact OG-CB 3.47Å; S1045-E1047 VanDerWaalsContact OG-CD 3.31Å; S1045-E1047 WeakPolarHBondContact OG-CG 3.06Å; S1045-E1047 PolarHBondContact OG-N 3.16Å; S1045-E1047 PolarHBondContact OG-OE2 3.07Å
1046	G	79.2	Confident	74.7	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.			trans	62.7	24.1	-177.4	0	0	0	0	0	114.5	R332 A1042 L1043 W1044 V1048 F1049	R332-G1046 VanDerWaalsContact CZ-CA 3.41Å; R332-G1046 VanDerWaalsContact NH2-CA 3.3Å; A1042-G1046 CarbonylContact O-C 3.6Å; A1042-G1046 VanDerWaalsContact O-C 3.25Å; A1042-G1046 WeakPolarHBondContact O-CA 3.42Å; A1042-G1046 PolarHBondContact O-N 3.42Å; L1043-G1046 VanDerWaalsContact O-CA 3.31Å; L1043-G1046 WeakPolarHBondContact O-CA 3.46Å; L1043-G1046 PolarHBondContact O-N 3.44Å; W1044-G1046 PolarHBondContact O-N 3.09Å; G1046-V1048 PolarHBondContact O-N 3.31Å; G1046-F1049 WeakPolarHBondContact O-CB 3.39Å; G1046-F1049 PolarHBondContact O-N 3.17Å
1047	E	79.1	Confident	73.5	Confident	130 Å²	130	56.1 Å²	56.1	61%	0.607	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-60	-24.6	169.5	-74	163.7	136.4	0	0	112.5	A1042 S1045 F1049 D1050	A1042-E1047 PolarHBondContact O-N 2.99Å; S1045-E1047 VanDerWaalsContact C-N 3.25Å; S1045-E1047 WeakPolarHBondContact CB-OE2 3.48Å; S1045-E1047 PolarHBondContact O-N 3.1Å; S1045-E1047 WeakPolarHBondContact OG-CB 3.47Å; S1045-E1047 VanDerWaalsContact OG-CD 3.31Å; S1045-E1047 WeakPolarHBondContact OG-CG 3.06Å; S1045-E1047 PolarHBondContact OG-N 3.16Å; S1045-E1047 PolarHBondContact OG-OE2 3.07Å; E1047-F1049 PolarHBondContact O-N 2.88Å; E1047-D1050 PolarHBondContact O-N 2.91Å
1048	V	78.2	Confident	72	Confident	39 Å²	39	63.4 Å²	63.4	24%	0.236	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-44.7	-43.2	164.1	166	0	0	0	0	111.6	L234 A1042 L1043 G1046	L234-V1048 HydrophobicContact CD2-CG1 4.12Å; L234-V1048 HydrophobicContact CD2-CG2 3.92Å; A1042-V1048 HydrophobicContact CB-CG2 3.94Å; A1042-V1048 WeakPolarHBondContact O-CG2 3.31Å; A1042-V1048 PolarHBondContact O-N 2.9Å; L1043-V1048 HydrophobicContact CB-CG2 4.45Å; G1046-V1048 PolarHBondContact O-N 3.31Å
1049	F	79.1	Confident	70	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.009	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-89.1	-12.1	-175.6	-55.5	-60.1	0	0	0	113.7	N288 H333 Y336 L1043 G1046 E1047 K1051 D1052 L1053	N288-F1049 HydrophobicContact CB-CE1 4.44Å; N288-F1049 HydrophobicContact CB-CE2 4.14Å; N288-F1049 HydrophobicContact CB-CZ 3.84Å; H333-F1049 AromaticContact CE1-CE2 3.78Å; H333-F1049 AromaticContact ND1-CE2 3.93Å; Y336-F1049 HydrophobicContact CD1-CD1 4.05Å; Y336-F1049 HydrophobicContact CD1-CE1 4.38Å; Y336-F1049 HydrophobicContact CD1-CG 4.15Å; Y336-F1049 HydrophobicContact CD2-CB 3.63Å; Y336-F1049 HydrophobicContact CD2-CD1 4.27Å; Y336-F1049 HydrophobicContact CD2-CG 4.09Å; Y336-F1049 AromaticContact CE1-CD1 3.48Å; Y336-F1049 HydrophobicContact CE1-CD1 3.48Å; Y336-F1049 VanDerWaalsContact CE1-CD1 3.48Å; Y336-F1049 AromaticContact CE1-CE1 3.71Å; Y336-F1049 HydrophobicContact CE1-CE1 3.71Å; Y336-F1049 HydrophobicContact CE1-CG 4.04Å; Y336-F1049 HydrophobicContact CE1-CZ 4.45Å; Y336-F1049 HydrophobicContact CE2-CB 3.66Å; Y336-F1049 AromaticContact CE2-CD1 3.72Å; Y336-F1049 HydrophobicContact CE2-CD1 3.72Å; Y336-F1049 AromaticContact CE2-CG 3.97Å; Y336-F1049 HydrophobicContact CE2-CG 3.97Å; Y336-F1049 HydrophobicContact CG-CB 4.09Å; Y336-F1049 HydrophobicContact CG-CD1 4.4Å; Y336-F1049 HydrophobicContact CG-CG 4.16Å; Y336-F1049 AromaticContact CZ-CD1 3.28Å; Y336-F1049 AromaticContact CZ-CE1 3.89Å; Y336-F1049 AromaticContact CZ-CG 3.94Å; Y336-F1049 WeakPolarHBondContact OH-CD1 3.4Å; L1043-F1049 HydrophobicContact CD1-CE2 3.6Å; L1043-F1049 HydrophobicContact CD1-CZ 3.62Å; G1046-F1049 WeakPolarHBondContact O-CB 3.39Å; G1046-F1049 PolarHBondContact O-N 3.17Å; E1047-F1049 PolarHBondContact O-N 2.88Å; F1049-K1051 PolarHBondContact O-N 3.5Å; F1049-D1052 PolarHBondContact O-N 2.83Å; F1049-L1053 HydrophobicContact CB-CD1 4.4Å; F1049-L1053 PolarHBondContact O-N 3.43Å; F1049-L1053 VanDerWaalsContact O-N 3.09Å
1050	D	71.5	Confident	68.4	Low	46 Å²	46	66.1 Å²	66.1	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-73.3	-17.8	-170.2	-143.1	48.9	0	0	0	112.7	E1047 S1054	E1047-D1050 PolarHBondContact O-N 2.91Å; D1050-S1054 WeakPolarHBondContact O-CB 3.34Å; D1050-S1054 PolarHBondContact O-N 3.42Å; D1050-S1054 PolarHBondContact O-OG 3.4Å
1051	K	64.5	Low	66.4	Low	163 Å²	163	71.1 Å²	71.1	71%	0.709	34%	0.339	S	S	*	.	H	α-helix	trans	-60.4	-43.6	166.5	-76	173.4	-177.3	163.9	0	111.3	F1049 S1054 K1055	F1049-K1051 PolarHBondContact O-N 3.5Å; K1051-S1054 WeakPolarHBondContact O-CB 3.42Å; K1051-S1054 PolarHBondContact O-N 2.94Å; K1051-K1055 WeakPolarHBondContact O-CG 3.26Å; K1051-K1055 PolarHBondContact O-N 3.42Å
1052	D	62.5	Low	64.1	Low	53 Å²	53	76.2 Å²	76.2	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-82.4	-39.1	-177.5	-65.5	-50.9	0	0	0	112.4	Y336 M339 F1049 S1054 K1055 M1056	Y336-D1052 HydrophobicContact CE2-CB 4.33Å; M339-D1052 HydrophobicContact CE-CB 4.01Å; F1049-D1052 PolarHBondContact O-N 2.83Å; D1052-S1054 PolarHBondContact O-N 3.21Å; D1052-K1055 CarbonylContact O-C 3.48Å; D1052-K1055 WeakPolarHBondContact O-CB 3.21Å; D1052-K1055 PolarHBondContact O-N 3.24Å; D1052-K1055 VanDerWaalsContact OD1-CD 3.24Å; D1052-K1055 WeakPolarHBondContact OD1-CD 3.24Å; D1052-K1055 WeakPolarHBondContact OD1-CE 3.26Å; D1052-K1055 IonicContact OD1-NZ 2.85Å; D1052-K1055 PolarHBondContact OD1-NZ 2.97Å; D1052-M1056 PolarHBondContact O-N 2.61Å
1053	L	61.2	Low	62.1	Low	14 Å²	14	80.8 Å²	80.8	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-55.9	-34.2	166.8	-65.6	162.6	0	0	0	111.2	R332 Y336 M339 F1049 K1057	R332-L1053 HydrophobicContact CG-CD1 3.91Å; Y336-L1053 HydrophobicContact CD2-CD1 4.43Å; Y336-L1053 HydrophobicContact CD2-CD2 4.22Å; Y336-L1053 HydrophobicContact CD2-CG 4.08Å; M339-L1053 HydrophobicContact SD-CD2 3.78Å; M339-L1053 HydrophobicContact SD-CG 4.33Å; F1049-L1053 HydrophobicContact CB-CD1 4.4Å; F1049-L1053 PolarHBondContact O-N 3.43Å; F1049-L1053 VanDerWaalsContact O-N 3.09Å; L1053-K1057 WeakPolarHBondContact O-CD 3.38Å; L1053-K1057 WeakPolarHBondContact O-CG 3.23Å; L1053-K1057 PolarHBondContact O-N 3.05Å
1054	S	56.3	Low	59.9	Low	42 Å²	42	86.2 Å²	86.2	29%	0.294	40%	0.396	S	S	.	.	H	α-helix	trans	-75.6	-38	172.4	-68.1	0	0	0	0	113.8	D1050 K1051 D1052 M1056 K1057 R1058	D1050-S1054 WeakPolarHBondContact O-CB 3.34Å; D1050-S1054 PolarHBondContact O-N 3.42Å; D1050-S1054 PolarHBondContact O-OG 3.4Å; K1051-S1054 WeakPolarHBondContact O-CB 3.42Å; K1051-S1054 PolarHBondContact O-N 2.94Å; D1052-S1054 PolarHBondContact O-N 3.21Å; S1054-M1056 VanDerWaalsContact C-N 3.33Å; S1054-K1057 PolarHBondContact O-N 3.32Å; S1054-R1058 WeakPolarHBondContact O-CB 3.24Å; S1054-R1058 VanDerWaalsContact O-CG 3.29Å; S1054-R1058 WeakPolarHBondContact O-CG 3.47Å; S1054-R1058 PolarHBondContact O-N 2.91Å
1055	K	56.5	Low	57.6	Low	117 Å²	117	86.7 Å²	86.7	51%	0.509	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-43	170.8	-72.5	174.5	-154.4	161.8	0	110.4	K1051 D1052 R1058 N1059	K1051-K1055 WeakPolarHBondContact O-CG 3.26Å; K1051-K1055 PolarHBondContact O-N 3.42Å; D1052-K1055 CarbonylContact O-C 3.48Å; D1052-K1055 WeakPolarHBondContact O-CB 3.21Å; D1052-K1055 PolarHBondContact O-N 3.24Å; D1052-K1055 VanDerWaalsContact OD1-CD 3.24Å; D1052-K1055 WeakPolarHBondContact OD1-CD 3.24Å; D1052-K1055 WeakPolarHBondContact OD1-CE 3.26Å; D1052-K1055 IonicContact OD1-NZ 2.85Å; D1052-K1055 PolarHBondContact OD1-NZ 2.97Å; K1055-R1058 CarbonylContact O-C 3.6Å; K1055-R1058 PolarHBondContact O-N 3.05Å; K1055-N1059 WeakPolarHBondContact O-CB 3.41Å; K1055-N1059 PolarHBondContact O-N 3.36Å
1056	M	48.5	Very low	55.2	Low	63 Å²	63	92.1 Å²	92.1	31%	0.31	43%	0.427	S	S	.	.	H	α-helix	trans	-59.4	-50.5	176.9	-162.2	-139.4	-159.6	0	0	111.1	M339 D1052 S1054 R1058 N1059 R1060	M339-M1056 HydrophobicContact CB-CE 4.44Å; M339-M1056 HydrophobicContact CG-CB 4.45Å; M339-M1056 HydrophobicContact CG-CE 3.86Å; M339-M1056 HydrophobicContact CG-CG 4.08Å; M339-M1056 HydrophobicContact CG-SD 3.85Å; M339-M1056 HydrophobicContact SD-CB 3.78Å; M339-M1056 HydrophobicContact SD-CG 4.08Å; M339-M1056 HydrophobicContact SD-SD 4.15Å; D1052-M1056 PolarHBondContact O-N 2.61Å; S1054-M1056 VanDerWaalsContact C-N 3.33Å; M1056-R1058 VanDerWaalsContact C-N 3.29Å; M1056-R1058 PolarHBondContact O-N 3.12Å; M1056-N1059 PolarHBondContact O-N 3.46Å; M1056-R1060 WeakPolarHBondContact O-CB 3.25Å; M1056-R1060 PolarHBondContact O-N 2.98Å
1057	K	52.9	Low	53.1	Low	88 Å²	88	96.1 Å²	96.1	38%	0.383	46%	0.455	S	S	.	.	H	α-helix	trans	-60.6	-34.4	175.9	-72.2	165.9	-175.7	164.3	0	112.9	L1053 S1054 K1061	L1053-K1057 WeakPolarHBondContact O-CD 3.38Å; L1053-K1057 WeakPolarHBondContact O-CG 3.23Å; L1053-K1057 PolarHBondContact O-N 3.05Å; S1054-K1057 PolarHBondContact O-N 3.32Å; K1057-K1061 PolarHBondContact O-N 3.22Å
1058	R	48.8	Very low	51.3	Low	187 Å²	187	94.5 Å²	94.5	71%	0.706	45%	0.454	S	S	*	.	H	α-helix	trans	-76.2	-39.5	175.2	-72.1	176.8	-172.4	-169.6	4.7	113.2	S1054 K1055 M1056 K1061 R1062	S1054-R1058 WeakPolarHBondContact O-CB 3.24Å; S1054-R1058 VanDerWaalsContact O-CG 3.29Å; S1054-R1058 WeakPolarHBondContact O-CG 3.47Å; S1054-R1058 PolarHBondContact O-N 2.91Å; K1055-R1058 CarbonylContact O-C 3.6Å; K1055-R1058 PolarHBondContact O-N 3.05Å; M1056-R1058 VanDerWaalsContact C-N 3.29Å; M1056-R1058 PolarHBondContact O-N 3.12Å; R1058-K1061 CarbonylContact O-C 3.6Å; R1058-K1061 WeakPolarHBondContact O-CB 3.43Å; R1058-K1061 PolarHBondContact O-N 3.12Å; R1058-R1062 PolarHBondContact O-N 3.29Å
1059	N	41.8	Very low	49	Very low	88 Å²	88	98.7 Å²	98.7	47%	0.471	48%	0.476	S	S	.	.	H	α-helix	trans	-69.2	-39.8	177.4	-78.9	-10	0	0	0	111.2	K1055 M1056 K1061 R1062 I1063	K1055-N1059 WeakPolarHBondContact O-CB 3.41Å; K1055-N1059 PolarHBondContact O-N 3.36Å; M1056-N1059 PolarHBondContact O-N 3.46Å; N1059-K1061 PolarHBondContact O-N 2.81Å; N1059-R1062 PolarHBondContact O-N 2.99Å; N1059-I1063 WeakPolarHBondContact O-CG1 3.13Å; N1059-I1063 PolarHBondContact O-N 2.67Å
1060	R	47.6	Very low	46.6	Very low	108 Å²	108	103.7 Å²	103.7	41%	0.408	51%	0.511	S	S	.	.	H	α-helix	trans	-58	-36.9	170.7	-161.1	171.4	-170.9	151.7	5.2	111.7	M1056 N1064	M1056-R1060 WeakPolarHBondContact O-CB 3.25Å; M1056-R1060 PolarHBondContact O-N 2.98Å; R1060-N1064 WeakPolarHBondContact O-CB 3.32Å; R1060-N1064 PolarHBondContact O-N 3.15Å
1061	K	42.8	Very low	44.7	Very low	111 Å²	111	106.3 Å²	106.3	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-70.5	-38.5	169.5	-93	178.3	178.8	61	0	114.2	E1009 K1057 R1058 N1059 N1064 N1065	E1009-K1061 IonicContact OE1-NZ 2.71Å; E1009-K1061 PolarHBondContact OE1-NZ 3.02Å; E1009-K1061 IonicContact OE2-NZ 3.22Å; K1057-K1061 PolarHBondContact O-N 3.22Å; R1058-K1061 CarbonylContact O-C 3.6Å; R1058-K1061 WeakPolarHBondContact O-CB 3.43Å; R1058-K1061 PolarHBondContact O-N 3.12Å; N1059-K1061 PolarHBondContact O-N 2.81Å; K1061-N1064 PolarHBondContact O-N 3.06Å; K1061-N1065 PolarHBondContact O-N 3.29Å
1062	R	37	Very low	43.4	Very low	177 Å²	177	109 Å²	109	67%	0.668	54%	0.538	S	S	*	.	H	α-helix	trans	-70.7	-42	-177.8	-118.4	-179	179	-178.1	-2.1	112.5	R1058 N1059 N1064 N1065 Q1066	R1058-R1062 PolarHBondContact O-N 3.29Å; N1059-R1062 PolarHBondContact O-N 2.99Å; R1062-N1064 PolarHBondContact O-N 3.25Å; R1062-N1065 PolarHBondContact O-N 3.44Å; R1062-Q1066 PolarHBondContact O-N 2.63Å
1063	I	42.5	Very low	41.9	Very low	125 Å²	125	115.6 Å²	115.6	64%	0.641	57%	0.567	S	S	*	*	H	α-helix	trans	-58.2	-40.8	173.3	-68.1	165.3	0	0	0	110	N1059 N1065	N1059-I1063 WeakPolarHBondContact O-CG1 3.13Å; N1059-I1063 PolarHBondContact O-N 2.67Å; I1063-N1065 PolarHBondContact O-N 3.32Å
1064	N	39.5	Very low	40.5	Very low	118 Å²	118	126.1 Å²	126.1	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-74.5	-5.3	178.2	-147.2	55.3	0	0	0	115	R1060 K1061 R1062 S1067	R1060-N1064 WeakPolarHBondContact O-CB 3.32Å; R1060-N1064 PolarHBondContact O-N 3.15Å; K1061-N1064 PolarHBondContact O-N 3.06Å; R1062-N1064 PolarHBondContact O-N 3.25Å; N1064-S1067 PolarHBondContact O-OG 3.46Å
1065	N	35.6	Very low	39.4	Very low	112 Å²	112	130.1 Å²	130.1	60%	0.599	63%	0.631	S	S	*	*	H	α-helix	trans	-113.7	-20.6	175.9	-91.1	38.3	0	0	0	113.2	K1061 R1062 I1063 S1067 T1068	K1061-N1065 PolarHBondContact O-N 3.29Å; R1062-N1065 PolarHBondContact O-N 3.44Å; I1063-N1065 PolarHBondContact O-N 3.32Å; N1065-S1067 VanDerWaalsContact C-N 3.26Å; N1065-T1068 PolarHBondContact O-N 3.01Å; N1065-T1068 PolarHBondContact O-OG1 3.27Å
1066	Q	34.1	Very low	38.2	Very low	152 Å²	152	131.1 Å²	131.1	71%	0.71	65%	0.646	S	S	*	*	H	α-helix	trans	-76.8	-16.2	173.3	-76.5	-175	-49.6	0	0	112.6	R1062 T1068	R1062-Q1066 PolarHBondContact O-N 2.63Å; Q1066-T1068 VanDerWaalsContact C-N 3.29Å
1067	S	35.7	Very low	37.8	Very low	84 Å²	84	134.4 Å²	134.4	59%	0.587	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-6.1	171.2	51.5	0	0	0	0	114.5	N1064 N1065	N1064-S1067 PolarHBondContact O-OG 3.46Å; N1065-S1067 VanDerWaalsContact C-N 3.26Å
1068	T	41.3	Very low	36.7	Very low	96 Å²	96	139.9 Å²	139.9	59%	0.589	69%	0.694	S	S	*	*	S	Bend	trans	-116.4	-10.2	-170.6	54.8	0	0	0	0	116.3	N1065 Q1066	N1065-T1068 PolarHBondContact O-N 3.01Å; N1065-T1068 PolarHBondContact O-OG1 3.27Å; Q1066-T1068 VanDerWaalsContact C-N 3.29Å
1069	D	29.1	Very low	36	Very low	127 Å²	127	138.5 Å²	138.5	68%	0.679	70%	0.7	S	S	*	*	S	Bend	trans	-123.3	13.4	-167	-144.9	17.4	0	0	0	116	S1071	D1069-S1071 PolarHBondContact O-N 3.04Å
1070	S	29.3	Very low	35.5	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	72%	0.716	S	S	*	*	S	Bend	trans	-82.2	8.4	172.5	59.7	0	0	0	0	114.4
1071	S	32.2	Very low	34.8	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	76%	0.757	S	S	*	*			trans	-116.2	30.5	-162.5	-61.3	0	0	0	0	114.8	D1069	D1069-S1071 PolarHBondContact O-N 3.04Å
1072	R	37.2	Very low	34.4	Very low	221 Å²	221	150 Å²	150	83%	0.834	77%	0.771	S	S	*	*			trans	-139.5	60.5	-177.6	-78.5	-167.5	169	160.1	-1.3	116.3
1073	E	29.7	Very low	34.3	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	78%	0.776	S	S	*	*			trans	-118.3	142.9	141.1	-71.1	-159.9	131.6	0	0	109.8
1074	R	32.7	Very low	33.9	Very low	234 Å²	234	149.8 Å²	149.8	88%	0.883	78%	0.783	S	S	*	*			trans	-109.5	116.4	-178.8	-77.9	-178.9	172.5	177.1	-2.7	110.3	V1076	R1074-V1076 PolarHBondContact O-N 2.64Å
1075	P	32.3	Very low	33.5	Very low	127 Å²	127	151.7 Å²	151.7	83%	0.825	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.7	122.8	160.1	-13.5	29.2	0	0	0	109.4
1076	V	30.9	Very low	33.4	Very low	137 Å²	137	154.2 Å²	154.2	83%	0.83	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.3	126.5	166.2	174.7	0	0	0	0	108.1	R1074	R1074-V1076 PolarHBondContact O-N 2.64Å
1077	T	40.8	Very low	33.4	Very low	132 Å²	132	154.3 Å²	154.3	81%	0.81	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.1	124.9	180	39.7	0	0	0	0	112.5
1078	K	29.6	Very low	33.2	Very low	203 Å²	203	159.4 Å²	159.4	88%	0.883	83%	0.827	S	S	*	*			trans	-141.1	150.7	149.3	-82.2	-162	173.8	-177.8	0	109.7
1079	L	34.8	Very low	32.6	Very low	158 Å²	158	164.2 Å²	164.2	83%	0.827	85%	0.845	S	S	*	*			trans	-79.7	157	-176.7	-52.4	95.6	0	0	0	111.6
1080	N	30.2	Very low	32.9	Very low	152 Å²	152	167.3 Å²	167.3	81%	0.813	86%	0.859	S	S	*	*				-167.6	138.2	112.6	-97.6	-11.4	0	0	0	112
1081	I	34.6	Very low	33.2	Very low	246 Å²	246	172.8 Å²	172.8	100%	1.262	87%	0.869	S	S	*	*			trans	63.7	0	174.3	-55.4	166.3	0	0	0	113.9

Retrieved 1,081 of 1,081 residues in 2359.9 ms (Link to these results)

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