A0A5K4F362_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F362, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,068 aa.

						>A0A5K4F362_SCHMA|A0A5K4F362
MNKTFTKLAFSKHSNLYSSSGQLKYSSSLTMPKQQQLQNKDSYGVSTNSCLYCVTKTVHPRLGRGETYVCGYKPYRCEICNYSTTTKGNLAIHQQSDKHLNNLQEHEQTIFNTADTRSNHSESPDCNRHQQNNLHQNLTHLNSASKKSNSSCDLNILTAQTLSERRTISSSHQNMKLDQKTIEFLQNKTENEKVRDNININKAITNFLEIGLPNGEDRMHQPSCPSYSSSVTDSTSFCYDHPLKTFIPLTSSYDNLLCNLTETANHPLACQVCCTFTTDNLDVLIEHVERNRVPFDLDYVTNLITLHTNGFWFCKLCSYKSPLKANFQLHCKTEKHAQRLSFLVHVCEGGLWNQSRILSTLNICENKMLDISNNNNVQCSTTKGQNYITSSMNITTNLTTHNNNSSNVGNNSSNCNNVKNNFNLTSSIQLYCIACDLFTTSVHKFRLHCQTLSHIGAVKIFTHLVNRRNYLWNTLASLSLFYVDLLKSLIDENDNDEETDNGHTDSSLNSTNKLKHQTKFNKILLQLSSILTNLQVVYVCHKNYLPFISPLTNCSSPSSSSPSINLMSPDKSSQQCVTRFKSLTNALNHWHVSEHQRSIAKQQFLTDHENLPQYNQFNDSNYYSNEIFDIHWQLNDIEGNIEELPTMIIKILIPIINDSINKQSIHSNEYNTLINSNIINDIELINSKQDYNYNLKNSMKDNEENNYNNELIHDKMKMIDIPYEQDTMNKTDQQYRILVDSNEQIINKKFKLLSEYIGQSDRKLILSLHKTPTTSNAEDNHLPTISATGSNNIGDVIIPFSPTERNGEQVNETEAIRCHSQNNSSAIDQNCTEDLTNATKYKLQPCKKLNKTVISIKSHAGDWPTRPNSEPILKLTNHNSSEFEIDSNKINIYKAKTYQNLSDSTVNNQEYKNIMTANAFLSSNCTVEDNVSASRLFLPKELHISDEWRKSEQRLTASNTSNMSSPIHNFNICGTSVTPMELFAQMTAHYKQISENCNYAQSMELFLTNPSVITQLASMNVSKITETVSISTSTAQQPPSSSSSSSDFTLTPLTTISKPSDLSSKQIDKIDSPTNHKRMSTNDFFHEFNILPNLHSLLKQSFELIICENFSNIQNDKYCSEELLAFTLEVIVNDKVYYSNIYEKLNNHWFKLEYIHELQMKEGNLCTYCCSDNYNDNDNDEDDNVNNENGNDNNKKRKHQNQSHRFLLESSLELHRNLQHSKQISDSNNNPLTVILTNSTFNELVEKLNLLISNSTFSDLFHSSLENHCKLQPYIKSSSPNLLSIHLKHIQSDSFQSMPKSLLQTNEIELNTTNSSTSFIVEQNFSAKNLATDNNTTTTTKNDINNICDSNIPLSLSMITSDQANLLHKDSIINDPHETLTNNVYSDHSNLLLNYTTTNKNDPNENNNITGKDNKINSLLTEAYFNSIKDYHLNNHHENIKFYEQYKQQTNTSIYSLQKRSRTRLNETQLNILRSYFDINNSPSDEKINEICNKTGLQEKVVKHWFRNTLFKERQKNKDNPYNFSIPPSTSLNIEEYEKTGRIELNNNNSFKQNYKLLYLNNNNNNEQNDKDKMNNLNLETNSNDLIIMKDKMNNDLYSIDQSIENENINNGSLNSTMKRSCEMESLKIIDQMKWINQNKRQRLEKDIQDGSLNDERPTSIVSIEDSDIIYNYKRNLHPTMTTTTTTTPSTENTDGEVHSFVLADNSNNSHESPPSITSESSPSISETPLSPRLPMIPELDNPQGVLAALIHLGHHNHIQQQSKSESEQKLTNLWGFPYLSSTSSSSTIRGFLNGTEVYTDPNKLHCQLTALMNASLSRTMPHIQTSSDSNEAPLDLSAKTTQSINVNSTGDNNCQNSSSFILEQNAQIIDNEDNNDFPVNNQDQFLSVPSLIQTEHASSVYRSTSTTSSTNGGRRNRTSITALQSRCMHSIYNYHKTPSVHECDRLGEMIGLSRRVVQVWFQNQRAKEKKMARVSSGQYNLSVNSSLLTEKLSPIDSSSCIDSNFCQICSISIQKSEITNNSVLTNQQATNACNQSTNFSSHASFVDHLFSAVHLKKLLRWCTMDTT
					

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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	29.9	Very low	27.6	Very low	199 Å²	199	142.7 Å²	142.7	98%	0.98	74%	0.744	S	S	*	*				0	163.4	0	-93.8	-176.3	-88.6	0	0	110.8	K1429 D1430	M1-K1429 CarbonylContact O-C 2.85Å; M1-K1429 VanDerWaalsContact O-O 3.12Å; M1-D1430 PolarHBondContact N-O 2.9Å; M1-D1430 PolarHBondContact O-N 3.42Å
2	N	25	Very low	28	Very low	121 Å²	121	145.9 Å²	145.9	65%	0.647	75%	0.748	S	S	*	*			trans	-49.4	136.5	-177.2	-80.7	-71.9	0	0	0	116.8
3	K	25.2	Very low	28.1	Very low	142 Å²	142	148.4 Å²	148.4	62%	0.617	75%	0.754	S	S	*	*				67	163.2	129.1	-56.7	169.2	-178.3	159.1	0	116.2	I1428 K1429	K3-I1428 VanDerWaalsContact CA-CG2 3.47Å; K3-K1429 PolarHBondContact N-O 3.49Å
4	T	30.4	Very low	28.1	Very low	110 Å²	110	144.9 Å²	144.9	68%	0.675	75%	0.749	S	S	*	*			cis	-160.1	154.9	19.8	-29.6	0	0	0	0	112.2
5	F	24.8	Very low	27.9	Very low	139 Å²	139	145.2 Å²	145.2	61%	0.61	75%	0.753	S	S	*	*				79.4	99.2	119.2	-47.8	-116.6	0	0	0	120.7
6	T	28.6	Very low	27.7	Very low	102 Å²	102	145.3 Å²	145.3	63%	0.626	75%	0.754	S	S	*	*			trans	-32.7	156.1	159.9	57.6	0	0	0	0	119.5
7	K	26.7	Very low	27.6	Very low	192 Å²	192	148.2 Å²	148.2	84%	0.835	75%	0.754	S	S	*	*				-178.7	171.2	111.4	-105.2	177.5	-180	177.9	0	115.7
8	L	28.2	Very low	27.5	Very low	172 Å²	172	145.4 Å²	145.4	90%	0.901	75%	0.75	S	S	*	*			trans	76.2	139.6	173.2	-58.7	165	0	0	0	116
9	A	30.7	Very low	27.5	Very low	78 Å²	78	143.7 Å²	143.7	65%	0.645	75%	0.753	S	S	*	*			cis	-159	147	-13.4	0	0	0	0	0	113
10	F	24.8	Very low	27.4	Very low	211 Å²	211	142.7 Å²	142.7	93%	0.925	76%	0.758	S	S	*	*			trans	24.4	114.8	157.2	-72.1	-91.8	0	0	0	122.3
11	S	29.3	Very low	27.5	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	76%	0.763	S	S	*	*			trans	-167.9	117.6	133.5	-174.5	0	0	0	0	114.1
12	K	32.1	Very low	27.5	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.787	76%	0.756	S	S	*	*			trans	57.5	114.3	149.8	-62.5	174.4	-175.7	178.1	0	122.1
13	H	30.1	Very low	27.4	Very low	178 Å²	178	139 Å²	139	82%	0.824	76%	0.756	S	S	*	*				31.1	150.9	98.8	-74.6	-92.3	0	0	0	120.6
14	S	28.2	Very low	27.6	Very low	99 Å²	99	141.2 Å²	141.2	69%	0.692	77%	0.765	S	S	*	*			cis	-177.9	156.8	-24.8	46.2	0	0	0	0	109.2
15	N	25.2	Very low	27.4	Very low	150 Å²	150	145.8 Å²	145.8	80%	0.802	77%	0.772	S	S	*	*			trans	-66.6	160.9	178.1	-63.1	-37.2	0	0	0	114.1
16	L	24.2	Very low	27.6	Very low	147 Å²	147	143.8 Å²	143.8	77%	0.77	78%	0.775	S	S	*	*				162.2	156.9	113	-85.4	176.2	0	0	0	117.2
17	Y	26.5	Very low	27.5	Very low	194 Å²	194	143.9 Å²	143.9	76%	0.761	78%	0.78	S	S	*	*			trans	57.4	92.6	153.5	-75	-65.4	0	0	0	124.3
18	S	25.1	Very low	27.4	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	78%	0.776	S	S	*	*				62	155.2	105.7	-56.9	0	0	0	0	126.1
19	S	27.7	Very low	27.4	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	77%	0.77	S	S	*	*			trans	81.2	153.4	156.3	79.9	0	0	0	0	118.1
20	S	25.4	Very low	27.5	Very low	123 Å²	123	141.3 Å²	141.3	86%	0.86	78%	0.778	S	S	*	*			cis	-166.7	136.5	-27.6	-94.4	0	0	0	0	108.1
21	G	29.5	Very low	27.4	Very low	83 Å²	83	139.1 Å²	139.1	86%	0.856	77%	0.773	S	S	*	*			trans	-155.9	111.9	-176.4	0	0	0	0	0	114.3
22	Q	29.1	Very low	27.6	Very low	178 Å²	178	139.4 Å²	139.4	83%	0.832	77%	0.772	S	S	*	*			trans	-89	145.6	-165.6	-80.5	-178.7	-18.6	0	0	116.5
23	L	22.9	Very low	27.4	Very low	125 Å²	125	139.4 Å²	139.4	65%	0.654	77%	0.772	S	S	*	*			trans	54.4	118.6	133	-60.2	169.3	0	0	0	121.7
24	K	30.2	Very low	27.4	Very low	188 Å²	188	139.5 Å²	139.5	82%	0.817	77%	0.773	S	S	*	*				-173.1	136.7	108.6	-93.3	153.5	-174.6	178.4	0	109.4
25	Y	26.1	Very low	27.4	Very low	206 Å²	206	143.2 Å²	143.2	81%	0.808	78%	0.779	S	S	*	*				54.1	131.9	79.9	-74.1	-79.8	0	0	0	112.7
26	S	28.6	Very low	27.6	Very low	98 Å²	98	144.5 Å²	144.5	69%	0.685	78%	0.781	S	S	*	*			cis	-169.7	147.8	13.5	44.8	0	0	0	0	115.9
27	S	26.7	Very low	27.9	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	78%	0.78	S	S	*	*			trans	70.9	125.2	136.7	-60.4	0	0	0	0	124.8
28	S	25.7	Very low	28	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	78%	0.78	S	S	*	*				73.1	158.6	128.2	-62.7	0	0	0	0	120
29	L	27.9	Very low	28.1	Very low	146 Å²	146	143.4 Å²	143.4	76%	0.764	78%	0.775	S	S	*	*			cis	-158.5	133.2	-5.1	-126.9	164.9	0	0	0	111.2
30	T	32	Very low	28.1	Very low	135 Å²	135	147.7 Å²	147.7	83%	0.828	78%	0.779	S	S	*	*				149.7	159.3	128.9	48.1	0	0	0	0	113.9
31	M	22.8	Very low	28.3	Very low	164 Å²	164	147.5 Å²	147.5	81%	0.808	77%	0.769	S	S	*	*			trans	-152.4	154.4	-176	-121.7	-81.1	162.1	0	0	107.8	K33	M31-K33 PolarHBondContact SD-N 3.39Å
32	P	34.2	Very low	28.3	Very low	110 Å²	110	148.7 Å²	148.7	71%	0.714	76%	0.764	S	S	*	*				-152.7	134.6	101.9	35.7	-16.4	0	0	0	118.4
33	K	28.5	Very low	28.2	Very low	181 Å²	181	151.2 Å²	151.2	79%	0.787	77%	0.768	S	S	*	*			trans	55.7	102.1	130.3	-58	177.1	179.1	178.8	0	120.1	M31	M31-K33 PolarHBondContact SD-N 3.39Å
34	Q	29.1	Very low	28.6	Very low	181 Å²	181	149.1 Å²	149.1	85%	0.846	78%	0.776	S	S	*	*	S	Bend		172.1	130.8	105.1	-91.9	-170.4	44.8	0	0	108.6
35	Q	28.5	Very low	28.8	Very low	176 Å²	176	146 Å²	146	82%	0.822	77%	0.772	S	S	*	*			cis	-129.9	154.6	-1.8	-59.7	175.2	-12.3	0	0	109.3
36	Q	29.6	Very low	29.1	Very low	177 Å²	177	140.1 Å²	140.1	83%	0.827	76%	0.761	S	S	*	*			trans	-126.4	147.9	174.3	-102.3	-172.4	-6.3	0	0	111.9
37	L	30.3	Very low	29.5	Very low	143 Å²	143	141.2 Å²	141.2	75%	0.749	76%	0.764	S	S	*	*			trans	-83.4	153.8	166.4	-67.3	70.3	0	0	0	110.5
38	Q	27.8	Very low	30.4	Very low	164 Å²	164	142.3 Å²	142.3	77%	0.766	76%	0.762	S	S	*	*			trans	-174.2	132	137.7	-98.5	148.3	73.9	0	0	107.6
39	N	26.8	Very low	31.8	Very low	110 Å²	110	141.5 Å²	141.5	59%	0.588	76%	0.756	S	S	*	*			cis	92.1	124.6	47.2	-79.4	40.2	0	0	0	113.6
40	K	28.4	Very low	34.1	Very low	202 Å²	202	135.1 Å²	135.1	88%	0.878	72%	0.724	S	S	*	*			trans	-179.7	91.3	145	-101.9	166.3	-176.9	178.2	0	106.9
41	D	30.2	Very low	35.9	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	71%	0.714	S	S	*	*				75.4	114.3	61.5	-61	-46.3	0	0	0	114
42	S	28.4	Very low	38.7	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	69%	0.691	S	S	*	*			trans	-169.8	102.7	147.3	-86.5	0	0	0	0	113.7
43	Y	28.6	Very low	40.8	Very low	232 Å²	232	128.2 Å²	128.2	91%	0.91	68%	0.677	S	S	*	*			trans	60.4	106.3	149.3	-60.8	-76.8	0	0	0	121.9
44	G	31.3	Very low	43	Very low	81 Å²	81	124.4 Å²	124.4	84%	0.835	67%	0.669	S	S	*	*			trans	-163.7	100.2	162.5	0	0	0	0	0	112
45	V	34.3	Very low	45.2	Very low	121 Å²	121	119.2 Å²	119.2	73%	0.733	65%	0.65	S	S	*	*			trans	-77.6	142	-178.5	168	0	0	0	0	110.4
46	S	30.9	Very low	47.2	Very low	83 Å²	83	120.1 Å²	120.1	58%	0.58	65%	0.651	S	S	*	*			cis	-165.5	-175.8	-12.8	58	0	0	0	0	111.2
47	T	37.6	Very low	49.1	Very low	122 Å²	122	115 Å²	115	75%	0.748	63%	0.632	S	S	*	*			trans	54.3	96.8	153.4	48.2	0	0	0	0	118.4
48	N	45.6	Very low	51.1	Low	127 Å²	127	114.5 Å²	114.5	68%	0.679	64%	0.635	S	S	*	*			trans	-146.3	57.9	156.1	-147.4	-15.3	0	0	0	111.1	V69	N48-V69 HydrophobicContact CB-CG1 3.89Å; N48-V69 VanDerWaalsContact O-CG1 3.27Å; N48-V69 WeakPolarHBondContact O-CG1 3.39Å
49	S	55.2	Low	53.4	Low	89 Å²	89	107.7 Å²	107.7	62%	0.622	60%	0.603	S	S	*	*			trans	-70.9	128.1	179.5	44.6	0	0	0	0	110.7	L51	S49-L51 PolarHBondContact O-N 2.83Å; S49-L51 VanDerWaalsContact O-N 3.14Å
50	C	76	Confident	55.5	Low	13 Å²	13	105.4 Å²	105.4	9%	0.088	59%	0.594	C	S	.	*			trans	-64.8	119.3	-179.3	-177.9	0	0	0	0	110.8	Y52 C53 V54 H59 C70	C50-Y52 PolarHBondContact O-N 3.41Å; C50-Y52 VanDerWaalsContact O-N 3.15Å; C50-C53 HydrophobicContact CB-CB 4.12Å; C50-C53 WeakPolarHBondContact O-CA 3.3Å; C50-C53 WeakPolarHBondContact O-CB 3.19Å; C50-C53 PolarHBondContact O-N 3.5Å; C50-V54 PolarHBondContact O-N 2.68Å; C50-H59 PolarHBondContact SG-NE2 2.9Å; C50-H59 VanDerWaalsContact SG-NE2 3.44Å; C50-C70 HydrophobicContact CB-CB 3.5Å; C50-C70 VanDerWaalsContact CB-CB 3.5Å; C50-C70 WeakPolarHBondContact CB-SG 3.47Å
51	L	70.7	Confident	57.3	Low	120 Å²	120	105.8 Å²	105.8	63%	0.628	59%	0.589	S	S	*	*	H	α-helix	trans	-51.8	-39.6	-177.9	-175	62.1	0	0	0	112.7	S49 V54 T55	S49-L51 PolarHBondContact O-N 2.83Å; S49-L51 VanDerWaalsContact O-N 3.14Å; L51-V54 PolarHBondContact O-N 3.08Å; L51-T55 HydrophobicContact CD1-CG2 4.24Å; L51-T55 WeakPolarHBondContact O-CB 3.31Å; L51-T55 WeakPolarHBondContact O-CG2 3.27Å; L51-T55 PolarHBondContact O-N 3.17Å; L51-T55 PolarHBondContact O-OG1 3Å
52	Y	80.3	Confident	58.9	Low	79 Å²	79	102.4 Å²	102.4	31%	0.31	57%	0.571	S	S	.	*	H	α-helix	trans	-68.6	-38.2	177.8	-54.4	-74.4	0	0	0	112.8	C50 T55 K56 T57 H59 P60 Y68	C50-Y52 PolarHBondContact O-N 3.41Å; C50-Y52 VanDerWaalsContact O-N 3.15Å; Y52-T55 PolarHBondContact O-OG1 3.33Å; Y52-K56 CarbonylContact O-C 3.57Å; Y52-K56 WeakPolarHBondContact O-CA 3.19Å; Y52-K56 PolarHBondContact O-N 3.08Å; Y52-K56 VanDerWaalsContact O-N 3.07Å; Y52-T57 PolarHBondContact O-N 2.77Å; Y52-H59 VanDerWaalsContact CB-CE1 3.48Å; Y52-H59 WeakPolarHBondContact CB-CE1 3.37Å; Y52-H59 WeakPolarHBondContact CB-ND1 3.2Å; Y52-P60 VanDerWaalsContact CE1-CD 3.4Å; Y52-P60 HydrophobicContact CE1-CG 3.93Å; Y52-P60 HydrophobicContact CE2-CG 4.36Å; Y52-Y68 HydrophobicContact CD2-CD1 4.21Å; Y52-Y68 AromaticContact CD2-CE1 3.75Å; Y52-Y68 HydrophobicContact CD2-CE1 3.75Å; Y52-Y68 HydrophobicContact CE2-CD1 4.43Å; Y52-Y68 AromaticContact CE2-CE1 3.69Å; Y52-Y68 HydrophobicContact CE2-CE1 3.69Å
53	C	78.6	Confident	60.5	Low	64 Å²	64	98.7 Å²	98.7	43%	0.432	55%	0.55	S	S	.	*	H	α-helix	trans	-65.4	-44.2	172.7	-67.4	0	0	0	0	111.9	C50 K56 H59	C50-C53 HydrophobicContact CB-CB 4.12Å; C50-C53 WeakPolarHBondContact O-CA 3.3Å; C50-C53 WeakPolarHBondContact O-CB 3.19Å; C50-C53 PolarHBondContact O-N 3.5Å; C53-K56 PolarHBondContact O-N 3.39Å; C53-H59 PolarHBondContact SG-CE1 3Å; C53-H59 PolarHBondContact SG-NE2 3.35Å
54	V	75.6	Confident	61.7	Low	101 Å²	101	99.6 Å²	99.6	61%	0.612	55%	0.552	S	S	*	*	H	α-helix	trans	-66.6	-41.2	-178.7	176.8	0	0	0	0	111.3	C50 L51 K56	C50-V54 PolarHBondContact O-N 2.68Å; L51-V54 PolarHBondContact O-N 3.08Å; V54-K56 VanDerWaalsContact C-N 3.29Å; V54-K56 PolarHBondContact O-N 2.87Å
55	T	75	Confident	63.2	Low	72 Å²	72	98.9 Å²	98.9	44%	0.442	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-2.2	177.5	56	0	0	0	0	114	L51 Y52 T57	L51-T55 HydrophobicContact CD1-CG2 4.24Å; L51-T55 WeakPolarHBondContact O-CB 3.31Å; L51-T55 WeakPolarHBondContact O-CG2 3.27Å; L51-T55 PolarHBondContact O-N 3.17Å; L51-T55 PolarHBondContact O-OG1 3Å; Y52-T55 PolarHBondContact O-OG1 3.33Å; T55-T57 PolarHBondContact O-N 3.26Å; T55-T57 VanDerWaalsContact O-N 3.15Å; T55-T57 PolarHBondContact OG1-OG1 2.92Å
56	K	70.2	Confident	64.9	Low	196 Å²	196	98.1 Å²	98.1	85%	0.852	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	24.6	-170	-59.7	-176.6	178.3	-179.9	0	114.2	Y52 C53 V54	Y52-K56 CarbonylContact O-C 3.57Å; Y52-K56 WeakPolarHBondContact O-CA 3.19Å; Y52-K56 PolarHBondContact O-N 3.08Å; Y52-K56 VanDerWaalsContact O-N 3.07Å; C53-K56 PolarHBondContact O-N 3.39Å; V54-K56 VanDerWaalsContact C-N 3.29Å; V54-K56 PolarHBondContact O-N 2.87Å
57	T	69.2	Low	66.9	Low	69 Å²	69	99 Å²	99	42%	0.423	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-86.4	152.9	179.6	54.4	0	0	0	0	111.8	Y52 T55 H59	Y52-T57 PolarHBondContact O-N 2.77Å; T55-T57 PolarHBondContact O-N 3.26Å; T55-T57 VanDerWaalsContact O-N 3.15Å; T55-T57 PolarHBondContact OG1-OG1 2.92Å; T57-H59 PolarHBondContact O-N 2.73Å
58	V	72.6	Confident	68.8	Low	133 Å²	133	94.2 Å²	94.2	81%	0.806	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-65.6	126.5	176.7	-178.2	0	0	0	0	109.1
59	H	76.7	Confident	69.9	Low	21 Å²	21	92.6 Å²	92.6	10%	0.097	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-67.3	130.2	178.1	-66.8	56.9	0	0	0	109.7	C50 Y52 C53 T57 Y68 C70 Y72	C50-H59 PolarHBondContact SG-NE2 2.9Å; C50-H59 VanDerWaalsContact SG-NE2 3.44Å; Y52-H59 VanDerWaalsContact CB-CE1 3.48Å; Y52-H59 WeakPolarHBondContact CB-CE1 3.37Å; Y52-H59 WeakPolarHBondContact CB-ND1 3.2Å; C53-H59 PolarHBondContact SG-CE1 3Å; C53-H59 PolarHBondContact SG-NE2 3.35Å; T57-H59 PolarHBondContact O-N 2.73Å; H59-Y68 HydrophobicContact CB-CD2 4.32Å; H59-Y68 HydrophobicContact CB-CE1 4.42Å; H59-Y68 HydrophobicContact CB-CE2 3.7Å; H59-Y68 AromaticContact CD2-CD1 3.76Å; H59-Y68 AromaticContact CD2-CD2 3.73Å; H59-Y68 AromaticContact CD2-CE1 3.97Å; H59-Y68 AromaticContact CD2-CE2 3.93Å; H59-Y68 AromaticContact CD2-CG 3.67Å; H59-C70 PolarHBondContact NE2-SG 3.28Å; H59-Y72 HydrophobicContact CB-CD1 3.58Å; H59-Y72 HydrophobicContact CB-CE1 3.65Å; H59-Y72 AromaticContact CD2-CD1 3.6Å; H59-Y72 AromaticContact CD2-CG 3.79Å; H59-Y72 AromaticContact CG-CD1 3.48Å; H59-Y72 VanDerWaalsContact CG-CD1 3.48Å; H59-Y72 AromaticContact CG-CE1 3.88Å; H59-Y72 AromaticContact CG-CG 3.97Å; H59-Y72 AromaticContact NE2-CG 3.91Å
60	P	70.2	Confident	71.2	Confident	61 Å²	61	91 Å²	91	40%	0.396	49%	0.486	S	S	.	.			trans	-66.5	-176.7	179	22	-29.4	0	0	0	113.8	Y52 Y68	Y52-P60 VanDerWaalsContact CE1-CD 3.4Å; Y52-P60 HydrophobicContact CE1-CG 3.93Å; Y52-P60 HydrophobicContact CE2-CG 4.36Å; P60-Y68 WeakPolarHBondContact CD-OH 3.36Å; P60-Y68 WeakPolarHBondContact CG-OH 3.44Å; P60-Y68 PolarHBondContact O-OH 2.82Å
61	R	65.8	Low	71.1	Confident	210 Å²	210	92.6 Å²	92.6	79%	0.792	51%	0.505	S	S	*	.			trans	-90.3	111.9	176	-72.4	-175.4	176.4	168.9	4	110.9	Y75	R61-Y75 PolarHBondContact NE-OH 3.23Å
62	L	65	Low	71.4	Confident	49 Å²	49	91.8 Å²	91.8	26%	0.257	49%	0.494	S	S	.	.			trans	-71.1	155.6	174	-67.4	-178.8	0	0	0	113.3	E66 Y68	L62-E66 HydrophobicContact CB-CB 3.86Å; L62-E66 HydrophobicContact CD1-CB 4.1Å; L62-E66 HydrophobicContact CD2-CB 4.26Å; L62-E66 HydrophobicContact CG-CB 4.3Å; L62-Y68 HydrophobicContact CD1-CD1 4.21Å; L62-Y68 HydrophobicContact CD1-CD2 3.52Å; L62-Y68 HydrophobicContact CD1-CE1 4.14Å; L62-Y68 HydrophobicContact CD1-CE2 3.44Å; L62-Y68 VanDerWaalsContact CD1-CE2 3.44Å; L62-Y68 HydrophobicContact CD1-CG 3.89Å; L62-Y68 HydrophobicContact CD2-CE1 3.91Å; L62-Y68 HydrophobicContact CD2-CE2 4.2Å; L62-Y68 HydrophobicContact CG-CD2 4.15Å; L62-Y68 HydrophobicContact CG-CE1 4.15Å; L62-Y68 HydrophobicContact CG-CE2 3.52Å; L62-Y68 VanDerWaalsContact CG-CZ 3.5Å
63	G	62	Low	71.6	Confident	30 Å²	30	92.4 Å²	92.4	31%	0.309	50%	0.498	S	S	.	.			trans	-72	177.5	174.5	0	0	0	0	0	114.4	G65 E66	G63-G65 PolarHBondContact O-N 3.14Å; G63-E66 WeakPolarHBondContact CA-OE1 3.37Å; G63-E66 PolarHBondContact N-OE2 3.32Å; G63-E66 PolarHBondContact O-N 3.01Å
64	R	53.1	Low	71.5	Confident	251 Å²	251	91.4 Å²	91.4	95%	0.947	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	97.4	-179.2	-90.6	-168.9	172.9	-167.2	0.1	111.7
65	G	61.7	Low	71.9	Confident	66 Å²	66	88.6 Å²	88.6	68%	0.68	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.9	-5.4	173.5	0	0	0	0	0	114.1	G63	G63-G65 PolarHBondContact O-N 3.14Å
66	E	71.5	Confident	72.5	Confident	104 Å²	104	91.8 Å²	91.8	49%	0.486	47%	0.473	S	S	.	.			trans	-77.4	152.1	173	-72.6	151.7	-135.1	0	0	111.5	L62 G63 T85	L62-E66 HydrophobicContact CB-CB 3.86Å; L62-E66 HydrophobicContact CD1-CB 4.1Å; L62-E66 HydrophobicContact CD2-CB 4.26Å; L62-E66 HydrophobicContact CG-CB 4.3Å; G63-E66 WeakPolarHBondContact CA-OE1 3.37Å; G63-E66 PolarHBondContact N-OE2 3.32Å; G63-E66 PolarHBondContact O-N 3.01Å; E66-T85 PolarHBondContact O-OG1 3.18Å
67	T	73.1	Confident	73.4	Confident	102 Å²	102	82.6 Å²	82.6	63%	0.626	43%	0.434	S	S	*	.			trans	-143.2	139.8	179.8	54.4	0	0	0	0	110.6	T85	T67-T85 HydrophobicContact CG2-CG2 4.05Å
68	Y	76.5	Confident	74.1	Confident	21 Å²	21	86.9 Å²	86.9	8%	0.082	45%	0.449	C	S	.	.			trans	-69.8	144.4	173.8	-74.9	-67	0	0	0	112.3	Y52 H59 P60 L62 C70 G71 Y72	Y52-Y68 HydrophobicContact CD2-CD1 4.21Å; Y52-Y68 AromaticContact CD2-CE1 3.75Å; Y52-Y68 HydrophobicContact CD2-CE1 3.75Å; Y52-Y68 HydrophobicContact CE2-CD1 4.43Å; Y52-Y68 AromaticContact CE2-CE1 3.69Å; Y52-Y68 HydrophobicContact CE2-CE1 3.69Å; H59-Y68 HydrophobicContact CB-CD2 4.32Å; H59-Y68 HydrophobicContact CB-CE1 4.42Å; H59-Y68 HydrophobicContact CB-CE2 3.7Å; H59-Y68 AromaticContact CD2-CD1 3.76Å; H59-Y68 AromaticContact CD2-CD2 3.73Å; H59-Y68 AromaticContact CD2-CE1 3.97Å; H59-Y68 AromaticContact CD2-CE2 3.93Å; H59-Y68 AromaticContact CD2-CG 3.67Å; P60-Y68 WeakPolarHBondContact CD-OH 3.36Å; P60-Y68 WeakPolarHBondContact CG-OH 3.44Å; P60-Y68 PolarHBondContact O-OH 2.82Å; L62-Y68 HydrophobicContact CD1-CD1 4.21Å; L62-Y68 HydrophobicContact CD1-CD2 3.52Å; L62-Y68 HydrophobicContact CD1-CE1 4.14Å; L62-Y68 HydrophobicContact CD1-CE2 3.44Å; L62-Y68 VanDerWaalsContact CD1-CE2 3.44Å; L62-Y68 HydrophobicContact CD1-CG 3.89Å; L62-Y68 HydrophobicContact CD2-CE1 3.91Å; L62-Y68 HydrophobicContact CD2-CE2 4.2Å; L62-Y68 HydrophobicContact CG-CD2 4.15Å; L62-Y68 HydrophobicContact CG-CE1 4.15Å; L62-Y68 HydrophobicContact CG-CE2 3.52Å; L62-Y68 VanDerWaalsContact CG-CZ 3.5Å; Y68-C70 VanDerWaalsContact C-N 3.26Å; Y68-C70 PolarHBondContact O-N 2.97Å; Y68-G71 WeakPolarHBondContact O-CA 3.37Å; Y68-G71 PolarHBondContact O-N 2.74Å; Y68-Y72 HydrophobicContact CD2-CD1 4.05Å; Y68-Y72 HydrophobicContact CE2-CD1 4.33Å
69	V	69.7	Low	74.8	Confident	94 Å²	94	83.2 Å²	83.2	57%	0.57	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.6	-179.9	-172.3	0	0	0	0	112.3	N48 G71	N48-V69 HydrophobicContact CB-CG1 3.89Å; N48-V69 VanDerWaalsContact O-CG1 3.27Å; N48-V69 WeakPolarHBondContact O-CG1 3.39Å; V69-G71 PolarHBondContact O-N 3.36Å
70	C	82.1	Confident	75.3	Confident	55 Å²	55	83.8 Å²	83.8	37%	0.372	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	2.3	170.5	56.7	0	0	0	0	114.5	C50 H59 Y68 Y72	C50-C70 HydrophobicContact CB-CB 3.5Å; C50-C70 VanDerWaalsContact CB-CB 3.5Å; C50-C70 WeakPolarHBondContact CB-SG 3.47Å; H59-C70 PolarHBondContact NE2-SG 3.28Å; Y68-C70 VanDerWaalsContact C-N 3.26Å; Y68-C70 PolarHBondContact O-N 2.97Å; C70-Y72 PolarHBondContact O-N 2.61Å; C70-Y72 WeakPolarHBondContact SG-CB 3.44Å
71	G	74.1	Confident	76	Confident	46 Å²	46	85.3 Å²	85.3	47%	0.474	44%	0.435	S	S	.	.			trans	70.6	8	-174.2	0	0	0	0	0	115.2	Y68 V69 K73	Y68-G71 WeakPolarHBondContact O-CA 3.37Å; Y68-G71 PolarHBondContact O-N 2.74Å; V69-G71 PolarHBondContact O-N 3.36Å; G71-K73 WeakPolarHBondContact O-CG 3.15Å; G71-K73 PolarHBondContact O-N 3.16Å
72	Y	76.7	Confident	77	Confident	103 Å²	103	79.7 Å²	79.7	40%	0.404	42%	0.415	S	S	.	.			trans	-58.5	136.4	179.7	-175.7	-100.3	0	0	0	111.9	H59 Y68 C70 P74	H59-Y72 HydrophobicContact CB-CD1 3.58Å; H59-Y72 HydrophobicContact CB-CE1 3.65Å; H59-Y72 AromaticContact CD2-CD1 3.6Å; H59-Y72 AromaticContact CD2-CG 3.79Å; H59-Y72 AromaticContact CG-CD1 3.48Å; H59-Y72 VanDerWaalsContact CG-CD1 3.48Å; H59-Y72 AromaticContact CG-CE1 3.88Å; H59-Y72 AromaticContact CG-CG 3.97Å; H59-Y72 AromaticContact NE2-CG 3.91Å; Y68-Y72 HydrophobicContact CD2-CD1 4.05Å; Y68-Y72 HydrophobicContact CE2-CD1 4.33Å; C70-Y72 PolarHBondContact O-N 2.61Å; C70-Y72 WeakPolarHBondContact SG-CB 3.44Å; Y72-P74 HydrophobicContact CE1-CB 3.91Å
73	K	83.5	Confident	78	Confident	92 Å²	92	79.2 Å²	79.2	40%	0.4	42%	0.415	S	S	.	.			trans	-134.5	94.9	-169.1	-81.5	159	160.6	-156.3	0	109	G71 Y75 S83 T84 T85	G71-K73 WeakPolarHBondContact O-CG 3.15Å; G71-K73 PolarHBondContact O-N 3.16Å; K73-Y75 PolarHBondContact O-N 3.5Å; K73-S83 WeakPolarHBondContact CD-O 3.39Å; K73-S83 WeakPolarHBondContact CD-OG 3.42Å; K73-S83 WeakPolarHBondContact CE-O 3.45Å; K73-S83 PolarHBondContact NZ-O 3.3Å; K73-T84 CarbonylContact C-O 3.52Å; K73-T85 HydrophobicContact CG-CG2 3.77Å
74	P	77.9	Confident	79.2	Confident	43 Å²	43	78.2 Å²	78.2	28%	0.279	40%	0.404	S	S	.	.	S	Bend	trans	-68.3	-2.2	-171	24.4	-34.3	0	0	0	115.6	Y72	Y72-P74 HydrophobicContact CE1-CB 3.91Å
75	Y	82.8	Confident	80.5	Confident	43 Å²	43	67.2 Å²	67.2	17%	0.169	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	112.4	177.5	-58.4	-76.7	0	0	0	109.4	R61 K73 S83 T84 K87	R61-Y75 PolarHBondContact NE-OH 3.23Å; K73-Y75 PolarHBondContact O-N 3.5Å; Y75-S83 WeakPolarHBondContact O-CA 3.4Å; Y75-T84 PolarHBondContact N-O 3.5Å; Y75-T84 PolarHBondContact O-N 3.38Å; Y75-K87 HydrophobicContact CD1-CB 4.02Å; Y75-K87 HydrophobicContact CD1-CG 4.29Å; Y75-K87 HydrophobicContact CE1-CB 3.69Å; Y75-K87 HydrophobicContact CE1-CD 4.41Å; Y75-K87 HydrophobicContact CE1-CG 4.07Å; Y75-K87 HydrophobicContact CE2-CB 4.27Å; Y75-K87 HydrophobicContact CG-CB 4.44Å
76	R	87.2	Confident	81.4	Confident	138 Å²	138	65.5 Å²	65.5	52%	0.521	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.7	180	-169.4	175.8	-169.6	-111.8	10.3	110.1	N81 Y82	R76-N81 PolarHBondContact NH1-OD1 2.66Å; R76-N81 PolarHBondContact NH2-OD1 3.15Å; R76-Y82 CarbonylContact C-O 3.59Å; R76-Y82 VanDerWaalsContact CA-O 3.3Å; R76-Y82 WeakPolarHBondContact CA-O 3.33Å
77	C	90.1	Very high	81.8	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.02	35%	0.348	C	S	.	.			trans	-88.1	131.5	162.1	174.3	0	0	0	0	107.9	C80 N81 Y82 L90 H99	C77-C80 HydrophobicContact CB-CB 4.48Å; C77-C80 PolarHBondContact SG-N 3.38Å; C77-C80 VanDerWaalsContact SG-N 3.37Å; C77-N81 CarbonylContact O-C 3.53Å; C77-N81 WeakPolarHBondContact O-CA 3.44Å; C77-N81 PolarHBondContact O-N 2.84Å; C77-Y82 PolarHBondContact N-O 2.97Å; C77-Y82 PolarHBondContact O-N 3.41Å; C77-L90 HydrophobicContact CB-CD1 3.74Å; C77-H99 PolarHBondContact SG-CE1 2.89Å; C77-H99 PolarHBondContact SG-ND1 3.11Å
78	E	84.4	Confident	82.4	Confident	159 Å²	159	64.8 Å²	64.8	74%	0.743	34%	0.339	S	S	*	.	S	Bend	trans	-79.9	-50.7	-178.1	-68.2	171.5	171.1	0	0	110.8	C80 N81	E78-C80 VanDerWaalsContact C-N 3.35Å; E78-C80 PolarHBondContact O-N 3.3Å; E78-N81 PolarHBondContact O-N 3.2Å; E78-N81 VanDerWaalsContact O-N 3.17Å; E78-N81 PolarHBondContact O-OD1 3.18Å
79	I	86.3	Confident	82.8	Confident	57 Å²	57	67.1 Å²	67.1	29%	0.292	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-45.4	176.8	-61.8	106.6	0	0	0	113.2	N102 L103 H106	I79-N102 HydrophobicContact CG2-CB 3.91Å; I79-N102 WeakPolarHBondContact CG2-O 3.24Å; I79-L103 HydrophobicContact CD1-CD2 3.74Å; I79-L103 HydrophobicContact CD1-CG 4.4Å; I79-L103 HydrophobicContact CG1-CD2 3.93Å; I79-L103 HydrophobicContact CG1-CG 4.49Å; I79-L103 HydrophobicContact CG2-CG 4.41Å; I79-H106 HydrophobicContact CG2-CB 4.34Å
80	C	87.5	Confident	83.7	Confident	33 Å²	33	63.5 Å²	63.5	22%	0.223	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	1.2	-178.4	-58.5	0	0	0	0	113.9	C77 E78 Y82 H93 H99	C77-C80 HydrophobicContact CB-CB 4.48Å; C77-C80 PolarHBondContact SG-N 3.38Å; C77-C80 VanDerWaalsContact SG-N 3.37Å; E78-C80 VanDerWaalsContact C-N 3.35Å; E78-C80 PolarHBondContact O-N 3.3Å; C80-Y82 PolarHBondContact O-N 2.89Å; C80-H93 VanDerWaalsContact CB-NE2 3.34Å; C80-H93 WeakPolarHBondContact CB-NE2 3.35Å; C80-H99 PolarHBondContact SG-ND1 2.86Å
81	N	83.9	Confident	84	Confident	92 Å²	92	62.7 Å²	62.7	49%	0.492	33%	0.328	S	S	.	.			trans	51.8	5.3	-170.4	-71.3	-53.5	0	0	0	116.6	R76 C77 E78 S83	R76-N81 PolarHBondContact NH1-OD1 2.66Å; R76-N81 PolarHBondContact NH2-OD1 3.15Å; C77-N81 CarbonylContact O-C 3.53Å; C77-N81 WeakPolarHBondContact O-CA 3.44Å; C77-N81 PolarHBondContact O-N 2.84Å; E78-N81 PolarHBondContact O-N 3.2Å; E78-N81 VanDerWaalsContact O-N 3.17Å; E78-N81 PolarHBondContact O-OD1 3.18Å; N81-S83 PolarHBondContact O-N 3.49Å
82	Y	88.3	Confident	84.7	Confident	92 Å²	92	66 Å²	66	36%	0.361	33%	0.333	S	S	.	.			trans	-64.3	124.7	-176.2	170.7	-95.3	0	0	0	111.9	R76 C77 C80 T84 L90 H93	R76-Y82 CarbonylContact C-O 3.59Å; R76-Y82 VanDerWaalsContact CA-O 3.3Å; R76-Y82 WeakPolarHBondContact CA-O 3.33Å; C77-Y82 PolarHBondContact N-O 2.97Å; C77-Y82 PolarHBondContact O-N 3.41Å; C80-Y82 PolarHBondContact O-N 2.89Å; Y82-T84 HydrophobicContact CE1-CG2 3.89Å; Y82-L90 HydrophobicContact CD1-CD1 4.39Å; Y82-H93 WeakPolarHBondContact CB-NE2 3.22Å; Y82-H93 HydrophobicContact CD1-CB 3.75Å; Y82-H93 AromaticContact CD1-CD2 3.37Å; Y82-H93 WeakPolarHBondContact CD1-CD2 3.5Å; Y82-H93 AromaticContact CD1-CG 3.48Å; Y82-H93 VanDerWaalsContact CD1-CG 3.48Å; Y82-H93 HydrophobicContact CE1-CB 3.7Å; Y82-H93 AromaticContact CE1-CG 3.95Å; Y82-H93 AromaticContact CG-CD2 3.74Å; Y82-H93 AromaticContact CG-CG 3.86Å; Y82-H93 AromaticContact CG-NE2 3.95Å
83	S	86.4	Confident	85.5	Confident	39 Å²	39	62.3 Å²	62.3	27%	0.273	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.7	-178	61.8	0	0	0	0	113.1	K73 Y75 N81	K73-S83 WeakPolarHBondContact CD-O 3.39Å; K73-S83 WeakPolarHBondContact CD-OG 3.42Å; K73-S83 WeakPolarHBondContact CE-O 3.45Å; K73-S83 PolarHBondContact NZ-O 3.3Å; Y75-S83 WeakPolarHBondContact O-CA 3.4Å; N81-S83 PolarHBondContact O-N 3.49Å
84	T	85.6	Confident	85.8	Confident	10 Å²	10	62.3 Å²	62.3	6%	0.061	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	158.6	-173.9	-163	0	0	0	0	112.5	K73 Y75 Y82 T86 N89 L90	K73-T84 CarbonylContact C-O 3.52Å; Y75-T84 PolarHBondContact N-O 3.5Å; Y75-T84 PolarHBondContact O-N 3.38Å; Y82-T84 HydrophobicContact CE1-CG2 3.89Å; T84-T86 WeakPolarHBondContact CG2-O 3.34Å; T84-N89 HydrophobicContact CG2-CB 3.75Å; T84-N89 VanDerWaalsContact OG1-CB 3.25Å; T84-N89 WeakPolarHBondContact OG1-CB 3.18Å; T84-N89 PolarHBondContact OG1-ND2 3.32Å; T84-L90 HydrophobicContact CG2-CB 3.89Å
85	T	81.5	Confident	86.2	Confident	20 Å²	20	67.7 Å²	67.7	12%	0.123	34%	0.342	C	S	.	.	S	Bend	trans	-86.9	-10.9	-176.6	57.7	0	0	0	0	114.3	E66 T67 K73	E66-T85 PolarHBondContact O-OG1 3.18Å; T67-T85 HydrophobicContact CG2-CG2 4.05Å; K73-T85 HydrophobicContact CG-CG2 3.77Å
86	T	79.7	Confident	86.4	Confident	30 Å²	30	67.3 Å²	67.3	18%	0.184	35%	0.346	C	S	.	.	S	Bend	trans	-127.1	136.8	-178.7	77.7	0	0	0	0	112.9	T84 G88 N89 L90	T84-T86 WeakPolarHBondContact CG2-O 3.34Å; T86-G88 PolarHBondContact O-N 2.99Å; T86-G88 VanDerWaalsContact O-N 3.15Å; T86-N89 PolarHBondContact O-N 2.81Å; T86-N89 VanDerWaalsContact O-N 3.08Å; T86-N89 PolarHBondContact OG1-N 3.41Å; T86-N89 PolarHBondContact OG1-ND2 3Å; T86-L90 PolarHBondContact O-N 3.42Å
87	K	80.8	Confident	86.2	Confident	149 Å²	149	66.8 Å²	66.8	65%	0.648	35%	0.353	S	S	*	.	H	α-helix	trans	-55.1	-33.9	177.5	-170.7	175.9	178.8	179.2	0	112.7	Y75 L90 A91	Y75-K87 HydrophobicContact CD1-CB 4.02Å; Y75-K87 HydrophobicContact CD1-CG 4.29Å; Y75-K87 HydrophobicContact CE1-CB 3.69Å; Y75-K87 HydrophobicContact CE1-CD 4.41Å; Y75-K87 HydrophobicContact CE1-CG 4.07Å; Y75-K87 HydrophobicContact CE2-CB 4.27Å; Y75-K87 HydrophobicContact CG-CB 4.44Å; K87-L90 PolarHBondContact O-N 2.98Å; K87-A91 PolarHBondContact O-N 3.23Å
88	G	86.1	Confident	85.8	Confident	41 Å²	41	71.4 Å²	71.4	42%	0.423	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-39.8	178	0	0	0	0	0	113.4	T86 L90 A91 I92	T86-G88 PolarHBondContact O-N 2.99Å; T86-G88 VanDerWaalsContact O-N 3.15Å; G88-L90 VanDerWaalsContact C-N 3.34Å; G88-A91 PolarHBondContact O-N 2.83Å; G88-I92 WeakPolarHBondContact O-CD1 3.42Å; G88-I92 VanDerWaalsContact O-CG1 3.27Å; G88-I92 WeakPolarHBondContact O-CG1 3.42Å; G88-I92 PolarHBondContact O-N 3.23Å
89	N	84.5	Confident	86.1	Confident	71 Å²	71	64.3 Å²	64.3	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-68.3	-35	175.8	-69.1	-10.9	0	0	0	111.8	T84 T86 H93	T84-N89 HydrophobicContact CG2-CB 3.75Å; T84-N89 VanDerWaalsContact OG1-CB 3.25Å; T84-N89 WeakPolarHBondContact OG1-CB 3.18Å; T84-N89 PolarHBondContact OG1-ND2 3.32Å; T86-N89 PolarHBondContact O-N 2.81Å; T86-N89 VanDerWaalsContact O-N 3.08Å; T86-N89 PolarHBondContact OG1-N 3.41Å; T86-N89 PolarHBondContact OG1-ND2 3Å; N89-H93 WeakPolarHBondContact O-CB 3.15Å; N89-H93 PolarHBondContact O-N 3.41Å
90	L	88.6	Confident	86.1	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-67.6	-45.2	175.1	-179.7	61.5	0	0	0	110.6	C77 Y82 T84 T86 K87 G88 I92 H93 Q94	C77-L90 HydrophobicContact CB-CD1 3.74Å; Y82-L90 HydrophobicContact CD1-CD1 4.39Å; T84-L90 HydrophobicContact CG2-CB 3.89Å; T86-L90 PolarHBondContact O-N 3.42Å; K87-L90 PolarHBondContact O-N 2.98Å; G88-L90 VanDerWaalsContact C-N 3.34Å; L90-I92 VanDerWaalsContact C-N 3.33Å; L90-I92 PolarHBondContact O-N 3.41Å; L90-H93 PolarHBondContact O-N 2.77Å; L90-H93 VanDerWaalsContact O-N 3.13Å; L90-Q94 HydrophobicContact CD1-CG 4.26Å; L90-Q94 HydrophobicContact CG-CG 4.37Å; L90-Q94 WeakPolarHBondContact O-CG 2.93Å; L90-Q94 PolarHBondContact O-N 3.36Å
91	A	88.8	Confident	85.9	Confident	39 Å²	39	68.1 Å²	68.1	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-60.3	-39.9	176.4	0	0	0	0	0	112.7	K87 G88 Q94 Q95	K87-A91 PolarHBondContact O-N 3.23Å; G88-A91 PolarHBondContact O-N 2.83Å; A91-Q94 PolarHBondContact O-N 3.31Å; A91-Q95 WeakPolarHBondContact O-CG 2.97Å; A91-Q95 PolarHBondContact O-N 2.9Å; A91-Q95 VanDerWaalsContact O-N 3.14Å
92	I	88.9	Confident	85.9	Confident	114 Å²	114	66.6 Å²	66.6	59%	0.585	35%	0.35	S	S	*	.	H	α-helix	trans	-66.1	-39.2	174.5	-68.8	164.2	0	0	0	111.2	G88 L90 Q95 S96	G88-I92 WeakPolarHBondContact O-CD1 3.42Å; G88-I92 VanDerWaalsContact O-CG1 3.27Å; G88-I92 WeakPolarHBondContact O-CG1 3.42Å; G88-I92 PolarHBondContact O-N 3.23Å; L90-I92 VanDerWaalsContact C-N 3.33Å; L90-I92 PolarHBondContact O-N 3.41Å; I92-Q95 CarbonylContact O-C 3.57Å; I92-Q95 PolarHBondContact O-N 2.9Å; I92-S96 PolarHBondContact O-N 2.75Å
93	H	91.9	Very high	85.8	Confident	26 Å²	26	64.5 Å²	64.5	12%	0.12	35%	0.345	C	S	.	.	H	α-helix	trans	-66.1	-40.6	174.2	168.9	59.6	0	0	0	112	C80 Y82 N89 L90 Q95 S96 H99	C80-H93 VanDerWaalsContact CB-NE2 3.34Å; C80-H93 WeakPolarHBondContact CB-NE2 3.35Å; Y82-H93 WeakPolarHBondContact CB-NE2 3.22Å; Y82-H93 HydrophobicContact CD1-CB 3.75Å; Y82-H93 AromaticContact CD1-CD2 3.37Å; Y82-H93 WeakPolarHBondContact CD1-CD2 3.5Å; Y82-H93 AromaticContact CD1-CG 3.48Å; Y82-H93 VanDerWaalsContact CD1-CG 3.48Å; Y82-H93 HydrophobicContact CE1-CB 3.7Å; Y82-H93 AromaticContact CE1-CG 3.95Å; Y82-H93 AromaticContact CG-CD2 3.74Å; Y82-H93 AromaticContact CG-CG 3.86Å; Y82-H93 AromaticContact CG-NE2 3.95Å; N89-H93 WeakPolarHBondContact O-CB 3.15Å; N89-H93 PolarHBondContact O-N 3.41Å; L90-H93 PolarHBondContact O-N 2.77Å; L90-H93 VanDerWaalsContact O-N 3.13Å; H93-Q95 PolarHBondContact O-N 3.29Å; H93-Q95 VanDerWaalsContact O-N 3.15Å; H93-S96 PolarHBondContact ND1-OG 2.63Å; H93-S96 WeakPolarHBondContact O-CB 3.11Å; H93-S96 PolarHBondContact O-N 3.02Å; H93-S96 PolarHBondContact O-OG 3.22Å; H93-H99 WeakPolarHBondContact O-CB 3.44Å
94	Q	91	Very high	85.4	Confident	93 Å²	93	68 Å²	68	44%	0.435	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.2	173.7	-70.2	175.1	-60.5	0	0	113.5	L90 A91 H99	L90-Q94 HydrophobicContact CD1-CG 4.26Å; L90-Q94 HydrophobicContact CG-CG 4.37Å; L90-Q94 WeakPolarHBondContact O-CG 2.93Å; L90-Q94 PolarHBondContact O-N 3.36Å; A91-Q94 PolarHBondContact O-N 3.31Å; Q94-H99 VanDerWaalsContact CA-CD2 3.43Å; Q94-H99 WeakPolarHBondContact CA-CD2 3.2Å; Q94-H99 PolarHBondContact O-CD2 3.22Å
95	Q	85.3	Confident	85	Confident	155 Å²	155	72.9 Å²	72.9	72%	0.724	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	10.5	173.5	-68.6	174.1	-15	0	0	112.5	A91 I92 H93	A91-Q95 WeakPolarHBondContact O-CG 2.97Å; A91-Q95 PolarHBondContact O-N 2.9Å; A91-Q95 VanDerWaalsContact O-N 3.14Å; I92-Q95 CarbonylContact O-C 3.57Å; I92-Q95 PolarHBondContact O-N 2.9Å; H93-Q95 PolarHBondContact O-N 3.29Å; H93-Q95 VanDerWaalsContact O-N 3.15Å
96	S	87.8	Confident	84.7	Confident	36 Å²	36	76.1 Å²	76.1	25%	0.252	39%	0.393	S	S	.	.	S	Bend	trans	-94.7	145.1	178.9	70.7	0	0	0	0	111.5	I92 H93 K98 H99 L100	I92-S96 PolarHBondContact O-N 2.75Å; H93-S96 PolarHBondContact ND1-OG 2.63Å; H93-S96 WeakPolarHBondContact O-CB 3.11Å; H93-S96 PolarHBondContact O-N 3.02Å; H93-S96 PolarHBondContact O-OG 3.22Å; S96-K98 PolarHBondContact O-N 2.92Å; S96-K98 VanDerWaalsContact O-N 3.13Å; S96-H99 WeakPolarHBondContact O-CA 3.47Å; S96-H99 WeakPolarHBondContact O-CB 3.38Å; S96-H99 PolarHBondContact O-N 3.49Å; S96-L100 PolarHBondContact O-N 3.12Å
97	D	83.3	Confident	84.2	Confident	126 Å²	126	78.6 Å²	78.6	67%	0.674	40%	0.402	S	S	*	.	H	α-helix	trans	-54.9	-37.3	-175.5	-39.6	-58.8	0	0	0	112	H99 L100 N101	D97-H99 VanDerWaalsContact C-N 3.28Å; D97-H99 PolarHBondContact O-N 3.1Å; D97-L100 PolarHBondContact O-N 3.4Å; D97-L100 VanDerWaalsContact O-N 3.16Å; D97-N101 PolarHBondContact O-N 2.79Å; D97-N101 PolarHBondContact O-OD1 3.35Å; D97-N101 VanDerWaalsContact O-OD1 3.1Å
98	K	81.6	Confident	83	Confident	100 Å²	100	77.3 Å²	77.3	44%	0.435	40%	0.398	S	S	.	.	H	α-helix	trans	-59	-33.5	173	-90.7	-166.7	168.7	-172	0	114	S96 N102 F1524	S96-K98 PolarHBondContact O-N 2.92Å; S96-K98 VanDerWaalsContact O-N 3.13Å; K98-N102 VanDerWaalsContact O-CB 3.28Å; K98-N102 WeakPolarHBondContact O-CB 3.19Å; K98-N102 PolarHBondContact O-N 3.18Å; K98-N102 PolarHBondContact O-OD1 3.5Å; K98-F1524 HydrophobicContact CD-CE2 4.47Å
99	H	89.5	Confident	81.5	Confident	10 Å²	10	79 Å²	79	5%	0.046	40%	0.401	C	S	.	.	H	α-helix	trans	-76	-36.6	175.9	-176	63.5	0	0	0	112	C77 C80 H93 Q94 S96 D97 L103	C77-H99 PolarHBondContact SG-CE1 2.89Å; C77-H99 PolarHBondContact SG-ND1 3.11Å; C80-H99 PolarHBondContact SG-ND1 2.86Å; H93-H99 WeakPolarHBondContact O-CB 3.44Å; Q94-H99 VanDerWaalsContact CA-CD2 3.43Å; Q94-H99 WeakPolarHBondContact CA-CD2 3.2Å; Q94-H99 PolarHBondContact O-CD2 3.22Å; S96-H99 WeakPolarHBondContact O-CA 3.47Å; S96-H99 WeakPolarHBondContact O-CB 3.38Å; S96-H99 PolarHBondContact O-N 3.49Å; D97-H99 VanDerWaalsContact C-N 3.28Å; D97-H99 PolarHBondContact O-N 3.1Å; H99-L103 WeakPolarHBondContact NE2-CD1 3.35Å; H99-L103 WeakPolarHBondContact O-CB 3.39Å; H99-L103 WeakPolarHBondContact O-CG 3.19Å; H99-L103 PolarHBondContact O-N 3.49Å
100	L	87.8	Confident	80.1	Confident	83 Å²	83	80.2 Å²	80.2	44%	0.435	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-43.7	178.1	-60.8	175.2	0	0	0	111.4	S96 D97 L103 Q104	S96-L100 PolarHBondContact O-N 3.12Å; D97-L100 PolarHBondContact O-N 3.4Å; D97-L100 VanDerWaalsContact O-N 3.16Å; L100-L103 WeakPolarHBondContact O-CB 3.4Å; L100-L103 PolarHBondContact O-N 2.77Å; L100-Q104 WeakPolarHBondContact O-CG 3.22Å; L100-Q104 PolarHBondContact O-N 3.46Å
101	N	83.2	Confident	78	Confident	88 Å²	88	86.8 Å²	86.8	47%	0.471	43%	0.434	S	S	.	.	H	α-helix	trans	-63.8	-48.8	174.8	-68.8	28.2	0	0	0	111.4	D97 L103 Q104 E105	D97-N101 PolarHBondContact O-N 2.79Å; D97-N101 PolarHBondContact O-OD1 3.35Å; D97-N101 VanDerWaalsContact O-OD1 3.1Å; N101-L103 PolarHBondContact O-N 3.08Å; N101-Q104 PolarHBondContact O-N 3.1Å; N101-Q104 VanDerWaalsContact O-N 3.15Å; N101-E105 WeakPolarHBondContact O-CG 3.13Å; N101-E105 PolarHBondContact O-N 3.38Å
102	N	83.8	Confident	75.7	Confident	60 Å²	60	90.3 Å²	90.3	32%	0.321	45%	0.448	S	S	.	.	H	α-helix	trans	-62.8	-28.4	176.8	-81.7	68.6	0	0	0	113	I79 K98 H106	I79-N102 HydrophobicContact CG2-CB 3.91Å; I79-N102 WeakPolarHBondContact CG2-O 3.24Å; K98-N102 VanDerWaalsContact O-CB 3.28Å; K98-N102 WeakPolarHBondContact O-CB 3.19Å; K98-N102 PolarHBondContact O-N 3.18Å; K98-N102 PolarHBondContact O-OD1 3.5Å; N102-H106 WeakPolarHBondContact O-CB 3.36Å; N102-H106 PolarHBondContact O-N 3Å
103	L	85	Confident	73.4	Confident	47 Å²	47	89.6 Å²	89.6	25%	0.246	45%	0.449	C	S	.	.	H	α-helix	trans	-66	-50.6	170.9	-93.5	167.2	0	0	0	110.9	I79 H99 L100 N101 E105 H106 E107	I79-L103 HydrophobicContact CD1-CD2 3.74Å; I79-L103 HydrophobicContact CD1-CG 4.4Å; I79-L103 HydrophobicContact CG1-CD2 3.93Å; I79-L103 HydrophobicContact CG1-CG 4.49Å; I79-L103 HydrophobicContact CG2-CG 4.41Å; H99-L103 WeakPolarHBondContact NE2-CD1 3.35Å; H99-L103 WeakPolarHBondContact O-CB 3.39Å; H99-L103 WeakPolarHBondContact O-CG 3.19Å; H99-L103 PolarHBondContact O-N 3.49Å; L100-L103 WeakPolarHBondContact O-CB 3.4Å; L100-L103 PolarHBondContact O-N 2.77Å; N101-L103 PolarHBondContact O-N 3.08Å; L103-E105 PolarHBondContact O-N 3.02Å; L103-H106 PolarHBondContact O-N 3.47Å; L103-H106 VanDerWaalsContact O-N 3.11Å; L103-E107 WeakPolarHBondContact O-CB 3.39Å; L103-E107 WeakPolarHBondContact O-CG 3.47Å; L103-E107 PolarHBondContact O-N 2.79Å
104	Q	79	Confident	70.8	Confident	112 Å²	112	91.8 Å²	91.8	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-61.5	-41.3	179.4	-70.9	174.5	-21	0	0	112.2	L100 N101 E107 Q108	L100-Q104 WeakPolarHBondContact O-CG 3.22Å; L100-Q104 PolarHBondContact O-N 3.46Å; N101-Q104 PolarHBondContact O-N 3.1Å; N101-Q104 VanDerWaalsContact O-N 3.15Å; Q104-E107 PolarHBondContact O-N 3.44Å; Q104-Q108 WeakPolarHBondContact O-CB 3.48Å; Q104-Q108 VanDerWaalsContact O-CG 3.26Å; Q104-Q108 WeakPolarHBondContact O-CG 3.46Å; Q104-Q108 PolarHBondContact O-N 3.35Å
105	E	76.7	Confident	68	Low	113 Å²	113	94.1 Å²	94.1	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-44.2	172.1	-72.3	174.1	-177.3	0	0	111.4	N101 L103 Q108 T109	N101-E105 WeakPolarHBondContact O-CG 3.13Å; N101-E105 PolarHBondContact O-N 3.38Å; L103-E105 PolarHBondContact O-N 3.02Å; E105-Q108 PolarHBondContact O-N 3.48Å; E105-T109 WeakPolarHBondContact O-CG2 3.22Å; E105-T109 PolarHBondContact O-N 3.46Å; E105-T109 PolarHBondContact O-OG1 2.8Å
106	H	74.9	Confident	65.4	Low	88 Å²	88	91.9 Å²	91.9	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-66.7	-39.4	179.7	-165.9	-54.2	0	0	0	112.1	I79 N102 L103 T109 I110	I79-H106 HydrophobicContact CG2-CB 4.34Å; N102-H106 WeakPolarHBondContact O-CB 3.36Å; N102-H106 PolarHBondContact O-N 3Å; L103-H106 PolarHBondContact O-N 3.47Å; L103-H106 VanDerWaalsContact O-N 3.11Å; H106-T109 WeakPolarHBondContact CA-OG1 2.87Å; H106-T109 PolarHBondContact O-N 2.9Å; H106-T109 PolarHBondContact O-OG1 3.27Å; H106-I110 WeakPolarHBondContact ND1-CD1 3.43Å; H106-I110 WeakPolarHBondContact O-CG1 3.43Å; H106-I110 PolarHBondContact O-N 3.24Å; H106-I110 VanDerWaalsContact O-N 3.1Å
107	E	69.8	Low	62.7	Low	83 Å²	83	101.3 Å²	101.3	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-45.5	173.6	-72.7	169.1	166.5	0	0	110.6	L103 Q104 T109 I110 F111	L103-E107 WeakPolarHBondContact O-CB 3.39Å; L103-E107 WeakPolarHBondContact O-CG 3.47Å; L103-E107 PolarHBondContact O-N 2.79Å; Q104-E107 PolarHBondContact O-N 3.44Å; E107-T109 VanDerWaalsContact C-N 3.34Å; E107-T109 PolarHBondContact O-N 2.72Å; E107-I110 PolarHBondContact O-N 3.42Å; E107-I110 VanDerWaalsContact O-N 3.11Å; E107-F111 WeakPolarHBondContact O-CD2 3.21Å; E107-F111 PolarHBondContact O-N 2.77Å; E107-F111 VanDerWaalsContact O-N 3.15Å
108	Q	55.2	Low	60	Low	121 Å²	121	100 Å²	100	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-60.8	-38.1	173.7	-73.1	172.6	13.1	0	0	112.8	Q104 E105 I110 F111 N112	Q104-Q108 WeakPolarHBondContact O-CB 3.48Å; Q104-Q108 VanDerWaalsContact O-CG 3.26Å; Q104-Q108 WeakPolarHBondContact O-CG 3.46Å; Q104-Q108 PolarHBondContact O-N 3.35Å; E105-Q108 PolarHBondContact O-N 3.48Å; Q108-I110 VanDerWaalsContact C-N 3.32Å; Q108-I110 PolarHBondContact O-N 2.87Å; Q108-F111 PolarHBondContact O-N 3.25Å; Q108-N112 WeakPolarHBondContact O-CB 3.45Å; Q108-N112 VanDerWaalsContact O-CG 3.29Å; Q108-N112 PolarHBondContact O-N 2.99Å; Q108-N112 PolarHBondContact O-ND2 3.46Å
109	T	54.4	Low	57.6	Low	76 Å²	76	102.1 Å²	102.1	47%	0.466	53%	0.531	S	S	.	.	H	α-helix	trans	-69.2	-26.8	174.8	56.9	0	0	0	0	113.8	E105 H106 E107 T113	E105-T109 WeakPolarHBondContact O-CG2 3.22Å; E105-T109 PolarHBondContact O-N 3.46Å; E105-T109 PolarHBondContact O-OG1 2.8Å; H106-T109 WeakPolarHBondContact CA-OG1 2.87Å; H106-T109 PolarHBondContact O-N 2.9Å; H106-T109 PolarHBondContact O-OG1 3.27Å; E107-T109 VanDerWaalsContact C-N 3.34Å; E107-T109 PolarHBondContact O-N 2.72Å; T109-T113 WeakPolarHBondContact O-CB 3.27Å; T109-T113 WeakPolarHBondContact O-CG2 3.33Å; T109-T113 PolarHBondContact O-N 2.8Å; T109-T113 PolarHBondContact O-OG1 3.27Å
110	I	54.9	Low	54.9	Low	98 Å²	98	111.3 Å²	111.3	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-70.2	-45.2	173.8	-70.9	165.6	0	0	0	110.3	H106 E107 Q108 T113	H106-I110 WeakPolarHBondContact ND1-CD1 3.43Å; H106-I110 WeakPolarHBondContact O-CG1 3.43Å; H106-I110 PolarHBondContact O-N 3.24Å; H106-I110 VanDerWaalsContact O-N 3.1Å; E107-I110 PolarHBondContact O-N 3.42Å; E107-I110 VanDerWaalsContact O-N 3.11Å; Q108-I110 VanDerWaalsContact C-N 3.32Å; Q108-I110 PolarHBondContact O-N 2.87Å; I110-T113 PolarHBondContact O-N 2.82Å; I110-T113 PolarHBondContact O-OG1 3.31Å
111	F	44.9	Very low	52	Low	154 Å²	154	112.5 Å²	112.5	68%	0.675	59%	0.589	S	S	*	*	H	α-helix	trans	-64.7	-46.8	175.3	-79	-77.3	0	0	0	111.9	E107 Q108 T113 A114	E107-F111 WeakPolarHBondContact O-CD2 3.21Å; E107-F111 PolarHBondContact O-N 2.77Å; E107-F111 VanDerWaalsContact O-N 3.15Å; Q108-F111 PolarHBondContact O-N 3.25Å; F111-T113 PolarHBondContact O-N 3.21Å; F111-T113 VanDerWaalsContact O-N 3.09Å; F111-A114 PolarHBondContact O-N 3.4Å; F111-A114 VanDerWaalsContact O-N 3.13Å
112	N	40.7	Very low	49.6	Very low	113 Å²	113	118.1 Å²	118.1	60%	0.604	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-5.2	-179.1	-68.4	-19.8	0	0	0	115	Q108	Q108-N112 WeakPolarHBondContact O-CB 3.45Å; Q108-N112 VanDerWaalsContact O-CG 3.29Å; Q108-N112 PolarHBondContact O-N 2.99Å; Q108-N112 PolarHBondContact O-ND2 3.46Å
113	T	41.1	Very low	47	Very low	100 Å²	100	120.9 Å²	120.9	61%	0.613	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-1.4	173.1	48.3	0	0	0	0	114	T109 I110 F111	T109-T113 WeakPolarHBondContact O-CB 3.27Å; T109-T113 WeakPolarHBondContact O-CG2 3.33Å; T109-T113 PolarHBondContact O-N 2.8Å; T109-T113 PolarHBondContact O-OG1 3.27Å; I110-T113 PolarHBondContact O-N 2.82Å; I110-T113 PolarHBondContact O-OG1 3.31Å; F111-T113 PolarHBondContact O-N 3.21Å; F111-T113 VanDerWaalsContact O-N 3.09Å
114	A	36.2	Very low	44.8	Very low	71 Å²	71	124.3 Å²	124.3	59%	0.587	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-47	168.1	0	0	0	0	0	111.7	F111 T116	F111-A114 PolarHBondContact O-N 3.4Å; F111-A114 VanDerWaalsContact O-N 3.13Å; A114-T116 PolarHBondContact O-N 3.44Å
115	D	33.2	Very low	42.5	Very low	143 Å²	143	125 Å²	125	77%	0.765	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	15.5	-166.2	-65	-40.4	0	0	0	115.5
116	T	31.6	Very low	40.1	Very low	108 Å²	108	123.9 Å²	123.9	66%	0.663	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	29.5	-179.3	62.2	0	0	0	0	114.2	A114	A114-T116 PolarHBondContact O-N 3.44Å
117	R	29.6	Very low	37.9	Very low	233 Å²	233	125.9 Å²	125.9	88%	0.879	69%	0.686	S	S	*	*	S	Bend	trans	-137.9	51	176.4	-79.5	-168	167.5	177.3	-3.3	114.8
118	S	28	Very low	36	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	70%	0.701	S	S	*	*			trans	-142.1	166.4	157.7	59.4	0	0	0	0	109.9
119	N	30.1	Very low	35	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	71%	0.713	S	S	*	*			trans	67.1	57.6	176.3	-56.3	-15	0	0	0	117.4
120	H	32.7	Very low	33.8	Very low	203 Å²	203	136.8 Å²	136.8	94%	0.94	72%	0.723	S	S	*	*			trans	-138.8	112.2	135.1	-100.9	-63.1	0	0	0	109
121	S	28.1	Very low	32.8	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	74%	0.739	S	S	*	*			trans	-155	101.7	-177.6	56.3	0	0	0	0	111.5
122	E	31.7	Very low	32	Very low	205 Å²	205	139.7 Å²	139.7	96%	0.958	74%	0.742	S	S	*	*			trans	-130.8	146.4	165.1	-68.3	-171.7	132.7	0	0	109.1
123	S	28.9	Very low	31.5	Very low	118 Å²	118	142 Å²	142	83%	0.825	75%	0.754	S	S	*	*			trans	-110.8	-177.5	-176.1	-126.2	0	0	0	0	110.5
124	P	40	Very low	30.8	Very low	119 Å²	119	144 Å²	144	77%	0.773	76%	0.76	S	S	*	*			cis	-117	-155.8	17.3	40.2	-22	0	0	0	112.6
125	D	30.9	Very low	30.4	Very low	128 Å²	128	148.3 Å²	148.3	68%	0.684	77%	0.768	S	S	*	*			cis	-145.3	-143.3	10.5	-174.5	58.9	0	0	0	112.1	N127	D125-N127 PolarHBondContact OD2-ND2 3.01Å
126	C	24.7	Very low	30.1	Very low	89 Å²	89	148.6 Å²	148.6	60%	0.601	77%	0.765	S	S	*	*			trans	-149	-90.9	-165.4	-173.8	0	0	0	0	114.9	R128	C126-R128 PolarHBondContact O-N 2.89Å
127	N	30.1	Very low	29.9	Very low	130 Å²	130	149.5 Å²	149.5	70%	0.695	77%	0.765	S	S	*	*			trans	23.8	81.2	170.8	-65.1	-49.4	0	0	0	117.1	D125	D125-N127 PolarHBondContact OD2-ND2 3.01Å
128	R	29.4	Very low	30.2	Very low	184 Å²	184	144.9 Å²	144.9	69%	0.694	76%	0.757	S	S	*	*			cis	70.8	98.2	25.9	-174.8	-165.2	175.1	-178.4	1.1	115.5	C126	C126-R128 PolarHBondContact O-N 2.89Å
129	H	32.9	Very low	30.6	Very low	178 Å²	178	145.7 Å²	145.7	82%	0.824	76%	0.758	S	S	*	*			trans	-166.7	135.1	147.8	-98.3	50.3	0	0	0	105.7
130	Q	30.6	Very low	30.5	Very low	146 Å²	146	145.5 Å²	145.5	68%	0.682	75%	0.752	S	S	*	*			cis	79.6	95.7	29.1	-79.6	-168.8	-48.3	0	0	117.7
131	Q	32.9	Very low	29.9	Very low	179 Å²	179	142 Å²	142	84%	0.836	74%	0.74	S	S	*	*			trans	-177.7	120.2	139.8	-96.9	162.6	31.3	0	0	107.3
132	N	28.1	Very low	29.6	Very low	135 Å²	135	142.9 Å²	142.9	72%	0.722	74%	0.736	S	S	*	*				82	93.8	59.5	-70.8	0	0	0	0	114.5
133	N	30.5	Very low	29.1	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	73%	0.726	S	S	*	*				-171.2	177.4	108.6	-105.8	-61.9	0	0	0	115.1
134	L	25.9	Very low	29	Very low	142 Å²	142	137.4 Å²	137.4	74%	0.743	73%	0.726	S	S	*	*			trans	-104	161	-159.6	-84.2	153.6	0	0	0	115.8
135	H	28.3	Very low	28.4	Very low	161 Å²	161	136 Å²	136	75%	0.745	72%	0.72	S	S	*	*			trans	67.5	141.6	164.4	-76.5	50	0	0	0	115.3
136	Q	27.5	Very low	28.4	Very low	149 Å²	149	138.7 Å²	138.7	70%	0.696	73%	0.725	S	S	*	*			cis	-166.1	155.4	30.3	-139.9	172.5	58.6	0	0	110.4
137	N	26.9	Very low	28.5	Very low	127 Å²	127	143.7 Å²	143.7	68%	0.679	74%	0.736	S	S	*	*			trans	64	145.9	159.5	-55.5	-34.8	0	0	0	118.1
138	L	35.4	Very low	28.2	Very low	136 Å²	136	142.6 Å²	142.6	71%	0.712	74%	0.739	S	S	*	*			cis	-163.9	157.1	-17.6	-141.4	63.2	0	0	0	105.7
139	T	37.1	Very low	28.2	Very low	116 Å²	116	140.8 Å²	140.8	71%	0.712	74%	0.743	S	S	*	*			cis	-112.4	175.2	2	73.4	0	0	0	0	110.2
140	H	27.6	Very low	27.9	Very low	140 Å²	140	137.5 Å²	137.5	65%	0.648	74%	0.74	S	S	*	*			cis	79.7	122.9	19.9	-86.4	-128.5	0	0	0	118.2
141	L	20.1	Very low	27.6	Very low	129 Å²	129	136.3 Å²	136.3	68%	0.675	75%	0.748	S	S	*	*				42.3	145.7	123.1	-50	-171.4	0	0	0	119.8
142	N	21.6	Very low	27.1	Very low	128 Å²	128	133.1 Å²	133.1	68%	0.684	74%	0.744	S	S	*	*			cis	-168.4	164.7	-5.4	-123.2	-10.8	0	0	0	111.6
143	S	22.5	Very low	27	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	75%	0.747	S	S	*	*			trans	68.7	152.2	144.1	71.1	0	0	0	0	121.7
144	A	26.8	Very low	26.8	Very low	99 Å²	99	132.9 Å²	132.9	82%	0.818	74%	0.742	S	S	*	*			trans	68.6	127.7	170.1	0	0	0	0	0	118.2
145	S	27.1	Very low	26.8	Very low	91 Å²	91	132.3 Å²	132.3	64%	0.636	74%	0.74	S	S	*	*			cis	-162.6	163.2	-10.8	73.4	0	0	0	0	113.7
146	K	30.1	Very low	26.7	Very low	183 Å²	183	131.9 Å²	131.9	80%	0.796	74%	0.742	S	S	*	*			trans	77.5	101.1	153.5	-67.1	166.2	-174.5	171.1	0	121.1
147	K	26.8	Very low	26.6	Very low	194 Å²	194	132 Å²	132	84%	0.843	75%	0.746	S	S	*	*				72.9	113.5	120.3	-69.7	-170.2	175.2	-169.1	0	121.2
148	S	25.2	Very low	26.5	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	75%	0.746	S	S	*	*				121.3	137.1	107.9	66.1	0	0	0	0	119.8
149	N	27.7	Very low	26.2	Very low	146 Å²	146	126.2 Å²	126.2	78%	0.781	73%	0.725	S	S	*	*			trans	75.6	89.5	154.9	-63.7	10	0	0	0	121.3
150	S	28	Very low	25.8	Very low	109 Å²	109	125 Å²	125	76%	0.762	71%	0.71	S	S	*	*				74.7	108.4	119.2	65.5	0	0	0	0	122.5
151	S	24.4	Very low	26	Very low	121 Å²	121	120.8 Å²	120.8	85%	0.846	70%	0.695	S	S	*	*				84.3	78.1	121.4	-164.6	0	0	0	0	120.6
152	C	22.7	Very low	26.4	Very low	112 Å²	112	119.8 Å²	119.8	76%	0.757	69%	0.69	S	S	*	*			trans	-140.9	149.3	145.8	24	0	0	0	0	106.2
153	D	25.3	Very low	26.6	Very low	148 Å²	148	117.5 Å²	117.5	79%	0.791	68%	0.684	S	S	*	*			cis	-157.8	-177.3	10.5	-108.5	-36.9	0	0	0	111.5
154	L	25.5	Very low	26.8	Very low	144 Å²	144	119.4 Å²	119.4	75%	0.754	68%	0.681	S	S	*	*			trans	97.5	151.3	145.4	-116.4	70.2	0	0	0	123.4
155	N	26.3	Very low	26.8	Very low	130 Å²	130	122.4 Å²	122.4	70%	0.695	67%	0.671	S	S	*	*			trans	81.5	87.1	155.8	-64	-12.1	0	0	0	123.8
156	I	25.5	Very low	26.8	Very low	153 Å²	153	127.5 Å²	127.5	79%	0.785	68%	0.676	S	S	*	*				42.8	117.4	99.7	-64.7	178.8	0	0	0	120.6
157	L	25.3	Very low	26.5	Very low	152 Å²	152	123.9 Å²	123.9	80%	0.796	67%	0.669	S	S	*	*			trans	79.7	139.3	144	-128	76	0	0	0	125.1
158	T	26.4	Very low	26.5	Very low	110 Å²	110	121.9 Å²	121.9	68%	0.675	67%	0.666	S	S	*	*			trans	77.9	167.5	153	15.4	0	0	0	0	119.8
159	A	28.5	Very low	26.5	Very low	31 Å²	31	121 Å²	121	26%	0.256	66%	0.66	S	S	.	*			trans	-80.3	158.6	-158.5	0	0	0	0	0	110.4	I599 Q602	A159-I599 HydrophobicContact CB-CG1 4.44Å; A159-I599 WeakPolarHBondContact O-CG2 3.49Å; A159-Q602 VanDerWaalsContact CB-OE1 3.31Å
160	Q	29.3	Very low	26.4	Very low	89 Å²	89	119 Å²	119	42%	0.416	66%	0.657	S	S	.	*			cis	166.2	-140.9	7.8	158.8	-172.2	-77.8	0	0	105.3	H595 I599	Q160-H595 WeakPolarHBondContact CG-CE1 3.45Å; Q160-H595 WeakPolarHBondContact CG-NE2 3.46Å; Q160-H595 PolarHBondContact NE2-CD2 2.93Å; Q160-H595 VanDerWaalsContact NE2-CD2 3.31Å; Q160-H595 PolarHBondContact NE2-O 3.48Å; Q160-H595 PolarHBondContact OE1-CD2 3.08Å; Q160-H595 PolarHBondContact OE1-NE2 3.11Å; Q160-I599 HydrophobicContact CB-CD1 3.81Å; Q160-I599 HydrophobicContact CB-CG1 3.31Å; Q160-I599 HydrophobicContact CG-CD1 3.69Å; Q160-I599 HydrophobicContact CG-CG1 3.79Å
161	T	31.5	Very low	26.3	Very low	53 Å²	53	118.7 Å²	118.7	33%	0.325	66%	0.655	S	S	.	*			trans	-63.2	155.7	-175.6	36.9	0	0	0	0	118.3	Q596 I599	T161-Q596 WeakPolarHBondContact OG1-CG 3.2Å; T161-I599 VanDerWaalsContact O-CB 3.32Å; T161-I599 WeakPolarHBondContact O-CB 3.16Å; T161-I599 VanDerWaalsContact O-CD1 3.25Å; T161-I599 WeakPolarHBondContact O-CD1 3.23Å; T161-I599 VanDerWaalsContact OG1-CD1 3.28Å; T161-I599 WeakPolarHBondContact OG1-CD1 3.2Å
162	L	27.3	Very low	26.7	Very low	107 Å²	107	120.7 Å²	120.7	56%	0.56	65%	0.651	S	S	*	*				-164.8	151.4	63.2	-124.9	-170.9	0	0	0	115.5	Q596	L162-Q596 HydrophobicContact CD1-CB 3.88Å; L162-Q596 HydrophobicContact CD1-CG 4.06Å; L162-Q596 HydrophobicContact CD2-CG 4.23Å; L162-Q596 HydrophobicContact CG-CB 3.98Å; L162-Q596 HydrophobicContact CG-CG 3.7Å
163	S	26.6	Very low	27	Very low	80 Å²	80	122.6 Å²	122.6	56%	0.559	65%	0.649	S	S	*	*			trans	38	117.3	150.7	56.7	0	0	0	0	125
164	E	26.4	Very low	27.1	Very low	148 Å²	148	121.7 Å²	121.7	69%	0.692	64%	0.644	S	S	*	*				68.4	152.2	114.7	-60	-153.8	151.3	0	0	121.2
165	R	26.9	Very low	27	Very low	163 Å²	163	120.4 Å²	120.4	62%	0.615	64%	0.636	S	S	*	*			cis	-162.5	169.1	-1.8	-127.8	-172.5	-132.8	-129.8	-3.1	111.1
166	R	27.5	Very low	27	Very low	198 Å²	198	119.7 Å²	119.7	75%	0.747	63%	0.626	S	S	*	*			trans	70.4	145.7	146	-79.2	-179.9	-143.5	-139.9	5.4	119.5
167	T	24.5	Very low	26.9	Very low	106 Å²	106	115.6 Å²	115.6	65%	0.65	61%	0.605	S	S	*	*			cis	-173.8	164	-24.9	14.4	0	0	0	0	110.3
168	I	26.2	Very low	26.9	Very low	153 Å²	153	113.9 Å²	113.9	79%	0.785	60%	0.597	S	S	*	*			trans	73.3	137.8	144.2	-77.7	162.7	0	0	0	117.3
169	S	24	Very low	26.9	Very low	89 Å²	89	114 Å²	114	62%	0.622	59%	0.59	S	S	*	*			cis	-167.9	172.4	-9.2	55.5	0	0	0	0	114.1
170	S	25.6	Very low	26.8	Very low	102 Å²	102	121 Å²	121	71%	0.713	62%	0.615	S	S	*	*			trans	67.3	149.5	141	52.7	0	0	0	0	121.6
171	S	26.5	Very low	27.2	Very low	103 Å²	103	124 Å²	124	72%	0.72	64%	0.639	S	S	*	*			cis	173.1	140.6	-31.7	49.7	0	0	0	0	109.1
172	H	32.2	Very low	26.7	Very low	163 Å²	163	126.9 Å²	126.9	76%	0.755	65%	0.652	S	S	*	*			trans	-162.6	130.1	153	-118.3	-90	0	0	0	113.2
173	Q	30.1	Very low	26.6	Very low	153 Å²	153	127.3 Å²	127.3	72%	0.715	65%	0.651	S	S	*	*			trans	30.3	120.2	149.5	-69.6	162.9	-13.6	0	0	119.4
174	N	26	Very low	26.8	Very low	128 Å²	128	130.3 Å²	130.3	68%	0.684	65%	0.654	S	S	*	*			cis	60.2	131.4	42.6	-55.3	-12.9	0	0	0	114.4	T189	N174-T189 HydrophobicContact CB-CG2 4.29Å
175	M	24.7	Very low	26.6	Very low	118 Å²	118	125.7 Å²	125.7	58%	0.581	63%	0.634	S	S	*	*			cis	-164.1	-167.5	-5.8	-106.4	179.4	96.8	0	0	106.8	N187 T189	M175-N187 HydrophobicContact CB-CB 4.18Å; M175-N187 WeakPolarHBondContact CB-OD1 3.44Å; M175-N187 HydrophobicContact CE-CB 4.2Å; M175-T189 HydrophobicContact SD-CG2 4.06Å
176	K	25.1	Very low	26.7	Very low	114 Å²	114	123.6 Å²	123.6	50%	0.496	63%	0.631	S	S	.	*			trans	86.2	129.2	-178.9	-138.4	160.3	-148.5	158.5	0	110.1	N187	K176-N187 VanDerWaalsContact CA-CG 3.42Å; K176-N187 WeakPolarHBondContact CA-OD1 3.49Å; K176-N187 HydrophobicContact CB-CB 3.93Å; K176-N187 WeakPolarHBondContact CB-ND2 3.24Å; K176-N187 WeakPolarHBondContact CB-OD1 3.44Å; K176-N187 WeakPolarHBondContact CD-ND2 3.37Å; K176-N187 WeakPolarHBondContact CE-ND2 3.33Å; K176-N187 WeakPolarHBondContact CE-O 3.17Å; K176-N187 HydrophobicContact CG-CB 3.89Å; K176-N187 WeakPolarHBondContact CG-ND2 3.11Å; K176-N187 VanDerWaalsContact N-CG 3.32Å; K176-N187 PolarHBondContact N-OD1 2.97Å; K176-N187 PolarHBondContact NZ-ND2 2.88Å; K176-N187 PolarHBondContact NZ-O 3.37Å
177	L	24.7	Very low	26.7	Very low	67 Å²	67	115.2 Å²	115.2	35%	0.351	60%	0.601	S	S	.	*			cis	-154	147.3	6.5	-106.6	-105.1	0	0	0	103.3	L185 Q186	L177-L185 VanDerWaalsContact CB-CA 3.41Å; L177-L185 HydrophobicContact CB-CB 3.25Å; L177-L185 HydrophobicContact CB-CD2 3.06Å; L177-L185 HydrophobicContact CB-CG 3.54Å; L177-L185 HydrophobicContact CD1-CB 3.53Å; L177-L185 WeakPolarHBondContact CD1-O 3.48Å; L177-L185 HydrophobicContact CD2-CB 4.06Å; L177-L185 HydrophobicContact CD2-CD2 3.8Å; L177-L185 HydrophobicContact CD2-CG 4.32Å; L177-L185 HydrophobicContact CG-CB 3.58Å; L177-L185 HydrophobicContact CG-CD2 3.95Å; L177-L185 HydrophobicContact CG-CG 4.22Å; L177-L185 WeakPolarHBondContact O-CD2 3.21Å; L177-Q186 VanDerWaalsContact C-N 3.3Å; L177-Q186 WeakPolarHBondContact CA-O 3.35Å; L177-Q186 VanDerWaalsContact CG-N 3.3Å
178	D	25.7	Very low	26.8	Very low	117 Å²	117	116.7 Å²	116.7	63%	0.626	60%	0.599	S	S	*	*			trans	-131.6	146.1	-176.7	61.4	-55.4	0	0	0	119.9	E183 L185	D178-E183 CarbonylContact C-O 3.46Å; D178-E183 WeakPolarHBondContact CA-O 3.46Å; D178-E183 PolarHBondContact N-O 3.24Å; D178-L185 VanDerWaalsContact N-CA 3.3Å; D178-L185 PolarHBondContact O-N 2.86Å
179	Q	26.4	Very low	26.7	Very low	113 Å²	113	112.3 Å²	112.3	53%	0.528	58%	0.579	S	S	.	*			trans	167.4	162.4	167.6	-161.4	-117.7	119.5	0	0	115.4	I182 E183 F184	Q179-I182 CarbonylContact C-O 3.51Å; Q179-I182 CarbonylContact O-C 2.91Å; Q179-E183 PolarHBondContact N-O 3.17Å; Q179-E183 CarbonylContact O-C 3.23Å; Q179-E183 PolarHBondContact O-N 3.42Å; Q179-F184 WeakPolarHBondContact CB-O 3.19Å; Q179-F184 PolarHBondContact NE2-O 3.37Å; Q179-F184 PolarHBondContact O-N 2.63Å
180	K	25.8	Very low	26.8	Very low	176 Å²	176	114.7 Å²	114.7	77%	0.765	58%	0.58	S	S	*	*	S	Bend	trans	58.8	-173.1	-160.9	-77	-174.3	-177.9	171.3	0	110.1	I182	K180-I182 HydrophobicContact CB-CG2 4.07Å; K180-I182 HydrophobicContact CD-CG2 4.46Å; K180-I182 PolarHBondContact O-N 2.77Å
181	T	37.9	Very low	26.8	Very low	152 Å²	152	115 Å²	115	93%	0.933	57%	0.574	S	S	*	*	S	Bend	trans	-71.6	35	163.8	-35.1	0	0	0	0	111.3
182	I	21.3	Very low	26.7	Very low	114 Å²	114	116.6 Å²	116.6	59%	0.585	57%	0.57	S	S	*	*	S	Bend	trans	-169.9	-144.6	-164.7	-127	162.7	0	0	0	109.1	Q179 K180	Q179-I182 CarbonylContact C-O 3.51Å; Q179-I182 CarbonylContact O-C 2.91Å; K180-I182 HydrophobicContact CB-CG2 4.07Å; K180-I182 HydrophobicContact CD-CG2 4.46Å; K180-I182 PolarHBondContact O-N 2.77Å
183	E	25.5	Very low	26.3	Very low	117 Å²	117	116 Å²	116	55%	0.547	57%	0.565	S	S	.	*			trans	-50.8	-81.8	-176.4	-64.3	141.6	179.9	0	0	121.2	D178 Q179 L185	D178-E183 CarbonylContact C-O 3.46Å; D178-E183 WeakPolarHBondContact CA-O 3.46Å; D178-E183 PolarHBondContact N-O 3.24Å; Q179-E183 PolarHBondContact N-O 3.17Å; Q179-E183 CarbonylContact O-C 3.23Å; Q179-E183 PolarHBondContact O-N 3.42Å; E183-L185 HydrophobicContact CB-CD1 3.9Å; E183-L185 HydrophobicContact CB-CG 3.94Å; E183-L185 WeakPolarHBondContact O-CA 3.25Å; E183-L185 VanDerWaalsContact O-CG 3.27Å; E183-L185 WeakPolarHBondContact O-CG 3.41Å; E183-L185 PolarHBondContact O-N 3.37Å
184	F	29.8	Very low	26.1	Very low	142 Å²	142	113.7 Å²	113.7	62%	0.623	56%	0.561	S	S	*	*				-85.8	102.9	-122.3	-144.8	-61.5	0	0	0	120.6	Q179	Q179-F184 WeakPolarHBondContact CB-O 3.19Å; Q179-F184 PolarHBondContact NE2-O 3.37Å; Q179-F184 PolarHBondContact O-N 2.63Å
185	L	22.3	Very low	26.1	Very low	52 Å²	52	116.7 Å²	116.7	27%	0.272	56%	0.563	S	S	.	*			cis	-179.2	132.3	-14.2	-107.9	153.3	0	0	0	102.4	L177 D178 E183	L177-L185 VanDerWaalsContact CB-CA 3.41Å; L177-L185 HydrophobicContact CB-CB 3.25Å; L177-L185 HydrophobicContact CB-CD2 3.06Å; L177-L185 HydrophobicContact CB-CG 3.54Å; L177-L185 HydrophobicContact CD1-CB 3.53Å; L177-L185 WeakPolarHBondContact CD1-O 3.48Å; L177-L185 HydrophobicContact CD2-CB 4.06Å; L177-L185 HydrophobicContact CD2-CD2 3.8Å; L177-L185 HydrophobicContact CD2-CG 4.32Å; L177-L185 HydrophobicContact CG-CB 3.58Å; L177-L185 HydrophobicContact CG-CD2 3.95Å; L177-L185 HydrophobicContact CG-CG 4.22Å; L177-L185 WeakPolarHBondContact O-CD2 3.21Å; D178-L185 VanDerWaalsContact N-CA 3.3Å; D178-L185 PolarHBondContact O-N 2.86Å; E183-L185 HydrophobicContact CB-CD1 3.9Å; E183-L185 HydrophobicContact CB-CG 3.94Å; E183-L185 WeakPolarHBondContact O-CA 3.25Å; E183-L185 VanDerWaalsContact O-CG 3.27Å; E183-L185 WeakPolarHBondContact O-CG 3.41Å; E183-L185 PolarHBondContact O-N 3.37Å
186	Q	29.3	Very low	26	Very low	118 Å²	118	116 Å²	116	55%	0.551	56%	0.562	S	S	*	*			trans	-157.6	148.6	170.4	-158	51.4	-88.3	0	0	122.2	L177	L177-Q186 VanDerWaalsContact C-N 3.3Å; L177-Q186 WeakPolarHBondContact CA-O 3.35Å; L177-Q186 VanDerWaalsContact CG-N 3.3Å
187	N	26	Very low	26	Very low	22 Å²	22	116.7 Å²	116.7	12%	0.118	57%	0.571	C	S	.	*			trans	-167	176.2	161.5	90.6	160.7	0	0	0	112.4	M175 K176	M175-N187 HydrophobicContact CB-CB 4.18Å; M175-N187 WeakPolarHBondContact CB-OD1 3.44Å; M175-N187 HydrophobicContact CE-CB 4.2Å; K176-N187 VanDerWaalsContact CA-CG 3.42Å; K176-N187 WeakPolarHBondContact CA-OD1 3.49Å; K176-N187 HydrophobicContact CB-CB 3.93Å; K176-N187 WeakPolarHBondContact CB-ND2 3.24Å; K176-N187 WeakPolarHBondContact CB-OD1 3.44Å; K176-N187 WeakPolarHBondContact CD-ND2 3.37Å; K176-N187 WeakPolarHBondContact CE-ND2 3.33Å; K176-N187 WeakPolarHBondContact CE-O 3.17Å; K176-N187 HydrophobicContact CG-CB 3.89Å; K176-N187 WeakPolarHBondContact CG-ND2 3.11Å; K176-N187 VanDerWaalsContact N-CG 3.32Å; K176-N187 PolarHBondContact N-OD1 2.97Å; K176-N187 PolarHBondContact NZ-ND2 2.88Å; K176-N187 PolarHBondContact NZ-O 3.37Å
188	K	27.1	Very low	26	Very low	138 Å²	138	119.3 Å²	119.3	60%	0.6	58%	0.584	S	S	*	*				-159.5	162.8	68.5	-154.5	144	-158.7	-163.4	0	114.8
189	T	24.5	Very low	25.9	Very low	60 Å²	60	119.5 Å²	119.5	37%	0.368	59%	0.585	S	S	.	*			trans	-44.1	166.9	152.2	64.3	0	0	0	0	111.5	N174 M175	N174-T189 HydrophobicContact CB-CG2 4.29Å; M175-T189 HydrophobicContact SD-CG2 4.06Å
190	E	26.7	Very low	25.7	Very low	139 Å²	139	120.1 Å²	120.1	65%	0.65	59%	0.59	S	S	*	*				-158.1	142.1	85.5	-101.3	179.5	-148.7	0	0	113.4
191	N	25.3	Very low	25.6	Very low	109 Å²	109	117.5 Å²	117.5	58%	0.583	59%	0.585	S	S	*	*			trans	73.9	133.7	139.4	-66.6	-13	0	0	0	116.5
192	E	23.5	Very low	25	Very low	137 Å²	137	117.6 Å²	117.6	64%	0.64	57%	0.572	S	S	*	*				57.1	131.8	78.4	-55.7	-157	155.8	0	0	111.8
193	K	24.2	Very low	25.4	Very low	149 Å²	149	116.4 Å²	116.4	65%	0.648	58%	0.58	S	S	*	*			cis	-176.6	169.9	5.7	-121.5	177	-165.5	145.4	0	108.3
194	V	25.3	Very low	25.3	Very low	105 Å²	105	117.4 Å²	117.4	64%	0.636	59%	0.587	S	S	*	*			trans	65.9	150.1	137.7	164.8	0	0	0	0	118.4
195	R	26.1	Very low	24.9	Very low	191 Å²	191	116.4 Å²	116.4	72%	0.721	59%	0.593	S	S	*	*			trans	63.6	114.2	-175.1	-94	51.7	-101	-171.8	-1.5	109.7
196	D	24.2	Very low	24.9	Very low	105 Å²	105	120 Å²	120	56%	0.561	61%	0.613	S	S	*	*				55.3	134	70	-44.3	-0.9	0	0	0	108.9
197	N	24.6	Very low	24.7	Very low	128 Å²	128	123.2 Å²	123.2	68%	0.684	63%	0.625	S	S	*	*			cis	-158.4	-170.3	34.6	-147.7	-20.2	0	0	0	109.9
198	I	24.5	Very low	24.6	Very low	122 Å²	122	128.3 Å²	128.3	63%	0.626	65%	0.652	S	S	*	*			trans	54.2	94.5	141.8	-72.8	164	0	0	0	112.7
199	N	23.8	Very low	24.5	Very low	120 Å²	120	129 Å²	129	64%	0.642	66%	0.657	S	S	*	*				124.8	126.7	68.5	-100.4	-3.6	0	0	0	105.4
200	I	23.1	Very low	24.7	Very low	126 Å²	126	132.7 Å²	132.7	65%	0.646	67%	0.673	S	S	*	*				74.9	150.2	97.4	-72.5	175.2	0	0	0	112.5
201	N	22.6	Very low	24.8	Very low	121 Å²	121	129.7 Å²	129.7	65%	0.647	68%	0.679	S	S	*	*			trans	72.6	151	169.9	-66.9	-20.6	0	0	0	115.8
202	K	24.7	Very low	25.5	Very low	155 Å²	155	132.1 Å²	132.1	67%	0.674	69%	0.691	S	S	*	*			cis	-164.6	169.6	-16.6	-117.2	164.5	-169.7	150.1	0	108.7	I204	K202-I204 WeakPolarHBondContact CB-O 3.36Å
203	A	29.5	Very low	25.7	Very low	89 Å²	89	130.5 Å²	130.5	74%	0.736	69%	0.693	S	S	*	*	S	Bend	trans	-73.8	126.9	144.9	0	0	0	0	0	108.3
204	I	23.6	Very low	25.8	Very low	137 Å²	137	131.3 Å²	131.3	70%	0.703	70%	0.704	S	S	*	*			trans	75.9	123.7	-167.1	-44.5	152.9	0	0	0	109.7	K202	K202-I204 WeakPolarHBondContact CB-O 3.36Å
205	T	21.3	Very low	26.1	Very low	121 Å²	121	129.5 Å²	129.5	74%	0.742	71%	0.707	S	S	*	*				-150.2	141.6	66.5	45.6	0	0	0	0	115.7
206	N	23.7	Very low	26.2	Very low	129 Å²	129	129.6 Å²	129.6	69%	0.69	72%	0.716	S	S	*	*			trans	25.2	130	133.3	-62.7	3.7	0	0	0	122.2
207	F	24.7	Very low	26.6	Very low	184 Å²	184	131 Å²	131	81%	0.807	72%	0.723	S	S	*	*			trans	66.3	140.8	131.8	-80.8	-105	0	0	0	122.5
208	L	24.1	Very low	26.9	Very low	130 Å²	130	135.4 Å²	135.4	68%	0.681	73%	0.73	S	S	*	*			trans	19.2	133.3	150.1	-91.5	64.7	0	0	0	122.4
209	E	25.6	Very low	27.1	Very low	153 Å²	153	136.1 Å²	136.1	72%	0.715	73%	0.732	S	S	*	*			trans	86.9	131.4	131.5	-75.2	-176	144.4	0	0	123
210	I	27.4	Very low	27.5	Very low	137 Å²	137	137.4 Å²	137.4	70%	0.703	73%	0.734	S	S	*	*			trans	54.6	109.5	135.6	-56.6	166.8	0	0	0	117.1
211	G	30	Very low	27.7	Very low	75 Å²	75	139.1 Å²	139.1	77%	0.773	74%	0.74	S	S	*	*			trans	-77.2	160.1	173.9	0	0	0	0	0	114.4
212	L	39.3	Very low	28.1	Very low	160 Å²	160	138.2 Å²	138.2	84%	0.838	74%	0.74	S	S	*	*			trans	-156.6	144.1	-178.5	-107.1	154.5	0	0	0	110.9
213	P	27.2	Very low	28.1	Very low	104 Å²	104	135.4 Å²	135.4	68%	0.675	74%	0.74	S	S	*	*			trans	-129.1	154.1	156.3	37.1	-25.8	0	0	0	114.2
214	N	26.1	Very low	27.7	Very low	165 Å²	165	137 Å²	137	88%	0.882	74%	0.744	S	S	*	*			trans	94.9	137.8	165.7	-49.8	-31.7	0	0	0	118.3
215	G	32.5	Very low	28.2	Very low	68 Å²	68	135.8 Å²	135.8	70%	0.701	75%	0.746	S	S	*	*			trans	98.6	90.2	-172.8	0	0	0	0	0	111.7
216	E	28.2	Very low	28.4	Very low	193 Å²	193	133.3 Å²	133.3	90%	0.902	73%	0.733	S	S	*	*				96.4	148.5	63.4	-74.4	-170.2	143.4	0	0	114.3
217	D	33	Very low	28.5	Very low	135 Å²	135	132.6 Å²	132.6	72%	0.722	72%	0.721	S	S	*	*			trans	62.4	91.5	170.6	-74.5	-25.4	0	0	0	125.2
218	R	30.7	Very low	28.4	Very low	220 Å²	220	127.5 Å²	127.5	83%	0.83	71%	0.709	S	S	*	*				61	116.8	101.9	-74.9	-174.4	176.1	-173	-1	123.8
219	M	28.2	Very low	28.3	Very low	136 Å²	136	124.7 Å²	124.7	67%	0.67	70%	0.7	S	S	*	*				97.9	129.7	124.9	-61.8	-97.4	64.8	0	0	122.8
220	H	32	Very low	28.2	Very low	147 Å²	147	119.3 Å²	119.3	68%	0.681	68%	0.679	S	S	*	*			trans	69.4	148.9	156.7	-56.7	-37.5	0	0	0	118.5
221	Q	27.2	Very low	28.2	Very low	163 Å²	163	116.1 Å²	116.1	76%	0.762	67%	0.666	S	S	*	*			cis	-170.6	177.4	-13.6	-108.9	-172.5	3.2	0	0	107.8
222	P	31	Very low	27.8	Very low	101 Å²	101	116.8 Å²	116.8	66%	0.656	66%	0.655	S	S	*	*			cis	-138.7	158.9	-33.5	39.3	-21.8	0	0	0	116.7
223	S	24.8	Very low	27	Very low	96 Å²	96	111.9 Å²	111.9	67%	0.671	63%	0.63	S	S	*	*			trans	53.2	117.7	141.6	64.7	0	0	0	0	126.2
224	C	21.7	Very low	26.8	Very low	123 Å²	123	108.4 Å²	108.4	83%	0.831	61%	0.608	S	S	*	*				69.8	158.6	127.2	-63.4	0	0	0	0	122.5
225	P	33.4	Very low	26.7	Very low	112 Å²	112	105.5 Å²	105.5	73%	0.727	60%	0.596	S	S	*	*			cis	-136.7	-170.4	-34.9	40.2	-22.2	0	0	0	114.5
226	S	26.6	Very low	26.3	Very low	68 Å²	68	106.7 Å²	106.7	48%	0.476	59%	0.594	S	S	.	*			trans	-33.7	159.2	170.9	38.8	0	0	0	0	118.9	Q759	S226-Q759 PolarHBondContact O-OE1 3.43Å; S226-Q759 VanDerWaalsContact OG-CD 3.26Å; S226-Q759 PolarHBondContact OG-NE2 2.88Å; S226-Q759 VanDerWaalsContact OG-NE2 3.1Å; S226-Q759 PolarHBondContact OG-OE1 3.03Å
227	Y	24.1	Very low	26	Very low	114 Å²	114	105.9 Å²	105.9	45%	0.447	59%	0.588	S	S	.	*			cis	-114.5	-170.5	10.2	-78.9	157.8	0	0	0	111	I757 Q759	Y227-I757 VanDerWaalsContact CB-O 3.24Å; Y227-I757 WeakPolarHBondContact CB-O 3.24Å; Y227-I757 HydrophobicContact CD1-CB 4.01Å; Y227-I757 HydrophobicContact CD1-CD1 4.07Å; Y227-I757 HydrophobicContact CD1-CG1 3.53Å; Y227-I757 HydrophobicContact CD1-CG2 4.04Å; Y227-I757 HydrophobicContact CD2-CD1 3.97Å; Y227-I757 HydrophobicContact CD2-CG1 4.22Å; Y227-I757 HydrophobicContact CD2-CG2 3.8Å; Y227-I757 HydrophobicContact CE1-CB 4.44Å; Y227-I757 HydrophobicContact CE1-CD1 3.72Å; Y227-I757 HydrophobicContact CE1-CG1 3.48Å; Y227-I757 VanDerWaalsContact CE1-CG1 3.48Å; Y227-I757 HydrophobicContact CE2-CD1 3.55Å; Y227-I757 HydrophobicContact CE2-CG1 4.13Å; Y227-I757 HydrophobicContact CE2-CG2 4.44Å; Y227-I757 HydrophobicContact CG-CB 4.11Å; Y227-I757 HydrophobicContact CG-CD1 4.26Å; Y227-I757 HydrophobicContact CG-CG1 3.97Å; Y227-I757 HydrophobicContact CG-CG2 3.61Å; Y227-I757 VanDerWaalsContact CZ-CD1 3.42Å; Y227-Q759 HydrophobicContact CD1-CB 3.36Å; Y227-Q759 HydrophobicContact CD1-CG 3.7Å; Y227-Q759 HydrophobicContact CD2-CB 4.3Å; Y227-Q759 HydrophobicContact CD2-CG 4.3Å; Y227-Q759 VanDerWaalsContact CD2-NE2 3.26Å; Y227-Q759 HydrophobicContact CE1-CB 3.99Å; Y227-Q759 HydrophobicContact CE1-CG 3.8Å; Y227-Q759 HydrophobicContact CE2-CG 4.42Å; Y227-Q759 HydrophobicContact CG-CB 3.5Å; Y227-Q759 VanDerWaalsContact CG-CB 3.5Å; Y227-Q759 HydrophobicContact CG-CG 3.93Å
228	S	22.7	Very low	25.5	Very low	78 Å²	78	105.4 Å²	105.4	55%	0.545	59%	0.594	S	S	.	*			trans	-88.9	-164.5	-170.6	50.4	0	0	0	0	115.3	Y756 I757	S228-Y756 PolarHBondContact OG-O 3.39Å; S228-I757 CarbonylContact C-O 3.33Å; S228-I757 PolarHBondContact N-O 3.38Å
229	S	22.6	Very low	25	Very low	70 Å²	70	104.2 Å²	104.2	49%	0.49	59%	0.591	S	S	.	*				-154.6	170.5	68.6	-168.8	0	0	0	0	114.3	Y756	S229-Y756 WeakPolarHBondContact CB-O 3.26Å; S229-Y756 PolarHBondContact OG-N 3.11Å; S229-Y756 PolarHBondContact OG-O 3.46Å
230	S	23.9	Very low	24.7	Very low	40 Å²	40	105.4 Å²	105.4	28%	0.28	60%	0.6	S	S	.	*			trans	11.1	124.2	151.5	59.8	0	0	0	0	122.2
231	V	26.4	Very low	24.3	Very low	70 Å²	70	106.2 Å²	106.2	42%	0.424	60%	0.603	S	S	.	*				77.1	153.8	128.6	175.4	0	0	0	0	118.2	K751 L752	V231-K751 HydrophobicContact CG1-CB 3.55Å; V231-K751 HydrophobicContact CG1-CD 4.22Å; V231-K751 HydrophobicContact CG1-CG 3.57Å; V231-K751 WeakPolarHBondContact CG1-O 3.44Å; V231-K751 HydrophobicContact CG2-CD 4.46Å; V231-K751 HydrophobicContact CG2-CG 4.14Å; V231-L752 HydrophobicContact CB-CD1 4.25Å; V231-L752 HydrophobicContact CB-CG 4.04Å; V231-L752 HydrophobicContact CG1-CB 4.13Å; V231-L752 HydrophobicContact CG1-CD1 4.41Å; V231-L752 HydrophobicContact CG1-CG 4.15Å; V231-L752 HydrophobicContact CG2-CG 4.31Å
232	T	23	Very low	24.2	Very low	89 Å²	89	104.1 Å²	104.1	55%	0.546	60%	0.604	S	S	.	*			cis	-101.7	168.3	0.5	61.6	0	0	0	0	111.9	K751	T232-K751 HydrophobicContact CG2-CB 4.21Å
233	D	22.4	Very low	23.8	Very low	58 Å²	58	106.2 Å²	106.2	31%	0.31	61%	0.609	S	S	.	*			cis	90.5	126.4	31.9	-128.1	69.2	0	0	0	118.2	K749 K751	D233-K749 WeakPolarHBondContact OD2-CD 3.44Å; D233-K749 VanDerWaalsContact OD2-CE 3.29Å; D233-K749 WeakPolarHBondContact OD2-CE 3.36Å; D233-K749 IonicContact OD2-NZ 3.69Å; D233-K749 PolarHBondContact OD2-NZ 3.02Å; D233-K751 HydrophobicContact CB-CB 4.38Å; D233-K751 HydrophobicContact CB-CD 4.12Å; D233-K751 WeakPolarHBondContact OD1-CE 3.3Å; D233-K751 IonicContact OD1-NZ 3.94Å; D233-K751 PolarHBondContact OD1-NZ 2.95Å
234	S	22.7	Very low	23.6	Very low	30 Å²	30	110.9 Å²	110.9	21%	0.21	62%	0.617	C	S	.	*			trans	147.5	127.2	131.4	-68.8	0	0	0	0	119.9	K748 K749	S234-K748 VanDerWaalsContact CB-CD 3.48Å; S234-K748 VanDerWaalsContact CB-CG 3.48Å; S234-K748 PolarHBondContact O-NZ 3.44Å; S234-K748 WeakPolarHBondContact OG-CG 3.48Å; S234-K749 VanDerWaalsContact OG-CD 3.31Å; S234-K749 WeakPolarHBondContact OG-CD 3.44Å; S234-K749 WeakPolarHBondContact OG-CG 3.28Å
235	T	23.3	Very low	23.6	Very low	104 Å²	104	110.7 Å²	110.7	64%	0.638	61%	0.612	S	S	*	*			trans	68.5	153.8	140.7	66.1	0	0	0	0	120.7	K748	T235-K748 WeakPolarHBondContact OG1-CE 3.37Å; T235-K748 PolarHBondContact OG1-NZ 3.23Å
236	S	24.6	Very low	23.1	Very low	93 Å²	93	115.3 Å²	115.3	65%	0.65	62%	0.621	S	S	*	*			cis	-160.4	147.9	24.1	56.9	0	0	0	0	117.8
237	F	21.5	Very low	22.9	Very low	176 Å²	176	117.7 Å²	117.7	77%	0.772	63%	0.627	S	S	*	*			trans	60.4	156.6	150.6	-64.6	-53.9	0	0	0	121.6	Y239	F237-Y239 HydrophobicContact CD1-CE2 4.44Å; F237-Y239 HydrophobicContact CE1-CE2 4.16Å
238	C	22.1	Very low	22.8	Very low	126 Å²	126	116.7 Å²	116.7	85%	0.851	64%	0.635	S	S	*	*			cis	-127	175.9	21.5	-86.1	0	0	0	0	116.8
239	Y	21.7	Very low	22.8	Very low	195 Å²	195	121.8 Å²	121.8	77%	0.765	66%	0.655	S	S	*	*			trans	-74.2	156.7	173.4	-79	-105.7	0	0	0	112.6	F237	F237-Y239 HydrophobicContact CD1-CE2 4.44Å; F237-Y239 HydrophobicContact CE1-CE2 4.16Å
240	D	21.7	Very low	23	Very low	161 Å²	161	123.1 Å²	123.1	86%	0.861	66%	0.66	S	S	*	*				-168.7	167.8	78.9	-107.6	-33.8	0	0	0	114.8
241	H	22.1	Very low	23.3	Very low	164 Å²	164	122.3 Å²	122.3	76%	0.759	66%	0.655	S	S	*	*			trans	-91.1	164.8	177.2	-115.7	-30.7	0	0	0	112.1
242	P	27.1	Very low	24.1	Very low	119 Å²	119	121.8 Å²	121.8	77%	0.773	65%	0.654	S	S	*	*				-150.8	-162.1	58.2	42.5	-19.9	0	0	0	116.8
243	L	20.8	Very low	25.2	Very low	144 Å²	144	122.1 Å²	122.1	75%	0.754	65%	0.646	S	S	*	*			trans	-84.7	165.3	-168.4	-64.8	160.6	0	0	0	115.9
244	K	21.3	Very low	26.7	Very low	194 Å²	194	123.3 Å²	123.3	84%	0.843	65%	0.652	S	S	*	*			trans	72.8	147	172.4	-50.5	175.7	-179.4	172.7	0	113.4
245	T	21.5	Very low	28.5	Very low	119 Å²	119	126.2 Å²	126.2	73%	0.73	67%	0.666	S	S	*	*			cis	-153.3	141.1	12.4	-26.9	0	0	0	0	110
246	F	23.8	Very low	30.5	Very low	210 Å²	210	122.4 Å²	122.4	92%	0.921	64%	0.641	S	S	*	*			trans	177.4	98.8	140.4	-101.8	-62.6	0	0	0	111.4
247	I	22.1	Very low	32.7	Very low	118 Å²	118	119.3 Å²	119.3	61%	0.605	62%	0.617	S	S	*	*			trans	-141.9	135.3	160.3	-38.3	177.4	0	0	0	108.2	S251	I247-S251 VanDerWaalsContact CG2-OG 3.29Å; I247-S251 WeakPolarHBondContact CG2-OG 3.32Å
248	P	21.2	Very low	34.9	Very low	93 Å²	93	113.2 Å²	113.2	60%	0.604	60%	0.596	S	S	*	*			trans	-64.8	158.4	177.5	-22.8	34.5	0	0	0	113.5	T250 S251	P248-T250 PolarHBondContact O-N 3.21Å; P248-S251 PolarHBondContact O-N 3.29Å; P248-S251 VanDerWaalsContact O-N 3.15Å; P248-S251 PolarHBondContact O-OG 2.83Å
249	L	22.2	Very low	37.3	Very low	184 Å²	184	110.2 Å²	110.2	96%	0.963	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	26.1	179.7	-76.3	85.4	0	0	0	114.9
250	T	27.4	Very low	40.2	Very low	99 Å²	99	101.3 Å²	101.3	61%	0.607	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-29.5	164.8	52.5	0	0	0	0	112.1	P248 S252 Y253	P248-T250 PolarHBondContact O-N 3.21Å; T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 3.08Å; T250-S252 VanDerWaalsContact O-N 3.15Å; T250-Y253 PolarHBondContact O-N 2.8Å
251	S	30.8	Very low	43.1	Very low	23 Å²	23	93.7 Å²	93.7	16%	0.161	50%	0.496	C	S	.	.	H	α-helix	trans	-63.4	-21.6	-168.5	53.9	0	0	0	0	116.8	I247 P248 Y253 D254 N255	I247-S251 VanDerWaalsContact CG2-OG 3.29Å; I247-S251 WeakPolarHBondContact CG2-OG 3.32Å; P248-S251 PolarHBondContact O-N 3.29Å; P248-S251 VanDerWaalsContact O-N 3.15Å; P248-S251 PolarHBondContact O-OG 2.83Å; S251-Y253 PolarHBondContact O-N 3.28Å; S251-Y253 VanDerWaalsContact O-N 3.16Å; S251-D254 PolarHBondContact O-N 2.96Å; S251-N255 PolarHBondContact O-N 3.35Å
252	S	42.7	Very low	45.9	Very low	58 Å²	58	89.7 Å²	89.7	41%	0.406	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-19	177.2	-176.9	0	0	0	0	113	T250 S355	T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 3.08Å; T250-S252 VanDerWaalsContact O-N 3.15Å; S252-S355 PolarHBondContact OG-OG 2.8Å; S252-S355 VanDerWaalsContact OG-OG 3.13Å
253	Y	46	Very low	48.4	Very low	96 Å²	96	87.9 Å²	87.9	38%	0.376	47%	0.465	S	S	.	.	H	α-helix	trans	-87.2	-48.3	176.3	-178.5	-92.1	0	0	0	111.6	T250 S251 N255 L256 L257 Q271	T250-Y253 PolarHBondContact O-N 2.8Å; S251-Y253 PolarHBondContact O-N 3.28Å; S251-Y253 VanDerWaalsContact O-N 3.16Å; Y253-N255 PolarHBondContact O-N 3.47Å; Y253-L256 WeakPolarHBondContact O-CB 3.46Å; Y253-L256 PolarHBondContact O-N 3.36Å; Y253-L256 VanDerWaalsContact O-N 3.16Å; Y253-L257 HydrophobicContact CE1-CD2 4.33Å; Y253-L257 PolarHBondContact O-N 3.42Å; Y253-L257 VanDerWaalsContact O-N 3.13Å; Y253-Q271 PolarHBondContact OH-NE2 3.42Å
254	D	53.3	Low	51.5	Low	84 Å²	84	81.3 Å²	81.3	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-42.3	-174.4	-51	-40.8	0	0	0	111.4	S251 L256 L257 C258	S251-D254 PolarHBondContact O-N 2.96Å; D254-L256 VanDerWaalsContact C-N 3.29Å; D254-L256 PolarHBondContact O-N 3.17Å; D254-L257 PolarHBondContact O-N 3.29Å; D254-L257 VanDerWaalsContact O-N 3.15Å; D254-C258 PolarHBondContact O-N 3.17Å; D254-C258 PolarHBondContact O-SG 3.11Å; D254-C258 VanDerWaalsContact O-SG 3.41Å
255	N	61.8	Low	54.7	Low	91 Å²	91	74.8 Å²	74.8	49%	0.487	41%	0.406	S	S	.	.	H	α-helix	trans	-60.7	-37.4	175.2	-70.7	0.9	0	0	0	112.4	S251 Y253 L257 N259	S251-N255 PolarHBondContact O-N 3.35Å; Y253-N255 PolarHBondContact O-N 3.47Å; N255-L257 VanDerWaalsContact C-N 3.33Å; N255-N259 WeakPolarHBondContact O-CB 3.49Å; N255-N259 PolarHBondContact O-N 2.64Å; N255-N259 PolarHBondContact O-OD1 2.65Å; N255-N259 VanDerWaalsContact O-OD1 3.1Å
256	L	65.3	Low	58.1	Low	23 Å²	23	72.2 Å²	72.2	12%	0.12	39%	0.385	C	S	.	.	H	α-helix	trans	-66.8	-36	177.5	-110.9	168.2	0	0	0	111.7	Y253 D254 L260 W352 R356	Y253-L256 WeakPolarHBondContact O-CB 3.46Å; Y253-L256 PolarHBondContact O-N 3.36Å; Y253-L256 VanDerWaalsContact O-N 3.16Å; D254-L256 VanDerWaalsContact C-N 3.29Å; D254-L256 PolarHBondContact O-N 3.17Å; L256-L260 WeakPolarHBondContact O-CB 3.4Å; L256-L260 PolarHBondContact O-N 3.27Å; L256-L260 VanDerWaalsContact O-N 3.16Å; L256-W352 HydrophobicContact CD2-CB 4.15Å; L256-R356 HydrophobicContact CD1-CG 4.32Å
257	L	70.4	Confident	61.4	Low	28 Å²	28	62.6 Å²	62.6	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-74.2	-43.8	177.3	-160	67	0	0	0	111.3	Y253 D254 N255 N259 L260 T261 Y431	Y253-L257 HydrophobicContact CE1-CD2 4.33Å; Y253-L257 PolarHBondContact O-N 3.42Å; Y253-L257 VanDerWaalsContact O-N 3.13Å; D254-L257 PolarHBondContact O-N 3.29Å; D254-L257 VanDerWaalsContact O-N 3.15Å; N255-L257 VanDerWaalsContact C-N 3.33Å; L257-N259 PolarHBondContact O-N 2.89Å; L257-L260 WeakPolarHBondContact O-CB 3.45Å; L257-L260 PolarHBondContact O-N 2.96Å; L257-L260 VanDerWaalsContact O-N 3.16Å; L257-T261 WeakPolarHBondContact O-CG2 3.49Å; L257-T261 PolarHBondContact O-N 3.37Å; L257-Y431 HydrophobicContact CD1-CD1 3.87Å; L257-Y431 HydrophobicContact CD1-CE1 3.52Å; L257-Y431 HydrophobicContact CD1-CE2 4.24Å; L257-Y431 HydrophobicContact CD1-CG 4.37Å; L257-Y431 HydrophobicContact CD2-CE2 4.23Å; L257-Y431 HydrophobicContact CG-CE1 4.05Å
258	C	67.6	Low	64.9	Low	48 Å²	48	57.1 Å²	57.1	32%	0.324	32%	0.316	S	S	.	.	H	α-helix	trans	-57	-50	173.5	-69.5	0	0	0	0	111.6	D254 L260 T261 E262	D254-C258 PolarHBondContact O-N 3.17Å; D254-C258 PolarHBondContact O-SG 3.11Å; D254-C258 VanDerWaalsContact O-SG 3.41Å; C258-L260 VanDerWaalsContact C-N 3.27Å; C258-L260 PolarHBondContact O-N 3.06Å; C258-T261 PolarHBondContact O-N 2.99Å; C258-T261 PolarHBondContact O-OG1 3.31Å; C258-E262 PolarHBondContact O-N 3Å
259	N	73.3	Confident	68.3	Low	64 Å²	64	52.7 Å²	52.7	34%	0.342	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-39.2	176.4	-71.4	15.2	0	0	0	111.9	N255 L257 E262 T263 W352	N255-N259 WeakPolarHBondContact O-CB 3.49Å; N255-N259 PolarHBondContact O-N 2.64Å; N255-N259 PolarHBondContact O-OD1 2.65Å; N255-N259 VanDerWaalsContact O-OD1 3.1Å; L257-N259 PolarHBondContact O-N 2.89Å; N259-E262 PolarHBondContact O-N 3.32Å; N259-T263 WeakPolarHBondContact O-CB 3.18Å; N259-T263 VanDerWaalsContact O-CG2 3.3Å; N259-T263 WeakPolarHBondContact O-CG2 3.4Å; N259-T263 PolarHBondContact O-N 3.23Å; N259-T263 PolarHBondContact O-OG1 3.2Å; N259-W352 WeakPolarHBondContact ND2-CZ3 3.26Å
260	L	81.8	Confident	71.8	Confident	7 Å²	7	44 Å²	44	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-45.6	173.9	175.9	57.6	0	0	0	111.7	L256 L257 C258 E262 T263 A264 A269 C274 T277 Y431	L256-L260 WeakPolarHBondContact O-CB 3.4Å; L256-L260 PolarHBondContact O-N 3.27Å; L256-L260 VanDerWaalsContact O-N 3.16Å; L257-L260 WeakPolarHBondContact O-CB 3.45Å; L257-L260 PolarHBondContact O-N 2.96Å; L257-L260 VanDerWaalsContact O-N 3.16Å; C258-L260 VanDerWaalsContact C-N 3.27Å; C258-L260 PolarHBondContact O-N 3.06Å; L260-E262 VanDerWaalsContact C-N 3.3Å; L260-E262 PolarHBondContact O-N 3.21Å; L260-T263 PolarHBondContact O-N 2.89Å; L260-A264 HydrophobicContact CD1-CB 4.4Å; L260-A264 WeakPolarHBondContact O-CB 3.3Å; L260-A264 PolarHBondContact O-N 2.95Å; L260-A269 HydrophobicContact CD1-CB 4.46Å; L260-A269 HydrophobicContact CD2-CB 4.07Å; L260-C274 HydrophobicContact CD2-CB 4.15Å; L260-T277 HydrophobicContact CD1-CG2 3.98Å; L260-Y431 HydrophobicContact CD2-CD1 4.32Å
261	T	81.9	Confident	74.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-35	177.5	64.2	0	0	0	0	112.9	L257 C258 Y431 I433 T584	L257-T261 WeakPolarHBondContact O-CG2 3.49Å; L257-T261 PolarHBondContact O-N 3.37Å; C258-T261 PolarHBondContact O-N 2.99Å; C258-T261 PolarHBondContact O-OG1 3.31Å; T261-Y431 HydrophobicContact CG2-CE1 4.04Å; T261-Y431 WeakPolarHBondContact CG2-OH 3.42Å; T261-I433 HydrophobicContact CG2-CG1 4.41Å; T261-I433 HydrophobicContact CG2-CG2 3.8Å; T261-T584 PolarHBondContact OG1-OG1 2.9Å
262	E	81	Confident	77.5	Confident	79 Å²	79	38.8 Å²	38.8	37%	0.369	21%	0.207	S	C	.	.	H	α-helix	trans	-80.5	-28.5	-179.6	-71.3	-179.9	-172.3	0	0	113.5	C258 N259 L260 R468 S582	C258-E262 PolarHBondContact O-N 3Å; N259-E262 PolarHBondContact O-N 3.32Å; L260-E262 VanDerWaalsContact C-N 3.3Å; L260-E262 PolarHBondContact O-N 3.21Å; E262-R468 PolarHBondContact O-NH1 2.81Å; E262-S582 WeakPolarHBondContact OE1-CB 3.28Å
263	T	80.4	Confident	79.8	Confident	82 Å²	82	36 Å²	36	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-94.1	-28.5	-179.4	56.5	0	0	0	0	114.2	N259 L260 K1135	N259-T263 WeakPolarHBondContact O-CB 3.18Å; N259-T263 VanDerWaalsContact O-CG2 3.3Å; N259-T263 WeakPolarHBondContact O-CG2 3.4Å; N259-T263 PolarHBondContact O-N 3.23Å; N259-T263 PolarHBondContact O-OG1 3.2Å; L260-T263 PolarHBondContact O-N 2.89Å; T263-K1135 WeakPolarHBondContact O-CE 3.46Å; T263-K1135 PolarHBondContact O-NZ 3.46Å
264	A	86.5	Confident	81.8	Confident	5 Å²	5	32.4 Å²	32.4	4%	0.041	18%	0.177	C	C	.	.			trans	-56.9	147.5	-175.5	0	0	0	0	0	114	L260 T277 I433 F461 R468	L260-A264 HydrophobicContact CD1-CB 4.4Å; L260-A264 WeakPolarHBondContact O-CB 3.3Å; L260-A264 PolarHBondContact O-N 2.95Å; A264-T277 HydrophobicContact CB-CG2 3.96Å; A264-I433 HydrophobicContact CB-CD1 3.45Å; A264-I433 VanDerWaalsContact CB-CD1 3.45Å; A264-F461 HydrophobicContact CB-CZ 4.48Å; A264-R468 PolarHBondContact O-NH1 3.17Å; A264-R468 PolarHBondContact O-NH2 3.02Å
265	N	87.5	Confident	83.4	Confident	58 Å²	58	32 Å²	32	31%	0.31	18%	0.177	S	C	.	.	S	Bend	trans	-101.2	-16.8	172.9	-74.6	-12.7	0	0	0	113.1	R468 N469 K1135	N265-R468 PolarHBondContact OD1-NH2 3.08Å; N265-N469 PolarHBondContact OD1-ND2 3.41Å; N265-N469 VanDerWaalsContact OD1-ND2 3.07Å; N265-K1135 PolarHBondContact OD1-NZ 3.03Å
266	H	93.2	Very high	84.8	Confident	65 Å²	65	30.5 Å²	30.5	30%	0.301	17%	0.166	S	C	.	.	S	Bend	trans	-131.4	152.9	-174.9	-55.5	-87.9	0	0	0	111.4	L268 T278 D279 I433	H266-L268 PolarHBondContact O-N 3.25Å; H266-T278 WeakPolarHBondContact CB-O 3.45Å; H266-D279 IonicContact ND1-OD2 2.65Å; H266-I433 WeakPolarHBondContact O-CD1 3.37Å
267	P	92.2	Very high	86.2	Confident	7 Å²	7	30.8 Å²	30.8	5%	0.045	17%	0.169	C	C	.	.	S	Bend	trans	-76.9	-19.5	-168.6	29.7	-37.1	0	0	0	114.7	C432 I433 A434 V458 F461	P267-C432 CarbonylContact O-C 3.34Å; P267-C432 WeakPolarHBondContact O-CA 3.24Å; P267-I433 PolarHBondContact O-N 3.39Å; P267-A434 HydrophobicContact CB-CB 3.96Å; P267-V458 HydrophobicContact CB-CG2 3.91Å; P267-V458 HydrophobicContact CG-CG1 4.06Å; P267-V458 HydrophobicContact CG-CG2 4.05Å; P267-F461 HydrophobicContact CB-CD1 3.8Å; P267-F461 HydrophobicContact CB-CE1 4.05Å; P267-F461 HydrophobicContact CB-CG 4.42Å; P267-F461 HydrophobicContact CG-CD1 4.49Å
268	L	95.4	Very high	87.3	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	137.2	179	-40.5	177.2	0	0	0	109.6	H266 T277 T278 L281 L284 C432 F445	H266-L268 PolarHBondContact O-N 3.25Å; L268-T277 CarbonylContact O-C 3.49Å; L268-T277 VanDerWaalsContact O-CA 3.24Å; L268-T277 WeakPolarHBondContact O-CA 3.33Å; L268-T278 WeakPolarHBondContact CA-O 3.25Å; L268-T278 VanDerWaalsContact CB-O 3.23Å; L268-T278 WeakPolarHBondContact CB-O 3.34Å; L268-T278 PolarHBondContact N-O 2.99Å; L268-T278 VanDerWaalsContact N-O 3.12Å; L268-T278 PolarHBondContact O-N 3.17Å; L268-T278 VanDerWaalsContact O-O 3.1Å; L268-L281 HydrophobicContact CD1-CB 3.96Å; L268-L281 HydrophobicContact CD1-CD1 4.37Å; L268-L284 HydrophobicContact CB-CD2 3.72Å; L268-C432 HydrophobicContact CD2-CB 4.39Å; L268-F445 HydrophobicContact CB-CE1 4.45Å; L268-F445 HydrophobicContact CD2-CE1 4.14Å; L268-F445 HydrophobicContact CD2-CZ 4.01Å
269	A	93.7	Very high	88.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151	-174.5	0	0	0	0	0	113.3	L260 Q271 F276 T277 Y431 I433	L260-A269 HydrophobicContact CD1-CB 4.46Å; L260-A269 HydrophobicContact CD2-CB 4.07Å; A269-Q271 PolarHBondContact O-N 3.48Å; A269-F276 WeakPolarHBondContact CA-O 3.35Å; A269-T277 HydrophobicContact CB-CG2 3.89Å; A269-Y431 HydrophobicContact CB-CD1 4.41Å; A269-Y431 PolarHBondContact N-O 2.82Å; A269-Y431 PolarHBondContact O-N 2.83Å; A269-I433 HydrophobicContact CB-CD1 3.75Å; A269-I433 HydrophobicContact CB-CG1 4.25Å
270	C	94.6	Very high	89.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	111.8	172.2	179.4	0	0	0	0	110.4	V272 C273 C274 F276 L284 V288 H345	C270-V272 PolarHBondContact O-N 3.2Å; C270-C273 VanDerWaalsContact CB-SG 3.52Å; C270-C274 WeakPolarHBondContact O-CA 3.38Å; C270-C274 PolarHBondContact O-N 2.69Å; C270-F276 HydrophobicContact CB-CB 4.05Å; C270-F276 PolarHBondContact N-O 2.79Å; C270-L284 HydrophobicContact CB-CD1 3.85Å; C270-V288 HydrophobicContact CB-CG2 4.19Å; C270-H345 PolarHBondContact SG-CE1 3.28Å; C270-H345 PolarHBondContact SG-NE2 2.79Å; C270-H345 VanDerWaalsContact SG-NE2 3.44Å
271	Q	88.9	Confident	89.8	Confident	13 Å²	13	34.7 Å²	34.7	6%	0.061	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-14.1	-179.3	-174.2	-176.8	8.9	0	0	112.7	Y253 A269 C274 R356 Q429	Y253-Q271 PolarHBondContact OH-NE2 3.42Å; A269-Q271 PolarHBondContact O-N 3.48Å; Q271-C274 PolarHBondContact O-SG 2.99Å; Q271-C274 VanDerWaalsContact O-SG 3.39Å; Q271-R356 PolarHBondContact O-NH1 2.96Å; Q271-R356 PolarHBondContact O-NH2 2.97Å; Q271-Q429 HydrophobicContact CB-CB 3.74Å; Q271-Q429 HydrophobicContact CG-CB 4.14Å; Q271-Q429 PolarHBondContact N-O 3.34Å
272	V	89.2	Confident	90.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-56	177.7	-170.7	0	0	0	0	111.2	C270 F342 H345 V346 N353 R356 S427 Q429	C270-V272 PolarHBondContact O-N 3.2Å; V272-F342 HydrophobicContact CG1-CD2 3.83Å; V272-F342 HydrophobicContact CG1-CE2 3.61Å; V272-F342 HydrophobicContact CG1-CZ 4.35Å; V272-F342 HydrophobicContact CG2-CE2 4.22Å; V272-H345 HydrophobicContact CG1-CB 3.77Å; V272-H345 WeakPolarHBondContact CG1-ND1 3.45Å; V272-V346 HydrophobicContact CG1-CG2 3.73Å; V272-N353 PolarHBondContact O-ND2 3.44Å; V272-R356 PolarHBondContact O-NH1 2.53Å; V272-R356 VanDerWaalsContact O-NH1 3.13Å; V272-R356 PolarHBondContact O-NH2 3.29Å; V272-S427 WeakPolarHBondContact CG2-O 3.29Å; V272-Q429 HydrophobicContact CG2-CB 3.77Å; V272-Q429 HydrophobicContact CG2-CG 3.98Å
273	C	91.7	Very high	91	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-30.4	177.9	60.1	0	0	0	0	113.2	C270 T275 F276 H287 H345 E348 G349 N353	C270-C273 VanDerWaalsContact CB-SG 3.52Å; C273-T275 PolarHBondContact O-N 2.97Å; C273-F276 PolarHBondContact SG-N 2.88Å; C273-H287 PolarHBondContact SG-NE2 2.73Å; C273-H345 WeakPolarHBondContact CA-O 3.34Å; C273-H345 VanDerWaalsContact CB-O 3.28Å; C273-H345 WeakPolarHBondContact CB-O 3.45Å; C273-E348 HydrophobicContact CB-CB 4.26Å; C273-G349 WeakPolarHBondContact O-CA 3.26Å; C273-N353 PolarHBondContact O-ND2 3.44Å
274	C	87.9	Confident	91.6	Very high	21 Å²	21	33.9 Å²	33.9	14%	0.142	18%	0.184	C	C	.	.	S	Bend	trans	57.3	17.3	-171.1	-62.8	0	0	0	0	115.8	L260 C270 Q271 R356	L260-C274 HydrophobicContact CD2-CB 4.15Å; C270-C274 WeakPolarHBondContact O-CA 3.38Å; C270-C274 PolarHBondContact O-N 2.69Å; Q271-C274 PolarHBondContact O-SG 2.99Å; Q271-C274 VanDerWaalsContact O-SG 3.39Å; C274-R356 PolarHBondContact SG-NH1 3.46Å
275	T	86.6	Confident	91.9	Very high	75 Å²	75	34.2 Å²	34.2	46%	0.46	19%	0.186	S	C	.	.			trans	-116.1	-30.6	173.5	43.3	0	0	0	0	113.2	C273 E348	C273-T275 PolarHBondContact O-N 2.97Å; T275-E348 PolarHBondContact OG1-O 3.11Å
276	F	92.6	Very high	92.1	Very high	59 Å²	59	36.3 Å²	36.3	26%	0.259	19%	0.193	S	C	.	.			trans	-81.9	122.7	178.5	-168.5	-95.4	0	0	0	112.1	A269 C270 C273 T278 V283 L284 H287	A269-F276 WeakPolarHBondContact CA-O 3.35Å; C270-F276 HydrophobicContact CB-CB 4.05Å; C270-F276 PolarHBondContact N-O 2.79Å; C273-F276 PolarHBondContact SG-N 2.88Å; F276-T278 HydrophobicContact CE1-CG2 3.75Å; F276-T278 HydrophobicContact CZ-CG2 4.42Å; F276-V283 HydrophobicContact CE1-CG1 4.5Å; F276-V283 HydrophobicContact CZ-CG1 3.97Å; F276-L284 HydrophobicContact CD1-CD1 3.89Å; F276-L284 HydrophobicContact CE1-CD1 4.22Å; F276-H287 WeakPolarHBondContact CB-CE1 3.24Å; F276-H287 HydrophobicContact CD1-CB 3.83Å; F276-H287 AromaticContact CD1-CD2 3.79Å; F276-H287 AromaticContact CD1-CG 3.49Å; F276-H287 VanDerWaalsContact CD1-CG 3.49Å; F276-H287 AromaticContact CD1-ND1 3.74Å; F276-H287 AromaticContact CD2-CE1 3.74Å; F276-H287 AromaticContact CD2-CG 4Å; F276-H287 AromaticContact CD2-ND1 3.37Å; F276-H287 WeakPolarHBondContact CD2-ND1 3.32Å; F276-H287 HydrophobicContact CE1-CB 3.64Å; F276-H287 AromaticContact CE1-CG 3.82Å; F276-H287 HydrophobicContact CE2-CB 4.47Å; F276-H287 AromaticContact CE2-ND1 3.82Å; F276-H287 HydrophobicContact CG-CB 4.33Å; F276-H287 AromaticContact CG-CD2 3.87Å; F276-H287 AromaticContact CG-CE1 3.48Å; F276-H287 VanDerWaalsContact CG-CE1 3.48Å; F276-H287 WeakPolarHBondContact CG-CE1 3.37Å; F276-H287 AromaticContact CG-CG 3.59Å; F276-H287 AromaticContact CG-ND1 3.32Å; F276-H287 VanDerWaalsContact CG-ND1 3.32Å; F276-H287 WeakPolarHBondContact CG-ND1 3.19Å; F276-H287 AromaticContact CG-NE2 3.84Å; F276-H287 HydrophobicContact CZ-CB 3.99Å
277	T	93.7	Very high	92.1	Very high	30 Å²	30	34.5 Å²	34.5	18%	0.184	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	145.9	173.9	70.9	0	0	0	0	110.1	L260 A264 L268 A269	L260-T277 HydrophobicContact CD1-CG2 3.98Å; A264-T277 HydrophobicContact CB-CG2 3.96Å; L268-T277 CarbonylContact O-C 3.49Å; L268-T277 VanDerWaalsContact O-CA 3.24Å; L268-T277 WeakPolarHBondContact O-CA 3.33Å; A269-T277 HydrophobicContact CB-CG2 3.89Å
278	T	93.4	Very high	92.1	Very high	14 Å²	14	34.5 Å²	34.5	9%	0.086	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	158.8	178.6	-179.9	0	0	0	0	110.4	H266 L268 F276 N280 L284	H266-T278 WeakPolarHBondContact CB-O 3.45Å; L268-T278 WeakPolarHBondContact CA-O 3.25Å; L268-T278 VanDerWaalsContact CB-O 3.23Å; L268-T278 WeakPolarHBondContact CB-O 3.34Å; L268-T278 PolarHBondContact N-O 2.99Å; L268-T278 VanDerWaalsContact N-O 3.12Å; L268-T278 PolarHBondContact O-N 3.17Å; L268-T278 VanDerWaalsContact O-O 3.1Å; F276-T278 HydrophobicContact CE1-CG2 3.75Å; F276-T278 HydrophobicContact CZ-CG2 4.42Å; T278-N280 VanDerWaalsContact CG2-O 3.25Å; T278-N280 WeakPolarHBondContact CG2-O 3.36Å; T278-N280 PolarHBondContact OG1-N 2.8Å; T278-N280 VanDerWaalsContact OG1-N 3.11Å; T278-L284 HydrophobicContact CG2-CB 3.68Å
279	D	92	Very high	91.8	Very high	111 Å²	111	40.1 Å²	40.1	59%	0.594	21%	0.211	S	C	*	.	S	Bend	trans	-85.9	-24.2	169.3	48.5	3.7	0	0	0	112.1	H266	H266-D279 IonicContact ND1-OD2 2.65Å
280	N	91.7	Very high	91.5	Very high	76 Å²	76	46.1 Å²	46.1	41%	0.406	23%	0.234	S	C	.	.			trans	-89.1	114.9	179.8	-171.8	-33.6	0	0	0	112	T278 D282 V283 L284	T278-N280 VanDerWaalsContact CG2-O 3.25Å; T278-N280 WeakPolarHBondContact CG2-O 3.36Å; T278-N280 PolarHBondContact OG1-N 2.8Å; T278-N280 VanDerWaalsContact OG1-N 3.11Å; N280-D282 PolarHBondContact O-N 2.85Å; N280-D282 PolarHBondContact OD1-N 3.29Å; N280-V283 HydrophobicContact CB-CB 4.09Å; N280-V283 HydrophobicContact CB-CG2 3.85Å; N280-V283 PolarHBondContact O-N 3.42Å; N280-V283 PolarHBondContact OD1-N 3.28Å; N280-L284 PolarHBondContact O-N 3.05Å; N280-L284 VanDerWaalsContact O-N 3.17Å
281	L	91.6	Very high	90.9	Very high	28 Å²	28	51.4 Å²	51.4	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-41.6	179.9	174.7	56.9	0	0	0	113.9	L268 L284 I285 F445 R446 C449	L268-L281 HydrophobicContact CD1-CB 3.96Å; L268-L281 HydrophobicContact CD1-CD1 4.37Å; L281-L284 PolarHBondContact O-N 3.33Å; L281-I285 HydrophobicContact CD1-CD1 4.02Å; L281-I285 HydrophobicContact CD1-CG1 4.43Å; L281-I285 HydrophobicContact CG-CD1 4.02Å; L281-I285 WeakPolarHBondContact O-CD1 3.25Å; L281-I285 VanDerWaalsContact O-CG1 3.32Å; L281-I285 WeakPolarHBondContact O-CG1 3.35Å; L281-I285 PolarHBondContact O-N 2.93Å; L281-I285 VanDerWaalsContact O-N 3.08Å; L281-F445 HydrophobicContact CD1-CD1 3.4Å; L281-F445 HydrophobicContact CD1-CE1 3.86Å; L281-F445 HydrophobicContact CD1-CG 4.44Å; L281-R446 HydrophobicContact CD2-CB 4.38Å; L281-R446 HydrophobicContact CD2-CG 3.64Å; L281-R446 HydrophobicContact CG-CG 4.43Å; L281-C449 HydrophobicContact CD2-CB 4.01Å
282	D	93.2	Very high	90.9	Very high	86 Å²	86	52 Å²	52	46%	0.46	26%	0.264	S	S	.	.	H	α-helix	trans	-76.1	-30.8	-175.8	-67.8	-49.2	0	0	0	111.9	N280 L284 I285 E286 R446	N280-D282 PolarHBondContact O-N 2.85Å; N280-D282 PolarHBondContact OD1-N 3.29Å; D282-L284 VanDerWaalsContact C-N 3.34Å; D282-I285 PolarHBondContact O-N 3.4Å; D282-E286 PolarHBondContact O-N 3.16Å; D282-R446 IonicContact OD1-CZ 2.65Å; D282-R446 IonicContact OD1-NE 2.64Å; D282-R446 IonicContact OD1-NH2 3.7Å; D282-R446 PolarHBondContact OD1-NH2 2.65Å
283	V	94.2	Very high	90.4	Very high	59 Å²	59	54 Å²	54	36%	0.358	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-36.8	170.6	178.5	0	0	0	0	111.2	F276 N280 H287	F276-V283 HydrophobicContact CE1-CG1 4.5Å; F276-V283 HydrophobicContact CZ-CG1 3.97Å; N280-V283 HydrophobicContact CB-CB 4.09Å; N280-V283 HydrophobicContact CB-CG2 3.85Å; N280-V283 PolarHBondContact O-N 3.42Å; N280-V283 PolarHBondContact OD1-N 3.28Å; V283-H287 WeakPolarHBondContact O-CB 3.14Å; V283-H287 PolarHBondContact O-N 2.94Å
284	L	94.2	Very high	89.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-39.8	172	-179.7	60.1	0	0	0	112	L268 C270 F276 T278 N280 L281 D282 H287 V288 L430 F445	L268-L284 HydrophobicContact CB-CD2 3.72Å; C270-L284 HydrophobicContact CB-CD1 3.85Å; F276-L284 HydrophobicContact CD1-CD1 3.89Å; F276-L284 HydrophobicContact CE1-CD1 4.22Å; T278-L284 HydrophobicContact CG2-CB 3.68Å; N280-L284 PolarHBondContact O-N 3.05Å; N280-L284 VanDerWaalsContact O-N 3.17Å; L281-L284 PolarHBondContact O-N 3.33Å; D282-L284 VanDerWaalsContact C-N 3.34Å; L284-H287 PolarHBondContact O-N 3.4Å; L284-V288 HydrophobicContact CD1-CG2 4.16Å; L284-V288 VanDerWaalsContact O-CG2 3.32Å; L284-V288 WeakPolarHBondContact O-CG2 3.41Å; L284-V288 PolarHBondContact O-N 2.79Å; L284-L430 HydrophobicContact CD1-CD2 4.49Å; L284-L430 HydrophobicContact CD2-CD2 3.83Å; L284-L430 HydrophobicContact CG-CD2 3.75Å; L284-F445 HydrophobicContact CD2-CE1 3.89Å
285	I	92.9	Very high	87.8	Confident	13 Å²	13	64.5 Å²	64.5	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-46.4	177	-66.2	159.4	0	0	0	110	L281 D282 H287 V288 E289 V442	L281-I285 HydrophobicContact CD1-CD1 4.02Å; L281-I285 HydrophobicContact CD1-CG1 4.43Å; L281-I285 HydrophobicContact CG-CD1 4.02Å; L281-I285 WeakPolarHBondContact O-CD1 3.25Å; L281-I285 VanDerWaalsContact O-CG1 3.32Å; L281-I285 WeakPolarHBondContact O-CG1 3.35Å; L281-I285 PolarHBondContact O-N 2.93Å; L281-I285 VanDerWaalsContact O-N 3.08Å; D282-I285 PolarHBondContact O-N 3.4Å; I285-H287 PolarHBondContact O-N 3.01Å; I285-V288 PolarHBondContact O-N 2.82Å; I285-V288 VanDerWaalsContact O-N 3.1Å; I285-E289 HydrophobicContact CG2-CG 4.34Å; I285-E289 PolarHBondContact O-N 2.86Å; I285-V442 HydrophobicContact CD1-CG1 3.5Å; I285-V442 HydrophobicContact CG1-CG1 3.86Å; I285-V442 HydrophobicContact CG2-CG1 4.24Å; I285-V442 HydrophobicContact CG2-CG2 4.41Å
286	E	92.1	Very high	86.4	Confident	101 Å²	101	66.7 Å²	66.7	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-57.6	-47	175.6	-166.7	-162	139	0	0	111.5	D282 V288 E289 R290	D282-E286 PolarHBondContact O-N 3.16Å; E286-V288 VanDerWaalsContact C-N 3.28Å; E286-V288 PolarHBondContact O-N 2.79Å; E286-E289 PolarHBondContact O-N 3.33Å; E286-R290 WeakPolarHBondContact O-CB 3.46Å; E286-R290 PolarHBondContact O-N 3.07Å
287	H	93	Very high	85	Confident	27 Å²	27	65.4 Å²	65.4	13%	0.125	33%	0.328	C	S	.	.	H	α-helix	trans	-57.5	-39.8	175.6	173.2	94.4	0	0	0	112.2	C273 F276 V283 L284 I285 R292 H345	C273-H287 PolarHBondContact SG-NE2 2.73Å; F276-H287 WeakPolarHBondContact CB-CE1 3.24Å; F276-H287 HydrophobicContact CD1-CB 3.83Å; F276-H287 AromaticContact CD1-CD2 3.79Å; F276-H287 AromaticContact CD1-CG 3.49Å; F276-H287 VanDerWaalsContact CD1-CG 3.49Å; F276-H287 AromaticContact CD1-ND1 3.74Å; F276-H287 AromaticContact CD2-CE1 3.74Å; F276-H287 AromaticContact CD2-CG 4Å; F276-H287 AromaticContact CD2-ND1 3.37Å; F276-H287 WeakPolarHBondContact CD2-ND1 3.32Å; F276-H287 HydrophobicContact CE1-CB 3.64Å; F276-H287 AromaticContact CE1-CG 3.82Å; F276-H287 HydrophobicContact CE2-CB 4.47Å; F276-H287 AromaticContact CE2-ND1 3.82Å; F276-H287 HydrophobicContact CG-CB 4.33Å; F276-H287 AromaticContact CG-CD2 3.87Å; F276-H287 AromaticContact CG-CE1 3.48Å; F276-H287 VanDerWaalsContact CG-CE1 3.48Å; F276-H287 WeakPolarHBondContact CG-CE1 3.37Å; F276-H287 AromaticContact CG-CG 3.59Å; F276-H287 AromaticContact CG-ND1 3.32Å; F276-H287 VanDerWaalsContact CG-ND1 3.32Å; F276-H287 WeakPolarHBondContact CG-ND1 3.19Å; F276-H287 AromaticContact CG-NE2 3.84Å; F276-H287 HydrophobicContact CZ-CB 3.99Å; V283-H287 WeakPolarHBondContact O-CB 3.14Å; V283-H287 PolarHBondContact O-N 2.94Å; L284-H287 PolarHBondContact O-N 3.4Å; I285-H287 PolarHBondContact O-N 3.01Å; H287-R292 PolarHBondContact CE1-NH2 3.4Å; H287-R292 VanDerWaalsContact CE1-NH2 3.34Å; H287-R292 PolarHBondContact ND1-NH2 2.97Å; H287-R292 PolarHBondContact O-NH2 2.9Å; H287-H345 AromaticContact CD2-NE2 3.54Å; H287-H345 AromaticContact CE1-NE2 3.84Å; H287-H345 AromaticContact NE2-CD2 3.88Å; H287-H345 AromaticContact NE2-CE1 3.84Å; H287-H345 AromaticContact NE2-NE2 2.91Å; H287-H345 PolarHBondContact NE2-NE2 2.92Å
288	V	90.7	Very high	83.3	Confident	8 Å²	8	68.1 Å²	68.1	5%	0.048	34%	0.342	C	S	.	.	H	α-helix	trans	-80.5	-28.3	-177.1	175.3	0	0	0	0	112.9	C270 L284 I285 E286 I428 L430	C270-V288 HydrophobicContact CB-CG2 4.19Å; L284-V288 HydrophobicContact CD1-CG2 4.16Å; L284-V288 VanDerWaalsContact O-CG2 3.32Å; L284-V288 WeakPolarHBondContact O-CG2 3.41Å; L284-V288 PolarHBondContact O-N 2.79Å; I285-V288 PolarHBondContact O-N 2.82Å; I285-V288 VanDerWaalsContact O-N 3.1Å; E286-V288 VanDerWaalsContact C-N 3.28Å; E286-V288 PolarHBondContact O-N 2.79Å; V288-I428 HydrophobicContact CG1-CB 4.05Å; V288-I428 HydrophobicContact CG1-CG1 4.1Å; V288-I428 HydrophobicContact CG1-CG2 3.86Å; V288-L430 HydrophobicContact CB-CD2 4.4Å; V288-L430 HydrophobicContact CG2-CD2 3.95Å
289	E	88.9	Confident	81.4	Confident	121 Å²	121	73.9 Å²	73.9	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-90.6	-10.3	177.9	-63.9	-168.8	167.8	0	0	113.8	I285 E286 N291 I428	I285-E289 HydrophobicContact CG2-CG 4.34Å; I285-E289 PolarHBondContact O-N 2.86Å; E286-E289 PolarHBondContact O-N 3.33Å; E289-N291 PolarHBondContact O-N 3.12Å; E289-I428 HydrophobicContact CG-CD1 4.31Å
290	R	88.4	Confident	80	Confident	126 Å²	126	70.1 Å²	70.1	48%	0.475	34%	0.344	S	S	.	.			trans	-52.9	125.1	175.6	-172.5	172.5	-179.3	129.5	-7.5	112.2	E286 R292	E286-R290 WeakPolarHBondContact O-CB 3.46Å; E286-R290 PolarHBondContact O-N 3.07Å; R290-R292 PolarHBondContact O-N 3.33Å
291	N	82.5	Confident	78.8	Confident	111 Å²	111	67.2 Å²	67.2	59%	0.594	33%	0.329	S	S	*	.			trans	-70.9	121.7	176.6	-179.1	9.4	0	0	0	111.1	E289 V293	E289-N291 PolarHBondContact O-N 3.12Å; N291-V293 WeakPolarHBondContact OD1-CG2 3.37Å; N291-V293 PolarHBondContact OD1-N 3.1Å
292	R	87.5	Confident	77.5	Confident	26 Å²	26	71.3 Å²	71.3	10%	0.098	35%	0.351	C	S	.	.			trans	-115	16.6	-175.1	-63	157.7	-169.5	-66.9	7.8	113.2	H287 R290 P294 S341 V344 H345 E348	H287-R292 PolarHBondContact CE1-NH2 3.4Å; H287-R292 VanDerWaalsContact CE1-NH2 3.34Å; H287-R292 PolarHBondContact ND1-NH2 2.97Å; H287-R292 PolarHBondContact O-NH2 2.9Å; R290-R292 PolarHBondContact O-N 3.33Å; R292-P294 WeakPolarHBondContact O-CD 3.42Å; R292-S341 WeakPolarHBondContact CB-OG 3.33Å; R292-S341 PolarHBondContact N-OG 3.48Å; R292-S341 VanDerWaalsContact N-OG 3.1Å; R292-V344 HydrophobicContact CB-CB 4.22Å; R292-V344 HydrophobicContact CB-CG1 3.97Å; R292-H345 PolarHBondContact NE-CD2 2.95Å; R292-H345 PolarHBondContact NH2-NE2 3.03Å; R292-E348 VanDerWaalsContact CD-OE1 3.28Å; R292-E348 WeakPolarHBondContact CD-OE1 3.43Å; R292-E348 IonicContact CZ-OE1 3.55Å; R292-E348 IonicContact CZ-OE2 2.63Å; R292-E348 IonicContact NE-OE1 3.66Å; R292-E348 IonicContact NE-OE2 2.68Å; R292-E348 IonicContact NH1-OE1 3.76Å; R292-E348 PolarHBondContact NH1-OE1 3.03Å; R292-E348 IonicContact NH1-OE2 2.67Å; R292-E348 PolarHBondContact NH1-OE2 3.28Å; R292-E348 IonicContact NH2-OE2 3.52Å
293	V	78.9	Confident	76.3	Confident	43 Å²	43	72.3 Å²	72.3	26%	0.261	36%	0.356	S	S	.	.			trans	-74.3	118.4	173.2	-178.9	0	0	0	0	109	N291 L297 A337	N291-V293 WeakPolarHBondContact OD1-CG2 3.37Å; N291-V293 PolarHBondContact OD1-N 3.1Å; V293-L297 HydrophobicContact CG1-CD1 4.36Å; V293-A337 HydrophobicContact CG2-CB 4.03Å
294	P	69.1	Low	75.6	Confident	44 Å²	44	70 Å²	70	29%	0.286	34%	0.341	S	S	.	.			trans	-61.7	143.7	179.9	-23.1	34.7	0	0	0	112	R292 D296 V300	R292-P294 WeakPolarHBondContact O-CD 3.42Å; P294-D296 VanDerWaalsContact C-N 3.29Å; P294-D296 PolarHBondContact O-N 2.96Å; P294-V300 HydrophobicContact CG-CG2 4.14Å
295	F	56.3	Low	74.9	Confident	197 Å²	197	70.6 Å²	70.6	86%	0.864	35%	0.345	S	S	*	.	S	Bend	trans	-58.9	-41.9	175.3	-69.6	-75.7	0	0	0	111.8	L297	F295-L297 PolarHBondContact O-N 3Å
296	D	58.2	Low	74.4	Confident	121 Å²	121	74 Å²	74	65%	0.647	36%	0.363	S	S	*	.			trans	-95.5	83.4	177.2	-140.9	-31.1	0	0	0	111.2	P294 D298	P294-D296 VanDerWaalsContact C-N 3.29Å; P294-D296 PolarHBondContact O-N 2.96Å; D296-D298 PolarHBondContact O-N 3.21Å
297	L	62.3	Low	74.1	Confident	31 Å²	31	74 Å²	74	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-26.8	-173.1	-171.6	66	0	0	0	113	V293 F295 T301 K332 L340	V293-L297 HydrophobicContact CG1-CD1 4.36Å; F295-L297 PolarHBondContact O-N 3Å; L297-T301 VanDerWaalsContact O-CB 3.26Å; L297-T301 WeakPolarHBondContact O-CB 3.46Å; L297-T301 PolarHBondContact O-N 2.9Å; L297-T301 PolarHBondContact O-OG1 3.12Å; L297-K332 HydrophobicContact CD2-CG 4.3Å; L297-L340 HydrophobicContact CD1-CD2 3.47Å; L297-L340 VanDerWaalsContact CD1-CD2 3.47Å
298	D	58	Low	73.7	Confident	87 Å²	87	75.7 Å²	75.7	47%	0.465	38%	0.375	S	S	.	.	H	α-helix	trans	-74.1	-32	-167.4	-77.8	-9.6	0	0	0	112.8	D296 T301 N302	D296-D298 PolarHBondContact O-N 3.21Å; D298-T301 PolarHBondContact O-N 2.96Å; D298-N302 PolarHBondContact O-N 3.49Å; D298-N302 PolarHBondContact O-ND2 2.77Å
299	Y	54.4	Low	73.2	Confident	136 Å²	136	83 Å²	83	53%	0.533	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-54.9	174.1	177.9	-100.1	0	0	0	111.8	T301 N302 L303	Y299-T301 PolarHBondContact O-N 2.77Å; Y299-N302 WeakPolarHBondContact O-CB 3.36Å; Y299-N302 PolarHBondContact O-N 3Å; Y299-L303 HydrophobicContact CE1-CD1 4.18Å
300	V	62.1	Low	73	Confident	32 Å²	32	79.2 Å²	79.2	19%	0.194	41%	0.407	C	S	.	.	H	α-helix	trans	-69.3	-25.6	-179.3	-173.6	0	0	0	0	111.6	P294 N302 I304 L340	P294-V300 HydrophobicContact CG-CG2 4.14Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 3.2Å; V300-I304 HydrophobicContact CG1-CD1 3.78Å; V300-I304 WeakPolarHBondContact O-CG1 3.29Å; V300-I304 PolarHBondContact O-N 2.83Å; V300-L340 HydrophobicContact CG1-CD1 3.81Å
301	T	67.2	Low	73	Confident	15 Å²	15	77.2 Å²	77.2	9%	0.092	40%	0.402	C	S	.	.	H	α-helix	trans	-60.4	-39.2	168.7	-63.9	0	0	0	0	111.5	L297 D298 Y299 L303 I304 T305	L297-T301 VanDerWaalsContact O-CB 3.26Å; L297-T301 WeakPolarHBondContact O-CB 3.46Å; L297-T301 PolarHBondContact O-N 2.9Å; L297-T301 PolarHBondContact O-OG1 3.12Å; D298-T301 PolarHBondContact O-N 2.96Å; Y299-T301 PolarHBondContact O-N 2.77Å; T301-L303 PolarHBondContact O-N 3.3Å; T301-I304 PolarHBondContact O-N 2.91Å; T301-T305 HydrophobicContact CG2-CG2 3.68Å; T301-T305 VanDerWaalsContact O-CB 3.25Å; T301-T305 WeakPolarHBondContact O-CB 3.42Å; T301-T305 WeakPolarHBondContact O-CG2 3.18Å; T301-T305 PolarHBondContact O-N 3.48Å; T301-T305 PolarHBondContact O-OG1 2.85Å
302	N	64.1	Low	73.3	Confident	113 Å²	113	74.3 Å²	74.3	60%	0.604	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-41.5	-178.3	-67.3	-30.9	0	0	0	112.8	D298 Y299 V300 I304 T305	D298-N302 PolarHBondContact O-N 3.49Å; D298-N302 PolarHBondContact O-ND2 2.77Å; Y299-N302 WeakPolarHBondContact O-CB 3.36Å; Y299-N302 PolarHBondContact O-N 3Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 3.2Å; N302-I304 VanDerWaalsContact C-N 3.32Å; N302-I304 PolarHBondContact O-N 2.92Å; N302-T305 PolarHBondContact O-N 3.43Å; N302-T305 VanDerWaalsContact O-O 3.1Å
303	L	68.3	Low	73.4	Confident	108 Å²	108	76.3 Å²	76.3	57%	0.565	39%	0.392	S	S	*	.	H	α-helix	trans	-61.8	-38.2	175.9	-74.4	158.3	0	0	0	113	Y299 T301 K315	Y299-L303 HydrophobicContact CE1-CD1 4.18Å; T301-L303 PolarHBondContact O-N 3.3Å; L303-K315 PolarHBondContact O-NZ 2.93Å
304	I	78.1	Confident	74.1	Confident	9 Å²	9	74.3 Å²	74.3	5%	0.046	38%	0.38	C	S	.	.	H	α-helix	trans	-90.2	-13.6	-172.2	-63.9	175.4	0	0	0	112.2	V300 T301 N302 K315 L316 L340 L343	V300-I304 HydrophobicContact CG1-CD1 3.78Å; V300-I304 WeakPolarHBondContact O-CG1 3.29Å; V300-I304 PolarHBondContact O-N 2.83Å; T301-I304 PolarHBondContact O-N 2.91Å; N302-I304 VanDerWaalsContact C-N 3.32Å; N302-I304 PolarHBondContact O-N 2.92Å; I304-K315 HydrophobicContact CG2-CB 4.45Å; I304-K315 VanDerWaalsContact O-CB 3.3Å; I304-K315 WeakPolarHBondContact O-CB 3.44Å; I304-K315 VanDerWaalsContact O-CG 3.24Å; I304-K315 WeakPolarHBondContact O-CG 3.31Å; I304-K315 PolarHBondContact O-N 3.48Å; I304-L316 HydrophobicContact CD1-CD1 3.82Å; I304-L316 HydrophobicContact CD1-CG 4.25Å; I304-L316 HydrophobicContact CG2-CB 3.77Å; I304-L316 HydrophobicContact CG2-CD1 3.94Å; I304-L316 HydrophobicContact CG2-CG 3.66Å; I304-L340 HydrophobicContact CD1-CD1 3.53Å; I304-L343 HydrophobicContact CD1-CD2 3.88Å
305	T	79.7	Confident	74.8	Confident	14 Å²	14	75.6 Å²	75.6	9%	0.086	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.2	-174.7	68.5	0	0	0	0	112.6	T301 N302 F313 C314 F327	T301-T305 HydrophobicContact CG2-CG2 3.68Å; T301-T305 VanDerWaalsContact O-CB 3.25Å; T301-T305 WeakPolarHBondContact O-CB 3.42Å; T301-T305 WeakPolarHBondContact O-CG2 3.18Å; T301-T305 PolarHBondContact O-N 3.48Å; T301-T305 PolarHBondContact O-OG1 2.85Å; N302-T305 PolarHBondContact O-N 3.43Å; N302-T305 VanDerWaalsContact O-O 3.1Å; T305-F313 CarbonylContact C-O 3.57Å; T305-F313 WeakPolarHBondContact CA-O 3.31Å; T305-F313 WeakPolarHBondContact CB-O 3.31Å; T305-C314 HydrophobicContact CG2-CB 4.36Å; T305-F327 HydrophobicContact CG2-CE1 3.52Å; T305-F327 HydrophobicContact CG2-CZ 3.38Å
306	L	82.6	Confident	76.2	Confident	83 Å²	83	66.4 Å²	66.4	44%	0.435	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.5	-176.2	-148.2	83	0	0	0	108.4	T308 F313	L306-T308 HydrophobicContact CD2-CG2 3.81Å; L306-T308 HydrophobicContact CG-CG2 4.17Å; L306-F313 HydrophobicContact CB-CB 4.26Å; L306-F313 PolarHBondContact N-O 3.3Å; L306-F313 PolarHBondContact O-N 3.47Å
307	H	86	Confident	77.7	Confident	102 Å²	102	61.9 Å²	61.9	47%	0.472	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	104.7	172.5	-177.4	-109.5	0	0	0	109.9	F311 W312	H307-F311 WeakPolarHBondContact CA-O 3.27Å; H307-F311 PolarHBondContact CD2-O 3Å; H307-W312 HydrophobicContact CB-CD2 4.39Å; H307-W312 HydrophobicContact CB-CE3 4.38Å; H307-W312 HydrophobicContact CB-CH2 4.41Å; H307-W312 HydrophobicContact CB-CZ2 4.44Å; H307-W312 HydrophobicContact CB-CZ3 4.4Å; H307-W312 AromaticContact CD2-CD1 3.47Å; H307-W312 VanDerWaalsContact CD2-CD1 3.47Å; H307-W312 AromaticContact CD2-CD2 3.73Å; H307-W312 AromaticContact CD2-CE2 3.35Å; H307-W312 AromaticContact CD2-CG 3.77Å; H307-W312 AromaticContact CD2-CZ2 3.84Å; H307-W312 AromaticContact CD2-NE1 3.18Å; H307-W312 PolarHBondContact CD2-NE1 3.44Å; H307-W312 AromaticContact CG-CE2 3.93Å; H307-W312 AromaticContact NE2-CD1 3.9Å; H307-W312 AromaticContact NE2-CE2 3.88Å; H307-W312 AromaticContact NE2-NE1 3.39Å; H307-W312 PolarHBondContact NE2-NE1 2.93Å
308	T	85.2	Confident	78.8	Confident	62 Å²	62	65.4 Å²	65.4	38%	0.38	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.9	-179.2	53.4	0	0	0	0	110.6	L306 G310 F311 F313	L306-T308 HydrophobicContact CD2-CG2 3.81Å; L306-T308 HydrophobicContact CG-CG2 4.17Å; T308-G310 PolarHBondContact O-N 3.41Å; T308-G310 VanDerWaalsContact O-N 3.08Å; T308-F311 PolarHBondContact N-O 3.01Å; T308-F311 PolarHBondContact O-N 2.73Å; T308-F313 VanDerWaalsContact OG1-CE2 3.29Å; T308-F313 WeakPolarHBondContact OG1-CE2 3.48Å
309	N	79.5	Confident	80.3	Confident	163 Å²	163	65.1 Å²	65.1	87%	0.872	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	33.4	179.5	-58.1	3.8	0	0	0	114.4	F311	N309-F311 VanDerWaalsContact C-N 3.29Å; N309-F311 WeakPolarHBondContact O-CD2 3.49Å; N309-F311 PolarHBondContact O-N 2.88Å
310	G	85.5	Confident	82	Confident	41 Å²	41	65.3 Å²	65.3	42%	0.423	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	7.2	-177.7	0	0	0	0	0	115.3	T308 P322	T308-G310 PolarHBondContact O-N 3.41Å; T308-G310 VanDerWaalsContact O-N 3.08Å; G310-P322 WeakPolarHBondContact O-CA 3.41Å
311	F	87.3	Confident	83.4	Confident	84 Å²	84	63.9 Å²	63.9	37%	0.368	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.8	174.8	-70.1	-95.9	0	0	0	111.1	H307 T308 N309 F313 P322	H307-F311 WeakPolarHBondContact CA-O 3.27Å; H307-F311 PolarHBondContact CD2-O 3Å; T308-F311 PolarHBondContact N-O 3.01Å; T308-F311 PolarHBondContact O-N 2.73Å; N309-F311 VanDerWaalsContact C-N 3.29Å; N309-F311 WeakPolarHBondContact O-CD2 3.49Å; N309-F311 PolarHBondContact O-N 2.88Å; F311-F313 HydrophobicContact CB-CD2 4.19Å; F311-F313 HydrophobicContact CB-CE2 3.45Å; F311-F313 VanDerWaalsContact CB-CE2 3.45Å; F311-F313 HydrophobicContact CB-CZ 3.64Å; F311-F313 HydrophobicContact CG-CZ 4.44Å; F311-F313 VanDerWaalsContact O-CD2 3.3Å; F311-F313 WeakPolarHBondContact O-CD2 3.13Å; F311-F313 WeakPolarHBondContact O-CE2 3.49Å; F311-P322 HydrophobicContact CD1-CB 3.84Å; F311-P322 HydrophobicContact CD1-CG 4.3Å; F311-P322 HydrophobicContact CE1-CB 3.67Å; F311-P322 HydrophobicContact CE1-CG 3.92Å; F311-P322 HydrophobicContact CG-CB 4.5Å; F311-P322 HydrophobicContact CZ-CB 4.18Å
312	W	90	Very high	84.5	Confident	50 Å²	50	66.9 Å²	66.9	19%	0.189	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.9	169.3	-63.8	73.5	0	0	0	109.1	H307 K320 S321 K324 F327	H307-W312 HydrophobicContact CB-CD2 4.39Å; H307-W312 HydrophobicContact CB-CE3 4.38Å; H307-W312 HydrophobicContact CB-CH2 4.41Å; H307-W312 HydrophobicContact CB-CZ2 4.44Å; H307-W312 HydrophobicContact CB-CZ3 4.4Å; H307-W312 AromaticContact CD2-CD1 3.47Å; H307-W312 VanDerWaalsContact CD2-CD1 3.47Å; H307-W312 AromaticContact CD2-CD2 3.73Å; H307-W312 AromaticContact CD2-CE2 3.35Å; H307-W312 AromaticContact CD2-CG 3.77Å; H307-W312 AromaticContact CD2-CZ2 3.84Å; H307-W312 AromaticContact CD2-NE1 3.18Å; H307-W312 PolarHBondContact CD2-NE1 3.44Å; H307-W312 AromaticContact CG-CE2 3.93Å; H307-W312 AromaticContact NE2-CD1 3.9Å; H307-W312 AromaticContact NE2-CE2 3.88Å; H307-W312 AromaticContact NE2-NE1 3.39Å; H307-W312 PolarHBondContact NE2-NE1 2.93Å; W312-K320 CarbonylContact O-C 3.51Å; W312-K320 VanDerWaalsContact O-CA 3.28Å; W312-K320 WeakPolarHBondContact O-CA 3.26Å; W312-S321 PolarHBondContact N-O 2.94Å; W312-S321 PolarHBondContact O-N 3.13Å; W312-K324 HydrophobicContact CD2-CB 4.41Å; W312-K324 HydrophobicContact CD2-CG 4.19Å; W312-K324 HydrophobicContact CH2-CD 3.81Å; W312-K324 HydrophobicContact CH2-CG 4.16Å; W312-K324 HydrophobicContact CZ2-CB 4.16Å; W312-K324 HydrophobicContact CZ2-CD 3.54Å; W312-K324 HydrophobicContact CZ2-CG 3.77Å; W312-K324 HydrophobicContact CZ3-CG 4.49Å; W312-F327 HydrophobicContact CB-CB 3.78Å; W312-F327 HydrophobicContact CB-CD1 3.65Å; W312-F327 HydrophobicContact CB-CD2 3.44Å; W312-F327 VanDerWaalsContact CB-CD2 3.44Å; W312-F327 HydrophobicContact CB-CE1 4.01Å; W312-F327 HydrophobicContact CB-CE2 3.84Å; W312-F327 HydrophobicContact CB-CG 3.32Å; W312-F327 HydrophobicContact CB-CZ 4.1Å; W312-F327 HydrophobicContact CD2-CD1 4.1Å; W312-F327 HydrophobicContact CD2-CG 4.49Å; W312-F327 AromaticContact CE3-CD1 3.71Å; W312-F327 HydrophobicContact CE3-CD1 3.71Å; W312-F327 AromaticContact CE3-CE1 3.87Å; W312-F327 HydrophobicContact CE3-CE1 3.87Å; W312-F327 HydrophobicContact CG-CB 4.16Å; W312-F327 HydrophobicContact CG-CD1 4.1Å; W312-F327 HydrophobicContact CG-CG 4.03Å
313	F	89.2	Confident	85.6	Confident	67 Å²	67	65.3 Å²	65.3	29%	0.294	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.4	-179.3	-61	-93.7	0	0	0	110.5	T305 L306 T308 F311 Y319 K320 F327	T305-F313 CarbonylContact C-O 3.57Å; T305-F313 WeakPolarHBondContact CA-O 3.31Å; T305-F313 WeakPolarHBondContact CB-O 3.31Å; L306-F313 HydrophobicContact CB-CB 4.26Å; L306-F313 PolarHBondContact N-O 3.3Å; L306-F313 PolarHBondContact O-N 3.47Å; T308-F313 VanDerWaalsContact OG1-CE2 3.29Å; T308-F313 WeakPolarHBondContact OG1-CE2 3.48Å; F311-F313 HydrophobicContact CB-CD2 4.19Å; F311-F313 HydrophobicContact CB-CE2 3.45Å; F311-F313 VanDerWaalsContact CB-CE2 3.45Å; F311-F313 HydrophobicContact CB-CZ 3.64Å; F311-F313 HydrophobicContact CG-CZ 4.44Å; F311-F313 VanDerWaalsContact O-CD2 3.3Å; F311-F313 WeakPolarHBondContact O-CD2 3.13Å; F311-F313 WeakPolarHBondContact O-CE2 3.49Å; F313-Y319 CarbonylContact C-O 3.51Å; F313-Y319 WeakPolarHBondContact CA-O 3.27Å; F313-K320 HydrophobicContact CD1-CB 3.58Å; F313-K320 HydrophobicContact CD1-CD 4.5Å; F313-K320 HydrophobicContact CE1-CB 3.68Å; F313-K320 HydrophobicContact CE1-CD 3.87Å; F313-K320 HydrophobicContact CE1-CG 4.45Å; F313-K320 HydrophobicContact CG-CB 4.41Å; F313-F327 VanDerWaalsContact C-CE2 3.44Å; F313-F327 VanDerWaalsContact C-CZ 3.45Å; F313-F327 WeakPolarHBondContact O-CZ 3.46Å
314	C	92.6	Very high	86.5	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113	173.7	175.2	0	0	0	0	109.3	T305 L316 C317 S318 Y319 F327 H336	T305-C314 HydrophobicContact CG2-CB 4.36Å; C314-L316 PolarHBondContact O-N 2.96Å; C314-C317 HydrophobicContact CB-CB 4.43Å; C314-C317 PolarHBondContact O-N 3.11Å; C314-S318 WeakPolarHBondContact O-CA 3.19Å; C314-S318 PolarHBondContact O-N 3.39Å; C314-Y319 PolarHBondContact N-O 3.24Å; C314-F327 HydrophobicContact CB-CE2 3.73Å; C314-F327 HydrophobicContact CB-CZ 3.8Å; C314-H336 PolarHBondContact SG-CE1 3.2Å; C314-H336 PolarHBondContact SG-ND1 2.97Å; C314-H336 VanDerWaalsContact SG-ND1 3.41Å
315	K	83.7	Confident	87	Confident	71 Å²	71	68.3 Å²	68.3	31%	0.309	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-56.2	-53.7	-179.1	-63.7	169.2	-172.2	166	0	110.6	L303 I304 C317 S318 L361	L303-K315 PolarHBondContact O-NZ 2.93Å; I304-K315 HydrophobicContact CG2-CB 4.45Å; I304-K315 VanDerWaalsContact O-CB 3.3Å; I304-K315 WeakPolarHBondContact O-CB 3.44Å; I304-K315 VanDerWaalsContact O-CG 3.24Å; I304-K315 WeakPolarHBondContact O-CG 3.31Å; I304-K315 PolarHBondContact O-N 3.48Å; K315-C317 PolarHBondContact O-N 2.79Å; K315-S318 PolarHBondContact O-N 3.31Å; K315-L361 HydrophobicContact CB-CD2 4.37Å
316	L	87.1	Confident	87.4	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-50.4	-29.4	178.4	-94.9	-173.9	0	0	0	116.1	I304 C314 R339 L340 L343 L361	I304-L316 HydrophobicContact CD1-CD1 3.82Å; I304-L316 HydrophobicContact CD1-CG 4.25Å; I304-L316 HydrophobicContact CG2-CB 3.77Å; I304-L316 HydrophobicContact CG2-CD1 3.94Å; I304-L316 HydrophobicContact CG2-CG 3.66Å; C314-L316 PolarHBondContact O-N 2.96Å; L316-R339 HydrophobicContact CD1-CB 4.48Å; L316-R339 HydrophobicContact CD2-CB 4.26Å; L316-R339 WeakPolarHBondContact O-CD 3.42Å; L316-R339 PolarHBondContact O-NH1 2.86Å; L316-L340 HydrophobicContact CD1-CB 3.89Å; L316-L340 HydrophobicContact CD1-CD1 4Å; L316-L343 HydrophobicContact CD1-CD2 4.34Å; L316-L343 HydrophobicContact CD2-CB 4.12Å; L316-L343 HydrophobicContact CD2-CD2 3.92Å; L316-L343 HydrophobicContact CD2-CG 4.5Å; L316-L343 HydrophobicContact CG-CD2 4.19Å; L316-L361 HydrophobicContact CD2-CD2 4.34Å; L316-L361 HydrophobicContact CG-CD2 4.41Å
317	C	88.5	Confident	87.8	Confident	26 Å²	26	67.5 Å²	67.5	18%	0.176	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-122	-2.6	-171.1	-66.7	0	0	0	0	113.7	C314 K315 Y319 H330	C314-C317 HydrophobicContact CB-CB 4.43Å; C314-C317 PolarHBondContact O-N 3.11Å; K315-C317 PolarHBondContact O-N 2.79Å; C317-Y319 PolarHBondContact O-N 3.31Å; C317-H330 WeakPolarHBondContact CB-CE1 3.37Å; C317-H330 VanDerWaalsContact CB-NE2 3.28Å; C317-H330 WeakPolarHBondContact CB-NE2 3.28Å; C317-H330 VanDerWaalsContact SG-CE1 3.52Å
318	S	85.4	Confident	87.9	Confident	104 Å²	104	66.9 Å²	66.9	73%	0.727	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	24.8	-170	-41.6	0	0	0	0	113.5	C314 K315	C314-S318 WeakPolarHBondContact O-CA 3.19Å; C314-S318 PolarHBondContact O-N 3.39Å; K315-S318 PolarHBondContact O-N 3.31Å
319	Y	89.5	Confident	88	Confident	82 Å²	82	70.1 Å²	70.1	32%	0.322	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.3	-176	179.6	-97	0	0	0	110.2	F313 C314 C317 F327 H330	F313-Y319 CarbonylContact C-O 3.51Å; F313-Y319 WeakPolarHBondContact CA-O 3.27Å; C314-Y319 PolarHBondContact N-O 3.24Å; C317-Y319 PolarHBondContact O-N 3.31Å; Y319-F327 AromaticContact CD1-CD2 3.97Å; Y319-F327 HydrophobicContact CD1-CD2 3.97Å; Y319-F327 HydrophobicContact CD1-CE2 4.28Å; Y319-F327 HydrophobicContact CE1-CD2 4.18Å; Y319-H330 HydrophobicContact CD1-CB 3.65Å; Y319-H330 AromaticContact CD1-CD2 3.38Å; Y319-H330 WeakPolarHBondContact CD1-CD2 3.32Å; Y319-H330 AromaticContact CD1-CG 3.37Å; Y319-H330 HydrophobicContact CE1-CB 3.54Å; Y319-H330 AromaticContact CE1-CG 3.82Å; Y319-H330 HydrophobicContact CG-CB 4.28Å; Y319-H330 AromaticContact CG-CD2 3.7Å; Y319-H330 AromaticContact CG-CG 3.64Å; Y319-H330 AromaticContact CG-ND1 3.92Å; Y319-H330 AromaticContact CG-NE2 3.99Å
320	K	91.3	Very high	88.6	Confident	140 Å²	140	63.4 Å²	63.4	61%	0.609	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.8	177	69.3	-179.3	-177.4	177.3	0	112.8	W312 F313	W312-K320 CarbonylContact O-C 3.51Å; W312-K320 VanDerWaalsContact O-CA 3.28Å; W312-K320 WeakPolarHBondContact O-CA 3.26Å; F313-K320 HydrophobicContact CD1-CB 3.58Å; F313-K320 HydrophobicContact CD1-CD 4.5Å; F313-K320 HydrophobicContact CE1-CB 3.68Å; F313-K320 HydrophobicContact CE1-CD 3.87Å; F313-K320 HydrophobicContact CE1-CG 4.45Å; F313-K320 HydrophobicContact CG-CB 4.41Å
321	S	91.5	Very high	88.7	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.014	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	130.4	179.3	171.4	0	0	0	0	112.2	W312 L323 N326	W312-S321 PolarHBondContact N-O 2.94Å; W312-S321 PolarHBondContact O-N 3.13Å; S321-L323 PolarHBondContact O-N 3.02Å; S321-L323 PolarHBondContact OG-N 2.77Å; S321-L323 PolarHBondContact OG-O 3.1Å; S321-N326 WeakPolarHBondContact OG-CB 3.42Å
322	P	89.4	Confident	88.6	Confident	77 Å²	77	64.9 Å²	64.9	50%	0.5	33%	0.332	S	S	.	.	S	Bend	trans	-74.3	-2.1	171.4	31.5	-34.1	0	0	0	113.4	G310 F311	G310-P322 WeakPolarHBondContact O-CA 3.41Å; F311-P322 HydrophobicContact CD1-CB 3.84Å; F311-P322 HydrophobicContact CD1-CG 4.3Å; F311-P322 HydrophobicContact CE1-CB 3.67Å; F311-P322 HydrophobicContact CE1-CG 3.92Å; F311-P322 HydrophobicContact CG-CB 4.5Å; F311-P322 HydrophobicContact CZ-CB 4.18Å
323	L	87.4	Confident	88.5	Confident	81 Å²	81	65.1 Å²	65.1	42%	0.424	34%	0.339	S	S	.	.			trans	-121	119.9	-178.9	-64.6	175.7	0	0	0	110.7	S321 A325 N326 F327	S321-L323 PolarHBondContact O-N 3.02Å; S321-L323 PolarHBondContact OG-N 2.77Å; S321-L323 PolarHBondContact OG-O 3.1Å; L323-A325 PolarHBondContact O-N 3.03Å; L323-N326 HydrophobicContact CB-CB 4.27Å; L323-N326 PolarHBondContact O-N 3.34Å; L323-N326 VanDerWaalsContact O-N 3.14Å; L323-F327 PolarHBondContact O-N 2.85Å; L323-F327 VanDerWaalsContact O-N 3.11Å
324	K	87.5	Confident	88.3	Confident	111 Å²	111	69 Å²	69	48%	0.483	36%	0.357	S	S	.	.	H	α-helix	trans	-54.8	-38.4	176.8	-167.4	175.7	-172.4	174.8	0	112	W312 F327 Q328	W312-K324 HydrophobicContact CD2-CB 4.41Å; W312-K324 HydrophobicContact CD2-CG 4.19Å; W312-K324 HydrophobicContact CH2-CD 3.81Å; W312-K324 HydrophobicContact CH2-CG 4.16Å; W312-K324 HydrophobicContact CZ2-CB 4.16Å; W312-K324 HydrophobicContact CZ2-CD 3.54Å; W312-K324 HydrophobicContact CZ2-CG 3.77Å; W312-K324 HydrophobicContact CZ3-CG 4.49Å; K324-F327 WeakPolarHBondContact O-CB 2.76Å; K324-F327 PolarHBondContact O-N 3.28Å; K324-F327 VanDerWaalsContact O-N 3.12Å; K324-Q328 HydrophobicContact CG-CG 4.43Å; K324-Q328 WeakPolarHBondContact O-CG 3.5Å; K324-Q328 PolarHBondContact O-N 3.32Å
325	A	88.1	Confident	87.9	Confident	69 Å²	69	76.3 Å²	76.3	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-63.5	-42.3	178	0	0	0	0	0	113.7	L323 F327 L329	L323-A325 PolarHBondContact O-N 3.03Å; A325-F327 VanDerWaalsContact C-N 3.26Å; A325-F327 PolarHBondContact O-N 3.07Å; A325-L329 WeakPolarHBondContact O-CB 3.33Å; A325-L329 PolarHBondContact O-N 2.81Å
326	N	89.1	Confident	88.2	Confident	76 Å²	76	73 Å²	73	41%	0.406	38%	0.375	S	S	.	.	H	α-helix	trans	-67.1	-32.1	173.7	-76.6	-8.4	0	0	0	111.3	S321 L323 L329 H330	S321-N326 WeakPolarHBondContact OG-CB 3.42Å; L323-N326 HydrophobicContact CB-CB 4.27Å; L323-N326 PolarHBondContact O-N 3.34Å; L323-N326 VanDerWaalsContact O-N 3.14Å; N326-L329 WeakPolarHBondContact O-CB 3.44Å; N326-L329 PolarHBondContact O-N 3.38Å; N326-H330 PolarHBondContact O-N 3.16Å
327	F	90.1	Very high	88.3	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-72.7	-44.6	-179.8	-169.1	-105.8	0	0	0	112.7	T305 W312 F313 C314 Y319 L323 K324 A325 L329 H330 C331	T305-F327 HydrophobicContact CG2-CE1 3.52Å; T305-F327 HydrophobicContact CG2-CZ 3.38Å; W312-F327 HydrophobicContact CB-CB 3.78Å; W312-F327 HydrophobicContact CB-CD1 3.65Å; W312-F327 HydrophobicContact CB-CD2 3.44Å; W312-F327 VanDerWaalsContact CB-CD2 3.44Å; W312-F327 HydrophobicContact CB-CE1 4.01Å; W312-F327 HydrophobicContact CB-CE2 3.84Å; W312-F327 HydrophobicContact CB-CG 3.32Å; W312-F327 HydrophobicContact CB-CZ 4.1Å; W312-F327 HydrophobicContact CD2-CD1 4.1Å; W312-F327 HydrophobicContact CD2-CG 4.49Å; W312-F327 AromaticContact CE3-CD1 3.71Å; W312-F327 HydrophobicContact CE3-CD1 3.71Å; W312-F327 AromaticContact CE3-CE1 3.87Å; W312-F327 HydrophobicContact CE3-CE1 3.87Å; W312-F327 HydrophobicContact CG-CB 4.16Å; W312-F327 HydrophobicContact CG-CD1 4.1Å; W312-F327 HydrophobicContact CG-CG 4.03Å; F313-F327 VanDerWaalsContact C-CE2 3.44Å; F313-F327 VanDerWaalsContact C-CZ 3.45Å; F313-F327 WeakPolarHBondContact O-CZ 3.46Å; C314-F327 HydrophobicContact CB-CE2 3.73Å; C314-F327 HydrophobicContact CB-CZ 3.8Å; Y319-F327 AromaticContact CD1-CD2 3.97Å; Y319-F327 HydrophobicContact CD1-CD2 3.97Å; Y319-F327 HydrophobicContact CD1-CE2 4.28Å; Y319-F327 HydrophobicContact CE1-CD2 4.18Å; L323-F327 PolarHBondContact O-N 2.85Å; L323-F327 VanDerWaalsContact O-N 3.11Å; K324-F327 WeakPolarHBondContact O-CB 2.76Å; K324-F327 PolarHBondContact O-N 3.28Å; K324-F327 VanDerWaalsContact O-N 3.12Å; A325-F327 VanDerWaalsContact C-N 3.26Å; A325-F327 PolarHBondContact O-N 3.07Å; F327-L329 VanDerWaalsContact C-N 3.26Å; F327-L329 PolarHBondContact O-N 2.84Å; F327-H330 WeakPolarHBondContact O-CA 3.36Å; F327-H330 WeakPolarHBondContact O-CB 3.4Å; F327-H330 PolarHBondContact O-N 2.98Å; F327-C331 PolarHBondContact O-N 3.38Å; F327-C331 PolarHBondContact O-SG 3.32Å
328	Q	87.4	Confident	88.2	Confident	89 Å²	89	77.6 Å²	77.6	42%	0.416	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-36.4	169.3	-71.8	174.1	-47.6	0	0	111.4	K324 H330 C331 K332	K324-Q328 HydrophobicContact CG-CG 4.43Å; K324-Q328 WeakPolarHBondContact O-CG 3.5Å; K324-Q328 PolarHBondContact O-N 3.32Å; Q328-H330 VanDerWaalsContact C-N 3.29Å; Q328-H330 PolarHBondContact O-N 3.07Å; Q328-C331 PolarHBondContact O-N 2.84Å; Q328-K332 WeakPolarHBondContact O-CB 3.35Å; Q328-K332 WeakPolarHBondContact O-CG 3.27Å; Q328-K332 PolarHBondContact O-N 3.02Å; Q328-K332 VanDerWaalsContact O-N 3.09Å
329	L	89.1	Confident	88.3	Confident	129 Å²	129	76.4 Å²	76.4	68%	0.675	38%	0.378	S	S	*	.	H	α-helix	trans	-63.9	-35.4	172.3	-152.5	85.7	0	0	0	112	A325 N326 F327 K332 T333	A325-L329 WeakPolarHBondContact O-CB 3.33Å; A325-L329 PolarHBondContact O-N 2.81Å; N326-L329 WeakPolarHBondContact O-CB 3.44Å; N326-L329 PolarHBondContact O-N 3.38Å; F327-L329 VanDerWaalsContact C-N 3.26Å; F327-L329 PolarHBondContact O-N 2.84Å; L329-K332 CarbonylContact O-C 3.59Å; L329-T333 WeakPolarHBondContact O-CG2 3.39Å; L329-T333 PolarHBondContact O-N 2.84Å
330	H	90.3	Very high	88.2	Confident	22 Å²	22	72.5 Å²	72.5	10%	0.102	36%	0.363	C	S	.	.	H	α-helix	trans	-69.2	-46.6	174.7	164.8	58.2	0	0	0	112.6	C317 Y319 N326 F327 Q328 K332 T333 H336	C317-H330 WeakPolarHBondContact CB-CE1 3.37Å; C317-H330 VanDerWaalsContact CB-NE2 3.28Å; C317-H330 WeakPolarHBondContact CB-NE2 3.28Å; C317-H330 VanDerWaalsContact SG-CE1 3.52Å; Y319-H330 HydrophobicContact CD1-CB 3.65Å; Y319-H330 AromaticContact CD1-CD2 3.38Å; Y319-H330 WeakPolarHBondContact CD1-CD2 3.32Å; Y319-H330 AromaticContact CD1-CG 3.37Å; Y319-H330 HydrophobicContact CE1-CB 3.54Å; Y319-H330 AromaticContact CE1-CG 3.82Å; Y319-H330 HydrophobicContact CG-CB 4.28Å; Y319-H330 AromaticContact CG-CD2 3.7Å; Y319-H330 AromaticContact CG-CG 3.64Å; Y319-H330 AromaticContact CG-ND1 3.92Å; Y319-H330 AromaticContact CG-NE2 3.99Å; N326-H330 PolarHBondContact O-N 3.16Å; F327-H330 WeakPolarHBondContact O-CA 3.36Å; F327-H330 WeakPolarHBondContact O-CB 3.4Å; F327-H330 PolarHBondContact O-N 2.98Å; Q328-H330 VanDerWaalsContact C-N 3.29Å; Q328-H330 PolarHBondContact O-N 3.07Å; H330-K332 PolarHBondContact O-N 3.42Å; H330-T333 WeakPolarHBondContact O-CB 3.42Å; H330-T333 PolarHBondContact O-N 2.64Å; H330-T333 PolarHBondContact O-OG1 3.22Å; H330-H336 AromaticContact NE2-ND1 3.63Å; H330-H336 WeakPolarHBondContact O-CB 3.33Å
331	C	87.7	Confident	88	Confident	7 Å²	7	66.9 Å²	66.9	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-31.3	177.6	-55.5	0	0	0	0	111.2	F327 Q328 T333 H336	F327-C331 PolarHBondContact O-N 3.38Å; F327-C331 PolarHBondContact O-SG 3.32Å; Q328-C331 PolarHBondContact O-N 2.84Å; C331-T333 VanDerWaalsContact C-N 3.25Å; C331-T333 PolarHBondContact O-N 3.23Å; C331-H336 PolarHBondContact O-CD2 3.44Å
332	K	85.2	Confident	87.8	Confident	150 Å²	150	68 Å²	68	65%	0.652	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	18.8	172.4	-61.8	-177.9	-176.9	-169.7	0	114	L297 Q328 L329 H330	L297-K332 HydrophobicContact CD2-CG 4.3Å; Q328-K332 WeakPolarHBondContact O-CB 3.35Å; Q328-K332 WeakPolarHBondContact O-CG 3.27Å; Q328-K332 PolarHBondContact O-N 3.02Å; Q328-K332 VanDerWaalsContact O-N 3.09Å; L329-K332 CarbonylContact O-C 3.59Å; H330-K332 PolarHBondContact O-N 3.42Å
333	T	89.1	Confident	87.7	Confident	55 Å²	55	64.9 Å²	64.9	34%	0.337	33%	0.325	S	S	.	.	S	Bend	trans	-90.1	143.6	167.9	61.4	0	0	0	0	111.9	L329 H330 C331 K335 H336 A337	L329-T333 WeakPolarHBondContact O-CG2 3.39Å; L329-T333 PolarHBondContact O-N 2.84Å; H330-T333 WeakPolarHBondContact O-CB 3.42Å; H330-T333 PolarHBondContact O-N 2.64Å; H330-T333 PolarHBondContact O-OG1 3.22Å; C331-T333 VanDerWaalsContact C-N 3.25Å; C331-T333 PolarHBondContact O-N 3.23Å; T333-K335 PolarHBondContact O-N 2.91Å; T333-H336 WeakPolarHBondContact O-CA 3.42Å; T333-H336 WeakPolarHBondContact O-CB 3.43Å; T333-H336 PolarHBondContact O-N 3.48Å; T333-A337 PolarHBondContact O-N 3.24Å
334	E	84.9	Confident	87.7	Confident	147 Å²	147	63 Å²	63	69%	0.687	32%	0.317	S	S	*	.	H	α-helix	trans	-50.5	-38	173.3	-172.3	-177.5	167.6	0	0	113.1	H336 A337 Q338	E334-H336 VanDerWaalsContact C-N 3.33Å; E334-H336 PolarHBondContact O-N 3.07Å; E334-A337 PolarHBondContact O-N 2.83Å; E334-Q338 WeakPolarHBondContact O-CB 3.36Å; E334-Q338 VanDerWaalsContact O-CG 3.28Å; E334-Q338 WeakPolarHBondContact O-CG 3.31Å; E334-Q338 PolarHBondContact O-N 2.9Å; E334-Q338 PolarHBondContact OE1-NE2 3.42Å
335	K	84.5	Confident	87.9	Confident	156 Å²	156	58 Å²	58	68%	0.678	30%	0.295	S	S	*	.	H	α-helix	trans	-68.7	-27.3	176.2	-69.2	-165.7	173.4	-166.1	0	114.4	T333 R339	T333-K335 PolarHBondContact O-N 2.91Å; K335-R339 WeakPolarHBondContact O-CG 3.48Å
336	H	89.8	Confident	87.8	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-75.8	-47.7	170.9	-178.5	99.9	0	0	0	109.5	C314 H330 C331 T333 E334 Q338 R339 L340	C314-H336 PolarHBondContact SG-CE1 3.2Å; C314-H336 PolarHBondContact SG-ND1 2.97Å; C314-H336 VanDerWaalsContact SG-ND1 3.41Å; H330-H336 AromaticContact NE2-ND1 3.63Å; H330-H336 WeakPolarHBondContact O-CB 3.33Å; C331-H336 PolarHBondContact O-CD2 3.44Å; T333-H336 WeakPolarHBondContact O-CA 3.42Å; T333-H336 WeakPolarHBondContact O-CB 3.43Å; T333-H336 PolarHBondContact O-N 3.48Å; E334-H336 VanDerWaalsContact C-N 3.33Å; E334-H336 PolarHBondContact O-N 3.07Å; H336-Q338 PolarHBondContact O-N 3.5Å; H336-R339 PolarHBondContact O-N 2.85Å; H336-R339 VanDerWaalsContact O-N 3.17Å; H336-L340 WeakPolarHBondContact O-CB 3.47Å; H336-L340 PolarHBondContact O-N 3.39Å
337	A	87.7	Confident	87.6	Confident	29 Å²	29	53.6 Å²	53.6	24%	0.24	27%	0.265	C	S	.	.	H	α-helix	trans	-56.1	-46.2	177.2	0	0	0	0	0	113.3	V293 T333 E334 R339 L340 S341	V293-A337 HydrophobicContact CG2-CB 4.03Å; T333-A337 PolarHBondContact O-N 3.24Å; E334-A337 PolarHBondContact O-N 2.83Å; A337-R339 PolarHBondContact O-N 3.07Å; A337-L340 PolarHBondContact O-N 2.93Å; A337-S341 WeakPolarHBondContact O-CB 3.4Å; A337-S341 PolarHBondContact O-N 3.16Å
338	Q	86.5	Confident	87.5	Confident	99 Å²	99	56.6 Å²	56.6	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-59.7	-43.2	175.8	-75.6	165.7	-12.9	0	0	112.4	E334 H336 F342	E334-Q338 WeakPolarHBondContact O-CB 3.36Å; E334-Q338 VanDerWaalsContact O-CG 3.28Å; E334-Q338 WeakPolarHBondContact O-CG 3.31Å; E334-Q338 PolarHBondContact O-N 2.9Å; E334-Q338 PolarHBondContact OE1-NE2 3.42Å; H336-Q338 PolarHBondContact O-N 3.5Å; Q338-F342 WeakPolarHBondContact O-CB 3.4Å; Q338-F342 PolarHBondContact O-N 3.18Å
339	R	87.6	Confident	87.2	Confident	78 Å²	78	52.4 Å²	52.4	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-71.4	-33	177.9	-73	-178	171.1	-147.4	-4.2	112.8	L316 K335 H336 A337 L343 L424	L316-R339 HydrophobicContact CD1-CB 4.48Å; L316-R339 HydrophobicContact CD2-CB 4.26Å; L316-R339 WeakPolarHBondContact O-CD 3.42Å; L316-R339 PolarHBondContact O-NH1 2.86Å; K335-R339 WeakPolarHBondContact O-CG 3.48Å; H336-R339 PolarHBondContact O-N 2.85Å; H336-R339 VanDerWaalsContact O-N 3.17Å; A337-R339 PolarHBondContact O-N 3.07Å; R339-L343 WeakPolarHBondContact O-CB 3.2Å; R339-L343 PolarHBondContact O-N 3.26Å; R339-L424 HydrophobicContact CB-CD2 4.47Å; R339-L424 HydrophobicContact CG-CD2 4.1Å
340	L	87.7	Confident	86.8	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-68.7	-48	174.1	-179.6	59.5	0	0	0	110.9	L297 V300 I304 L316 H336 A337 F342 L343 V344	L297-L340 HydrophobicContact CD1-CD2 3.47Å; L297-L340 VanDerWaalsContact CD1-CD2 3.47Å; V300-L340 HydrophobicContact CG1-CD1 3.81Å; I304-L340 HydrophobicContact CD1-CD1 3.53Å; L316-L340 HydrophobicContact CD1-CB 3.89Å; L316-L340 HydrophobicContact CD1-CD1 4Å; H336-L340 WeakPolarHBondContact O-CB 3.47Å; H336-L340 PolarHBondContact O-N 3.39Å; A337-L340 PolarHBondContact O-N 2.93Å; L340-F342 VanDerWaalsContact C-N 3.29Å; L340-F342 PolarHBondContact O-N 3.36Å; L340-L343 PolarHBondContact O-N 3.4Å; L340-L343 VanDerWaalsContact O-N 3.12Å; L340-V344 HydrophobicContact CD1-CG2 4.36Å; L340-V344 WeakPolarHBondContact O-CG2 3.11Å; L340-V344 PolarHBondContact O-N 2.8Å
341	S	88.5	Confident	85.8	Confident	21 Å²	21	51.9 Å²	51.9	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-41.2	175.6	-162.7	0	0	0	0	111.6	R292 A337 H345	R292-S341 WeakPolarHBondContact CB-OG 3.33Å; R292-S341 PolarHBondContact N-OG 3.48Å; R292-S341 VanDerWaalsContact N-OG 3.1Å; A337-S341 WeakPolarHBondContact O-CB 3.4Å; A337-S341 PolarHBondContact O-N 3.16Å; S341-H345 WeakPolarHBondContact O-CB 3.34Å; S341-H345 PolarHBondContact O-N 3.37Å
342	F	87.2	Confident	84.8	Confident	26 Å²	26	58.5 Å²	58.5	11%	0.114	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-42.6	173.9	-180	-98.6	0	0	0	112.7	V272 Q338 L340 H345 V346 L424	V272-F342 HydrophobicContact CG1-CD2 3.83Å; V272-F342 HydrophobicContact CG1-CE2 3.61Å; V272-F342 HydrophobicContact CG1-CZ 4.35Å; V272-F342 HydrophobicContact CG2-CE2 4.22Å; Q338-F342 WeakPolarHBondContact O-CB 3.4Å; Q338-F342 PolarHBondContact O-N 3.18Å; L340-F342 VanDerWaalsContact C-N 3.29Å; L340-F342 PolarHBondContact O-N 3.36Å; F342-H345 PolarHBondContact O-N 3.31Å; F342-V346 HydrophobicContact CD1-CG2 4.34Å; F342-V346 HydrophobicContact CE1-CG2 3.92Å; F342-V346 HydrophobicContact CE2-CG2 4.43Å; F342-V346 HydrophobicContact CZ-CG2 3.98Å; F342-V346 WeakPolarHBondContact O-CG2 3.3Å; F342-V346 PolarHBondContact O-N 3.45Å; F342-L424 HydrophobicContact CD1-CD2 3.87Å; F342-L424 HydrophobicContact CE1-CD2 4.26Å
343	L	86.9	Confident	84.5	Confident	12 Å²	12	51.3 Å²	51.3	6%	0.063	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-45.4	176.5	-178.5	69.7	0	0	0	111.5	I304 L316 R339 L340 H345 V346 C347 I357 T360 L361	I304-L343 HydrophobicContact CD1-CD2 3.88Å; L316-L343 HydrophobicContact CD1-CD2 4.34Å; L316-L343 HydrophobicContact CD2-CB 4.12Å; L316-L343 HydrophobicContact CD2-CD2 3.92Å; L316-L343 HydrophobicContact CD2-CG 4.5Å; L316-L343 HydrophobicContact CG-CD2 4.19Å; R339-L343 WeakPolarHBondContact O-CB 3.2Å; R339-L343 PolarHBondContact O-N 3.26Å; L340-L343 PolarHBondContact O-N 3.4Å; L340-L343 VanDerWaalsContact O-N 3.12Å; L343-H345 VanDerWaalsContact C-N 3.31Å; L343-H345 PolarHBondContact O-N 2.89Å; L343-V346 PolarHBondContact O-N 3.02Å; L343-C347 PolarHBondContact O-N 3.27Å; L343-C347 PolarHBondContact O-SG 3.21Å; L343-I357 HydrophobicContact CD1-CG2 4.4Å; L343-T360 HydrophobicContact CD1-CG2 3.96Å; L343-L361 HydrophobicContact CD1-CD2 4.49Å; L343-L361 HydrophobicContact CD1-CG 4.3Å; L343-L361 HydrophobicContact CD2-CD2 3.91Å; L343-L361 HydrophobicContact CD2-CG 4.45Å
344	V	87.1	Confident	83.6	Confident	41 Å²	41	53.3 Å²	53.3	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-43.6	175.4	174.6	0	0	0	0	110.5	R292 L340 V346 C347 E348	R292-V344 HydrophobicContact CB-CB 4.22Å; R292-V344 HydrophobicContact CB-CG1 3.97Å; L340-V344 HydrophobicContact CD1-CG2 4.36Å; L340-V344 WeakPolarHBondContact O-CG2 3.11Å; L340-V344 PolarHBondContact O-N 2.8Å; V344-V346 VanDerWaalsContact C-N 3.3Å; V344-V346 PolarHBondContact O-N 2.82Å; V344-C347 WeakPolarHBondContact O-CA 3.3Å; V344-C347 WeakPolarHBondContact O-CB 3.37Å; V344-C347 PolarHBondContact O-N 2.91Å; V344-E348 WeakPolarHBondContact O-CG 3.34Å; V344-E348 PolarHBondContact O-N 3.17Å
345	H	90.7	Very high	82.8	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-33.4	177.2	-161.7	-172.7	0	0	0	113.3	C270 V272 C273 H287 R292 S341 F342 L343 E348	C270-H345 PolarHBondContact SG-CE1 3.28Å; C270-H345 PolarHBondContact SG-NE2 2.79Å; C270-H345 VanDerWaalsContact SG-NE2 3.44Å; V272-H345 HydrophobicContact CG1-CB 3.77Å; V272-H345 WeakPolarHBondContact CG1-ND1 3.45Å; C273-H345 WeakPolarHBondContact CA-O 3.34Å; C273-H345 VanDerWaalsContact CB-O 3.28Å; C273-H345 WeakPolarHBondContact CB-O 3.45Å; H287-H345 AromaticContact CD2-NE2 3.54Å; H287-H345 AromaticContact CE1-NE2 3.84Å; H287-H345 AromaticContact NE2-CD2 3.88Å; H287-H345 AromaticContact NE2-CE1 3.84Å; H287-H345 AromaticContact NE2-NE2 2.91Å; H287-H345 PolarHBondContact NE2-NE2 2.92Å; R292-H345 PolarHBondContact NE-CD2 2.95Å; R292-H345 PolarHBondContact NH2-NE2 3.03Å; S341-H345 WeakPolarHBondContact O-CB 3.34Å; S341-H345 PolarHBondContact O-N 3.37Å; F342-H345 PolarHBondContact O-N 3.31Å; L343-H345 VanDerWaalsContact C-N 3.31Å; L343-H345 PolarHBondContact O-N 2.89Å; H345-E348 IonicContact CD2-OE2 2.94Å
346	V	87.7	Confident	82.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-70	-38.7	170.2	174.1	0	0	0	0	110.9	V272 F342 L343 V344 E348 G349 N353 R356 I357	V272-V346 HydrophobicContact CG1-CG2 3.73Å; F342-V346 HydrophobicContact CD1-CG2 4.34Å; F342-V346 HydrophobicContact CE1-CG2 3.92Å; F342-V346 HydrophobicContact CE2-CG2 4.43Å; F342-V346 HydrophobicContact CZ-CG2 3.98Å; F342-V346 WeakPolarHBondContact O-CG2 3.3Å; F342-V346 PolarHBondContact O-N 3.45Å; L343-V346 PolarHBondContact O-N 3.02Å; V344-V346 VanDerWaalsContact C-N 3.3Å; V344-V346 PolarHBondContact O-N 2.82Å; V346-E348 VanDerWaalsContact C-N 3.25Å; V346-E348 PolarHBondContact O-N 2.88Å; V346-G349 PolarHBondContact O-N 3.2Å; V346-G349 VanDerWaalsContact O-N 3.11Å; V346-N353 HydrophobicContact CG1-CB 3.86Å; V346-N353 VanDerWaalsContact O-CB 3.3Å; V346-N353 WeakPolarHBondContact O-CB 3.44Å; V346-N353 PolarHBondContact O-ND2 3.04Å; V346-R356 HydrophobicContact CG1-CB 3.85Å; V346-I357 HydrophobicContact CG1-CG1 3.96Å
347	C	85	Confident	81.4	Confident	51 Å²	51	45.4 Å²	45.4	35%	0.345	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-26.6	175.8	-64.4	0	0	0	0	113.8	L343 V344 G349 G350 I357	L343-C347 PolarHBondContact O-N 3.27Å; L343-C347 PolarHBondContact O-SG 3.21Å; V344-C347 WeakPolarHBondContact O-CA 3.3Å; V344-C347 WeakPolarHBondContact O-CB 3.37Å; V344-C347 PolarHBondContact O-N 2.91Å; C347-G349 PolarHBondContact O-N 3.15Å; C347-G350 PolarHBondContact O-N 3.06Å; C347-I357 HydrophobicContact CB-CD1 4.36Å
348	E	86.3	Confident	80.4	Confident	68 Å²	68	47.2 Å²	47.2	32%	0.318	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-9.3	173.9	-69.1	167	-145.5	0	0	114	C273 T275 R292 V344 H345 V346	C273-E348 HydrophobicContact CB-CB 4.26Å; T275-E348 PolarHBondContact OG1-O 3.11Å; R292-E348 VanDerWaalsContact CD-OE1 3.28Å; R292-E348 WeakPolarHBondContact CD-OE1 3.43Å; R292-E348 IonicContact CZ-OE1 3.55Å; R292-E348 IonicContact CZ-OE2 2.63Å; R292-E348 IonicContact NE-OE1 3.66Å; R292-E348 IonicContact NE-OE2 2.68Å; R292-E348 IonicContact NH1-OE1 3.76Å; R292-E348 PolarHBondContact NH1-OE1 3.03Å; R292-E348 IonicContact NH1-OE2 2.67Å; R292-E348 PolarHBondContact NH1-OE2 3.28Å; R292-E348 IonicContact NH2-OE2 3.52Å; V344-E348 WeakPolarHBondContact O-CG 3.34Å; V344-E348 PolarHBondContact O-N 3.17Å; H345-E348 IonicContact CD2-OE2 2.94Å; V346-E348 VanDerWaalsContact C-N 3.25Å; V346-E348 PolarHBondContact O-N 2.88Å
349	G	81.8	Confident	79.1	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.1	166.2	0	0	0	0	0	114.9	C273 V346 C347 N353	C273-G349 WeakPolarHBondContact O-CA 3.26Å; V346-G349 PolarHBondContact O-N 3.2Å; V346-G349 VanDerWaalsContact O-N 3.11Å; C347-G349 PolarHBondContact O-N 3.15Å; G349-N353 WeakPolarHBondContact CA-ND2 3.34Å
350	G	80.3	Confident	77.7	Confident	13 Å²	13	42.3 Å²	42.3	13%	0.134	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	61.7	-148.9	-176.7	0	0	0	0	0	113.1	C347 W352 N353	C347-G350 PolarHBondContact O-N 3.06Å; G350-W352 VanDerWaalsContact C-N 3.26Å; G350-W352 PolarHBondContact O-N 3.3Å; G350-N353 PolarHBondContact O-N 3.3Å; G350-N353 VanDerWaalsContact O-N 3.11Å
351	L	70	Confident	76.3	Confident	127 Å²	127	43.6 Å²	43.6	67%	0.665	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-55.7	-35.8	-175.4	-77.5	158.2	0	0	0	113.7	N353 Q354	L351-N353 PolarHBondContact O-N 3.14Å; L351-N353 VanDerWaalsContact O-N 3.1Å; L351-Q354 VanDerWaalsContact O-CB 3.22Å; L351-Q354 WeakPolarHBondContact O-CB 3.1Å; L351-Q354 PolarHBondContact O-N 3.18Å
352	W	66	Low	74.4	Confident	145 Å²	145	47.3 Å²	47.3	55%	0.549	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-55.7	-30.8	178.6	-59.7	104.1	0	0	0	113.2	L256 N259 G350	L256-W352 HydrophobicContact CD2-CB 4.15Å; N259-W352 WeakPolarHBondContact ND2-CZ3 3.26Å; G350-W352 VanDerWaalsContact C-N 3.26Å; G350-W352 PolarHBondContact O-N 3.3Å
353	N	79	Confident	72.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-92.9	5.5	179.1	-77.8	-13.9	0	0	0	114.2	V272 C273 V346 G349 G350 L351 S355 R356 I357	V272-N353 PolarHBondContact O-ND2 3.44Å; C273-N353 PolarHBondContact O-ND2 3.44Å; V346-N353 HydrophobicContact CG1-CB 3.86Å; V346-N353 VanDerWaalsContact O-CB 3.3Å; V346-N353 WeakPolarHBondContact O-CB 3.44Å; V346-N353 PolarHBondContact O-ND2 3.04Å; G349-N353 WeakPolarHBondContact CA-ND2 3.34Å; G350-N353 PolarHBondContact O-N 3.3Å; G350-N353 VanDerWaalsContact O-N 3.11Å; L351-N353 PolarHBondContact O-N 3.14Å; L351-N353 VanDerWaalsContact O-N 3.1Å; N353-S355 VanDerWaalsContact C-N 3.3Å; N353-S355 PolarHBondContact O-N 2.76Å; N353-R356 HydrophobicContact CB-CB 4.48Å; N353-R356 CarbonylContact O-C 3.5Å; N353-R356 WeakPolarHBondContact O-CA 3.26Å; N353-R356 WeakPolarHBondContact O-CB 3.43Å; N353-R356 PolarHBondContact O-N 2.86Å; N353-R356 VanDerWaalsContact OD1-CD 3.23Å; N353-R356 WeakPolarHBondContact OD1-CD 3.42Å; N353-R356 PolarHBondContact OD1-NH1 3.15Å; N353-I357 WeakPolarHBondContact O-CG1 3.42Å; N353-I357 PolarHBondContact O-N 3.05Å
354	Q	70.6	Confident	69.4	Low	97 Å²	97	53 Å²	53	45%	0.453	29%	0.287	S	S	.	.	H	α-helix	trans	-55.4	-41.5	-178.6	-169.5	176.2	11.6	0	0	112.8	L351 R356 I357 L358	L351-Q354 VanDerWaalsContact O-CB 3.22Å; L351-Q354 WeakPolarHBondContact O-CB 3.1Å; L351-Q354 PolarHBondContact O-N 3.18Å; Q354-R356 VanDerWaalsContact C-N 3.33Å; Q354-R356 PolarHBondContact O-N 3.07Å; Q354-I357 PolarHBondContact O-N 3.1Å; Q354-L358 HydrophobicContact CG-CD1 4.37Å; Q354-L358 WeakPolarHBondContact O-CG 3.48Å; Q354-L358 PolarHBondContact O-N 2.95Å
355	S	68.2	Low	66.5	Low	59 Å²	59	59 Å²	59	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-39.6	172.5	176.6	0	0	0	0	112.8	S252 N353 S359	S252-S355 PolarHBondContact OG-OG 2.8Å; S252-S355 VanDerWaalsContact OG-OG 3.13Å; N353-S355 VanDerWaalsContact C-N 3.3Å; N353-S355 PolarHBondContact O-N 2.76Å; S355-S359 WeakPolarHBondContact O-CB 3.26Å; S355-S359 PolarHBondContact O-N 2.72Å; S355-S359 VanDerWaalsContact O-N 3.14Å; S355-S359 PolarHBondContact O-OG 3.39Å
356	R	71	Confident	63.5	Low	40 Å²	40	65.7 Å²	65.7	15%	0.151	35%	0.349	C	S	.	.	H	α-helix	trans	-70.9	-35	176.8	-63.3	169.8	73.2	176.9	10	111.9	L256 Q271 V272 C274 V346 N353 Q354 S359 T360	L256-R356 HydrophobicContact CD1-CG 4.32Å; Q271-R356 PolarHBondContact O-NH1 2.96Å; Q271-R356 PolarHBondContact O-NH2 2.97Å; V272-R356 PolarHBondContact O-NH1 2.53Å; V272-R356 VanDerWaalsContact O-NH1 3.13Å; V272-R356 PolarHBondContact O-NH2 3.29Å; C274-R356 PolarHBondContact SG-NH1 3.46Å; V346-R356 HydrophobicContact CG1-CB 3.85Å; N353-R356 HydrophobicContact CB-CB 4.48Å; N353-R356 CarbonylContact O-C 3.5Å; N353-R356 WeakPolarHBondContact O-CA 3.26Å; N353-R356 WeakPolarHBondContact O-CB 3.43Å; N353-R356 PolarHBondContact O-N 2.86Å; N353-R356 VanDerWaalsContact OD1-CD 3.23Å; N353-R356 WeakPolarHBondContact OD1-CD 3.42Å; N353-R356 PolarHBondContact OD1-NH1 3.15Å; Q354-R356 VanDerWaalsContact C-N 3.33Å; Q354-R356 PolarHBondContact O-N 3.07Å; R356-S359 WeakPolarHBondContact CA-OG 3.43Å; R356-S359 PolarHBondContact O-OG 3.31Å; R356-S359 VanDerWaalsContact O-OG 3.13Å; R356-T360 WeakPolarHBondContact O-CB 3.49Å; R356-T360 PolarHBondContact O-N 3.09Å; R356-T360 PolarHBondContact O-OG1 3.5Å
357	I	75.1	Confident	60.6	Low	39 Å²	39	74 Å²	74	20%	0.2	38%	0.384	C	S	.	.	H	α-helix	trans	-67.6	-49	176.5	-64.6	164.4	0	0	0	110.4	L343 V346 C347 N353 Q354 S359 T360 L361	L343-I357 HydrophobicContact CD1-CG2 4.4Å; V346-I357 HydrophobicContact CG1-CG1 3.96Å; C347-I357 HydrophobicContact CB-CD1 4.36Å; N353-I357 WeakPolarHBondContact O-CG1 3.42Å; N353-I357 PolarHBondContact O-N 3.05Å; Q354-I357 PolarHBondContact O-N 3.1Å; I357-S359 PolarHBondContact O-N 3.29Å; I357-T360 PolarHBondContact O-N 3.31Å; I357-L361 HydrophobicContact CG2-CD1 3.93Å; I357-L361 PolarHBondContact O-N 3.16Å
358	L	65.4	Low	57.8	Low	67 Å²	67	78.7 Å²	78.7	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-58.6	-48.1	178.9	-72.7	166.9	0	0	0	112	Q354 L361 N362 I363	Q354-L358 HydrophobicContact CG-CD1 4.37Å; Q354-L358 WeakPolarHBondContact O-CG 3.48Å; Q354-L358 PolarHBondContact O-N 2.95Å; L358-L361 PolarHBondContact O-N 3.27Å; L358-N362 PolarHBondContact O-N 2.92Å; L358-I363 HydrophobicContact CD2-CB 4.27Å; L358-I363 HydrophobicContact CD2-CG2 4.32Å; L358-I363 PolarHBondContact O-N 2.92Å
359	S	59.6	Low	54.9	Low	49 Å²	49	82.5 Å²	82.5	34%	0.343	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-35	176.4	52.2	0	0	0	0	113.2	S355 R356 I357	S355-S359 WeakPolarHBondContact O-CB 3.26Å; S355-S359 PolarHBondContact O-N 2.72Å; S355-S359 VanDerWaalsContact O-N 3.14Å; S355-S359 PolarHBondContact O-OG 3.39Å; R356-S359 WeakPolarHBondContact CA-OG 3.43Å; R356-S359 PolarHBondContact O-OG 3.31Å; R356-S359 VanDerWaalsContact O-OG 3.13Å; I357-S359 PolarHBondContact O-N 3.29Å
360	T	58.6	Low	52.1	Low	25 Å²	25	88.2 Å²	88.2	15%	0.153	46%	0.455	C	S	.	.	H	α-helix	trans	-67.5	-34.3	174.9	-62.5	0	0	0	0	112.6	L343 R356 I357 L424	L343-T360 HydrophobicContact CD1-CG2 3.96Å; R356-T360 WeakPolarHBondContact O-CB 3.49Å; R356-T360 PolarHBondContact O-N 3.09Å; R356-T360 PolarHBondContact O-OG1 3.5Å; I357-T360 PolarHBondContact O-N 3.31Å; T360-L424 HydrophobicContact CG2-CD2 4.14Å
361	L	58.1	Low	49.4	Very low	27 Å²	27	95.2 Å²	95.2	14%	0.141	49%	0.488	C	S	.	.	H	α-helix	trans	-88.5	-6.5	-178.6	-70.5	172.9	0	0	0	114.5	K315 L316 L343 I357 L358 I363	K315-L361 HydrophobicContact CB-CD2 4.37Å; L316-L361 HydrophobicContact CD2-CD2 4.34Å; L316-L361 HydrophobicContact CG-CD2 4.41Å; L343-L361 HydrophobicContact CD1-CD2 4.49Å; L343-L361 HydrophobicContact CD1-CG 4.3Å; L343-L361 HydrophobicContact CD2-CD2 3.91Å; L343-L361 HydrophobicContact CD2-CG 4.45Å; I357-L361 HydrophobicContact CG2-CD1 3.93Å; I357-L361 PolarHBondContact O-N 3.16Å; L358-L361 PolarHBondContact O-N 3.27Å; L361-I363 HydrophobicContact CB-CD1 3.81Å; L361-I363 HydrophobicContact CB-CG1 3.83Å; L361-I363 HydrophobicContact CD1-CD1 3.9Å; L361-I363 PolarHBondContact O-N 3.3Å
362	N	48.3	Very low	47.3	Very low	99 Å²	99	93.8 Å²	93.8	53%	0.529	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	40.7	-169.7	-81.3	-73.9	0	0	0	112.5	L358 C364	L358-N362 PolarHBondContact O-N 2.92Å; N362-C364 PolarHBondContact O-N 2.8Å
363	I	39.5	Very low	45.2	Very low	46 Å²	46	94.9 Å²	94.9	24%	0.236	51%	0.505	C	S	.	.			trans	-85.8	92.2	170.7	-61.3	170.7	0	0	0	106.6	L358 L361	L358-I363 HydrophobicContact CD2-CB 4.27Å; L358-I363 HydrophobicContact CD2-CG2 4.32Å; L358-I363 PolarHBondContact O-N 2.92Å; L361-I363 HydrophobicContact CB-CD1 3.81Å; L361-I363 HydrophobicContact CB-CG1 3.83Å; L361-I363 HydrophobicContact CD1-CD1 3.9Å; L361-I363 PolarHBondContact O-N 3.3Å
364	C	29.5	Very low	42.7	Very low	112 Å²	112	100.2 Å²	100.2	76%	0.757	53%	0.534	S	S	*	.			trans	-59.4	137.1	160.3	-61.9	0	0	0	0	108.1	N362 N366	N362-C364 PolarHBondContact O-N 2.8Å; C364-N366 PolarHBondContact O-N 3.13Å; C364-N366 VanDerWaalsContact O-N 3.08Å
365	E	26.6	Very low	40.5	Very low	167 Å²	167	103.1 Å²	103.1	78%	0.78	55%	0.553	S	S	*	*	S	Bend	trans	-55.9	115.4	-177.8	-65.3	172.3	124.8	0	0	111
366	N	26.3	Very low	38.4	Very low	147 Å²	147	107.6 Å²	107.6	79%	0.786	57%	0.572	S	S	*	*	S	Bend	trans	179.3	116.2	157.3	-101.9	-73.8	0	0	0	107.3	C364	C364-N366 PolarHBondContact O-N 3.13Å; C364-N366 VanDerWaalsContact O-N 3.08Å
367	K	27.9	Very low	36.2	Very low	174 Å²	174	111.8 Å²	111.8	76%	0.757	60%	0.601	S	S	*	*	S	Bend	trans	70	47.2	174.2	-49	-169.1	175.4	-160.5	0	118.7
368	M	25.3	Very low	33.7	Very low	151 Å²	151	118.5 Å²	118.5	74%	0.744	63%	0.632	S	S	*	*	S	Bend	trans	-138.2	31	155.4	-72.7	-81.5	82.5	0	0	111.4
369	L	25.6	Very low	31.6	Very low	148 Å²	148	120.4 Å²	120.4	78%	0.775	65%	0.65	S	S	*	*	S	Bend	trans	-146.4	66.1	175.7	-103.6	166.1	0	0	0	106.7
370	D	23.8	Very low	29.8	Very low	120 Å²	120	121.7 Å²	121.7	64%	0.642	66%	0.659	S	S	*	*			trans	-166.7	151.3	177.5	-97	-45.6	0	0	0	106.5
371	I	24.3	Very low	28.1	Very low	161 Å²	161	125.7 Å²	125.7	83%	0.826	68%	0.683	S	S	*	*	S	Bend	trans	69.8	106.8	-160.4	-45.8	165.7	0	0	0	110.2
372	S	23.9	Very low	26.5	Very low	97 Å²	97	128.6 Å²	128.6	68%	0.678	70%	0.702	S	S	*	*	S	Bend	cis	-143.4	113.9	4.9	55.8	0	0	0	0	112.9
373	N	23.7	Very low	25.4	Very low	168 Å²	168	133.1 Å²	133.1	90%	0.898	72%	0.717	S	S	*	*	S	Bend	trans	-149.5	97.5	136	-146.4	6.8	0	0	0	107.8
374	N	26.1	Very low	24.7	Very low	112 Å²	112	134 Å²	134	60%	0.599	74%	0.738	S	S	*	*			trans	-157.1	111.2	-173.2	-127.7	-27.8	0	0	0	111.3
375	N	25	Very low	24.6	Very low	158 Å²	158	137.1 Å²	137.1	85%	0.845	74%	0.741	S	S	*	*			trans	-154.8	132.6	139.5	-98.5	-33.7	0	0	0	107.8
376	N	22.8	Very low	24.5	Very low	152 Å²	152	135 Å²	135	81%	0.813	74%	0.735	S	S	*	*	S	Bend	trans	74	105	-159	-51.4	-31.3	0	0	0	112.4
377	V	24.4	Very low	24.4	Very low	128 Å²	128	138.3 Å²	138.3	78%	0.776	74%	0.738	S	S	*	*			cis	-140.5	150.5	17.5	179.7	0	0	0	0	112.5
378	Q	23.2	Very low	24.2	Very low	180 Å²	180	136.7 Å²	136.7	84%	0.841	74%	0.737	S	S	*	*			trans	-55.2	134.2	176.1	-77.3	159.9	-78.5	0	0	113.4
379	C	21.1	Very low	24.2	Very low	107 Å²	107	136.2 Å²	136.2	72%	0.723	74%	0.742	S	S	*	*				61.7	122.1	84.9	-163.8	0	0	0	0	113.2
380	S	21.7	Very low	24.2	Very low	77 Å²	77	134.9 Å²	134.9	54%	0.538	75%	0.745	S	S	.	*				-171.5	-176.3	84.5	-66.2	0	0	0	0	114.4
381	T	22.7	Very low	24.3	Very low	108 Å²	108	134 Å²	134	66%	0.663	75%	0.748	S	S	*	*			trans	-125.4	144.4	-159.7	47.5	0	0	0	0	118.1
382	T	24.6	Very low	24.3	Very low	88 Å²	88	134.4 Å²	134.4	54%	0.54	75%	0.749	S	S	.	*			trans	76.8	131.4	138.2	51.4	0	0	0	0	124.8
383	K	26.1	Very low	24.3	Very low	195 Å²	195	134.9 Å²	134.9	85%	0.848	74%	0.744	S	S	*	*			trans	72.7	140.3	146.6	-62.2	152.9	-173.2	168.9	0	118.6
384	G	25.4	Very low	24.4	Very low	65 Å²	65	132.3 Å²	132.3	67%	0.67	73%	0.729	S	S	*	*			cis	150.2	167.3	-12.9	0	0	0	0	0	114.9
385	Q	26	Very low	24.2	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.822	74%	0.736	S	S	*	*			trans	68.7	140.2	164.1	-61.4	-164.8	-77.1	0	0	117.4
386	N	25	Very low	24.2	Very low	122 Å²	122	131 Å²	131	65%	0.652	73%	0.731	S	S	*	*			cis	-152.8	148.2	-6.1	-85.8	-36.1	0	0	0	108.6
387	Y	24.4	Very low	24.4	Very low	217 Å²	217	130 Å²	130	85%	0.851	73%	0.726	S	S	*	*			trans	-166.3	116.5	131.5	-102.4	-68.2	0	0	0	110.5
388	I	23.2	Very low	24.3	Very low	141 Å²	141	132.1 Å²	132.1	72%	0.723	73%	0.732	S	S	*	*			trans	28.8	102.9	153.1	-51.7	169.3	0	0	0	115.5
389	T	24.7	Very low	24.4	Very low	141 Å²	141	128.9 Å²	128.9	87%	0.865	72%	0.724	S	S	*	*				-141.2	166.8	76.1	31.5	0	0	0	0	113.9
390	S	26.3	Very low	24.7	Very low	119 Å²	119	128.9 Å²	128.9	83%	0.832	72%	0.721	S	S	*	*			trans	-103.8	154.7	-154.6	-54.6	0	0	0	0	115.9
391	S	25.4	Very low	24.9	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	74%	0.738	S	S	*	*			trans	-76.3	152.9	175.7	56.8	0	0	0	0	114.9
392	M	24.6	Very low	25.7	Very low	170 Å²	170	135.6 Å²	135.6	84%	0.837	74%	0.74	S	S	*	*			trans	71.2	134.3	167.5	-61.5	-178.1	178.9	0	0	115.2
393	N	23.5	Very low	25.7	Very low	108 Å²	108	137.6 Å²	137.6	58%	0.578	75%	0.748	S	S	*	*			cis	-158.4	146	25.8	-105.3	-33.8	0	0	0	113.4
394	I	25.8	Very low	25.7	Very low	113 Å²	113	135.2 Å²	135.2	58%	0.579	75%	0.745	S	S	*	*			trans	44.6	134.4	133	-60.7	175.3	0	0	0	121	C415	I394-C415 HydrophobicContact CD1-CB 4.34Å
395	T	23.4	Very low	25.6	Very low	124 Å²	124	137.3 Å²	137.3	76%	0.761	75%	0.749	S	S	*	*			trans	66.5	145.5	167.6	50.1	0	0	0	0	117.3
396	T	24	Very low	25.6	Very low	120 Å²	120	133.8 Å²	133.8	74%	0.736	74%	0.743	S	S	*	*			cis	-154.9	147.2	0.2	-2.9	0	0	0	0	110.1
397	N	26.4	Very low	25.6	Very low	131 Å²	131	135.8 Å²	135.8	70%	0.701	75%	0.754	S	S	*	*			trans	-163.8	76.1	147.2	-109.7	-20.5	0	0	0	112.9	T399	N397-T399 WeakPolarHBondContact OD1-CG2 3.39Å; N397-T399 PolarHBondContact OD1-OG1 3.49Å
398	L	24.1	Very low	25.6	Very low	172 Å²	172	131.6 Å²	131.6	90%	0.901	75%	0.751	S	S	*	*			trans	-101.8	76.8	137	-106.1	82	0	0	0	106.5	T400	L398-T400 PolarHBondContact O-N 2.67Å
399	T	25.2	Very low	25.7	Very low	112 Å²	112	128.4 Å²	128.4	69%	0.687	75%	0.753	S	S	*	*			trans	-78.3	96.9	166.2	21	0	0	0	0	107.6	N397 H401	N397-T399 WeakPolarHBondContact OD1-CG2 3.39Å; N397-T399 PolarHBondContact OD1-OG1 3.49Å; T399-H401 PolarHBondContact O-N 2.97Å
400	T	26.2	Very low	25.7	Very low	107 Å²	107	128.1 Å²	128.1	66%	0.656	75%	0.746	S	S	*	*			trans	-51.3	137.6	163.6	49.3	0	0	0	0	109.5	L398 N402	L398-T400 PolarHBondContact O-N 2.67Å; T400-N402 PolarHBondContact O-N 3.33Å
401	H	26.1	Very low	25.8	Very low	191 Å²	191	128.9 Å²	128.9	88%	0.884	74%	0.741	S	S	*	*			trans	-59.3	103.2	162.3	-101.2	-67.2	0	0	0	108.6	T399	T399-H401 PolarHBondContact O-N 2.97Å
402	N	38.8	Very low	25.7	Very low	134 Å²	134	129.2 Å²	129.2	72%	0.717	74%	0.743	S	S	*	*			trans	-147.4	80.9	179.1	-149.3	13.5	0	0	0	108.8	T400	T400-N402 PolarHBondContact O-N 3.33Å
403	N	25.4	Very low	25.8	Very low	131 Å²	131	126.5 Å²	126.5	70%	0.701	74%	0.741	S	S	*	*			trans	-95.4	124.7	173.1	-64.2	-8.3	0	0	0	106.2
404	N	25.2	Very low	25.9	Very low	145 Å²	145	127.8 Å²	127.8	78%	0.775	75%	0.748	S	S	*	*			cis	-137.3	153.1	39.4	-71.8	-48.9	0	0	0	116.4
405	S	24	Very low	25.7	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	75%	0.747	S	S	*	*			trans	83.3	128.3	140.9	65.9	0	0	0	0	122.9
406	S	26.3	Very low	25.7	Very low	101 Å²	101	126.1 Å²	126.1	71%	0.706	74%	0.741	S	S	*	*			trans	78.9	79.7	145.6	44.8	0	0	0	0	121.8
407	N	25.8	Very low	25.6	Very low	164 Å²	164	126 Å²	126	88%	0.877	74%	0.736	S	S	*	*				75.7	129.2	123.8	-67	11.7	0	0	0	122.8
408	V	23	Very low	25.6	Very low	130 Å²	130	126.2 Å²	126.2	79%	0.788	74%	0.742	S	S	*	*			trans	-87.2	151.3	170.4	171.6	0	0	0	0	111.1	N410	V408-N410 WeakPolarHBondContact CG1-OD1 3.12Å
409	G	26.3	Very low	25.6	Very low	74 Å²	74	124.3 Å²	124.3	76%	0.763	73%	0.726	S	S	*	*			trans	-143.4	125.7	159.9	0	0	0	0	0	109.4
410	N	24	Very low	25.6	Very low	134 Å²	134	124.3 Å²	124.3	72%	0.717	72%	0.722	S	S	*	*			trans	-81.2	152.1	-164.1	-68.7	-33.9	0	0	0	114.5	V408	V408-N410 WeakPolarHBondContact CG1-OD1 3.12Å
411	N	27.9	Very low	25.5	Very low	136 Å²	136	124.7 Å²	124.7	73%	0.727	72%	0.72	S	S	*	*				-160	157.4	126.7	-117.5	-82.5	0	0	0	112.2	E1438	N411-E1438 PolarHBondContact ND2-OE1 2.74Å
412	S	23.1	Very low	25.7	Very low	108 Å²	108	122.9 Å²	122.9	76%	0.755	71%	0.71	S	S	*	*			trans	-116.7	152.6	-163.1	67.2	0	0	0	0	114.5
413	S	26.6	Very low	25.4	Very low	113 Å²	113	122.1 Å²	122.1	79%	0.79	71%	0.706	S	S	*	*			trans	-166.7	130.7	153.3	46.7	0	0	0	0	115.4
414	N	26.1	Very low	26.4	Very low	134 Å²	134	118.2 Å²	118.2	72%	0.717	68%	0.684	S	S	*	*			trans	45.7	81.1	151.6	-80.3	-42.1	0	0	0	120.7	N416	N414-N416 PolarHBondContact O-N 3.24Å; N414-N416 PolarHBondContact OD1-ND2 3.35Å
415	C	22	Very low	27.3	Very low	84 Å²	84	116.7 Å²	116.7	57%	0.568	68%	0.681	S	S	*	*			trans	-72.5	64.8	148	48.4	0	0	0	0	111.8	I394	I394-C415 HydrophobicContact CD1-CB 4.34Å
416	N	22.3	Very low	28.8	Very low	118 Å²	118	113.3 Å²	113.3	63%	0.631	66%	0.657	S	S	*	*			trans	-127	127.2	178.2	-102	-55.7	0	0	0	111.3	N414	N414-N416 PolarHBondContact O-N 3.24Å; N414-N416 PolarHBondContact OD1-ND2 3.35Å
417	N	23.5	Very low	30.7	Very low	119 Å²	119	111.4 Å²	111.4	64%	0.636	64%	0.644	S	S	*	*			trans	81.4	57.1	-168.1	-54	-101	0	0	0	116.3	K419	N417-K419 HydrophobicContact CB-CG 4.4Å; N417-K419 PolarHBondContact O-N 3.36Å; N417-K419 WeakPolarHBondContact OD1-CE 3.3Å; N417-K419 PolarHBondContact OD1-NZ 2.93Å
418	V	25	Very low	32.9	Very low	135 Å²	135	105.3 Å²	105.3	82%	0.818	61%	0.611	S	S	*	*			trans	-70.9	89.2	137.3	-179.1	0	0	0	0	106.6
419	K	25.5	Very low	35.9	Very low	132 Å²	132	101.2 Å²	101.2	57%	0.574	58%	0.583	S	S	*	*			trans	-84.2	117.2	163.8	-78.8	175.6	175.6	158.2	0	106.9	N417 N421	N417-K419 HydrophobicContact CB-CG 4.4Å; N417-K419 PolarHBondContact O-N 3.36Å; N417-K419 WeakPolarHBondContact OD1-CE 3.3Å; N417-K419 PolarHBondContact OD1-NZ 2.93Å; K419-N421 PolarHBondContact O-N 3.13Å
420	N	24.8	Very low	39.1	Very low	112 Å²	112	97.7 Å²	97.7	60%	0.599	55%	0.547	S	S	*	.			trans	-67	74.5	168.5	-72.4	-3.7	0	0	0	109.4	F422	N420-F422 PolarHBondContact O-N 3.09Å
421	N	24.8	Very low	42.3	Very low	114 Å²	114	91.4 Å²	91.4	61%	0.61	51%	0.513	S	S	*	.			trans	-78.8	70.6	175.1	-70.5	-34.3	0	0	0	109.1	K419 N423	K419-N421 PolarHBondContact O-N 3.13Å; N421-N423 VanDerWaalsContact C-N 3.32Å; N421-N423 PolarHBondContact O-N 3.43Å
422	F	29.8	Very low	45.5	Very low	153 Å²	153	84.9 Å²	84.9	67%	0.671	48%	0.478	S	S	*	.			trans	-56.9	107.3	146.9	-90.4	-79.3	0	0	0	106.4	N420 L424	N420-F422 PolarHBondContact O-N 3.09Å; F422-L424 VanDerWaalsContact C-N 3.35Å; F422-L424 PolarHBondContact O-N 3.15Å
423	N	32.7	Very low	48.7	Very low	119 Å²	119	79.9 Å²	79.9	64%	0.636	44%	0.443	S	S	*	.			trans	-78.9	85.6	-173.3	-101.5	-32.4	0	0	0	109.2	N421 T425	N421-N423 VanDerWaalsContact C-N 3.32Å; N421-N423 PolarHBondContact O-N 3.43Å; N423-T425 HydrophobicContact CB-CG2 3.83Å; N423-T425 WeakPolarHBondContact O-CB 3.36Å; N423-T425 PolarHBondContact O-N 3.4Å; N423-T425 PolarHBondContact O-OG1 3.35Å
424	L	45.9	Very low	51.8	Low	48 Å²	48	74.5 Å²	74.5	25%	0.251	41%	0.405	S	S	.	.			trans	-59.3	84.9	166.2	-70.9	102.7	0	0	0	109.5	R339 F342 T360 F422	R339-L424 HydrophobicContact CB-CD2 4.47Å; R339-L424 HydrophobicContact CG-CD2 4.1Å; F342-L424 HydrophobicContact CD1-CD2 3.87Å; F342-L424 HydrophobicContact CE1-CD2 4.26Å; T360-L424 HydrophobicContact CG2-CD2 4.14Å; F422-L424 VanDerWaalsContact C-N 3.35Å; F422-L424 PolarHBondContact O-N 3.15Å
425	T	44	Very low	54.9	Low	114 Å²	114	69.3 Å²	69.3	70%	0.699	38%	0.379	S	S	*	.			trans	-133.7	-12.3	-167.7	50.4	0	0	0	0	114.3	N423	N423-T425 HydrophobicContact CB-CG2 3.83Å; N423-T425 WeakPolarHBondContact O-CB 3.36Å; N423-T425 PolarHBondContact O-N 3.4Å; N423-T425 PolarHBondContact O-OG1 3.35Å
426	S	55.9	Low	58	Low	38 Å²	38	68.6 Å²	68.6	27%	0.266	37%	0.37	S	S	.	.			trans	-137.4	134	166.5	-171.4	0	0	0	0	109	I428	S426-I428 PolarHBondContact OG-N 2.9Å; S426-I428 VanDerWaalsContact OG-N 3.08Å; S426-I428 PolarHBondContact OG-O 3.46Å
427	S	65.6	Low	61.3	Low	61 Å²	61	66.1 Å²	66.1	43%	0.427	36%	0.356	S	S	.	.	S	Bend	trans	-82.7	-19.7	163.2	49	0	0	0	0	112.1	V272	V272-S427 WeakPolarHBondContact CG2-O 3.29Å
428	I	72.8	Confident	64.4	Low	35 Å²	35	67.2 Å²	67.2	18%	0.179	36%	0.356	C	S	.	.			trans	-91.5	120	-179.2	-55.6	-179.5	0	0	0	108.9	V288 E289 S426 L430 T440 V442	V288-I428 HydrophobicContact CG1-CB 4.05Å; V288-I428 HydrophobicContact CG1-CG1 4.1Å; V288-I428 HydrophobicContact CG1-CG2 3.86Å; E289-I428 HydrophobicContact CG-CD1 4.31Å; S426-I428 PolarHBondContact OG-N 2.9Å; S426-I428 VanDerWaalsContact OG-N 3.08Å; S426-I428 PolarHBondContact OG-O 3.46Å; I428-L430 HydrophobicContact CG2-CD1 4.2Å; I428-L430 HydrophobicContact CG2-CG 4.13Å; I428-T440 WeakPolarHBondContact O-CA 3.39Å; I428-T440 WeakPolarHBondContact O-CB 3.4Å; I428-T440 WeakPolarHBondContact O-CG2 3.22Å; I428-V442 HydrophobicContact CD1-CG2 4.27Å; I428-V442 HydrophobicContact CG2-CG2 4.14Å
429	Q	86.3	Confident	67.5	Low	44 Å²	44	61.5 Å²	61.5	21%	0.206	32%	0.321	C	S	.	.			trans	-142.5	111.2	172.3	-54.9	-170.7	-43.3	0	0	108.9	Q271 V272 T440	Q271-Q429 HydrophobicContact CB-CB 3.74Å; Q271-Q429 HydrophobicContact CG-CB 4.14Å; Q271-Q429 PolarHBondContact N-O 3.34Å; V272-Q429 HydrophobicContact CG2-CB 3.77Å; V272-Q429 HydrophobicContact CG2-CG 3.98Å; Q429-T440 HydrophobicContact CG-CG2 4.49Å
430	L	91.9	Very high	70.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.9	-174.8	-60.4	166.6	0	0	0	109.2	L284 V288 I428 F438 T439 V442 F445	L284-L430 HydrophobicContact CD1-CD2 4.49Å; L284-L430 HydrophobicContact CD2-CD2 3.83Å; L284-L430 HydrophobicContact CG-CD2 3.75Å; V288-L430 HydrophobicContact CB-CD2 4.4Å; V288-L430 HydrophobicContact CG2-CD2 3.95Å; I428-L430 HydrophobicContact CG2-CD1 4.2Å; I428-L430 HydrophobicContact CG2-CG 4.13Å; L430-F438 CarbonylContact O-C 3.5Å; L430-F438 WeakPolarHBondContact O-CA 3.28Å; L430-T439 HydrophobicContact CB-CG2 4.1Å; L430-T439 PolarHBondContact N-O 3.11Å; L430-T439 PolarHBondContact O-N 3.35Å; L430-V442 HydrophobicContact CD1-CG2 4.14Å; L430-F445 HydrophobicContact CB-CD1 3.9Å; L430-F445 HydrophobicContact CB-CD2 4.23Å; L430-F445 HydrophobicContact CB-CE1 4.1Å; L430-F445 HydrophobicContact CB-CE2 4.36Å; L430-F445 HydrophobicContact CB-CG 4Å; L430-F445 HydrophobicContact CB-CZ 4.31Å; L430-F445 HydrophobicContact CD1-CB 3.83Å; L430-F445 HydrophobicContact CD1-CD1 3.9Å; L430-F445 HydrophobicContact CD1-CG 4Å; L430-F445 HydrophobicContact CG-CD1 4.34Å
431	Y	92.7	Very high	73.5	Confident	2 Å²	2	56 Å²	56	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133	-179.4	-178.9	-125.3	0	0	0	111.5	L257 L260 T261 A269 I433 D436 L437 F438	L257-Y431 HydrophobicContact CD1-CD1 3.87Å; L257-Y431 HydrophobicContact CD1-CE1 3.52Å; L257-Y431 HydrophobicContact CD1-CE2 4.24Å; L257-Y431 HydrophobicContact CD1-CG 4.37Å; L257-Y431 HydrophobicContact CD2-CE2 4.23Å; L257-Y431 HydrophobicContact CG-CE1 4.05Å; L260-Y431 HydrophobicContact CD2-CD1 4.32Å; T261-Y431 HydrophobicContact CG2-CE1 4.04Å; T261-Y431 WeakPolarHBondContact CG2-OH 3.42Å; A269-Y431 HydrophobicContact CB-CD1 4.41Å; A269-Y431 PolarHBondContact N-O 2.82Å; A269-Y431 PolarHBondContact O-N 2.83Å; Y431-I433 HydrophobicContact CD1-CG1 3.71Å; Y431-I433 HydrophobicContact CE1-CB 4.26Å; Y431-I433 HydrophobicContact CE1-CG1 3.52Å; Y431-D436 VanDerWaalsContact CE2-OD1 3.26Å; Y431-D436 WeakPolarHBondContact CE2-OD1 3.49Å; Y431-D436 PolarHBondContact OH-OD1 2.84Å; Y431-L437 WeakPolarHBondContact CA-O 3.44Å; Y431-F438 HydrophobicContact CD2-CB 4.16Å
432	C	94.7	Very high	76.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	105.9	169.3	177	0	0	0	0	108.2	P267 L268 A434 C435 D436 L437 F445 H448 H454	P267-C432 CarbonylContact O-C 3.34Å; P267-C432 WeakPolarHBondContact O-CA 3.24Å; L268-C432 HydrophobicContact CD2-CB 4.39Å; C432-A434 VanDerWaalsContact C-N 3.34Å; C432-C435 HydrophobicContact CB-CB 4.37Å; C432-C435 PolarHBondContact O-N 3.32Å; C432-C435 PolarHBondContact SG-N 3.04Å; C432-C435 VanDerWaalsContact SG-SG 3.67Å; C432-D436 WeakPolarHBondContact O-CA 3.45Å; C432-D436 PolarHBondContact O-N 3.1Å; C432-L437 HydrophobicContact CB-CB 4.33Å; C432-L437 PolarHBondContact N-O 3.12Å; C432-L437 PolarHBondContact O-N 3.11Å; C432-L437 VanDerWaalsContact O-N 3.12Å; C432-F445 HydrophobicContact CB-CE2 3.65Å; C432-F445 HydrophobicContact CB-CZ 3.75Å; C432-H448 PolarHBondContact SG-NE2 3.4Å; C432-H448 VanDerWaalsContact SG-NE2 3.42Å; C432-H454 PolarHBondContact SG-CE1 2.98Å
433	I	90.6	Very high	79.5	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-43.8	179	-67	154.2	0	0	0	110.5	T261 A264 H266 P267 A269 Y431 C435 D436 F461	T261-I433 HydrophobicContact CG2-CG1 4.41Å; T261-I433 HydrophobicContact CG2-CG2 3.8Å; A264-I433 HydrophobicContact CB-CD1 3.45Å; A264-I433 VanDerWaalsContact CB-CD1 3.45Å; H266-I433 WeakPolarHBondContact O-CD1 3.37Å; P267-I433 PolarHBondContact O-N 3.39Å; A269-I433 HydrophobicContact CB-CD1 3.75Å; A269-I433 HydrophobicContact CB-CG1 4.25Å; Y431-I433 HydrophobicContact CD1-CG1 3.71Å; Y431-I433 HydrophobicContact CE1-CB 4.26Å; Y431-I433 HydrophobicContact CE1-CG1 3.52Å; I433-C435 PolarHBondContact O-N 3.26Å; I433-D436 PolarHBondContact O-N 3.44Å; I433-F461 HydrophobicContact CB-CE2 4.26Å; I433-F461 HydrophobicContact CG2-CD2 3.98Å; I433-F461 HydrophobicContact CG2-CE2 3.4Å; I433-F461 HydrophobicContact CG2-CZ 4.11Å
434	A	90.3	Very high	82.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.6	-178.3	0	0	0	0	0	112.6	P267 C432 A457 V458 F461 H591	P267-A434 HydrophobicContact CB-CB 3.96Å; C432-A434 VanDerWaalsContact C-N 3.34Å; A434-A457 HydrophobicContact CB-CB 4.02Å; A434-V458 HydrophobicContact CB-CG2 4.03Å; A434-F461 HydrophobicContact CB-CB 3.9Å; A434-F461 HydrophobicContact CB-CG 4.23Å; A434-H591 PolarHBondContact O-CE1 2.89Å; A434-H591 PolarHBondContact O-NE2 3.2Å
435	C	91	Very high	84.5	Confident	25 Å²	25	48.2 Å²	48.2	17%	0.169	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	5.9	-175	-56.9	0	0	0	0	115	C432 I433 L437 H448 A457	C432-C435 HydrophobicContact CB-CB 4.37Å; C432-C435 PolarHBondContact O-N 3.32Å; C432-C435 PolarHBondContact SG-N 3.04Å; C432-C435 VanDerWaalsContact SG-SG 3.67Å; I433-C435 PolarHBondContact O-N 3.26Å; C435-L437 HydrophobicContact CB-CB 4.42Å; C435-L437 PolarHBondContact O-N 3.25Å; C435-H448 WeakPolarHBondContact CB-CE1 3.47Å; C435-H448 WeakPolarHBondContact CB-NE2 3.37Å; C435-H448 PolarHBondContact SG-CE1 3.04Å; C435-A457 VanDerWaalsContact SG-CB 3.54Å
436	D	88.5	Confident	86.9	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.374	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	29.2	-168.2	-161	32.1	0	0	0	114.9	Y431 C432 I433	Y431-D436 VanDerWaalsContact CE2-OD1 3.26Å; Y431-D436 WeakPolarHBondContact CE2-OD1 3.49Å; Y431-D436 PolarHBondContact OH-OD1 2.84Å; C432-D436 WeakPolarHBondContact O-CA 3.45Å; C432-D436 PolarHBondContact O-N 3.1Å; I433-D436 PolarHBondContact O-N 3.44Å
437	L	90.1	Very high	88.6	Confident	66 Å²	66	51 Å²	51	35%	0.346	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	114.5	-175.3	-170.5	76.9	0	0	0	111.5	Y431 C432 C435 H448	Y431-L437 WeakPolarHBondContact CA-O 3.44Å; C432-L437 HydrophobicContact CB-CB 4.33Å; C432-L437 PolarHBondContact N-O 3.12Å; C432-L437 PolarHBondContact O-N 3.11Å; C432-L437 VanDerWaalsContact O-N 3.12Å; C435-L437 HydrophobicContact CB-CB 4.42Å; C435-L437 PolarHBondContact O-N 3.25Å; L437-H448 HydrophobicContact CD2-CB 3.56Å; L437-H448 VanDerWaalsContact CD2-CD2 3.45Å; L437-H448 WeakPolarHBondContact CD2-CD2 3.31Å
438	F	89.3	Confident	89.9	Confident	142 Å²	142	49.3 Å²	49.3	62%	0.623	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.9	168.1	68.5	-87.2	0	0	0	112.2	L430 Y431	L430-F438 CarbonylContact O-C 3.5Å; L430-F438 WeakPolarHBondContact O-CA 3.28Å; Y431-F438 HydrophobicContact CD2-CB 4.16Å
439	T	89.7	Confident	90.8	Very high	14 Å²	14	48.8 Å²	48.8	9%	0.086	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	145.6	173.8	178.2	0	0	0	0	112.5	L430 S441 F445	L430-T439 HydrophobicContact CB-CG2 4.1Å; L430-T439 PolarHBondContact N-O 3.11Å; L430-T439 PolarHBondContact O-N 3.35Å; T439-S441 PolarHBondContact OG1-N 2.76Å; T439-S441 PolarHBondContact OG1-O 3.08Å; T439-F445 HydrophobicContact CG2-CB 3.62Å; T439-F445 HydrophobicContact CG2-CD2 3.39Å; T439-F445 HydrophobicContact CG2-CE2 4.32Å; T439-F445 HydrophobicContact CG2-CG 3.78Å
440	T	88.4	Confident	91	Very high	84 Å²	84	53.5 Å²	53.5	52%	0.515	27%	0.266	S	S	.	.	S	Bend	trans	-94.1	5.8	170.2	57.5	0	0	0	0	113	I428 Q429	I428-T440 WeakPolarHBondContact O-CA 3.39Å; I428-T440 WeakPolarHBondContact O-CB 3.4Å; I428-T440 WeakPolarHBondContact O-CG2 3.22Å; Q429-T440 HydrophobicContact CG-CG2 4.49Å
441	S	89.5	Confident	90.9	Very high	44 Å²	44	55.9 Å²	55.9	31%	0.308	28%	0.28	S	S	.	.			trans	-121.1	115.3	-177.6	176.6	0	0	0	0	111	T439 H443 K444 F445	T439-S441 PolarHBondContact OG1-N 2.76Å; T439-S441 PolarHBondContact OG1-O 3.08Å; S441-H443 VanDerWaalsContact C-N 3.27Å; S441-H443 PolarHBondContact O-N 3.44Å; S441-K444 PolarHBondContact O-N 3.49Å; S441-F445 PolarHBondContact O-N 3.24Å; S441-F445 VanDerWaalsContact O-N 3.13Å
442	V	90.2	Very high	90.3	Very high	24 Å²	24	62 Å²	62	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-52.1	-45.1	173.6	177.8	0	0	0	0	111.5	I285 I428 L430 K444 F445 R446	I285-V442 HydrophobicContact CD1-CG1 3.5Å; I285-V442 HydrophobicContact CG1-CG1 3.86Å; I285-V442 HydrophobicContact CG2-CG1 4.24Å; I285-V442 HydrophobicContact CG2-CG2 4.41Å; I428-V442 HydrophobicContact CD1-CG2 4.27Å; I428-V442 HydrophobicContact CG2-CG2 4.14Å; L430-V442 HydrophobicContact CD1-CG2 4.14Å; V442-K444 PolarHBondContact O-N 3.3Å; V442-F445 WeakPolarHBondContact O-CB 3.44Å; V442-F445 PolarHBondContact O-N 2.73Å; V442-F445 VanDerWaalsContact O-N 3.08Å; V442-R446 PolarHBondContact O-N 3.03Å
443	H	90.5	Very high	89.7	Confident	106 Å²	106	64 Å²	64	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-42.2	-179.5	-163.9	-71.5	0	0	0	112.6	S441 F445 R446 L447	S441-H443 VanDerWaalsContact C-N 3.27Å; S441-H443 PolarHBondContact O-N 3.44Å; H443-F445 VanDerWaalsContact C-N 3.29Å; H443-F445 PolarHBondContact O-N 3.26Å; H443-R446 PolarHBondContact O-N 2.84Å; H443-L447 WeakPolarHBondContact O-CG 3.39Å; H443-L447 PolarHBondContact O-N 2.63Å; H443-L447 VanDerWaalsContact O-N 3.12Å
444	K	89.9	Confident	89.7	Confident	142 Å²	142	64.6 Å²	64.6	62%	0.617	33%	0.329	S	S	*	.	H	α-helix	trans	-67	-32.1	175.2	-68.9	-168.2	173.6	-163.8	0	112.3	S441 V442 H448	S441-K444 PolarHBondContact O-N 3.49Å; V442-K444 PolarHBondContact O-N 3.3Å; K444-H448 WeakPolarHBondContact O-CB 3.33Å; K444-H448 PolarHBondContact O-N 2.72Å
445	F	93.3	Very high	89.5	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-72.4	-40.4	177.6	-149.9	-126.6	0	0	0	111.8	L268 L281 L284 L430 C432 T439 S441 V442 H443 H448 C449	L268-F445 HydrophobicContact CB-CE1 4.45Å; L268-F445 HydrophobicContact CD2-CE1 4.14Å; L268-F445 HydrophobicContact CD2-CZ 4.01Å; L281-F445 HydrophobicContact CD1-CD1 3.4Å; L281-F445 HydrophobicContact CD1-CE1 3.86Å; L281-F445 HydrophobicContact CD1-CG 4.44Å; L284-F445 HydrophobicContact CD2-CE1 3.89Å; L430-F445 HydrophobicContact CB-CD1 3.9Å; L430-F445 HydrophobicContact CB-CD2 4.23Å; L430-F445 HydrophobicContact CB-CE1 4.1Å; L430-F445 HydrophobicContact CB-CE2 4.36Å; L430-F445 HydrophobicContact CB-CG 4Å; L430-F445 HydrophobicContact CB-CZ 4.31Å; L430-F445 HydrophobicContact CD1-CB 3.83Å; L430-F445 HydrophobicContact CD1-CD1 3.9Å; L430-F445 HydrophobicContact CD1-CG 4Å; L430-F445 HydrophobicContact CG-CD1 4.34Å; C432-F445 HydrophobicContact CB-CE2 3.65Å; C432-F445 HydrophobicContact CB-CZ 3.75Å; T439-F445 HydrophobicContact CG2-CB 3.62Å; T439-F445 HydrophobicContact CG2-CD2 3.39Å; T439-F445 HydrophobicContact CG2-CE2 4.32Å; T439-F445 HydrophobicContact CG2-CG 3.78Å; S441-F445 PolarHBondContact O-N 3.24Å; S441-F445 VanDerWaalsContact O-N 3.13Å; V442-F445 WeakPolarHBondContact O-CB 3.44Å; V442-F445 PolarHBondContact O-N 2.73Å; V442-F445 VanDerWaalsContact O-N 3.08Å; H443-F445 VanDerWaalsContact C-N 3.29Å; H443-F445 PolarHBondContact O-N 3.26Å; F445-H448 WeakPolarHBondContact O-CB 3.35Å; F445-H448 PolarHBondContact O-N 3.17Å; F445-C449 PolarHBondContact O-N 3.38Å; F445-C449 PolarHBondContact O-SG 3.36Å
446	R	93.8	Very high	89.1	Confident	114 Å²	114	67 Å²	67	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-58	-48.2	170.9	-81.7	178	175	159.6	0.6	112.4	L281 D282 V442 H443 H448 C449 Q450	L281-R446 HydrophobicContact CD2-CB 4.38Å; L281-R446 HydrophobicContact CD2-CG 3.64Å; L281-R446 HydrophobicContact CG-CG 4.43Å; D282-R446 IonicContact OD1-CZ 2.65Å; D282-R446 IonicContact OD1-NE 2.64Å; D282-R446 IonicContact OD1-NH2 3.7Å; D282-R446 PolarHBondContact OD1-NH2 2.65Å; V442-R446 PolarHBondContact O-N 3.03Å; H443-R446 PolarHBondContact O-N 2.84Å; R446-H448 VanDerWaalsContact C-N 3.3Å; R446-H448 PolarHBondContact O-N 3.27Å; R446-C449 PolarHBondContact O-N 3.37Å; R446-Q450 WeakPolarHBondContact O-CG 3.18Å; R446-Q450 PolarHBondContact O-N 3.48Å
447	L	92.2	Very high	89.1	Confident	97 Å²	97	63.6 Å²	63.6	51%	0.508	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-33.9	175.4	-68.1	175.2	0	0	0	113	H443	H443-L447 WeakPolarHBondContact O-CG 3.39Å; H443-L447 PolarHBondContact O-N 2.63Å; H443-L447 VanDerWaalsContact O-N 3.12Å
448	H	92.7	Very high	89.1	Confident	24 Å²	24	62 Å²	62	11%	0.111	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-46.5	174.5	167.9	52	0	0	0	112.5	C432 C435 L437 K444 F445 R446 Q450 T451 H454	C432-H448 PolarHBondContact SG-NE2 3.4Å; C432-H448 VanDerWaalsContact SG-NE2 3.42Å; C435-H448 WeakPolarHBondContact CB-CE1 3.47Å; C435-H448 WeakPolarHBondContact CB-NE2 3.37Å; C435-H448 PolarHBondContact SG-CE1 3.04Å; L437-H448 HydrophobicContact CD2-CB 3.56Å; L437-H448 VanDerWaalsContact CD2-CD2 3.45Å; L437-H448 WeakPolarHBondContact CD2-CD2 3.31Å; K444-H448 WeakPolarHBondContact O-CB 3.33Å; K444-H448 PolarHBondContact O-N 2.72Å; F445-H448 WeakPolarHBondContact O-CB 3.35Å; F445-H448 PolarHBondContact O-N 3.17Å; R446-H448 VanDerWaalsContact C-N 3.3Å; R446-H448 PolarHBondContact O-N 3.27Å; H448-Q450 PolarHBondContact O-N 2.72Å; H448-T451 PolarHBondContact O-N 3.44Å; H448-T451 PolarHBondContact O-OG1 3.49Å; H448-H454 AromaticContact CD2-ND1 3.59Å; H448-H454 AromaticContact CE1-ND1 3.45Å; H448-H454 PolarHBondContact CE1-ND1 3.39Å; H448-H454 AromaticContact NE2-CE1 3.83Å; H448-H454 AromaticContact NE2-ND1 3.01Å; H448-H454 PolarHBondContact NE2-ND1 3.19Å; H448-H454 WeakPolarHBondContact O-CB 3.08Å
449	C	91.8	Very high	89	Confident	25 Å²	25	60 Å²	60	17%	0.169	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-13	-177.6	-61	0	0	0	0	113	L281 F445 R446 H454	L281-C449 HydrophobicContact CD2-CB 4.01Å; F445-C449 PolarHBondContact O-N 3.38Å; F445-C449 PolarHBondContact O-SG 3.36Å; R446-C449 PolarHBondContact O-N 3.37Å; C449-H454 PolarHBondContact O-CD2 3.23Å
450	Q	89.8	Confident	88.8	Confident	143 Å²	143	60.1 Å²	60.1	67%	0.668	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-3.4	175.7	-69.3	170.1	-22	0	0	114	R446 H448	R446-Q450 WeakPolarHBondContact O-CG 3.18Å; R446-Q450 PolarHBondContact O-N 3.48Å; H448-Q450 PolarHBondContact O-N 2.72Å
451	T	89.5	Confident	88.9	Confident	50 Å²	50	56.2 Å²	56.2	31%	0.307	28%	0.281	S	S	.	.	S	Bend	trans	-79.8	144.5	179.4	72.7	0	0	0	0	112.4	H448 S453 H454 I455	H448-T451 PolarHBondContact O-N 3.44Å; H448-T451 PolarHBondContact O-OG1 3.49Å; T451-S453 PolarHBondContact O-N 3.04Å; T451-S453 PolarHBondContact OG1-OG 3.24Å; T451-H454 WeakPolarHBondContact O-CB 3.42Å; T451-H454 PolarHBondContact O-N 3.21Å; T451-H454 WeakPolarHBondContact OG1-CB 3.27Å; T451-H454 PolarHBondContact OG1-N 3.15Å; T451-H454 VanDerWaalsContact OG1-N 3.17Å; T451-I455 PolarHBondContact O-N 2.8Å; T451-I455 VanDerWaalsContact O-N 3.1Å
452	L	80.2	Confident	88.9	Confident	129 Å²	129	56.7 Å²	56.7	68%	0.675	28%	0.282	S	S	*	.	H	α-helix	trans	-57.2	-34.3	174.2	-72.8	164	0	0	0	112.4	I455 G456 Y623	L452-I455 PolarHBondContact O-N 3.27Å; L452-G456 PolarHBondContact O-N 3.02Å; L452-Y623 PolarHBondContact O-OH 3.45Å
453	S	82.6	Confident	88.7	Confident	42 Å²	42	57.4 Å²	57.4	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-65	-37.5	173.4	52	0	0	0	0	113.2	T451 G456 A457 W590 E594	T451-S453 PolarHBondContact O-N 3.04Å; T451-S453 PolarHBondContact OG1-OG 3.24Å; S453-G456 PolarHBondContact O-N 3.31Å; S453-A457 VanDerWaalsContact O-CB 3.31Å; S453-A457 WeakPolarHBondContact O-CB 3.35Å; S453-A457 PolarHBondContact O-N 3.05Å; S453-W590 WeakPolarHBondContact O-CH2 3.34Å; S453-E594 WeakPolarHBondContact CA-OE1 2.98Å; S453-E594 WeakPolarHBondContact CB-OE1 3.32Å; S453-E594 WeakPolarHBondContact CB-OE2 3.38Å
454	H	90.1	Very high	88.5	Confident	15 Å²	15	52.4 Å²	52.4	7%	0.069	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-46.1	173.5	-179.6	92.4	0	0	0	111.1	C432 H448 C449 T451 G456 A457 V458	C432-H454 PolarHBondContact SG-CE1 2.98Å; H448-H454 AromaticContact CD2-ND1 3.59Å; H448-H454 AromaticContact CE1-ND1 3.45Å; H448-H454 PolarHBondContact CE1-ND1 3.39Å; H448-H454 AromaticContact NE2-CE1 3.83Å; H448-H454 AromaticContact NE2-ND1 3.01Å; H448-H454 PolarHBondContact NE2-ND1 3.19Å; H448-H454 WeakPolarHBondContact O-CB 3.08Å; C449-H454 PolarHBondContact O-CD2 3.23Å; T451-H454 WeakPolarHBondContact O-CB 3.42Å; T451-H454 PolarHBondContact O-N 3.21Å; T451-H454 WeakPolarHBondContact OG1-CB 3.27Å; T451-H454 PolarHBondContact OG1-N 3.15Å; T451-H454 VanDerWaalsContact OG1-N 3.17Å; H454-G456 VanDerWaalsContact C-N 3.26Å; H454-G456 PolarHBondContact O-N 2.89Å; H454-A457 PolarHBondContact O-N 3.23Å; H454-V458 WeakPolarHBondContact O-CB 3.29Å; H454-V458 VanDerWaalsContact O-CG2 3.29Å; H454-V458 WeakPolarHBondContact O-CG2 3.39Å; H454-V458 PolarHBondContact O-N 3.37Å
455	I	87.2	Confident	88.4	Confident	75 Å²	75	45.8 Å²	45.8	39%	0.385	23%	0.232	S	C	.	.	H	α-helix	trans	-59.4	-39	177	-62.3	167.4	0	0	0	110.9	T451 L452 K459	T451-I455 PolarHBondContact O-N 2.8Å; T451-I455 VanDerWaalsContact O-N 3.1Å; L452-I455 PolarHBondContact O-N 3.27Å; I455-K459 WeakPolarHBondContact O-CG 3.41Å; I455-K459 PolarHBondContact O-N 3.22Å
456	G	82.6	Confident	88.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-51.5	173.8	0	0	0	0	0	113.7	L452 S453 H454 V458 K459 I460	L452-G456 PolarHBondContact O-N 3.02Å; S453-G456 PolarHBondContact O-N 3.31Å; H454-G456 VanDerWaalsContact C-N 3.26Å; H454-G456 PolarHBondContact O-N 2.89Å; G456-V458 VanDerWaalsContact C-N 3.34Å; G456-V458 PolarHBondContact O-N 2.97Å; G456-K459 PolarHBondContact O-N 3.15Å; G456-I460 PolarHBondContact O-N 3.14Å
457	A	88.1	Confident	87.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-42.7	179.8	0	0	0	0	0	112.2	A434 C435 S453 H454 K459 I460 F461 W590	A434-A457 HydrophobicContact CB-CB 4.02Å; C435-A457 VanDerWaalsContact SG-CB 3.54Å; S453-A457 VanDerWaalsContact O-CB 3.31Å; S453-A457 WeakPolarHBondContact O-CB 3.35Å; S453-A457 PolarHBondContact O-N 3.05Å; H454-A457 PolarHBondContact O-N 3.23Å; A457-K459 PolarHBondContact O-N 3.2Å; A457-I460 PolarHBondContact O-N 3.24Å; A457-F461 WeakPolarHBondContact O-CB 3.41Å; A457-F461 PolarHBondContact O-N 3.34Å; A457-W590 HydrophobicContact CB-CE3 4.27Å; A457-W590 HydrophobicContact CB-CH2 3.99Å; A457-W590 HydrophobicContact CB-CZ3 3.61Å
458	V	90.3	Very high	87.3	Confident	33 Å²	33	42.9 Å²	42.9	20%	0.2	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-39.9	178.8	166.6	0	0	0	0	111.8	P267 A434 H454 G456 T462	P267-V458 HydrophobicContact CB-CG2 3.91Å; P267-V458 HydrophobicContact CG-CG1 4.06Å; P267-V458 HydrophobicContact CG-CG2 4.05Å; A434-V458 HydrophobicContact CB-CG2 4.03Å; H454-V458 WeakPolarHBondContact O-CB 3.29Å; H454-V458 VanDerWaalsContact O-CG2 3.29Å; H454-V458 WeakPolarHBondContact O-CG2 3.39Å; H454-V458 PolarHBondContact O-N 3.37Å; G456-V458 VanDerWaalsContact C-N 3.34Å; G456-V458 PolarHBondContact O-N 2.97Å; V458-T462 VanDerWaalsContact O-CB 3.29Å; V458-T462 WeakPolarHBondContact O-CB 3.45Å; V458-T462 PolarHBondContact O-N 2.81Å; V458-T462 PolarHBondContact O-OG1 3.27Å
459	K	86.4	Confident	86.9	Confident	99 Å²	99	43 Å²	43	43%	0.43	22%	0.223	S	C	.	.	H	α-helix	trans	-60.4	-47.8	175.4	-75.5	174.4	179.1	-177.5	0	111.7	I455 G456 A457 T462 H463 Y623	I455-K459 WeakPolarHBondContact O-CG 3.41Å; I455-K459 PolarHBondContact O-N 3.22Å; G456-K459 PolarHBondContact O-N 3.15Å; A457-K459 PolarHBondContact O-N 3.2Å; K459-T462 PolarHBondContact O-N 3.13Å; K459-H463 WeakPolarHBondContact O-CB 3.42Å; K459-H463 PolarHBondContact O-N 3.27Å; K459-Y623 HydrophobicContact CD-CG 4.26Å
460	I	85.7	Confident	86.4	Confident	17 Å²	17	47.2 Å²	47.2	9%	0.087	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-43.5	-179.4	-65.7	170.5	0	0	0	111	G456 A457 T462 H463 L464 W590 F628	G456-I460 PolarHBondContact O-N 3.14Å; A457-I460 PolarHBondContact O-N 3.24Å; I460-T462 VanDerWaalsContact C-N 3.35Å; I460-T462 PolarHBondContact O-N 3.01Å; I460-H463 PolarHBondContact O-N 3.39Å; I460-L464 HydrophobicContact CG2-CD1 3.94Å; I460-L464 HydrophobicContact CG2-CG 4.44Å; I460-L464 WeakPolarHBondContact O-CB 3.18Å; I460-L464 WeakPolarHBondContact O-CG 3.27Å; I460-L464 PolarHBondContact O-N 2.81Å; I460-W590 VanDerWaalsContact CD1-CD1 3.4Å; I460-W590 HydrophobicContact CD1-CD2 4.09Å; I460-W590 HydrophobicContact CD1-CG 3.98Å; I460-W590 HydrophobicContact CD1-CZ2 4.29Å; I460-F628 HydrophobicContact CG2-CB 4.37Å; I460-F628 HydrophobicContact CG2-CD2 4.32Å; I460-F628 HydrophobicContact CG2-CG 4.45Å
461	F	90.8	Very high	85.9	Confident	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-56	-49.1	173.2	175.1	-91.2	0	0	0	111.4	A264 P267 I433 A434 A457 H463 L464 V465 L583 L587	A264-F461 HydrophobicContact CB-CZ 4.48Å; P267-F461 HydrophobicContact CB-CD1 3.8Å; P267-F461 HydrophobicContact CB-CE1 4.05Å; P267-F461 HydrophobicContact CB-CG 4.42Å; P267-F461 HydrophobicContact CG-CD1 4.49Å; I433-F461 HydrophobicContact CB-CE2 4.26Å; I433-F461 HydrophobicContact CG2-CD2 3.98Å; I433-F461 HydrophobicContact CG2-CE2 3.4Å; I433-F461 HydrophobicContact CG2-CZ 4.11Å; A434-F461 HydrophobicContact CB-CB 3.9Å; A434-F461 HydrophobicContact CB-CG 4.23Å; A457-F461 WeakPolarHBondContact O-CB 3.41Å; A457-F461 PolarHBondContact O-N 3.34Å; F461-H463 PolarHBondContact O-N 3.42Å; F461-L464 PolarHBondContact O-N 2.85Å; F461-V465 HydrophobicContact CD1-CG2 4.14Å; F461-V465 HydrophobicContact CD2-CG2 4.27Å; F461-V465 HydrophobicContact CE1-CG2 3.68Å; F461-V465 HydrophobicContact CE2-CG2 3.83Å; F461-V465 HydrophobicContact CG-CG2 4.42Å; F461-V465 HydrophobicContact CZ-CG2 3.53Å; F461-V465 WeakPolarHBondContact O-CB 3.47Å; F461-V465 WeakPolarHBondContact O-CG2 3.43Å; F461-V465 PolarHBondContact O-N 2.89Å; F461-L583 HydrophobicContact CD2-CD2 4.11Å; F461-L583 HydrophobicContact CE2-CD2 3.89Å; F461-L587 HydrophobicContact CD2-CD1 4.2Å
462	T	89.1	Confident	85.5	Confident	55 Å²	55	43.5 Å²	43.5	34%	0.337	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-40.9	-179.5	-55.5	0	0	0	0	111.6	V458 K459 I460 N466	V458-T462 VanDerWaalsContact O-CB 3.29Å; V458-T462 WeakPolarHBondContact O-CB 3.45Å; V458-T462 PolarHBondContact O-N 2.81Å; V458-T462 PolarHBondContact O-OG1 3.27Å; K459-T462 PolarHBondContact O-N 3.13Å; I460-T462 VanDerWaalsContact C-N 3.35Å; I460-T462 PolarHBondContact O-N 3.01Å; T462-N466 VanDerWaalsContact O-CB 3.29Å; T462-N466 WeakPolarHBondContact O-CB 3.45Å; T462-N466 PolarHBondContact O-N 2.87Å; T462-N466 PolarHBondContact O-ND2 3.46Å
463	H	85.8	Confident	85.4	Confident	39 Å²	39	41.6 Å²	41.6	18%	0.181	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-50.5	175.9	-175.2	70.5	0	0	0	111.9	K459 I460 F461 N466 R467	K459-H463 WeakPolarHBondContact O-CB 3.42Å; K459-H463 PolarHBondContact O-N 3.27Å; I460-H463 PolarHBondContact O-N 3.39Å; F461-H463 PolarHBondContact O-N 3.42Å; H463-N466 PolarHBondContact O-N 3.34Å; H463-R467 VanDerWaalsContact NE2-CD 3.31Å; H463-R467 WeakPolarHBondContact NE2-CD 3.2Å; H463-R467 PolarHBondContact O-N 3.34Å
464	L	87.3	Confident	85.1	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-64.7	-43	179.2	-68.9	176	0	0	0	112	I460 F461 N466 R467 R468 Y538 L583 F628 I630	I460-L464 HydrophobicContact CG2-CD1 3.94Å; I460-L464 HydrophobicContact CG2-CG 4.44Å; I460-L464 WeakPolarHBondContact O-CB 3.18Å; I460-L464 WeakPolarHBondContact O-CG 3.27Å; I460-L464 PolarHBondContact O-N 2.81Å; F461-L464 PolarHBondContact O-N 2.85Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.32Å; L464-R467 PolarHBondContact O-N 3.14Å; L464-R468 WeakPolarHBondContact O-CB 3.37Å; L464-R468 PolarHBondContact O-N 3.49Å; L464-Y538 HydrophobicContact CD1-CD1 4.28Å; L464-Y538 HydrophobicContact CD2-CD1 4.19Å; L464-L583 HydrophobicContact CB-CD1 4.05Å; L464-L583 HydrophobicContact CD1-CD1 3.63Å; L464-F628 HydrophobicContact CD1-CB 4.38Å; L464-F628 HydrophobicContact CD2-CB 4.19Å; L464-I630 HydrophobicContact CB-CD1 4.25Å; L464-I630 HydrophobicContact CD2-CD1 4.04Å; L464-I630 HydrophobicContact CD2-CG1 3.75Å; L464-I630 WeakPolarHBondContact O-CD1 3.48Å
465	V	87.9	Confident	84.4	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-41.5	175.1	162.4	0	0	0	0	111.7	F461 R468 N469 L583	F461-V465 HydrophobicContact CD1-CG2 4.14Å; F461-V465 HydrophobicContact CD2-CG2 4.27Å; F461-V465 HydrophobicContact CE1-CG2 3.68Å; F461-V465 HydrophobicContact CE2-CG2 3.83Å; F461-V465 HydrophobicContact CG-CG2 4.42Å; F461-V465 HydrophobicContact CZ-CG2 3.53Å; F461-V465 WeakPolarHBondContact O-CB 3.47Å; F461-V465 WeakPolarHBondContact O-CG2 3.43Å; F461-V465 PolarHBondContact O-N 2.89Å; V465-R468 PolarHBondContact O-N 3.41Å; V465-N469 VanDerWaalsContact O-CB 3.27Å; V465-N469 WeakPolarHBondContact O-CB 3.25Å; V465-N469 PolarHBondContact O-N 3.47Å; V465-N469 PolarHBondContact O-OD1 3.26Å; V465-L583 HydrophobicContact CG2-CD2 4.26Å
466	N	86.4	Confident	83.9	Confident	97 Å²	97	38.7 Å²	38.7	52%	0.519	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-44.9	179.1	-72.9	-8.5	0	0	0	111.8	T462 H463 L464 N469 Y470	T462-N466 VanDerWaalsContact O-CB 3.29Å; T462-N466 WeakPolarHBondContact O-CB 3.45Å; T462-N466 PolarHBondContact O-N 2.87Å; T462-N466 PolarHBondContact O-ND2 3.46Å; H463-N466 PolarHBondContact O-N 3.34Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.32Å; N466-N469 PolarHBondContact O-N 3.49Å; N466-Y470 WeakPolarHBondContact O-CB 3.34Å; N466-Y470 PolarHBondContact O-N 3.43Å
467	R	83.2	Confident	83.6	Confident	49 Å²	49	42.3 Å²	42.3	19%	0.185	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-36.8	176.1	-78.5	-179.7	72.3	93	-26.3	112.6	H463 L464 Y470 L471 D629 I630 I641 E642	H463-R467 VanDerWaalsContact NE2-CD 3.31Å; H463-R467 WeakPolarHBondContact NE2-CD 3.2Å; H463-R467 PolarHBondContact O-N 3.34Å; L464-R467 PolarHBondContact O-N 3.14Å; R467-Y470 PolarHBondContact O-N 3.05Å; R467-L471 PolarHBondContact O-N 3.09Å; R467-D629 IonicContact CZ-OD1 2.81Å; R467-D629 IonicContact CZ-OD2 3.42Å; R467-D629 IonicContact NE-OD1 2.84Å; R467-D629 PolarHBondContact NE-OD1 2.87Å; R467-D629 VanDerWaalsContact NH2-CG 3.32Å; R467-D629 IonicContact NH2-OD1 3.87Å; R467-D629 PolarHBondContact NH2-OD1 2.75Å; R467-D629 IonicContact NH2-OD2 3.55Å; R467-D629 PolarHBondContact NH2-OD2 2.91Å; R467-I630 HydrophobicContact CB-CD1 4.4Å; R467-I641 HydrophobicContact CB-CD1 3.82Å; R467-I641 HydrophobicContact CG-CD1 4.41Å; R467-E642 IonicContact CZ-OE1 2.63Å; R467-E642 IonicContact NH1-OE1 2.66Å; R467-E642 PolarHBondContact NH1-OE1 2.73Å; R467-E642 IonicContact NH2-OE1 3.14Å
468	R	86.3	Confident	82.9	Confident	5 Å²	5	43.5 Å²	43.5	2%	0.019	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-47.6	170.8	-174.7	-164.2	67.5	-160.7	-7.7	111.6	E262 A264 N265 L464 V465 L471 W472 V536 I630	E262-R468 PolarHBondContact O-NH1 2.81Å; A264-R468 PolarHBondContact O-NH1 3.17Å; A264-R468 PolarHBondContact O-NH2 3.02Å; N265-R468 PolarHBondContact OD1-NH2 3.08Å; L464-R468 WeakPolarHBondContact O-CB 3.37Å; L464-R468 PolarHBondContact O-N 3.49Å; V465-R468 PolarHBondContact O-N 3.41Å; R468-L471 WeakPolarHBondContact O-CB 3.47Å; R468-L471 PolarHBondContact O-N 3.47Å; R468-W472 PolarHBondContact O-N 3.14Å; R468-W472 VanDerWaalsContact O-N 3.1Å; R468-V536 HydrophobicContact CG-CG1 4.47Å; R468-I630 HydrophobicContact CB-CD1 3.77Å
469	N	83.5	Confident	82.1	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.144	22%	0.224	C	C	.	.	H	α-helix	trans	-70.4	-34.3	-179	-69	0.1	0	0	0	111.2	N265 V465 N466 W472 N473	N265-N469 PolarHBondContact OD1-ND2 3.41Å; N265-N469 VanDerWaalsContact OD1-ND2 3.07Å; V465-N469 VanDerWaalsContact O-CB 3.27Å; V465-N469 WeakPolarHBondContact O-CB 3.25Å; V465-N469 PolarHBondContact O-N 3.47Å; V465-N469 PolarHBondContact O-OD1 3.26Å; N466-N469 PolarHBondContact O-N 3.49Å; N469-W472 PolarHBondContact O-N 3.46Å; N469-N473 WeakPolarHBondContact O-CB 3.03Å; N469-N473 PolarHBondContact O-N 2.91Å; N469-N473 PolarHBondContact O-OD1 3.19Å
470	Y	81.9	Confident	81.6	Confident	112 Å²	112	44 Å²	44	44%	0.439	23%	0.23	S	C	.	.	H	α-helix	trans	-61	-44.7	170.2	178.6	-102	0	0	0	112.1	N466 R467 W472 N473 T474 I641	N466-Y470 WeakPolarHBondContact O-CB 3.34Å; N466-Y470 PolarHBondContact O-N 3.43Å; R467-Y470 PolarHBondContact O-N 3.05Å; Y470-W472 PolarHBondContact O-N 3.33Å; Y470-N473 PolarHBondContact O-N 3.49Å; Y470-T474 HydrophobicContact CD1-CG2 4.28Å; Y470-T474 HydrophobicContact CD2-CG2 4.29Å; Y470-T474 HydrophobicContact CE1-CG2 3.86Å; Y470-T474 HydrophobicContact CE2-CG2 3.87Å; Y470-T474 HydrophobicContact CG-CG2 4.48Å; Y470-T474 WeakPolarHBondContact O-CG2 3.48Å; Y470-T474 PolarHBondContact O-N 3.22Å; Y470-T474 PolarHBondContact O-OG1 3.46Å; Y470-T474 VanDerWaalsContact O-OG1 3.07Å; Y470-I641 HydrophobicContact CD1-CG2 3.95Å; Y470-I641 HydrophobicContact CE1-CG2 4.18Å
471	L	79.9	Confident	81	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-48.2	173.8	-177.3	157.9	0	0	0	111.6	R467 R468 N473 T474 L475 L534 V536 I630 W632 I641 L644	R467-L471 PolarHBondContact O-N 3.09Å; R468-L471 WeakPolarHBondContact O-CB 3.47Å; R468-L471 PolarHBondContact O-N 3.47Å; L471-N473 PolarHBondContact O-N 3.03Å; L471-T474 PolarHBondContact O-N 3.21Å; L471-T474 PolarHBondContact O-OG1 2.67Å; L471-L475 VanDerWaalsContact O-CB 3.31Å; L471-L475 WeakPolarHBondContact O-CB 3.4Å; L471-L475 PolarHBondContact O-N 3.16Å; L471-L534 HydrophobicContact CD2-CD2 4.28Å; L471-V536 HydrophobicContact CD2-CG2 4.32Å; L471-I630 HydrophobicContact CD1-CG2 4.29Å; L471-W632 HydrophobicContact CD1-CB 4.09Å; L471-I641 HydrophobicContact CB-CG2 3.82Å; L471-I641 HydrophobicContact CD1-CG1 4.37Å; L471-I641 HydrophobicContact CD1-CG2 4.25Å; L471-I641 HydrophobicContact CG-CG2 4.16Å; L471-L644 HydrophobicContact CG-CD2 4.09Å
472	W	79.1	Confident	79.8	Confident	115 Å²	115	48.8 Å²	48.8	44%	0.436	25%	0.25	S	C	.	.	H	α-helix	trans	-64.4	-39.8	177.1	-72.1	114.5	0	0	0	113	R468 N469 Y470 L475 A476 V536	R468-W472 PolarHBondContact O-N 3.14Å; R468-W472 VanDerWaalsContact O-N 3.1Å; N469-W472 PolarHBondContact O-N 3.46Å; Y470-W472 PolarHBondContact O-N 3.33Å; W472-L475 HydrophobicContact CE3-CD2 3.89Å; W472-L475 HydrophobicContact CZ3-CD2 3.77Å; W472-L475 PolarHBondContact O-N 3.37Å; W472-A476 WeakPolarHBondContact O-CB 3.4Å; W472-A476 PolarHBondContact O-N 3.44Å; W472-V536 HydrophobicContact CZ2-CG2 4.28Å
473	N	79.4	Confident	79	Confident	89 Å²	89	48.7 Å²	48.7	48%	0.476	25%	0.249	S	C	.	.	H	α-helix	trans	-67.6	-40.7	178.5	-70.1	4.5	0	0	0	112.3	N469 Y470 L471 A476 S477	N469-N473 WeakPolarHBondContact O-CB 3.03Å; N469-N473 PolarHBondContact O-N 2.91Å; N469-N473 PolarHBondContact O-OD1 3.19Å; Y470-N473 PolarHBondContact O-N 3.49Å; L471-N473 PolarHBondContact O-N 3.03Å; N473-A476 PolarHBondContact O-N 2.98Å; N473-S477 WeakPolarHBondContact O-CB 3.3Å; N473-S477 PolarHBondContact O-N 3.41Å; N473-S477 PolarHBondContact O-OG 3.41Å
474	T	77	Confident	78.2	Confident	23 Å²	23	51.4 Å²	51.4	14%	0.141	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-39.2	174	54.3	0	0	0	0	111.2	Y470 L471 S477 L478	Y470-T474 HydrophobicContact CD1-CG2 4.28Å; Y470-T474 HydrophobicContact CD2-CG2 4.29Å; Y470-T474 HydrophobicContact CE1-CG2 3.86Å; Y470-T474 HydrophobicContact CE2-CG2 3.87Å; Y470-T474 HydrophobicContact CG-CG2 4.48Å; Y470-T474 WeakPolarHBondContact O-CG2 3.48Å; Y470-T474 PolarHBondContact O-N 3.22Å; Y470-T474 PolarHBondContact O-OG1 3.46Å; Y470-T474 VanDerWaalsContact O-OG1 3.07Å; L471-T474 PolarHBondContact O-N 3.21Å; L471-T474 PolarHBondContact O-OG1 2.67Å; T474-S477 PolarHBondContact O-N 3.33Å; T474-L478 WeakPolarHBondContact O-CB 3.42Å; T474-L478 WeakPolarHBondContact O-CD1 3.4Å; T474-L478 VanDerWaalsContact O-CG 3.29Å; T474-L478 WeakPolarHBondContact O-CG 3.42Å; T474-L478 PolarHBondContact O-N 3.15Å
475	L	75.5	Confident	77.3	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-41.7	176	-164.3	70	0	0	0	112.7	L471 W472 L478 S479 L531 L534 L644 I648	L471-L475 VanDerWaalsContact O-CB 3.31Å; L471-L475 WeakPolarHBondContact O-CB 3.4Å; L471-L475 PolarHBondContact O-N 3.16Å; W472-L475 HydrophobicContact CE3-CD2 3.89Å; W472-L475 HydrophobicContact CZ3-CD2 3.77Å; W472-L475 PolarHBondContact O-N 3.37Å; L475-L478 PolarHBondContact O-N 3.4Å; L475-S479 WeakPolarHBondContact O-CB 3.38Å; L475-S479 PolarHBondContact O-N 3Å; L475-S479 PolarHBondContact O-OG 3.4Å; L475-L531 HydrophobicContact CD1-CD2 3.6Å; L475-L531 HydrophobicContact CD2-CD2 3.76Å; L475-L531 HydrophobicContact CG-CD2 3.54Å; L475-L534 HydrophobicContact CD1-CD2 3.72Å; L475-L534 HydrophobicContact CD2-CD2 3.62Å; L475-L534 HydrophobicContact CG-CD2 4.28Å; L475-L644 HydrophobicContact CD1-CD2 4.44Å; L475-I648 HydrophobicContact CD1-CD1 3.71Å
476	A	74.9	Confident	76.2	Confident	37 Å²	37	54.1 Å²	54.1	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-67.5	-38.2	174.3	0	0	0	0	0	112.4	W472 N473 S479 L480	W472-A476 WeakPolarHBondContact O-CB 3.4Å; W472-A476 PolarHBondContact O-N 3.44Å; N473-A476 PolarHBondContact O-N 2.98Å; A476-S479 PolarHBondContact O-N 2.96Å; A476-S479 PolarHBondContact O-OG 3.33Å; A476-S479 VanDerWaalsContact O-OG 3.08Å; A476-L480 WeakPolarHBondContact O-CB 3.45Å; A476-L480 WeakPolarHBondContact O-CG 3.28Å; A476-L480 PolarHBondContact O-N 2.97Å
477	S	76.3	Confident	75.2	Confident	77 Å²	77	55.1 Å²	55.1	54%	0.538	28%	0.279	S	S	.	.	H	α-helix	trans	-65.7	-41	175.4	-55.8	0	0	0	0	111.5	N473 T474 F481	N473-S477 WeakPolarHBondContact O-CB 3.3Å; N473-S477 PolarHBondContact O-N 3.41Å; N473-S477 PolarHBondContact O-OG 3.41Å; T474-S477 PolarHBondContact O-N 3.33Å; S477-F481 WeakPolarHBondContact O-CB 3.43Å; S477-F481 PolarHBondContact O-N 3.08Å
478	L	74.3	Confident	74.3	Confident	25 Å²	25	55.4 Å²	55.4	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-46	174.5	-76	161	0	0	0	111.5	T474 L475 L480 F481 Y482 P645 I648	T474-L478 WeakPolarHBondContact O-CB 3.42Å; T474-L478 WeakPolarHBondContact O-CD1 3.4Å; T474-L478 VanDerWaalsContact O-CG 3.29Å; T474-L478 WeakPolarHBondContact O-CG 3.42Å; T474-L478 PolarHBondContact O-N 3.15Å; L475-L478 PolarHBondContact O-N 3.4Å; L478-L480 PolarHBondContact O-N 3.26Å; L478-F481 PolarHBondContact O-N 3.02Å; L478-Y482 HydrophobicContact CB-CE2 4.46Å; L478-Y482 HydrophobicContact CD2-CE2 4.06Å; L478-Y482 WeakPolarHBondContact O-CD2 3.49Å; L478-Y482 PolarHBondContact O-N 3.44Å; L478-P645 HydrophobicContact CD1-CB 4.06Å; L478-P645 HydrophobicContact CD1-CG 4.24Å; L478-P645 HydrophobicContact CD2-CB 4.32Å; L478-I648 HydrophobicContact CD1-CD1 4Å
479	S	73	Confident	72.8	Confident	37 Å²	37	58 Å²	58	26%	0.259	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-39.3	-179.4	66.8	0	0	0	0	112.2	L475 A476 Y482 V483	L475-S479 WeakPolarHBondContact O-CB 3.38Å; L475-S479 PolarHBondContact O-N 3Å; L475-S479 PolarHBondContact O-OG 3.4Å; A476-S479 PolarHBondContact O-N 2.96Å; A476-S479 PolarHBondContact O-OG 3.33Å; A476-S479 VanDerWaalsContact O-OG 3.08Å; S479-Y482 PolarHBondContact O-N 2.95Å; S479-V483 VanDerWaalsContact O-CG2 3.29Å; S479-V483 WeakPolarHBondContact O-CG2 3.27Å; S479-V483 PolarHBondContact O-N 3.29Å
480	L	75.2	Confident	71.5	Confident	106 Å²	106	59.5 Å²	59.5	56%	0.555	31%	0.31	S	S	*	.	H	α-helix	trans	-61.8	-50.1	171.2	-72.1	170.9	0	0	0	111.7	A476 L478 Y482 V483 D484	A476-L480 WeakPolarHBondContact O-CB 3.45Å; A476-L480 WeakPolarHBondContact O-CG 3.28Å; A476-L480 PolarHBondContact O-N 2.97Å; L478-L480 PolarHBondContact O-N 3.26Å; L480-Y482 VanDerWaalsContact C-N 3.29Å; L480-Y482 PolarHBondContact O-N 3.15Å; L480-V483 PolarHBondContact O-N 2.97Å; L480-V483 VanDerWaalsContact O-N 3.07Å; L480-D484 PolarHBondContact O-N 3.07Å
481	F	73.9	Confident	69.9	Low	101 Å²	101	58.1 Å²	58.1	44%	0.443	31%	0.31	S	S	.	.	H	α-helix	trans	-56.2	-41.4	177.8	176.6	-98.3	0	0	0	112.7	S477 L478 D484 L485 I685	S477-F481 WeakPolarHBondContact O-CB 3.43Å; S477-F481 PolarHBondContact O-N 3.08Å; L478-F481 PolarHBondContact O-N 3.02Å; F481-D484 PolarHBondContact O-N 3.45Å; F481-L485 HydrophobicContact CE1-CD2 4.39Å; F481-L485 VanDerWaalsContact O-CB 3.28Å; F481-L485 WeakPolarHBondContact O-CB 3.44Å; F481-L485 PolarHBondContact O-N 3.44Å; F481-I685 HydrophobicContact CZ-CD1 4.28Å
482	Y	65.7	Low	68.2	Low	16 Å²	16	65.2 Å²	65.2	6%	0.063	34%	0.343	C	S	.	.	H	α-helix	trans	-72.6	-31.7	176.2	-74.4	-63.2	0	0	0	113.8	L478 S479 L480 L485 L486 I648 I649 L652	L478-Y482 HydrophobicContact CB-CE2 4.46Å; L478-Y482 HydrophobicContact CD2-CE2 4.06Å; L478-Y482 WeakPolarHBondContact O-CD2 3.49Å; L478-Y482 PolarHBondContact O-N 3.44Å; S479-Y482 PolarHBondContact O-N 2.95Å; L480-Y482 VanDerWaalsContact C-N 3.29Å; L480-Y482 PolarHBondContact O-N 3.15Å; Y482-L485 HydrophobicContact CD1-CD2 4.14Å; Y482-L485 HydrophobicContact CE1-CD2 4.34Å; Y482-L486 VanDerWaalsContact O-CB 3.27Å; Y482-L486 WeakPolarHBondContact O-CB 3.25Å; Y482-L486 WeakPolarHBondContact O-CD1 3.38Å; Y482-L486 WeakPolarHBondContact O-CG 2.93Å; Y482-L486 PolarHBondContact O-N 2.69Å; Y482-I648 HydrophobicContact CD2-CG2 4.4Å; Y482-I648 HydrophobicContact CE2-CG2 3.66Å; Y482-I649 WeakPolarHBondContact OH-CA 3.5Å; Y482-I649 WeakPolarHBondContact OH-CG1 3.47Å; Y482-L652 HydrophobicContact CD1-CD1 3.86Å; Y482-L652 HydrophobicContact CD2-CD1 3.58Å; Y482-L652 HydrophobicContact CE1-CB 4.33Å; Y482-L652 HydrophobicContact CE1-CD1 3.67Å; Y482-L652 HydrophobicContact CE2-CD1 3.4Å; Y482-L652 VanDerWaalsContact CE2-CD1 3.4Å; Y482-L652 HydrophobicContact CG-CD1 3.83Å; Y482-L652 VanDerWaalsContact CZ-CD1 3.44Å
483	V	72.3	Confident	66.5	Low	54 Å²	54	64.9 Å²	64.9	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-43.9	172.1	167.4	0	0	0	0	110.7	S479 L480 L486 K487 L524	S479-V483 VanDerWaalsContact O-CG2 3.29Å; S479-V483 WeakPolarHBondContact O-CG2 3.27Å; S479-V483 PolarHBondContact O-N 3.29Å; L480-V483 PolarHBondContact O-N 2.97Å; L480-V483 VanDerWaalsContact O-N 3.07Å; V483-L486 PolarHBondContact O-N 2.89Å; V483-K487 WeakPolarHBondContact O-CB 3.46Å; V483-K487 PolarHBondContact O-N 2.97Å; V483-L524 HydrophobicContact CG2-CD2 4.08Å
484	D	70	Confident	64.5	Low	95 Å²	95	65.4 Å²	65.4	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-68.5	-40.6	177.9	-72.1	-32.1	0	0	0	111.9	L480 F481 K487 S488	L480-D484 PolarHBondContact O-N 3.07Å; F481-D484 PolarHBondContact O-N 3.45Å; D484-K487 WeakPolarHBondContact O-CB 3.44Å; D484-K487 PolarHBondContact O-N 2.95Å; D484-K487 VanDerWaalsContact O-N 3.15Å; D484-S488 PolarHBondContact O-N 2.96Å
485	L	67.8	Low	62.5	Low	49 Å²	49	70.3 Å²	70.3	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-42.5	174	-178.6	68.2	0	0	0	112.5	F481 Y482 K487 S488 L489	F481-L485 HydrophobicContact CE1-CD2 4.39Å; F481-L485 VanDerWaalsContact O-CB 3.28Å; F481-L485 WeakPolarHBondContact O-CB 3.44Å; F481-L485 PolarHBondContact O-N 3.44Å; Y482-L485 HydrophobicContact CD1-CD2 4.14Å; Y482-L485 HydrophobicContact CE1-CD2 4.34Å; L485-K487 PolarHBondContact O-N 3Å; L485-S488 PolarHBondContact O-N 2.78Å; L485-S488 PolarHBondContact O-OG 2.72Å; L485-S488 VanDerWaalsContact O-OG 3.06Å; L485-L489 HydrophobicContact CG-CD1 4.4Å; L485-L489 VanDerWaalsContact O-CG 3.32Å; L485-L489 WeakPolarHBondContact O-CG 3.23Å; L485-L489 PolarHBondContact O-N 3.27Å
486	L	65.1	Low	60.5	Low	12 Å²	12	77.4 Å²	77.4	6%	0.063	42%	0.416	C	S	.	.	H	α-helix	trans	-69.2	-20.6	176	-72	169.5	0	0	0	112.4	Y482 V483 F520 I523 L527	Y482-L486 VanDerWaalsContact O-CB 3.27Å; Y482-L486 WeakPolarHBondContact O-CB 3.25Å; Y482-L486 WeakPolarHBondContact O-CD1 3.38Å; Y482-L486 WeakPolarHBondContact O-CG 2.93Å; Y482-L486 PolarHBondContact O-N 2.69Å; V483-L486 PolarHBondContact O-N 2.89Å; L486-F520 HydrophobicContact CB-CD2 4.08Å; L486-F520 HydrophobicContact CB-CE2 3.76Å; L486-I523 HydrophobicContact CD1-CB 4.44Å; L486-I523 HydrophobicContact CD1-CG2 3.67Å; L486-I523 HydrophobicContact CD2-CD1 4.11Å; L486-I523 HydrophobicContact CD2-CG2 3.98Å; L486-L527 HydrophobicContact CD1-CD1 3.7Å
487	K	65.8	Low	58.5	Low	117 Å²	117	84.5 Å²	84.5	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-80.8	-45.9	173.6	-171.9	-174.2	172.2	-165.3	0	111.8	V483 D484 L485 L489 I490 D491	V483-K487 WeakPolarHBondContact O-CB 3.46Å; V483-K487 PolarHBondContact O-N 2.97Å; D484-K487 WeakPolarHBondContact O-CB 3.44Å; D484-K487 PolarHBondContact O-N 2.95Å; D484-K487 VanDerWaalsContact O-N 3.15Å; L485-K487 PolarHBondContact O-N 3Å; K487-L489 PolarHBondContact O-N 3.01Å; K487-I490 WeakPolarHBondContact O-CA 3.43Å; K487-I490 WeakPolarHBondContact O-CB 3.44Å; K487-I490 PolarHBondContact O-N 3.19Å; K487-D491 PolarHBondContact O-N 3.09Å; K487-D491 VanDerWaalsContact O-N 3.15Å
488	S	63.7	Low	56.2	Low	56 Å²	56	90.1 Å²	90.1	39%	0.392	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-35.4	177.1	63.8	0	0	0	0	112.2	D484 L485 I490 D491 E492	D484-S488 PolarHBondContact O-N 2.96Å; L485-S488 PolarHBondContact O-N 2.78Å; L485-S488 PolarHBondContact O-OG 2.72Å; L485-S488 VanDerWaalsContact O-OG 3.06Å; S488-I490 PolarHBondContact O-N 2.89Å; S488-D491 PolarHBondContact O-N 2.9Å; S488-E492 WeakPolarHBondContact O-CG 3.35Å; S488-E492 PolarHBondContact O-N 3.36Å; S488-E492 VanDerWaalsContact O-N 3.16Å
489	L	53.8	Low	54.3	Low	59 Å²	59	95.6 Å²	95.6	31%	0.309	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-10.9	172.9	-70.9	170.2	0	0	0	114.6	L485 K487 N493 I678	L485-L489 HydrophobicContact CG-CD1 4.4Å; L485-L489 VanDerWaalsContact O-CG 3.32Å; L485-L489 WeakPolarHBondContact O-CG 3.23Å; L485-L489 PolarHBondContact O-N 3.27Å; K487-L489 PolarHBondContact O-N 3.01Å; L489-N493 PolarHBondContact O-ND2 2.91Å; L489-I678 HydrophobicContact CD2-CD1 4.42Å
490	I	56	Low	52.2	Low	59 Å²	59	100.6 Å²	100.6	30%	0.303	52%	0.519	S	S	.	.	H	α-helix	trans	-92.3	-47.2	170.2	-67.4	169.5	0	0	0	109.9	K487 S488 E492 N493 F520	K487-I490 WeakPolarHBondContact O-CA 3.43Å; K487-I490 WeakPolarHBondContact O-CB 3.44Å; K487-I490 PolarHBondContact O-N 3.19Å; S488-I490 PolarHBondContact O-N 2.89Å; I490-E492 VanDerWaalsContact C-N 3.27Å; I490-E492 PolarHBondContact O-N 2.8Å; I490-N493 PolarHBondContact O-N 2.93Å; I490-N493 VanDerWaalsContact O-N 3.08Å; I490-F520 HydrophobicContact CD1-CB 4.2Å; I490-F520 HydrophobicContact CD1-CD2 3.52Å; I490-F520 HydrophobicContact CD1-CE2 3.91Å; I490-F520 HydrophobicContact CD1-CG 3.87Å
491	D	50.2	Low	50	Low	83 Å²	83	102.5 Å²	102.5	44%	0.444	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-30	-175.3	-63.1	-25.7	0	0	0	112.7	K487 S488 N493 N495	K487-D491 PolarHBondContact O-N 3.09Å; K487-D491 VanDerWaalsContact O-N 3.15Å; S488-D491 PolarHBondContact O-N 2.9Å; D491-N493 PolarHBondContact O-N 3.41Å; D491-N495 PolarHBondContact O-ND2 3.18Å
492	E	43.5	Very low	47.7	Very low	150 Å²	150	101.2 Å²	101.2	70%	0.701	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-63.9	-20	174.1	-71	-83.3	116.8	0	0	114.2	S488 I490	S488-E492 WeakPolarHBondContact O-CG 3.35Å; S488-E492 PolarHBondContact O-N 3.36Å; S488-E492 VanDerWaalsContact O-N 3.16Å; I490-E492 VanDerWaalsContact C-N 3.27Å; I490-E492 PolarHBondContact O-N 2.8Å
493	N	42.7	Very low	46	Very low	107 Å²	107	109.2 Å²	109.2	57%	0.572	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-91.1	-0.1	-175.8	-74.3	-100	0	0	0	114.3	L489 I490 D491	L489-N493 PolarHBondContact O-ND2 2.91Å; I490-N493 PolarHBondContact O-N 2.93Å; I490-N493 VanDerWaalsContact O-N 3.08Å; D491-N493 PolarHBondContact O-N 3.41Å
494	D	38.7	Very low	43.8	Very low	101 Å²	101	112.4 Å²	112.4	54%	0.54	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-105.5	2.2	-174.9	-89.9	-7	0	0	0	114.1	K513	D494-K513 IonicContact OD1-NZ 2.67Å; D494-K513 PolarHBondContact OD1-NZ 3.27Å; D494-K513 IonicContact OD2-NZ 2.69Å; D494-K513 PolarHBondContact OD2-NZ 3.38Å
495	N	35.1	Very low	41.8	Very low	126 Å²	126	114.4 Å²	114.4	67%	0.674	61%	0.613	S	S	*	*			trans	-108	-12.6	-167.4	-71.3	-54.1	0	0	0	117.3	D491 E497	D491-N495 PolarHBondContact O-ND2 3.18Å; N495-E497 PolarHBondContact O-N 3.27Å
496	D	33.3	Very low	39.8	Very low	158 Å²	158	118.5 Å²	118.5	85%	0.845	65%	0.646	S	S	*	*			trans	-98.2	60.3	-172.4	-84.2	-25.9	0	0	0	114.1
497	E	31.1	Very low	38.2	Very low	186 Å²	186	121.8 Å²	121.8	87%	0.869	67%	0.669	S	S	*	*			trans	-160.8	67.9	163.8	-129.4	173.3	-131	0	0	116	N495	N495-E497 PolarHBondContact O-N 3.27Å
498	E	28.8	Very low	36.6	Very low	196 Å²	196	120.7 Å²	120.7	92%	0.916	67%	0.669	S	S	*	*			trans	-129.7	62.5	165.6	-80.7	-152.2	150.3	0	0	114.2
499	T	33.8	Very low	35.3	Very low	139 Å²	139	124.4 Å²	124.4	85%	0.853	68%	0.684	S	S	*	*	S	Bend	trans	-144	93.4	155.1	54.5	0	0	0	0	113.9
500	D	30	Very low	34.1	Very low	143 Å²	143	125.9 Å²	125.9	77%	0.765	70%	0.699	S	S	*	*			trans	61.9	117	140.9	-121.9	31.8	0	0	0	122.5
501	N	28.2	Very low	33.2	Very low	146 Å²	146	126 Å²	126	78%	0.781	70%	0.703	S	S	*	*			trans	72.8	121.2	156.2	-52.5	-69	0	0	0	120.4
502	G	26.4	Very low	32.7	Very low	73 Å²	73	125.4 Å²	125.4	75%	0.753	70%	0.7	S	S	*	*			trans	175.7	-8.7	160.9	0	0	0	0	0	125.5
503	H	28.9	Very low	32.5	Very low	185 Å²	185	123.9 Å²	123.9	86%	0.856	69%	0.691	S	S	*	*			trans	63.8	143.4	-178.9	-87.1	-74.8	0	0	0	119.2
504	T	28	Very low	32.3	Very low	121 Å²	121	124 Å²	124	74%	0.742	69%	0.691	S	S	*	*			trans	52.8	95	155.9	53.9	0	0	0	0	120
505	D	26.2	Very low	32.7	Very low	137 Å²	137	124.5 Å²	124.5	73%	0.733	69%	0.688	S	S	*	*				-170.2	96	109	-109.3	-10.9	0	0	0	113.6	S507	D505-S507 VanDerWaalsContact C-N 3.32Å; D505-S507 PolarHBondContact O-N 2.83Å; D505-S507 VanDerWaalsContact O-N 3.12Å
506	S	27.3	Very low	33.4	Very low	135 Å²	135	121.1 Å²	121.1	94%	0.944	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	40.2	-171.9	66	0	0	0	0	114.8
507	S	30	Very low	34.3	Very low	80 Å²	80	118 Å²	118	56%	0.559	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	-13.8	-178.4	72.4	0	0	0	0	116.8	D505	D505-S507 VanDerWaalsContact C-N 3.32Å; D505-S507 PolarHBondContact O-N 2.83Å; D505-S507 VanDerWaalsContact O-N 3.12Å
508	L	32.9	Very low	35.5	Very low	95 Å²	95	112.5 Å²	112.5	50%	0.497	63%	0.628	S	S	.	*	S	Bend	trans	-86.4	-33.8	-176	-85.3	82.1	0	0	0	115	S510 T511	L508-S510 VanDerWaalsContact C-N 3.32Å; L508-S510 PolarHBondContact O-N 3.24Å; L508-T511 PolarHBondContact O-N 3.12Å; L508-T511 PolarHBondContact O-OG1 3.11Å
509	N	35.7	Very low	36.9	Very low	133 Å²	133	106.5 Å²	106.5	71%	0.711	60%	0.599	S	S	*	*	H	α-helix	trans	-64.7	-28.1	-167	-81	-0.3	0	0	0	115.1	T511 K513	N509-T511 VanDerWaalsContact C-N 3.31Å; N509-T511 PolarHBondContact O-N 2.83Å; N509-K513 PolarHBondContact O-N 3.44Å
510	S	30.4	Very low	38.2	Very low	90 Å²	90	102.1 Å²	102.1	63%	0.629	57%	0.568	S	S	*	*	H	α-helix	trans	-62.9	-37.1	172.7	56.3	0	0	0	0	112.3	L508 L514	L508-S510 VanDerWaalsContact C-N 3.32Å; L508-S510 PolarHBondContact O-N 3.24Å; S510-L514 PolarHBondContact O-N 3.1Å
511	T	36.9	Very low	39.8	Very low	62 Å²	62	98.9 Å²	98.9	38%	0.38	55%	0.551	S	S	.	*	H	α-helix	trans	-74.6	-27.2	-176	76.3	0	0	0	0	113	L508 N509 K515	L508-T511 PolarHBondContact O-N 3.12Å; L508-T511 PolarHBondContact O-OG1 3.11Å; N509-T511 VanDerWaalsContact C-N 3.31Å; N509-T511 PolarHBondContact O-N 2.83Å; T511-K515 WeakPolarHBondContact O-CD 3.35Å; T511-K515 VanDerWaalsContact O-CG 3.24Å; T511-K515 WeakPolarHBondContact O-CG 3.32Å; T511-K515 PolarHBondContact O-N 2.99Å
512	N	39.9	Very low	41.6	Very low	71 Å²	71	98.8 Å²	98.8	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-79.9	-43.5	179.5	-73.4	-16.7	0	0	0	111.6	L514 K515 H516	N512-L514 VanDerWaalsContact C-N 3.28Å; N512-L514 PolarHBondContact O-N 3.43Å; N512-K515 WeakPolarHBondContact O-CB 3.49Å; N512-K515 PolarHBondContact O-N 2.94Å; N512-K515 VanDerWaalsContact O-N 3.08Å; N512-K515 PolarHBondContact OD1-NZ 3.34Å; N512-K515 VanDerWaalsContact OD1-NZ 3.17Å; N512-H516 PolarHBondContact O-CD2 3.31Å; N512-H516 PolarHBondContact O-N 3.31Å
513	K	38.4	Very low	43.5	Very low	117 Å²	117	96 Å²	96	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-58.2	-41.5	175	-127.3	177.8	179.8	83.6	0	111.7	D494 N509 K515 H516 Q517	D494-K513 IonicContact OD1-NZ 2.67Å; D494-K513 PolarHBondContact OD1-NZ 3.27Å; D494-K513 IonicContact OD2-NZ 2.69Å; D494-K513 PolarHBondContact OD2-NZ 3.38Å; N509-K513 PolarHBondContact O-N 3.44Å; K513-K515 PolarHBondContact O-N 3.4Å; K513-H516 PolarHBondContact O-N 3.3Å; K513-Q517 WeakPolarHBondContact O-CB 3.39Å; K513-Q517 PolarHBondContact O-N 3.2Å
514	L	39.3	Very low	45.2	Very low	109 Å²	109	89.7 Å²	89.7	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-64.4	-34.9	175.7	-161.5	72.7	0	0	0	113.6	S510 N512 T518	S510-L514 PolarHBondContact O-N 3.1Å; N512-L514 VanDerWaalsContact C-N 3.28Å; N512-L514 PolarHBondContact O-N 3.43Å; L514-T518 WeakPolarHBondContact O-CG2 3.48Å; L514-T518 PolarHBondContact O-N 2.83Å; L514-T518 PolarHBondContact O-OG1 3.28Å
515	K	47	Very low	47.1	Very low	112 Å²	112	88.6 Å²	88.6	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-68.5	-39.4	174	-73.1	164.6	-163.8	157.4	0	112.3	T511 N512 K513 T518 K519	T511-K515 WeakPolarHBondContact O-CD 3.35Å; T511-K515 VanDerWaalsContact O-CG 3.24Å; T511-K515 WeakPolarHBondContact O-CG 3.32Å; T511-K515 PolarHBondContact O-N 2.99Å; N512-K515 WeakPolarHBondContact O-CB 3.49Å; N512-K515 PolarHBondContact O-N 2.94Å; N512-K515 VanDerWaalsContact O-N 3.08Å; N512-K515 PolarHBondContact OD1-NZ 3.34Å; N512-K515 VanDerWaalsContact OD1-NZ 3.17Å; K513-K515 PolarHBondContact O-N 3.4Å; K515-T518 WeakPolarHBondContact CA-OG1 3.45Å; K515-T518 PolarHBondContact O-OG1 3.45Å; K515-K519 PolarHBondContact O-N 3.01Å
516	H	48.4	Very low	49	Very low	55 Å²	55	86.6 Å²	86.6	26%	0.255	46%	0.459	S	S	.	.	H	α-helix	trans	-67.6	-43.3	175.6	-80.9	-108.6	0	0	0	111.1	N512 K513 T518 K519 F520 Q663	N512-H516 PolarHBondContact O-CD2 3.31Å; N512-H516 PolarHBondContact O-N 3.31Å; K513-H516 PolarHBondContact O-N 3.3Å; H516-T518 PolarHBondContact O-N 2.85Å; H516-K519 WeakPolarHBondContact O-CB 3.49Å; H516-K519 PolarHBondContact O-N 3.17Å; H516-F520 WeakPolarHBondContact O-CB 3.43Å; H516-F520 PolarHBondContact O-N 3.41Å; H516-Q663 PolarHBondContact CE1-NE2 2.91Å; H516-Q663 PolarHBondContact NE2-NE2 3.17Å
517	Q	52.3	Low	50.9	Low	92 Å²	92	81 Å²	81	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-38.1	176.9	-162.5	170	3.2	0	0	112.8	K513 F520 N521	K513-Q517 WeakPolarHBondContact O-CB 3.39Å; K513-Q517 PolarHBondContact O-N 3.2Å; Q517-F520 PolarHBondContact O-N 2.66Å; Q517-N521 VanDerWaalsContact O-CG 3.27Å; Q517-N521 PolarHBondContact O-N 3.37Å; Q517-N521 PolarHBondContact O-OD1 3.39Å
518	T	56.8	Low	52.6	Low	72 Å²	72	78.2 Å²	78.2	44%	0.442	40%	0.399	S	S	.	.	H	α-helix	trans	-75.7	-21.6	174.3	48.8	0	0	0	0	114.4	L514 K515 H516 K522	L514-T518 WeakPolarHBondContact O-CG2 3.48Å; L514-T518 PolarHBondContact O-N 2.83Å; L514-T518 PolarHBondContact O-OG1 3.28Å; K515-T518 WeakPolarHBondContact CA-OG1 3.45Å; K515-T518 PolarHBondContact O-OG1 3.45Å; H516-T518 PolarHBondContact O-N 2.85Å; T518-K522 WeakPolarHBondContact O-CG 3.35Å
519	K	57.6	Low	54.2	Low	69 Å²	69	76.6 Å²	76.6	30%	0.3	40%	0.395	S	S	.	.	H	α-helix	trans	-69.6	-51.2	163.7	-78	-175.6	178.3	-172.9	0	110.7	K515 H516 N521 K522 I523 S659	K515-K519 PolarHBondContact O-N 3.01Å; H516-K519 WeakPolarHBondContact O-CB 3.49Å; H516-K519 PolarHBondContact O-N 3.17Å; K519-N521 PolarHBondContact O-N 2.96Å; K519-K522 WeakPolarHBondContact O-CB 3.4Å; K519-K522 PolarHBondContact O-N 3.26Å; K519-I523 PolarHBondContact O-N 2.92Å; K519-I523 VanDerWaalsContact O-N 3.16Å; K519-S659 PolarHBondContact NZ-O 3.49Å
520	F	61.2	Low	55.8	Low	48 Å²	48	71.8 Å²	71.8	21%	0.211	37%	0.369	C	S	.	.	H	α-helix	trans	-54.7	-48.1	-179.8	173.3	-100.7	0	0	0	112.2	L486 I490 H516 Q517 K522 I523 L524	L486-F520 HydrophobicContact CB-CD2 4.08Å; L486-F520 HydrophobicContact CB-CE2 3.76Å; I490-F520 HydrophobicContact CD1-CB 4.2Å; I490-F520 HydrophobicContact CD1-CD2 3.52Å; I490-F520 HydrophobicContact CD1-CE2 3.91Å; I490-F520 HydrophobicContact CD1-CG 3.87Å; H516-F520 WeakPolarHBondContact O-CB 3.43Å; H516-F520 PolarHBondContact O-N 3.41Å; Q517-F520 PolarHBondContact O-N 2.66Å; F520-K522 VanDerWaalsContact C-N 3.25Å; F520-K522 PolarHBondContact O-N 3.06Å; F520-I523 PolarHBondContact O-N 3.27Å; F520-I523 VanDerWaalsContact O-N 3.09Å; F520-L524 HydrophobicContact CD1-CD1 3.88Å; F520-L524 HydrophobicContact CE1-CD1 3.36Å; F520-L524 HydrophobicContact CE1-CG 4.33Å; F520-L524 HydrophobicContact CE2-CD1 4.4Å; F520-L524 HydrophobicContact CZ-CD1 3.67Å; F520-L524 HydrophobicContact CZ-CG 4.35Å; F520-L524 PolarHBondContact O-N 3.42Å
521	N	64.4	Low	57.6	Low	75 Å²	75	69.8 Å²	69.8	40%	0.401	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-33	176.3	-70.9	-5.4	0	0	0	112.9	Q517 K519 L525	Q517-N521 VanDerWaalsContact O-CG 3.27Å; Q517-N521 PolarHBondContact O-N 3.37Å; Q517-N521 PolarHBondContact O-OD1 3.39Å; K519-N521 PolarHBondContact O-N 2.96Å; N521-L525 WeakPolarHBondContact O-CB 3.21Å; N521-L525 WeakPolarHBondContact O-CD1 3.39Å; N521-L525 VanDerWaalsContact O-CG 3.24Å; N521-L525 WeakPolarHBondContact O-CG 3.17Å; N521-L525 PolarHBondContact O-N 3.39Å
522	K	66.4	Low	58.9	Low	143 Å²	143	71 Å²	71	62%	0.622	36%	0.358	S	S	*	.	H	α-helix	trans	-71.2	-37.7	175.6	-73.5	172.5	-179.6	175	0	112.6	T518 K519 F520 L525 Q526	T518-K522 WeakPolarHBondContact O-CG 3.35Å; K519-K522 WeakPolarHBondContact O-CB 3.4Å; K519-K522 PolarHBondContact O-N 3.26Å; F520-K522 VanDerWaalsContact C-N 3.25Å; F520-K522 PolarHBondContact O-N 3.06Å; K522-L525 PolarHBondContact O-N 2.89Å; K522-Q526 WeakPolarHBondContact O-CG 3.38Å; K522-Q526 PolarHBondContact O-N 3.22Å
523	I	65.4	Low	60.4	Low	15 Å²	15	70.7 Å²	70.7	8%	0.077	36%	0.357	C	S	.	.	H	α-helix	trans	-67.1	-42.1	175.3	-58	171.4	0	0	0	109.9	L486 K519 F520 L525 Q526 L527 I655	L486-I523 HydrophobicContact CD1-CB 4.44Å; L486-I523 HydrophobicContact CD1-CG2 3.67Å; L486-I523 HydrophobicContact CD2-CD1 4.11Å; L486-I523 HydrophobicContact CD2-CG2 3.98Å; K519-I523 PolarHBondContact O-N 2.92Å; K519-I523 VanDerWaalsContact O-N 3.16Å; F520-I523 PolarHBondContact O-N 3.27Å; F520-I523 VanDerWaalsContact O-N 3.09Å; I523-L525 PolarHBondContact O-N 3.08Å; I523-Q526 PolarHBondContact O-N 2.88Å; I523-L527 HydrophobicContact CG2-CD1 4.3Å; I523-L527 PolarHBondContact O-N 3.1Å; I523-I655 HydrophobicContact CG1-CG2 4.45Å; I523-I655 HydrophobicContact CG2-CG2 4.27Å
524	L	65.3	Low	62.1	Low	53 Å²	53	65.9 Å²	65.9	28%	0.277	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-41.2	173	-78.4	176	0	0	0	113	V483 F520 Q526 L527 S528	V483-L524 HydrophobicContact CG2-CD2 4.08Å; F520-L524 HydrophobicContact CD1-CD1 3.88Å; F520-L524 HydrophobicContact CE1-CD1 3.36Å; F520-L524 HydrophobicContact CE1-CG 4.33Å; F520-L524 HydrophobicContact CE2-CD1 4.4Å; F520-L524 HydrophobicContact CZ-CD1 3.67Å; F520-L524 HydrophobicContact CZ-CG 4.35Å; F520-L524 PolarHBondContact O-N 3.42Å; L524-Q526 VanDerWaalsContact C-N 3.33Å; L524-Q526 PolarHBondContact O-N 2.82Å; L524-L527 PolarHBondContact O-N 3.43Å; L524-S528 WeakPolarHBondContact O-CB 3.49Å; L524-S528 PolarHBondContact O-N 3.32Å
525	L	67.9	Low	63.8	Low	97 Å²	97	65.2 Å²	65.2	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-66.9	-32.8	175	-74	166.7	0	0	0	112.4	N521 K522 I523 S529 L1123	N521-L525 WeakPolarHBondContact O-CB 3.21Å; N521-L525 WeakPolarHBondContact O-CD1 3.39Å; N521-L525 VanDerWaalsContact O-CG 3.24Å; N521-L525 WeakPolarHBondContact O-CG 3.17Å; N521-L525 PolarHBondContact O-N 3.39Å; K522-L525 PolarHBondContact O-N 2.89Å; I523-L525 PolarHBondContact O-N 3.08Å; L525-S529 WeakPolarHBondContact O-CB 3.49Å; L525-S529 PolarHBondContact O-N 3.46Å; L525-L1123 HydrophobicContact CD2-CD1 4.43Å
526	Q	65.6	Low	65.4	Low	96 Å²	96	61 Å²	61	45%	0.449	31%	0.314	S	S	.	.	H	α-helix	trans	-71.3	-41.9	172.9	-75.1	179.5	-35.5	0	0	112.2	K522 I523 L524 S529 I530	K522-Q526 WeakPolarHBondContact O-CG 3.38Å; K522-Q526 PolarHBondContact O-N 3.22Å; I523-Q526 PolarHBondContact O-N 2.88Å; L524-Q526 VanDerWaalsContact C-N 3.33Å; L524-Q526 PolarHBondContact O-N 2.82Å; Q526-S529 PolarHBondContact O-N 3.13Å; Q526-I530 WeakPolarHBondContact O-CG1 3.4Å; Q526-I530 PolarHBondContact O-N 3.42Å
527	L	67.1	Low	67.1	Low	18 Å²	18	58.5 Å²	58.5	9%	0.094	30%	0.303	C	S	.	.	H	α-helix	trans	-58.3	-48.2	170.5	-83.3	163.1	0	0	0	111.5	L486 I523 L524 S529 I530 L531 L652	L486-L527 HydrophobicContact CD1-CD1 3.7Å; I523-L527 HydrophobicContact CG2-CD1 4.3Å; I523-L527 PolarHBondContact O-N 3.1Å; L524-L527 PolarHBondContact O-N 3.43Å; L527-S529 VanDerWaalsContact C-N 3.34Å; L527-S529 PolarHBondContact O-N 2.92Å; L527-I530 PolarHBondContact O-N 3.47Å; L527-L531 WeakPolarHBondContact O-CB 3.19Å; L527-L531 VanDerWaalsContact O-CG 3.24Å; L527-L531 WeakPolarHBondContact O-CG 3.29Å; L527-L531 PolarHBondContact O-N 3.08Å; L527-L652 HydrophobicContact CD2-CD1 3.73Å; L527-L652 HydrophobicContact CD2-CD2 3.61Å; L527-L652 HydrophobicContact CD2-CG 4.3Å; L527-L652 HydrophobicContact CG-CD2 4.01Å
528	S	65.6	Low	68.7	Low	20 Å²	20	54.6 Å²	54.6	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-54.4	-48.1	173.5	165.3	0	0	0	0	111.5	L524 I530 L531 T532 F1126	L524-S528 WeakPolarHBondContact O-CB 3.49Å; L524-S528 PolarHBondContact O-N 3.32Å; S528-I530 PolarHBondContact O-N 3.23Å; S528-L531 PolarHBondContact O-N 3.04Å; S528-T532 WeakPolarHBondContact O-CG2 3.46Å; S528-T532 PolarHBondContact O-N 3.48Å; S528-T532 PolarHBondContact O-OG1 2.78Å; S528-T532 VanDerWaalsContact O-OG1 3.09Å; S528-F1126 VanDerWaalsContact CB-CZ 3.43Å; S528-F1126 VanDerWaalsContact OG-CE1 3.3Å; S528-F1126 WeakPolarHBondContact OG-CE1 3.42Å; S528-F1126 VanDerWaalsContact OG-CE2 3.3Å; S528-F1126 WeakPolarHBondContact OG-CE2 3.14Å; S528-F1126 WeakPolarHBondContact OG-CZ 3.23Å
529	S	67.7	Low	69.9	Low	62 Å²	62	51.2 Å²	51.2	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-63.6	-35.6	178.2	-169.9	0	0	0	0	113.6	L525 Q526 L527 T532 N533	L525-S529 WeakPolarHBondContact O-CB 3.49Å; L525-S529 PolarHBondContact O-N 3.46Å; Q526-S529 PolarHBondContact O-N 3.13Å; L527-S529 VanDerWaalsContact C-N 3.34Å; L527-S529 PolarHBondContact O-N 2.92Å; S529-T532 PolarHBondContact O-OG1 3.32Å; S529-N533 PolarHBondContact O-N 3.36Å; S529-N533 PolarHBondContact O-ND2 3.42Å
530	I	68.7	Low	71.1	Confident	32 Å²	32	48.2 Å²	48.2	16%	0.164	25%	0.252	C	S	.	.	H	α-helix	trans	-67.2	-44.9	173.3	-69.5	160.3	0	0	0	110.4	Q526 L527 S528 N533 L534 L634 I651 I655	Q526-I530 WeakPolarHBondContact O-CG1 3.4Å; Q526-I530 PolarHBondContact O-N 3.42Å; L527-I530 PolarHBondContact O-N 3.47Å; S528-I530 PolarHBondContact O-N 3.23Å; I530-N533 PolarHBondContact O-N 3.2Å; I530-L534 PolarHBondContact O-N 3.01Å; I530-L634 HydrophobicContact CG2-CD1 4.28Å; I530-L634 HydrophobicContact CG2-CD2 4.01Å; I530-L634 VanDerWaalsContact O-CD1 3.3Å; I530-L634 WeakPolarHBondContact O-CD1 3.3Å; I530-I651 HydrophobicContact CD1-CG2 3.67Å; I530-I655 HydrophobicContact CD1-CD1 4.37Å
531	L	67.1	Low	71.7	Confident	47 Å²	47	48.4 Å²	48.4	25%	0.246	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-41.6	-179.6	-68.6	169	0	0	0	112.6	L475 L527 S528 N533 L534	L475-L531 HydrophobicContact CD1-CD2 3.6Å; L475-L531 HydrophobicContact CD2-CD2 3.76Å; L475-L531 HydrophobicContact CG-CD2 3.54Å; L527-L531 WeakPolarHBondContact O-CB 3.19Å; L527-L531 VanDerWaalsContact O-CG 3.24Å; L527-L531 WeakPolarHBondContact O-CG 3.29Å; L527-L531 PolarHBondContact O-N 3.08Å; S528-L531 PolarHBondContact O-N 3.04Å; L531-N533 VanDerWaalsContact C-N 3.31Å; L531-N533 PolarHBondContact O-N 3.03Å; L531-L534 PolarHBondContact O-N 3.12Å
532	T	65.9	Low	71.3	Confident	87 Å²	87	49.7 Å²	49.7	53%	0.534	26%	0.255	S	S	.	.	H	α-helix	trans	-72.3	-20.7	179.3	53.2	0	0	0	0	113.9	S528 S529 F1126	S528-T532 WeakPolarHBondContact O-CG2 3.46Å; S528-T532 PolarHBondContact O-N 3.48Å; S528-T532 PolarHBondContact O-OG1 2.78Å; S528-T532 VanDerWaalsContact O-OG1 3.09Å; S529-T532 PolarHBondContact O-OG1 3.32Å; T532-F1126 HydrophobicContact CG2-CD2 4.48Å; T532-F1126 HydrophobicContact CG2-CE2 3.78Å
533	N	70.5	Confident	70.2	Confident	66 Å²	66	47.7 Å²	47.7	35%	0.353	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-1.5	175.5	-75.7	-71.4	0	0	0	113.8	S529 I530 L531 Q535 L634	S529-N533 PolarHBondContact O-N 3.36Å; S529-N533 PolarHBondContact O-ND2 3.42Å; I530-N533 PolarHBondContact O-N 3.2Å; L531-N533 VanDerWaalsContact C-N 3.31Å; L531-N533 PolarHBondContact O-N 3.03Å; N533-Q535 PolarHBondContact O-N 2.87Å; N533-L634 HydrophobicContact CB-CD1 3.9Å
534	L	74.7	Confident	69	Low	15 Å²	15	52.8 Å²	52.8	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	116.7	177.2	-163.2	78.7	0	0	0	110.9	L471 L475 I530 L531 W632 Q633 L634 L644	L471-L534 HydrophobicContact CD2-CD2 4.28Å; L475-L534 HydrophobicContact CD1-CD2 3.72Å; L475-L534 HydrophobicContact CD2-CD2 3.62Å; L475-L534 HydrophobicContact CG-CD2 4.28Å; I530-L534 PolarHBondContact O-N 3.01Å; L531-L534 PolarHBondContact O-N 3.12Å; L534-W632 HydrophobicContact CD1-CB 4.18Å; L534-W632 HydrophobicContact CD1-CE3 4.12Å; L534-Q633 WeakPolarHBondContact CA-O 3.36Å; L534-L634 HydrophobicContact CD1-CB 4.07Å; L534-L634 HydrophobicContact CD1-CD1 4.37Å; L534-L644 HydrophobicContact CD1-CD1 3.98Å; L534-L644 HydrophobicContact CD2-CD1 4.42Å; L534-L644 HydrophobicContact CD2-CD2 4.14Å
535	Q	75.1	Confident	67.5	Low	95 Å²	95	57.2 Å²	57.2	44%	0.444	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	147.8	178.2	-62.6	-172.1	0.2	0	0	111.5	N533 Q633	N533-Q535 PolarHBondContact O-N 2.87Å; Q535-Q633 HydrophobicContact CB-CB 4.43Å; Q535-Q633 PolarHBondContact N-O 2.76Å; Q535-Q633 PolarHBondContact O-N 3.38Å
536	V	80.7	Confident	65.8	Low	23 Å²	23	57.9 Å²	57.9	14%	0.139	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	122.4	173.9	-178.2	0	0	0	0	108.8	R468 L471 W472 Y538 I630	R468-V536 HydrophobicContact CG-CG1 4.47Å; L471-V536 HydrophobicContact CD2-CG2 4.32Å; W472-V536 HydrophobicContact CZ2-CG2 4.28Å; V536-Y538 HydrophobicContact CB-CE2 4.49Å; V536-Y538 HydrophobicContact CG1-CE1 4.44Å; V536-Y538 HydrophobicContact CG1-CE2 3.91Å; V536-I630 HydrophobicContact CG1-CD1 4.39Å; V536-I630 HydrophobicContact CG1-CG2 3.59Å
537	V	83	Confident	63.9	Low	4 Å²	4	62.5 Å²	62.5	2%	0.024	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.8	177.6	-175.7	0	0	0	0	109.3	V539 R579 I630 H631 Q633	V537-V539 HydrophobicContact CG1-CG2 4.03Å; V537-R579 HydrophobicContact CG1-CB 4Å; V537-R579 HydrophobicContact CG1-CG 4.27Å; V537-I630 CarbonylContact O-C 2.92Å; V537-I630 WeakPolarHBondContact O-CA 3.37Å; V537-H631 HydrophobicContact CB-CB 4.47Å; V537-H631 PolarHBondContact N-O 2.74Å; V537-H631 PolarHBondContact O-N 3.08Å; V537-Q633 HydrophobicContact CG2-CB 3.67Å
538	Y	85.9	Confident	62.1	Low	9 Å²	9	67.5 Å²	67.5	4%	0.035	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128	178.1	-58	-96.9	0	0	0	108.7	L464 V536 R579 F580 L583 A586 I630	L464-Y538 HydrophobicContact CD1-CD1 4.28Å; L464-Y538 HydrophobicContact CD2-CD1 4.19Å; V536-Y538 HydrophobicContact CB-CE2 4.49Å; V536-Y538 HydrophobicContact CG1-CE1 4.44Å; V536-Y538 HydrophobicContact CG1-CE2 3.91Å; Y538-R579 CarbonylContact O-C 3.56Å; Y538-R579 WeakPolarHBondContact O-CA 3.43Å; Y538-F580 PolarHBondContact N-O 3.14Å; Y538-F580 PolarHBondContact O-N 3.15Å; Y538-L583 HydrophobicContact CD1-CD1 4.08Å; Y538-L583 HydrophobicContact CE1-CB 3.91Å; Y538-L583 HydrophobicContact CE1-CD1 3.83Å; Y538-L583 HydrophobicContact CE1-CG 4.35Å; Y538-L583 HydrophobicContact CE2-CB 4.3Å; Y538-A586 HydrophobicContact CG-CB 4.27Å; Y538-I630 HydrophobicContact CD1-CD1 3.87Å; Y538-I630 HydrophobicContact CD1-CG1 3.74Å; Y538-I630 HydrophobicContact CE1-CD1 3.57Å; Y538-I630 HydrophobicContact CE1-CG1 3.98Å; Y538-I630 HydrophobicContact CG-CG1 4.48Å
539	V	83.1	Confident	60.1	Low	1 Å²	1	70.1 Å²	70.1	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138	-165.1	-177.5	0	0	0	0	109.9	V537 V577 T578 R579 F628 D629 H631	V537-V539 HydrophobicContact CG1-CG2 4.03Å; V539-V577 HydrophobicContact CG1-CG1 3.24Å; V539-T578 CarbonylContact C-O 3.05Å; V539-R579 HydrophobicContact CG2-CG 4.23Å; V539-F628 CarbonylContact O-C 3.5Å; V539-F628 VanDerWaalsContact O-CA 3.25Å; V539-F628 WeakPolarHBondContact O-CA 3.46Å; V539-D629 PolarHBondContact N-O 3.31Å; V539-D629 PolarHBondContact O-N 2.9Å; V539-H631 HydrophobicContact CG2-CB 4.05Å; V539-H631 WeakPolarHBondContact CG2-CD2 3.28Å
540	C	82.5	Confident	58.6	Low	7 Å²	7	73.2 Å²	73.2	5%	0.047	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.6	-179.1	176.3	0	0	0	0	111.5	V577 T578 F580 I627 F628	C540-V577 WeakPolarHBondContact O-CA 3.47Å; C540-T578 PolarHBondContact N-O 3.46Å; C540-T578 PolarHBondContact O-N 2.68Å; C540-T578 PolarHBondContact O-OG1 2.67Å; C540-F580 HydrophobicContact CB-CE2 4.21Å; C540-I627 VanDerWaalsContact CA-O 3.3Å; C540-I627 WeakPolarHBondContact CA-O 3.42Å; C540-I627 PolarHBondContact SG-O 3.02Å; C540-F628 HydrophobicContact CB-CD1 3.78Å; C540-F628 HydrophobicContact CB-CE1 3.63Å; C540-F628 HydrophobicContact CB-CE2 4.36Å; C540-F628 HydrophobicContact CB-CG 4.24Å; C540-F628 HydrophobicContact CB-CZ 3.95Å
541	H	74.1	Confident	56.5	Low	52 Å²	52	78.9 Å²	78.9	24%	0.241	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	109.6	-173.8	-62.2	-99.4	0	0	0	110.5	N543 I627	H541-N543 PolarHBondContact O-N 3.49Å; H541-I627 PolarHBondContact N-O 3.36Å
542	K	55.5	Low	54.9	Low	101 Å²	101	82.9 Å²	82.9	44%	0.439	44%	0.441	S	S	.	.			trans	-79.6	36	-171	-66.1	-173.4	174.7	-176.8	0	115.8	C576 T578	K542-C576 HydrophobicContact CB-CB 4.48Å; K542-C576 WeakPolarHBondContact CB-O 3.38Å; K542-C576 HydrophobicContact CD-CB 4.45Å; K542-C576 WeakPolarHBondContact CD-O 3.48Å; K542-C576 WeakPolarHBondContact CG-O 3.41Å; K542-T578 VanDerWaalsContact CE-OG1 3.25Å; K542-T578 WeakPolarHBondContact CE-OG1 3.39Å
543	N	43.1	Very low	53.1	Low	102 Å²	102	85.9 Å²	85.9	55%	0.545	45%	0.454	S	S	.	.			trans	-95.6	14.6	-176.1	-78.8	13.4	0	0	0	115	H541	H541-N543 PolarHBondContact O-N 3.49Å
544	Y	39.4	Very low	51	Low	122 Å²	122	88.8 Å²	88.8	48%	0.478	48%	0.478	S	S	.	.			trans	-119.3	67.5	-177.8	-92.8	-76.7	0	0	0	114.6	R597 E626	Y544-R597 PolarHBondContact O-NH2 2.71Å; Y544-E626 HydrophobicContact CE2-CB 4.42Å; Y544-E626 WeakPolarHBondContact CE2-OE2 3.25Å; Y544-E626 PolarHBondContact OH-OE2 3.26Å
545	L	33.9	Very low	48.9	Very low	146 Å²	146	92.7 Å²	92.7	76%	0.764	51%	0.507	S	S	*	.			trans	-148	102.3	162.1	-101.7	172.7	0	0	0	110.2
546	P	31.6	Very low	46.8	Very low	111 Å²	111	93.3 Å²	93.3	72%	0.721	52%	0.521	S	S	*	.			trans	-77.9	132.4	172.7	31	-32.5	0	0	0	111.3
547	F	26.4	Very low	44.8	Very low	193 Å²	193	97.4 Å²	97.4	85%	0.846	55%	0.549	S	S	*	.			trans	28.2	100.8	159.8	-79.5	-93.9	0	0	0	119.3
548	I	28.9	Very low	42.1	Very low	123 Å²	123	102.6 Å²	102.6	63%	0.631	59%	0.585	S	S	*	*			trans	-127.4	105.3	139.9	-58.3	170.9	0	0	0	107.5	F604	I548-F604 HydrophobicContact CD1-CE2 3.7Å; I548-F604 HydrophobicContact CD1-CZ 3.74Å; I548-F604 HydrophobicContact CG1-CZ 4.22Å; I548-F604 HydrophobicContact CG2-CZ 4.36Å
549	S	24.4	Very low	39.4	Very low	75 Å²	75	107.8 Å²	107.8	52%	0.524	62%	0.623	S	S	.	*			trans	-103.4	119	173.6	52.6	0	0	0	0	109.6	L551	S549-L551 PolarHBondContact O-N 3.18Å; S549-L551 VanDerWaalsContact O-N 3.13Å
550	P	35.7	Very low	36.8	Very low	127 Å²	127	113.5 Å²	113.5	83%	0.825	66%	0.663	S	S	*	*			trans	-73.4	106.9	-174.9	28.1	-33.9	0	0	0	111.9
551	L	25.6	Very low	34.2	Very low	150 Å²	150	118.4 Å²	118.4	79%	0.785	70%	0.697	S	S	*	*			trans	-85.2	112	166.3	-98	75.8	0	0	0	110.5	S549	S549-L551 PolarHBondContact O-N 3.18Å; S549-L551 VanDerWaalsContact O-N 3.13Å
552	T	32.8	Very low	32.3	Very low	131 Å²	131	121.3 Å²	121.3	80%	0.804	72%	0.721	S	S	*	*			trans	-141.4	104.9	148.7	51.5	0	0	0	0	109.8	C554	T552-C554 PolarHBondContact O-N 2.8Å
553	N	27.4	Very low	31	Very low	150 Å²	150	121.8 Å²	121.8	80%	0.802	74%	0.736	S	S	*	*			trans	-76.1	117	170.7	-87.6	-30.5	0	0	0	110.4
554	C	26.7	Very low	30.3	Very low	128 Å²	128	123.9 Å²	123.9	87%	0.865	75%	0.746	S	S	*	*			trans	-124	69.6	160.4	-79.8	0	0	0	0	109.8	T552	T552-C554 PolarHBondContact O-N 2.8Å
555	S	31	Very low	29.7	Very low	97 Å²	97	125.9 Å²	125.9	68%	0.678	77%	0.765	S	S	*	*			trans	-61.2	154.9	162.7	-41	0	0	0	0	109.7
556	S	30.5	Very low	29.4	Very low	107 Å²	107	126 Å²	126	75%	0.748	77%	0.766	S	S	*	*			cis	177.2	-162.7	-14	60.3	0	0	0	0	105.5
557	P	39.2	Very low	29.1	Very low	110 Å²	110	129.2 Å²	129.2	71%	0.714	77%	0.773	S	S	*	*			cis	-129.1	171.3	-26.4	39.3	-25.2	0	0	0	113.1
558	S	27.2	Very low	29.1	Very low	112 Å²	112	124.3 Å²	124.3	78%	0.783	76%	0.763	S	S	*	*			trans	-175.6	133.7	132.3	24.2	0	0	0	0	112.3
559	S	28.4	Very low	29.4	Very low	118 Å²	118	124 Å²	124	83%	0.825	77%	0.769	S	S	*	*			trans	20.7	129.5	161.4	55.1	0	0	0	0	120.3
560	S	29.4	Very low	29.3	Very low	122 Å²	122	127.5 Å²	127.5	85%	0.853	78%	0.782	S	S	*	*			cis	-148.5	165.2	21.5	52.1	0	0	0	0	114.7
561	S	26.3	Very low	29	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	78%	0.783	S	S	*	*			trans	-129.9	-177.1	177.3	60.4	0	0	0	0	108.7
562	P	35.6	Very low	29.2	Very low	114 Å²	114	128.5 Å²	128.5	74%	0.74	78%	0.78	S	S	*	*			cis	-117.4	-169	-3.7	31.4	-7.9	0	0	0	111.1
563	S	28.1	Very low	28.9	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	78%	0.783	S	S	*	*			cis	-156.9	160.4	30	-47.6	0	0	0	0	113.3
564	I	28.1	Very low	29.3	Very low	147 Å²	147	129.9 Å²	129.9	75%	0.754	79%	0.786	S	S	*	*			trans	-119.9	143.6	172	-66.9	168	0	0	0	108.3	L566	I564-L566 HydrophobicContact CG2-CD1 3.92Å
565	N	26.3	Very low	30	Very low	164 Å²	164	128.9 Å²	128.9	88%	0.877	77%	0.769	S	S	*	*			trans	-155.8	150.6	140	-118.9	-20.3	0	0	0	112.1
566	L	28.6	Very low	30.9	Very low	147 Å²	147	128.2 Å²	128.2	77%	0.77	76%	0.763	S	S	*	*			trans	-103	138.8	-173.7	-66	82.1	0	0	0	111.8	I564	I564-L566 HydrophobicContact CG2-CD1 3.92Å
567	M	23.5	Very low	32.5	Very low	179 Å²	179	125 Å²	125	88%	0.882	74%	0.739	S	S	*	*			trans	-171.3	138.7	146.1	-77.4	-141.5	95.5	0	0	105.6
568	S	26.4	Very low	34.4	Very low	90 Å²	90	121.4 Å²	121.4	63%	0.629	72%	0.715	S	S	*	*			cis	-145.4	167.5	4.6	-79.2	0	0	0	0	109.3
569	P	35.5	Very low	36.9	Very low	118 Å²	118	122.2 Å²	122.2	77%	0.766	70%	0.701	S	S	*	*			trans	-67.9	137.6	171	29.3	-35.8	0	0	0	112.1
570	D	23.4	Very low	39.5	Very low	147 Å²	147	118.3 Å²	118.3	79%	0.786	67%	0.669	S	S	*	*			trans	168.5	110.4	139	-95	-15.5	0	0	0	112.5
571	K	28.6	Very low	41.9	Very low	195 Å²	195	118.7 Å²	118.7	85%	0.848	66%	0.655	S	S	*	*			trans	155.6	140	131.5	-85	157.8	-174.3	176.5	0	114.8
572	S	29.3	Very low	44.5	Very low	104 Å²	104	114.1 Å²	114.1	73%	0.727	62%	0.624	S	S	*	*			trans	50.1	87.6	162.9	59.9	0	0	0	0	118.3	Q574	S572-Q574 PolarHBondContact O-N 3.09Å
573	S	27.6	Very low	46.8	Very low	123 Å²	123	108.7 Å²	108.7	86%	0.86	59%	0.588	S	S	*	*			trans	-74.2	93.2	154.9	43.2	0	0	0	0	110.7	Q575	S573-Q575 PolarHBondContact O-N 3.43Å; S573-Q575 VanDerWaalsContact O-N 3.17Å
574	Q	36.4	Very low	49.5	Very low	186 Å²	186	104.5 Å²	104.5	87%	0.869	56%	0.558	S	S	*	*			trans	-70.1	109.9	172.8	-75.8	-173.3	-30.5	0	0	110.8	S572 C576	S572-Q574 PolarHBondContact O-N 3.09Å; Q574-C576 PolarHBondContact O-N 2.79Å
575	Q	41.6	Very low	52.1	Low	107 Å²	107	101.7 Å²	101.7	50%	0.5	54%	0.544	S	S	.	.			trans	-63.1	130.8	169.1	-63.7	-173.5	3	0	0	109.9	S573 V577	S573-Q575 PolarHBondContact O-N 3.43Å; S573-Q575 VanDerWaalsContact O-N 3.17Å; Q575-V577 VanDerWaalsContact C-N 3.32Å; Q575-V577 HydrophobicContact CB-CG2 4.08Å; Q575-V577 PolarHBondContact O-N 3.32Å
576	C	48.2	Very low	54.9	Low	84 Å²	84	93.9 Å²	93.9	57%	0.568	50%	0.503	S	S	*	.			trans	-80.5	80	179.3	-169.3	0	0	0	0	110.7	K542 Q574	K542-C576 HydrophobicContact CB-CB 4.48Å; K542-C576 WeakPolarHBondContact CB-O 3.38Å; K542-C576 HydrophobicContact CD-CB 4.45Å; K542-C576 WeakPolarHBondContact CD-O 3.48Å; K542-C576 WeakPolarHBondContact CG-O 3.41Å; Q574-C576 PolarHBondContact O-N 2.79Å
577	V	65.5	Low	57.6	Low	39 Å²	39	87.1 Å²	87.1	24%	0.236	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	125	-177.7	177.7	0	0	0	0	111.2	V539 C540 Q575	V539-V577 HydrophobicContact CG1-CG1 3.24Å; C540-V577 WeakPolarHBondContact O-CA 3.47Å; Q575-V577 VanDerWaalsContact C-N 3.32Å; Q575-V577 HydrophobicContact CB-CG2 4.08Å; Q575-V577 PolarHBondContact O-N 3.32Å
578	T	77.6	Confident	60.4	Low	34 Å²	34	81.7 Å²	81.7	21%	0.209	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.5	174.7	30.9	0	0	0	0	111.7	V539 C540 K542	V539-T578 CarbonylContact C-O 3.05Å; C540-T578 PolarHBondContact N-O 3.46Å; C540-T578 PolarHBondContact O-N 2.68Å; C540-T578 PolarHBondContact O-OG1 2.67Å; K542-T578 VanDerWaalsContact CE-OG1 3.25Å; K542-T578 WeakPolarHBondContact CE-OG1 3.39Å
579	R	80.2	Confident	63	Low	130 Å²	130	79.6 Å²	79.6	49%	0.491	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.8	-174.1	-64.7	173.1	168.6	77.8	-6.6	111.8	V537 Y538 V539 E638	V537-R579 HydrophobicContact CG1-CB 4Å; V537-R579 HydrophobicContact CG1-CG 4.27Å; Y538-R579 CarbonylContact O-C 3.56Å; Y538-R579 WeakPolarHBondContact O-CA 3.43Å; V539-R579 HydrophobicContact CG2-CG 4.23Å; R579-E638 WeakPolarHBondContact CD-OE1 3.25Å; R579-E638 IonicContact CZ-OE1 2.67Å; R579-E638 IonicContact CZ-OE2 2.65Å; R579-E638 IonicContact NE-OE1 2.84Å; R579-E638 PolarHBondContact NE-OE1 3.17Å; R579-E638 IonicContact NE-OE2 2.63Å; R579-E638 PolarHBondContact NE-OE2 2.87Å; R579-E638 IonicContact NH2-OE2 2.66Å; R579-E638 PolarHBondContact NH2-OE2 3.25Å
580	F	84	Confident	65.3	Low	36 Å²	36	75 Å²	75	16%	0.158	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.2	179.2	-47	-83.9	0	0	0	110.3	Y538 C540 S582 N585 A586 H589 F628	Y538-F580 PolarHBondContact N-O 3.14Å; Y538-F580 PolarHBondContact O-N 3.15Å; C540-F580 HydrophobicContact CB-CE2 4.21Å; F580-S582 VanDerWaalsContact C-N 3.34Å; F580-N585 HydrophobicContact CB-CB 4.1Å; F580-N585 HydrophobicContact CD1-CB 4.14Å; F580-N585 HydrophobicContact CG-CB 4.46Å; F580-A586 HydrophobicContact CB-CB 4.27Å; F580-A586 HydrophobicContact CD2-CB 3.93Å; F580-A586 HydrophobicContact CG-CB 4.21Å; F580-H589 HydrophobicContact CE1-CB 3.71Å; F580-H589 AromaticContact CE1-CG 3.94Å; F580-H589 HydrophobicContact CE2-CB 4.24Å; F580-H589 HydrophobicContact CZ-CB 3.49Å; F580-H589 VanDerWaalsContact CZ-CB 3.49Å; F580-H589 AromaticContact CZ-CD2 3.67Å; F580-H589 AromaticContact CZ-CG 3.35Å; F580-H589 AromaticContact CZ-ND1 3.71Å; F580-F628 HydrophobicContact CD2-CE1 4.43Å; F580-F628 HydrophobicContact CE2-CE1 4.07Å
581	K	78.4	Confident	68.1	Low	129 Å²	129	70 Å²	70	56%	0.561	36%	0.361	S	S	*	.	S	Bend	trans	-84.4	-2.3	177.7	-76.2	-170.7	172.7	-75.1	0	114.5
582	S	82.4	Confident	70.6	Confident	14 Å²	14	64.1 Å²	64.1	10%	0.098	34%	0.342	C	S	.	.	S	Bend	trans	-146.9	151.6	176.7	60.7	0	0	0	0	112.8	E262 F580 T584 N585 A586	E262-S582 WeakPolarHBondContact OE1-CB 3.28Å; F580-S582 VanDerWaalsContact C-N 3.34Å; S582-T584 VanDerWaalsContact C-N 3.29Å; S582-T584 PolarHBondContact O-N 3.44Å; S582-N585 PolarHBondContact O-N 2.74Å; S582-N585 PolarHBondContact OG-ND2 3.49Å; S582-A586 PolarHBondContact O-N 3.46Å; S582-A586 VanDerWaalsContact O-N 3.16Å
583	L	84.2	Confident	72.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-38.3	178.7	-178.2	54.3	0	0	0	111.4	F461 L464 V465 Y538 N585 A586 L587	F461-L583 HydrophobicContact CD2-CD2 4.11Å; F461-L583 HydrophobicContact CE2-CD2 3.89Å; L464-L583 HydrophobicContact CB-CD1 4.05Å; L464-L583 HydrophobicContact CD1-CD1 3.63Å; V465-L583 HydrophobicContact CG2-CD2 4.26Å; Y538-L583 HydrophobicContact CD1-CD1 4.08Å; Y538-L583 HydrophobicContact CE1-CB 3.91Å; Y538-L583 HydrophobicContact CE1-CD1 3.83Å; Y538-L583 HydrophobicContact CE1-CG 4.35Å; Y538-L583 HydrophobicContact CE2-CB 4.3Å; L583-N585 VanDerWaalsContact C-N 3.3Å; L583-N585 PolarHBondContact O-N 3.38Å; L583-A586 PolarHBondContact O-N 3.25Å; L583-L587 HydrophobicContact CD1-CD1 4.18Å; L583-L587 HydrophobicContact CD1-CG 4.05Å; L583-L587 HydrophobicContact CG-CD1 3.96Å; L583-L587 HydrophobicContact CG-CG 4.32Å; L583-L587 WeakPolarHBondContact O-CB 3.4Å; L583-L587 WeakPolarHBondContact O-CG 3.34Å; L583-L587 PolarHBondContact O-N 3.35Å
584	T	83.5	Confident	75.2	Confident	22 Å²	22	57.8 Å²	57.8	14%	0.135	29%	0.292	C	S	.	.	H	α-helix	trans	-55.9	-43.7	175.4	-27.4	0	0	0	0	111.7	T261 S582 N588	T261-T584 PolarHBondContact OG1-OG1 2.9Å; S582-T584 VanDerWaalsContact C-N 3.29Å; S582-T584 PolarHBondContact O-N 3.44Å; T584-N588 VanDerWaalsContact O-CB 3.31Å; T584-N588 WeakPolarHBondContact O-CB 3.28Å; T584-N588 PolarHBondContact O-N 3.19Å; T584-N588 PolarHBondContact O-ND2 3.46Å
585	N	82.6	Confident	76.9	Confident	87 Å²	87	53 Å²	53	47%	0.465	27%	0.269	S	S	.	.	H	α-helix	trans	-72	-36.5	178.9	-77.8	-47	0	0	0	112.7	F580 S582 L583 H589	F580-N585 HydrophobicContact CB-CB 4.1Å; F580-N585 HydrophobicContact CD1-CB 4.14Å; F580-N585 HydrophobicContact CG-CB 4.46Å; S582-N585 PolarHBondContact O-N 2.74Å; S582-N585 PolarHBondContact OG-ND2 3.49Å; L583-N585 VanDerWaalsContact C-N 3.3Å; L583-N585 PolarHBondContact O-N 3.38Å; N585-H589 PolarHBondContact O-N 3.48Å
586	A	85.1	Confident	78.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-46.6	174.6	0	0	0	0	0	112	Y538 F580 S582 L583 H589 W590 F628	Y538-A586 HydrophobicContact CG-CB 4.27Å; F580-A586 HydrophobicContact CB-CB 4.27Å; F580-A586 HydrophobicContact CD2-CB 3.93Å; F580-A586 HydrophobicContact CG-CB 4.21Å; S582-A586 PolarHBondContact O-N 3.46Å; S582-A586 VanDerWaalsContact O-N 3.16Å; L583-A586 PolarHBondContact O-N 3.25Å; A586-H589 PolarHBondContact O-N 3.1Å; A586-W590 PolarHBondContact O-N 3.27Å; A586-F628 HydrophobicContact CB-CD1 4.36Å; A586-F628 HydrophobicContact CB-CE1 3.93Å; A586-F628 WeakPolarHBondContact O-CZ 3.45Å
587	L	85.3	Confident	79.5	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-44.5	175.1	-68.5	170.1	0	0	0	111.4	F461 L583 H589 W590 H591	F461-L587 HydrophobicContact CD2-CD1 4.2Å; L583-L587 HydrophobicContact CD1-CD1 4.18Å; L583-L587 HydrophobicContact CD1-CG 4.05Å; L583-L587 HydrophobicContact CG-CD1 3.96Å; L583-L587 HydrophobicContact CG-CG 4.32Å; L583-L587 WeakPolarHBondContact O-CB 3.4Å; L583-L587 WeakPolarHBondContact O-CG 3.34Å; L583-L587 PolarHBondContact O-N 3.35Å; L587-H589 VanDerWaalsContact C-N 3.3Å; L587-H589 PolarHBondContact O-N 2.93Å; L587-W590 CarbonylContact O-C 3.43Å; L587-W590 WeakPolarHBondContact O-CA 3.46Å; L587-W590 WeakPolarHBondContact O-CB 3.38Å; L587-W590 PolarHBondContact O-N 2.97Å; L587-H591 PolarHBondContact O-CD2 3.02Å; L587-H591 PolarHBondContact O-N 2.68Å
588	N	82.8	Confident	79.6	Confident	64 Å²	64	51 Å²	51	34%	0.342	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-37.4	176.6	-75.5	-19.3	0	0	0	112.6	T584 H591 V592	T584-N588 VanDerWaalsContact O-CB 3.31Å; T584-N588 WeakPolarHBondContact O-CB 3.28Å; T584-N588 PolarHBondContact O-N 3.19Å; T584-N588 PolarHBondContact O-ND2 3.46Å; N588-H591 PolarHBondContact O-N 3.29Å; N588-V592 WeakPolarHBondContact O-CG2 3.4Å; N588-V592 PolarHBondContact O-N 3.08Å
589	H	82	Confident	79.2	Confident	46 Å²	46	49.4 Å²	49.4	21%	0.213	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-37.9	171.7	-178.9	-93.5	0	0	0	112.3	F580 N585 A586 L587 S593 F628	F580-H589 HydrophobicContact CE1-CB 3.71Å; F580-H589 AromaticContact CE1-CG 3.94Å; F580-H589 HydrophobicContact CE2-CB 4.24Å; F580-H589 HydrophobicContact CZ-CB 3.49Å; F580-H589 VanDerWaalsContact CZ-CB 3.49Å; F580-H589 AromaticContact CZ-CD2 3.67Å; F580-H589 AromaticContact CZ-CG 3.35Å; F580-H589 AromaticContact CZ-ND1 3.71Å; N585-H589 PolarHBondContact O-N 3.48Å; A586-H589 PolarHBondContact O-N 3.1Å; L587-H589 VanDerWaalsContact C-N 3.3Å; L587-H589 PolarHBondContact O-N 2.93Å; H589-S593 WeakPolarHBondContact O-CB 3.34Å; H589-S593 PolarHBondContact O-N 2.97Å; H589-S593 PolarHBondContact O-OG 2.96Å; H589-F628 AromaticContact ND1-CZ 3.96Å
590	W	82.8	Confident	78.5	Confident	22 Å²	22	45.3 Å²	45.3	8%	0.083	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-47.6	172.6	-178.1	80.4	0	0	0	111.9	S453 A457 I460 A586 L587 V592 S593 E594 F628	S453-W590 WeakPolarHBondContact O-CH2 3.34Å; A457-W590 HydrophobicContact CB-CE3 4.27Å; A457-W590 HydrophobicContact CB-CH2 3.99Å; A457-W590 HydrophobicContact CB-CZ3 3.61Å; I460-W590 VanDerWaalsContact CD1-CD1 3.4Å; I460-W590 HydrophobicContact CD1-CD2 4.09Å; I460-W590 HydrophobicContact CD1-CG 3.98Å; I460-W590 HydrophobicContact CD1-CZ2 4.29Å; A586-W590 PolarHBondContact O-N 3.27Å; L587-W590 CarbonylContact O-C 3.43Å; L587-W590 WeakPolarHBondContact O-CA 3.46Å; L587-W590 WeakPolarHBondContact O-CB 3.38Å; L587-W590 PolarHBondContact O-N 2.97Å; W590-V592 VanDerWaalsContact C-N 3.34Å; W590-V592 PolarHBondContact O-N 2.79Å; W590-S593 CarbonylContact O-C 3.51Å; W590-S593 WeakPolarHBondContact O-CA 3.32Å; W590-S593 WeakPolarHBondContact O-CB 3.47Å; W590-S593 PolarHBondContact O-N 2.65Å; W590-E594 HydrophobicContact CH2-CB 4.09Å; W590-E594 HydrophobicContact CH2-CG 4.12Å; W590-E594 WeakPolarHBondContact CH2-OE1 3.35Å; W590-E594 WeakPolarHBondContact CH2-OE2 3.44Å; W590-E594 HydrophobicContact CZ2-CB 4Å; W590-E594 HydrophobicContact CZ2-CG 4.08Å; W590-E594 HydrophobicContact CZ3-CB 4.36Å; W590-E594 PolarHBondContact O-N 3.32Å; W590-F628 HydrophobicContact CB-CE2 3.85Å; W590-F628 HydrophobicContact CB-CZ 3.99Å; W590-F628 AromaticContact CD1-CE2 3.92Å; W590-F628 HydrophobicContact CG-CE2 4.28Å
591	H	81.5	Confident	77.6	Confident	41 Å²	41	49 Å²	49	19%	0.19	25%	0.251	C	S	.	.	H	α-helix	trans	-56.9	-47.2	177.5	-73.3	-51.6	0	0	0	111.7	A434 L587 N588 S593 E594 H595	A434-H591 PolarHBondContact O-CE1 2.89Å; A434-H591 PolarHBondContact O-NE2 3.2Å; L587-H591 PolarHBondContact O-CD2 3.02Å; L587-H591 PolarHBondContact O-N 2.68Å; N588-H591 PolarHBondContact O-N 3.29Å; H591-S593 VanDerWaalsContact C-N 3.27Å; H591-S593 PolarHBondContact O-N 3.38Å; H591-E594 PolarHBondContact O-N 3.22Å; H591-H595 WeakPolarHBondContact O-CB 3.28Å; H591-H595 PolarHBondContact O-N 3.17Å
592	V	81.3	Confident	76.8	Confident	73 Å²	73	46.2 Å²	46.2	44%	0.442	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-38.6	174	170.6	0	0	0	0	111.2	N588 W590 Q596	N588-V592 WeakPolarHBondContact O-CG2 3.4Å; N588-V592 PolarHBondContact O-N 3.08Å; W590-V592 VanDerWaalsContact C-N 3.34Å; W590-V592 PolarHBondContact O-N 2.79Å; V592-Q596 HydrophobicContact CG1-CG 4.4Å; V592-Q596 VanDerWaalsContact CG1-NE2 3.28Å; V592-Q596 VanDerWaalsContact O-CB 3.23Å; V592-Q596 WeakPolarHBondContact O-CB 3.44Å; V592-Q596 WeakPolarHBondContact O-CG 3.32Å; V592-Q596 PolarHBondContact O-N 3.29Å
593	S	76.8	Confident	75.5	Confident	42 Å²	42	50.2 Å²	50.2	29%	0.294	26%	0.257	S	S	.	.	H	α-helix	trans	-72.8	-40.3	179.6	-57.5	0	0	0	0	113.8	H589 W590 H591 Q596 R597	H589-S593 WeakPolarHBondContact O-CB 3.34Å; H589-S593 PolarHBondContact O-N 2.97Å; H589-S593 PolarHBondContact O-OG 2.96Å; W590-S593 CarbonylContact O-C 3.51Å; W590-S593 WeakPolarHBondContact O-CA 3.32Å; W590-S593 WeakPolarHBondContact O-CB 3.47Å; W590-S593 PolarHBondContact O-N 2.65Å; H591-S593 VanDerWaalsContact C-N 3.27Å; H591-S593 PolarHBondContact O-N 3.38Å; S593-Q596 PolarHBondContact O-N 3.46Å; S593-R597 WeakPolarHBondContact O-CB 3.24Å; S593-R597 PolarHBondContact O-N 3.18Å
594	E	76.2	Confident	73.7	Confident	52 Å²	52	56.9 Å²	56.9	24%	0.243	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-47.2	174.6	-169.1	-162.5	-135.5	0	0	110.2	S453 W590 H591 Q596 R597 S598	S453-E594 WeakPolarHBondContact CA-OE1 2.98Å; S453-E594 WeakPolarHBondContact CB-OE1 3.32Å; S453-E594 WeakPolarHBondContact CB-OE2 3.38Å; W590-E594 HydrophobicContact CH2-CB 4.09Å; W590-E594 HydrophobicContact CH2-CG 4.12Å; W590-E594 WeakPolarHBondContact CH2-OE1 3.35Å; W590-E594 WeakPolarHBondContact CH2-OE2 3.44Å; W590-E594 HydrophobicContact CZ2-CB 4Å; W590-E594 HydrophobicContact CZ2-CG 4.08Å; W590-E594 HydrophobicContact CZ3-CB 4.36Å; W590-E594 PolarHBondContact O-N 3.32Å; H591-E594 PolarHBondContact O-N 3.22Å; E594-Q596 VanDerWaalsContact C-N 3.27Å; E594-Q596 PolarHBondContact O-N 2.68Å; E594-R597 PolarHBondContact O-N 3.39Å; E594-S598 PolarHBondContact O-N 3.34Å
595	H	74.1	Confident	71.9	Confident	84 Å²	84	63 Å²	63	39%	0.389	32%	0.317	S	S	.	.	H	α-helix	trans	-47	-53.8	170.2	175	-91.1	0	0	0	109.2	Q160 H591 R597 S598 I599	Q160-H595 WeakPolarHBondContact CG-CE1 3.45Å; Q160-H595 WeakPolarHBondContact CG-NE2 3.46Å; Q160-H595 PolarHBondContact NE2-CD2 2.93Å; Q160-H595 VanDerWaalsContact NE2-CD2 3.31Å; Q160-H595 PolarHBondContact NE2-O 3.48Å; Q160-H595 PolarHBondContact OE1-CD2 3.08Å; Q160-H595 PolarHBondContact OE1-NE2 3.11Å; H591-H595 WeakPolarHBondContact O-CB 3.28Å; H591-H595 PolarHBondContact O-N 3.17Å; H595-R597 PolarHBondContact O-N 3.46Å; H595-S598 WeakPolarHBondContact O-CB 3.37Å; H595-S598 PolarHBondContact O-N 3.48Å; H595-I599 WeakPolarHBondContact O-CD1 3.49Å
596	Q	74.3	Confident	70.2	Confident	52 Å²	52	63.8 Å²	63.8	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-34.8	176.8	-73.6	172	-0.5	0	0	115.1	T161 L162 V592 S593 E594 I599	T161-Q596 WeakPolarHBondContact OG1-CG 3.2Å; L162-Q596 HydrophobicContact CD1-CB 3.88Å; L162-Q596 HydrophobicContact CD1-CG 4.06Å; L162-Q596 HydrophobicContact CD2-CG 4.23Å; L162-Q596 HydrophobicContact CG-CB 3.98Å; L162-Q596 HydrophobicContact CG-CG 3.7Å; V592-Q596 HydrophobicContact CG1-CG 4.4Å; V592-Q596 VanDerWaalsContact CG1-NE2 3.28Å; V592-Q596 VanDerWaalsContact O-CB 3.23Å; V592-Q596 WeakPolarHBondContact O-CB 3.44Å; V592-Q596 WeakPolarHBondContact O-CG 3.32Å; V592-Q596 PolarHBondContact O-N 3.29Å; S593-Q596 PolarHBondContact O-N 3.46Å; E594-Q596 VanDerWaalsContact C-N 3.27Å; E594-Q596 PolarHBondContact O-N 2.68Å; Q596-I599 VanDerWaalsContact O-CD1 3.29Å; Q596-I599 WeakPolarHBondContact O-CD1 3.09Å
597	R	69.5	Low	67.9	Low	86 Å²	86	69.8 Å²	69.8	33%	0.325	36%	0.358	S	S	.	.	H	α-helix	trans	-75.2	-31.4	176.1	-177.8	176.7	-79	177.8	-6	112.8	Y544 S593 E594 H595 I599 A600 K601	Y544-R597 PolarHBondContact O-NH2 2.71Å; S593-R597 WeakPolarHBondContact O-CB 3.24Å; S593-R597 PolarHBondContact O-N 3.18Å; E594-R597 PolarHBondContact O-N 3.39Å; H595-R597 PolarHBondContact O-N 3.46Å; R597-I599 PolarHBondContact O-N 2.89Å; R597-A600 PolarHBondContact O-N 3.44Å; R597-K601 PolarHBondContact O-N 3.49Å
598	S	67.7	Low	65.7	Low	52 Å²	52	78 Å²	78	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-29.3	178.7	-168	0	0	0	0	112.8	E594 H595 Q602	E594-S598 PolarHBondContact O-N 3.34Å; H595-S598 WeakPolarHBondContact O-CB 3.37Å; H595-S598 PolarHBondContact O-N 3.48Å; S598-Q602 WeakPolarHBondContact O-CG 3.38Å; S598-Q602 PolarHBondContact O-N 2.98Å; S598-Q602 VanDerWaalsContact O-N 3.15Å
599	I	68.3	Low	63.2	Low	0 Å²	0	83.4 Å²	83.4	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-79.9	-41.9	176.8	-47.8	100.2	0	0	0	112.6	A159 Q160 T161 H595 Q596 R597 K601 Q602 Q603	A159-I599 HydrophobicContact CB-CG1 4.44Å; A159-I599 WeakPolarHBondContact O-CG2 3.49Å; Q160-I599 HydrophobicContact CB-CD1 3.81Å; Q160-I599 HydrophobicContact CB-CG1 3.31Å; Q160-I599 HydrophobicContact CG-CD1 3.69Å; Q160-I599 HydrophobicContact CG-CG1 3.79Å; T161-I599 VanDerWaalsContact O-CB 3.32Å; T161-I599 WeakPolarHBondContact O-CB 3.16Å; T161-I599 VanDerWaalsContact O-CD1 3.25Å; T161-I599 WeakPolarHBondContact O-CD1 3.23Å; T161-I599 VanDerWaalsContact OG1-CD1 3.28Å; T161-I599 WeakPolarHBondContact OG1-CD1 3.2Å; H595-I599 WeakPolarHBondContact O-CD1 3.49Å; Q596-I599 VanDerWaalsContact O-CD1 3.29Å; Q596-I599 WeakPolarHBondContact O-CD1 3.09Å; R597-I599 PolarHBondContact O-N 2.89Å; I599-K601 CarbonylContact O-C 3.59Å; I599-K601 PolarHBondContact O-N 3.43Å; I599-K601 VanDerWaalsContact O-N 3.15Å; I599-Q602 CarbonylContact O-C 3.54Å; I599-Q602 WeakPolarHBondContact O-CA 3.26Å; I599-Q602 PolarHBondContact O-N 2.89Å; I599-Q603 HydrophobicContact CG2-CG 3.71Å; I599-Q603 PolarHBondContact O-N 2.62Å
600	A	65.8	Low	60.8	Low	43 Å²	43	88.1 Å²	88.1	36%	0.355	45%	0.445	S	S	.	.	H	α-helix	trans	-52.7	-39.1	174.3	0	0	0	0	0	109.4	R597 F604	R597-A600 PolarHBondContact O-N 3.44Å; A600-F604 WeakPolarHBondContact O-CB 3.5Å; A600-F604 VanDerWaalsContact O-CD2 3.24Å; A600-F604 WeakPolarHBondContact O-CD2 3.09Å; A600-F604 PolarHBondContact O-N 2.68Å; A600-F604 VanDerWaalsContact O-N 3.17Å
601	K	66.3	Low	58.4	Low	115 Å²	115	94.4 Å²	94.4	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-42.4	169.6	-66.9	-168.6	173.1	-169.1	0	114.3	R597 I599 L605	R597-K601 PolarHBondContact O-N 3.49Å; I599-K601 CarbonylContact O-C 3.59Å; I599-K601 PolarHBondContact O-N 3.43Å; I599-K601 VanDerWaalsContact O-N 3.15Å; K601-L605 WeakPolarHBondContact O-CD1 3.33Å; K601-L605 WeakPolarHBondContact O-CG 3.35Å
602	Q	60	Low	56	Low	69 Å²	69	98.7 Å²	98.7	32%	0.322	51%	0.511	S	S	.	.	H	α-helix	trans	-72.1	-38.7	179.5	-72.3	-178.7	9.2	0	0	114.1	A159 S598 I599 L605	A159-Q602 VanDerWaalsContact CB-OE1 3.31Å; S598-Q602 WeakPolarHBondContact O-CG 3.38Å; S598-Q602 PolarHBondContact O-N 2.98Å; S598-Q602 VanDerWaalsContact O-N 3.15Å; I599-Q602 CarbonylContact O-C 3.54Å; I599-Q602 WeakPolarHBondContact O-CA 3.26Å; I599-Q602 PolarHBondContact O-N 2.89Å; Q602-L605 PolarHBondContact O-N 3.36Å
603	Q	56.3	Low	53.6	Low	98 Å²	98	103.5 Å²	103.5	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-72.7	-37.6	178.8	-75.7	172.6	-15.1	0	0	112.2	I599 L605 T606	I599-Q603 HydrophobicContact CG2-CG 3.71Å; I599-Q603 PolarHBondContact O-N 2.62Å; Q603-L605 PolarHBondContact O-N 3.4Å; Q603-T606 PolarHBondContact O-N 3.41Å; Q603-T606 VanDerWaalsContact O-N 3.16Å; Q603-T606 PolarHBondContact O-OG1 3.12Å
604	F	45.9	Very low	51.4	Low	141 Å²	141	110.7 Å²	110.7	62%	0.618	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-11.9	171.8	-88.1	-101.3	0	0	0	113.8	I548 A600	I548-F604 HydrophobicContact CD1-CE2 3.7Å; I548-F604 HydrophobicContact CD1-CZ 3.74Å; I548-F604 HydrophobicContact CG1-CZ 4.22Å; I548-F604 HydrophobicContact CG2-CZ 4.36Å; A600-F604 WeakPolarHBondContact O-CB 3.5Å; A600-F604 VanDerWaalsContact O-CD2 3.24Å; A600-F604 WeakPolarHBondContact O-CD2 3.09Å; A600-F604 PolarHBondContact O-N 2.68Å; A600-F604 VanDerWaalsContact O-N 3.17Å
605	L	46.4	Very low	49	Very low	149 Å²	149	116.3 Å²	116.3	78%	0.78	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-11.6	173	-79.6	167.1	0	0	0	113.7	K601 Q602 Q603	K601-L605 WeakPolarHBondContact O-CD1 3.33Å; K601-L605 WeakPolarHBondContact O-CG 3.35Å; Q602-L605 PolarHBondContact O-N 3.36Å; Q603-L605 PolarHBondContact O-N 3.4Å
606	T	45.8	Very low	46.8	Very low	105 Å²	105	121 Å²	121	64%	0.644	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-25.8	176.6	46.7	0	0	0	0	113.6	Q603	Q603-T606 PolarHBondContact O-N 3.41Å; Q603-T606 VanDerWaalsContact O-N 3.16Å; Q603-T606 PolarHBondContact O-OG1 3.12Å
607	D	37	Very low	44.7	Very low	127 Å²	127	125.2 Å²	125.2	68%	0.679	62%	0.622	S	S	*	*	S	Bend	trans	-114.9	69.3	-177.2	-69.7	-49.2	0	0	0	112.2
608	H	39.9	Very low	42.7	Very low	177 Å²	177	127 Å²	127	82%	0.819	64%	0.639	S	S	*	*			trans	173.9	103.8	145.8	-98.7	-67.6	0	0	0	112
609	E	28.6	Very low	41.4	Very low	178 Å²	178	129.6 Å²	129.6	83%	0.832	65%	0.648	S	S	*	*	S	Bend	trans	-73.4	138.4	155.9	-68.7	-169.9	150.1	0	0	109.6
610	N	31.8	Very low	39.9	Very low	144 Å²	144	133.5 Å²	133.5	77%	0.77	68%	0.676	S	S	*	*			trans	79.5	77.9	175.5	-47.6	-81.9	0	0	0	118
611	L	32.2	Very low	38.6	Very low	155 Å²	155	137.4 Å²	137.4	81%	0.812	69%	0.691	S	S	*	*			trans	-159.2	103.6	147	-118.8	160.5	0	0	0	112.4	Q613	L611-Q613 PolarHBondContact O-N 2.9Å
612	P	32.7	Very low	37.7	Very low	130 Å²	130	136.4 Å²	136.4	84%	0.844	68%	0.684	S	S	*	*			trans	-92	63.5	-168.7	36.8	-36.8	0	0	0	113.8
613	Q	29.5	Very low	37.3	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.813	68%	0.68	S	S	*	*			trans	-155.9	54.9	178.2	-132.2	168.6	20	0	0	116.2	L611	L611-Q613 PolarHBondContact O-N 2.9Å
614	Y	31.2	Very low	36.9	Very low	194 Å²	194	132.7 Å²	132.7	76%	0.761	67%	0.668	S	S	*	*			trans	-131.4	19.8	175.7	-108.9	-88.3	0	0	0	116.2	Q616 F617	Y614-Q616 PolarHBondContact O-N 2.81Å; Y614-F617 HydrophobicContact CD1-CD2 4.25Å; Y614-F617 HydrophobicContact CD1-CE2 4.17Å; Y614-F617 HydrophobicContact CE1-CD2 4.14Å; Y614-F617 AromaticContact CE1-CE2 3.63Å; Y614-F617 HydrophobicContact CE1-CE2 3.63Å
615	N	26.4	Very low	37.2	Very low	170 Å²	170	130.8 Å²	130.8	91%	0.909	67%	0.665	S	S	*	*			trans	-92.4	54.1	175.2	-78	-8.2	0	0	0	112.8
616	Q	27.4	Very low	37.5	Very low	182 Å²	182	129.1 Å²	129.1	85%	0.85	65%	0.653	S	S	*	*			trans	-159	55.2	173.8	-125.8	169.4	33.4	0	0	114.5	Y614	Y614-Q616 PolarHBondContact O-N 2.81Å
617	F	29.8	Very low	38.6	Very low	140 Å²	140	125.7 Å²	125.7	61%	0.614	63%	0.63	S	S	*	*			trans	-113.4	122	162.8	-89.8	-91.7	0	0	0	109.8	Y614 D619	Y614-F617 HydrophobicContact CD1-CD2 4.25Å; Y614-F617 HydrophobicContact CD1-CE2 4.17Å; Y614-F617 HydrophobicContact CE1-CD2 4.14Å; Y614-F617 AromaticContact CE1-CE2 3.63Å; Y614-F617 HydrophobicContact CE1-CE2 3.63Å; F617-D619 PolarHBondContact O-N 2.87Å
618	N	28.7	Very low	40.5	Very low	125 Å²	125	120 Å²	120	67%	0.668	60%	0.6	S	S	*	*			trans	-76.8	110.8	178.9	-73.5	-14.2	0	0	0	110.5	S620 N621	N618-S620 PolarHBondContact O-N 3.11Å; N618-N621 PolarHBondContact O-N 3.17Å
619	D	39.8	Very low	42.4	Very low	105 Å²	105	113.1 Å²	113.1	56%	0.561	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-62.4	-9.1	176.1	-76.3	-50.2	0	0	0	114	F617 N621 Y622	F617-D619 PolarHBondContact O-N 2.87Å; D619-N621 PolarHBondContact O-N 3.04Å; D619-Y622 PolarHBondContact O-N 3.44Å
620	S	36.6	Very low	44.9	Very low	83 Å²	83	104.7 Å²	104.7	58%	0.58	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-54.9	-35.2	175.2	56.5	0	0	0	0	113.4	N618	N618-S620 PolarHBondContact O-N 3.11Å
621	N	38.4	Very low	47.3	Very low	125 Å²	125	98.8 Å²	98.8	67%	0.668	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-94.1	-4.7	-171.5	-63.8	21.3	0	0	0	112.9	N618 D619 Y623	N618-N621 PolarHBondContact O-N 3.17Å; D619-N621 PolarHBondContact O-N 3.04Å; N621-Y623 PolarHBondContact O-N 3.34Å
622	Y	47.8	Very low	49.7	Very low	93 Å²	93	91.5 Å²	91.5	37%	0.365	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-8.8	-175.2	-107.7	-70.5	0	0	0	115	D619	D619-Y622 PolarHBondContact O-N 3.44Å
623	Y	52.2	Low	52	Low	57 Å²	57	87.6 Å²	87.6	22%	0.224	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	42.5	-178.2	-56.4	-76.6	0	0	0	111.3	L452 K459 N621	L452-Y623 PolarHBondContact O-OH 3.45Å; K459-Y623 HydrophobicContact CD-CG 4.26Å; N621-Y623 PolarHBondContact O-N 3.34Å
624	S	47.1	Very low	54.2	Low	32 Å²	32	80.1 Å²	80.1	22%	0.224	40%	0.395	C	S	.	.			trans	-65.1	149.3	174.2	72.7	0	0	0	0	111	E626	S624-E626 VanDerWaalsContact CB-OE2 3.31Å; S624-E626 WeakPolarHBondContact CB-OE2 3.17Å; S624-E626 PolarHBondContact O-N 3Å; S624-E626 VanDerWaalsContact O-N 3.09Å; S624-E626 PolarHBondContact OG-OE2 2.83Å
625	N	51.9	Low	56.3	Low	101 Å²	101	75.7 Å²	75.7	54%	0.54	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-65.9	-9	180	-66.2	-22.5	0	0	0	113.2	I627	N625-I627 VanDerWaalsContact C-N 3.3Å; N625-I627 PolarHBondContact O-N 3.03Å
626	E	53.1	Low	58.4	Low	115 Å²	115	75.5 Å²	75.5	54%	0.537	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-77.7	-11.2	-169	-54	160.4	141.7	0	0	113.7	Y544 S624	Y544-E626 HydrophobicContact CE2-CB 4.42Å; Y544-E626 WeakPolarHBondContact CE2-OE2 3.25Å; Y544-E626 PolarHBondContact OH-OE2 3.26Å; S624-E626 VanDerWaalsContact CB-OE2 3.31Å; S624-E626 WeakPolarHBondContact CB-OE2 3.17Å; S624-E626 PolarHBondContact O-N 3Å; S624-E626 VanDerWaalsContact O-N 3.09Å; S624-E626 PolarHBondContact OG-OE2 2.83Å
627	I	69.6	Low	60.3	Low	32 Å²	32	69.9 Å²	69.9	16%	0.164	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-79.3	-31.6	-174.6	-53.1	177.8	0	0	0	111.4	C540 H541 N625	C540-I627 VanDerWaalsContact CA-O 3.3Å; C540-I627 WeakPolarHBondContact CA-O 3.42Å; C540-I627 PolarHBondContact SG-O 3.02Å; H541-I627 PolarHBondContact N-O 3.36Å; N625-I627 VanDerWaalsContact C-N 3.3Å; N625-I627 PolarHBondContact O-N 3.03Å
628	F	76.8	Confident	62.5	Low	8 Å²	8	66 Å²	66	4%	0.035	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	121.6	-175.3	-86.7	-88.6	0	0	0	111.2	I460 L464 V539 C540 F580 A586 H589 W590	I460-F628 HydrophobicContact CG2-CB 4.37Å; I460-F628 HydrophobicContact CG2-CD2 4.32Å; I460-F628 HydrophobicContact CG2-CG 4.45Å; L464-F628 HydrophobicContact CD1-CB 4.38Å; L464-F628 HydrophobicContact CD2-CB 4.19Å; V539-F628 CarbonylContact O-C 3.5Å; V539-F628 VanDerWaalsContact O-CA 3.25Å; V539-F628 WeakPolarHBondContact O-CA 3.46Å; C540-F628 HydrophobicContact CB-CD1 3.78Å; C540-F628 HydrophobicContact CB-CE1 3.63Å; C540-F628 HydrophobicContact CB-CE2 4.36Å; C540-F628 HydrophobicContact CB-CG 4.24Å; C540-F628 HydrophobicContact CB-CZ 3.95Å; F580-F628 HydrophobicContact CD2-CE1 4.43Å; F580-F628 HydrophobicContact CE2-CE1 4.07Å; A586-F628 HydrophobicContact CB-CD1 4.36Å; A586-F628 HydrophobicContact CB-CE1 3.93Å; A586-F628 WeakPolarHBondContact O-CZ 3.45Å; H589-F628 AromaticContact ND1-CZ 3.96Å; W590-F628 HydrophobicContact CB-CE2 3.85Å; W590-F628 HydrophobicContact CB-CZ 3.99Å; W590-F628 AromaticContact CD1-CE2 3.92Å; W590-F628 HydrophobicContact CG-CE2 4.28Å
629	D	78.8	Confident	64.7	Low	33 Å²	33	60.3 Å²	60.3	18%	0.176	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	178.7	176.7	-155.5	-13.3	0	0	0	110.9	R467 V539	R467-D629 IonicContact CZ-OD1 2.81Å; R467-D629 IonicContact CZ-OD2 3.42Å; R467-D629 IonicContact NE-OD1 2.84Å; R467-D629 PolarHBondContact NE-OD1 2.87Å; R467-D629 VanDerWaalsContact NH2-CG 3.32Å; R467-D629 IonicContact NH2-OD1 3.87Å; R467-D629 PolarHBondContact NH2-OD1 2.75Å; R467-D629 IonicContact NH2-OD2 3.55Å; R467-D629 PolarHBondContact NH2-OD2 2.91Å; V539-D629 PolarHBondContact N-O 3.31Å; V539-D629 PolarHBondContact O-N 2.9Å
630	I	82.1	Confident	66.6	Low	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.3	175.2	-72.5	177.4	0	0	0	109.3	L464 R467 R468 L471 V536 V537 Y538 I641	L464-I630 HydrophobicContact CB-CD1 4.25Å; L464-I630 HydrophobicContact CD2-CD1 4.04Å; L464-I630 HydrophobicContact CD2-CG1 3.75Å; L464-I630 WeakPolarHBondContact O-CD1 3.48Å; R467-I630 HydrophobicContact CB-CD1 4.4Å; R468-I630 HydrophobicContact CB-CD1 3.77Å; L471-I630 HydrophobicContact CD1-CG2 4.29Å; V536-I630 HydrophobicContact CG1-CD1 4.39Å; V536-I630 HydrophobicContact CG1-CG2 3.59Å; V537-I630 CarbonylContact O-C 2.92Å; V537-I630 WeakPolarHBondContact O-CA 3.37Å; Y538-I630 HydrophobicContact CD1-CD1 3.87Å; Y538-I630 HydrophobicContact CD1-CG1 3.74Å; Y538-I630 HydrophobicContact CE1-CD1 3.57Å; Y538-I630 HydrophobicContact CE1-CG1 3.98Å; Y538-I630 HydrophobicContact CG-CG1 4.48Å; I630-I641 HydrophobicContact CB-CD1 4.06Å; I630-I641 HydrophobicContact CG2-CD1 3.96Å; I630-I641 HydrophobicContact CG2-CG1 4.4Å; I630-I641 WeakPolarHBondContact O-CG1 3.48Å
631	H	82.2	Confident	68.3	Low	20 Å²	20	54.4 Å²	54.4	9%	0.093	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	155.6	170.2	-71.9	-123.4	0	0	0	109.5	V537 V539 E638 G639 N640	V537-H631 HydrophobicContact CB-CB 4.47Å; V537-H631 PolarHBondContact N-O 2.74Å; V537-H631 PolarHBondContact O-N 3.08Å; V539-H631 HydrophobicContact CG2-CB 4.05Å; V539-H631 WeakPolarHBondContact CG2-CD2 3.28Å; H631-E638 HydrophobicContact CB-CG 3.8Å; H631-G639 WeakPolarHBondContact CA-O 3.32Å; H631-G639 VanDerWaalsContact CB-O 3.29Å; H631-G639 WeakPolarHBondContact CB-O 3.34Å; H631-G639 PolarHBondContact ND1-O 2.99Å; H631-N640 PolarHBondContact CE1-OD1 3.31Å; H631-N640 PolarHBondContact ND1-OD1 3.32Å
632	W	82.3	Confident	70.1	Confident	3 Å²	3	54.3 Å²	54.3	1%	0.011	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	148.9	162.8	61.2	-89.8	0	0	0	109.4	L471 L534 L634 I637 E638 G639 N640 L644 M647	L471-W632 HydrophobicContact CD1-CB 4.09Å; L534-W632 HydrophobicContact CD1-CB 4.18Å; L534-W632 HydrophobicContact CD1-CE3 4.12Å; W632-L634 HydrophobicContact CE3-CB 4.03Å; W632-L634 HydrophobicContact CZ3-CB 3.81Å; W632-I637 HydrophobicContact CH2-CB 4.36Å; W632-I637 HydrophobicContact CH2-CG2 3.66Å; W632-I637 HydrophobicContact CZ3-CB 4.24Å; W632-I637 HydrophobicContact CZ3-CG2 4.03Å; W632-E638 VanDerWaalsContact O-CA 3.26Å; W632-E638 WeakPolarHBondContact O-CA 3.33Å; W632-G639 PolarHBondContact N-O 3.24Å; W632-G639 VanDerWaalsContact NE1-C 3.31Å; W632-G639 PolarHBondContact NE1-O 2.95Å; W632-G639 PolarHBondContact O-N 3.1Å; W632-N640 PolarHBondContact NE1-O 3.02Å; W632-L644 HydrophobicContact CB-CD1 4.32Å; W632-L644 HydrophobicContact CB-CD2 4.42Å; W632-L644 HydrophobicContact CD2-CD1 3.79Å; W632-L644 HydrophobicContact CE3-CD1 4.26Å; W632-L644 HydrophobicContact CG-CB 4.22Å; W632-L644 HydrophobicContact CG-CD1 3.8Å; W632-L644 HydrophobicContact CG-CD2 4.42Å; W632-L644 HydrophobicContact CG-CG 4.36Å; W632-M647 HydrophobicContact CH2-CB 4.12Å; W632-M647 HydrophobicContact CH2-CE 4.4Å; W632-M647 HydrophobicContact CH2-CG 3.52Å; W632-M647 HydrophobicContact CH2-SD 3.95Å; W632-M647 HydrophobicContact CZ2-CB 3.94Å; W632-M647 HydrophobicContact CZ2-CG 3.83Å; W632-M647 HydrophobicContact CZ2-SD 4.21Å; W632-M647 HydrophobicContact CZ3-CG 4.42Å
633	Q	79.4	Confident	71.4	Confident	48 Å²	48	54.6 Å²	54.6	22%	0.224	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.3	169.3	179.3	177.8	10.9	0	0	109.4	L534 Q535 V537 N635 I637	L534-Q633 WeakPolarHBondContact CA-O 3.36Å; Q535-Q633 HydrophobicContact CB-CB 4.43Å; Q535-Q633 PolarHBondContact N-O 2.76Å; Q535-Q633 PolarHBondContact O-N 3.38Å; V537-Q633 HydrophobicContact CG2-CB 3.67Å; Q633-N635 WeakPolarHBondContact CG-O 3.35Å; Q633-N635 PolarHBondContact NE2-O 2.94Å; Q633-I637 CarbonylContact C-O 3.44Å; Q633-I637 VanDerWaalsContact CA-O 3.3Å; Q633-I637 WeakPolarHBondContact CA-O 3.28Å
634	L	77	Confident	72.4	Confident	16 Å²	16	52 Å²	52	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	107.7	170.3	-174.8	66.7	0	0	0	108.4	I530 N533 L534 W632 D636 I637 I651	I530-L634 HydrophobicContact CG2-CD1 4.28Å; I530-L634 HydrophobicContact CG2-CD2 4.01Å; I530-L634 VanDerWaalsContact O-CD1 3.3Å; I530-L634 WeakPolarHBondContact O-CD1 3.3Å; N533-L634 HydrophobicContact CB-CD1 3.9Å; L534-L634 HydrophobicContact CD1-CB 4.07Å; L534-L634 HydrophobicContact CD1-CD1 4.37Å; W632-L634 HydrophobicContact CE3-CB 4.03Å; W632-L634 HydrophobicContact CZ3-CB 3.81Å; L634-D636 PolarHBondContact O-N 3.19Å; L634-I637 PolarHBondContact N-O 2.79Å; L634-I637 PolarHBondContact O-N 3.2Å; L634-I651 HydrophobicContact CD2-CD1 3.74Å
635	N	74.2	Confident	73.5	Confident	102 Å²	102	51.6 Å²	51.6	55%	0.545	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	-121	-170.2	-55	-54.3	0	0	0	111.4	Q633	Q633-N635 WeakPolarHBondContact CG-O 3.35Å; Q633-N635 PolarHBondContact NE2-O 2.94Å
636	D	71	Confident	74.5	Confident	165 Å²	165	49.2 Å²	49.2	88%	0.882	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.7	179.6	-61.1	-46.2	0	0	0	113.9	L634	L634-D636 PolarHBondContact O-N 3.19Å
637	I	68.5	Low	75.5	Confident	64 Å²	64	46 Å²	46	33%	0.328	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.8	-179	-48.5	-179.8	0	0	0	109.5	W632 Q633 L634 M647	W632-I637 HydrophobicContact CH2-CB 4.36Å; W632-I637 HydrophobicContact CH2-CG2 3.66Å; W632-I637 HydrophobicContact CZ3-CB 4.24Å; W632-I637 HydrophobicContact CZ3-CG2 4.03Å; Q633-I637 CarbonylContact C-O 3.44Å; Q633-I637 VanDerWaalsContact CA-O 3.3Å; Q633-I637 WeakPolarHBondContact CA-O 3.28Å; L634-I637 PolarHBondContact N-O 2.79Å; L634-I637 PolarHBondContact O-N 3.2Å; I637-M647 HydrophobicContact CD1-CE 3.72Å; I637-M647 HydrophobicContact CG2-CE 3.99Å
638	E	75.2	Confident	75.5	Confident	60 Å²	60	45.1 Å²	45.1	28%	0.28	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.2	173.8	-178.9	-169.3	-129.4	0	0	108.6	R579 H631 W632	R579-E638 WeakPolarHBondContact CD-OE1 3.25Å; R579-E638 IonicContact CZ-OE1 2.67Å; R579-E638 IonicContact CZ-OE2 2.65Å; R579-E638 IonicContact NE-OE1 2.84Å; R579-E638 PolarHBondContact NE-OE1 3.17Å; R579-E638 IonicContact NE-OE2 2.63Å; R579-E638 PolarHBondContact NE-OE2 2.87Å; R579-E638 IonicContact NH2-OE2 2.66Å; R579-E638 PolarHBondContact NH2-OE2 3.25Å; H631-E638 HydrophobicContact CB-CG 3.8Å; W632-E638 VanDerWaalsContact O-CA 3.26Å; W632-E638 WeakPolarHBondContact O-CA 3.33Å
639	G	75.4	Confident	75.2	Confident	5 Å²	5	46.1 Å²	46.1	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	171.1	-178.7	0	0	0	0	0	113.4	H631 W632 E643	H631-G639 WeakPolarHBondContact CA-O 3.32Å; H631-G639 VanDerWaalsContact CB-O 3.29Å; H631-G639 WeakPolarHBondContact CB-O 3.34Å; H631-G639 PolarHBondContact ND1-O 2.99Å; W632-G639 PolarHBondContact N-O 3.24Å; W632-G639 VanDerWaalsContact NE1-C 3.31Å; W632-G639 PolarHBondContact NE1-O 2.95Å; W632-G639 PolarHBondContact O-N 3.1Å; G639-E643 WeakPolarHBondContact CA-OE2 3.34Å
640	N	78.2	Confident	74.8	Confident	62 Å²	62	51 Å²	51	33%	0.332	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	150	177.4	-70.5	2.8	0	0	0	110.2	H631 W632 E642 E643	H631-N640 PolarHBondContact CE1-OD1 3.31Å; H631-N640 PolarHBondContact ND1-OD1 3.32Å; W632-N640 PolarHBondContact NE1-O 3.02Å; N640-E642 PolarHBondContact O-N 3.46Å; N640-E642 VanDerWaalsContact O-N 3.14Å; N640-E643 HydrophobicContact CB-CG 4.22Å; N640-E643 PolarHBondContact N-OE2 3.4Å; N640-E643 WeakPolarHBondContact O-CB 3.45Å; N640-E643 PolarHBondContact O-N 3.46Å
641	I	73.5	Confident	74.2	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-55.6	-36.5	-178.5	-42.6	-178.9	0	0	0	111.9	R467 Y470 L471 I630 E643 L644	R467-I641 HydrophobicContact CB-CD1 3.82Å; R467-I641 HydrophobicContact CG-CD1 4.41Å; Y470-I641 HydrophobicContact CD1-CG2 3.95Å; Y470-I641 HydrophobicContact CE1-CG2 4.18Å; L471-I641 HydrophobicContact CB-CG2 3.82Å; L471-I641 HydrophobicContact CD1-CG1 4.37Å; L471-I641 HydrophobicContact CD1-CG2 4.25Å; L471-I641 HydrophobicContact CG-CG2 4.16Å; I630-I641 HydrophobicContact CB-CD1 4.06Å; I630-I641 HydrophobicContact CG2-CD1 3.96Å; I630-I641 HydrophobicContact CG2-CG1 4.4Å; I630-I641 WeakPolarHBondContact O-CG1 3.48Å; I641-E643 PolarHBondContact O-N 3.17Å; I641-L644 VanDerWaalsContact O-CB 3.31Å; I641-L644 WeakPolarHBondContact O-CB 3.32Å; I641-L644 PolarHBondContact O-N 3.16Å
642	E	74.9	Confident	73.4	Confident	122 Å²	122	52.5 Å²	52.5	57%	0.57	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-64.5	-25.2	178	-70	140.1	-135.5	0	0	113.1	R467 N640	R467-E642 IonicContact CZ-OE1 2.63Å; R467-E642 IonicContact NH1-OE1 2.66Å; R467-E642 PolarHBondContact NH1-OE1 2.73Å; R467-E642 IonicContact NH2-OE1 3.14Å; N640-E642 PolarHBondContact O-N 3.46Å; N640-E642 VanDerWaalsContact O-N 3.14Å
643	E	75.9	Confident	72.7	Confident	99 Å²	99	55.1 Å²	55.1	46%	0.463	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-83.5	-21.9	177.7	-59.7	174.8	131.3	0	0	112.7	G639 N640 I641 P645 T646 M647	G639-E643 WeakPolarHBondContact CA-OE2 3.34Å; N640-E643 HydrophobicContact CB-CG 4.22Å; N640-E643 PolarHBondContact N-OE2 3.4Å; N640-E643 WeakPolarHBondContact O-CB 3.45Å; N640-E643 PolarHBondContact O-N 3.46Å; I641-E643 PolarHBondContact O-N 3.17Å; E643-P645 VanDerWaalsContact C-CD 3.5Å; E643-T646 PolarHBondContact O-N 3.03Å; E643-T646 VanDerWaalsContact O-N 3.11Å; E643-T646 PolarHBondContact O-OG1 3.08Å; E643-M647 PolarHBondContact O-N 3.17Å
644	L	74.3	Confident	72	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-53.7	-44.7	-172.6	-177.8	59.5	0	0	0	114	L471 L475 L534 W632 I641 T646 M647 I648	L471-L644 HydrophobicContact CG-CD2 4.09Å; L475-L644 HydrophobicContact CD1-CD2 4.44Å; L534-L644 HydrophobicContact CD1-CD1 3.98Å; L534-L644 HydrophobicContact CD2-CD1 4.42Å; L534-L644 HydrophobicContact CD2-CD2 4.14Å; W632-L644 HydrophobicContact CB-CD1 4.32Å; W632-L644 HydrophobicContact CB-CD2 4.42Å; W632-L644 HydrophobicContact CD2-CD1 3.79Å; W632-L644 HydrophobicContact CE3-CD1 4.26Å; W632-L644 HydrophobicContact CG-CB 4.22Å; W632-L644 HydrophobicContact CG-CD1 3.8Å; W632-L644 HydrophobicContact CG-CD2 4.42Å; W632-L644 HydrophobicContact CG-CG 4.36Å; I641-L644 VanDerWaalsContact O-CB 3.31Å; I641-L644 WeakPolarHBondContact O-CB 3.32Å; I641-L644 PolarHBondContact O-N 3.16Å; L644-T646 PolarHBondContact O-N 3.12Å; L644-M647 PolarHBondContact O-N 3.18Å; L644-I648 HydrophobicContact CD1-CD1 3.7Å; L644-I648 HydrophobicContact CD1-CG1 4.07Å; L644-I648 HydrophobicContact CG-CD1 3.88Å; L644-I648 WeakPolarHBondContact O-CG1 3.45Å; L644-I648 PolarHBondContact O-N 2.79Å
645	P	69.5	Low	71.3	Confident	25 Å²	25	56.4 Å²	56.4	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-46.6	177.2	-21.4	33.9	0	0	0	111.7	L478 E643 M647 I648 I649	L478-P645 HydrophobicContact CD1-CB 4.06Å; L478-P645 HydrophobicContact CD1-CG 4.24Å; L478-P645 HydrophobicContact CD2-CB 4.32Å; E643-P645 VanDerWaalsContact C-CD 3.5Å; P645-M647 VanDerWaalsContact C-N 3.29Å; P645-M647 PolarHBondContact O-N 3.34Å; P645-I648 PolarHBondContact O-N 2.96Å; P645-I649 WeakPolarHBondContact O-CD1 3.36Å; P645-I649 VanDerWaalsContact O-CG1 3.26Å; P645-I649 WeakPolarHBondContact O-CG1 3.38Å; P645-I649 PolarHBondContact O-N 3.05Å
646	T	73	Confident	70.7	Confident	50 Å²	50	52.6 Å²	52.6	31%	0.307	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-31.4	179.3	75.5	0	0	0	0	112.3	E643 L644 K650	E643-T646 PolarHBondContact O-N 3.03Å; E643-T646 VanDerWaalsContact O-N 3.11Å; E643-T646 PolarHBondContact O-OG1 3.08Å; L644-T646 PolarHBondContact O-N 3.12Å; T646-K650 WeakPolarHBondContact O-CB 3.42Å; T646-K650 WeakPolarHBondContact O-CD 3.45Å; T646-K650 WeakPolarHBondContact O-CG 3.41Å; T646-K650 PolarHBondContact O-N 3.08Å
647	M	72.7	Confident	70.1	Confident	47 Å²	47	46.9 Å²	46.9	23%	0.232	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-44.2	175.2	-158.3	82.7	-169.9	0	0	111.4	W632 I637 E643 L644 P645 K650 I651	W632-M647 HydrophobicContact CH2-CB 4.12Å; W632-M647 HydrophobicContact CH2-CE 4.4Å; W632-M647 HydrophobicContact CH2-CG 3.52Å; W632-M647 HydrophobicContact CH2-SD 3.95Å; W632-M647 HydrophobicContact CZ2-CB 3.94Å; W632-M647 HydrophobicContact CZ2-CG 3.83Å; W632-M647 HydrophobicContact CZ2-SD 4.21Å; W632-M647 HydrophobicContact CZ3-CG 4.42Å; I637-M647 HydrophobicContact CD1-CE 3.72Å; I637-M647 HydrophobicContact CG2-CE 3.99Å; E643-M647 PolarHBondContact O-N 3.17Å; L644-M647 PolarHBondContact O-N 3.18Å; P645-M647 VanDerWaalsContact C-N 3.29Å; P645-M647 PolarHBondContact O-N 3.34Å; M647-K650 PolarHBondContact O-N 3.09Å; M647-I651 HydrophobicContact CG-CD1 4.3Å; M647-I651 WeakPolarHBondContact O-CG1 3.47Å; M647-I651 PolarHBondContact O-N 2.94Å
648	I	71.4	Confident	69.4	Low	14 Å²	14	48.7 Å²	48.7	7%	0.072	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-43.3	176.9	-72.8	171	0	0	0	110.7	L475 L478 Y482 L644 P645 K650 I651 L652	L475-I648 HydrophobicContact CD1-CD1 3.71Å; L478-I648 HydrophobicContact CD1-CD1 4Å; Y482-I648 HydrophobicContact CD2-CG2 4.4Å; Y482-I648 HydrophobicContact CE2-CG2 3.66Å; L644-I648 HydrophobicContact CD1-CD1 3.7Å; L644-I648 HydrophobicContact CD1-CG1 4.07Å; L644-I648 HydrophobicContact CG-CD1 3.88Å; L644-I648 WeakPolarHBondContact O-CG1 3.45Å; L644-I648 PolarHBondContact O-N 2.79Å; P645-I648 PolarHBondContact O-N 2.96Å; I648-K650 PolarHBondContact O-N 3.33Å; I648-I651 PolarHBondContact O-N 3.43Å; I648-L652 HydrophobicContact CG2-CD1 3.57Å; I648-L652 WeakPolarHBondContact O-CG 3.45Å; I648-L652 PolarHBondContact O-N 2.8Å
649	I	69.6	Low	68.3	Low	30 Å²	30	47.4 Å²	47.4	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-49.8	172	-69.3	161.9	0	0	0	110.9	Y482 P645 I651 L652 I653 I682	Y482-I649 WeakPolarHBondContact OH-CA 3.5Å; Y482-I649 WeakPolarHBondContact OH-CG1 3.47Å; P645-I649 WeakPolarHBondContact O-CD1 3.36Å; P645-I649 VanDerWaalsContact O-CG1 3.26Å; P645-I649 WeakPolarHBondContact O-CG1 3.38Å; P645-I649 PolarHBondContact O-N 3.05Å; I649-I651 VanDerWaalsContact C-N 3.26Å; I649-I651 PolarHBondContact O-N 3.43Å; I649-L652 PolarHBondContact O-N 3.01Å; I649-I653 HydrophobicContact CG2-CD1 3.58Å; I649-I653 HydrophobicContact CG2-CG1 4.23Å; I649-I653 WeakPolarHBondContact O-CG1 3.28Å; I649-I653 PolarHBondContact O-N 3.32Å; I649-I682 HydrophobicContact CG2-CG2 4.04Å
650	K	69.7	Low	67	Low	135 Å²	135	49.8 Å²	49.8	59%	0.587	26%	0.258	S	S	*	.	H	α-helix	trans	-62.9	-27.7	179.2	-73.7	163.2	-174	162.2	0	113.8	T646 M647 I648 P654	T646-K650 WeakPolarHBondContact O-CB 3.42Å; T646-K650 WeakPolarHBondContact O-CD 3.45Å; T646-K650 WeakPolarHBondContact O-CG 3.41Å; T646-K650 PolarHBondContact O-N 3.08Å; M647-K650 PolarHBondContact O-N 3.09Å; I648-K650 PolarHBondContact O-N 3.33Å; K650-P654 WeakPolarHBondContact O-CD 3.49Å
651	I	70.1	Confident	65.2	Low	48 Å²	48	50.4 Å²	50.4	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-80.2	-34.4	175.8	-68.3	164.3	0	0	0	111.4	I530 L634 M647 I648 I649 I655	I530-I651 HydrophobicContact CD1-CG2 3.67Å; L634-I651 HydrophobicContact CD2-CD1 3.74Å; M647-I651 HydrophobicContact CG-CD1 4.3Å; M647-I651 WeakPolarHBondContact O-CG1 3.47Å; M647-I651 PolarHBondContact O-N 2.94Å; I648-I651 PolarHBondContact O-N 3.43Å; I649-I651 VanDerWaalsContact C-N 3.26Å; I649-I651 PolarHBondContact O-N 3.43Å; I651-I655 HydrophobicContact CG2-CD1 4.24Å; I651-I655 WeakPolarHBondContact O-CD1 3.15Å; I651-I655 WeakPolarHBondContact O-CG1 3.48Å
652	L	66.5	Low	63.7	Low	4 Å²	4	56.8 Å²	56.8	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-87.4	-32.1	-173.8	-72	165	0	0	0	114.4	Y482 L527 I648 I649 I655 I656	Y482-L652 HydrophobicContact CD1-CD1 3.86Å; Y482-L652 HydrophobicContact CD2-CD1 3.58Å; Y482-L652 HydrophobicContact CE1-CB 4.33Å; Y482-L652 HydrophobicContact CE1-CD1 3.67Å; Y482-L652 HydrophobicContact CE2-CD1 3.4Å; Y482-L652 VanDerWaalsContact CE2-CD1 3.4Å; Y482-L652 HydrophobicContact CG-CD1 3.83Å; Y482-L652 VanDerWaalsContact CZ-CD1 3.44Å; L527-L652 HydrophobicContact CD2-CD1 3.73Å; L527-L652 HydrophobicContact CD2-CD2 3.61Å; L527-L652 HydrophobicContact CD2-CG 4.3Å; L527-L652 HydrophobicContact CG-CD2 4.01Å; I648-L652 HydrophobicContact CG2-CD1 3.57Å; I648-L652 WeakPolarHBondContact O-CG 3.45Å; I648-L652 PolarHBondContact O-N 2.8Å; I649-L652 PolarHBondContact O-N 3.01Å; L652-I655 HydrophobicContact CD2-CD1 4.29Å; L652-I655 PolarHBondContact O-N 3.46Å; L652-I656 HydrophobicContact CB-CD1 4.45Å; L652-I656 WeakPolarHBondContact O-CG1 3.45Å; L652-I656 PolarHBondContact O-N 3.4Å
653	I	66.8	Low	61.7	Low	58 Å²	58	56.3 Å²	56.3	30%	0.297	29%	0.287	S	S	.	.	H	α-helix	trans	-51.9	-47.9	175.3	-72.5	166.9	0	0	0	111.7	I649 I655 N657 I682	I649-I653 HydrophobicContact CG2-CD1 3.58Å; I649-I653 HydrophobicContact CG2-CG1 4.23Å; I649-I653 WeakPolarHBondContact O-CG1 3.28Å; I649-I653 PolarHBondContact O-N 3.32Å; I653-I655 PolarHBondContact O-N 3.5Å; I653-N657 VanDerWaalsContact O-CB 3.31Å; I653-N657 WeakPolarHBondContact O-CB 3.29Å; I653-N657 VanDerWaalsContact O-CG 3.24Å; I653-N657 PolarHBondContact O-N 2.9Å; I653-I682 HydrophobicContact CD1-CD1 4.44Å; I653-I682 HydrophobicContact CD1-CG2 4.4Å; I653-I682 HydrophobicContact CG1-CD1 4.32Å
654	P	64	Low	59.5	Low	58 Å²	58	53.5 Å²	53.5	38%	0.377	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-40.7	174	-25.3	35	0	0	0	114	K650 N657 D658	K650-P654 WeakPolarHBondContact O-CD 3.49Å; P654-N657 PolarHBondContact O-N 2.87Å; P654-D658 WeakPolarHBondContact O-CB 3.28Å; P654-D658 PolarHBondContact O-N 3.04Å
655	I	63.1	Low	57.4	Low	33 Å²	33	61.2 Å²	61.2	17%	0.169	32%	0.317	C	S	.	.	H	α-helix	trans	-67.7	-40	-176.7	-65.5	170.8	0	0	0	111.2	I523 I530 I651 L652 I653 S659	I523-I655 HydrophobicContact CG1-CG2 4.45Å; I523-I655 HydrophobicContact CG2-CG2 4.27Å; I530-I655 HydrophobicContact CD1-CD1 4.37Å; I651-I655 HydrophobicContact CG2-CD1 4.24Å; I651-I655 WeakPolarHBondContact O-CD1 3.15Å; I651-I655 WeakPolarHBondContact O-CG1 3.48Å; L652-I655 HydrophobicContact CD2-CD1 4.29Å; L652-I655 PolarHBondContact O-N 3.46Å; I653-I655 PolarHBondContact O-N 3.5Å; I655-S659 WeakPolarHBondContact O-CB 3.37Å; I655-S659 PolarHBondContact O-N 3.08Å; I655-S659 PolarHBondContact O-OG 2.91Å
656	I	61.9	Low	55.4	Low	22 Å²	22	69 Å²	69	11%	0.113	35%	0.351	C	S	.	.	H	α-helix	trans	-67.6	-51.4	175.1	-65.8	167.1	0	0	0	109.7	L652 D658 S659 I660	L652-I656 HydrophobicContact CB-CD1 4.45Å; L652-I656 WeakPolarHBondContact O-CG1 3.45Å; L652-I656 PolarHBondContact O-N 3.4Å; I656-D658 VanDerWaalsContact C-N 3.34Å; I656-D658 PolarHBondContact O-N 2.79Å; I656-S659 WeakPolarHBondContact O-CB 3.47Å; I656-S659 PolarHBondContact O-N 3.39Å; I656-I660 HydrophobicContact CG2-CD1 3.74Å; I656-I660 WeakPolarHBondContact O-CG1 3.46Å; I656-I660 PolarHBondContact O-N 3.05Å; I656-I660 VanDerWaalsContact O-N 3.08Å
657	N	58.2	Low	53.1	Low	45 Å²	45	71 Å²	71	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-39.3	-179.9	-73.7	-2.8	0	0	0	112.8	I653 P654 S659 I660 N661	I653-N657 VanDerWaalsContact O-CB 3.31Å; I653-N657 WeakPolarHBondContact O-CB 3.29Å; I653-N657 VanDerWaalsContact O-CG 3.24Å; I653-N657 PolarHBondContact O-N 2.9Å; P654-N657 PolarHBondContact O-N 2.87Å; N657-S659 PolarHBondContact O-N 3.48Å; N657-I660 PolarHBondContact O-N 3.31Å; N657-N661 VanDerWaalsContact O-CB 3.31Å; N657-N661 WeakPolarHBondContact O-CB 3.18Å; N657-N661 PolarHBondContact O-N 3.01Å; N657-N661 PolarHBondContact O-ND2 2.94Å
658	D	53.9	Low	51	Low	102 Å²	102	76.5 Å²	76.5	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-75.2	-13.2	179.8	-156.9	46.8	0	0	0	112.8	P654 I656 K662	P654-D658 WeakPolarHBondContact O-CB 3.28Å; P654-D658 PolarHBondContact O-N 3.04Å; I656-D658 VanDerWaalsContact C-N 3.34Å; I656-D658 PolarHBondContact O-N 2.79Å; D658-K662 PolarHBondContact O-NZ 2.96Å; D658-K662 IonicContact OD1-NZ 3.95Å; D658-K662 PolarHBondContact OD1-NZ 3.2Å; D658-K662 IonicContact OD2-NZ 3.94Å; D658-K662 PolarHBondContact OD2-NZ 3.29Å
659	S	51.1	Low	49	Very low	32 Å²	32	84.3 Å²	84.3	22%	0.224	43%	0.434	C	S	.	.	H	α-helix	trans	-88.4	-32.3	172.8	-60.9	0	0	0	0	113.1	K519 I655 I656 N657	K519-S659 PolarHBondContact NZ-O 3.49Å; I655-S659 WeakPolarHBondContact O-CB 3.37Å; I655-S659 PolarHBondContact O-N 3.08Å; I655-S659 PolarHBondContact O-OG 2.91Å; I656-S659 WeakPolarHBondContact O-CB 3.47Å; I656-S659 PolarHBondContact O-N 3.39Å; N657-S659 PolarHBondContact O-N 3.48Å
660	I	48.7	Very low	47.1	Very low	56 Å²	56	91.7 Å²	91.7	29%	0.287	46%	0.461	S	S	.	.	H	α-helix	trans	-81.1	-51	177.4	-65.1	170.9	0	0	0	111.1	I656 N657 K662 Q663	I656-I660 HydrophobicContact CG2-CD1 3.74Å; I656-I660 WeakPolarHBondContact O-CG1 3.46Å; I656-I660 PolarHBondContact O-N 3.05Å; I656-I660 VanDerWaalsContact O-N 3.08Å; N657-I660 PolarHBondContact O-N 3.31Å; I660-K662 PolarHBondContact O-N 3.36Å; I660-Q663 WeakPolarHBondContact O-CB 3.5Å; I660-Q663 PolarHBondContact O-N 3.46Å; I660-Q663 VanDerWaalsContact O-N 3.07Å
661	N	41.4	Very low	45.2	Very low	75 Å²	75	88.2 Å²	88.2	40%	0.401	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-65.6	-9.3	-171.9	-74.9	-55.3	0	0	0	115.2	N657 Q663	N657-N661 VanDerWaalsContact O-CB 3.31Å; N657-N661 WeakPolarHBondContact O-CB 3.18Å; N657-N661 PolarHBondContact O-N 3.01Å; N657-N661 PolarHBondContact O-ND2 2.94Å; N661-Q663 PolarHBondContact O-N 3.22Å
662	K	40.4	Very low	43.5	Very low	135 Å²	135	91.1 Å²	91.1	59%	0.587	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-81	9.4	172.1	-67.1	-175.1	-177.1	62.4	0	113.9	D658 I660	D658-K662 PolarHBondContact O-NZ 2.96Å; D658-K662 IonicContact OD1-NZ 3.95Å; D658-K662 PolarHBondContact OD1-NZ 3.2Å; D658-K662 IonicContact OD2-NZ 3.94Å; D658-K662 PolarHBondContact OD2-NZ 3.29Å; I660-K662 PolarHBondContact O-N 3.36Å
663	Q	33.5	Very low	41.9	Very low	113 Å²	113	96.4 Å²	96.4	53%	0.528	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-107.3	-1.4	-177.5	-147.9	130.8	-22	0	0	114.1	H516 I660 N661	H516-Q663 PolarHBondContact CE1-NE2 2.91Å; H516-Q663 PolarHBondContact NE2-NE2 3.17Å; I660-Q663 WeakPolarHBondContact O-CB 3.5Å; I660-Q663 PolarHBondContact O-N 3.46Å; I660-Q663 VanDerWaalsContact O-N 3.07Å; N661-Q663 PolarHBondContact O-N 3.22Å
664	S	29.6	Very low	40.3	Very low	40 Å²	40	98 Å²	98	28%	0.28	51%	0.505	S	S	.	.			trans	-129.2	87.3	178	65.4	0	0	0	0	114.2	N671	S664-N671 WeakPolarHBondContact CB-ND2 3.33Å; S664-N671 PolarHBondContact OG-ND2 2.91Å
665	I	29.8	Very low	38.9	Very low	163 Å²	163	97 Å²	97	84%	0.836	50%	0.497	S	S	*	.	S	Bend	trans	-124.4	51.7	154	-46	-179.5	0	0	0	108.6
666	H	27.8	Very low	37.4	Very low	189 Å²	189	97.7 Å²	97.7	88%	0.875	50%	0.504	S	S	*	.	S	Bend	trans	-178.5	59	154.5	-103.8	-67.2	0	0	0	112.7
667	S	26.2	Very low	36.2	Very low	91 Å²	91	101 Å²	101	64%	0.636	52%	0.522	S	S	*	.			trans	-176.3	109.1	156.5	28.5	0	0	0	0	110.3
668	N	28	Very low	35.4	Very low	163 Å²	163	101.5 Å²	101.5	87%	0.872	52%	0.524	S	S	*	.			trans	-87.8	110.8	166.7	-73.3	-12.8	0	0	0	107.7
669	E	28.9	Very low	34.8	Very low	178 Å²	178	100.5 Å²	100.5	83%	0.832	52%	0.518	S	S	*	.	S	Bend	trans	174.6	-24.3	138.5	-97	161	-163.4	0	0	113.1
670	Y	29.9	Very low	34.2	Very low	186 Å²	186	103.2 Å²	103.2	73%	0.729	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-82.6	-24.7	-175.6	-112	-95.1	0	0	0	116.3	T672	Y670-T672 VanDerWaalsContact C-N 3.26Å; Y670-T672 PolarHBondContact O-N 2.99Å; Y670-T672 VanDerWaalsContact O-N 3.14Å
671	N	30.3	Very low	34	Very low	61 Å²	61	105.2 Å²	105.2	33%	0.326	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-77.7	4.4	-169.5	-85.7	-7	0	0	0	116.4	S664 N675	S664-N671 WeakPolarHBondContact CB-ND2 3.33Å; S664-N671 PolarHBondContact OG-ND2 2.91Å; N671-N675 PolarHBondContact O-ND2 3.49Å
672	T	34.1	Very low	33.9	Very low	110 Å²	110	103.9 Å²	103.9	68%	0.675	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-91.5	-25.2	175.8	46.1	0	0	0	0	113.6	Y670 S676	Y670-T672 VanDerWaalsContact C-N 3.26Å; Y670-T672 PolarHBondContact O-N 2.99Å; Y670-T672 VanDerWaalsContact O-N 3.14Å; T672-S676 PolarHBondContact O-OG 2.94Å
673	L	31.8	Very low	33.8	Very low	114 Å²	114	103.5 Å²	103.5	60%	0.597	53%	0.534	S	S	*	.	H	α-helix	trans	-86.3	-40.2	-174	-152.7	71.8	0	0	0	112.9	S676 N677	L673-S676 PolarHBondContact O-N 3.12Å; L673-S676 PolarHBondContact O-OG 3.3Å; L673-N677 PolarHBondContact O-N 2.87Å
674	I	33.9	Very low	34.1	Very low	92 Å²	92	102.1 Å²	102.1	47%	0.472	53%	0.53	S	S	.	.	H	α-helix	trans	-68.8	-43.2	178.8	-62.4	172.1	0	0	0	110.9	S676 N677 I678	I674-S676 VanDerWaalsContact C-N 3.26Å; I674-S676 PolarHBondContact O-N 2.89Å; I674-N677 PolarHBondContact O-N 3.13Å; I674-I678 HydrophobicContact CG2-CD1 3.87Å; I674-I678 PolarHBondContact O-N 2.81Å
675	N	34.1	Very low	34.6	Very low	38 Å²	38	103.6 Å²	103.6	20%	0.203	53%	0.533	C	S	.	.	H	α-helix	trans	-64.5	-25.9	178.4	-81.6	-57.4	0	0	0	113.5	N671 I679	N671-N675 PolarHBondContact O-ND2 3.49Å; N675-I679 WeakPolarHBondContact O-CD1 3.5Å; N675-I679 VanDerWaalsContact O-CG1 3.27Å; N675-I679 WeakPolarHBondContact O-CG1 3.44Å
676	S	32.2	Very low	34.9	Very low	46 Å²	46	98.7 Å²	98.7	32%	0.322	51%	0.509	S	S	.	.	H	α-helix	trans	-81.3	-39.3	178.5	37.5	0	0	0	0	112.4	T672 L673 I674 N680	T672-S676 PolarHBondContact O-OG 2.94Å; L673-S676 PolarHBondContact O-N 3.12Å; L673-S676 PolarHBondContact O-OG 3.3Å; I674-S676 VanDerWaalsContact C-N 3.26Å; I674-S676 PolarHBondContact O-N 2.89Å; S676-N680 WeakPolarHBondContact O-CB 3.41Å; S676-N680 PolarHBondContact O-N 3.01Å; S676-N680 PolarHBondContact O-ND2 3.21Å; S676-N680 VanDerWaalsContact O-ND2 3.17Å
677	N	37.2	Very low	35.1	Very low	92 Å²	92	92.6 Å²	92.6	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-47.7	177.3	-71.4	-12	0	0	0	112.6	L673 I674 I679 N680 D681	L673-N677 PolarHBondContact O-N 2.87Å; I674-N677 PolarHBondContact O-N 3.13Å; N677-I679 VanDerWaalsContact C-N 3.27Å; N677-I679 PolarHBondContact O-N 3.47Å; N677-N680 PolarHBondContact O-N 3.27Å; N677-N680 VanDerWaalsContact O-N 3.11Å; N677-D681 PolarHBondContact O-N 3.47Å
678	I	40.8	Very low	35.5	Very low	56 Å²	56	94.8 Å²	94.8	29%	0.287	49%	0.486	S	S	.	.	H	α-helix	trans	-61.5	-35.6	-179.1	-63.3	172.5	0	0	0	111.7	L489 I674 I682	L489-I678 HydrophobicContact CD2-CD1 4.42Å; I674-I678 HydrophobicContact CG2-CD1 3.87Å; I674-I678 PolarHBondContact O-N 2.81Å; I678-I682 HydrophobicContact CG2-CD1 4.25Å; I678-I682 WeakPolarHBondContact O-CD1 3.42Å; I678-I682 VanDerWaalsContact O-CG1 3.31Å; I678-I682 WeakPolarHBondContact O-CG1 3.21Å; I678-I682 PolarHBondContact O-N 3.34Å
679	I	41.1	Very low	35.6	Very low	80 Å²	80	92.9 Å²	92.9	41%	0.41	47%	0.472	S	S	.	.	H	α-helix	trans	-71.4	-43.2	175.6	-67.9	174.7	0	0	0	110.9	N675 N677 D681 I682 E683	N675-I679 WeakPolarHBondContact O-CD1 3.5Å; N675-I679 VanDerWaalsContact O-CG1 3.27Å; N675-I679 WeakPolarHBondContact O-CG1 3.44Å; N677-I679 VanDerWaalsContact C-N 3.27Å; N677-I679 PolarHBondContact O-N 3.47Å; I679-D681 VanDerWaalsContact C-N 3.35Å; I679-D681 PolarHBondContact O-N 2.77Å; I679-I682 PolarHBondContact O-N 3.27Å; I679-E683 PolarHBondContact O-N 2.83Å
680	N	38.4	Very low	35.7	Very low	89 Å²	89	91 Å²	91	48%	0.476	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-41.3	177.2	-72.5	-24.7	0	0	0	112.4	S676 N677 I682 E683 L684	S676-N680 WeakPolarHBondContact O-CB 3.41Å; S676-N680 PolarHBondContact O-N 3.01Å; S676-N680 PolarHBondContact O-ND2 3.21Å; S676-N680 VanDerWaalsContact O-ND2 3.17Å; N677-N680 PolarHBondContact O-N 3.27Å; N677-N680 VanDerWaalsContact O-N 3.11Å; N680-I682 VanDerWaalsContact C-N 3.34Å; N680-I682 PolarHBondContact O-N 3.49Å; N680-E683 PolarHBondContact O-N 3.5Å; N680-L684 VanDerWaalsContact O-CB 3.3Å; N680-L684 WeakPolarHBondContact O-CB 3.4Å; N680-L684 PolarHBondContact O-N 2.89Å
681	D	43.9	Very low	35.5	Very low	98 Å²	98	92.1 Å²	92.1	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-35.9	177.9	-75.4	-40.6	0	0	0	112.3	N677 I679 L684 I685	N677-D681 PolarHBondContact O-N 3.47Å; I679-D681 VanDerWaalsContact C-N 3.35Å; I679-D681 PolarHBondContact O-N 2.77Å; D681-L684 PolarHBondContact O-N 3.41Å; D681-I685 VanDerWaalsContact O-CG1 3.31Å; D681-I685 WeakPolarHBondContact O-CG1 3.3Å; D681-I685 PolarHBondContact O-N 3.47Å
682	I	40.7	Very low	35.3	Very low	47 Å²	47	95.8 Å²	95.8	24%	0.241	49%	0.491	C	S	.	.	H	α-helix	trans	-68	-40.7	174.6	-67.9	168.4	0	0	0	111.2	I649 I653 I678 I679 N680 I685 N686	I649-I682 HydrophobicContact CG2-CG2 4.04Å; I653-I682 HydrophobicContact CD1-CD1 4.44Å; I653-I682 HydrophobicContact CD1-CG2 4.4Å; I653-I682 HydrophobicContact CG1-CD1 4.32Å; I678-I682 HydrophobicContact CG2-CD1 4.25Å; I678-I682 WeakPolarHBondContact O-CD1 3.42Å; I678-I682 VanDerWaalsContact O-CG1 3.31Å; I678-I682 WeakPolarHBondContact O-CG1 3.21Å; I678-I682 PolarHBondContact O-N 3.34Å; I679-I682 PolarHBondContact O-N 3.27Å; N680-I682 VanDerWaalsContact C-N 3.34Å; N680-I682 PolarHBondContact O-N 3.49Å; I682-I685 PolarHBondContact O-N 3.01Å; I682-N686 PolarHBondContact O-N 3.48Å; I682-N686 PolarHBondContact O-ND2 2.86Å
683	E	37.1	Very low	34.9	Very low	127 Å²	127	100.8 Å²	100.8	59%	0.593	50%	0.499	S	S	*	.	H	α-helix	trans	-68.3	-36.6	173.9	-68.9	-164.3	155.6	0	0	112.4	I679 N680 I685 N686 S687	I679-E683 PolarHBondContact O-N 2.83Å; N680-E683 PolarHBondContact O-N 3.5Å; E683-I685 VanDerWaalsContact C-N 3.29Å; E683-I685 PolarHBondContact O-N 3.45Å; E683-N686 PolarHBondContact O-N 3.42Å; E683-S687 PolarHBondContact O-N 2.88Å
684	L	41.1	Very low	34.5	Very low	85 Å²	85	102.6 Å²	102.6	45%	0.445	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-32.6	176.4	-166.4	70.3	0	0	0	112.1	N680 D681 S687	N680-L684 VanDerWaalsContact O-CB 3.3Å; N680-L684 WeakPolarHBondContact O-CB 3.4Å; N680-L684 PolarHBondContact O-N 2.89Å; D681-L684 PolarHBondContact O-N 3.41Å; L684-S687 PolarHBondContact O-N 3.28Å; L684-S687 PolarHBondContact O-OG 3.33Å
685	I	39.9	Very low	34	Very low	70 Å²	70	106.4 Å²	106.4	36%	0.359	53%	0.53	S	S	.	.	H	α-helix	trans	-67.1	-41.3	174.9	-73	165	0	0	0	111.7	F481 D681 I682 E683 S687 K688 Q689	F481-I685 HydrophobicContact CZ-CD1 4.28Å; D681-I685 VanDerWaalsContact O-CG1 3.31Å; D681-I685 WeakPolarHBondContact O-CG1 3.3Å; D681-I685 PolarHBondContact O-N 3.47Å; I682-I685 PolarHBondContact O-N 3.01Å; E683-I685 VanDerWaalsContact C-N 3.29Å; E683-I685 PolarHBondContact O-N 3.45Å; I685-S687 VanDerWaalsContact C-N 3.3Å; I685-S687 PolarHBondContact O-N 2.84Å; I685-K688 PolarHBondContact O-N 2.98Å; I685-K688 VanDerWaalsContact O-N 3.08Å; I685-Q689 PolarHBondContact O-N 3.3Å
686	N	35.5	Very low	33.6	Very low	60 Å²	60	114.1 Å²	114.1	32%	0.321	56%	0.562	S	S	.	*	H	α-helix	trans	-56.6	-46	175	-67.3	-39.5	0	0	0	110.8	I682 E683 K688 Q689	I682-N686 PolarHBondContact O-N 3.48Å; I682-N686 PolarHBondContact O-ND2 2.86Å; E683-N686 PolarHBondContact O-N 3.42Å; N686-K688 PolarHBondContact O-N 2.98Å; N686-Q689 PolarHBondContact O-N 3.38Å; N686-Q689 VanDerWaalsContact O-N 3.13Å
687	S	32	Very low	33.3	Very low	61 Å²	61	119.6 Å²	119.6	43%	0.427	59%	0.587	S	S	.	*	H	α-helix	trans	-60.6	-19.1	179.1	79.4	0	0	0	0	114.9	E683 L684 I685	E683-S687 PolarHBondContact O-N 2.88Å; L684-S687 PolarHBondContact O-N 3.28Å; L684-S687 PolarHBondContact O-OG 3.33Å; I685-S687 VanDerWaalsContact C-N 3.3Å; I685-S687 PolarHBondContact O-N 2.84Å
688	K	34.1	Very low	32.8	Very low	137 Å²	137	121.1 Å²	121.1	60%	0.596	61%	0.605	S	S	*	*	H	α-helix	trans	-96.4	-14.2	-179.2	-71.6	174.8	-179.4	170.9	0	113.8	I685 N686	I685-K688 PolarHBondContact O-N 2.98Å; I685-K688 VanDerWaalsContact O-N 3.08Å; N686-K688 PolarHBondContact O-N 2.98Å
689	Q	30.3	Very low	31.9	Very low	124 Å²	124	126.3 Å²	126.3	58%	0.579	63%	0.63	S	S	*	*	H	α-helix	trans	-87.4	-36.8	175.5	-68.7	-168.8	-16.4	0	0	112.3	I685 N686 Y691 N692	I685-Q689 PolarHBondContact O-N 3.3Å; N686-Q689 PolarHBondContact O-N 3.38Å; N686-Q689 VanDerWaalsContact O-N 3.13Å; Q689-Y691 PolarHBondContact O-N 3.02Å; Q689-N692 PolarHBondContact O-N 3.32Å
690	D	30.6	Very low	31.2	Very low	139 Å²	139	130.6 Å²	130.6	74%	0.743	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-16.4	179.2	-76	-28.6	0	0	0	114.5
691	Y	26.5	Very low	30.6	Very low	209 Å²	209	132.7 Å²	132.7	82%	0.82	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	5.9	-176	-96.3	-79.9	0	0	0	116	Q689	Q689-Y691 PolarHBondContact O-N 3.02Å
692	N	25.9	Very low	29.8	Very low	137 Å²	137	135.1 Å²	135.1	73%	0.733	67%	0.67	S	S	*	*	S	Bend	trans	-131.6	15.5	-171.4	-116	-34	0	0	0	117.3	Q689	Q689-N692 PolarHBondContact O-N 3.32Å
693	Y	25.4	Very low	29.1	Very low	215 Å²	215	141.4 Å²	141.4	84%	0.843	70%	0.698	S	S	*	*	S	Bend	trans	-138.4	44.3	174.3	-107.6	-76.3	0	0	0	114.8
694	N	24.1	Very low	28.6	Very low	153 Å²	153	143 Å²	143	82%	0.818	71%	0.706	S	S	*	*			trans	-142.9	43	179.4	-117.6	-34.2	0	0	0	116
695	L	24.1	Very low	28	Very low	172 Å²	172	144 Å²	144	90%	0.901	71%	0.711	S	S	*	*			trans	-158.8	101.2	155.5	-142.1	74.3	0	0	0	115.1
696	K	24.9	Very low	27.4	Very low	200 Å²	200	146.3 Å²	146.3	87%	0.87	73%	0.725	S	S	*	*	S	Bend	trans	-165.2	137.9	145.7	-112.5	162.1	-173.6	171.4	0	110.6
697	N	26.9	Very low	26.8	Very low	160 Å²	160	152.5 Å²	152.5	86%	0.856	75%	0.745	S	S	*	*	S	Bend	trans	71.9	60	174.3	-54.3	-10.7	0	0	0	117.4
698	S	25.5	Very low	26.4	Very low	124 Å²	124	155.7 Å²	155.7	87%	0.867	76%	0.757	S	S	*	*				-126.4	151.3	117.2	-165.7	0	0	0	0	108.9
699	M	22.5	Very low	25.9	Very low	165 Å²	165	154.8 Å²	154.8	81%	0.813	76%	0.759	S	S	*	*			trans	-121.8	143.8	-178.1	-119.5	-168.8	-176.3	0	0	108.6
700	K	25.4	Very low	25.6	Very low	171 Å²	171	156.6 Å²	156.6	74%	0.743	77%	0.767	S	S	*	*			trans	72.1	137.4	162.2	-67.9	-169.2	176.5	-166.2	0	116
701	D	26.3	Very low	25.3	Very low	132 Å²	132	157.4 Å²	157.4	71%	0.706	77%	0.771	S	S	*	*			cis	-138.4	-177.1	2.2	-79.9	-49.3	0	0	0	111
702	N	28.2	Very low	25.3	Very low	149 Å²	149	154.8 Å²	154.8	80%	0.797	77%	0.769	S	S	*	*			trans	83.3	95.1	170.6	-54.1	-12.9	0	0	0	118.1
703	E	24.2	Very low	25.1	Very low	179 Å²	179	155 Å²	155	84%	0.836	77%	0.766	S	S	*	*				11.9	142	109.7	-64.9	168	-177.5	0	0	117.3
704	E	27.1	Very low	25.2	Very low	161 Å²	161	150.9 Å²	150.9	75%	0.752	76%	0.758	S	S	*	*			cis	-161.6	162.9	26.9	-141.6	-168.8	-172.8	0	0	113.2
705	N	29.1	Very low	25.4	Very low	105 Å²	105	150.8 Å²	150.8	56%	0.561	75%	0.751	S	S	*	*			trans	61.5	93.8	149.9	-77.8	-44.6	0	0	0	123.9
706	N	26.2	Very low	25.3	Very low	120 Å²	120	149.9 Å²	149.9	64%	0.642	74%	0.744	S	S	*	*				76.6	123.8	105.5	-79	-25.8	0	0	0	125.8
707	Y	24.4	Very low	25.3	Very low	190 Å²	190	147.6 Å²	147.6	75%	0.745	73%	0.734	S	S	*	*			trans	67.1	99.6	137.8	-70.5	-63.6	0	0	0	124.1
708	N	22.3	Very low	25.2	Very low	128 Å²	128	147 Å²	147	68%	0.684	73%	0.728	S	S	*	*				64.5	131.2	108.7	-73.9	35.6	0	0	0	125.1
709	N	23.2	Very low	25.2	Very low	117 Å²	117	147.1 Å²	147.1	63%	0.626	72%	0.717	S	S	*	*			trans	94.9	123.6	131.4	-77.1	37.5	0	0	0	122.9
710	E	24	Very low	25.3	Very low	162 Å²	162	146.9 Å²	146.9	76%	0.757	72%	0.719	S	S	*	*			trans	69.1	96.7	132.7	-64.8	172.9	125	0	0	121
711	L	25.3	Very low	25.3	Very low	156 Å²	156	145.5 Å²	145.5	82%	0.817	72%	0.718	S	S	*	*				47.3	113.4	107.6	-157.9	85.7	0	0	0	118.4
712	I	26	Very low	25.6	Very low	154 Å²	154	144.8 Å²	144.8	79%	0.79	72%	0.721	S	S	*	*				-178.8	135.2	118.2	-92.7	157.1	0	0	0	113.1
713	H	22.6	Very low	25.5	Very low	143 Å²	143	146.5 Å²	146.5	66%	0.662	72%	0.718	S	S	*	*			trans	-16.9	132.3	158.6	-113.9	-95.2	0	0	0	120.9
714	D	26.9	Very low	25.6	Very low	128 Å²	128	146.1 Å²	146.1	68%	0.684	72%	0.716	S	S	*	*				175.2	127.5	100.2	-103.7	-10.7	0	0	0	112.1
715	K	28.6	Very low	25.4	Very low	150 Å²	150	144.7 Å²	144.7	65%	0.652	71%	0.709	S	S	*	*				79	94.9	82.5	-79.6	-171.3	-172.6	142.2	0	118.3
716	M	21.5	Very low	25.3	Very low	153 Å²	153	145.5 Å²	145.5	75%	0.754	71%	0.714	S	S	*	*				99.9	133.1	108	-165	152.9	77.1	0	0	121.9
717	K	25.7	Very low	25.3	Very low	153 Å²	153	145.2 Å²	145.2	67%	0.665	72%	0.716	S	S	*	*			trans	88.2	116.3	148.8	-100	175.4	-176.9	-177.7	0	122.1	I719	K717-I719 HydrophobicContact CG-CD1 4.49Å
718	M	23.9	Very low	25.3	Very low	148 Å²	148	143.3 Å²	143.3	73%	0.729	72%	0.716	S	S	*	*			trans	157.1	90.2	132.4	-83.4	-55.7	103.8	0	0	106.9
719	I	25	Very low	25.4	Very low	125 Å²	125	142.5 Å²	142.5	64%	0.641	71%	0.712	S	S	*	*				71.9	116.7	72.7	-62	178.8	0	0	0	113.6	K717	K717-I719 HydrophobicContact CG-CD1 4.49Å
720	D	25.3	Very low	25.4	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	72%	0.715	S	S	*	*			trans	-157.2	126.1	136.9	-118.4	-18.3	0	0	0	110.3
721	I	26.5	Very low	25.4	Very low	141 Å²	141	142.3 Å²	142.3	72%	0.723	71%	0.713	S	S	*	*			trans	-156.4	137	-179.8	-57.8	178	0	0	0	109.5
722	P	32	Very low	25.4	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	70%	0.703	S	S	*	*			trans	-107.6	135	148.9	-0.3	21.6	0	0	0	110.9
723	Y	24.9	Very low	25.3	Very low	185 Å²	185	139.5 Å²	139.5	73%	0.725	70%	0.696	S	S	*	*				62.5	132.8	65.6	-92.3	-97	0	0	0	112.8	Q725	Y723-Q725 VanDerWaalsContact CE1-OE1 3.29Å
724	E	26.9	Very low	25.4	Very low	171 Å²	171	139 Å²	139	80%	0.799	69%	0.694	S	S	*	*			cis	-121	161.4	14.2	-74.7	160.2	153.1	0	0	111
725	Q	23.1	Very low	25.3	Very low	132 Å²	132	142.1 Å²	142.1	62%	0.617	70%	0.697	S	S	*	*				56.4	134.9	60.3	-72.2	-165.9	-103.1	0	0	113.1	Y723	Y723-Q725 VanDerWaalsContact CE1-OE1 3.29Å
726	D	25.9	Very low	25.2	Very low	122 Å²	122	144 Å²	144	65%	0.652	70%	0.7	S	S	*	*			cis	-158	173.3	25.1	-113.1	-17.1	0	0	0	115
727	T	27.9	Very low	25.5	Very low	113 Å²	113	142.7 Å²	142.7	69%	0.693	70%	0.695	S	S	*	*			trans	2.9	162.5	148.8	77.7	0	0	0	0	122.2
728	M	23.1	Very low	25.4	Very low	150 Å²	150	142 Å²	142	74%	0.739	70%	0.698	S	S	*	*			cis	-172.8	158.3	-13	-116.5	-170.8	161.9	0	0	109.6
729	N	24.2	Very low	25.6	Very low	112 Å²	112	140.2 Å²	140.2	60%	0.599	70%	0.695	S	S	*	*			trans	58.4	157.7	145.9	-69	-23.6	0	0	0	119.8
730	K	24.1	Very low	25.7	Very low	160 Å²	160	140.5 Å²	140.5	70%	0.696	70%	0.697	S	S	*	*			cis	-171.1	161.5	-19.2	-111.5	174.9	-175.8	-178.6	0	107.3
731	T	24.6	Very low	25.7	Very low	115 Å²	115	137.4 Å²	137.4	71%	0.706	69%	0.688	S	S	*	*			trans	61.1	148.6	150.6	52.4	0	0	0	0	118.5
732	D	25.3	Very low	25.5	Very low	114 Å²	114	136.9 Å²	136.9	61%	0.61	69%	0.687	S	S	*	*			cis	-160.3	163	-7.2	-119.2	-26.7	0	0	0	111.9
733	Q	24.4	Very low	25.1	Very low	137 Å²	137	137.9 Å²	137.9	64%	0.64	68%	0.682	S	S	*	*			trans	28.1	148.6	134.5	-64.3	170.8	58.4	0	0	121.1
734	Q	24.1	Very low	25.1	Very low	133 Å²	133	138.1 Å²	138.1	62%	0.621	69%	0.689	S	S	*	*			cis	-169.8	-166.6	1.2	-121.5	174.3	20.4	0	0	110.5
735	Y	25.3	Very low	25	Very low	193 Å²	193	136.1 Å²	136.1	76%	0.757	68%	0.683	S	S	*	*			trans	91.2	136.6	159.8	-65.1	-54	0	0	0	116.9
736	R	25	Very low	25.1	Very low	190 Å²	190	136.7 Å²	136.7	72%	0.717	69%	0.689	S	S	*	*			cis	-153.8	144.6	12.9	-126.7	167.3	-167.6	-107.2	-3	113
737	I	27.6	Very low	25	Very low	124 Å²	124	138 Å²	138	64%	0.636	70%	0.696	S	S	*	*			trans	73.1	136.5	141	-77.6	166.7	0	0	0	117.5
738	L	25.4	Very low	25	Very low	140 Å²	140	139.2 Å²	139.2	73%	0.733	69%	0.691	S	S	*	*			cis	-160.6	158.3	-4	-103.4	172.4	0	0	0	110.5
739	V	27.2	Very low	25.4	Very low	109 Å²	109	137.8 Å²	137.8	66%	0.661	68%	0.681	S	S	*	*			trans	63.6	140.2	140.9	168.7	0	0	0	0	119.3
740	D	27.1	Very low	25.4	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	69%	0.694	S	S	*	*			cis	-166.3	163.1	-23.5	-100.2	-16.4	0	0	0	109.5
741	S	24.7	Very low	25.5	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	68%	0.68	S	S	*	*			trans	45.4	122.3	142.4	-55.9	0	0	0	0	124
742	N	23.4	Very low	25.7	Very low	130 Å²	130	138.8 Å²	138.8	70%	0.695	68%	0.675	S	S	*	*			trans	84.8	121.6	132.4	-68.6	32.3	0	0	0	123.5
743	E	23	Very low	25.6	Very low	139 Å²	139	139.2 Å²	139.2	65%	0.65	68%	0.677	S	S	*	*				57	95.7	129	-59.4	178.9	110.2	0	0	121.9
744	Q	25.5	Very low	25.5	Very low	189 Å²	189	137 Å²	137	88%	0.883	68%	0.677	S	S	*	*				-176.1	111.4	116.2	-97.2	153	69.3	0	0	108.4
745	I	25.1	Very low	25.6	Very low	129 Å²	129	137.4 Å²	137.4	66%	0.662	68%	0.679	S	S	*	*				77.9	111.7	52	-58.9	-180	0	0	0	113.2
746	I	24.4	Very low	25.6	Very low	145 Å²	145	134.7 Å²	134.7	74%	0.744	67%	0.668	S	S	*	*			trans	76.6	128.4	166.4	-68.4	164.2	0	0	0	118.2
747	N	23.5	Very low	25.5	Very low	149 Å²	149	128.7 Å²	128.7	80%	0.797	65%	0.65	S	S	*	*			trans	62.9	121.7	169.8	-71.1	-31.2	0	0	0	118.5
748	K	29.1	Very low	25.4	Very low	139 Å²	139	125.9 Å²	125.9	60%	0.604	65%	0.651	S	S	*	*				-160.8	84.4	128.3	-103	-175.3	-174.3	-151.8	0	113	S234 T235	S234-K748 VanDerWaalsContact CB-CD 3.48Å; S234-K748 VanDerWaalsContact CB-CG 3.48Å; S234-K748 PolarHBondContact O-NZ 3.44Å; S234-K748 WeakPolarHBondContact OG-CG 3.48Å; T235-K748 WeakPolarHBondContact OG1-CE 3.37Å; T235-K748 PolarHBondContact OG1-NZ 3.23Å
749	K	31	Very low	25.5	Very low	119 Å²	119	123.6 Å²	123.6	52%	0.517	64%	0.637	S	S	.	*			trans	46.5	122	153.3	-58	-171.6	73.6	-169	0	120.3	D233 S234 K751	D233-K749 WeakPolarHBondContact OD2-CD 3.44Å; D233-K749 VanDerWaalsContact OD2-CE 3.29Å; D233-K749 WeakPolarHBondContact OD2-CE 3.36Å; D233-K749 IonicContact OD2-NZ 3.69Å; D233-K749 PolarHBondContact OD2-NZ 3.02Å; S234-K749 VanDerWaalsContact OG-CD 3.31Å; S234-K749 WeakPolarHBondContact OG-CD 3.44Å; S234-K749 WeakPolarHBondContact OG-CG 3.28Å; K749-K751 PolarHBondContact O-N 3.34Å
750	F	24.3	Very low	25.4	Very low	198 Å²	198	122.7 Å²	122.7	87%	0.868	64%	0.635	S	S	*	*			trans	-43.6	120.1	142.8	-101.8	-96	0	0	0	110.9
751	K	25	Very low	25.5	Very low	96 Å²	96	124.7 Å²	124.7	42%	0.417	65%	0.646	S	S	.	*			trans	-152.8	129.1	147.1	-171.2	168.8	81.5	-180	0	104.1	V231 T232 D233 K749	V231-K751 HydrophobicContact CG1-CB 3.55Å; V231-K751 HydrophobicContact CG1-CD 4.22Å; V231-K751 HydrophobicContact CG1-CG 3.57Å; V231-K751 WeakPolarHBondContact CG1-O 3.44Å; V231-K751 HydrophobicContact CG2-CD 4.46Å; V231-K751 HydrophobicContact CG2-CG 4.14Å; T232-K751 HydrophobicContact CG2-CB 4.21Å; D233-K751 HydrophobicContact CB-CB 4.38Å; D233-K751 HydrophobicContact CB-CD 4.12Å; D233-K751 WeakPolarHBondContact OD1-CE 3.3Å; D233-K751 IonicContact OD1-NZ 3.94Å; D233-K751 PolarHBondContact OD1-NZ 2.95Å; K749-K751 PolarHBondContact O-N 3.34Å
752	L	29.5	Very low	25.6	Very low	114 Å²	114	130.5 Å²	130.5	60%	0.597	65%	0.653	S	S	*	*			trans	-176.2	105.2	145.4	-149.4	150.4	0	0	0	108.9	V231	V231-L752 HydrophobicContact CB-CD1 4.25Å; V231-L752 HydrophobicContact CB-CG 4.04Å; V231-L752 HydrophobicContact CG1-CB 4.13Å; V231-L752 HydrophobicContact CG1-CD1 4.41Å; V231-L752 HydrophobicContact CG1-CG 4.15Å; V231-L752 HydrophobicContact CG2-CG 4.31Å
753	L	22.3	Very low	25.9	Very low	123 Å²	123	133.2 Å²	133.2	64%	0.644	66%	0.659	S	S	*	*			trans	-98.7	145.7	157.1	-160.7	77.5	0	0	0	106.9
754	S	22.3	Very low	26.1	Very low	92 Å²	92	132.8 Å²	132.8	64%	0.643	66%	0.66	S	S	*	*			trans	-52.3	145.4	165.1	51.7	0	0	0	0	109.9
755	E	25.9	Very low	26.3	Very low	141 Å²	141	131.1 Å²	131.1	66%	0.659	66%	0.656	S	S	*	*			cis	-135.5	179.6	27.8	-83.7	-169.6	117.9	0	0	110.8
756	Y	25.4	Very low	26.3	Very low	136 Å²	136	131.1 Å²	131.1	53%	0.533	66%	0.656	S	S	.	*			cis	-166.5	153.5	32.1	-151.7	-154.3	0	0	0	110.5	S228 S229	S228-Y756 PolarHBondContact OG-O 3.39Å; S229-Y756 WeakPolarHBondContact CB-O 3.26Å; S229-Y756 PolarHBondContact OG-N 3.11Å; S229-Y756 PolarHBondContact OG-O 3.46Å
757	I	24.6	Very low	26.5	Very low	64 Å²	64	129.6 Å²	129.6	33%	0.328	66%	0.659	S	S	.	*			trans	66.2	120.9	138.9	-126	-179.3	0	0	0	117.4	Y227 S228	Y227-I757 VanDerWaalsContact CB-O 3.24Å; Y227-I757 WeakPolarHBondContact CB-O 3.24Å; Y227-I757 HydrophobicContact CD1-CB 4.01Å; Y227-I757 HydrophobicContact CD1-CD1 4.07Å; Y227-I757 HydrophobicContact CD1-CG1 3.53Å; Y227-I757 HydrophobicContact CD1-CG2 4.04Å; Y227-I757 HydrophobicContact CD2-CD1 3.97Å; Y227-I757 HydrophobicContact CD2-CG1 4.22Å; Y227-I757 HydrophobicContact CD2-CG2 3.8Å; Y227-I757 HydrophobicContact CE1-CB 4.44Å; Y227-I757 HydrophobicContact CE1-CD1 3.72Å; Y227-I757 HydrophobicContact CE1-CG1 3.48Å; Y227-I757 VanDerWaalsContact CE1-CG1 3.48Å; Y227-I757 HydrophobicContact CE2-CD1 3.55Å; Y227-I757 HydrophobicContact CE2-CG1 4.13Å; Y227-I757 HydrophobicContact CE2-CG2 4.44Å; Y227-I757 HydrophobicContact CG-CB 4.11Å; Y227-I757 HydrophobicContact CG-CD1 4.26Å; Y227-I757 HydrophobicContact CG-CG1 3.97Å; Y227-I757 HydrophobicContact CG-CG2 3.61Å; Y227-I757 VanDerWaalsContact CZ-CD1 3.42Å; S228-I757 CarbonylContact C-O 3.33Å; S228-I757 PolarHBondContact N-O 3.38Å
758	G	25.2	Very low	26.7	Very low	65 Å²	65	128.9 Å²	128.9	67%	0.67	65%	0.654	S	S	*	*			trans	-137.9	129.1	174.7	0	0	0	0	0	111
759	Q	26.3	Very low	26.7	Very low	91 Å²	91	129.1 Å²	129.1	43%	0.425	66%	0.657	S	S	.	*			trans	-94	134.4	-149.4	-160.3	163.6	70.9	0	0	117	S226 Y227	S226-Q759 PolarHBondContact O-OE1 3.43Å; S226-Q759 VanDerWaalsContact OG-CD 3.26Å; S226-Q759 PolarHBondContact OG-NE2 2.88Å; S226-Q759 VanDerWaalsContact OG-NE2 3.1Å; S226-Q759 PolarHBondContact OG-OE1 3.03Å; Y227-Q759 HydrophobicContact CD1-CB 3.36Å; Y227-Q759 HydrophobicContact CD1-CG 3.7Å; Y227-Q759 HydrophobicContact CD2-CB 4.3Å; Y227-Q759 HydrophobicContact CD2-CG 4.3Å; Y227-Q759 VanDerWaalsContact CD2-NE2 3.26Å; Y227-Q759 HydrophobicContact CE1-CB 3.99Å; Y227-Q759 HydrophobicContact CE1-CG 3.8Å; Y227-Q759 HydrophobicContact CE2-CG 4.42Å; Y227-Q759 HydrophobicContact CG-CB 3.5Å; Y227-Q759 VanDerWaalsContact CG-CB 3.5Å; Y227-Q759 HydrophobicContact CG-CG 3.93Å
760	S	26.4	Very low	26.6	Very low	90 Å²	90	131 Å²	131	63%	0.629	67%	0.665	S	S	*	*			trans	-6.1	117.9	160.9	-48.7	0	0	0	0	118.9
761	D	28.6	Very low	26.6	Very low	173 Å²	173	127.6 Å²	127.6	93%	0.925	66%	0.661	S	S	*	*			trans	-67.2	148	151	-125.8	-38	0	0	0	111.3
762	R	25.8	Very low	27	Very low	218 Å²	218	128 Å²	128	82%	0.823	67%	0.673	S	S	*	*			trans	-166.2	147.5	-169	-159	179.2	-171.7	-168.8	4.5	112.6
763	K	30	Very low	26.7	Very low	188 Å²	188	128.5 Å²	128.5	82%	0.817	68%	0.681	S	S	*	*			trans	96.3	153.5	177.4	-61.4	162	-175.7	171.5	0	113.2
764	L	27.7	Very low	26.8	Very low	129 Å²	129	128.8 Å²	128.8	68%	0.675	69%	0.688	S	S	*	*			cis	-149.5	-174.4	-7	-111.8	162.5	0	0	0	106.2	L766	L764-L766 HydrophobicContact CD2-CB 3.82Å; L764-L766 HydrophobicContact CD2-CD1 3.94Å; L764-L766 HydrophobicContact CD2-CG 4.24Å
765	I	29.6	Very low	27	Very low	155 Å²	155	129.5 Å²	129.5	80%	0.795	69%	0.694	S	S	*	*			cis	-137.5	138.3	16.4	-63.8	174.5	0	0	0	105.7
766	L	25.6	Very low	27.1	Very low	128 Å²	128	130.4 Å²	130.4	67%	0.67	70%	0.703	S	S	*	*			cis	96	90.5	38.7	-146.6	-174.9	0	0	0	115	L764	L764-L766 HydrophobicContact CD2-CB 3.82Å; L764-L766 HydrophobicContact CD2-CD1 3.94Å; L764-L766 HydrophobicContact CD2-CG 4.24Å
767	S	29.2	Very low	27.2	Very low	114 Å²	114	128.4 Å²	128.4	80%	0.797	72%	0.715	S	S	*	*			trans	-164.6	152.1	161.4	59.9	0	0	0	0	110.9
768	L	26.6	Very low	27.4	Very low	133 Å²	133	132 Å²	132	70%	0.696	73%	0.73	S	S	*	*			cis	-154.7	137.2	-37.6	-150.8	95.3	0	0	0	110.9
769	H	28.4	Very low	27.6	Very low	145 Å²	145	132.6 Å²	132.6	67%	0.671	72%	0.718	S	S	*	*			trans	68.3	112.3	153.3	-81.3	-167.8	0	0	0	125.1
770	K	28.8	Very low	27.8	Very low	157 Å²	157	134.3 Å²	134.3	68%	0.683	73%	0.73	S	S	*	*				90.8	106.1	115.5	-73.6	-170.9	176.7	-172.5	0	124.8
771	T	25.7	Very low	28.1	Very low	127 Å²	127	135.7 Å²	135.7	78%	0.779	73%	0.726	S	S	*	*				76.9	165.1	127	66.2	0	0	0	0	119.2
772	P	32.2	Very low	28.1	Very low	104 Å²	104	133.2 Å²	133.2	68%	0.675	71%	0.712	S	S	*	*				-142.8	-177.5	-87.9	39.8	-17.8	0	0	0	117.9
773	T	23.3	Very low	28.5	Very low	125 Å²	125	127.7 Å²	127.7	77%	0.767	71%	0.705	S	S	*	*			trans	77	147.1	152.9	41	0	0	0	0	122.8
774	T	26.2	Very low	28.6	Very low	129 Å²	129	124.3 Å²	124.3	79%	0.791	70%	0.7	S	S	*	*			trans	75.4	114.3	160.8	46	0	0	0	0	122.8
775	S	25.2	Very low	28.6	Very low	108 Å²	108	125.7 Å²	125.7	76%	0.755	71%	0.706	S	S	*	*			trans	59.1	110.2	140.1	57.9	0	0	0	0	123.7
776	N	27.7	Very low	28.4	Very low	160 Å²	160	123.3 Å²	123.3	86%	0.856	70%	0.703	S	S	*	*			trans	25	125.1	138.5	-58.5	15.1	0	0	0	123.2
777	A	29.2	Very low	28.5	Very low	94 Å²	94	121.3 Å²	121.3	78%	0.777	71%	0.706	S	S	*	*			trans	66.3	149.4	136.3	0	0	0	0	0	120.1
778	E	28.1	Very low	28.3	Very low	138 Å²	138	122.7 Å²	122.7	65%	0.645	71%	0.709	S	S	*	*			cis	-131.4	-132.1	9.3	-157.7	156	-111.4	0	0	112
779	D	29.1	Very low	28.5	Very low	78 Å²	78	119.9 Å²	119.9	42%	0.417	71%	0.712	S	S	.	*			trans	99.3	130.7	156.8	-58.2	149.4	0	0	0	123.6	N792 I793	D779-N792 HydrophobicContact CB-CB 4.08Å; D779-N792 VanDerWaalsContact CB-OD1 3.3Å; D779-N792 WeakPolarHBondContact CB-OD1 3.47Å; D779-N792 VanDerWaalsContact OD1-CG 3.25Å; D779-N792 PolarHBondContact OD1-ND2 3.18Å; D779-N792 PolarHBondContact OD1-OD1 3.4Å; D779-N792 WeakPolarHBondContact OD2-CA 3.42Å; D779-N792 WeakPolarHBondContact OD2-CB 3.23Å; D779-N792 PolarHBondContact OD2-ND2 3.22Å; D779-N792 VanDerWaalsContact OD2-ND2 3.13Å; D779-I793 PolarHBondContact OD2-N 3.28Å
780	N	30.7	Very low	28.5	Very low	128 Å²	128	115.7 Å²	115.7	68%	0.684	70%	0.699	S	S	*	*			trans	-168.6	137.3	168.1	167.1	85.9	0	0	0	113.3	N792	N780-N792 VanDerWaalsContact C-N 3.32Å
781	H	32	Very low	28.8	Very low	119 Å²	119	113 Å²	113	55%	0.551	69%	0.692	S	S	*	*			trans	-158.5	-146.8	172.4	-150.7	71.4	0	0	0	117.1	N791	H781-N791 WeakPolarHBondContact CB-O 3.29Å
782	L	29	Very low	29.1	Very low	120 Å²	120	110.1 Å²	110.1	63%	0.628	67%	0.672	S	S	*	*			trans	-130.4	175.5	-153.6	-107.6	80	0	0	0	115.2	S790	L782-S790 WeakPolarHBondContact O-CB 3.35Å; L782-S790 PolarHBondContact O-OG 3.06Å
783	P	33.8	Very low	28.9	Very low	103 Å²	103	111.9 Å²	111.9	67%	0.669	68%	0.675	S	S	*	*			trans	-96.3	136.8	-135.4	35.6	-39.2	0	0	0	119.9
784	T	32.6	Very low	29.1	Very low	117 Å²	117	108.4 Å²	108.4	72%	0.718	66%	0.664	S	S	*	*				54.2	84	129.4	-40.4	0	0	0	0	119.3
785	I	27.1	Very low	29.3	Very low	157 Å²	157	109.5 Å²	109.5	81%	0.805	66%	0.664	S	S	*	*	S	Bend		-70.6	148.5	124.3	-68.7	176.4	0	0	0	107.6	A787	I785-A787 PolarHBondContact O-N 3.46Å
786	S	25.4	Very low	29.4	Very low	105 Å²	105	110.2 Å²	110.2	73%	0.734	66%	0.664	S	S	*	*	S	Bend	trans	-59	135.4	177	51.5	0	0	0	0	112
787	A	27.5	Very low	29.4	Very low	87 Å²	87	109.9 Å²	109.9	72%	0.719	66%	0.661	S	S	*	*	S	Bend	trans	87.8	90.6	-170.5	0	0	0	0	0	115.8	I785	I785-A787 PolarHBondContact O-N 3.46Å
788	T	25.4	Very low	29.4	Very low	143 Å²	143	112.5 Å²	112.5	88%	0.877	66%	0.66	S	S	*	*	S	Bend	trans	56.1	101.3	145.9	56.2	0	0	0	0	120.4
789	G	31.2	Very low	29.6	Very low	73 Å²	73	110.7 Å²	110.7	75%	0.753	66%	0.66	S	S	*	*			trans	101.6	122.6	145.7	0	0	0	0	0	116.6
790	S	29.3	Very low	29.4	Very low	58 Å²	58	116 Å²	116	41%	0.406	68%	0.68	S	S	.	*			trans	-161.9	159.9	167.3	53.4	0	0	0	0	114.1	L782	L782-S790 WeakPolarHBondContact O-CB 3.35Å; L782-S790 PolarHBondContact O-OG 3.06Å
791	N	34.7	Very low	29.2	Very low	100 Å²	100	115 Å²	115	54%	0.535	68%	0.683	S	S	.	*				176.2	122.4	-77.3	-94.9	51	0	0	0	112.9	H781	H781-N791 WeakPolarHBondContact CB-O 3.29Å
792	N	31.4	Very low	29.2	Very low	66 Å²	66	115 Å²	115	35%	0.353	69%	0.693	S	S	.	*			trans	98.9	137	135.5	-63.7	42.7	0	0	0	125.9	D779 N780	D779-N792 HydrophobicContact CB-CB 4.08Å; D779-N792 VanDerWaalsContact CB-OD1 3.3Å; D779-N792 WeakPolarHBondContact CB-OD1 3.47Å; D779-N792 VanDerWaalsContact OD1-CG 3.25Å; D779-N792 PolarHBondContact OD1-ND2 3.18Å; D779-N792 PolarHBondContact OD1-OD1 3.4Å; D779-N792 WeakPolarHBondContact OD2-CA 3.42Å; D779-N792 WeakPolarHBondContact OD2-CB 3.23Å; D779-N792 PolarHBondContact OD2-ND2 3.22Å; D779-N792 VanDerWaalsContact OD2-ND2 3.13Å; N780-N792 VanDerWaalsContact C-N 3.32Å
793	I	29.1	Very low	29.3	Very low	142 Å²	142	115.6 Å²	115.6	73%	0.728	70%	0.702	S	S	*	*			trans	58.3	160.9	165.8	-115.2	170.8	0	0	0	118.5	D779	D779-I793 PolarHBondContact OD2-N 3.28Å
794	G	27.5	Very low	29	Very low	52 Å²	52	117.1 Å²	117.1	54%	0.536	70%	0.701	S	S	.	*			cis	-178.6	-163.8	0.6	0	0	0	0	0	108.7
795	D	28.7	Very low	28.7	Very low	151 Å²	151	120.3 Å²	120.3	81%	0.807	70%	0.7	S	S	*	*			cis	-165.8	166.7	-6.8	179.1	28	0	0	0	108.7
796	V	27.6	Very low	28.7	Very low	124 Å²	124	119.7 Å²	119.7	75%	0.752	70%	0.698	S	S	*	*			trans	-146.7	133.6	-176.2	175.1	0	0	0	0	114.5
797	I	28.2	Very low	28.8	Very low	153 Å²	153	118.1 Å²	118.1	79%	0.785	70%	0.698	S	S	*	*			trans	-166.4	130	149.1	-110.5	155.4	0	0	0	116.9
798	I	28.4	Very low	28.8	Very low	149 Å²	149	122.7 Å²	122.7	76%	0.764	71%	0.705	S	S	*	*			trans	60.1	134.9	149.8	-60.6	171.6	0	0	0	122.6
799	P	33.4	Very low	28.7	Very low	100 Å²	100	123.7 Å²	123.7	65%	0.649	70%	0.699	S	S	*	*			trans	-116.5	165.5	174.1	42.2	-33.3	0	0	0	116.2
800	F	25.4	Very low	28.7	Very low	190 Å²	190	126.2 Å²	126.2	83%	0.833	70%	0.7	S	S	*	*				167	127.8	125	-101.4	-72.2	0	0	0	114.7
801	S	24.8	Very low	28.4	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	71%	0.711	S	S	*	*			trans	52.5	172	154.5	65.4	0	0	0	0	121
802	P	33.5	Very low	28.1	Very low	118 Å²	118	131 Å²	131	77%	0.766	72%	0.717	S	S	*	*				-121.4	-174.3	-53.2	37.4	-24.6	0	0	0	112.7
803	T	30.5	Very low	27.9	Very low	133 Å²	133	133.1 Å²	133.1	82%	0.816	73%	0.732	S	S	*	*			trans	-70.4	132.8	176.8	48.3	0	0	0	0	114.7
804	E	28	Very low	27.9	Very low	136 Å²	136	133.2 Å²	133.2	64%	0.636	73%	0.729	S	S	*	*				-176.6	147.9	118.1	-89.2	-123.1	105.7	0	0	111.8
805	R	25.9	Very low	28.1	Very low	184 Å²	184	133.6 Å²	133.6	69%	0.694	73%	0.727	S	S	*	*			trans	29.4	138.1	142.5	-77.6	-172.3	-93.5	-176.4	-1.1	120.1
806	N	26.3	Very low	28.2	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	73%	0.727	S	S	*	*			cis	-175.7	152	38.5	-112.4	-12.7	0	0	0	110.5
807	G	28	Very low	28.3	Very low	72 Å²	72	135.8 Å²	135.8	74%	0.742	72%	0.721	S	S	*	*			trans	69.3	163.1	155	0	0	0	0	0	117.6
808	E	27.4	Very low	28.2	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	72%	0.719	S	S	*	*			cis	-151.4	178.9	-16.1	-149.2	162	-162.5	0	0	110
809	Q	24.4	Very low	28.3	Very low	164 Å²	164	134.7 Å²	134.7	77%	0.766	72%	0.72	S	S	*	*			trans	-52.1	153.1	178.1	-61.8	155.9	1.6	0	0	111.2
810	V	30.5	Very low	28.1	Very low	125 Å²	125	134.2 Å²	134.2	76%	0.758	72%	0.719	S	S	*	*				-160.2	129.8	66.7	151.4	0	0	0	0	106.2
811	N	23.5	Very low	28.2	Very low	121 Å²	121	133 Å²	133	65%	0.647	72%	0.716	S	S	*	*				52	150.5	81.4	-84.4	27.6	0	0	0	111.8
812	E	27.5	Very low	28.4	Very low	139 Å²	139	133.6 Å²	133.6	65%	0.65	71%	0.711	S	S	*	*			cis	-168.8	171.3	14.8	-138.8	164.2	-114.8	0	0	109
813	T	28.1	Very low	28.1	Very low	109 Å²	109	135.6 Å²	135.6	67%	0.669	72%	0.715	S	S	*	*			trans	63.6	158.5	148.1	61.9	0	0	0	0	119.1
814	E	28.9	Very low	27.7	Very low	144 Å²	144	134.5 Å²	134.5	67%	0.673	71%	0.712	S	S	*	*			cis	-162	175.6	-10.4	-118.3	-173	178.2	0	0	108.4	R817	E814-R817 IonicContact OE1-CZ 2.69Å; E814-R817 IonicContact OE1-NH2 3.01Å; E814-R817 PolarHBondContact OE1-NH2 3.43Å; E814-R817 IonicContact OE2-CZ 3.82Å; E814-R817 IonicContact OE2-NH1 2.67Å; E814-R817 IonicContact OE2-NH2 2.65Å; E814-R817 PolarHBondContact OE2-NH2 2.84Å
815	A	31.3	Very low	27.6	Very low	61 Å²	61	133.6 Å²	133.6	50%	0.504	72%	0.722	S	S	.	*			cis	-152.9	-176.9	-5.7	0	0	0	0	0	105.9
816	I	31.3	Very low	27.6	Very low	155 Å²	155	128.8 Å²	128.8	80%	0.795	72%	0.721	S	S	*	*			cis	-164.1	151	44.4	-74.2	-179.6	0	0	0	108.1
817	R	29	Very low	27.7	Very low	166 Å²	166	129.5 Å²	129.5	63%	0.626	72%	0.723	S	S	*	*			cis	161.9	126.7	-25.4	177.9	177.6	-88	140.8	-8.4	105.4	E814	E814-R817 IonicContact OE1-CZ 2.69Å; E814-R817 IonicContact OE1-NH2 3.01Å; E814-R817 PolarHBondContact OE1-NH2 3.43Å; E814-R817 IonicContact OE2-CZ 3.82Å; E814-R817 IonicContact OE2-NH1 2.67Å; E814-R817 IonicContact OE2-NH2 2.65Å; E814-R817 PolarHBondContact OE2-NH2 2.84Å
818	C	26.7	Very low	27.5	Very low	111 Å²	111	132 Å²	132	75%	0.75	72%	0.719	S	S	*	*			cis	-165.4	-141.8	-9.7	-168.2	0	0	0	0	107.6
819	H	29.2	Very low	27.6	Very low	168 Å²	168	130.2 Å²	130.2	78%	0.778	71%	0.711	S	S	*	*			trans	91.8	132.5	167.3	-56.8	-81.8	0	0	0	119
820	S	29.3	Very low	27.7	Very low	89 Å²	89	128.4 Å²	128.4	62%	0.622	71%	0.707	S	S	*	*			cis	-168.9	143.7	-19.6	46.3	0	0	0	0	113.8
821	Q	28.9	Very low	27.6	Very low	165 Å²	165	127.5 Å²	127.5	77%	0.771	71%	0.705	S	S	*	*			trans	78.1	121.4	142.4	-80.6	-176.1	-9.4	0	0	123.1
822	N	28.2	Very low	27.8	Very low	119 Å²	119	127.6 Å²	127.6	64%	0.636	71%	0.71	S	S	*	*				99.9	116.7	125.5	-67.2	-1.3	0	0	0	122.8
823	N	26.9	Very low	27.7	Very low	159 Å²	159	128.8 Å²	128.8	85%	0.85	72%	0.716	S	S	*	*			trans	83.7	155	135.2	-63.7	0	0	0	0	120.8
824	S	22.6	Very low	27.7	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	72%	0.716	S	S	*	*			trans	-113.7	143.1	-167.9	49.2	0	0	0	0	112.5
825	S	25.7	Very low	27.4	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	72%	0.717	S	S	*	*				174.5	145.7	129.5	41.3	0	0	0	0	113.4
826	A	27	Very low	27.2	Very low	83 Å²	83	131.6 Å²	131.6	69%	0.686	73%	0.726	S	S	*	*			trans	42.4	120.9	144.1	0	0	0	0	0	123
827	I	26.6	Very low	26.9	Very low	158 Å²	158	131.2 Å²	131.2	81%	0.81	73%	0.725	S	S	*	*				81.2	126.1	126.9	-66.4	171.8	0	0	0	120.1
828	D	25.1	Very low	26.7	Very low	124 Å²	124	126.2 Å²	126.2	66%	0.663	72%	0.72	S	S	*	*			trans	67.2	128.9	152.7	-82.3	28	0	0	0	126.2
829	Q	28.6	Very low	26.6	Very low	147 Å²	147	126.5 Å²	126.5	69%	0.687	72%	0.718	S	S	*	*			trans	80.4	142.2	133.1	-74.3	179.1	50.5	0	0	122.5
830	N	27.3	Very low	26.6	Very low	125 Å²	125	125.7 Å²	125.7	67%	0.668	71%	0.713	S	S	*	*			trans	68.4	112	157.6	-57.4	-27.2	0	0	0	116.5
831	C	27.1	Very low	26.7	Very low	106 Å²	106	129.7 Å²	129.7	72%	0.716	72%	0.715	S	S	*	*				92.7	157.6	63.3	-78.5	0	0	0	0	112.4
832	T	28	Very low	26.8	Very low	123 Å²	123	129.6 Å²	129.6	76%	0.755	71%	0.712	S	S	*	*			trans	68.1	146.5	-178.1	72.2	0	0	0	0	115.4
833	E	26.7	Very low	26.9	Very low	165 Å²	165	131 Å²	131	77%	0.771	72%	0.719	S	S	*	*			cis	-162.6	168.4	-32.6	-122	151.9	-155.5	0	0	110
834	D	26.7	Very low	26.8	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	71%	0.71	S	S	*	*			trans	51.3	105.6	149.8	-76.6	19	0	0	0	123.6
835	L	24.2	Very low	27.3	Very low	135 Å²	135	131.3 Å²	131.3	71%	0.707	72%	0.715	S	S	*	*				61.8	112.9	115.8	-88	75.6	0	0	0	120.5
836	T	25.5	Very low	27.2	Very low	111 Å²	111	129.9 Å²	129.9	68%	0.681	70%	0.704	S	S	*	*				89.9	134.2	127.3	66.6	0	0	0	0	121.7
837	N	24.8	Very low	27.2	Very low	147 Å²	147	135.1 Å²	135.1	79%	0.786	71%	0.711	S	S	*	*			trans	71.9	94.2	133.3	-71.6	-19.7	0	0	0	121
838	A	24.8	Very low	27.4	Very low	62 Å²	62	137.1 Å²	137.1	51%	0.512	71%	0.714	S	S	.	*				117.3	140.8	78	0	0	0	0	0	117.1
839	T	25.7	Very low	27.3	Very low	117 Å²	117	138.2 Å²	138.2	72%	0.718	72%	0.719	S	S	*	*			trans	65.2	150.4	150.2	60.3	0	0	0	0	118
840	K	29.9	Very low	27.2	Very low	151 Å²	151	137.7 Å²	137.7	66%	0.657	72%	0.721	S	S	*	*				160.4	148.7	120.9	-84.7	150.7	-171.9	157.2	0	110.2
841	Y	30.2	Very low	27.3	Very low	173 Å²	173	140 Å²	140	68%	0.678	73%	0.725	S	S	*	*			cis	-162.6	163.1	8.5	-125.6	-32.4	0	0	0	113
842	K	31.8	Very low	27.2	Very low	163 Å²	163	140.3 Å²	140.3	71%	0.709	72%	0.724	S	S	*	*			trans	76.2	142.2	144.4	-73.2	166.9	-173.3	177.5	0	118.1
843	L	30.3	Very low	26.9	Very low	148 Å²	148	140.6 Å²	140.6	78%	0.775	73%	0.725	S	S	*	*			cis	-143	133.8	-9.3	-83.6	131.7	0	0	0	106.8
844	Q	24.6	Very low	27	Very low	142 Å²	142	140.1 Å²	140.1	66%	0.664	73%	0.726	S	S	*	*				44	137.8	80.8	-88.7	-138.5	-4.2	0	0	117.6	C846	Q844-C846 PolarHBondContact NE2-SG 3.15Å
845	P	33.3	Very low	27.1	Very low	133 Å²	133	138.3 Å²	138.3	86%	0.864	72%	0.723	S	S	*	*				-134.5	127.3	109.3	36	-27.4	0	0	0	115.1
846	C	22.4	Very low	27.1	Very low	89 Å²	89	138.6 Å²	138.6	60%	0.601	72%	0.724	S	S	*	*			trans	-91.1	143.4	158.5	-74.8	0	0	0	0	112	Q844	Q844-C846 PolarHBondContact NE2-SG 3.15Å
847	K	28.2	Very low	27.3	Very low	192 Å²	192	142.6 Å²	142.6	84%	0.835	73%	0.732	S	S	*	*			trans	-178.9	139.7	156	-95.7	144.1	-173.9	177.9	0	106.5
848	K	29.6	Very low	27.5	Very low	200 Å²	200	139.6 Å²	139.6	87%	0.87	72%	0.723	S	S	*	*			cis	-118.2	152.8	15.2	-54.4	159	-173.5	170.1	0	108.9
849	L	23.9	Very low	27.8	Very low	147 Å²	147	145.4 Å²	145.4	77%	0.77	74%	0.739	S	S	*	*			cis	70.5	83.2	31	-82.3	170.2	0	0	0	116.9
850	N	26.3	Very low	28	Very low	136 Å²	136	144.4 Å²	144.4	73%	0.727	74%	0.742	S	S	*	*			trans	-149.3	122.1	130	-103.1	-22	0	0	0	106.4
851	K	29.1	Very low	28.1	Very low	173 Å²	173	140 Å²	140	75%	0.752	74%	0.739	S	S	*	*				69.5	131.1	93.7	-73.1	-172.4	-168.3	178.9	0	113.9
852	T	24.6	Very low	28.1	Very low	113 Å²	113	138 Å²	138	69%	0.693	74%	0.741	S	S	*	*			cis	159.6	132.2	-16.8	25.4	0	0	0	0	106
853	V	23.1	Very low	27.8	Very low	130 Å²	130	141.2 Å²	141.2	79%	0.788	75%	0.749	S	S	*	*			trans	71.7	159.4	148.9	-177.7	0	0	0	0	116.8
854	I	29.1	Very low	28.1	Very low	154 Å²	154	138.3 Å²	138.3	79%	0.79	74%	0.738	S	S	*	*			trans	74.3	130.3	-179.4	-44.9	-175.6	0	0	0	112.5
855	S	27.9	Very low	28.4	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	75%	0.745	S	S	*	*			cis	-148.5	143.1	-6	-110.7	0	0	0	0	108.1
856	I	24.9	Very low	28	Very low	141 Å²	141	142.8 Å²	142.8	72%	0.723	75%	0.747	S	S	*	*				65.7	121.7	79.5	-59.8	173.5	0	0	0	114.7
857	K	29.5	Very low	28.8	Very low	195 Å²	195	143.1 Å²	143.1	85%	0.848	75%	0.748	S	S	*	*			trans	74.3	144.6	168.7	-72.6	169.2	-179.1	-176.7	0	118
858	S	28.5	Very low	28.7	Very low	84 Å²	84	140.9 Å²	140.9	59%	0.587	75%	0.745	S	S	*	*			cis	-175	149.6	-14.6	48.6	0	0	0	0	113.6
859	H	30.7	Very low	28.6	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.856	74%	0.736	S	S	*	*			trans	67.4	146.7	167.9	-57.4	-73.3	0	0	0	117.5
860	A	30.6	Very low	28.7	Very low	95 Å²	95	137.9 Å²	137.9	79%	0.785	74%	0.741	S	S	*	*			cis	-163.4	131.4	-24.6	0	0	0	0	0	106.7
861	G	31.5	Very low	29.4	Very low	58 Å²	58	136.5 Å²	136.5	60%	0.598	74%	0.739	S	S	*	*				90.5	137.1	92.4	0	0	0	0	0	111.4
862	D	31.2	Very low	29.3	Very low	133 Å²	133	136.2 Å²	136.2	71%	0.711	74%	0.744	S	S	*	*			cis	-157.8	129.5	3	-69.6	-48.6	0	0	0	107.3
863	W	25.1	Very low	29.3	Very low	230 Å²	230	137.8 Å²	137.8	87%	0.871	75%	0.748	S	S	*	*				67.7	150.8	86	-83.5	57	0	0	0	116.9
864	P	35.7	Very low	29.6	Very low	86 Å²	86	140.1 Å²	140.1	56%	0.558	75%	0.747	S	S	*	*			cis	-150.6	165.5	-25.7	41.2	-21.9	0	0	0	119
865	T	30.8	Very low	29.6	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	75%	0.746	S	S	*	*			trans	61.3	169.9	145.6	50.6	0	0	0	0	123
866	R	25.9	Very low	29.5	Very low	237 Å²	237	140.6 Å²	140.6	89%	0.894	75%	0.748	S	S	*	*				-173.5	179	-52.1	-118.3	-157.3	164.1	-164.8	-4.9	109.9
867	P	38.8	Very low	29.6	Very low	97 Å²	97	139.8 Å²	139.8	63%	0.63	75%	0.745	S	S	*	*			trans	-132.9	-153.5	-137.7	34.2	-7.7	0	0	0	117.2
868	N	26.9	Very low	29.6	Very low	145 Å²	145	137.6 Å²	137.6	78%	0.775	74%	0.737	S	S	*	*			trans	92.1	155.9	162.9	-64.2	13.6	0	0	0	119.2
869	S	25.7	Very low	29.5	Very low	95 Å²	95	140.2 Å²	140.2	66%	0.664	75%	0.745	S	S	*	*			cis	-175.5	148.2	-25.4	54.7	0	0	0	0	114.2
870	E	26.6	Very low	29.3	Very low	189 Å²	189	136 Å²	136	88%	0.883	74%	0.736	S	S	*	*			trans	66.2	163	149.7	-70.5	-163.6	125.9	0	0	125.9
871	P	40.7	Very low	29.1	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	73%	0.732	S	S	*	*			trans	-132.8	-178.9	-168.7	44.2	-27.2	0	0	0	117.5
872	I	27.1	Very low	28.8	Very low	168 Å²	168	141.2 Å²	141.2	86%	0.862	74%	0.74	S	S	*	*			trans	173.7	168.5	141.3	-91.5	159.6	0	0	0	114.5
873	L	26	Very low	28.6	Very low	146 Å²	146	142.7 Å²	142.7	76%	0.764	74%	0.74	S	S	*	*			trans	-81.8	165.5	-168.9	-58.6	143.7	0	0	0	114.8
874	K	29	Very low	28.6	Very low	178 Å²	178	139.7 Å²	139.7	77%	0.774	74%	0.736	S	S	*	*				170.9	144.8	60.8	-146.7	161	-174.4	177.5	0	113.2
875	L	27.7	Very low	28.4	Very low	146 Å²	146	144 Å²	144	76%	0.764	75%	0.753	S	S	*	*			trans	24.2	149.7	151.1	-79.2	72.9	0	0	0	122.5
876	T	26.9	Very low	28.3	Very low	106 Å²	106	144.5 Å²	144.5	65%	0.65	75%	0.75	S	S	*	*			cis	-167.4	154.5	11.5	5.7	0	0	0	0	113.5
877	N	26.8	Very low	28.3	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	74%	0.736	S	S	*	*			trans	35.7	147.3	147.6	-55.2	5.6	0	0	0	122.6
878	H	29	Very low	27.9	Very low	149 Å²	149	139.2 Å²	139.2	69%	0.69	74%	0.741	S	S	*	*			cis	-160.6	156.4	30.9	-103.2	-60.6	0	0	0	113.1
879	N	27.2	Very low	28.1	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	74%	0.74	S	S	*	*			trans	38.4	147.8	140.4	-53.8	12.9	0	0	0	122.3
880	S	25.8	Very low	28.3	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	74%	0.742	S	S	*	*			cis	-177.1	163.7	-11.5	50.1	0	0	0	0	111.3
881	S	26	Very low	28.3	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	73%	0.732	S	S	*	*			trans	63.8	148.1	162.1	55.5	0	0	0	0	119.1
882	E	25.7	Very low	27.9	Very low	163 Å²	163	141.1 Å²	141.1	76%	0.762	73%	0.733	S	S	*	*			cis	-165.2	177.7	-8.3	-115.5	174.7	-179.6	0	0	111.8
883	F	26.9	Very low	27.9	Very low	164 Å²	164	142.6 Å²	142.6	72%	0.719	73%	0.729	S	S	*	*			trans	73.9	95.1	165.9	-71.5	-71.1	0	0	0	122.7
884	E	24.2	Very low	28.1	Very low	166 Å²	166	144.8 Å²	144.8	78%	0.776	73%	0.733	S	S	*	*				29.4	134.4	121.1	-56.3	-178.9	138.3	0	0	122.6
885	I	31.9	Very low	28.1	Very low	178 Å²	178	140.1 Å²	140.1	91%	0.913	73%	0.727	S	S	*	*				-165.8	160.5	122.7	-101.7	161.2	0	0	0	110.8
886	D	28.4	Very low	28.4	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	73%	0.731	S	S	*	*			trans	-78.9	141.2	-157.2	-110.7	-52.2	0	0	0	119.7
887	S	27.6	Very low	28.6	Very low	86 Å²	86	142.4 Å²	142.4	60%	0.601	73%	0.731	S	S	*	*				23.7	130.2	129.1	-49	0	0	0	0	123
888	N	28.9	Very low	28.5	Very low	138 Å²	138	146 Å²	146	74%	0.738	74%	0.736	S	S	*	*			trans	119.5	119.6	139.3	-76	-72.4	0	0	0	121.6
889	K	32.1	Very low	28.5	Very low	172 Å²	172	146 Å²	146	75%	0.748	74%	0.737	S	S	*	*			trans	89.1	110.5	133.2	-71.2	173.4	-177.8	175.4	0	124.5
890	I	29	Very low	28.6	Very low	140 Å²	140	146 Å²	146	72%	0.718	74%	0.737	S	S	*	*				74.8	94.4	121.4	-58.5	170.7	0	0	0	120.5
891	N	28	Very low	28.5	Very low	125 Å²	125	149.1 Å²	149.1	67%	0.668	75%	0.745	S	S	*	*				52.3	120	116.3	-67.1	-1.2	0	0	0	125.8
892	I	31.4	Very low	28.5	Very low	138 Å²	138	148.8 Å²	148.8	71%	0.708	74%	0.743	S	S	*	*				76.7	166.5	120.9	-62	168.8	0	0	0	119.4
893	Y	26.9	Very low	28.5	Very low	198 Å²	198	148.2 Å²	148.2	78%	0.776	75%	0.745	S	S	*	*			trans	112.2	158.8	165.6	-68.3	-72.5	0	0	0	115.5
894	K	30.5	Very low	28.3	Very low	193 Å²	193	145.2 Å²	145.2	84%	0.839	74%	0.744	S	S	*	*			cis	-159.3	-177.4	29.3	-132.2	136.1	-172.5	171	0	109.7
895	A	30	Very low	28.4	Very low	80 Å²	80	143.1 Å²	143.1	66%	0.661	74%	0.743	S	S	*	*			cis	-153.7	160.2	5.1	0	0	0	0	0	109.2
896	K	33.8	Very low	28.1	Very low	193 Å²	193	140.2 Å²	140.2	84%	0.839	73%	0.733	S	S	*	*				160.8	158.9	95.2	-109.5	-177.6	179.8	177.9	0	108.1
897	T	29.3	Very low	28	Very low	107 Å²	107	139.7 Å²	139.7	66%	0.656	73%	0.731	S	S	*	*			cis	-154.8	179.1	-13.2	-18.4	0	0	0	0	108.3
898	Y	26.4	Very low	27.8	Very low	199 Å²	199	142.4 Å²	142.4	78%	0.78	74%	0.738	S	S	*	*			trans	69.8	117.3	-177.1	-66.3	-83.5	0	0	0	113.2
899	Q	29.2	Very low	27.7	Very low	151 Å²	151	142.5 Å²	142.5	71%	0.706	73%	0.734	S	S	*	*				64.8	129.3	76.1	-68.2	-172.2	-16	0	0	112.5
900	N	28.1	Very low	27.3	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	72%	0.724	S	S	*	*			cis	-152.4	175.4	-1	-107.4	-11	0	0	0	110.3
901	L	24.3	Very low	27.4	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	72%	0.724	S	S	*	*			trans	-73.3	141.9	166.1	-56.5	81.6	0	0	0	109.8
902	S	25	Very low	27.3	Very low	93 Å²	93	141.3 Å²	141.3	65%	0.65	72%	0.716	S	S	*	*				179.8	168.2	107.7	70.5	0	0	0	0	113.1
903	D	27.5	Very low	27.1	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	72%	0.715	S	S	*	*			trans	65.2	149.2	149.8	-52.4	-40.2	0	0	0	122.6
904	S	22.5	Very low	27.1	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	71%	0.71	S	S	*	*			trans	-113.9	-169.7	-173.8	55.6	0	0	0	0	110.7
905	T	24.9	Very low	27.5	Very low	122 Å²	122	136.3 Å²	136.3	75%	0.748	71%	0.709	S	S	*	*			trans	89.5	122.6	164.2	71.3	0	0	0	0	119.8
906	V	25.7	Very low	27.4	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.715	71%	0.713	S	S	*	*				65.9	86.6	126.8	-178.7	0	0	0	0	118.1
907	N	26.7	Very low	27.3	Very low	130 Å²	130	133 Å²	133	70%	0.695	71%	0.705	S	S	*	*				176.1	138.3	97.6	-96.8	-28.1	0	0	0	108.9
908	N	24.1	Very low	27.4	Very low	142 Å²	142	135 Å²	135	76%	0.759	71%	0.712	S	S	*	*			cis	75.1	142.9	28.5	-148.1	17.3	0	0	0	114.5
909	Q	25.6	Very low	27.5	Very low	141 Å²	141	129.5 Å²	129.5	66%	0.659	71%	0.707	S	S	*	*			trans	69.2	112.3	-173.9	-58.4	-165.5	-92.8	0	0	115.2
910	E	25.5	Very low	27.5	Very low	114 Å²	114	131.7 Å²	131.7	53%	0.533	71%	0.714	S	S	.	*				67.1	117.9	84.7	-66.8	-174	92.8	0	0	114	K912	E910-K912 IonicContact OE1-NZ 2.66Å; E910-K912 PolarHBondContact OE1-NZ 3.15Å
911	Y	29.3	Very low	27.6	Very low	181 Å²	181	132.3 Å²	132.3	71%	0.71	72%	0.717	S	S	*	*				-165.3	129.2	91.3	-109.2	-113.3	0	0	0	105.8
912	K	27.2	Very low	28	Very low	116 Å²	116	129.3 Å²	129.3	50%	0.504	71%	0.71	S	S	.	*				59.2	135.7	81.2	-71.1	161.9	171.5	158.6	0	111.3	E910	E910-K912 IonicContact OE1-NZ 2.66Å; E910-K912 PolarHBondContact OE1-NZ 3.15Å
913	N	26.7	Very low	28.2	Very low	127 Å²	127	129.3 Å²	129.3	68%	0.679	71%	0.71	S	S	*	*			cis	-175.4	176.9	17.9	-125.9	-3.2	0	0	0	112.2
914	I	27.8	Very low	28.2	Very low	133 Å²	133	129.1 Å²	129.1	68%	0.682	71%	0.709	S	S	*	*			trans	66.9	116.6	152.3	-66.3	155.7	0	0	0	115.2
915	M	37.9	Very low	28.3	Very low	165 Å²	165	130.6 Å²	130.6	81%	0.813	72%	0.717	S	S	*	*			cis	-139.8	131.4	44.4	-79	-168.6	173	0	0	111.5
916	T	29	Very low	28.3	Very low	121 Å²	121	131 Å²	131	74%	0.742	72%	0.72	S	S	*	*				59.6	135.6	75.2	61.7	0	0	0	0	115.7
917	A	29.9	Very low	28.3	Very low	81 Å²	81	132 Å²	132	67%	0.669	73%	0.726	S	S	*	*			cis	-165.5	175.1	-13.8	0	0	0	0	0	107.3
918	N	32.4	Very low	28.2	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	73%	0.73	S	S	*	*			cis	-136	165.6	13.4	-73.6	-71.7	0	0	0	108.8
919	A	27.5	Very low	28.2	Very low	82 Å²	82	133.7 Å²	133.7	68%	0.678	73%	0.73	S	S	*	*			cis	92.1	97	21.1	0	0	0	0	0	116.8
920	F	30.5	Very low	28.2	Very low	197 Å²	197	133 Å²	133	86%	0.864	73%	0.731	S	S	*	*			trans	-156.6	107.6	146.3	-119.4	-78.4	0	0	0	110.9
921	L	30.5	Very low	28.2	Very low	149 Å²	149	133.4 Å²	133.4	78%	0.78	74%	0.741	S	S	*	*			trans	35.2	138.4	151.2	-53.2	179.3	0	0	0	121.3
922	S	32.2	Very low	28.2	Very low	101 Å²	101	130 Å²	130	71%	0.706	74%	0.744	S	S	*	*			cis	178.6	155.1	-4.1	45.3	0	0	0	0	109.9
923	S	29.8	Very low	28.3	Very low	92 Å²	92	129 Å²	129	64%	0.643	76%	0.757	S	S	*	*			cis	-177.5	146.4	-18.9	53.4	0	0	0	0	110.9
924	N	27.2	Very low	28.6	Very low	147 Å²	147	128 Å²	128	79%	0.786	76%	0.759	S	S	*	*			trans	74.8	140.7	160.2	-48.6	-16.2	0	0	0	117.4
925	C	23.7	Very low	28.7	Very low	132 Å²	132	132.3 Å²	132.3	89%	0.892	77%	0.767	S	S	*	*			cis	80.9	153.2	16	-58.2	0	0	0	0	118.2
926	T	24.7	Very low	27.9	Very low	132 Å²	132	131.6 Å²	131.6	81%	0.81	77%	0.766	S	S	*	*			trans	-91.5	162.1	-166.5	46.9	0	0	0	0	114.5
927	V	26.6	Very low	27.8	Very low	137 Å²	137	133.7 Å²	133.7	83%	0.83	77%	0.765	S	S	*	*				174.5	168.8	128.5	151.7	0	0	0	0	109.8
928	E	23.5	Very low	27.9	Very low	168 Å²	168	137.8 Å²	137.8	79%	0.785	78%	0.775	S	S	*	*			trans	-87.8	177.9	-160.6	-57.6	164.7	125.3	0	0	116
929	D	25.4	Very low	27.6	Very low	140 Å²	140	134.9 Å²	134.9	75%	0.749	76%	0.764	S	S	*	*			trans	59.5	125.5	160	-80.7	16.2	0	0	0	118.6
930	N	25.5	Very low	27.6	Very low	128 Å²	128	139.6 Å²	139.6	68%	0.684	77%	0.769	S	S	*	*			cis	-175.5	162.3	28.3	-131.6	-49.6	0	0	0	112.1
931	V	25.2	Very low	27.3	Very low	122 Å²	122	139.3 Å²	139.3	74%	0.739	77%	0.771	S	S	*	*			trans	56.1	90.7	160	-172.2	0	0	0	0	118.6
932	S	28.6	Very low	27	Very low	110 Å²	110	139 Å²	139	77%	0.769	77%	0.769	S	S	*	*				178.5	132.6	111.8	-78.4	0	0	0	0	114
933	A	29.7	Very low	26.6	Very low	94 Å²	94	141.6 Å²	141.6	78%	0.777	77%	0.77	S	S	*	*			trans	30.2	122	150.6	0	0	0	0	0	120.2
934	S	33.3	Very low	26.6	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	77%	0.774	S	S	*	*			cis	-161.2	140.1	9.1	-68.9	0	0	0	0	113.7
935	R	29.4	Very low	26.4	Very low	224 Å²	224	141.1 Å²	141.1	85%	0.845	77%	0.765	S	S	*	*			trans	50.4	117.3	152.5	-61	175.8	-179.6	159.9	0.9	118.3
936	L	22.4	Very low	26.5	Very low	149 Å²	149	141.5 Å²	141.5	78%	0.78	76%	0.758	S	S	*	*			cis	67.8	144.3	44.8	-61.8	167.9	0	0	0	116.8
937	F	26	Very low	26.7	Very low	165 Å²	165	143.1 Å²	143.1	72%	0.724	76%	0.757	S	S	*	*			trans	94.2	107.5	157.7	-63.1	-69.5	0	0	0	120.5
938	L	31.5	Very low	26.7	Very low	168 Å²	168	145.5 Å²	145.5	88%	0.88	75%	0.751	S	S	*	*				-65.4	141.8	112.1	-92.6	86	0	0	0	107.7
939	P	27.5	Very low	26.6	Very low	90 Å²	90	149.2 Å²	149.2	58%	0.584	76%	0.757	S	S	*	*				-154.9	-170.2	87.4	40.4	-20.7	0	0	0	115
940	K	25.8	Very low	26.7	Very low	180 Å²	180	150.4 Å²	150.4	78%	0.783	76%	0.756	S	S	*	*			trans	77.1	117.9	170.4	-58.4	169	-175	-178.3	0	113.2
941	E	24.5	Very low	26.8	Very low	191 Å²	191	149.7 Å²	149.7	89%	0.893	76%	0.761	S	S	*	*			cis	63	85.6	20	-149.9	-178	-114.6	0	0	113.7
942	L	25.7	Very low	26.7	Very low	142 Å²	142	151.7 Å²	151.7	74%	0.743	76%	0.762	S	S	*	*			trans	-152.1	111.8	155.2	-94.4	151.1	0	0	0	103.8
943	H	23.4	Very low	26.5	Very low	157 Å²	157	153.8 Å²	153.8	73%	0.727	76%	0.76	S	S	*	*				56.6	118.3	103.3	-79	-77.1	0	0	0	112.8
944	I	28.9	Very low	26.4	Very low	144 Å²	144	160.1 Å²	160.1	74%	0.738	76%	0.764	S	S	*	*			cis	-152.1	135.1	34.1	-95.7	136	0	0	0	107.8
945	S	23.7	Very low	26.2	Very low	84 Å²	84	161.8 Å²	161.8	59%	0.587	76%	0.764	S	S	*	*				57.4	136.4	83.4	-91.1	0	0	0	0	113.5
946	D	24.5	Very low	26	Very low	141 Å²	141	156.9 Å²	156.9	75%	0.754	76%	0.759	S	S	*	*			cis	-145.2	-169.6	1.4	-84.2	-43.9	0	0	0	109.8
947	E	29.2	Very low	26.3	Very low	166 Å²	166	153.8 Å²	153.8	78%	0.776	76%	0.755	S	S	*	*			trans	79.7	122.3	167.3	-56.6	-137.3	118	0	0	117.3
948	W	26.1	Very low	26.3	Very low	187 Å²	187	150.6 Å²	150.6	71%	0.708	75%	0.753	S	S	*	*			cis	-135.6	136.3	-2.4	-122.6	53.9	0	0	0	112.5	K950	W948-K950 HydrophobicContact CE3-CB 3.88Å; W948-K950 HydrophobicContact CZ3-CB 3.87Å
949	R	22.5	Very low	26	Very low	245 Å²	245	149.5 Å²	149.5	93%	0.925	75%	0.748	S	S	*	*			trans	-124.1	87.5	165.4	-178.7	-174.8	179.2	170.7	1.9	109.3
950	K	27.6	Very low	26.1	Very low	166 Å²	166	151.1 Å²	151.1	72%	0.722	76%	0.756	S	S	*	*			trans	-173.5	148.2	168.3	-92.2	133.4	-174.7	-179.8	0	106.9	W948	W948-K950 HydrophobicContact CE3-CB 3.88Å; W948-K950 HydrophobicContact CZ3-CB 3.87Å
951	S	26.7	Very low	26.2	Very low	113 Å²	113	147 Å²	147	79%	0.79	75%	0.75	S	S	*	*			cis	-153.9	148.5	-4.3	45.7	0	0	0	0	109.8
952	E	23.7	Very low	26.4	Very low	163 Å²	163	144.5 Å²	144.5	76%	0.762	74%	0.743	S	S	*	*			trans	-101.2	162.4	177.4	-162.1	-170.2	-120.1	0	0	111
953	Q	24.2	Very low	26.3	Very low	154 Å²	154	145.4 Å²	145.4	72%	0.72	75%	0.745	S	S	*	*			trans	78.6	158.8	165.2	-48	-176.5	4.2	0	0	119
954	R	28.5	Very low	26.5	Very low	227 Å²	227	142.7 Å²	142.7	86%	0.857	74%	0.744	S	S	*	*			trans	79.9	128.5	175.6	-59	-174.2	-174	-140.8	-2	115.5
955	L	28.6	Very low	26.2	Very low	142 Å²	142	141.2 Å²	141.2	74%	0.743	75%	0.746	S	S	*	*			cis	-148.1	134.9	-0	-100.1	152.2	0	0	0	112.2
956	T	25.8	Very low	26.8	Very low	121 Å²	121	142.5 Å²	142.5	74%	0.742	75%	0.753	S	S	*	*			trans	4.9	156.8	142.3	60.3	0	0	0	0	123.1
957	A	28.4	Very low	26.9	Very low	84 Å²	84	142.8 Å²	142.8	69%	0.694	75%	0.753	S	S	*	*			trans	108.6	89.3	138.6	0	0	0	0	0	120.2
958	S	25.3	Very low	26.7	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	75%	0.75	S	S	*	*				56.1	134.1	119.6	68.6	0	0	0	0	124.1
959	N	26	Very low	26.8	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	74%	0.744	S	S	*	*			trans	95.5	146.3	136.5	-69.4	-8.5	0	0	0	123.2
960	T	28.9	Very low	26.9	Very low	124 Å²	124	134.3 Å²	134.3	76%	0.761	73%	0.732	S	S	*	*			trans	72.5	86.4	154	40.3	0	0	0	0	121.7
961	S	27.5	Very low	26.8	Very low	94 Å²	94	132.6 Å²	132.6	66%	0.657	73%	0.731	S	S	*	*				69.2	131.2	115.5	67.4	0	0	0	0	123.7
962	N	28.3	Very low	27	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	73%	0.731	S	S	*	*			trans	89.9	107.7	138	-71.5	-7.6	0	0	0	122.8
963	M	24.5	Very low	27.1	Very low	160 Å²	160	132.9 Å²	132.9	79%	0.788	74%	0.736	S	S	*	*			trans	91.2	116.5	132.7	-61.4	-62.4	157.8	0	0	122.4
964	S	26.7	Very low	27.3	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	74%	0.736	S	S	*	*			trans	59.1	96.4	144.9	56	0	0	0	0	121.6
965	S	24.5	Very low	27.4	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	74%	0.735	S	S	*	*				35.3	151	112.4	-49.7	0	0	0	0	122.1
966	P	36.2	Very low	27.5	Very low	111 Å²	111	123.1 Å²	123.1	72%	0.721	74%	0.737	S	S	*	*			cis	-144.6	-167.1	-25.7	35.2	-12.1	0	0	0	115.2
967	I	25.9	Very low	27.7	Very low	148 Å²	148	121.2 Å²	121.2	76%	0.759	73%	0.725	S	S	*	*			trans	105.6	95.2	154.6	-65.2	165.8	0	0	0	120.2
968	H	25.5	Very low	28.2	Very low	154 Å²	154	120.5 Å²	120.5	71%	0.713	71%	0.712	S	S	*	*			trans	76.9	134	132	-87.9	-78.6	0	0	0	127.3
969	N	27.2	Very low	28.5	Very low	109 Å²	109	121.5 Å²	121.5	58%	0.583	72%	0.716	S	S	*	*			trans	85.8	139.4	140.8	-68.7	-13	0	0	0	121.3
970	F	24.2	Very low	29.1	Very low	156 Å²	156	122 Å²	122	68%	0.684	72%	0.716	S	S	*	*			cis	-161.9	153	-7.7	-125.1	-37.6	0	0	0	113.8
971	N	26.5	Very low	29.5	Very low	131 Å²	131	120.3 Å²	120.3	70%	0.701	70%	0.699	S	S	*	*			trans	69.9	154.8	155.8	-64.5	-31.2	0	0	0	117.6
972	I	29.7	Very low	29.9	Very low	154 Å²	154	120.8 Å²	120.8	79%	0.79	69%	0.694	S	S	*	*			cis	-136.4	147.1	33.1	-75	171.8	0	0	0	114.1
973	C	27.4	Very low	30.3	Very low	128 Å²	128	121 Å²	121	87%	0.865	69%	0.689	S	S	*	*			trans	35.6	129.7	161.2	-66.7	0	0	0	0	122.9
974	G	28.7	Very low	31	Very low	69 Å²	69	116 Å²	116	71%	0.711	67%	0.672	S	S	*	*			trans	168.4	70.2	162.1	0	0	0	0	0	115.4
975	T	29.5	Very low	31.6	Very low	136 Å²	136	116.4 Å²	116.4	83%	0.834	66%	0.663	S	S	*	*			trans	22	103.7	166.3	49.1	0	0	0	0	118.7	V977	T975-V977 PolarHBondContact O-N 3.17Å
976	S	29.8	Very low	32	Very low	112 Å²	112	116.7 Å²	116.7	78%	0.783	65%	0.653	S	S	*	*			trans	-72	108	171	56.8	0	0	0	0	112.4
977	V	30.5	Very low	32.1	Very low	81 Å²	81	115 Å²	115	49%	0.491	64%	0.641	S	S	.	*			trans	-60.6	133	171.1	175.4	0	0	0	0	110.3	T975 E981	T975-V977 PolarHBondContact O-N 3.17Å; V977-E981 WeakPolarHBondContact CA-OE2 3.33Å; V977-E981 HydrophobicContact CG1-CB 3.85Å; V977-E981 HydrophobicContact CG1-CG 3.92Å
978	T	38.5	Very low	32.4	Very low	69 Å²	69	110.4 Å²	110.4	42%	0.423	63%	0.625	S	S	.	*			trans	-90	159.6	-178.7	66.1	0	0	0	0	112.8	M980 E981 L982	T978-M980 PolarHBondContact O-N 2.76Å; T978-M980 VanDerWaalsContact O-N 3.11Å; T978-E981 PolarHBondContact N-OE2 3.13Å; T978-E981 WeakPolarHBondContact O-CA 3.24Å; T978-E981 VanDerWaalsContact O-CB 3.24Å; T978-E981 WeakPolarHBondContact O-CB 3.45Å; T978-E981 PolarHBondContact O-N 3.28Å; T978-E981 PolarHBondContact OG1-OE2 3.39Å; T978-L982 PolarHBondContact O-N 3.05Å; T978-L982 VanDerWaalsContact O-N 3.08Å
979	P	33	Very low	32.8	Very low	119 Å²	119	109 Å²	109	77%	0.773	62%	0.619	S	S	*	*	H	α-helix	trans	-58.5	-26.6	175.5	-26.4	35.8	0	0	0	114	E981 F983	P979-E981 PolarHBondContact O-N 2.89Å; P979-F983 PolarHBondContact O-N 2.69Å; P979-F983 VanDerWaalsContact O-N 3.12Å
980	M	37.8	Very low	33	Very low	156 Å²	156	112.5 Å²	112.5	77%	0.768	63%	0.625	S	S	*	*	H	α-helix	trans	-71.7	-21.5	175.7	-154.6	146	-69.4	0	0	112.7	T978 A984	T978-M980 PolarHBondContact O-N 2.76Å; T978-M980 VanDerWaalsContact O-N 3.11Å; M980-A984 WeakPolarHBondContact O-CB 3.48Å; M980-A984 PolarHBondContact O-N 3.22Å
981	E	37.1	Very low	33.3	Very low	88 Å²	88	110.5 Å²	110.5	41%	0.411	62%	0.616	S	S	.	*	H	α-helix	trans	-94.9	-31.4	-176.5	-163.8	169.4	-161.7	0	0	110.8	V977 T978 P979 F983 A984 Q985	V977-E981 WeakPolarHBondContact CA-OE2 3.33Å; V977-E981 HydrophobicContact CG1-CB 3.85Å; V977-E981 HydrophobicContact CG1-CG 3.92Å; T978-E981 PolarHBondContact N-OE2 3.13Å; T978-E981 WeakPolarHBondContact O-CA 3.24Å; T978-E981 VanDerWaalsContact O-CB 3.24Å; T978-E981 WeakPolarHBondContact O-CB 3.45Å; T978-E981 PolarHBondContact O-N 3.28Å; T978-E981 PolarHBondContact OG1-OE2 3.39Å; P979-E981 PolarHBondContact O-N 2.89Å; E981-F983 VanDerWaalsContact C-N 3.32Å; E981-A984 PolarHBondContact O-N 2.79Å; E981-Q985 WeakPolarHBondContact O-CB 3.41Å; E981-Q985 WeakPolarHBondContact O-CG 3.41Å; E981-Q985 PolarHBondContact O-N 3.39Å
982	L	37.3	Very low	33.4	Very low	103 Å²	103	111.9 Å²	111.9	54%	0.539	62%	0.619	S	S	.	*	H	α-helix	trans	-62.1	-40.8	160.8	-160.2	83	0	0	0	111.1	T978 Q985 M986	T978-L982 PolarHBondContact O-N 3.05Å; T978-L982 VanDerWaalsContact O-N 3.08Å; L982-Q985 PolarHBondContact O-N 3.38Å; L982-M986 PolarHBondContact O-N 3.08Å
983	F	36.7	Very low	33.4	Very low	145 Å²	145	110.2 Å²	110.2	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-65.6	-38.1	173.4	-165	-92.1	0	0	0	111.9	P979 E981 T987	P979-F983 PolarHBondContact O-N 2.69Å; P979-F983 VanDerWaalsContact O-N 3.12Å; E981-F983 VanDerWaalsContact C-N 3.32Å; F983-T987 WeakPolarHBondContact O-CB 3.49Å; F983-T987 PolarHBondContact O-N 3Å; F983-T987 PolarHBondContact O-OG1 3.32Å
984	A	38.5	Very low	33.5	Very low	53 Å²	53	108 Å²	108	44%	0.438	60%	0.596	S	S	.	*	H	α-helix	trans	-64.7	-38.5	172	0	0	0	0	0	112.3	M980 E981 T987 A988	M980-A984 WeakPolarHBondContact O-CB 3.48Å; M980-A984 PolarHBondContact O-N 3.22Å; E981-A984 PolarHBondContact O-N 2.79Å; A984-T987 PolarHBondContact O-N 2.72Å; A984-A988 VanDerWaalsContact O-CB 3.27Å; A984-A988 WeakPolarHBondContact O-CB 3.38Å; A984-A988 PolarHBondContact O-N 2.93Å
985	Q	38.2	Very low	33.3	Very low	111 Å²	111	111.1 Å²	111.1	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-70.1	-40	175.9	-75.4	175.5	2.2	0	0	112.4	E981 L982 T987 A988 H989	E981-Q985 WeakPolarHBondContact O-CB 3.41Å; E981-Q985 WeakPolarHBondContact O-CG 3.41Å; E981-Q985 PolarHBondContact O-N 3.39Å; L982-Q985 PolarHBondContact O-N 3.38Å; Q985-T987 VanDerWaalsContact C-N 3.34Å; Q985-A988 PolarHBondContact O-N 3.43Å; Q985-H989 WeakPolarHBondContact O-CB 3.29Å; Q985-H989 PolarHBondContact O-N 3.49Å
986	M	34.5	Very low	33.2	Very low	117 Å²	117	111.9 Å²	111.9	58%	0.576	59%	0.591	S	S	*	*	H	α-helix	trans	-62.7	-40.7	170.5	-75.1	177.8	63	0	0	111.8	L982 H989 Y990	L982-M986 PolarHBondContact O-N 3.08Å; M986-H989 PolarHBondContact O-N 3.08Å; M986-Y990 PolarHBondContact O-N 3.11Å
987	T	37.5	Very low	33.1	Very low	76 Å²	76	112.4 Å²	112.4	47%	0.466	59%	0.593	S	S	.	*	H	α-helix	trans	-66.9	-38.7	176	-53.5	0	0	0	0	111.4	F983 A984 Q985 K991	F983-T987 WeakPolarHBondContact O-CB 3.49Å; F983-T987 PolarHBondContact O-N 3Å; F983-T987 PolarHBondContact O-OG1 3.32Å; A984-T987 PolarHBondContact O-N 2.72Å; Q985-T987 VanDerWaalsContact C-N 3.34Å; T987-K991 WeakPolarHBondContact O-CB 3.38Å; T987-K991 PolarHBondContact O-N 3.32Å
988	A	33.1	Very low	32.9	Very low	52 Å²	52	115.7 Å²	115.7	43%	0.43	61%	0.608	S	S	.	*	H	α-helix	trans	-66.9	-41.3	174.5	0	0	0	0	0	111.8	A984 Q985 K991 Q992	A984-A988 VanDerWaalsContact O-CB 3.27Å; A984-A988 WeakPolarHBondContact O-CB 3.38Å; A984-A988 PolarHBondContact O-N 2.93Å; Q985-A988 PolarHBondContact O-N 3.43Å; A988-K991 CarbonylContact O-C 3.53Å; A988-K991 PolarHBondContact O-N 3.1Å; A988-K991 VanDerWaalsContact O-N 3.16Å; A988-Q992 WeakPolarHBondContact O-CB 3.43Å; A988-Q992 PolarHBondContact O-N 3.04Å
989	H	33	Very low	32.2	Very low	123 Å²	123	121.7 Å²	121.7	57%	0.569	62%	0.624	S	S	*	*	H	α-helix	trans	-70.6	-30.8	178.2	-158.4	-64.1	0	0	0	112.4	Q985 M986 I993	Q985-H989 WeakPolarHBondContact O-CB 3.29Å; Q985-H989 PolarHBondContact O-N 3.49Å; M986-H989 PolarHBondContact O-N 3.08Å; H989-I993 WeakPolarHBondContact O-CG1 3.38Å; H989-I993 PolarHBondContact O-N 2.97Å
990	Y	31.6	Very low	31.7	Very low	183 Å²	183	119.9 Å²	119.9	72%	0.718	62%	0.619	S	S	*	*	H	α-helix	trans	-68.6	-40.4	166.7	-105.5	-89.2	0	0	0	111.9	M986 I993 S994	M986-Y990 PolarHBondContact O-N 3.11Å; Y990-I993 PolarHBondContact O-N 3.18Å; Y990-S994 PolarHBondContact O-N 3.11Å
991	K	30.6	Very low	31.2	Very low	114 Å²	114	121.2 Å²	121.2	50%	0.496	62%	0.624	S	S	.	*	H	α-helix	trans	-68.4	-33.8	177.8	-170.3	168.2	-178	179	0	113.1	T987 A988 I993 S994 E995	T987-K991 WeakPolarHBondContact O-CB 3.38Å; T987-K991 PolarHBondContact O-N 3.32Å; A988-K991 CarbonylContact O-C 3.53Å; A988-K991 PolarHBondContact O-N 3.1Å; A988-K991 VanDerWaalsContact O-N 3.16Å; K991-I993 VanDerWaalsContact C-N 3.26Å; K991-I993 PolarHBondContact O-N 3.23Å; K991-S994 WeakPolarHBondContact CA-OG 3.19Å; K991-S994 PolarHBondContact O-N 2.9Å; K991-S994 PolarHBondContact O-OG 3.21Å; K991-E995 WeakPolarHBondContact CE-OE1 3.46Å; K991-E995 WeakPolarHBondContact CE-OE2 3.22Å; K991-E995 IonicContact NZ-OE1 3.83Å; K991-E995 PolarHBondContact NZ-OE1 2.79Å; K991-E995 IonicContact NZ-OE2 2.67Å; K991-E995 PolarHBondContact O-N 3.39Å
992	Q	27.9	Very low	30.6	Very low	161 Å²	161	122.5 Å²	122.5	75%	0.752	64%	0.643	S	S	*	*	H	α-helix	trans	-79	-9.9	177.5	-150.6	165	10.4	0	0	113	A988	A988-Q992 WeakPolarHBondContact O-CB 3.43Å; A988-Q992 PolarHBondContact O-N 3.04Å
993	I	31.4	Very low	29.9	Very low	119 Å²	119	124.9 Å²	124.9	61%	0.61	65%	0.653	S	S	*	*	H	α-helix	trans	-91.3	-17	167.2	-72.8	173.3	0	0	0	111.8	H989 Y990 K991	H989-I993 WeakPolarHBondContact O-CG1 3.38Å; H989-I993 PolarHBondContact O-N 2.97Å; Y990-I993 PolarHBondContact O-N 3.18Å; K991-I993 VanDerWaalsContact C-N 3.26Å; K991-I993 PolarHBondContact O-N 3.23Å
994	S	27.7	Very low	29.3	Very low	82 Å²	82	125.4 Å²	125.4	57%	0.573	66%	0.657	S	S	*	*	H	α-helix	trans	-98	-11.3	-177.6	65.6	0	0	0	0	116.3	Y990 K991	Y990-S994 PolarHBondContact O-N 3.11Å; K991-S994 WeakPolarHBondContact CA-OG 3.19Å; K991-S994 PolarHBondContact O-N 2.9Å; K991-S994 PolarHBondContact O-OG 3.21Å
995	E	25.7	Very low	28.6	Very low	134 Å²	134	130.3 Å²	130.3	63%	0.626	68%	0.675	S	S	*	*	S	Bend	trans	-114.9	16.6	-174.3	-71.2	-179.2	173.6	0	0	114.1	K991	K991-E995 WeakPolarHBondContact CE-OE1 3.46Å; K991-E995 WeakPolarHBondContact CE-OE2 3.22Å; K991-E995 IonicContact NZ-OE1 3.83Å; K991-E995 PolarHBondContact NZ-OE1 2.79Å; K991-E995 IonicContact NZ-OE2 2.67Å; K991-E995 PolarHBondContact O-N 3.39Å
996	N	27.8	Very low	27.9	Very low	151 Å²	151	133.2 Å²	133.2	81%	0.807	69%	0.686	S	S	*	*	S	Bend	trans	-132.1	35.9	177.3	-139.6	12.8	0	0	0	114.3
997	C	26.4	Very low	27.5	Very low	124 Å²	124	133.7 Å²	133.7	84%	0.838	69%	0.691	S	S	*	*			trans	-140.6	90.8	166.2	-113.8	0	0	0	0	108.6
998	N	26.2	Very low	27	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	71%	0.707	S	S	*	*			trans	-153.6	129.5	177.3	-141.1	-29.1	0	0	0	113.1
999	Y	24.1	Very low	26.6	Very low	194 Å²	194	139.3 Å²	139.3	76%	0.761	72%	0.716	S	S	*	*			trans	94.3	127.8	162	-128.4	-109.1	0	0	0	121.5
1000	A	23.5	Very low	26.2	Very low	81 Å²	81	138.8 Å²	138.8	67%	0.669	72%	0.723	S	S	*	*			trans	76.8	75.1	153.2	0	0	0	0	0	122
1001	Q	25.7	Very low	25.8	Very low	185 Å²	185	135.5 Å²	135.5	86%	0.864	73%	0.727	S	S	*	*				-168.2	147.2	122.6	-112.5	173.6	-21.3	0	0	112.3
1002	S	25.6	Very low	25.5	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	74%	0.738	S	S	*	*			trans	60.6	125.3	175.5	20.4	0	0	0	0	115.4
1003	M	22.4	Very low	25.4	Very low	152 Å²	152	135.8 Å²	135.8	75%	0.749	74%	0.742	S	S	*	*			cis	62	133.6	16.6	-100.5	-71.2	-79.8	0	0	115.1
1004	E	23.2	Very low	25.1	Very low	157 Å²	157	135.1 Å²	135.1	73%	0.734	74%	0.743	S	S	*	*			trans	61.6	98.8	169.2	-67.1	169.5	168.6	0	0	118.2
1005	L	25.3	Very low	24.9	Very low	156 Å²	156	139.7 Å²	139.7	82%	0.817	76%	0.755	S	S	*	*			trans	-136.7	30.1	138.2	-114	-179.5	0	0	0	113.1	T1008	L1005-T1008 HydrophobicContact CD2-CG2 4.24Å
1006	F	23.1	Very low	25	Very low	171 Å²	171	140.1 Å²	140.1	75%	0.75	76%	0.761	S	S	*	*	S	Bend	trans	-77.9	140.5	147.9	-120.5	-91.7	0	0	0	107.4
1007	L	25.9	Very low	24.8	Very low	127 Å²	127	136.6 Å²	136.6	67%	0.665	75%	0.753	S	S	*	*			trans	61.5	76.5	172.9	-49	-176.5	0	0	0	117.1	N1009	L1007-N1009 HydrophobicContact CB-CB 4.21Å; L1007-N1009 HydrophobicContact CD2-CB 4.03Å; L1007-N1009 PolarHBondContact O-N 3.45Å
1008	T	25.9	Very low	24.9	Very low	131 Å²	131	135 Å²	135	80%	0.804	74%	0.743	S	S	*	*	S	Bend		-67.9	64.1	129.5	53	0	0	0	0	109.5	L1005	L1005-T1008 HydrophobicContact CD2-CG2 4.24Å
1009	N	25.8	Very low	24.8	Very low	116 Å²	116	135.2 Å²	135.2	62%	0.62	74%	0.741	S	S	*	*			trans	-156.3	92	177	-141.1	0.9	0	0	0	108.3	L1007	L1007-N1009 HydrophobicContact CB-CB 4.21Å; L1007-N1009 HydrophobicContact CD2-CB 4.03Å; L1007-N1009 PolarHBondContact O-N 3.45Å
1010	P	24.4	Very low	24.9	Very low	112 Å²	112	132 Å²	132	73%	0.727	74%	0.737	S	S	*	*			trans	-80	152.1	-171.3	31.7	-35	0	0	0	113
1011	S	22.9	Very low	25	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	74%	0.744	S	S	*	*			trans	68.1	143	-172.2	78.4	0	0	0	0	113.5
1012	V	25.3	Very low	25	Very low	121 Å²	121	130.2 Å²	130.2	73%	0.733	74%	0.735	S	S	*	*			cis	-143.2	126.1	32	169.7	0	0	0	0	112.3
1013	I	24.8	Very low	25.2	Very low	160 Å²	160	132.9 Å²	132.9	82%	0.821	73%	0.732	S	S	*	*	S	Bend	trans	-138.2	120.1	133.7	-69.3	-168.4	0	0	0	107.4
1014	T	25.1	Very low	25.3	Very low	105 Å²	105	133.9 Å²	133.9	64%	0.644	74%	0.738	S	S	*	*			trans	55.4	66.7	165.6	-40.7	0	0	0	0	118.2	L1016	T1014-L1016 HydrophobicContact CG2-CB 4.13Å; T1014-L1016 HydrophobicContact CG2-CD1 4.49Å; T1014-L1016 HydrophobicContact CG2-CG 4.41Å
1015	Q	24.2	Very low	25.5	Very low	178 Å²	178	130.1 Å²	130.1	83%	0.832	73%	0.726	S	S	*	*				-88.5	119.6	119.9	-74.5	-178.5	-4.4	0	0	105
1016	L	27.5	Very low	25.5	Very low	142 Å²	142	128.6 Å²	128.6	74%	0.743	72%	0.715	S	S	*	*			cis	53.2	81.2	33.8	-119.9	-178.7	0	0	0	111.8	T1014	T1014-L1016 HydrophobicContact CG2-CB 4.13Å; T1014-L1016 HydrophobicContact CG2-CD1 4.49Å; T1014-L1016 HydrophobicContact CG2-CG 4.41Å
1017	A	24.3	Very low	25.7	Very low	77 Å²	77	126.2 Å²	126.2	64%	0.636	71%	0.714	S	S	*	*	S	Bend	trans	55.6	79.7	162.6	0	0	0	0	0	116.9
1018	S	27.3	Very low	25.6	Very low	91 Å²	91	126.1 Å²	126.1	64%	0.636	72%	0.719	S	S	*	*				63.1	128.4	115.7	66.4	0	0	0	0	120.7
1019	M	25.2	Very low	25.6	Very low	154 Å²	154	124 Å²	124	76%	0.759	71%	0.71	S	S	*	*			trans	81.3	104.4	139.1	-69.6	172.6	73.9	0	0	119.3
1020	N	26.6	Very low	25.7	Very low	126 Å²	126	126 Å²	126	67%	0.674	72%	0.718	S	S	*	*				82.6	115.8	121.8	-62.8	1.4	0	0	0	116.8
1021	V	25.1	Very low	25.6	Very low	133 Å²	133	124.9 Å²	124.9	81%	0.806	71%	0.714	S	S	*	*				60.2	107.3	69.7	177.2	0	0	0	0	110.9
1022	S	25.4	Very low	25.9	Very low	97 Å²	97	126.2 Å²	126.2	68%	0.678	72%	0.717	S	S	*	*				176.3	142.8	129.3	43.7	0	0	0	0	110.2
1023	K	28.9	Very low	26.1	Very low	170 Å²	170	125 Å²	125	74%	0.739	71%	0.714	S	S	*	*				-175.6	111.8	108.1	-96.7	158.4	-174.3	174.6	0	111.7	T1025	K1023-T1025 HydrophobicContact CB-CG2 4.09Å; K1023-T1025 HydrophobicContact CD-CG2 3.79Å; K1023-T1025 HydrophobicContact CG-CG2 3.72Å
1024	I	25.1	Very low	26.4	Very low	173 Å²	173	123.8 Å²	123.8	89%	0.887	71%	0.714	S	S	*	*	S	Bend		-90.3	124.7	120.9	-70.7	175.5	0	0	0	105.2
1025	T	27.5	Very low	26.6	Very low	78 Å²	78	122.8 Å²	122.8	48%	0.479	72%	0.717	S	S	.	*			trans	-85.8	167.8	167.2	49.4	0	0	0	0	109.2	K1023	K1023-T1025 HydrophobicContact CB-CG2 4.09Å; K1023-T1025 HydrophobicContact CD-CG2 3.79Å; K1023-T1025 HydrophobicContact CG-CG2 3.72Å
1026	E	25.3	Very low	26.8	Very low	124 Å²	124	123.6 Å²	123.6	58%	0.579	72%	0.721	S	S	*	*			cis	-115.1	156.2	-0.4	-74.3	79.6	-124.6	0	0	110.1
1027	T	26.4	Very low	26.8	Very low	121 Å²	121	125.6 Å²	125.6	74%	0.742	73%	0.726	S	S	*	*				-164.3	134.3	68.7	26.6	0	0	0	0	109.1
1028	V	25.1	Very low	27.5	Very low	125 Å²	125	127.4 Å²	127.4	76%	0.758	73%	0.731	S	S	*	*				57.8	114.7	82.9	176.4	0	0	0	0	111.1
1029	S	24.8	Very low	27.9	Very low	88 Å²	88	127.4 Å²	127.4	62%	0.615	73%	0.729	S	S	*	*			cis	-174.7	168.2	0.9	54	0	0	0	0	111.9
1030	I	28	Very low	28.1	Very low	156 Å²	156	124.3 Å²	124.3	80%	0.8	72%	0.723	S	S	*	*			trans	68.8	145	157.6	-65.4	157.4	0	0	0	115.8
1031	S	22.6	Very low	28.3	Very low	90 Å²	90	122.9 Å²	122.9	63%	0.629	72%	0.723	S	S	*	*			cis	177.1	165.4	-34.5	-86.9	0	0	0	0	106.2
1032	T	29.3	Very low	28.3	Very low	141 Å²	141	121.6 Å²	121.6	87%	0.865	72%	0.72	S	S	*	*			trans	69.7	140.7	172.5	70.2	0	0	0	0	115.8
1033	S	30.2	Very low	28.3	Very low	96 Å²	96	122 Å²	122	67%	0.671	72%	0.722	S	S	*	*			cis	-161.5	149.5	-3	45.4	0	0	0	0	112.7
1034	T	29.7	Very low	28.1	Very low	135 Å²	135	118.7 Å²	118.7	83%	0.828	72%	0.72	S	S	*	*			trans	31.4	143	143.8	59	0	0	0	0	122.4
1035	A	30.2	Very low	28.1	Very low	84 Å²	84	115.4 Å²	115.4	69%	0.694	71%	0.713	S	S	*	*			cis	-174.6	168.8	-8.3	0	0	0	0	0	111.9
1036	Q	29	Very low	28.1	Very low	195 Å²	195	116.4 Å²	116.4	91%	0.911	72%	0.723	S	S	*	*			trans	72.6	172.3	159.3	-75.2	172.2	-26.5	0	0	119.4
1037	Q	26.7	Very low	28.2	Very low	184 Å²	184	116.9 Å²	116.9	86%	0.86	73%	0.729	S	S	*	*			trans	-131.8	178.3	-143.3	-75.8	-179.6	-49	0	0	113.7
1038	P	38.3	Very low	28.3	Very low	114 Å²	114	119.8 Å²	119.8	74%	0.74	73%	0.732	S	S	*	*			cis	-113.7	-46.5	-24.1	21.9	-13.4	0	0	0	121.8
1039	P	36.7	Very low	28.2	Very low	91 Å²	91	119.5 Å²	119.5	59%	0.591	73%	0.731	S	S	*	*				-128.5	170.7	-119.1	37	-19.4	0	0	0	117.7
1040	S	30.2	Very low	28.1	Very low	90 Å²	90	123 Å²	123	63%	0.629	74%	0.742	S	S	*	*			trans	65.3	153	147.7	52.2	0	0	0	0	120.6
1041	S	28.9	Very low	28.1	Very low	96 Å²	96	121.8 Å²	121.8	67%	0.671	74%	0.742	S	S	*	*			cis	-173	172.2	-26.1	55.8	0	0	0	0	109
1042	S	26	Very low	28.3	Very low	106 Å²	106	122.9 Å²	122.9	74%	0.741	75%	0.747	S	S	*	*			trans	64.5	157.2	158.8	28.6	0	0	0	0	117.2
1043	S	24.8	Very low	27.9	Very low	104 Å²	104	123.7 Å²	123.7	73%	0.727	75%	0.745	S	S	*	*			cis	-161.6	162.3	-15	42.4	0	0	0	0	110.2
1044	S	24.8	Very low	27.6	Very low	101 Å²	101	124.3 Å²	124.3	71%	0.706	75%	0.745	S	S	*	*			trans	29.5	112.2	158.7	59	0	0	0	0	120.5
1045	S	25.1	Very low	27.4	Very low	104 Å²	104	123.4 Å²	123.4	73%	0.727	74%	0.74	S	S	*	*			trans	68.9	135.4	138.2	61.9	0	0	0	0	122.7
1046	S	27.7	Very low	27.2	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	74%	0.744	S	S	*	*			trans	63	145.4	152.6	24.1	0	0	0	0	120.2
1047	D	27.9	Very low	27.3	Very low	133 Å²	133	123.1 Å²	123.1	71%	0.711	74%	0.74	S	S	*	*			cis	-159.3	160.5	-2.7	-121.7	-10.8	0	0	0	114.9
1048	F	28.1	Very low	27.1	Very low	182 Å²	182	122.8 Å²	122.8	80%	0.798	74%	0.736	S	S	*	*			trans	47.2	148.8	159.5	-74.1	-76.1	0	0	0	124
1049	T	23.1	Very low	26.8	Very low	120 Å²	120	122.6 Å²	122.6	74%	0.736	74%	0.735	S	S	*	*			trans	-76.5	161.8	164.9	49.7	0	0	0	0	110.9
1050	L	23.7	Very low	26.4	Very low	160 Å²	160	122.6 Å²	122.6	84%	0.838	74%	0.737	S	S	*	*			cis	-125	163.1	18.9	-70.4	78.3	0	0	0	113.4
1051	T	26.2	Very low	26.4	Very low	131 Å²	131	124.8 Å²	124.8	80%	0.804	74%	0.742	S	S	*	*			trans	-56.3	157	174.5	53.4	0	0	0	0	114.6
1052	P	26.8	Very low	26.3	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	75%	0.746	S	S	*	*			cis	-136.1	146.3	16.2	38.8	-21.4	0	0	0	117.6
1053	L	22.7	Very low	26.3	Very low	159 Å²	159	126.2 Å²	126.2	83%	0.832	74%	0.739	S	S	*	*			trans	-168.8	114.9	155.9	-125.8	63.1	0	0	0	105
1054	T	22.2	Very low	26.3	Very low	108 Å²	108	125.9 Å²	125.9	66%	0.663	74%	0.737	S	S	*	*				54	136.6	71.3	68.3	0	0	0	0	116.1
1055	T	26.9	Very low	26.5	Very low	117 Å²	117	130.1 Å²	130.1	72%	0.718	74%	0.743	S	S	*	*			trans	68.4	114	173	61.3	0	0	0	0	115.8
1056	I	25.5	Very low	26.4	Very low	154 Å²	154	133 Å²	133	79%	0.79	75%	0.745	S	S	*	*				68.9	107.2	79.7	-61.8	161.8	0	0	0	113.4
1057	S	30.7	Very low	26.2	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	74%	0.743	S	S	*	*				-177.7	158.7	121.2	-76.2	0	0	0	0	113.8
1058	K	23.5	Very low	26	Very low	177 Å²	177	134.6 Å²	134.6	77%	0.77	74%	0.744	S	S	*	*			trans	-143.1	-175.8	170.4	-81.4	-165.5	177.1	-165.9	0	106.6
1059	P	31.4	Very low	25.9	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	75%	0.745	S	S	*	*				-126.3	-113.3	-55	37.6	-18.9	0	0	0	110
1060	S	27.5	Very low	25.9	Very low	91 Å²	91	136.4 Å²	136.4	64%	0.636	75%	0.747	S	S	*	*			trans	79.4	141.1	166.4	11.7	0	0	0	0	117.3
1061	D	30.8	Very low	26	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	75%	0.749	S	S	*	*			cis	-158.3	152.2	9.3	-104.1	-24.9	0	0	0	116.7
1062	L	27.9	Very low	25.7	Very low	147 Å²	147	135.1 Å²	135.1	77%	0.77	74%	0.744	S	S	*	*			trans	48.7	156.5	148.6	-81.3	76.4	0	0	0	123.6
1063	S	24.4	Very low	25.8	Very low	85 Å²	85	135.2 Å²	135.2	59%	0.594	75%	0.745	S	S	*	*			cis	-175.6	131.5	-25.2	55.7	0	0	0	0	117
1064	S	24.7	Very low	25.9	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	74%	0.74	S	S	*	*			trans	65	149.9	135.2	77.1	0	0	0	0	125.5
1065	K	29.1	Very low	26	Very low	190 Å²	190	134.3 Å²	134.3	83%	0.826	74%	0.741	S	S	*	*			trans	78	161.2	165	-58.1	175.5	-175.1	175.3	0	117.3
1066	Q	24.5	Very low	25.8	Very low	164 Å²	164	136.6 Å²	136.6	77%	0.766	74%	0.743	S	S	*	*			cis	166	120.7	-41.1	-117.9	-169.5	-39.2	0	0	107.2
1067	I	23.5	Very low	25.9	Very low	131 Å²	131	139.1 Å²	139.1	67%	0.672	75%	0.748	S	S	*	*			trans	70.8	128	147.3	-60.5	172.9	0	0	0	120.3
1068	D	22	Very low	25.6	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	75%	0.753	S	S	*	*			trans	50.4	113.2	156.1	-57.1	-9.6	0	0	0	124.1
1069	K	27	Very low	25.5	Very low	189 Å²	189	145.7 Å²	145.7	82%	0.822	76%	0.76	S	S	*	*				174.8	125.6	108.3	-92.4	160.4	-172.5	175.8	0	111.3
1070	I	23	Very low	25.1	Very low	151 Å²	151	144.8 Å²	144.8	77%	0.774	76%	0.757	S	S	*	*				56.4	104.7	90.7	-57.5	176.1	0	0	0	113.4
1071	D	25	Very low	24.8	Very low	164 Å²	164	146 Å²	146	88%	0.877	76%	0.76	S	S	*	*				-162.5	172	126.9	-120.2	-32.1	0	0	0	112.9
1072	S	20.9	Very low	24.4	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	76%	0.764	S	S	*	*			trans	-121.2	171.8	-178.5	79.3	0	0	0	0	110.4
1073	P	28.9	Very low	24.2	Very low	115 Å²	115	147.2 Å²	147.2	75%	0.747	77%	0.768	S	S	*	*			cis	-143.4	-171.9	31.8	41.7	-19.6	0	0	0	117.5
1074	T	24.2	Very low	24.1	Very low	119 Å²	119	152.9 Å²	152.9	73%	0.73	78%	0.782	S	S	*	*			trans	-52.1	145	174.1	53.4	0	0	0	0	114.4
1075	N	24.5	Very low	24	Very low	128 Å²	128	156.8 Å²	156.8	68%	0.684	79%	0.787	S	S	*	*				-174.7	160.7	55.2	-126.2	-16.8	0	0	0	113.9
1076	H	23.4	Very low	23.7	Very low	165 Å²	165	156.9 Å²	156.9	76%	0.764	79%	0.79	S	S	*	*			trans	54	94.8	162.9	-59.3	-63.6	0	0	0	121.7
1077	K	26.5	Very low	23.6	Very low	207 Å²	207	156.8 Å²	156.8	90%	0.9	79%	0.79	S	S	*	*				-178.1	145.7	114.7	-101.3	167.2	-177.9	176.7	0	113.9
1078	R	25.9	Very low	23.6	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	79%	0.789	S	S	*	*			trans	47.6	103.6	165	-76.5	-175.1	169.8	169.4	-4	120
1079	M	21.1	Very low	23.7	Very low	188 Å²	188	157.3 Å²	157.3	93%	0.926	79%	0.787	S	S	*	*			trans	-104.9	172.3	138.5	-64.8	155.9	53.8	0	0	107.1
1080	S	22.1	Very low	23.8	Very low	91 Å²	91	155.4 Å²	155.4	64%	0.636	78%	0.784	S	S	*	*			cis	-152.2	160.8	14.1	66.5	0	0	0	0	113.8
1081	T	21.9	Very low	23.9	Very low	116 Å²	116	152.2 Å²	152.2	71%	0.712	77%	0.768	S	S	*	*			trans	43.8	111.6	143	57.2	0	0	0	0	121
1082	N	22.2	Very low	24	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	75%	0.746	S	S	*	*				-163.7	136.6	109.6	-97.5	-14.5	0	0	0	110.7
1083	D	24.3	Very low	24.5	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	74%	0.738	S	S	*	*			trans	164.8	79.6	147.6	-91.2	-10.1	0	0	0	109.8
1084	F	20.6	Very low	24.7	Very low	203 Å²	203	146.2 Å²	146.2	89%	0.89	73%	0.725	S	S	*	*			trans	-157.5	48.8	170.4	-135.5	-81	0	0	0	112.8
1085	F	23.5	Very low	25.1	Very low	180 Å²	180	146.8 Å²	146.8	79%	0.789	72%	0.719	S	S	*	*			trans	-140.8	103.7	171.2	-91.4	-77.1	0	0	0	110.7
1086	H	23.6	Very low	25.8	Very low	191 Å²	191	143.3 Å²	143.3	88%	0.884	71%	0.705	S	S	*	*			trans	-137.4	39.4	167.5	-155.7	-68.3	0	0	0	112.3
1087	E	22	Very low	26.4	Very low	162 Å²	162	140.7 Å²	140.7	76%	0.757	70%	0.696	S	S	*	*	S	Bend	trans	-155.8	157.2	160.1	-114.8	170.6	-167.9	0	0	108.6
1088	F	22.7	Very low	26.9	Very low	152 Å²	152	133.5 Å²	133.5	67%	0.667	67%	0.667	S	S	*	*			trans	61.1	78.5	-170.5	-68	-85.5	0	0	0	117.2
1089	N	25.4	Very low	27.5	Very low	125 Å²	125	126.8 Å²	126.8	67%	0.668	64%	0.644	S	S	*	*			trans	-139.9	85.2	165.1	-106.9	-20.5	0	0	0	114	P1092	N1089-P1092 VanDerWaalsContact OD1-CG 3.31Å; N1089-P1092 WeakPolarHBondContact OD1-CG 3.49Å
1090	I	27.4	Very low	28.2	Very low	150 Å²	150	123 Å²	123	77%	0.769	62%	0.624	S	S	*	*	S	Bend	trans	-131	-23.1	164.8	-64.8	-177.4	0	0	0	112
1091	L	25.3	Very low	28.9	Very low	83 Å²	83	120.2 Å²	120.2	44%	0.435	61%	0.605	S	S	.	*	S	Bend	trans	-100.7	-2.3	-171.6	-130.7	73.4	0	0	0	119.8	Y1137 R2061	L1091-Y1137 HydrophobicContact CD1-CE1 4.11Å; L1091-Y1137 WeakPolarHBondContact CD1-OH 3.31Å; L1091-R2061 VanDerWaalsContact CD2-NH1 3.34Å
1092	P	27.9	Very low	29.5	Very low	62 Å²	62	120 Å²	120	40%	0.403	60%	0.595	S	S	.	*	S	Bend	trans	-76.4	-36	170.8	-18.5	32.9	0	0	0	113.9	N1089 L1094 H1095 S1096	N1089-P1092 VanDerWaalsContact OD1-CG 3.31Å; N1089-P1092 WeakPolarHBondContact OD1-CG 3.49Å; P1092-L1094 VanDerWaalsContact C-N 3.32Å; P1092-L1094 PolarHBondContact O-N 3.39Å; P1092-H1095 PolarHBondContact O-N 3.21Å; P1092-H1095 VanDerWaalsContact O-N 3.08Å; P1092-S1096 PolarHBondContact O-N 3.2Å
1093	N	32	Very low	30	Very low	104 Å²	104	117.2 Å²	117.2	56%	0.556	58%	0.576	S	S	*	*	H	α-helix	trans	-57.9	-39.7	-164.9	-72.9	2.6	0	0	0	113.4	H1095 S1096 L1097	N1093-H1095 VanDerWaalsContact C-N 3.35Å; N1093-H1095 PolarHBondContact O-N 2.85Å; N1093-S1096 PolarHBondContact O-N 3.37Å; N1093-S1096 VanDerWaalsContact O-N 3.17Å; N1093-L1097 WeakPolarHBondContact O-CD1 3.05Å; N1093-L1097 PolarHBondContact O-N 2.66Å
1094	L	32	Very low	30.4	Very low	88 Å²	88	115.1 Å²	115.1	46%	0.461	57%	0.565	S	S	.	*	H	α-helix	trans	-68.7	-31.8	-178.1	-157.4	148.9	0	0	0	112.7	P1092 L1098 I1131	P1092-L1094 VanDerWaalsContact C-N 3.32Å; P1092-L1094 PolarHBondContact O-N 3.39Å; L1094-L1098 HydrophobicContact CD2-CD1 3.77Å; L1094-L1098 HydrophobicContact CD2-CG 4.45Å; L1094-L1098 WeakPolarHBondContact O-CB 3.31Å; L1094-L1098 WeakPolarHBondContact O-CG 3.35Å; L1094-L1098 PolarHBondContact O-N 3.23Å; L1094-L1098 VanDerWaalsContact O-N 3.12Å; L1094-I1131 HydrophobicContact CD2-CG2 4.47Å
1095	H	32.8	Very low	30.9	Very low	131 Å²	131	110.8 Å²	110.8	61%	0.606	55%	0.55	S	S	*	.	H	α-helix	trans	-78.3	-29.8	172.2	-168.7	-70	0	0	0	112	P1092 N1093 K1099	P1092-H1095 PolarHBondContact O-N 3.21Å; P1092-H1095 VanDerWaalsContact O-N 3.08Å; N1093-H1095 VanDerWaalsContact C-N 3.35Å; N1093-H1095 PolarHBondContact O-N 2.85Å; H1095-K1099 VanDerWaalsContact O-CB 3.27Å; H1095-K1099 WeakPolarHBondContact O-CB 3.4Å; H1095-K1099 PolarHBondContact O-N 3.06Å
1096	S	39.7	Very low	31.2	Very low	55 Å²	55	107.7 Å²	107.7	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-69.6	-45.9	172.6	-164.1	0	0	0	0	111.4	P1092 N1093 K1099 Q1100	P1092-S1096 PolarHBondContact O-N 3.2Å; N1093-S1096 PolarHBondContact O-N 3.37Å; N1093-S1096 VanDerWaalsContact O-N 3.17Å; S1096-K1099 PolarHBondContact O-N 3.23Å; S1096-Q1100 WeakPolarHBondContact O-CB 3.41Å; S1096-Q1100 WeakPolarHBondContact O-CG 3.36Å; S1096-Q1100 PolarHBondContact O-N 2.92Å; S1096-Q1100 PolarHBondContact OG-OE1 3.13Å
1097	L	35.6	Very low	31.2	Very low	110 Å²	110	103.3 Å²	103.3	58%	0.576	53%	0.53	S	S	*	.	H	α-helix	trans	-59.3	-49.6	175.1	-100.4	81.1	0	0	0	111.3	N1093 K1099 Q1100 S1101	N1093-L1097 WeakPolarHBondContact O-CD1 3.05Å; N1093-L1097 PolarHBondContact O-N 2.66Å; L1097-K1099 VanDerWaalsContact C-N 3.31Å; L1097-K1099 PolarHBondContact O-N 3.47Å; L1097-Q1100 PolarHBondContact O-N 2.97Å; L1097-S1101 WeakPolarHBondContact O-CB 3.39Å; L1097-S1101 PolarHBondContact O-N 3.35Å; L1097-S1101 PolarHBondContact O-OG 2.98Å
1098	L	37.4	Very low	31.4	Very low	57 Å²	57	103.5 Å²	103.5	30%	0.298	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-36.8	178.1	-76.4	172.7	0	0	0	112.4	L1094 S1101 F1102 I1131	L1094-L1098 HydrophobicContact CD2-CD1 3.77Å; L1094-L1098 HydrophobicContact CD2-CG 4.45Å; L1094-L1098 WeakPolarHBondContact O-CB 3.31Å; L1094-L1098 WeakPolarHBondContact O-CG 3.35Å; L1094-L1098 PolarHBondContact O-N 3.23Å; L1094-L1098 VanDerWaalsContact O-N 3.12Å; L1098-S1101 PolarHBondContact O-OG 3.3Å; L1098-S1101 VanDerWaalsContact O-OG 3.13Å; L1098-F1102 WeakPolarHBondContact O-CB 3.45Å; L1098-F1102 WeakPolarHBondContact O-CD2 3.4Å; L1098-F1102 PolarHBondContact O-N 3.19Å; L1098-I1131 HydrophobicContact CD2-CD1 4.06Å
1099	K	37.9	Very low	31.6	Very low	104 Å²	104	103.5 Å²	103.5	45%	0.452	54%	0.538	S	S	.	.	H	α-helix	trans	-69	-43.4	174.9	-173.7	172.5	-175.6	-73.8	0	111.6	H1095 S1096 L1097 F1102 E1103	H1095-K1099 VanDerWaalsContact O-CB 3.27Å; H1095-K1099 WeakPolarHBondContact O-CB 3.4Å; H1095-K1099 PolarHBondContact O-N 3.06Å; S1096-K1099 PolarHBondContact O-N 3.23Å; L1097-K1099 VanDerWaalsContact C-N 3.31Å; L1097-K1099 PolarHBondContact O-N 3.47Å; K1099-F1102 PolarHBondContact O-N 3.26Å; K1099-E1103 VanDerWaalsContact CE-OE1 3.25Å; K1099-E1103 WeakPolarHBondContact CE-OE1 3.32Å; K1099-E1103 HydrophobicContact CG-CG 4.44Å; K1099-E1103 IonicContact NZ-OE1 2.68Å; K1099-E1103 PolarHBondContact NZ-OE1 3.36Å; K1099-E1103 IonicContact NZ-OE2 2.62Å; K1099-E1103 PolarHBondContact NZ-OE2 3.33Å; K1099-E1103 WeakPolarHBondContact O-CB 3.47Å; K1099-E1103 WeakPolarHBondContact O-CG 3.47Å; K1099-E1103 PolarHBondContact O-N 2.89Å
1100	Q	36.5	Very low	31.5	Very low	107 Å²	107	107.7 Å²	107.7	50%	0.5	55%	0.551	S	S	.	*	H	α-helix	trans	-66.7	-38.5	177.7	-74.3	176.2	-65.2	0	0	112	S1096 L1097 L1104	S1096-Q1100 WeakPolarHBondContact O-CB 3.41Å; S1096-Q1100 WeakPolarHBondContact O-CG 3.36Å; S1096-Q1100 PolarHBondContact O-N 2.92Å; S1096-Q1100 PolarHBondContact OG-OE1 3.13Å; L1097-Q1100 PolarHBondContact O-N 2.97Å; Q1100-L1104 VanDerWaalsContact O-CB 3.23Å; Q1100-L1104 WeakPolarHBondContact O-CB 3.45Å; Q1100-L1104 WeakPolarHBondContact O-CD1 3.24Å; Q1100-L1104 WeakPolarHBondContact O-CG 3.43Å; Q1100-L1104 PolarHBondContact O-N 3.27Å
1101	S	36	Very low	31.4	Very low	34 Å²	34	105 Å²	105	24%	0.238	55%	0.545	C	S	.	.	H	α-helix	trans	-68.5	-38.6	175.1	64.6	0	0	0	0	112	L1097 L1098 I1105	L1097-S1101 WeakPolarHBondContact O-CB 3.39Å; L1097-S1101 PolarHBondContact O-N 3.35Å; L1097-S1101 PolarHBondContact O-OG 2.98Å; L1098-S1101 PolarHBondContact O-OG 3.3Å; L1098-S1101 VanDerWaalsContact O-OG 3.13Å; S1101-I1105 WeakPolarHBondContact O-CB 3.49Å; S1101-I1105 WeakPolarHBondContact O-CD1 3.43Å; S1101-I1105 WeakPolarHBondContact O-CG1 3.11Å; S1101-I1105 PolarHBondContact O-N 2.91Å; S1101-I1105 VanDerWaalsContact O-N 3.16Å
1102	F	34.6	Very low	31.3	Very low	112 Å²	112	108.5 Å²	108.5	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-68.7	-41.7	173.6	-95.9	-88	0	0	0	112.6	L1098 K1099 I1105 I1106	L1098-F1102 WeakPolarHBondContact O-CB 3.45Å; L1098-F1102 WeakPolarHBondContact O-CD2 3.4Å; L1098-F1102 PolarHBondContact O-N 3.19Å; K1099-F1102 PolarHBondContact O-N 3.26Å; F1102-I1105 PolarHBondContact O-N 3.49Å; F1102-I1106 HydrophobicContact CD1-CD1 4.25Å; F1102-I1106 WeakPolarHBondContact O-CB 3.43Å; F1102-I1106 WeakPolarHBondContact O-CD1 3.22Å; F1102-I1106 VanDerWaalsContact O-CG1 3.27Å; F1102-I1106 WeakPolarHBondContact O-CG1 3.48Å; F1102-I1106 PolarHBondContact O-N 2.73Å; F1102-I1106 VanDerWaalsContact O-N 3.08Å
1103	E	32.1	Very low	31.2	Very low	92 Å²	92	112.9 Å²	112.9	43%	0.43	58%	0.583	S	S	.	*	H	α-helix	trans	-72.1	-33.9	178.9	-74	177.6	159.6	0	0	112.3	K1099 I1105 I1106 C1107	K1099-E1103 VanDerWaalsContact CE-OE1 3.25Å; K1099-E1103 WeakPolarHBondContact CE-OE1 3.32Å; K1099-E1103 HydrophobicContact CG-CG 4.44Å; K1099-E1103 IonicContact NZ-OE1 2.68Å; K1099-E1103 PolarHBondContact NZ-OE1 3.36Å; K1099-E1103 IonicContact NZ-OE2 2.62Å; K1099-E1103 PolarHBondContact NZ-OE2 3.33Å; K1099-E1103 WeakPolarHBondContact O-CB 3.47Å; K1099-E1103 WeakPolarHBondContact O-CG 3.47Å; K1099-E1103 PolarHBondContact O-N 2.89Å; E1103-I1105 VanDerWaalsContact C-N 3.3Å; E1103-I1105 PolarHBondContact O-N 3.45Å; E1103-I1106 PolarHBondContact O-N 3.37Å; E1103-C1107 VanDerWaalsContact O-CB 3.26Å; E1103-C1107 WeakPolarHBondContact O-CB 3.48Å; E1103-C1107 PolarHBondContact O-N 3.35Å
1104	L	33.4	Very low	30.9	Very low	115 Å²	115	116.4 Å²	116.4	60%	0.602	60%	0.596	S	S	*	*	H	α-helix	trans	-66.2	-29.9	170.3	-74.5	167.9	0	0	0	112.9	Q1100	Q1100-L1104 VanDerWaalsContact O-CB 3.23Å; Q1100-L1104 WeakPolarHBondContact O-CB 3.45Å; Q1100-L1104 WeakPolarHBondContact O-CD1 3.24Å; Q1100-L1104 WeakPolarHBondContact O-CG 3.43Å; Q1100-L1104 PolarHBondContact O-N 3.27Å
1105	I	31.9	Very low	30.6	Very low	112 Å²	112	119 Å²	119	57%	0.574	61%	0.61	S	S	*	*	H	α-helix	trans	-78.7	-20.4	174.5	-71.6	168.8	0	0	0	112.1	S1101 F1102 E1103	S1101-I1105 WeakPolarHBondContact O-CB 3.49Å; S1101-I1105 WeakPolarHBondContact O-CD1 3.43Å; S1101-I1105 WeakPolarHBondContact O-CG1 3.11Å; S1101-I1105 PolarHBondContact O-N 2.91Å; S1101-I1105 VanDerWaalsContact O-N 3.16Å; F1102-I1105 PolarHBondContact O-N 3.49Å; E1103-I1105 VanDerWaalsContact C-N 3.3Å; E1103-I1105 PolarHBondContact O-N 3.45Å
1106	I	29.4	Very low	30.3	Very low	115 Å²	115	120.3 Å²	120.3	59%	0.59	62%	0.621	S	S	*	*	H	α-helix	trans	-105	-14	-175.6	-68.6	170.4	0	0	0	112.7	F1102 E1103	F1102-I1106 HydrophobicContact CD1-CD1 4.25Å; F1102-I1106 WeakPolarHBondContact O-CB 3.43Å; F1102-I1106 WeakPolarHBondContact O-CD1 3.22Å; F1102-I1106 VanDerWaalsContact O-CG1 3.27Å; F1102-I1106 WeakPolarHBondContact O-CG1 3.48Å; F1102-I1106 PolarHBondContact O-N 2.73Å; F1102-I1106 VanDerWaalsContact O-N 3.08Å; E1103-I1106 PolarHBondContact O-N 3.37Å
1107	C	24.5	Very low	29.8	Very low	100 Å²	100	125.8 Å²	125.8	68%	0.676	64%	0.638	S	S	*	*			trans	-119.5	42.8	-176.8	-64.6	0	0	0	0	114.6	E1103	E1103-C1107 VanDerWaalsContact O-CB 3.26Å; E1103-C1107 WeakPolarHBondContact O-CB 3.48Å; E1103-C1107 PolarHBondContact O-N 3.35Å
1108	E	24.9	Very low	29.5	Very low	165 Å²	165	130.5 Å²	130.5	77%	0.771	65%	0.65	S	S	*	*	S	Bend	trans	-99.6	146.4	148.3	-69.9	-161.8	151.8	0	0	110	F1110	E1108-F1110 PolarHBondContact O-N 2.87Å
1109	N	27.6	Very low	29.1	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	67%	0.665	S	S	*	*			trans	-68.3	132.7	-161.9	-76.8	-59.5	0	0	0	113.8	S1111	N1109-S1111 PolarHBondContact O-N 3.18Å
1110	F	23.9	Very low	28.9	Very low	214 Å²	214	131.2 Å²	131.2	94%	0.939	67%	0.672	S	S	*	*	S	Bend	trans	-71.9	53.4	166.5	-100	-92	0	0	0	112.2	E1108	E1108-F1110 PolarHBondContact O-N 2.87Å
1111	S	23.8	Very low	28.7	Very low	92 Å²	92	134 Å²	134	64%	0.643	69%	0.685	S	S	*	*	S	Bend	trans	-163.5	128.5	168.5	-80.1	0	0	0	0	109.2	N1109	N1109-S1111 PolarHBondContact O-N 3.18Å
1112	N	23.7	Very low	28.6	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	71%	0.705	S	S	*	*			trans	66.3	88	-176	-53.5	-31.8	0	0	0	115.8
1113	I	26.7	Very low	28.6	Very low	155 Å²	155	138.3 Å²	138.3	80%	0.795	71%	0.705	S	S	*	*				-155.4	118.2	122.2	-94	143.8	0	0	0	107.9
1114	Q	24.1	Very low	28.9	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	70%	0.702	S	S	*	*			trans	-106.8	138.8	153.2	-75.5	-175	-21.7	0	0	106.3
1115	N	26.1	Very low	29.1	Very low	143 Å²	143	134.3 Å²	134.3	77%	0.765	70%	0.695	S	S	*	*	S	Bend	trans	66.5	91.3	-176.8	-39.1	-44.3	0	0	0	113.9
1116	D	27.2	Very low	29.4	Very low	157 Å²	157	131.6 Å²	131.6	84%	0.84	68%	0.679	S	S	*	*				-165.8	-176	85	-107.8	-32.5	0	0	0	111.6
1117	K	29.6	Very low	29.7	Very low	171 Å²	171	128.5 Å²	128.5	74%	0.743	67%	0.665	S	S	*	*			trans	-109.6	147.9	-171.4	-68.3	-175.9	176.6	-179.6	0	114.5
1118	Y	28.5	Very low	30.3	Very low	209 Å²	209	128 Å²	128	82%	0.82	66%	0.656	S	S	*	*			trans	68.6	116.1	167.3	-54.4	-73.3	0	0	0	117.4
1119	C	28.2	Very low	30.9	Very low	92 Å²	92	126 Å²	126	62%	0.622	65%	0.646	S	S	*	*				174.8	94.5	107.9	-170	0	0	0	0	109.6
1120	S	34.9	Very low	31.3	Very low	83 Å²	83	122.4 Å²	122.4	58%	0.58	63%	0.629	S	S	*	*	S	Bend	trans	-146.1	-47.3	178.9	55.8	0	0	0	0	113.2	E1122 L1123 L1124	S1120-E1122 PolarHBondContact O-N 3.33Å; S1120-L1123 PolarHBondContact O-N 2.79Å; S1120-L1124 PolarHBondContact O-N 3.16Å; S1120-L1124 VanDerWaalsContact O-N 3.11Å
1121	E	31.1	Very low	31.8	Very low	167 Å²	167	115.2 Å²	115.2	78%	0.78	60%	0.6	S	S	*	*	H	α-helix	trans	-63.8	-41.3	179.8	-63.3	-173.9	134.9	0	0	112.8	L1124 A1125	E1121-L1124 PolarHBondContact O-N 3.43Å; E1121-A1125 WeakPolarHBondContact O-CB 3.07Å; E1121-A1125 PolarHBondContact O-N 2.58Å
1122	E	34.9	Very low	32.6	Very low	143 Å²	143	114.4 Å²	114.4	67%	0.668	59%	0.591	S	S	*	*	H	α-helix	trans	-66.4	-38	179.4	-64.5	176.4	137.1	0	0	112.4	S1120 A1125 F1126	S1120-E1122 PolarHBondContact O-N 3.33Å; E1122-A1125 PolarHBondContact O-N 3.12Å; E1122-F1126 WeakPolarHBondContact O-CB 3.3Å; E1122-F1126 PolarHBondContact O-N 2.94Å
1123	L	34.6	Very low	33	Very low	93 Å²	93	112.2 Å²	112.2	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-69.9	-38.7	178	-163.1	74.9	0	0	0	111.4	L525 S1120 T1127	L525-L1123 HydrophobicContact CD2-CD1 4.43Å; S1120-L1123 PolarHBondContact O-N 2.79Å; L1123-T1127 WeakPolarHBondContact O-CB 3.19Å; L1123-T1127 PolarHBondContact O-N 2.73Å; L1123-T1127 PolarHBondContact O-OG1 3.06Å
1124	L	37.3	Very low	33.3	Very low	68 Å²	68	108.4 Å²	108.4	36%	0.356	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-43.1	174.2	-174	65.8	0	0	0	111.3	S1120 E1121 T1127 L1128	S1120-L1124 PolarHBondContact O-N 3.16Å; S1120-L1124 VanDerWaalsContact O-N 3.11Å; E1121-L1124 PolarHBondContact O-N 3.43Å; L1124-T1127 PolarHBondContact O-N 3.06Å; L1124-L1128 HydrophobicContact CG-CD1 4.32Å; L1124-L1128 WeakPolarHBondContact O-CG 3.39Å; L1124-L1128 PolarHBondContact O-N 2.98Å
1125	A	38.4	Very low	34.1	Very low	55 Å²	55	103.7 Å²	103.7	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-60.8	-48.9	175.3	0	0	0	0	0	111.7	E1121 E1122 T1127 L1128 E1129	E1121-A1125 WeakPolarHBondContact O-CB 3.07Å; E1121-A1125 PolarHBondContact O-N 2.58Å; E1122-A1125 PolarHBondContact O-N 3.12Å; A1125-T1127 PolarHBondContact O-N 3.28Å; A1125-L1128 PolarHBondContact O-N 3.47Å; A1125-E1129 WeakPolarHBondContact O-CB 3.29Å; A1125-E1129 PolarHBondContact O-N 2.77Å
1126	F	38.7	Very low	34.7	Very low	55 Å²	55	102.3 Å²	102.3	24%	0.241	53%	0.534	C	S	.	.	H	α-helix	trans	-61.3	-42.5	177.4	179.4	-104	0	0	0	112.4	S528 T532 E1122 L1128 E1129 V1130	S528-F1126 VanDerWaalsContact CB-CZ 3.43Å; S528-F1126 VanDerWaalsContact OG-CE1 3.3Å; S528-F1126 WeakPolarHBondContact OG-CE1 3.42Å; S528-F1126 VanDerWaalsContact OG-CE2 3.3Å; S528-F1126 WeakPolarHBondContact OG-CE2 3.14Å; S528-F1126 WeakPolarHBondContact OG-CZ 3.23Å; T532-F1126 HydrophobicContact CG2-CD2 4.48Å; T532-F1126 HydrophobicContact CG2-CE2 3.78Å; E1122-F1126 WeakPolarHBondContact O-CB 3.3Å; E1122-F1126 PolarHBondContact O-N 2.94Å; F1126-L1128 VanDerWaalsContact C-N 3.3Å; F1126-L1128 PolarHBondContact O-N 3.49Å; F1126-E1129 PolarHBondContact O-N 3.37Å; F1126-V1130 HydrophobicContact CD1-CG2 4.33Å; F1126-V1130 HydrophobicContact CD2-CG2 4.25Å; F1126-V1130 HydrophobicContact CE1-CG2 3.8Å; F1126-V1130 HydrophobicContact CE2-CG2 3.72Å; F1126-V1130 HydrophobicContact CZ-CG2 3.45Å; F1126-V1130 VanDerWaalsContact CZ-CG2 3.45Å; F1126-V1130 WeakPolarHBondContact O-CG2 3.42Å; F1126-V1130 PolarHBondContact O-N 2.97Å
1127	T	35.5	Very low	35.1	Very low	50 Å²	50	99.5 Å²	99.5	31%	0.307	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-39.6	178	-55.2	0	0	0	0	111.4	L1123 L1124 A1125 I1131	L1123-T1127 WeakPolarHBondContact O-CB 3.19Å; L1123-T1127 PolarHBondContact O-N 2.73Å; L1123-T1127 PolarHBondContact O-OG1 3.06Å; L1124-T1127 PolarHBondContact O-N 3.06Å; A1125-T1127 PolarHBondContact O-N 3.28Å; T1127-I1131 HydrophobicContact CG2-CD1 4.08Å; T1127-I1131 WeakPolarHBondContact O-CB 3.33Å; T1127-I1131 WeakPolarHBondContact O-CD1 3.35Å; T1127-I1131 VanDerWaalsContact O-CG1 3.26Å; T1127-I1131 WeakPolarHBondContact O-CG1 3.26Å; T1127-I1131 PolarHBondContact O-N 3.34Å
1128	L	35.9	Very low	35.1	Very low	90 Å²	90	95.9 Å²	95.9	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-69.9	-39.7	174.6	-70	168.5	0	0	0	112.2	L1124 A1125 F1126 I1131 V1132	L1124-L1128 HydrophobicContact CG-CD1 4.32Å; L1124-L1128 WeakPolarHBondContact O-CG 3.39Å; L1124-L1128 PolarHBondContact O-N 2.98Å; A1125-L1128 PolarHBondContact O-N 3.47Å; F1126-L1128 VanDerWaalsContact C-N 3.3Å; F1126-L1128 PolarHBondContact O-N 3.49Å; L1128-I1131 PolarHBondContact O-N 3.32Å; L1128-V1132 VanDerWaalsContact O-CB 3.3Å; L1128-V1132 WeakPolarHBondContact O-CB 3.36Å; L1128-V1132 WeakPolarHBondContact O-CG2 3.4Å; L1128-V1132 PolarHBondContact O-N 3.45Å
1129	E	37.4	Very low	35.2	Very low	123 Å²	123	90.6 Å²	90.6	58%	0.575	49%	0.488	S	S	*	.	H	α-helix	trans	-66.3	-39.3	180	-172.6	166.5	-139.8	0	0	112.6	A1125 F1126 N1133	A1125-E1129 WeakPolarHBondContact O-CB 3.29Å; A1125-E1129 PolarHBondContact O-N 2.77Å; F1126-E1129 PolarHBondContact O-N 3.37Å; E1129-N1133 PolarHBondContact O-N 2.88Å; E1129-N1133 PolarHBondContact O-ND2 2.88Å
1130	V	37.7	Very low	35.4	Very low	76 Å²	76	89 Å²	89	46%	0.461	47%	0.473	S	S	.	.	H	α-helix	trans	-65.9	-44.7	173.3	173.9	0	0	0	0	111.2	F1126 V1132 N1133	F1126-V1130 HydrophobicContact CD1-CG2 4.33Å; F1126-V1130 HydrophobicContact CD2-CG2 4.25Å; F1126-V1130 HydrophobicContact CE1-CG2 3.8Å; F1126-V1130 HydrophobicContact CE2-CG2 3.72Å; F1126-V1130 HydrophobicContact CZ-CG2 3.45Å; F1126-V1130 VanDerWaalsContact CZ-CG2 3.45Å; F1126-V1130 WeakPolarHBondContact O-CG2 3.42Å; F1126-V1130 PolarHBondContact O-N 2.97Å; V1130-V1132 VanDerWaalsContact C-N 3.33Å; V1130-V1132 PolarHBondContact O-N 3.28Å; V1130-N1133 PolarHBondContact O-N 3.31Å
1131	I	34.5	Very low	35.3	Very low	62 Å²	62	88.5 Å²	88.5	32%	0.318	46%	0.464	S	S	.	.	H	α-helix	trans	-67.7	-31.3	179.3	-69	171.3	0	0	0	112.1	L1094 L1098 T1127 L1128	L1094-I1131 HydrophobicContact CD2-CG2 4.47Å; L1098-I1131 HydrophobicContact CD2-CD1 4.06Å; T1127-I1131 HydrophobicContact CG2-CD1 4.08Å; T1127-I1131 WeakPolarHBondContact O-CB 3.33Å; T1127-I1131 WeakPolarHBondContact O-CD1 3.35Å; T1127-I1131 VanDerWaalsContact O-CG1 3.26Å; T1127-I1131 WeakPolarHBondContact O-CG1 3.26Å; T1127-I1131 PolarHBondContact O-N 3.34Å; L1128-I1131 PolarHBondContact O-N 3.32Å
1132	V	39.5	Very low	35.3	Very low	75 Å²	75	84.3 Å²	84.3	46%	0.455	44%	0.441	S	S	.	.	H	α-helix	trans	-76.9	-25.2	179.8	165.4	0	0	0	0	112.9	L1128 V1130 D1134 Y1138	L1128-V1132 VanDerWaalsContact O-CB 3.3Å; L1128-V1132 WeakPolarHBondContact O-CB 3.36Å; L1128-V1132 WeakPolarHBondContact O-CG2 3.4Å; L1128-V1132 PolarHBondContact O-N 3.45Å; V1130-V1132 VanDerWaalsContact C-N 3.33Å; V1130-V1132 PolarHBondContact O-N 3.28Å; V1132-D1134 VanDerWaalsContact C-N 3.3Å; V1132-D1134 PolarHBondContact O-N 3.27Å; V1132-Y1138 HydrophobicContact CG1-CE2 3.95Å; V1132-Y1138 VanDerWaalsContact O-CD2 3.27Å; V1132-Y1138 WeakPolarHBondContact O-CD2 3.5Å; V1132-Y1138 WeakPolarHBondContact O-CE2 3.37Å
1133	N	32.6	Very low	35.1	Very low	112 Å²	112	83 Å²	83	60%	0.599	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-10	-177.6	-84	-51.7	0	0	0	114.9	E1129 V1130 K1135	E1129-N1133 PolarHBondContact O-N 2.88Å; E1129-N1133 PolarHBondContact O-ND2 2.88Å; V1130-N1133 PolarHBondContact O-N 3.31Å; N1133-K1135 PolarHBondContact O-N 3.27Å; N1133-K1135 VanDerWaalsContact O-N 3.11Å
1134	D	32.2	Very low	35.1	Very low	74 Å²	74	83 Å²	83	40%	0.396	43%	0.431	S	S	.	.			trans	-77.3	99.2	178	-165.2	-16.8	0	0	0	112.1	V1132 V1136 Y1137	V1132-D1134 VanDerWaalsContact C-N 3.3Å; V1132-D1134 PolarHBondContact O-N 3.27Å; D1134-V1136 PolarHBondContact O-N 2.92Å; D1134-V1136 VanDerWaalsContact O-N 3.11Å; D1134-V1136 PolarHBondContact OD1-N 3.32Å; D1134-Y1137 PolarHBondContact O-N 3.41Å
1135	K	41.1	Very low	34.6	Very low	79 Å²	79	84.5 Å²	84.5	34%	0.343	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.7	-169.9	-78.9	179.8	164.8	-174.1	0	114.9	T263 N265 N1133 Y1137	T263-K1135 WeakPolarHBondContact O-CE 3.46Å; T263-K1135 PolarHBondContact O-NZ 3.46Å; N265-K1135 PolarHBondContact OD1-NZ 3.03Å; N1133-K1135 PolarHBondContact O-N 3.27Å; N1133-K1135 VanDerWaalsContact O-N 3.11Å; K1135-Y1137 VanDerWaalsContact C-N 3.28Å; K1135-Y1137 PolarHBondContact O-N 2.92Å
1136	V	39.1	Very low	34.2	Very low	114 Å²	114	84.7 Å²	84.7	69%	0.691	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-28	-177.6	-176.2	0	0	0	0	111.8	D1134	D1134-V1136 PolarHBondContact O-N 2.92Å; D1134-V1136 VanDerWaalsContact O-N 3.11Å; D1134-V1136 PolarHBondContact OD1-N 3.32Å
1137	Y	34.5	Very low	33.8	Very low	98 Å²	98	86.8 Å²	86.8	38%	0.384	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-6.5	-178.1	-76.9	-84.2	0	0	0	115	L1091 D1134 K1135 S1139 N1140 I1141	L1091-Y1137 HydrophobicContact CD1-CE1 4.11Å; L1091-Y1137 WeakPolarHBondContact CD1-OH 3.31Å; D1134-Y1137 PolarHBondContact O-N 3.41Å; K1135-Y1137 VanDerWaalsContact C-N 3.28Å; K1135-Y1137 PolarHBondContact O-N 2.92Å; Y1137-S1139 PolarHBondContact O-N 2.93Å; Y1137-N1140 PolarHBondContact O-N 3.21Å; Y1137-N1140 VanDerWaalsContact O-N 3.11Å; Y1137-I1141 HydrophobicContact CD1-CD1 4.34Å; Y1137-I1141 HydrophobicContact CG-CD1 4.35Å; Y1137-I1141 PolarHBondContact O-N 3.08Å; Y1137-I1141 VanDerWaalsContact O-N 3.08Å
1138	Y	30.2	Very low	33.5	Very low	95 Å²	95	90.7 Å²	90.7	37%	0.373	46%	0.46	S	S	.	.	H	α-helix	trans	-53.7	-49.7	-165.5	-149.1	-86.9	0	0	0	113.7	V1132 Y1142	V1132-Y1138 HydrophobicContact CG1-CE2 3.95Å; V1132-Y1138 VanDerWaalsContact O-CD2 3.27Å; V1132-Y1138 WeakPolarHBondContact O-CD2 3.5Å; V1132-Y1138 WeakPolarHBondContact O-CE2 3.37Å; Y1138-Y1142 WeakPolarHBondContact O-CB 3.41Å; Y1138-Y1142 PolarHBondContact O-N 2.98Å
1139	S	31.3	Very low	33	Very low	98 Å²	98	95.9 Å²	95.9	69%	0.685	47%	0.474	S	S	*	.	H	α-helix	trans	-66.8	-43.3	-179.9	-177.4	0	0	0	0	112.4	Y1137 I1141 E1143	Y1137-S1139 PolarHBondContact O-N 2.93Å; S1139-I1141 PolarHBondContact O-N 3.4Å; S1139-E1143 WeakPolarHBondContact O-CB 2.97Å; S1139-E1143 PolarHBondContact O-N 3.31Å
1140	N	32	Very low	32.5	Very low	58 Å²	58	97.7 Å²	97.7	31%	0.31	48%	0.48	S	S	.	.	H	α-helix	trans	-79.3	-21.7	-168.5	-127.4	-47.6	0	0	0	113.4	Y1137 K1144	Y1137-N1140 PolarHBondContact O-N 3.21Å; Y1137-N1140 VanDerWaalsContact O-N 3.11Å; N1140-K1144 WeakPolarHBondContact O-CG 2.8Å; N1140-K1144 PolarHBondContact O-NZ 3.26Å; N1140-K1144 PolarHBondContact OD1-NZ 3.16Å
1141	I	31.7	Very low	32	Very low	74 Å²	74	101.7 Å²	101.7	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-92.3	-43	173.6	-63	-177.5	0	0	0	111.1	Y1137 S1139 E1143 K1144 L1145	Y1137-I1141 HydrophobicContact CD1-CD1 4.34Å; Y1137-I1141 HydrophobicContact CG-CD1 4.35Å; Y1137-I1141 PolarHBondContact O-N 3.08Å; Y1137-I1141 VanDerWaalsContact O-N 3.08Å; S1139-I1141 PolarHBondContact O-N 3.4Å; I1141-E1143 VanDerWaalsContact C-N 3.35Å; I1141-E1143 PolarHBondContact O-N 2.89Å; I1141-K1144 PolarHBondContact O-N 3.14Å; I1141-K1144 VanDerWaalsContact O-N 3.08Å; I1141-L1145 HydrophobicContact CG2-CD1 3.89Å; I1141-L1145 HydrophobicContact CG2-CG 4.36Å; I1141-L1145 PolarHBondContact O-N 3.41Å
1142	Y	31.2	Very low	31.5	Very low	78 Å²	78	102.6 Å²	102.6	31%	0.306	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-40.4	-177.9	-158	-92.9	0	0	0	112	Y1138 K1144 L1145 N1146	Y1138-Y1142 WeakPolarHBondContact O-CB 3.41Å; Y1138-Y1142 PolarHBondContact O-N 2.98Å; Y1142-K1144 VanDerWaalsContact C-N 3.3Å; Y1142-K1144 PolarHBondContact O-N 3.45Å; Y1142-L1145 PolarHBondContact O-N 3.3Å; Y1142-N1146 VanDerWaalsContact O-CB 3.22Å; Y1142-N1146 WeakPolarHBondContact O-CB 3.48Å; Y1142-N1146 PolarHBondContact O-N 3.46Å
1143	E	32.4	Very low	30.7	Very low	117 Å²	117	106.5 Å²	106.5	55%	0.547	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-34.1	175.2	-171.6	173.1	-134.6	0	0	112.4	S1139 I1141 N1147	S1139-E1143 WeakPolarHBondContact O-CB 2.97Å; S1139-E1143 PolarHBondContact O-N 3.31Å; I1141-E1143 VanDerWaalsContact C-N 3.35Å; I1141-E1143 PolarHBondContact O-N 2.89Å; E1143-N1147 VanDerWaalsContact O-CB 3.32Å; E1143-N1147 WeakPolarHBondContact O-CB 3.47Å; E1143-N1147 PolarHBondContact O-N 3.38Å; E1143-N1147 PolarHBondContact O-ND2 3.11Å
1144	K	33	Very low	30.3	Very low	92 Å²	92	109.1 Å²	109.1	40%	0.4	51%	0.513	S	S	.	.	H	α-helix	trans	-75.2	-38.4	178	-66.7	-174.7	-174.5	75.6	0	112.5	N1140 I1141 Y1142 H1148	N1140-K1144 WeakPolarHBondContact O-CG 2.8Å; N1140-K1144 PolarHBondContact O-NZ 3.26Å; N1140-K1144 PolarHBondContact OD1-NZ 3.16Å; I1141-K1144 PolarHBondContact O-N 3.14Å; I1141-K1144 VanDerWaalsContact O-N 3.08Å; Y1142-K1144 VanDerWaalsContact C-N 3.3Å; Y1142-K1144 PolarHBondContact O-N 3.45Å; K1144-H1148 PolarHBondContact O-N 3.42Å
1145	L	28	Very low	30	Very low	99 Å²	99	111.5 Å²	111.5	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-70.1	-44.6	175.4	-74.8	172	0	0	0	112.1	I1141 Y1142 N1147 H1148 W1149	I1141-L1145 HydrophobicContact CG2-CD1 3.89Å; I1141-L1145 HydrophobicContact CG2-CG 4.36Å; I1141-L1145 PolarHBondContact O-N 3.41Å; Y1142-L1145 PolarHBondContact O-N 3.3Å; L1145-N1147 PolarHBondContact O-N 3.19Å; L1145-H1148 WeakPolarHBondContact O-CA 3.29Å; L1145-H1148 WeakPolarHBondContact O-CB 3.25Å; L1145-H1148 PolarHBondContact O-N 3.11Å; L1145-W1149 PolarHBondContact O-N 3.1Å
1146	N	29.9	Very low	29.1	Very low	60 Å²	60	114.4 Å²	114.4	32%	0.321	54%	0.538	S	S	.	.	H	α-helix	trans	-66.7	-37.3	-177.9	-159.2	13.5	0	0	0	111.8	Y1142 H1148 W1149 F1150	Y1142-N1146 VanDerWaalsContact O-CB 3.22Å; Y1142-N1146 WeakPolarHBondContact O-CB 3.48Å; Y1142-N1146 PolarHBondContact O-N 3.46Å; N1146-H1148 PolarHBondContact O-N 2.76Å; N1146-W1149 PolarHBondContact O-N 3.11Å; N1146-F1150 PolarHBondContact O-N 3.22Å; N1146-F1150 VanDerWaalsContact O-N 3.1Å
1147	N	31.1	Very low	28.4	Very low	99 Å²	99	113.8 Å²	113.8	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-17.6	170.8	-82.9	-63.5	0	0	0	114.2	E1143 L1145 K1151	E1143-N1147 VanDerWaalsContact O-CB 3.32Å; E1143-N1147 WeakPolarHBondContact O-CB 3.47Å; E1143-N1147 PolarHBondContact O-N 3.38Å; E1143-N1147 PolarHBondContact O-ND2 3.11Å; L1145-N1147 PolarHBondContact O-N 3.19Å; N1147-K1151 WeakPolarHBondContact O-CG 3.2Å
1148	H	29.1	Very low	28	Very low	131 Å²	131	115.7 Å²	115.7	61%	0.606	54%	0.544	S	S	*	.	H	α-helix	trans	-88.3	-41.6	170.7	-105.1	-87.2	0	0	0	112.3	K1144 L1145 N1146 F1150 K1151 L1152	K1144-H1148 PolarHBondContact O-N 3.42Å; L1145-H1148 WeakPolarHBondContact O-CA 3.29Å; L1145-H1148 WeakPolarHBondContact O-CB 3.25Å; L1145-H1148 PolarHBondContact O-N 3.11Å; N1146-H1148 PolarHBondContact O-N 2.76Å; H1148-F1150 VanDerWaalsContact C-N 3.35Å; H1148-F1150 PolarHBondContact O-N 2.96Å; H1148-K1151 CarbonylContact O-C 3.58Å; H1148-K1151 WeakPolarHBondContact O-CA 3.4Å; H1148-K1151 PolarHBondContact O-N 3.44Å; H1148-L1152 WeakPolarHBondContact O-CG 3.28Å; H1148-L1152 PolarHBondContact O-N 2.83Å; H1148-L1152 VanDerWaalsContact O-N 3.14Å
1149	W	25.5	Very low	27.7	Very low	199 Å²	199	119.6 Å²	119.6	75%	0.754	57%	0.566	S	S	*	*	H	α-helix	trans	-62.1	-38.8	177.5	-87.2	65.9	0	0	0	112.6	L1145 N1146 K1151 L1152	L1145-W1149 PolarHBondContact O-N 3.1Å; N1146-W1149 PolarHBondContact O-N 3.11Å; W1149-K1151 PolarHBondContact O-N 3.01Å; W1149-L1152 PolarHBondContact O-N 3.3Å
1150	F	25.8	Very low	27.4	Very low	161 Å²	161	122.6 Å²	122.6	71%	0.706	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	3.1	171.1	-84.6	-81.6	0	0	0	115	N1146 H1148	N1146-F1150 PolarHBondContact O-N 3.22Å; N1146-F1150 VanDerWaalsContact O-N 3.1Å; H1148-F1150 VanDerWaalsContact C-N 3.35Å; H1148-F1150 PolarHBondContact O-N 2.96Å
1151	K	26.4	Very low	27.1	Very low	160 Å²	160	127.5 Å²	127.5	70%	0.696	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	5	171.2	-80.5	-173.6	172.2	-177.4	0	113.6	N1147 H1148 W1149 E1153 Y1154	N1147-K1151 WeakPolarHBondContact O-CG 3.2Å; H1148-K1151 CarbonylContact O-C 3.58Å; H1148-K1151 WeakPolarHBondContact O-CA 3.4Å; H1148-K1151 PolarHBondContact O-N 3.44Å; W1149-K1151 PolarHBondContact O-N 3.01Å; K1151-E1153 PolarHBondContact O-N 3.37Å; K1151-Y1154 PolarHBondContact O-N 3.44Å
1152	L	24.4	Very low	26.8	Very low	82 Å²	82	133.3 Å²	133.3	43%	0.429	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	28.5	-173	-95.6	171.7	0	0	0	115.8	H1148 W1149 I1155	H1148-L1152 WeakPolarHBondContact O-CG 3.28Å; H1148-L1152 PolarHBondContact O-N 2.83Å; H1148-L1152 VanDerWaalsContact O-N 3.14Å; W1149-L1152 PolarHBondContact O-N 3.3Å; L1152-I1155 HydrophobicContact CD2-CB 4.09Å; L1152-I1155 HydrophobicContact CD2-CD1 3.46Å; L1152-I1155 VanDerWaalsContact CD2-CD1 3.46Å; L1152-I1155 HydrophobicContact CD2-CG1 3.61Å
1153	E	23.8	Very low	26.6	Very low	157 Å²	157	133 Å²	133	73%	0.734	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-21	153.8	-72.8	-175.4	127.3	0	0	111.1	K1151 I1155 H1156	K1151-E1153 PolarHBondContact O-N 3.37Å; E1153-I1155 VanDerWaalsContact C-N 3.27Å; E1153-I1155 PolarHBondContact O-N 2.93Å; E1153-I1155 VanDerWaalsContact O-N 3.16Å; E1153-H1156 PolarHBondContact O-N 2.86Å; E1153-H1156 VanDerWaalsContact O-N 3.08Å
1154	Y	23.8	Very low	26.2	Very low	167 Å²	167	136 Å²	136	66%	0.655	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-0.8	-172	-137.3	-98.4	0	0	0	116.5	K1151	K1151-Y1154 PolarHBondContact O-N 3.44Å
1155	I	24.8	Very low	26	Very low	124 Å²	124	139.7 Å²	139.7	64%	0.636	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-11.7	169.4	-72.1	-174.3	0	0	0	111.7	L1152 E1153	L1152-I1155 HydrophobicContact CD2-CB 4.09Å; L1152-I1155 HydrophobicContact CD2-CD1 3.46Å; L1152-I1155 VanDerWaalsContact CD2-CD1 3.46Å; L1152-I1155 HydrophobicContact CD2-CG1 3.61Å; E1153-I1155 VanDerWaalsContact C-N 3.27Å; E1153-I1155 PolarHBondContact O-N 2.93Å; E1153-I1155 VanDerWaalsContact O-N 3.16Å
1156	H	23.9	Very low	25.9	Very low	140 Å²	140	140.6 Å²	140.6	65%	0.648	69%	0.691	S	S	*	*	S	Bend	trans	-93.4	-3.2	177.6	-145.4	-58.5	0	0	0	114.3	E1153	E1153-H1156 PolarHBondContact O-N 2.86Å; E1153-H1156 VanDerWaalsContact O-N 3.08Å
1157	E	24.8	Very low	25.6	Very low	100 Å²	100	143.6 Å²	143.6	47%	0.467	71%	0.712	S	S	.	*	S	Bend	trans	-97.1	-11.3	172.9	-91.2	-148.1	98	0	0	114.6	K1161	E1157-K1161 IonicContact OE1-NZ 3.17Å; E1157-K1161 PolarHBondContact OE1-NZ 3.5Å
1158	L	24.2	Very low	25.5	Very low	138 Å²	138	149.3 Å²	149.3	72%	0.723	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	4.6	-173.4	-81.9	168.5	0	0	0	115.5
1159	Q	25.3	Very low	25.5	Very low	177 Å²	177	148.6 Å²	148.6	83%	0.827	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	14.3	176.5	-72.5	-170.1	-41.3	0	0	114.4
1160	M	24.3	Very low	25.6	Very low	161 Å²	161	144.8 Å²	144.8	79%	0.793	74%	0.739	S	S	*	*	S	Bend	trans	-132.9	35.9	178.2	-73.6	-69.8	160.1	0	0	112.4
1161	K	25.3	Very low	25.4	Very low	162 Å²	162	142.1 Å²	142.1	70%	0.704	74%	0.74	S	S	*	*			trans	-139.6	11.9	177.8	-106.5	168.4	-171.2	157.9	0	114.9	E1157	E1157-K1161 IonicContact OE1-NZ 3.17Å; E1157-K1161 PolarHBondContact OE1-NZ 3.5Å
1162	E	26.6	Very low	25.3	Very low	196 Å²	196	140.8 Å²	140.8	92%	0.916	74%	0.741	S	S	*	*	S	Bend	trans	-78.3	122.6	157.9	-65.2	-165.7	142.5	0	0	108
1163	G	26.8	Very low	25.3	Very low	71 Å²	71	142.6 Å²	142.6	73%	0.732	75%	0.75	S	S	*	*			trans	-74.9	148.3	-175.3	0	0	0	0	0	112.1	L1165	G1163-L1165 PolarHBondContact O-N 3.34Å
1164	N	24.5	Very low	25.4	Very low	179 Å²	179	144.4 Å²	144.4	96%	0.957	75%	0.752	S	S	*	*			trans	-57.6	104.3	169.2	-71.7	-48.8	0	0	0	110.3
1165	L	27.1	Very low	25.5	Very low	171 Å²	171	142.2 Å²	142.2	90%	0.895	75%	0.752	S	S	*	*			trans	-106	132.1	154.3	-151.3	76	0	0	0	108.5	G1163	G1163-L1165 PolarHBondContact O-N 3.34Å
1166	C	25.6	Very low	25.8	Very low	117 Å²	117	142.9 Å²	142.9	79%	0.791	76%	0.757	S	S	*	*			trans	-71.1	140.8	-168.1	-169.8	0	0	0	0	112.2
1167	T	25.1	Very low	26	Very low	124 Å²	124	141.5 Å²	141.5	76%	0.761	75%	0.754	S	S	*	*			trans	-64.4	127.7	171.4	49.5	0	0	0	0	111.9
1168	Y	28.7	Very low	26.4	Very low	219 Å²	219	142.9 Å²	142.9	86%	0.859	76%	0.764	S	S	*	*			trans	-150.2	161	154.8	-123.4	-86	0	0	0	111
1169	C	27.9	Very low	26.7	Very low	116 Å²	116	143.3 Å²	143.3	78%	0.784	77%	0.768	S	S	*	*			trans	72.6	75	175.7	-63.2	0	0	0	0	117.2
1170	C	28.3	Very low	27.1	Very low	119 Å²	119	140.7 Å²	140.7	80%	0.804	76%	0.759	S	S	*	*			trans	-5.6	130.5	139.8	-53.8	0	0	0	0	119.2
1171	S	22	Very low	27.3	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	76%	0.76	S	S	*	*				41	141.5	109	-54.7	0	0	0	0	122.6
1172	D	25	Very low	27.5	Very low	133 Å²	133	139.7 Å²	139.7	71%	0.711	76%	0.759	S	S	*	*			trans	89.6	91.2	140.2	-68.2	7.4	0	0	0	121.7
1173	N	23.3	Very low	27.7	Very low	119 Å²	119	137.9 Å²	137.9	64%	0.636	76%	0.756	S	S	*	*				96.3	150	109.5	-67.4	-33.2	0	0	0	123.2
1174	Y	26.5	Very low	27.8	Very low	196 Å²	196	140.6 Å²	140.6	77%	0.769	75%	0.753	S	S	*	*			trans	75.9	106.5	162.4	-66.2	-65	0	0	0	120.9
1175	N	26.1	Very low	28	Very low	120 Å²	120	136.2 Å²	136.2	64%	0.642	73%	0.733	S	S	*	*				31.9	135	116.4	-56.3	23.7	0	0	0	119.5
1176	D	31.3	Very low	28.2	Very low	139 Å²	139	135 Å²	135	74%	0.743	73%	0.728	S	S	*	*				-156.6	124.9	97.8	-86.9	-27.2	0	0	0	111.2
1177	N	26.5	Very low	28.2	Very low	111 Å²	111	135.7 Å²	135.7	59%	0.594	72%	0.723	S	S	*	*				51.8	142	117.2	-39.3	-23.9	0	0	0	122.8
1178	D	33.8	Very low	28.5	Very low	128 Å²	128	138 Å²	138	68%	0.684	73%	0.725	S	S	*	*				169.1	149.7	112.9	-83.8	-3.3	0	0	0	110.5
1179	N	31.5	Very low	28.5	Very low	148 Å²	148	134.2 Å²	134.2	79%	0.791	72%	0.72	S	S	*	*			trans	73.6	81.1	-174.7	-42.4	-94	0	0	0	113.2
1180	D	32.2	Very low	28.5	Very low	121 Å²	121	132.1 Å²	132.1	65%	0.647	72%	0.718	S	S	*	*			cis	77.2	113.3	44.4	-46	-36.6	0	0	0	111.3
1181	E	29.5	Very low	28.6	Very low	173 Å²	173	134 Å²	134	81%	0.808	72%	0.721	S	S	*	*				75.6	146.1	74.4	-83.2	-171.1	-165.4	0	0	113
1182	D	28.2	Very low	28.8	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	72%	0.721	S	S	*	*			cis	-165.4	161.4	-20.7	-141.8	16.8	0	0	0	108.4
1183	D	32.7	Very low	29.2	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	72%	0.72	S	S	*	*			trans	-176.8	140.3	152.6	-113	-20.4	0	0	0	113
1184	N	27	Very low	29.5	Very low	127 Å²	127	134.3 Å²	134.3	68%	0.679	71%	0.714	S	S	*	*				-177.4	174.1	-62.9	-179.3	3.4	0	0	0	108.1
1185	V	30.3	Very low	29.7	Very low	88 Å²	88	132.4 Å²	132.4	53%	0.533	71%	0.71	S	S	.	*			trans	78	99.4	160.6	-162.8	0	0	0	0	119.3
1186	N	30.8	Very low	29.9	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	72%	0.717	S	S	*	*				172.3	102.4	116	-89.5	-60.6	0	0	0	109.4
1187	N	26.1	Very low	29.5	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	72%	0.722	S	S	*	*				49.8	118.6	83.1	-72.9	-29.6	0	0	0	113.5
1188	E	31.6	Very low	29.7	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.804	73%	0.734	S	S	*	*				-149.5	137.6	63.8	-83.8	-173.3	157.4	0	0	112.7
1189	N	27.6	Very low	29.3	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	74%	0.74	S	S	*	*				49.3	122.3	98.6	-58.5	-47.1	0	0	0	116.1
1190	G	29.1	Very low	29.1	Very low	72 Å²	72	147 Å²	147	74%	0.742	74%	0.741	S	S	*	*			cis	149.8	161	-6.4	0	0	0	0	0	112.3
1191	N	30.3	Very low	28.9	Very low	159 Å²	159	147.6 Å²	147.6	85%	0.85	74%	0.744	S	S	*	*			trans	-161	116.7	149.7	-134.7	-18.6	0	0	0	112.4
1192	D	26	Very low	28.9	Very low	136 Å²	136	147.6 Å²	147.6	73%	0.727	74%	0.744	S	S	*	*			trans	-62.4	152.8	159.6	-106.5	-60.1	0	0	0	110.4
1193	N	32.1	Very low	28.8	Very low	131 Å²	131	146.2 Å²	146.2	70%	0.701	75%	0.745	S	S	*	*				-174.1	109.7	126.1	-103.2	-70.5	0	0	0	112.9
1194	N	31.1	Very low	28.4	Very low	95 Å²	95	146.2 Å²	146.2	51%	0.508	74%	0.74	S	S	.	*				47.4	140.5	114.4	-67	-40.6	0	0	0	121.5
1195	K	29.5	Very low	28.2	Very low	156 Å²	156	149.4 Å²	149.4	68%	0.678	74%	0.742	S	S	*	*			cis	-178.5	153.4	-16.9	-123.5	179	-169	93.7	0	108.1
1196	K	30.2	Very low	27.9	Very low	184 Å²	184	152.9 Å²	152.9	80%	0.8	75%	0.75	S	S	*	*			trans	69	129.1	163.1	-56.6	153.8	180	171.8	0	115.4
1197	R	24.4	Very low	27.4	Very low	221 Å²	221	153.3 Å²	153.3	83%	0.834	75%	0.752	S	S	*	*			cis	69.5	107.7	44.3	-65.9	-173.2	172.3	-179.2	-2	115.7
1198	K	29	Very low	27.2	Very low	197 Å²	197	154.8 Å²	154.8	86%	0.857	76%	0.759	S	S	*	*				172.5	110.7	119.4	-92.2	169.4	-179.6	-171.3	0	108.8
1199	H	25.5	Very low	26.9	Very low	173 Å²	173	154.7 Å²	154.7	80%	0.801	76%	0.758	S	S	*	*				74.1	94.3	71.6	-82	-61.1	0	0	0	115.9
1200	Q	28.4	Very low	26.7	Very low	176 Å²	176	153.3 Å²	153.3	82%	0.822	76%	0.76	S	S	*	*			trans	-158.6	135.5	136.8	-87.9	176	1.5	0	0	104.6
1201	N	27.9	Very low	26.5	Very low	134 Å²	134	155.3 Å²	155.3	72%	0.717	76%	0.763	S	S	*	*			cis	-145.4	177.5	-3.7	-100.6	-16.5	0	0	0	111.6
1202	Q	28.1	Very low	26.2	Very low	173 Å²	173	156.1 Å²	156.1	81%	0.808	77%	0.766	S	S	*	*			trans	-45.9	162.2	170	-70.2	149.9	-42.4	0	0	115.7
1203	S	26.6	Very low	26.2	Very low	101 Å²	101	156.6 Å²	156.6	71%	0.706	76%	0.764	S	S	*	*			cis	-174.5	165.7	-14.3	52.9	0	0	0	0	112.3
1204	H	24.7	Very low	25.8	Very low	159 Å²	159	156.8 Å²	156.8	74%	0.736	76%	0.764	S	S	*	*			trans	-2.9	149.8	141.6	-75	-59.6	0	0	0	119.8
1205	R	23.4	Very low	25.4	Very low	193 Å²	193	160 Å²	160	73%	0.728	78%	0.775	S	S	*	*			cis	-172.4	159.4	-6.1	-147.1	175.7	-177.1	178.1	-0.2	108.9
1206	F	22.8	Very low	25.4	Very low	162 Å²	162	163.3 Å²	163.3	71%	0.711	78%	0.784	S	S	*	*			trans	63.3	130.8	162	-76	-70.2	0	0	0	121.9
1207	L	21.4	Very low	25.3	Very low	154 Å²	154	161.4 Å²	161.4	81%	0.806	78%	0.783	S	S	*	*			trans	38.1	108.4	141.8	-66.2	166.4	0	0	0	121
1208	L	21.6	Very low	25.2	Very low	161 Å²	161	158.7 Å²	158.7	84%	0.843	78%	0.784	S	S	*	*				-172.3	164.5	118	-101.6	161.3	0	0	0	112.6
1209	E	25.7	Very low	25	Very low	170 Å²	170	157.6 Å²	157.6	79%	0.794	78%	0.782	S	S	*	*			trans	56.7	90.1	157.1	-68.4	175.4	142.2	0	0	122.1
1210	S	23.6	Very low	25.4	Very low	113 Å²	113	158.3 Å²	158.3	79%	0.79	79%	0.785	S	S	*	*				24.4	126	120.7	-51.2	0	0	0	0	123.1
1211	S	23.3	Very low	25.2	Very low	114 Å²	114	154.9 Å²	154.9	80%	0.797	78%	0.78	S	S	*	*			trans	77	95.8	131.7	-58.5	0	0	0	0	122
1212	L	26	Very low	25.3	Very low	176 Å²	176	157.6 Å²	157.6	92%	0.921	79%	0.786	S	S	*	*				-165.3	169.7	121.7	-107	165	0	0	0	111.8
1213	E	25.8	Very low	25.5	Very low	146 Å²	146	157.6 Å²	157.6	68%	0.682	79%	0.786	S	S	*	*			trans	-139.2	151.4	-143.3	-173	62.4	-98.8	0	0	114.9
1214	L	23	Very low	25.5	Very low	134 Å²	134	159.1 Å²	159.1	70%	0.702	79%	0.785	S	S	*	*			trans	44	122.6	162.8	-84	163.8	0	0	0	122.4
1215	H	22.9	Very low	25.6	Very low	162 Å²	162	156.3 Å²	156.3	75%	0.75	78%	0.783	S	S	*	*				167.5	126	98.7	-126.7	75.7	0	0	0	114.4
1216	R	28.8	Very low	25.9	Very low	227 Å²	227	153.9 Å²	153.9	86%	0.857	78%	0.784	S	S	*	*			trans	170.3	113.1	133.9	-98.2	173.3	174.8	147.3	1.3	116.6
1217	N	27.5	Very low	26.1	Very low	144 Å²	144	150.6 Å²	150.6	77%	0.77	78%	0.782	S	S	*	*			trans	75.7	155.4	133.1	-63.1	17.6	0	0	0	123.4
1218	L	23	Very low	26.5	Very low	164 Å²	164	150.1 Å²	150.1	86%	0.859	78%	0.78	S	S	*	*			trans	-133.8	174.6	-171.4	-78.2	152.4	0	0	0	111.3
1219	Q	26.1	Very low	26.9	Very low	174 Å²	174	149.9 Å²	149.9	81%	0.813	78%	0.779	S	S	*	*			trans	76.6	124.5	160.8	-57.2	-170.4	-4.6	0	0	120.7
1220	H	32.4	Very low	26.9	Very low	187 Å²	187	149.4 Å²	149.4	87%	0.866	78%	0.782	S	S	*	*				-166.8	167	110.4	-106.6	-80.1	0	0	0	111
1221	S	25	Very low	27.2	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	78%	0.782	S	S	*	*			trans	-154.5	-179	-175.6	63.1	0	0	0	0	110.5
1222	K	30.5	Very low	27.1	Very low	191 Å²	191	151.9 Å²	151.9	83%	0.83	78%	0.784	S	S	*	*			cis	-161.7	-158.3	23	-153.5	179.2	175.5	-179	0	110.1
1223	Q	30.6	Very low	27.2	Very low	174 Å²	174	149.6 Å²	149.6	81%	0.813	78%	0.777	S	S	*	*			trans	81.6	153.4	166.3	-67.2	-178.4	-33.1	0	0	117.6
1224	I	27	Very low	27.2	Very low	133 Å²	133	148 Å²	148	68%	0.682	78%	0.777	S	S	*	*			cis	-170	170.2	-25.6	-166.5	158.5	0	0	0	110.4
1225	S	27.4	Very low	27.2	Very low	99 Å²	99	148.7 Å²	148.7	69%	0.692	78%	0.78	S	S	*	*			trans	74.4	145.3	154	62	0	0	0	0	122
1226	D	30.1	Very low	27.3	Very low	142 Å²	142	147.9 Å²	147.9	76%	0.759	78%	0.78	S	S	*	*			cis	-167.6	168.6	-34.3	-127.1	-64.2	0	0	0	114.9
1227	S	25.9	Very low	27.2	Very low	94 Å²	94	142.2 Å²	142.2	66%	0.657	77%	0.771	S	S	*	*			trans	67.4	121.7	162.4	72	0	0	0	0	122.5
1228	N	29.6	Very low	27.1	Very low	143 Å²	143	140.1 Å²	140.1	77%	0.765	76%	0.76	S	S	*	*			trans	91.2	94.4	146	-63.9	-4.7	0	0	0	122.5
1229	N	30.5	Very low	27.1	Very low	157 Å²	157	138.2 Å²	138.2	84%	0.84	76%	0.76	S	S	*	*			trans	84.6	117.3	137.5	-61.1	-9.4	0	0	0	120.6
1230	N	26.2	Very low	27.3	Very low	159 Å²	159	134.4 Å²	134.4	85%	0.85	75%	0.749	S	S	*	*			trans	-95.1	159.5	-178	-84	-22.8	0	0	0	111.1
1231	P	29.6	Very low	27.1	Very low	121 Å²	121	130.9 Å²	130.9	79%	0.786	73%	0.731	S	S	*	*			cis	-140.2	-175.2	47.3	41.4	-22.8	0	0	0	117.5
1232	L	22.2	Very low	27.1	Very low	159 Å²	159	132.9 Å²	132.9	83%	0.832	73%	0.734	S	S	*	*			trans	80.3	83.9	165.8	-128.7	174	0	0	0	117.3
1233	T	27.5	Very low	27.1	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	72%	0.722	S	S	*	*			trans	-169.6	132.1	156.2	13	0	0	0	0	105.3
1234	V	24.8	Very low	26.9	Very low	114 Å²	114	125.8 Å²	125.8	69%	0.691	71%	0.706	S	S	*	*				64.6	113.5	56.5	178.6	0	0	0	0	111.9
1235	I	24.5	Very low	26.9	Very low	148 Å²	148	122.4 Å²	122.4	76%	0.759	69%	0.692	S	S	*	*			trans	82.6	124	167.4	-67.2	167.4	0	0	0	118.2
1236	L	24.9	Very low	27	Very low	144 Å²	144	125.2 Å²	125.2	75%	0.754	69%	0.694	S	S	*	*			trans	73.4	95.4	158	-70.8	167.9	0	0	0	123.3
1237	T	25.1	Very low	27.1	Very low	108 Å²	108	125.4 Å²	125.4	66%	0.663	69%	0.688	S	S	*	*				79.8	130.4	124.1	51.8	0	0	0	0	124.7
1238	N	25.4	Very low	27	Very low	100 Å²	100	127.2 Å²	127.2	54%	0.535	69%	0.689	S	S	.	*			trans	85.4	82.5	136.4	-67.7	2.7	0	0	0	122	F1241	N1238-F1241 HydrophobicContact CB-CB 4.36Å; N1238-F1241 WeakPolarHBondContact OD1-CD2 3.32Å
1239	S	23.8	Very low	26.8	Very low	124 Å²	124	126.2 Å²	126.2	87%	0.867	68%	0.684	S	S	*	*	S	Bend	trans	-132.1	8.2	143.3	61.9	0	0	0	0	115.5
1240	T	30.6	Very low	26.6	Very low	94 Å²	94	126.3 Å²	126.3	58%	0.577	68%	0.684	S	S	*	*	S	Bend	trans	-122.1	8.9	173.7	49.1	0	0	0	0	114.1	N1242 E1243 L1244	T1240-N1242 PolarHBondContact O-N 3.07Å; T1240-N1242 VanDerWaalsContact O-N 3.14Å; T1240-E1243 PolarHBondContact O-N 3.47Å; T1240-E1243 VanDerWaalsContact O-N 3.11Å; T1240-L1244 PolarHBondContact O-N 2.81Å
1241	F	27	Very low	26.4	Very low	114 Å²	114	126.2 Å²	126.2	50%	0.5	68%	0.682	S	S	.	*	H	α-helix	trans	-65	-21.3	-171	-158	-101.3	0	0	0	114.5	N1238 V1245	N1238-F1241 HydrophobicContact CB-CB 4.36Å; N1238-F1241 WeakPolarHBondContact OD1-CD2 3.32Å; F1241-V1245 HydrophobicContact CD1-CG2 4.09Å; F1241-V1245 HydrophobicContact CE1-CG2 3.89Å; F1241-V1245 HydrophobicContact CZ-CG2 4.17Å; F1241-V1245 WeakPolarHBondContact O-CB 3.2Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.46Å
1242	N	26.7	Very low	26.1	Very low	146 Å²	146	128.3 Å²	128.3	78%	0.781	69%	0.685	S	S	*	*	H	α-helix	trans	-86.9	-10.3	177.2	-74.1	2.7	0	0	0	114.2	T1240	T1240-N1242 PolarHBondContact O-N 3.07Å; T1240-N1242 VanDerWaalsContact O-N 3.14Å
1243	E	30.7	Very low	26.4	Very low	123 Å²	123	125.7 Å²	125.7	58%	0.575	68%	0.68	S	S	*	*	H	α-helix	trans	-106.2	-20.7	177.1	-143	-162.8	130	0	0	113.1	T1240 K1247	T1240-E1243 PolarHBondContact O-N 3.47Å; T1240-E1243 VanDerWaalsContact O-N 3.11Å; E1243-K1247 WeakPolarHBondContact O-CD 3.46Å; E1243-K1247 IonicContact OE1-NZ 3.68Å; E1243-K1247 PolarHBondContact OE1-NZ 2.78Å
1244	L	26.4	Very low	26.4	Very low	92 Å²	92	126.2 Å²	126.2	48%	0.482	68%	0.679	S	S	.	*	H	α-helix	trans	-79.7	-30.1	170.4	-96.2	160.1	0	0	0	112.9	T1240 K1247 L1248	T1240-L1244 PolarHBondContact O-N 2.81Å; L1244-K1247 PolarHBondContact O-N 3.34Å; L1244-L1248 HydrophobicContact CD2-CD1 3.91Å; L1244-L1248 HydrophobicContact CD2-CG 4.49Å; L1244-L1248 WeakPolarHBondContact O-CB 3.16Å; L1244-L1248 PolarHBondContact O-N 2.95Å
1245	V	26.1	Very low	26.3	Very low	63 Å²	63	125.1 Å²	125.1	38%	0.382	68%	0.676	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-27.7	-177.7	170	0	0	0	0	113.1	F1241 N1249	F1241-V1245 HydrophobicContact CD1-CG2 4.09Å; F1241-V1245 HydrophobicContact CE1-CG2 3.89Å; F1241-V1245 HydrophobicContact CZ-CG2 4.17Å; F1241-V1245 WeakPolarHBondContact O-CB 3.2Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.46Å; V1245-N1249 PolarHBondContact O-ND2 3.44Å
1246	E	29.6	Very low	26.4	Very low	158 Å²	158	123.6 Å²	123.6	74%	0.738	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-23.9	169.2	-72.3	-164.5	131.5	0	0	113
1247	K	31.2	Very low	26.3	Very low	145 Å²	145	125.9 Å²	125.9	63%	0.63	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-15.5	179.4	-70.5	170	-176.8	164	0	113.7	E1243 L1244	E1243-K1247 WeakPolarHBondContact O-CD 3.46Å; E1243-K1247 IonicContact OE1-NZ 3.68Å; E1243-K1247 PolarHBondContact OE1-NZ 2.78Å; L1244-K1247 PolarHBondContact O-N 3.34Å
1248	L	23.7	Very low	26.1	Very low	132 Å²	132	126.3 Å²	126.3	69%	0.691	69%	0.685	S	S	*	*	S	Bend	trans	-106.4	22.6	179.7	-75.5	168.7	0	0	0	114.7	L1244	L1244-L1248 HydrophobicContact CD2-CD1 3.91Å; L1244-L1248 HydrophobicContact CD2-CG 4.49Å; L1244-L1248 WeakPolarHBondContact O-CB 3.16Å; L1244-L1248 PolarHBondContact O-N 2.95Å
1249	N	26.2	Very low	26.1	Very low	122 Å²	122	128 Å²	128	65%	0.652	69%	0.694	S	S	*	*	S	Bend	trans	-128.1	18.1	-179.2	-86.5	-64.6	0	0	0	115.3	V1245	V1245-N1249 PolarHBondContact O-ND2 3.44Å
1250	L	26.3	Very low	26.1	Very low	159 Å²	159	128.2 Å²	128.2	83%	0.832	69%	0.685	S	S	*	*	S	Bend	trans	-132.6	33.4	-173.6	-85.4	173.4	0	0	0	115.4
1251	L	22.3	Very low	25.7	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	69%	0.694	S	S	*	*			trans	-144	30.7	177.7	-115.5	165.7	0	0	0	116.3
1252	I	24.4	Very low	25.5	Very low	165 Å²	165	135.5 Å²	135.5	85%	0.846	71%	0.711	S	S	*	*			trans	-136.4	103.8	161.8	-54.5	177.7	0	0	0	105.5
1253	S	26.8	Very low	25.4	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	70%	0.704	S	S	*	*				-167.9	173.2	74.7	39.2	0	0	0	0	112.1
1254	N	27.7	Very low	25	Very low	138 Å²	138	132 Å²	132	74%	0.738	71%	0.712	S	S	*	*			trans	-77.4	169	-173.4	-63.8	-54.2	0	0	0	112.8
1255	S	24.3	Very low	24.8	Very low	91 Å²	91	135 Å²	135	64%	0.636	73%	0.728	S	S	*	*			cis	-172.4	154.7	40.3	54.1	0	0	0	0	114.4
1256	T	25	Very low	24.8	Very low	116 Å²	116	139.7 Å²	139.7	71%	0.712	75%	0.745	S	S	*	*			trans	154.4	83.9	130.4	43	0	0	0	0	112.8
1257	F	22.5	Very low	24.6	Very low	191 Å²	191	137.6 Å²	137.6	84%	0.838	74%	0.739	S	S	*	*			trans	-163.1	86.3	141.7	-131.8	-84.8	0	0	0	111.3
1258	S	21.8	Very low	24.4	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	75%	0.748	S	S	*	*			trans	-107.7	118.2	156.7	-67.7	0	0	0	0	107.1
1259	D	25.9	Very low	24.3	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	75%	0.752	S	S	*	*			trans	-167.1	122.1	145.8	-110.6	-22.3	0	0	0	111.2
1260	L	23.6	Very low	24.2	Very low	129 Å²	129	141.5 Å²	141.5	68%	0.675	76%	0.76	S	S	*	*			trans	66.3	135.1	166.6	-45.5	174.5	0	0	0	116.5
1261	F	22.4	Very low	24.1	Very low	175 Å²	175	141.6 Å²	141.6	77%	0.768	76%	0.761	S	S	*	*			cis	-135.2	127.3	18.2	-81.9	-93.1	0	0	0	114.7
1262	H	22.3	Very low	24.1	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.856	76%	0.757	S	S	*	*				-134.1	151	125.5	-108.7	-107.3	0	0	0	105.1
1263	S	25.4	Very low	24.2	Very low	91 Å²	91	139.4 Å²	139.4	64%	0.636	75%	0.753	S	S	*	*			cis	-139.8	-171.9	7.8	55.4	0	0	0	0	110.6
1264	S	21.3	Very low	24.1	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	75%	0.753	S	S	*	*			trans	-147.4	156	171.3	-73.8	0	0	0	0	109.9
1265	L	22.3	Very low	24	Very low	157 Å²	157	144.3 Å²	144.3	82%	0.822	76%	0.757	S	S	*	*			trans	70	141.4	-157.5	-65.5	73.9	0	0	0	111.1
1266	E	25.7	Very low	24.1	Very low	161 Å²	161	149 Å²	149	75%	0.752	77%	0.765	S	S	*	*			cis	-129.9	144.4	23.1	-89	-162.5	112.5	0	0	117
1267	N	26.3	Very low	24.1	Very low	113 Å²	113	148.3 Å²	148.3	60%	0.604	77%	0.766	S	S	*	*			trans	71.2	155.5	137.5	-57.6	-20.4	0	0	0	124.2
1268	H	26.5	Very low	24.4	Very low	178 Å²	178	144 Å²	144	82%	0.824	76%	0.759	S	S	*	*			trans	71.2	81.9	168.4	-60.6	-65	0	0	0	121.2
1269	C	21.8	Very low	24.4	Very low	113 Å²	113	143.4 Å²	143.4	76%	0.764	76%	0.755	S	S	*	*				24.2	133.3	121.1	-93.6	0	0	0	0	122
1270	K	23.1	Very low	25.1	Very low	191 Å²	191	139.9 Å²	139.9	83%	0.83	74%	0.739	S	S	*	*			trans	79	149.5	150	-65.7	178.4	178.6	176.4	0	118.6
1271	L	24.3	Very low	25.2	Very low	160 Å²	160	136.4 Å²	136.4	84%	0.838	72%	0.722	S	S	*	*			trans	68.1	92.5	164.3	-65.8	161	0	0	0	118.7
1272	Q	22.1	Very low	25.4	Very low	159 Å²	159	132.2 Å²	132.2	74%	0.743	71%	0.707	S	S	*	*				-73.6	149.9	118.5	-89.6	-169.8	-0.8	0	0	108.3
1273	P	26.5	Very low	25.6	Very low	118 Å²	118	130.5 Å²	130.5	77%	0.766	70%	0.703	S	S	*	*			cis	-123	170	38.8	40.5	-29.5	0	0	0	117.4
1274	Y	25.3	Very low	25.6	Very low	185 Å²	185	130.6 Å²	130.6	73%	0.725	70%	0.704	S	S	*	*			trans	-62	157.9	172.5	-85	-107.5	0	0	0	114.3
1275	I	26	Very low	25.9	Very low	161 Å²	161	132.4 Å²	132.4	83%	0.826	70%	0.704	S	S	*	*				-179.7	131	125.7	-91.8	152.6	0	0	0	105.4
1276	K	26.5	Very low	26.3	Very low	188 Å²	188	131 Å²	131	82%	0.817	69%	0.693	S	S	*	*	S	Bend	cis	-126	161.9	33	-57	169.3	-179.2	176.8	0	110.6
1277	S	25.6	Very low	26.5	Very low	103 Å²	103	127 Å²	127	72%	0.72	68%	0.676	S	S	*	*			cis	-150.1	136.7	10.5	46.6	0	0	0	0	113.1
1278	S	26.8	Very low	26.7	Very low	100 Å²	100	127.3 Å²	127.3	70%	0.699	67%	0.672	S	S	*	*			trans	26.9	128.2	145.8	56	0	0	0	0	120.6
1279	S	23.4	Very low	26.8	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	67%	0.673	S	S	*	*			cis	67.5	122.9	12.6	80.6	0	0	0	0	118.5
1280	P	39.8	Very low	27.3	Very low	60 Å²	60	129 Å²	129	39%	0.39	67%	0.672	S	S	.	*			trans	-127.7	-92.8	-157.1	36.1	-12.2	0	0	0	119.5	V1889 P1890 L1892	P1280-V1889 VanDerWaalsContact CD-O 3.29Å; P1280-V1889 WeakPolarHBondContact CD-O 3.39Å; P1280-P1890 CarbonylContact C-O 3.57Å; P1280-L1892 PolarHBondContact O-N 2.92Å
1281	N	26.7	Very low	27.5	Very low	57 Å²	57	128.2 Å²	128.2	31%	0.305	67%	0.671	S	S	.	*			trans	-147.5	151.1	-179.5	-146	-12.9	0	0	0	116.5	S1888 V1889 P1890 S1891 I1893	N1281-S1888 CarbonylContact O-C 3.57Å; N1281-S1888 VanDerWaalsContact O-C 3.32Å; N1281-V1889 CarbonylContact O-C 3.08Å; N1281-V1889 WeakPolarHBondContact O-CA 3.16Å; N1281-V1889 PolarHBondContact O-N 2.96Å; N1281-V1889 VanDerWaalsContact O-N 3.08Å; N1281-P1890 VanDerWaalsContact CA-O 3.25Å; N1281-P1890 WeakPolarHBondContact CA-O 3.36Å; N1281-P1890 PolarHBondContact N-O 3.33Å; N1281-S1891 VanDerWaalsContact OD1-CA 3.23Å; N1281-S1891 WeakPolarHBondContact OD1-CA 3.24Å; N1281-S1891 VanDerWaalsContact OD1-CB 3.29Å; N1281-S1891 WeakPolarHBondContact OD1-CB 3.42Å; N1281-S1891 PolarHBondContact OD1-OG 3.26Å; N1281-I1893 PolarHBondContact ND2-O 3.11Å
1282	L	25.1	Very low	27.6	Very low	87 Å²	87	125.5 Å²	125.5	46%	0.455	67%	0.665	S	S	.	*			trans	-107	158.1	-178.9	-151.7	158.7	0	0	0	112.7	V1889 P1890 S1891	L1282-V1889 HydrophobicContact CD1-CG1 4.18Å; L1282-V1889 HydrophobicContact CG-CG1 3.97Å; L1282-V1889 HydrophobicContact CG-CG2 4.14Å; L1282-P1890 HydrophobicContact CB-CB 4.45Å; L1282-P1890 HydrophobicContact CD1-CB 4.13Å; L1282-S1891 VanDerWaalsContact CB-OG 3.27Å; L1282-S1891 WeakPolarHBondContact CB-OG 2.96Å; L1282-S1891 PolarHBondContact N-OG 3.43Å
1283	L	27.3	Very low	27.8	Very low	149 Å²	149	125 Å²	125	78%	0.78	67%	0.667	S	S	*	*			trans	82.8	161.7	169.2	-143.4	73.1	0	0	0	114.3
1284	S	25.1	Very low	27.7	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	67%	0.666	S	S	*	*			trans	-121.7	166.4	-168.7	-50.9	0	0	0	0	112.1
1285	I	28.8	Very low	27.6	Very low	142 Å²	142	124.9 Å²	124.9	73%	0.728	67%	0.672	S	S	*	*			trans	77.1	122.7	165.2	-65.8	169	0	0	0	113.7
1286	H	29.1	Very low	27.6	Very low	128 Å²	128	125.6 Å²	125.6	59%	0.593	67%	0.672	S	S	*	*			cis	-172.4	177.3	-2.4	-158.7	-76	0	0	0	111.5
1287	L	29.6	Very low	27.6	Very low	76 Å²	76	121.4 Å²	121.4	40%	0.398	67%	0.667	S	S	.	*			trans	90	150.3	156.5	-57.2	165.1	0	0	0	118.6	S1899 S1900	L1287-S1899 VanDerWaalsContact CD1-C 3.41Å; L1287-S1899 VanDerWaalsContact CD1-O 3.3Å; L1287-S1899 WeakPolarHBondContact CD1-O 3.3Å; L1287-S1900 VanDerWaalsContact CD1-C 3.48Å; L1287-S1900 WeakPolarHBondContact CD1-O 3.27Å; L1287-S1900 VanDerWaalsContact CD2-O 3.3Å; L1287-S1900 WeakPolarHBondContact CD2-O 3.3Å
1288	K	31	Very low	27.7	Very low	121 Å²	121	123.9 Å²	123.9	53%	0.526	67%	0.669	S	S	.	*			cis	-170.8	147.8	-38.7	-131.8	-172.1	-157.7	170	0	111.1	V1901	K1288-V1901 PolarHBondContact NZ-O 3.48Å
1289	H	30	Very low	27.7	Very low	183 Å²	183	124 Å²	124	85%	0.847	67%	0.667	S	S	*	*			trans	175.5	135.7	153.7	-99.1	-62.8	0	0	0	106.6
1290	I	31.4	Very low	27.8	Very low	144 Å²	144	127.2 Å²	127.2	74%	0.738	67%	0.668	S	S	*	*			cis	-136.8	170.8	1.4	-82	159.9	0	0	0	108.9
1291	Q	26.4	Very low	27.1	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	68%	0.68	S	S	*	*			trans	-83.1	-176.4	-178.3	-54.9	133.9	-81.2	0	0	112.6
1292	S	27.3	Very low	27.1	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	70%	0.698	S	S	*	*			cis	-160.8	139.9	14.4	52.3	0	0	0	0	115
1293	D	26.9	Very low	27.3	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	71%	0.71	S	S	*	*			trans	52.6	94	135.7	-52.7	-18.7	0	0	0	125.3
1294	S	24.5	Very low	27.3	Very low	104 Å²	104	134 Å²	134	73%	0.727	70%	0.704	S	S	*	*				85.2	144.1	117.4	82.6	0	0	0	0	124.4
1295	F	22.1	Very low	27.4	Very low	197 Å²	197	133.7 Å²	133.7	86%	0.864	70%	0.698	S	S	*	*			trans	73.7	146.1	164	-79.9	-79.1	0	0	0	121.9
1296	Q	26.7	Very low	27.4	Very low	176 Å²	176	133.1 Å²	133.1	82%	0.822	70%	0.696	S	S	*	*			trans	77	131.6	169.7	-55.5	-162.6	2.8	0	0	121.1
1297	S	25.9	Very low	27.4	Very low	101 Å²	101	134 Å²	134	71%	0.706	70%	0.701	S	S	*	*			trans	40.5	134.8	138.8	68.2	0	0	0	0	123.7
1298	M	27.2	Very low	27.4	Very low	154 Å²	154	138.3 Å²	138.3	76%	0.759	72%	0.722	S	S	*	*			trans	-48.6	148.9	142	-87	-159.3	86.9	0	0	111.3	K1300	M1298-K1300 HydrophobicContact CE-CG 4.15Å
1299	P	27.9	Very low	27.2	Very low	104 Å²	104	139.6 Å²	139.6	68%	0.675	73%	0.73	S	S	*	*				-150.2	176	55.3	40.7	-20.3	0	0	0	119
1300	K	24.6	Very low	27.1	Very low	172 Å²	172	137.1 Å²	137.1	75%	0.748	72%	0.723	S	S	*	*			trans	-1	152.4	139.1	-37.4	171.6	-177.8	177.3	0	116.2	M1298	M1298-K1300 HydrophobicContact CE-CG 4.15Å
1301	S	25	Very low	27.1	Very low	92 Å²	92	137 Å²	137	64%	0.643	72%	0.723	S	S	*	*				173	-178.1	55	56.3	0	0	0	0	113.5
1302	L	26.9	Very low	27.1	Very low	130 Å²	130	134.2 Å²	134.2	68%	0.681	72%	0.719	S	S	*	*			trans	71.6	155.6	153.5	-64.7	165.9	0	0	0	118
1303	L	29	Very low	27.5	Very low	135 Å²	135	135.3 Å²	135.3	71%	0.707	72%	0.721	S	S	*	*			cis	-122.7	147.7	-9.5	-90.1	108.3	0	0	0	109.4
1304	Q	28.1	Very low	27.9	Very low	140 Å²	140	135 Å²	135	65%	0.654	72%	0.72	S	S	*	*				76	151.8	58.8	-106.3	179	-61.6	0	0	113.8
1305	T	27.8	Very low	28.4	Very low	84 Å²	84	135.5 Å²	135.5	52%	0.515	72%	0.723	S	S	.	*			cis	-144.1	-176.5	13.6	50.6	0	0	0	0	113.5
1306	N	28.4	Very low	28.8	Very low	131 Å²	131	131.9 Å²	131.9	70%	0.701	72%	0.722	S	S	*	*			trans	99.1	106.2	161.4	-49.7	-13.3	0	0	0	113.6
1307	E	28.4	Very low	29	Very low	147 Å²	147	128.8 Å²	128.8	69%	0.687	72%	0.715	S	S	*	*			cis	63.3	136.8	32.4	-53.1	85.6	-114.4	0	0	113.3
1308	I	29.5	Very low	29.2	Very low	166 Å²	166	128 Å²	128	85%	0.851	71%	0.71	S	S	*	*			cis	-141.7	-160.1	16.6	-167.6	138.5	0	0	0	109.1
1309	E	28.4	Very low	29.2	Very low	147 Å²	147	127.5 Å²	127.5	69%	0.687	70%	0.704	S	S	*	*			cis	-155.1	-129.6	21.3	-152.8	-139.1	-119.6	0	0	115.2
1310	L	26.8	Very low	30.1	Very low	132 Å²	132	130.7 Å²	130.7	69%	0.691	71%	0.713	S	S	*	*			trans	-131.1	147.4	-158.4	-64.9	155.6	0	0	0	116.6
1311	N	30.5	Very low	30.2	Very low	140 Å²	140	128.5 Å²	128.5	75%	0.749	71%	0.714	S	S	*	*				165	149.3	110.4	-89.6	-60.3	0	0	0	117.1
1312	T	26.7	Very low	30.1	Very low	117 Å²	117	132 Å²	132	72%	0.718	72%	0.72	S	S	*	*			trans	-39.9	139.7	-176.2	55.2	0	0	0	0	121.5
1313	T	35.6	Very low	30	Very low	125 Å²	125	133 Å²	133	77%	0.767	72%	0.721	S	S	*	*				-175.8	148.5	112.8	22.3	0	0	0	0	114.4
1314	N	35.8	Very low	30.2	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	72%	0.717	S	S	*	*			trans	64.7	133.5	157.1	-58.2	-19.5	0	0	0	122.3
1315	S	34.3	Very low	30.3	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	72%	0.723	S	S	*	*			trans	62.9	128.2	161.6	47.4	0	0	0	0	121.1
1316	S	32.4	Very low	30.6	Very low	121 Å²	121	134.1 Å²	134.1	85%	0.846	73%	0.728	S	S	*	*			trans	74.7	92.5	155.8	-52.5	0	0	0	0	119.6
1317	T	29.4	Very low	30.7	Very low	112 Å²	112	131.7 Å²	131.7	69%	0.687	73%	0.726	S	S	*	*			trans	-51.4	163.6	163.1	45.7	0	0	0	0	115.8
1318	S	29.8	Very low	30.9	Very low	84 Å²	84	133.9 Å²	133.9	59%	0.587	73%	0.734	S	S	*	*			cis	158.9	121.7	-31.8	54.7	0	0	0	0	109.1
1319	F	28	Very low	30.9	Very low	144 Å²	144	132.4 Å²	132.4	63%	0.632	73%	0.727	S	S	*	*			trans	-179.7	98.8	162.4	-106.9	-64.8	0	0	0	111.9	E1322	F1319-E1322 WeakPolarHBondContact CE1-O 3.27Å
1320	I	46.1	Very low	30.9	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	73%	0.733	S	S	*	*			trans	-148.2	141.2	162.8	-52.9	179.9	0	0	0	105.7
1321	V	26.5	Very low	31.1	Very low	126 Å²	126	129.7 Å²	129.7	76%	0.764	73%	0.727	S	S	*	*	S	Bend	trans	79.8	177.5	-143.2	-174.5	0	0	0	0	109.5
1322	E	24.1	Very low	31.3	Very low	165 Å²	165	129 Å²	129	77%	0.771	73%	0.728	S	S	*	*	S	Bend	trans	-72	-139.4	-158.6	-56.9	156.4	115.3	0	0	114.5	F1319	F1319-E1322 WeakPolarHBondContact CE1-O 3.27Å
1323	Q	23.7	Very low	31.4	Very low	151 Å²	151	129.6 Å²	129.6	71%	0.706	73%	0.727	S	S	*	*	S	Bend	trans	-59.6	169.9	176.6	-58.9	171.5	-7.8	0	0	113
1324	N	34.1	Very low	31.3	Very low	118 Å²	118	129.6 Å²	129.6	63%	0.631	72%	0.722	S	S	*	*			trans	93.4	92.8	156.9	-50.3	-48.8	0	0	0	119.2
1325	F	30.1	Very low	31	Very low	176 Å²	176	129.2 Å²	129.2	77%	0.772	72%	0.72	S	S	*	*				21.5	119.9	125.1	-75.6	-92	0	0	0	119.6
1326	S	33.4	Very low	30.7	Very low	89 Å²	89	129.6 Å²	129.6	62%	0.622	72%	0.718	S	S	*	*				170.1	135.6	103.7	-75.8	0	0	0	0	110.4
1327	A	32	Very low	30.5	Very low	80 Å²	80	129.7 Å²	129.7	66%	0.661	71%	0.713	S	S	*	*			cis	73.5	118.2	49.4	0	0	0	0	0	114.2
1328	K	31.2	Very low	30.4	Very low	194 Å²	194	130 Å²	130	84%	0.843	72%	0.715	S	S	*	*			trans	-165.1	135.3	166.1	-99.8	178.9	-175.7	173.9	0	105.3
1329	N	29.4	Very low	30.3	Very low	134 Å²	134	132 Å²	132	72%	0.717	72%	0.724	S	S	*	*	S	Bend	cis	-134.3	163.2	9	-66.8	-51.2	0	0	0	107.6
1330	L	29	Very low	30.5	Very low	156 Å²	156	132 Å²	132	82%	0.817	74%	0.736	S	S	*	*			cis	-159.5	160.3	-4.8	-135.5	72.7	0	0	0	103.8
1331	A	31.6	Very low	29.7	Very low	67 Å²	67	132.9 Å²	132.9	55%	0.554	73%	0.734	S	S	*	*			cis	-161.2	171.4	1.5	0	0	0	0	0	108.6
1332	T	33.9	Very low	29.8	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	73%	0.729	S	S	*	*			trans	58.3	148.8	149.6	53.1	0	0	0	0	121.2
1333	D	29.9	Very low	30.2	Very low	130 Å²	130	131.1 Å²	131.1	70%	0.695	73%	0.725	S	S	*	*			cis	-173.1	160	-26.9	-111.1	6.2	0	0	0	110.5
1334	N	32.1	Very low	30.7	Very low	124 Å²	124	130.5 Å²	130.5	66%	0.663	73%	0.725	S	S	*	*			trans	61.3	101.4	149.5	-62.1	-37.9	0	0	0	123.8
1335	N	29.3	Very low	30.4	Very low	135 Å²	135	131.5 Å²	131.5	72%	0.722	73%	0.73	S	S	*	*				60.7	110.8	109.1	-61.3	-18.3	0	0	0	124.5
1336	T	28	Very low	30.6	Very low	121 Å²	121	129.9 Å²	129.9	74%	0.742	73%	0.73	S	S	*	*				74.8	144.9	125.7	57.4	0	0	0	0	125.4
1337	T	28.2	Very low	30.5	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	74%	0.74	S	S	*	*			trans	85.3	114.6	146.8	35.8	0	0	0	0	124.1
1338	T	28.6	Very low	30.5	Very low	118 Å²	118	135 Å²	135	72%	0.724	75%	0.745	S	S	*	*			trans	60.2	95.5	137	55.9	0	0	0	0	123.3
1339	T	27.4	Very low	30.4	Very low	126 Å²	126	133 Å²	133	77%	0.773	74%	0.744	S	S	*	*				37	110.8	121.2	58.1	0	0	0	0	122.1
1340	T	31	Very low	30.5	Very low	146 Å²	146	130.6 Å²	130.6	90%	0.896	74%	0.737	S	S	*	*				-163.6	150.9	121.6	21.5	0	0	0	0	114.2
1341	K	30	Very low	30.5	Very low	188 Å²	188	129.7 Å²	129.7	82%	0.817	73%	0.734	S	S	*	*			trans	-28.7	156.8	163.8	-68.1	172.5	-176.9	177	0	117
1342	N	29.5	Very low	30.6	Very low	123 Å²	123	133.4 Å²	133.4	66%	0.658	74%	0.742	S	S	*	*			cis	-160.1	178.3	18.8	-134.2	47.6	0	0	0	111.7
1343	D	32.5	Very low	30.8	Very low	131 Å²	131	133 Å²	133	70%	0.701	74%	0.742	S	S	*	*			trans	69.8	140.1	161.5	-58.6	-7.2	0	0	0	117.9
1344	I	32.6	Very low	30.6	Very low	137 Å²	137	135 Å²	135	70%	0.703	75%	0.752	S	S	*	*			cis	-152.8	147.1	0.1	-104.9	157.2	0	0	0	110.3
1345	N	29	Very low	30.2	Very low	139 Å²	139	132.6 Å²	132.6	74%	0.743	75%	0.745	S	S	*	*			trans	65.8	113.3	164	-69.3	-13.1	0	0	0	124
1346	N	33	Very low	30.1	Very low	143 Å²	143	134 Å²	134	77%	0.765	75%	0.751	S	S	*	*			trans	71.5	127.2	133.4	-74.2	-6.1	0	0	0	125.6
1347	I	31.7	Very low	30.1	Very low	161 Å²	161	132.8 Å²	132.8	83%	0.826	75%	0.748	S	S	*	*			trans	86.2	134.2	152.6	-60.1	159	0	0	0	117.9
1348	C	32.5	Very low	30.1	Very low	115 Å²	115	135 Å²	135	78%	0.777	75%	0.752	S	S	*	*			trans	-127.8	-167.6	-172.5	-49.3	0	0	0	0	111.1
1349	D	29	Very low	30.1	Very low	151 Å²	151	136 Å²	136	81%	0.807	75%	0.751	S	S	*	*			cis	-155.6	-166.6	12.5	-152	-130.5	0	0	0	108.3
1350	S	31.3	Very low	30	Very low	84 Å²	84	136 Å²	136	59%	0.587	75%	0.751	S	S	*	*			cis	-162.3	-164.4	16.2	60.5	0	0	0	0	111.4
1351	N	29.9	Very low	29.8	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	74%	0.74	S	S	*	*			trans	-139.4	158.3	-177.5	-80.4	-92	0	0	0	113
1352	I	32.7	Very low	29.8	Very low	144 Å²	144	131.3 Å²	131.3	74%	0.738	74%	0.737	S	S	*	*			cis	81.4	144.3	27.5	-61.6	169.9	0	0	0	112.6
1353	P	39.3	Very low	29.7	Very low	117 Å²	117	134 Å²	134	76%	0.76	75%	0.746	S	S	*	*			cis	-125.4	-162.2	2	41.6	-24.4	0	0	0	115.6
1354	L	24.7	Very low	29.4	Very low	171 Å²	171	132 Å²	132	90%	0.895	75%	0.748	S	S	*	*			trans	-96.9	-174	155.7	-134.8	96	0	0	0	111.3
1355	S	25	Very low	29.3	Very low	75 Å²	75	133.4 Å²	133.4	52%	0.524	76%	0.757	S	S	.	*			trans	-97.3	142.7	-151.7	57.7	0	0	0	0	120.5
1356	L	27.3	Very low	29.2	Very low	163 Å²	163	133.8 Å²	133.8	85%	0.853	76%	0.758	S	S	*	*			trans	30.6	156.5	136.5	-88.8	72.2	0	0	0	122.2
1357	S	27.8	Very low	28.9	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	76%	0.761	S	S	*	*			cis	-175.7	155.1	-1.9	46.8	0	0	0	0	111.5
1358	M	26.4	Very low	28.8	Very low	169 Å²	169	133.6 Å²	133.6	83%	0.833	75%	0.753	S	S	*	*			trans	175.9	162.1	154.1	-102.7	179.4	-175.4	0	0	108.5
1359	I	29.3	Very low	28.7	Very low	137 Å²	137	135.6 Å²	135.6	70%	0.703	75%	0.748	S	S	*	*			cis	-165.3	160.4	-20.3	-153.5	167	0	0	0	106.1
1360	T	26.4	Very low	28.7	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	75%	0.751	S	S	*	*			cis	-113.7	-126.9	-2.3	-32.3	0	0	0	0	108.5
1361	S	26.1	Very low	28.6	Very low	93 Å²	93	136.8 Å²	136.8	65%	0.65	76%	0.756	S	S	*	*			cis	-133.4	-155.5	-10.9	57.3	0	0	0	0	107.9
1362	D	29.4	Very low	28.7	Very low	143 Å²	143	137.7 Å²	137.7	77%	0.765	76%	0.759	S	S	*	*			cis	-159.2	175.6	5.3	-137.1	-60	0	0	0	110.2
1363	Q	28.4	Very low	28.4	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	76%	0.757	S	S	*	*			trans	-144.1	135.2	-177.6	-70.4	-166.1	-16.3	0	0	119.8
1364	A	26.5	Very low	27.8	Very low	90 Å²	90	138 Å²	138	74%	0.744	75%	0.754	S	S	*	*			trans	66.6	128.3	142.8	0	0	0	0	0	122.8
1365	N	28.9	Very low	27.9	Very low	166 Å²	166	136.5 Å²	136.5	89%	0.888	75%	0.747	S	S	*	*			trans	-162.4	153.9	134.1	-114.6	-57.3	0	0	0	112.1
1366	L	26.7	Very low	28.5	Very low	147 Å²	147	137.5 Å²	137.5	77%	0.77	75%	0.752	S	S	*	*			trans	-155.1	111.7	-173.3	-159.3	169.2	0	0	0	112.5
1367	L	28	Very low	28.5	Very low	158 Å²	158	136.8 Å²	136.8	83%	0.827	74%	0.744	S	S	*	*			trans	-145.9	132.7	174.7	-79.1	169.2	0	0	0	106.6
1368	H	28.9	Very low	28.3	Very low	142 Å²	142	139.7 Å²	139.7	66%	0.657	75%	0.747	S	S	*	*			cis	64.2	129.8	24.9	-87.6	2.1	0	0	0	114.8
1369	K	31.1	Very low	28.4	Very low	157 Å²	157	137.1 Å²	137.1	68%	0.683	74%	0.741	S	S	*	*			cis	-170.4	156.7	-9	-159.8	177.4	-175.9	178.3	0	107.8
1370	D	28.6	Very low	28.3	Very low	162 Å²	162	137.2 Å²	137.2	87%	0.866	74%	0.742	S	S	*	*			trans	-176.8	172.3	141.7	-97.9	-21.7	0	0	0	113.2
1371	S	29.9	Very low	28.3	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	73%	0.734	S	S	*	*			trans	-140.1	171.3	-168.8	-50.4	0	0	0	0	111
1372	I	31	Very low	28.5	Very low	156 Å²	156	137.9 Å²	137.9	80%	0.8	74%	0.737	S	S	*	*			trans	164.4	137.2	143.2	-90.8	157.9	0	0	0	113.9
1373	I	26.9	Very low	28.3	Very low	137 Å²	137	137.2 Å²	137.2	70%	0.703	73%	0.733	S	S	*	*			trans	63.4	112.3	161	-74.8	166.1	0	0	0	117.6
1374	N	26.1	Very low	28.4	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	73%	0.725	S	S	*	*				67.2	145.3	86.2	-50.7	7.1	0	0	0	113.2
1375	D	26.4	Very low	28.5	Very low	139 Å²	139	140 Å²	140	74%	0.743	73%	0.73	S	S	*	*			cis	-161.3	-163.3	13.3	-129.7	1.2	0	0	0	109
1376	P	37.6	Very low	28.6	Very low	96 Å²	96	136.2 Å²	136.2	62%	0.623	72%	0.717	S	S	*	*				-125	-136.7	-77.6	37.4	-15.6	0	0	0	112.5
1377	H	27.9	Very low	28.7	Very low	148 Å²	148	136.1 Å²	136.1	69%	0.685	72%	0.718	S	S	*	*			trans	72.8	111.8	-176.8	-71.9	-81.4	0	0	0	115.4
1378	E	23.7	Very low	28.8	Very low	157 Å²	157	136.9 Å²	136.9	73%	0.734	72%	0.717	S	S	*	*				65.3	123.7	83.2	-74.2	-170.7	151	0	0	112.2
1379	T	28.3	Very low	28.8	Very low	116 Å²	116	134.3 Å²	134.3	71%	0.712	72%	0.715	S	S	*	*			cis	-159.4	177.8	14.3	24.1	0	0	0	0	108.4
1380	L	26.5	Very low	28.8	Very low	138 Å²	138	133.5 Å²	133.5	72%	0.723	72%	0.718	S	S	*	*			cis	-145.6	129.4	15.2	-112.8	119.9	0	0	0	110.2
1381	T	28.2	Very low	28.9	Very low	99 Å²	99	132.8 Å²	132.8	61%	0.607	71%	0.713	S	S	*	*			trans	45.6	149.3	134.9	67.1	0	0	0	0	124.3
1382	N	29	Very low	28.9	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	72%	0.72	S	S	*	*			trans	85.8	149.8	149	-62.4	-34.7	0	0	0	119.3
1383	N	26.1	Very low	29.1	Very low	129 Å²	129	134.8 Å²	134.8	69%	0.69	72%	0.716	S	S	*	*			cis	179.4	136.8	-40.6	-113.5	-40.7	0	0	0	108
1384	V	29.6	Very low	29.3	Very low	110 Å²	110	134.3 Å²	134.3	67%	0.667	72%	0.715	S	S	*	*			trans	51	112.1	155.7	-165.9	0	0	0	0	119.4
1385	Y	28.9	Very low	29.6	Very low	218 Å²	218	136 Å²	136	86%	0.855	71%	0.713	S	S	*	*				175.4	135.7	116.8	-105.9	-73.1	0	0	0	115.9
1386	S	30.9	Very low	29.9	Very low	88 Å²	88	135.7 Å²	135.7	62%	0.615	72%	0.716	S	S	*	*			trans	49	103.3	149.1	62.1	0	0	0	0	125.4
1387	D	29.1	Very low	29.6	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	72%	0.721	S	S	*	*				76.6	146	107	-56.3	-41.6	0	0	0	128
1388	H	30.4	Very low	29.7	Very low	174 Å²	174	135.4 Å²	135.4	81%	0.806	72%	0.723	S	S	*	*			trans	84.1	121.3	165.3	-62.8	-66.3	0	0	0	120.4
1389	S	27.9	Very low	29.9	Very low	88 Å²	88	134.8 Å²	134.8	62%	0.615	73%	0.725	S	S	*	*			cis	106.4	138.7	15.4	72.7	0	0	0	0	114.1
1390	N	31.3	Very low	30	Very low	139 Å²	139	137.4 Å²	137.4	74%	0.743	73%	0.727	S	S	*	*			cis	-158.7	169.4	-3.3	-94.4	0.3	0	0	0	108.1
1391	L	31.5	Very low	30.1	Very low	147 Å²	147	137.7 Å²	137.7	77%	0.77	73%	0.729	S	S	*	*			cis	84.9	131.3	27.4	-57.8	175.8	0	0	0	115.5
1392	L	29.7	Very low	30	Very low	158 Å²	158	140.4 Å²	140.4	83%	0.827	74%	0.74	S	S	*	*			cis	-145.3	-105.9	-1.4	-170.4	49.3	0	0	0	117.1
1393	L	34.2	Very low	30.4	Very low	139 Å²	139	139.2 Å²	139.2	73%	0.728	74%	0.739	S	S	*	*			trans	-161.6	150.4	-157.8	-164.4	88.1	0	0	0	115
1394	N	32.8	Very low	30.5	Very low	126 Å²	126	139.1 Å²	139.1	67%	0.674	74%	0.739	S	S	*	*			trans	54.2	178.3	154.8	-75.3	-0.1	0	0	0	122.3
1395	Y	31.6	Very low	30.6	Very low	168 Å²	168	141 Å²	141	66%	0.659	74%	0.74	S	S	*	*			trans	-59.2	174.9	-170.9	-53	-84.6	0	0	0	116.9	Y1598	Y1395-Y1598 WeakPolarHBondContact CD1-OH 3.18Å; Y1395-Y1598 HydrophobicContact CE1-CE1 4.09Å; Y1395-Y1598 AromaticContact CE1-CZ 3.85Å; Y1395-Y1598 WeakPolarHBondContact CE1-OH 3.49Å
1396	T	32	Very low	30.6	Very low	133 Å²	133	136.4 Å²	136.4	82%	0.816	73%	0.73	S	S	*	*			cis	-165.2	168.7	36.6	-31	0	0	0	0	114.7
1397	T	31.9	Very low	30.5	Very low	117 Å²	117	138.2 Å²	138.2	72%	0.718	73%	0.733	S	S	*	*			trans	-72.8	157.9	174.7	50.9	0	0	0	0	115.2
1398	T	30.5	Very low	30.4	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	73%	0.728	S	S	*	*			cis	-166.9	132.7	-6.7	23.9	0	0	0	0	111.7
1399	N	27.1	Very low	30.2	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	72%	0.724	S	S	*	*			trans	170.5	134.5	151.8	-100.7	-34.8	0	0	0	107.6
1400	K	30.6	Very low	30.4	Very low	171 Å²	171	138.2 Å²	138.2	74%	0.743	74%	0.736	S	S	*	*			cis	-165.3	148	-12.3	-134	179.6	-165.3	175.6	0	109
1401	N	28.7	Very low	30.4	Very low	144 Å²	144	135 Å²	135	77%	0.77	74%	0.736	S	S	*	*			trans	76.5	128.5	165.3	-47.8	-8.4	0	0	0	119.2
1402	D	26.1	Very low	30.4	Very low	156 Å²	156	137.7 Å²	137.7	83%	0.834	74%	0.741	S	S	*	*			trans	-84.6	-168.5	168.6	-41.8	-92.6	0	0	0	111.3
1403	P	36.3	Very low	30.4	Very low	109 Å²	109	134.6 Å²	134.6	71%	0.708	73%	0.726	S	S	*	*			cis	-138.3	-158.7	0.6	37	-12.8	0	0	0	115.7
1404	N	29.8	Very low	30	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	72%	0.724	S	S	*	*			trans	83	141.8	173.8	-63.4	26.7	0	0	0	115.9
1405	E	31.8	Very low	29.9	Very low	149 Å²	149	136.7 Å²	136.7	70%	0.696	73%	0.729	S	S	*	*			cis	-157	140.4	2.2	-126.2	171.1	-116.4	0	0	114.5
1406	N	28.9	Very low	29.7	Very low	121 Å²	121	135.3 Å²	135.3	65%	0.647	73%	0.732	S	S	*	*			trans	43.8	116.1	141.5	-72.8	-27.9	0	0	0	124.7
1407	N	28.1	Very low	29.6	Very low	126 Å²	126	136.4 Å²	136.4	67%	0.674	73%	0.733	S	S	*	*				79.5	123.6	116.9	-63.2	-22.1	0	0	0	125.3
1408	N	27.4	Very low	29.3	Very low	127 Å²	127	134.9 Å²	134.9	68%	0.679	73%	0.727	S	S	*	*				94.9	113.4	122.4	-74.8	-12.7	0	0	0	125.7
1409	I	26.2	Very low	29.4	Very low	138 Å²	138	136.4 Å²	136.4	71%	0.708	73%	0.73	S	S	*	*				84.3	149.9	121.5	-64.1	169.9	0	0	0	121
1410	T	32.2	Very low	29.3	Very low	143 Å²	143	136.3 Å²	136.3	88%	0.877	73%	0.729	S	S	*	*			trans	91.6	141.1	177	73	0	0	0	0	117
1411	G	29.9	Very low	29	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	73%	0.726	S	S	*	*			cis	168.9	147	-15.2	0	0	0	0	0	115.4
1412	K	32.7	Very low	28.7	Very low	202 Å²	202	134.6 Å²	134.6	88%	0.878	73%	0.726	S	S	*	*			trans	67.8	101.8	160.4	-62.1	178.8	-180	174.9	0	121.7
1413	D	29.1	Very low	28.6	Very low	93 Å²	93	130.7 Å²	130.7	50%	0.497	72%	0.716	S	S	.	*				47.7	120	110.1	-69	-26.4	0	0	0	124.8	K1590	D1413-K1590 IonicContact OD1-NZ 3.85Å; D1413-K1590 PolarHBondContact OD1-NZ 2.8Å
1414	N	27	Very low	28.1	Very low	130 Å²	130	135.2 Å²	135.2	70%	0.695	72%	0.72	S	S	*	*				89.1	140.6	120.9	-72.7	-28.8	0	0	0	124.3
1415	K	30.6	Very low	28	Very low	180 Å²	180	135.8 Å²	135.8	78%	0.783	72%	0.717	S	S	*	*			trans	86.5	108.9	153.6	-76.6	-179.1	178.7	178.7	0	121.8
1416	I	26.1	Very low	27.6	Very low	139 Å²	139	134.4 Å²	134.4	71%	0.713	71%	0.714	S	S	*	*				56.2	111.7	124.1	-56	166.3	0	0	0	118
1417	N	29.8	Very low	27.7	Very low	155 Å²	155	132.3 Å²	132.3	83%	0.829	71%	0.709	S	S	*	*				-158.6	147.6	114.8	-108.4	-35.2	0	0	0	112.3
1418	S	27.2	Very low	27.8	Very low	86 Å²	86	130.1 Å²	130.1	60%	0.601	70%	0.696	S	S	*	*			trans	-109.1	112.6	171.5	58	0	0	0	0	110.1
1419	L	31	Very low	27.7	Very low	151 Å²	151	131 Å²	131	79%	0.791	69%	0.694	S	S	*	*			trans	-140.6	100.1	164.8	-95.8	151	0	0	0	105.5
1420	L	26.2	Very low	27.7	Very low	144 Å²	144	127.1 Å²	127.1	75%	0.754	68%	0.675	S	S	*	*				52.2	99.7	94	-99	67.2	0	0	0	111.3
1421	T	23	Very low	27.4	Very low	111 Å²	111	129.6 Å²	129.6	68%	0.681	67%	0.67	S	S	*	*				94.6	138.8	55.2	-69.8	0	0	0	0	111.6
1422	E	23.7	Very low	27.3	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	67%	0.667	S	S	*	*			trans	73.3	143.2	169.8	-117.5	65.2	-99.3	0	0	120.1
1423	A	24.2	Very low	26.8	Very low	74 Å²	74	130 Å²	130	61%	0.612	66%	0.658	S	S	*	*			trans	44.1	107.6	143.2	0	0	0	0	0	120.7
1424	Y	24.5	Very low	26.6	Very low	204 Å²	204	131.7 Å²	131.7	80%	0.8	67%	0.668	S	S	*	*				-169.2	141.8	106.5	-117.2	-122.2	0	0	0	109.2
1425	F	28.2	Very low	26.5	Very low	138 Å²	138	132.1 Å²	132.1	61%	0.605	67%	0.67	S	S	*	*			cis	-160	166.3	-13.5	-148.3	-132.9	0	0	0	112.7	S1427	F1425-S1427 PolarHBondContact O-N 2.66Å
1426	N	23.6	Very low	26.4	Very low	121 Å²	121	130.7 Å²	130.7	65%	0.647	67%	0.665	S	S	*	*			trans	-37.7	124.1	162.6	-55.1	-74.9	0	0	0	115.3
1427	S	30.5	Very low	26.5	Very low	77 Å²	77	131.4 Å²	131.4	54%	0.538	67%	0.666	S	S	.	*			trans	-171	138	135.4	-83	0	0	0	0	110.6	F1425	F1425-S1427 PolarHBondContact O-N 2.66Å
1428	I	31.6	Very low	26.4	Very low	80 Å²	80	130 Å²	130	41%	0.41	65%	0.654	S	S	.	*			cis	-156.4	134.1	-10.3	-104.7	155	0	0	0	102.1	K3	K3-I1428 VanDerWaalsContact CA-CG2 3.47Å
1429	K	24.5	Very low	26.5	Very low	144 Å²	144	131.8 Å²	131.8	63%	0.626	66%	0.657	S	S	*	*				50	153.8	91.5	-99.1	179.9	162.1	-76.7	0	114.4	M1 K3	M1-K1429 CarbonylContact O-C 2.85Å; M1-K1429 VanDerWaalsContact O-O 3.12Å; K3-K1429 PolarHBondContact N-O 3.49Å
1430	D	25.6	Very low	26.8	Very low	57 Å²	57	130.1 Å²	130.1	31%	0.305	65%	0.648	S	S	.	*			cis	-152.4	-175.8	11.3	-142.8	-22.5	0	0	0	114.3	M1	M1-D1430 PolarHBondContact N-O 2.9Å; M1-D1430 PolarHBondContact O-N 3.42Å
1431	Y	26.3	Very low	27.2	Very low	196 Å²	196	131 Å²	131	77%	0.769	65%	0.646	S	S	*	*			trans	79.1	86.9	163.4	-71	-70.4	0	0	0	119.9
1432	H	27.2	Very low	27.7	Very low	150 Å²	150	132.7 Å²	132.7	69%	0.694	64%	0.644	S	S	*	*				62.6	119.9	122.1	-87.4	-107.4	0	0	0	122.9
1433	L	23.5	Very low	28.1	Very low	132 Å²	132	134 Å²	134	69%	0.691	64%	0.642	S	S	*	*			trans	82.1	123.3	134.4	-68.7	168.6	0	0	0	122.5
1434	N	24.4	Very low	28.6	Very low	129 Å²	129	136.9 Å²	136.9	69%	0.69	64%	0.644	S	S	*	*			trans	90.4	142.1	137.4	-67	-6.7	0	0	0	121.6
1435	N	25.5	Very low	29.2	Very low	139 Å²	139	131.9 Å²	131.9	74%	0.743	63%	0.627	S	S	*	*			trans	62.7	81.4	158.6	-57.5	-6	0	0	0	118.4
1436	H	27.6	Very low	29.4	Very low	149 Å²	149	132.9 Å²	132.9	69%	0.69	63%	0.628	S	S	*	*				167.8	112.7	107.6	-95.5	-77.8	0	0	0	111.5
1437	H	28.5	Very low	30.1	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.718	63%	0.63	S	S	*	*			trans	-152.2	17.7	163.2	-140.4	-60.7	0	0	0	116.9
1438	E	26.9	Very low	30.4	Very low	124 Å²	124	137.3 Å²	137.3	58%	0.579	63%	0.634	S	S	*	*	S	Bend	trans	-89.2	-27.5	179.3	-62.9	-163.2	128.9	0	0	114.3	N411 I1440	N411-E1438 PolarHBondContact ND2-OE1 2.74Å; E1438-I1440 VanDerWaalsContact C-N 3.28Å; E1438-I1440 PolarHBondContact O-N 3.13Å; E1438-I1440 VanDerWaalsContact O-N 3.16Å
1439	N	29	Very low	30.5	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	3	-172.1	-81.4	-14	0	0	0	116.3
1440	I	39.3	Very low	30.7	Very low	117 Å²	117	137.3 Å²	137.3	60%	0.6	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-11.6	177.6	-67.7	178.5	0	0	0	112.6	E1438	E1438-I1440 VanDerWaalsContact C-N 3.28Å; E1438-I1440 PolarHBondContact O-N 3.13Å; E1438-I1440 VanDerWaalsContact O-N 3.16Å
1441	K	34.4	Very low	31	Very low	163 Å²	163	140.1 Å²	140.1	71%	0.709	66%	0.657	S	S	*	*	H	α-helix	trans	-89.4	-24	176.1	-77.5	-177.5	175.7	174.3	0	115.2	Q1445	K1441-Q1445 WeakPolarHBondContact O-CB 3.22Å; K1441-Q1445 PolarHBondContact O-N 3.14Å
1442	F	32.7	Very low	31.2	Very low	146 Å²	146	135.5 Å²	135.5	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-73.1	-32.1	-177.8	-112.4	-90.9	0	0	0	113.7	Q1445 Y1446	F1442-Q1445 PolarHBondContact O-N 3.24Å; F1442-Y1446 PolarHBondContact O-N 3Å
1443	Y	31.4	Very low	31.3	Very low	194 Å²	194	132.8 Å²	132.8	76%	0.761	65%	0.647	S	S	*	*	H	α-helix	trans	-75.9	-31	-177.2	-143.1	-96.3	0	0	0	113.3	K1447	Y1443-K1447 PolarHBondContact O-N 2.99Å
1444	E	36.2	Very low	31.5	Very low	136 Å²	136	134.1 Å²	134.1	64%	0.636	65%	0.653	S	S	*	*	H	α-helix	trans	-72	-34.6	169.2	-65.7	-162.9	124	0	0	112	Q1448	E1444-Q1448 WeakPolarHBondContact O-CG 3.39Å; E1444-Q1448 PolarHBondContact O-N 3.4Å
1445	Q	37.2	Very low	31.7	Very low	99 Å²	99	138.1 Å²	138.1	46%	0.463	66%	0.66	S	S	.	*	H	α-helix	trans	-74	-37.5	-178.2	-167.7	164.8	-16.8	0	0	112.6	K1441 F1442 Q1448 Q1449	K1441-Q1445 WeakPolarHBondContact O-CB 3.22Å; K1441-Q1445 PolarHBondContact O-N 3.14Å; F1442-Q1445 PolarHBondContact O-N 3.24Å; Q1445-Q1448 PolarHBondContact O-N 2.85Å; Q1445-Q1449 PolarHBondContact O-N 2.9Å
1446	Y	32.3	Very low	31.9	Very low	159 Å²	159	136.8 Å²	136.8	62%	0.624	66%	0.661	S	S	*	*	H	α-helix	trans	-67.2	-38	175.3	-147.5	-102.3	0	0	0	111.9	F1442 Q1448 Q1449	F1442-Y1446 PolarHBondContact O-N 3Å; Y1446-Q1448 PolarHBondContact O-N 3.4Å; Y1446-Q1449 PolarHBondContact O-N 2.8Å
1447	K	36.5	Very low	32	Very low	158 Å²	158	137.8 Å²	137.8	69%	0.687	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.3	175.9	-145	171.6	-171.1	176.4	0	113.6	Y1443	Y1443-K1447 PolarHBondContact O-N 2.99Å
1448	Q	37.6	Very low	32	Very low	132 Å²	132	138.3 Å²	138.3	62%	0.617	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-9.9	171.7	-71	178.6	32.7	0	0	113.9	E1444 Q1445 Y1446 T1452	E1444-Q1448 WeakPolarHBondContact O-CG 3.39Å; E1444-Q1448 PolarHBondContact O-N 3.4Å; Q1445-Q1448 PolarHBondContact O-N 2.85Å; Y1446-Q1448 PolarHBondContact O-N 3.4Å; Q1448-T1452 VanDerWaalsContact O-CG2 3.22Å; Q1448-T1452 WeakPolarHBondContact O-CG2 3.38Å; Q1448-T1452 PolarHBondContact O-OG1 2.82Å
1449	Q	33.5	Very low	32.3	Very low	123 Å²	123	142 Å²	142	58%	0.575	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-18.7	-176.7	-72.1	-174.2	-17.9	0	0	114.5	Q1445 Y1446 T1452	Q1445-Q1449 PolarHBondContact O-N 2.9Å; Y1446-Q1449 PolarHBondContact O-N 2.8Å; Q1449-T1452 WeakPolarHBondContact CA-OG1 3.29Å; Q1449-T1452 PolarHBondContact O-OG1 3.06Å
1450	T	28.8	Very low	32.5	Very low	102 Å²	102	147.1 Å²	147.1	63%	0.626	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	8	172.5	50.7	0	0	0	0	114.4
1451	N	33.1	Very low	32.5	Very low	115 Å²	115	147 Å²	147	62%	0.615	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	16.8	171.4	-100.2	-44.7	0	0	0	112.9
1452	T	30.4	Very low	33.2	Very low	100 Å²	100	150 Å²	150	61%	0.613	71%	0.714	S	S	*	*			trans	-105.9	16.5	-178.1	39.3	0	0	0	0	115.2	Q1448 Q1449	Q1448-T1452 VanDerWaalsContact O-CG2 3.22Å; Q1448-T1452 WeakPolarHBondContact O-CG2 3.38Å; Q1448-T1452 PolarHBondContact O-OG1 2.82Å; Q1449-T1452 WeakPolarHBondContact CA-OG1 3.29Å; Q1449-T1452 PolarHBondContact O-OG1 3.06Å
1453	S	27.9	Very low	34.9	Very low	93 Å²	93	147 Å²	147	65%	0.65	71%	0.708	S	S	*	*	S	Bend	trans	-110.8	140.9	150.6	49.2	0	0	0	0	108.2
1454	I	29.1	Very low	37	Very low	159 Å²	159	148.5 Å²	148.5	82%	0.815	71%	0.713	S	S	*	*	S	Bend	trans	67.5	42.3	-172.4	-33.2	174.8	0	0	0	114.9
1455	Y	27.8	Very low	39.4	Very low	213 Å²	213	143.7 Å²	143.7	84%	0.835	69%	0.691	S	S	*	*	S	Bend	trans	-152.4	28.3	157	-101.6	-58.6	0	0	0	116.1
1456	S	28.6	Very low	41.8	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	70%	0.695	S	S	*	*	S	Bend	trans	-122.3	19.7	-175.1	54.4	0	0	0	0	115.4
1457	L	30.3	Very low	44.3	Very low	171 Å²	171	141.3 Å²	141.3	90%	0.895	69%	0.689	S	S	*	*			trans	-122.9	23.8	-174.5	-114.5	167.1	0	0	0	115.9
1458	Q	29.6	Very low	46.7	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	68%	0.684	S	S	*	*			trans	-113	105.1	166.3	-70.5	-167.9	2.3	0	0	112	R1460	Q1458-R1460 PolarHBondContact O-N 2.89Å; Q1458-R1460 VanDerWaalsContact O-N 3.16Å
1459	K	31.8	Very low	49.2	Very low	203 Å²	203	133.8 Å²	133.8	88%	0.883	66%	0.663	S	S	*	*			trans	-62.8	113.1	154.2	-73.6	179.1	179	174.9	0	106.7	S1461	K1459-S1461 PolarHBondContact O-N 3.29Å
1460	R	34.9	Very low	51.9	Low	231 Å²	231	130 Å²	130	87%	0.872	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-47.5	118.5	179.4	-67.5	-174	-176.4	-173.6	0.7	109.8	Q1458 R1462	Q1458-R1460 PolarHBondContact O-N 2.89Å; Q1458-R1460 VanDerWaalsContact O-N 3.16Å; R1460-R1462 PolarHBondContact O-N 3.16Å
1461	S	38.4	Very low	54.8	Low	114 Å²	114	128.4 Å²	128.4	80%	0.797	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-51.7	130.9	176.2	-67.1	0	0	0	0	109.3	K1459 T1463	K1459-S1461 PolarHBondContact O-N 3.29Å; S1461-T1463 PolarHBondContact O-N 3.49Å; S1461-T1463 VanDerWaalsContact O-N 3.09Å
1462	R	48.9	Very low	57.6	Low	225 Å²	225	125.2 Å²	125.2	85%	0.849	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-56.2	121.7	177.8	-178.9	-176.1	-179	-164.2	0.3	108.2	R1460 R1464	R1460-R1462 PolarHBondContact O-N 3.16Å; R1462-R1464 PolarHBondContact O-N 3.16Å; R1462-R1464 VanDerWaalsContact O-N 3.07Å
1463	T	69.4	Low	60.6	Low	84 Å²	84	120.5 Å²	120.5	52%	0.515	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-51.8	117.6	177.9	39	0	0	0	0	109.8	S1461 V1501	S1461-T1463 PolarHBondContact O-N 3.49Å; S1461-T1463 VanDerWaalsContact O-N 3.09Å; T1463-V1501 HydrophobicContact CG2-CG2 4.5Å
1464	R	75.2	Confident	63.6	Low	226 Å²	226	122.3 Å²	122.3	85%	0.853	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-77.6	138.5	159.7	-72.9	-177.3	172.6	-174.8	-1.6	106.5	R1462	R1462-R1464 PolarHBondContact O-N 3.16Å; R1462-R1464 VanDerWaalsContact O-N 3.07Å
1465	L	85.5	Confident	66.4	Low	34 Å²	34	116.3 Å²	116.3	18%	0.178	55%	0.552	C	S	.	*			trans	-105.8	134.6	173.5	-55.6	179.5	0	0	0	106.3	L1470 L1473 L1497 V1501 W1505	L1465-L1470 HydrophobicContact CB-CD2 3.88Å; L1465-L1470 HydrophobicContact CB-CG 3.89Å; L1465-L1470 HydrophobicContact CD1-CD2 3.84Å; L1465-L1470 HydrophobicContact CG-CD2 4.49Å; L1465-L1473 HydrophobicContact CD1-CD1 3.71Å; L1465-L1497 HydrophobicContact CD2-CD1 3.72Å; L1465-L1497 HydrophobicContact CD2-CD2 3.56Å; L1465-L1497 HydrophobicContact CD2-CG 4.31Å; L1465-V1501 HydrophobicContact CD2-CG1 4.16Å; L1465-W1505 HydrophobicContact CD1-CG 4.32Å
1466	N	87.3	Confident	69.3	Low	103 Å²	103	108 Å²	108	55%	0.551	52%	0.52	S	S	*	.			trans	-74.7	159.6	176.7	-66.9	-5.7	0	0	0	109.9	T1468 Q1469 L1470	N1466-T1468 VanDerWaalsContact C-N 3.27Å; N1466-T1468 PolarHBondContact O-N 2.91Å; N1466-Q1469 HydrophobicContact CB-CG 4.39Å; N1466-Q1469 WeakPolarHBondContact O-CB 3.32Å; N1466-Q1469 PolarHBondContact O-N 3.15Å; N1466-L1470 PolarHBondContact O-N 3.13Å
1467	E	84.9	Confident	72.3	Confident	105 Å²	105	103.2 Å²	103.2	49%	0.491	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-38.1	-176	-158.9	71.5	169	0	0	112.1	Q1469 L1470 N1471	E1467-Q1469 PolarHBondContact O-N 3.35Å; E1467-L1470 PolarHBondContact O-N 3.16Å; E1467-N1471 WeakPolarHBondContact O-CB 3.31Å; E1467-N1471 PolarHBondContact O-N 3.35Å; E1467-N1471 PolarHBondContact O-OD1 2.9Å
1468	T	87.2	Confident	74.8	Confident	97 Å²	97	99.8 Å²	99.8	60%	0.595	47%	0.468	S	S	*	.	H	α-helix	trans	-58.9	-45.2	172.5	50.4	0	0	0	0	112.6	N1466 L1470 N1471 I1472	N1466-T1468 VanDerWaalsContact C-N 3.27Å; N1466-T1468 PolarHBondContact O-N 2.91Å; T1468-L1470 VanDerWaalsContact C-N 3.35Å; T1468-N1471 PolarHBondContact O-N 3.21Å; T1468-I1472 WeakPolarHBondContact O-CG1 3.33Å; T1468-I1472 PolarHBondContact O-N 3.46Å; T1468-I1472 VanDerWaalsContact O-N 3.11Å
1469	Q	89.9	Confident	77.5	Confident	35 Å²	35	97.7 Å²	97.7	16%	0.164	46%	0.461	C	S	.	.	H	α-helix	trans	-65.6	-38.2	176.1	-63.8	173.9	-39.3	0	0	111.5	N1466 E1467 L1473 T1495 L1497	N1466-Q1469 HydrophobicContact CB-CG 4.39Å; N1466-Q1469 WeakPolarHBondContact O-CB 3.32Å; N1466-Q1469 PolarHBondContact O-N 3.15Å; E1467-Q1469 PolarHBondContact O-N 3.35Å; Q1469-L1473 WeakPolarHBondContact O-CB 3.3Å; Q1469-L1473 WeakPolarHBondContact O-CD1 3.48Å; Q1469-L1473 WeakPolarHBondContact O-CG 3.47Å; Q1469-L1473 PolarHBondContact O-N 3.16Å; Q1469-T1495 PolarHBondContact NE2-O 3.23Å; Q1469-L1497 HydrophobicContact CB-CD1 4.39Å
1470	L	91.6	Very high	79.9	Confident	43 Å²	43	90.9 Å²	90.9	23%	0.225	43%	0.434	C	S	.	.	H	α-helix	trans	-67.3	-38.4	176.3	-72.9	172.6	0	0	0	112.2	L1465 N1466 E1467 T1468 L1473 R1474	L1465-L1470 HydrophobicContact CB-CD2 3.88Å; L1465-L1470 HydrophobicContact CB-CG 3.89Å; L1465-L1470 HydrophobicContact CD1-CD2 3.84Å; L1465-L1470 HydrophobicContact CG-CD2 4.49Å; N1466-L1470 PolarHBondContact O-N 3.13Å; E1467-L1470 PolarHBondContact O-N 3.16Å; T1468-L1470 VanDerWaalsContact C-N 3.35Å; L1470-L1473 PolarHBondContact O-N 3.09Å; L1470-R1474 WeakPolarHBondContact O-CB 3.45Å; L1470-R1474 VanDerWaalsContact O-CG 3.25Å; L1470-R1474 WeakPolarHBondContact O-CG 3.45Å; L1470-R1474 PolarHBondContact O-N 3.35Å
1471	N	90.2	Very high	82.2	Confident	70 Å²	70	82.4 Å²	82.4	37%	0.374	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-41.3	178	-69.6	-5.6	0	0	0	111.6	E1467 T1468 R1474 S1475	E1467-N1471 WeakPolarHBondContact O-CB 3.31Å; E1467-N1471 PolarHBondContact O-N 3.35Å; E1467-N1471 PolarHBondContact O-OD1 2.9Å; T1468-N1471 PolarHBondContact O-N 3.21Å; N1471-R1474 PolarHBondContact O-N 3.39Å; N1471-S1475 PolarHBondContact O-N 2.82Å; N1471-S1475 PolarHBondContact O-OG 3.04Å
1472	I	90.1	Very high	84.5	Confident	48 Å²	48	80.7 Å²	80.7	25%	0.246	39%	0.394	C	S	.	.	H	α-helix	trans	-64.2	-44.7	172.4	-62.8	164.3	0	0	0	110.8	T1468 R1474 S1475 Y1476 K1494 T1495	T1468-I1472 WeakPolarHBondContact O-CG1 3.33Å; T1468-I1472 PolarHBondContact O-N 3.46Å; T1468-I1472 VanDerWaalsContact O-N 3.11Å; I1472-R1474 VanDerWaalsContact C-N 3.27Å; I1472-R1474 PolarHBondContact O-N 3.15Å; I1472-S1475 PolarHBondContact O-N 2.99Å; I1472-S1475 PolarHBondContact O-OG 3.3Å; I1472-Y1476 HydrophobicContact CG2-CD2 4.13Å; I1472-Y1476 HydrophobicContact CG2-CE2 4.2Å; I1472-Y1476 WeakPolarHBondContact O-CD2 3.11Å; I1472-Y1476 PolarHBondContact O-N 3.41Å; I1472-K1494 WeakPolarHBondContact CD1-O 2.98Å; I1472-K1494 HydrophobicContact CG2-CB 4.22Å; I1472-T1495 HydrophobicContact CB-CG2 3.84Å; I1472-T1495 HydrophobicContact CD1-CG2 4.28Å; I1472-T1495 HydrophobicContact CG2-CG2 3.57Å
1473	L	93.4	Very high	86.2	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-34.1	177.4	-74.7	166.8	0	0	0	112.6	L1465 Q1469 L1470 F1477 I1491 T1495 L1497 V1502 W1505 F1506	L1465-L1473 HydrophobicContact CD1-CD1 3.71Å; Q1469-L1473 WeakPolarHBondContact O-CB 3.3Å; Q1469-L1473 WeakPolarHBondContact O-CD1 3.48Å; Q1469-L1473 WeakPolarHBondContact O-CG 3.47Å; Q1469-L1473 PolarHBondContact O-N 3.16Å; L1470-L1473 PolarHBondContact O-N 3.09Å; L1473-F1477 VanDerWaalsContact O-CB 3.31Å; L1473-F1477 WeakPolarHBondContact O-CB 3.36Å; L1473-F1477 PolarHBondContact O-N 2.82Å; L1473-I1491 HydrophobicContact CD2-CG2 3.72Å; L1473-T1495 HydrophobicContact CG-CG2 4.35Å; L1473-L1497 HydrophobicContact CD1-CD1 3.84Å; L1473-V1502 HydrophobicContact CD2-CG1 4.04Å; L1473-V1502 HydrophobicContact CD2-CG2 4.39Å; L1473-W1505 HydrophobicContact CB-CD2 3.99Å; L1473-W1505 HydrophobicContact CB-CE3 3.94Å; L1473-W1505 HydrophobicContact CB-CH2 3.85Å; L1473-W1505 HydrophobicContact CB-CZ2 3.86Å; L1473-W1505 HydrophobicContact CB-CZ3 3.89Å; L1473-W1505 HydrophobicContact CD1-CD2 4Å; L1473-W1505 HydrophobicContact CD1-CG 3.93Å; L1473-W1505 HydrophobicContact CD2-CD2 4.34Å; L1473-W1505 HydrophobicContact CD2-CE3 4.21Å; L1473-W1505 HydrophobicContact CG-CD2 4.35Å; L1473-W1505 HydrophobicContact CG-CE3 4.49Å; L1473-W1505 WeakPolarHBondContact O-CH2 3.48Å; L1473-W1505 VanDerWaalsContact O-CZ3 3.29Å; L1473-W1505 WeakPolarHBondContact O-CZ3 3.25Å; L1473-F1506 HydrophobicContact CD2-CD2 4.32Å; L1473-F1506 HydrophobicContact CD2-CE2 3.79Å
1474	R	90.8	Very high	87.1	Confident	131 Å²	131	69.3 Å²	69.3	49%	0.494	35%	0.352	S	S	.	.	H	α-helix	trans	-69.3	-54.9	174.4	-77.5	175.9	174.1	-74.6	9.3	112.3	L1470 N1471 I1472 Y1476 F1477 D1478 W1505	L1470-R1474 WeakPolarHBondContact O-CB 3.45Å; L1470-R1474 VanDerWaalsContact O-CG 3.25Å; L1470-R1474 WeakPolarHBondContact O-CG 3.45Å; L1470-R1474 PolarHBondContact O-N 3.35Å; N1471-R1474 PolarHBondContact O-N 3.39Å; I1472-R1474 VanDerWaalsContact C-N 3.27Å; I1472-R1474 PolarHBondContact O-N 3.15Å; R1474-Y1476 PolarHBondContact O-N 2.68Å; R1474-Y1476 VanDerWaalsContact O-N 3.11Å; R1474-F1477 CarbonylContact O-C 3.6Å; R1474-F1477 WeakPolarHBondContact O-CA 3.38Å; R1474-F1477 WeakPolarHBondContact O-CB 3.32Å; R1474-F1477 PolarHBondContact O-N 3.26Å; R1474-D1478 PolarHBondContact O-N 2.99Å; R1474-W1505 HydrophobicContact CG-CH2 4.2Å; R1474-W1505 HydrophobicContact CG-CZ2 4.34Å
1475	S	88.6	Confident	87.8	Confident	34 Å²	34	63.2 Å²	63.2	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-37	-176.3	62.7	0	0	0	0	112.6	N1471 I1472 I1479	N1471-S1475 PolarHBondContact O-N 2.82Å; N1471-S1475 PolarHBondContact O-OG 3.04Å; I1472-S1475 PolarHBondContact O-N 2.99Å; I1472-S1475 PolarHBondContact O-OG 3.3Å; S1475-I1479 WeakPolarHBondContact O-CB 3.35Å; S1475-I1479 WeakPolarHBondContact O-CD1 3.41Å; S1475-I1479 WeakPolarHBondContact O-CG1 3.5Å; S1475-I1479 PolarHBondContact O-N 3.49Å; S1475-I1479 VanDerWaalsContact O-N 3.17Å
1476	Y	89.1	Confident	87.9	Confident	38 Å²	38	69 Å²	69	15%	0.149	36%	0.362	C	S	.	.	H	α-helix	trans	-72.6	-28.7	172.8	-83.4	-96.3	0	0	0	114.7	I1472 R1474 N1480 E1490 I1491 K1494	I1472-Y1476 HydrophobicContact CG2-CD2 4.13Å; I1472-Y1476 HydrophobicContact CG2-CE2 4.2Å; I1472-Y1476 WeakPolarHBondContact O-CD2 3.11Å; I1472-Y1476 PolarHBondContact O-N 3.41Å; R1474-Y1476 PolarHBondContact O-N 2.68Å; R1474-Y1476 VanDerWaalsContact O-N 3.11Å; Y1476-N1480 CarbonylContact O-C 3.12Å; Y1476-N1480 PolarHBondContact O-N 3.39Å; Y1476-N1480 VanDerWaalsContact O-O 3.08Å; Y1476-E1490 VanDerWaalsContact CE1-OE2 3.26Å; Y1476-E1490 WeakPolarHBondContact CE1-OE2 3.49Å; Y1476-E1490 PolarHBondContact OH-OE1 3.36Å; Y1476-E1490 PolarHBondContact OH-OE2 3.02Å; Y1476-I1491 HydrophobicContact CD1-CD1 3.54Å; Y1476-I1491 HydrophobicContact CD1-CG1 3.47Å; Y1476-I1491 VanDerWaalsContact CD1-CG1 3.47Å; Y1476-I1491 HydrophobicContact CD2-CD1 4.49Å; Y1476-I1491 HydrophobicContact CD2-CG1 3.89Å; Y1476-I1491 HydrophobicContact CE1-CD1 4.27Å; Y1476-I1491 HydrophobicContact CE1-CG1 3.78Å; Y1476-I1491 HydrophobicContact CE2-CG1 4.19Å; Y1476-I1491 HydrophobicContact CG-CD1 3.65Å; Y1476-I1491 HydrophobicContact CG-CG1 3.5Å; Y1476-K1494 HydrophobicContact CE2-CD 4.3Å; Y1476-K1494 WeakPolarHBondContact OH-CD 3.42Å; Y1476-K1494 PolarHBondContact OH-NZ 2.96Å
1477	F	90.7	Very high	87.9	Confident	10 Å²	10	68.7 Å²	68.7	4%	0.044	36%	0.356	C	S	.	.	H	α-helix	trans	-74.6	-41.6	175.4	-175.4	-89.4	0	0	0	112.3	L1473 R1474 I1479 N1480 N1481 W1505 F1506 T1509 L1510 E1513	L1473-F1477 VanDerWaalsContact O-CB 3.31Å; L1473-F1477 WeakPolarHBondContact O-CB 3.36Å; L1473-F1477 PolarHBondContact O-N 2.82Å; R1474-F1477 CarbonylContact O-C 3.6Å; R1474-F1477 WeakPolarHBondContact O-CA 3.38Å; R1474-F1477 WeakPolarHBondContact O-CB 3.32Å; R1474-F1477 PolarHBondContact O-N 3.26Å; F1477-I1479 VanDerWaalsContact C-N 3.31Å; F1477-N1480 CarbonylContact O-C 3.3Å; F1477-N1480 PolarHBondContact O-N 2.72Å; F1477-N1481 WeakPolarHBondContact CE1-OD1 3.48Å; F1477-N1481 WeakPolarHBondContact CZ-OD1 3.44Å; F1477-N1481 PolarHBondContact O-N 2.95Å; F1477-N1481 VanDerWaalsContact O-N 3.08Å; F1477-W1505 HydrophobicContact CB-CH2 4.23Å; F1477-W1505 HydrophobicContact CB-CZ3 3.89Å; F1477-W1505 AromaticContact CD2-CZ3 3.93Å; F1477-W1505 HydrophobicContact CD2-CZ3 3.93Å; F1477-W1505 HydrophobicContact CG-CH2 4.43Å; F1477-W1505 HydrophobicContact CG-CZ3 4.07Å; F1477-F1506 HydrophobicContact CB-CD1 4.43Å; F1477-F1506 HydrophobicContact CB-CE1 3.79Å; F1477-F1506 HydrophobicContact CB-CZ 4.19Å; F1477-F1506 AromaticContact CD2-CD1 3.63Å; F1477-F1506 HydrophobicContact CD2-CD1 3.63Å; F1477-F1506 AromaticContact CD2-CE1 3.86Å; F1477-F1506 HydrophobicContact CD2-CE1 3.86Å; F1477-F1506 HydrophobicContact CD2-CG 4.39Å; F1477-F1506 HydrophobicContact CE2-CD1 4.44Å; F1477-F1506 HydrophobicContact CG-CE1 4.32Å; F1477-T1509 HydrophobicContact CD1-CG2 4.09Å; F1477-T1509 HydrophobicContact CD2-CG2 4.07Å; F1477-T1509 HydrophobicContact CE1-CG2 3.71Å; F1477-T1509 HydrophobicContact CE2-CG2 3.7Å; F1477-T1509 HydrophobicContact CG-CG2 4.27Å; F1477-T1509 HydrophobicContact CZ-CG2 3.51Å; F1477-L1510 HydrophobicContact CE2-CB 4.03Å; F1477-L1510 HydrophobicContact CE2-CD1 4.35Å; F1477-L1510 HydrophobicContact CZ-CB 4.24Å; F1477-L1510 HydrophobicContact CZ-CD1 4.11Å; F1477-E1513 HydrophobicContact CE1-CG 4.32Å; F1477-E1513 HydrophobicContact CZ-CG 4.37Å
1478	D	84.4	Confident	88.2	Confident	100 Å²	100	64.2 Å²	64.2	54%	0.535	34%	0.335	S	S	.	.	H	α-helix	trans	-69.6	-32.6	179.8	-55	-34.3	0	0	0	110.2	R1474	R1474-D1478 PolarHBondContact O-N 2.99Å
1479	I	84.7	Confident	88.4	Confident	121 Å²	121	63.4 Å²	63.4	62%	0.621	33%	0.327	S	S	*	.	H	α-helix	trans	-74.8	-43.4	168	-66.4	166.1	0	0	0	112.3	S1475 F1477	S1475-I1479 WeakPolarHBondContact O-CB 3.35Å; S1475-I1479 WeakPolarHBondContact O-CD1 3.41Å; S1475-I1479 WeakPolarHBondContact O-CG1 3.5Å; S1475-I1479 PolarHBondContact O-N 3.49Å; S1475-I1479 VanDerWaalsContact O-N 3.17Å; F1477-I1479 VanDerWaalsContact C-N 3.31Å
1480	N	82	Confident	88.5	Confident	59 Å²	59	65.3 Å²	65.3	32%	0.316	34%	0.336	S	S	.	.			trans	-147.5	109.3	176.7	-175.8	2	0	0	0	112.8	Y1476 F1477 S1482	Y1476-N1480 CarbonylContact O-C 3.12Å; Y1476-N1480 PolarHBondContact O-N 3.39Å; Y1476-N1480 VanDerWaalsContact O-O 3.08Å; F1477-N1480 CarbonylContact O-C 3.3Å; F1477-N1480 PolarHBondContact O-N 2.72Å; N1480-S1482 PolarHBondContact ND2-O 2.72Å; N1480-S1482 PolarHBondContact O-N 3Å; N1480-S1482 VanDerWaalsContact OD1-C 3.31Å; N1480-S1482 PolarHBondContact OD1-N 3.16Å; N1480-S1482 PolarHBondContact OD1-O 3.03Å
1481	N	84.1	Confident	88.5	Confident	54 Å²	54	63.3 Å²	63.3	29%	0.289	33%	0.325	S	S	.	.	S	Bend	trans	-58.2	-12.7	175	-83.2	-83.4	0	0	0	114.9	F1477 L1510	F1477-N1481 WeakPolarHBondContact CE1-OD1 3.48Å; F1477-N1481 WeakPolarHBondContact CZ-OD1 3.44Å; F1477-N1481 PolarHBondContact O-N 2.95Å; F1477-N1481 VanDerWaalsContact O-N 3.08Å; N1481-L1510 HydrophobicContact CB-CD1 3.81Å
1482	S	86.3	Confident	88.6	Confident	77 Å²	77	60.6 Å²	60.6	54%	0.538	31%	0.312	S	S	.	.	S	Bend	trans	-149.8	83.7	174.8	-71.1	0	0	0	0	111.1	N1480	N1480-S1482 PolarHBondContact ND2-O 2.72Å; N1480-S1482 PolarHBondContact O-N 3Å; N1480-S1482 VanDerWaalsContact OD1-C 3.31Å; N1480-S1482 PolarHBondContact OD1-N 3.16Å; N1480-S1482 PolarHBondContact OD1-O 3.03Å
1483	P	85.5	Confident	88.7	Confident	18 Å²	18	64.9 Å²	64.9	12%	0.117	34%	0.336	C	S	.	.			trans	-66.8	150.1	-179.1	28.1	-35.5	0	0	0	112.7	K1487 I1488 I1491 F1506	P1483-K1487 HydrophobicContact CB-CB 3.94Å; P1483-I1488 HydrophobicContact CB-CG1 4.05Å; P1483-I1488 HydrophobicContact CG-CD1 4.16Å; P1483-I1488 HydrophobicContact CG-CG1 3.69Å; P1483-I1488 WeakPolarHBondContact O-CD1 3.46Å; P1483-I1491 HydrophobicContact CB-CD1 4.4Å; P1483-I1491 HydrophobicContact CG-CD1 4.34Å; P1483-F1506 VanDerWaalsContact CD-CE1 3.44Å; P1483-F1506 HydrophobicContact CG-CD1 3.63Å; P1483-F1506 HydrophobicContact CG-CD2 4.44Å; P1483-F1506 HydrophobicContact CG-CE1 3.54Å; P1483-F1506 HydrophobicContact CG-CE2 4.38Å; P1483-F1506 HydrophobicContact CG-CG 4.11Å; P1483-F1506 HydrophobicContact CG-CZ 3.96Å
1484	S	88.6	Confident	88.6	Confident	53 Å²	53	70.2 Å²	70.2	37%	0.371	36%	0.359	S	S	.	.			trans	-68.1	161.7	170.2	57	0	0	0	0	111.5	E1486 K1487 I1488	S1484-E1486 PolarHBondContact O-N 2.93Å; S1484-K1487 PolarHBondContact O-N 3.13Å; S1484-K1487 VanDerWaalsContact O-N 3.07Å; S1484-I1488 WeakPolarHBondContact O-CG1 3.31Å; S1484-I1488 PolarHBondContact O-N 2.72Å
1485	D	89.2	Confident	88.5	Confident	97 Å²	97	64.4 Å²	64.4	52%	0.519	34%	0.338	S	S	.	.	H	α-helix	trans	-58.9	-33.6	179.8	-70.9	-45.1	0	0	0	113.2	I1488 N1489 K1503	D1485-I1488 PolarHBondContact O-N 3.08Å; D1485-N1489 VanDerWaalsContact O-CG 3.27Å; D1485-N1489 PolarHBondContact O-N 3.48Å; D1485-N1489 PolarHBondContact O-ND2 2.94Å; D1485-K1503 WeakPolarHBondContact OD1-CE 3.29Å; D1485-K1503 IonicContact OD1-NZ 2.77Å; D1485-K1503 PolarHBondContact OD1-NZ 3.41Å
1486	E	88.3	Confident	88.6	Confident	157 Å²	157	66.1 Å²	66.1	73%	0.734	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-50	171.7	-62.3	170	159.8	0	0	112.1	S1484 I1488 N1489 E1490	S1484-E1486 PolarHBondContact O-N 2.93Å; E1486-I1488 VanDerWaalsContact C-N 3.28Å; E1486-I1488 PolarHBondContact O-N 3.42Å; E1486-N1489 PolarHBondContact O-N 3.38Å; E1486-N1489 VanDerWaalsContact O-N 3.16Å; E1486-E1490 PolarHBondContact O-N 3.43Å
1487	K	86.7	Confident	88.7	Confident	96 Å²	96	65.3 Å²	65.3	42%	0.417	36%	0.359	S	S	.	.	H	α-helix	trans	-66.4	-32.3	177	-71.6	-175.5	176.9	-174.8	0	111.3	P1483 S1484 E1490 I1491	P1483-K1487 HydrophobicContact CB-CB 3.94Å; S1484-K1487 PolarHBondContact O-N 3.13Å; S1484-K1487 VanDerWaalsContact O-N 3.07Å; K1487-E1490 PolarHBondContact O-N 3.19Å; K1487-I1491 WeakPolarHBondContact O-CB 3.41Å; K1487-I1491 VanDerWaalsContact O-CD1 3.27Å; K1487-I1491 WeakPolarHBondContact O-CD1 3.41Å; K1487-I1491 WeakPolarHBondContact O-CG1 3.35Å; K1487-I1491 PolarHBondContact O-N 3.41Å
1488	I	92.2	Very high	88.6	Confident	11 Å²	11	71.4 Å²	71.4	6%	0.056	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-44.6	172	-70.3	161.8	0	0	0	110.4	P1483 S1484 D1485 E1486 E1490 I1491 C1492 E1499 V1502 K1503	P1483-I1488 HydrophobicContact CB-CG1 4.05Å; P1483-I1488 HydrophobicContact CG-CD1 4.16Å; P1483-I1488 HydrophobicContact CG-CG1 3.69Å; P1483-I1488 WeakPolarHBondContact O-CD1 3.46Å; S1484-I1488 WeakPolarHBondContact O-CG1 3.31Å; S1484-I1488 PolarHBondContact O-N 2.72Å; D1485-I1488 PolarHBondContact O-N 3.08Å; E1486-I1488 VanDerWaalsContact C-N 3.28Å; E1486-I1488 PolarHBondContact O-N 3.42Å; I1488-E1490 VanDerWaalsContact C-N 3.35Å; I1488-E1490 PolarHBondContact O-N 3.04Å; I1488-I1491 PolarHBondContact O-N 2.87Å; I1488-C1492 PolarHBondContact O-N 2.72Å; I1488-C1492 PolarHBondContact O-SG 2.93Å; I1488-E1499 HydrophobicContact CG2-CG 3.89Å; I1488-V1502 HydrophobicContact CG2-CB 4.42Å; I1488-V1502 HydrophobicContact CG2-CG1 4.13Å; I1488-K1503 HydrophobicContact CD1-CD 4.38Å; I1488-K1503 HydrophobicContact CD1-CG 3.85Å; I1488-K1503 HydrophobicContact CG2-CG 4Å
1489	N	90.8	Very high	88.9	Confident	80 Å²	80	70 Å²	70	43%	0.428	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-39.9	175.5	-69.8	-22	0	0	0	111.8	D1485 E1486 I1491 C1492 N1493	D1485-N1489 VanDerWaalsContact O-CG 3.27Å; D1485-N1489 PolarHBondContact O-N 3.48Å; D1485-N1489 PolarHBondContact O-ND2 2.94Å; E1486-N1489 PolarHBondContact O-N 3.38Å; E1486-N1489 VanDerWaalsContact O-N 3.16Å; N1489-I1491 PolarHBondContact O-N 3.48Å; N1489-C1492 WeakPolarHBondContact O-CB 3.34Å; N1489-C1492 PolarHBondContact O-N 3.21Å; N1489-N1493 VanDerWaalsContact O-CG 3.26Å; N1489-N1493 PolarHBondContact O-N 3.28Å; N1489-N1493 PolarHBondContact O-OD1 2.92Å
1490	E	91.1	Very high	89.1	Confident	75 Å²	75	72.1 Å²	72.1	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-59.1	-45.6	172.2	-162.5	-158.6	179	0	0	111.9	Y1476 E1486 K1487 I1488 C1492 N1493 K1494	Y1476-E1490 VanDerWaalsContact CE1-OE2 3.26Å; Y1476-E1490 WeakPolarHBondContact CE1-OE2 3.49Å; Y1476-E1490 PolarHBondContact OH-OE1 3.36Å; Y1476-E1490 PolarHBondContact OH-OE2 3.02Å; E1486-E1490 PolarHBondContact O-N 3.43Å; K1487-E1490 PolarHBondContact O-N 3.19Å; I1488-E1490 VanDerWaalsContact C-N 3.35Å; I1488-E1490 PolarHBondContact O-N 3.04Å; E1490-C1492 VanDerWaalsContact C-N 3.33Å; E1490-C1492 PolarHBondContact O-N 3.27Å; E1490-N1493 PolarHBondContact O-N 3.44Å; E1490-K1494 HydrophobicContact CG-CD 4.42Å; E1490-K1494 WeakPolarHBondContact O-CG 3.21Å; E1490-K1494 PolarHBondContact O-N 3.49Å; E1490-K1494 VanDerWaalsContact OE1-CE 3.27Å; E1490-K1494 WeakPolarHBondContact OE1-CE 3.23Å; E1490-K1494 IonicContact OE1-NZ 3.93Å; E1490-K1494 PolarHBondContact OE1-NZ 3.1Å
1491	I	92.4	Very high	89.6	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.6	-37.9	175.4	-65.5	158	0	0	0	111.1	L1473 Y1476 P1483 K1487 I1488 N1489 K1494 T1495 V1502 F1506	L1473-I1491 HydrophobicContact CD2-CG2 3.72Å; Y1476-I1491 HydrophobicContact CD1-CD1 3.54Å; Y1476-I1491 HydrophobicContact CD1-CG1 3.47Å; Y1476-I1491 VanDerWaalsContact CD1-CG1 3.47Å; Y1476-I1491 HydrophobicContact CD2-CD1 4.49Å; Y1476-I1491 HydrophobicContact CD2-CG1 3.89Å; Y1476-I1491 HydrophobicContact CE1-CD1 4.27Å; Y1476-I1491 HydrophobicContact CE1-CG1 3.78Å; Y1476-I1491 HydrophobicContact CE2-CG1 4.19Å; Y1476-I1491 HydrophobicContact CG-CD1 3.65Å; Y1476-I1491 HydrophobicContact CG-CG1 3.5Å; P1483-I1491 HydrophobicContact CB-CD1 4.4Å; P1483-I1491 HydrophobicContact CG-CD1 4.34Å; K1487-I1491 WeakPolarHBondContact O-CB 3.41Å; K1487-I1491 VanDerWaalsContact O-CD1 3.27Å; K1487-I1491 WeakPolarHBondContact O-CD1 3.41Å; K1487-I1491 WeakPolarHBondContact O-CG1 3.35Å; K1487-I1491 PolarHBondContact O-N 3.41Å; I1488-I1491 PolarHBondContact O-N 2.87Å; N1489-I1491 PolarHBondContact O-N 3.48Å; I1491-K1494 PolarHBondContact O-N 3.47Å; I1491-T1495 HydrophobicContact CG2-CG2 4.1Å; I1491-T1495 VanDerWaalsContact O-CB 3.31Å; I1491-T1495 WeakPolarHBondContact O-CB 3.31Å; I1491-T1495 VanDerWaalsContact O-CG2 3.31Å; I1491-T1495 WeakPolarHBondContact O-CG2 3.38Å; I1491-T1495 PolarHBondContact O-N 3.07Å; I1491-T1495 PolarHBondContact O-OG1 3.08Å; I1491-V1502 HydrophobicContact CB-CG1 4.16Å; I1491-V1502 HydrophobicContact CG2-CG1 3.61Å; I1491-V1502 HydrophobicContact CG2-CG2 4.17Å; I1491-F1506 HydrophobicContact CD1-CE2 3.9Å; I1491-F1506 HydrophobicContact CD1-CZ 3.78Å
1492	C	92.8	Very high	90	Very high	14 Å²	14	68.1 Å²	68.1	10%	0.095	36%	0.362	C	S	.	.	H	α-helix	trans	-60.8	-48.5	175	-65	0	0	0	0	110.8	I1488 N1489 E1490 K1494 T1495 G1496 L1497 E1499	I1488-C1492 PolarHBondContact O-N 2.72Å; I1488-C1492 PolarHBondContact O-SG 2.93Å; N1489-C1492 WeakPolarHBondContact O-CB 3.34Å; N1489-C1492 PolarHBondContact O-N 3.21Å; E1490-C1492 VanDerWaalsContact C-N 3.33Å; E1490-C1492 PolarHBondContact O-N 3.27Å; C1492-K1494 PolarHBondContact O-N 3.38Å; C1492-T1495 PolarHBondContact O-N 3.43Å; C1492-G1496 WeakPolarHBondContact O-CA 3.41Å; C1492-G1496 PolarHBondContact O-N 2.99Å; C1492-L1497 VanDerWaalsContact CB-O 3.31Å; C1492-L1497 WeakPolarHBondContact CB-O 3.49Å; C1492-L1497 PolarHBondContact O-N 3.35Å; C1492-E1499 WeakPolarHBondContact SG-CA 3.49Å; C1492-E1499 PolarHBondContact SG-N 2.86Å
1493	N	91.5	Very high	90.3	Very high	138 Å²	138	67.9 Å²	67.9	74%	0.738	35%	0.351	S	S	*	.	H	α-helix	trans	-61.7	-43.9	178.4	-65.1	-9.7	0	0	0	111.3	N1489 E1490 T1495	N1489-N1493 VanDerWaalsContact O-CG 3.26Å; N1489-N1493 PolarHBondContact O-N 3.28Å; N1489-N1493 PolarHBondContact O-OD1 2.92Å; E1490-N1493 PolarHBondContact O-N 3.44Å; N1493-T1495 PolarHBondContact O-N 2.87Å
1494	K	91.1	Very high	90.4	Very high	112 Å²	112	71.3 Å²	71.3	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-71.9	-23.8	178.6	-73	-179.5	178.3	174.3	0	114.5	I1472 Y1476 E1490 I1491 C1492	I1472-K1494 WeakPolarHBondContact CD1-O 2.98Å; I1472-K1494 HydrophobicContact CG2-CB 4.22Å; Y1476-K1494 HydrophobicContact CE2-CD 4.3Å; Y1476-K1494 WeakPolarHBondContact OH-CD 3.42Å; Y1476-K1494 PolarHBondContact OH-NZ 2.96Å; E1490-K1494 HydrophobicContact CG-CD 4.42Å; E1490-K1494 WeakPolarHBondContact O-CG 3.21Å; E1490-K1494 PolarHBondContact O-N 3.49Å; E1490-K1494 VanDerWaalsContact OE1-CE 3.27Å; E1490-K1494 WeakPolarHBondContact OE1-CE 3.23Å; E1490-K1494 IonicContact OE1-NZ 3.93Å; E1490-K1494 PolarHBondContact OE1-NZ 3.1Å; I1491-K1494 PolarHBondContact O-N 3.47Å; C1492-K1494 PolarHBondContact O-N 3.38Å
1495	T	89.1	Confident	90.7	Very high	9 Å²	9	70.5 Å²	70.5	6%	0.055	36%	0.355	C	S	.	.	H	α-helix	trans	-105	-13.7	-178.3	59	0	0	0	0	114.5	Q1469 I1472 L1473 I1491 C1492 N1493 L1497	Q1469-T1495 PolarHBondContact NE2-O 3.23Å; I1472-T1495 HydrophobicContact CB-CG2 3.84Å; I1472-T1495 HydrophobicContact CD1-CG2 4.28Å; I1472-T1495 HydrophobicContact CG2-CG2 3.57Å; L1473-T1495 HydrophobicContact CG-CG2 4.35Å; I1491-T1495 HydrophobicContact CG2-CG2 4.1Å; I1491-T1495 VanDerWaalsContact O-CB 3.31Å; I1491-T1495 WeakPolarHBondContact O-CB 3.31Å; I1491-T1495 VanDerWaalsContact O-CG2 3.31Å; I1491-T1495 WeakPolarHBondContact O-CG2 3.38Å; I1491-T1495 PolarHBondContact O-N 3.07Å; I1491-T1495 PolarHBondContact O-OG1 3.08Å; C1492-T1495 PolarHBondContact O-N 3.43Å; N1493-T1495 PolarHBondContact O-N 2.87Å; T1495-L1497 HydrophobicContact CG2-CD1 4.38Å; T1495-L1497 PolarHBondContact O-N 2.87Å; T1495-L1497 WeakPolarHBondContact OG1-CB 3.41Å; T1495-L1497 WeakPolarHBondContact OG1-CG 3.2Å; T1495-L1497 PolarHBondContact OG1-N 3.19Å
1496	G	89.3	Confident	90.9	Very high	70 Å²	70	66.4 Å²	66.4	72%	0.722	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	15.4	-169.1	0	0	0	0	0	113.7	C1492	C1492-G1496 WeakPolarHBondContact O-CA 3.41Å; C1492-G1496 PolarHBondContact O-N 2.99Å
1497	L	91.5	Very high	90.9	Very high	21 Å²	21	66.7 Å²	66.7	11%	0.11	33%	0.326	C	S	.	.			trans	-94.8	145.1	-177.5	-62.6	172.8	0	0	0	111.3	L1465 Q1469 L1473 C1492 T1495 V1502	L1465-L1497 HydrophobicContact CD2-CD1 3.72Å; L1465-L1497 HydrophobicContact CD2-CD2 3.56Å; L1465-L1497 HydrophobicContact CD2-CG 4.31Å; Q1469-L1497 HydrophobicContact CB-CD1 4.39Å; L1473-L1497 HydrophobicContact CD1-CD1 3.84Å; C1492-L1497 VanDerWaalsContact CB-O 3.31Å; C1492-L1497 WeakPolarHBondContact CB-O 3.49Å; C1492-L1497 PolarHBondContact O-N 3.35Å; T1495-L1497 HydrophobicContact CG2-CD1 4.38Å; T1495-L1497 PolarHBondContact O-N 2.87Å; T1495-L1497 WeakPolarHBondContact OG1-CB 3.41Å; T1495-L1497 WeakPolarHBondContact OG1-CG 3.2Å; T1495-L1497 PolarHBondContact OG1-N 3.19Å; L1497-V1502 HydrophobicContact CB-CG2 3.83Å; L1497-V1502 HydrophobicContact CD1-CG2 4.4Å
1498	Q	88.7	Confident	91	Very high	137 Å²	137	65 Å²	65	64%	0.64	32%	0.322	S	S	*	.			trans	-62.3	139	170.1	-65.8	-178	-9.5	0	0	110.7	K1500 V1501 V1502	Q1498-K1500 PolarHBondContact O-N 2.67Å; Q1498-K1500 VanDerWaalsContact O-N 3.08Å; Q1498-V1501 HydrophobicContact CB-CG2 4.24Å; Q1498-V1501 WeakPolarHBondContact O-CA 3.38Å; Q1498-V1501 VanDerWaalsContact O-CB 3.3Å; Q1498-V1501 WeakPolarHBondContact O-CB 3.35Å; Q1498-V1501 PolarHBondContact O-N 2.94Å; Q1498-V1502 PolarHBondContact O-N 3.29Å; Q1498-V1502 VanDerWaalsContact O-N 3.12Å
1499	E	90.7	Very high	90.9	Very high	72 Å²	72	65.2 Å²	65.2	34%	0.336	32%	0.324	S	S	.	.	H	α-helix	trans	-43.9	-42.6	174.8	-171.1	-138	147.1	0	0	113.7	I1488 C1492 V1501 V1502 K1503	I1488-E1499 HydrophobicContact CG2-CG 3.89Å; C1492-E1499 WeakPolarHBondContact SG-CA 3.49Å; C1492-E1499 PolarHBondContact SG-N 2.86Å; E1499-V1501 VanDerWaalsContact C-N 3.29Å; E1499-V1501 PolarHBondContact O-N 2.98Å; E1499-V1502 PolarHBondContact O-N 2.83Å; E1499-K1503 HydrophobicContact CG-CD 4.24Å; E1499-K1503 WeakPolarHBondContact O-CB 2.95Å; E1499-K1503 PolarHBondContact O-N 3.2Å; E1499-K1503 WeakPolarHBondContact OE1-CD 3.25Å; E1499-K1503 WeakPolarHBondContact OE1-CE 3.3Å; E1499-K1503 IonicContact OE1-NZ 2.63Å; E1499-K1503 PolarHBondContact OE1-NZ 2.86Å
1500	K	90.2	Very high	90.6	Very high	165 Å²	165	62.9 Å²	62.9	72%	0.717	31%	0.311	S	S	*	.	H	α-helix	trans	-65.9	-27.9	177.6	-66.3	174.4	-176.9	170.9	0	113.2	Q1498 H1504	Q1498-K1500 PolarHBondContact O-N 2.67Å; Q1498-K1500 VanDerWaalsContact O-N 3.08Å; K1500-H1504 WeakPolarHBondContact O-CB 3.32Å; K1500-H1504 PolarHBondContact O-N 3.16Å
1501	V	91.2	Very high	90.1	Very high	28 Å²	28	65.5 Å²	65.5	17%	0.17	32%	0.322	C	S	.	.	H	α-helix	trans	-77.6	-43.6	173.2	-179.4	0	0	0	0	110.4	T1463 L1465 Q1498 E1499 H1504 W1505	T1463-V1501 HydrophobicContact CG2-CG2 4.5Å; L1465-V1501 HydrophobicContact CD2-CG1 4.16Å; Q1498-V1501 HydrophobicContact CB-CG2 4.24Å; Q1498-V1501 WeakPolarHBondContact O-CA 3.38Å; Q1498-V1501 VanDerWaalsContact O-CB 3.3Å; Q1498-V1501 WeakPolarHBondContact O-CB 3.35Å; Q1498-V1501 PolarHBondContact O-N 2.94Å; E1499-V1501 VanDerWaalsContact C-N 3.29Å; E1499-V1501 PolarHBondContact O-N 2.98Å; V1501-H1504 PolarHBondContact O-N 3.1Å; V1501-W1505 WeakPolarHBondContact O-CB 3.25Å; V1501-W1505 PolarHBondContact O-N 2.84Å
1502	V	92.3	Very high	89.4	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-55.2	176.6	178.8	0	0	0	0	110.8	L1473 I1488 I1491 L1497 Q1498 E1499 H1504 W1505 F1506	L1473-V1502 HydrophobicContact CD2-CG1 4.04Å; L1473-V1502 HydrophobicContact CD2-CG2 4.39Å; I1488-V1502 HydrophobicContact CG2-CB 4.42Å; I1488-V1502 HydrophobicContact CG2-CG1 4.13Å; I1491-V1502 HydrophobicContact CB-CG1 4.16Å; I1491-V1502 HydrophobicContact CG2-CG1 3.61Å; I1491-V1502 HydrophobicContact CG2-CG2 4.17Å; L1497-V1502 HydrophobicContact CB-CG2 3.83Å; L1497-V1502 HydrophobicContact CD1-CG2 4.4Å; Q1498-V1502 PolarHBondContact O-N 3.29Å; Q1498-V1502 VanDerWaalsContact O-N 3.12Å; E1499-V1502 PolarHBondContact O-N 2.83Å; V1502-H1504 PolarHBondContact O-N 2.83Å; V1502-W1505 WeakPolarHBondContact O-CB 3.21Å; V1502-W1505 PolarHBondContact O-N 3.15Å; V1502-F1506 HydrophobicContact CG1-CD2 3.92Å; V1502-F1506 HydrophobicContact CG1-CE2 3.96Å; V1502-F1506 WeakPolarHBondContact O-CD2 3.27Å; V1502-F1506 PolarHBondContact O-N 3.25Å
1503	K	92.2	Very high	88.6	Confident	72 Å²	72	74.9 Å²	74.9	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-54.4	-39.8	175.5	-78.7	178.6	171.6	176.5	0	112.7	D1485 I1488 E1499 R1507	D1485-K1503 WeakPolarHBondContact OD1-CE 3.29Å; D1485-K1503 IonicContact OD1-NZ 2.77Å; D1485-K1503 PolarHBondContact OD1-NZ 3.41Å; I1488-K1503 HydrophobicContact CD1-CD 4.38Å; I1488-K1503 HydrophobicContact CD1-CG 3.85Å; I1488-K1503 HydrophobicContact CG2-CG 4Å; E1499-K1503 HydrophobicContact CG-CD 4.24Å; E1499-K1503 WeakPolarHBondContact O-CB 2.95Å; E1499-K1503 PolarHBondContact O-N 3.2Å; E1499-K1503 WeakPolarHBondContact OE1-CD 3.25Å; E1499-K1503 WeakPolarHBondContact OE1-CE 3.3Å; E1499-K1503 IonicContact OE1-NZ 2.63Å; E1499-K1503 PolarHBondContact OE1-NZ 2.86Å; K1503-R1507 WeakPolarHBondContact O-CB 3.39Å; K1503-R1507 PolarHBondContact O-N 3.22Å; K1503-R1507 VanDerWaalsContact O-N 3.16Å
1504	H	89	Confident	87.5	Confident	91 Å²	91	75.7 Å²	75.7	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-72.6	-34.3	177.6	-171.2	62.8	0	0	0	112.8	K1500 V1501 V1502 R1507 N1508	K1500-H1504 WeakPolarHBondContact O-CB 3.32Å; K1500-H1504 PolarHBondContact O-N 3.16Å; V1501-H1504 PolarHBondContact O-N 3.1Å; V1502-H1504 PolarHBondContact O-N 2.83Å; H1504-R1507 PolarHBondContact ND1-NH2 2.81Å; H1504-N1508 PolarHBondContact CD2-ND2 2.63Å; H1504-N1508 PolarHBondContact CE1-ND2 3.38Å; H1504-N1508 VanDerWaalsContact CE1-ND2 3.33Å; H1504-N1508 PolarHBondContact NE2-ND2 3.12Å; H1504-N1508 VanDerWaalsContact O-CB 3.27Å; H1504-N1508 WeakPolarHBondContact O-CB 3.36Å; H1504-N1508 PolarHBondContact O-N 2.94Å; H1504-N1508 PolarHBondContact O-ND2 3.19Å
1505	W	93.6	Very high	86.3	Confident	36 Å²	36	74.2 Å²	74.2	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-54.4	173.7	-173	99.4	0	0	0	110.7	L1465 L1473 R1474 F1477 V1501 V1502 R1507 N1508 T1509	L1465-W1505 HydrophobicContact CD1-CG 4.32Å; L1473-W1505 HydrophobicContact CB-CD2 3.99Å; L1473-W1505 HydrophobicContact CB-CE3 3.94Å; L1473-W1505 HydrophobicContact CB-CH2 3.85Å; L1473-W1505 HydrophobicContact CB-CZ2 3.86Å; L1473-W1505 HydrophobicContact CB-CZ3 3.89Å; L1473-W1505 HydrophobicContact CD1-CD2 4Å; L1473-W1505 HydrophobicContact CD1-CG 3.93Å; L1473-W1505 HydrophobicContact CD2-CD2 4.34Å; L1473-W1505 HydrophobicContact CD2-CE3 4.21Å; L1473-W1505 HydrophobicContact CG-CD2 4.35Å; L1473-W1505 HydrophobicContact CG-CE3 4.49Å; L1473-W1505 WeakPolarHBondContact O-CH2 3.48Å; L1473-W1505 VanDerWaalsContact O-CZ3 3.29Å; L1473-W1505 WeakPolarHBondContact O-CZ3 3.25Å; R1474-W1505 HydrophobicContact CG-CH2 4.2Å; R1474-W1505 HydrophobicContact CG-CZ2 4.34Å; F1477-W1505 HydrophobicContact CB-CH2 4.23Å; F1477-W1505 HydrophobicContact CB-CZ3 3.89Å; F1477-W1505 AromaticContact CD2-CZ3 3.93Å; F1477-W1505 HydrophobicContact CD2-CZ3 3.93Å; F1477-W1505 HydrophobicContact CG-CH2 4.43Å; F1477-W1505 HydrophobicContact CG-CZ3 4.07Å; V1501-W1505 WeakPolarHBondContact O-CB 3.25Å; V1501-W1505 PolarHBondContact O-N 2.84Å; V1502-W1505 WeakPolarHBondContact O-CB 3.21Å; V1502-W1505 PolarHBondContact O-N 3.15Å; W1505-R1507 VanDerWaalsContact C-N 3.34Å; W1505-R1507 PolarHBondContact O-N 2.83Å; W1505-N1508 PolarHBondContact O-N 3.45Å; W1505-T1509 HydrophobicContact CH2-CG2 4.06Å; W1505-T1509 HydrophobicContact CZ3-CG2 4.28Å; W1505-T1509 PolarHBondContact O-N 2.79Å; W1505-T1509 PolarHBondContact O-OG1 3.17Å; W1505-T1509 VanDerWaalsContact O-OG1 3.12Å
1506	F	95.2	Very high	84.9	Confident	11 Å²	11	80 Å²	80	5%	0.048	37%	0.374	C	S	.	.	H	α-helix	trans	-54.4	-49.1	179.2	-88.9	-99.1	0	0	0	111.6	L1473 F1477 P1483 I1491 V1502 N1508 T1509 L1510	L1473-F1506 HydrophobicContact CD2-CD2 4.32Å; L1473-F1506 HydrophobicContact CD2-CE2 3.79Å; F1477-F1506 HydrophobicContact CB-CD1 4.43Å; F1477-F1506 HydrophobicContact CB-CE1 3.79Å; F1477-F1506 HydrophobicContact CB-CZ 4.19Å; F1477-F1506 AromaticContact CD2-CD1 3.63Å; F1477-F1506 HydrophobicContact CD2-CD1 3.63Å; F1477-F1506 AromaticContact CD2-CE1 3.86Å; F1477-F1506 HydrophobicContact CD2-CE1 3.86Å; F1477-F1506 HydrophobicContact CD2-CG 4.39Å; F1477-F1506 HydrophobicContact CE2-CD1 4.44Å; F1477-F1506 HydrophobicContact CG-CE1 4.32Å; P1483-F1506 VanDerWaalsContact CD-CE1 3.44Å; P1483-F1506 HydrophobicContact CG-CD1 3.63Å; P1483-F1506 HydrophobicContact CG-CD2 4.44Å; P1483-F1506 HydrophobicContact CG-CE1 3.54Å; P1483-F1506 HydrophobicContact CG-CE2 4.38Å; P1483-F1506 HydrophobicContact CG-CG 4.11Å; P1483-F1506 HydrophobicContact CG-CZ 3.96Å; I1491-F1506 HydrophobicContact CD1-CE2 3.9Å; I1491-F1506 HydrophobicContact CD1-CZ 3.78Å; V1502-F1506 HydrophobicContact CG1-CD2 3.92Å; V1502-F1506 HydrophobicContact CG1-CE2 3.96Å; V1502-F1506 WeakPolarHBondContact O-CD2 3.27Å; V1502-F1506 PolarHBondContact O-N 3.25Å; F1506-N1508 VanDerWaalsContact C-N 3.31Å; F1506-N1508 PolarHBondContact O-N 2.65Å; F1506-T1509 PolarHBondContact O-N 2.8Å; F1506-L1510 VanDerWaalsContact O-CB 3.31Å; F1506-L1510 WeakPolarHBondContact O-CB 3.38Å; F1506-L1510 PolarHBondContact O-N 3.03Å
1507	R	88.4	Confident	82.8	Confident	163 Å²	163	82 Å²	82	62%	0.615	37%	0.368	S	S	*	.	H	α-helix	trans	-60.9	-37.5	177.8	-166.5	-179.8	73.3	-162.9	5.1	113	K1503 H1504 W1505 F1511	K1503-R1507 WeakPolarHBondContact O-CB 3.39Å; K1503-R1507 PolarHBondContact O-N 3.22Å; K1503-R1507 VanDerWaalsContact O-N 3.16Å; H1504-R1507 PolarHBondContact ND1-NH2 2.81Å; W1505-R1507 VanDerWaalsContact C-N 3.34Å; W1505-R1507 PolarHBondContact O-N 2.83Å; R1507-F1511 WeakPolarHBondContact O-CB 3.44Å; R1507-F1511 PolarHBondContact O-N 3.06Å; R1507-F1511 VanDerWaalsContact O-N 3.1Å
1508	N	88.7	Confident	80.6	Confident	59 Å²	59	87.6 Å²	87.6	32%	0.316	39%	0.392	S	S	.	.	H	α-helix	trans	-75.3	-35.7	178.6	-71.1	-19.6	0	0	0	112.6	H1504 W1505 F1506 K1512	H1504-N1508 PolarHBondContact CD2-ND2 2.63Å; H1504-N1508 PolarHBondContact CE1-ND2 3.38Å; H1504-N1508 VanDerWaalsContact CE1-ND2 3.33Å; H1504-N1508 PolarHBondContact NE2-ND2 3.12Å; H1504-N1508 VanDerWaalsContact O-CB 3.27Å; H1504-N1508 WeakPolarHBondContact O-CB 3.36Å; H1504-N1508 PolarHBondContact O-N 2.94Å; H1504-N1508 PolarHBondContact O-ND2 3.19Å; W1505-N1508 PolarHBondContact O-N 3.45Å; F1506-N1508 VanDerWaalsContact C-N 3.31Å; F1506-N1508 PolarHBondContact O-N 2.65Å; N1508-K1512 WeakPolarHBondContact O-CG 3.44Å; N1508-K1512 PolarHBondContact O-N 3.13Å; N1508-K1512 VanDerWaalsContact O-N 3.1Å
1509	T	88.3	Confident	78.3	Confident	17 Å²	17	88.9 Å²	88.9	10%	0.104	40%	0.403	C	S	.	.	H	α-helix	trans	-67.8	-48.6	175.2	-55.2	0	0	0	0	109.8	F1477 W1505 F1506 F1511 K1512 E1513	F1477-T1509 HydrophobicContact CD1-CG2 4.09Å; F1477-T1509 HydrophobicContact CD2-CG2 4.07Å; F1477-T1509 HydrophobicContact CE1-CG2 3.71Å; F1477-T1509 HydrophobicContact CE2-CG2 3.7Å; F1477-T1509 HydrophobicContact CG-CG2 4.27Å; F1477-T1509 HydrophobicContact CZ-CG2 3.51Å; W1505-T1509 HydrophobicContact CH2-CG2 4.06Å; W1505-T1509 HydrophobicContact CZ3-CG2 4.28Å; W1505-T1509 PolarHBondContact O-N 2.79Å; W1505-T1509 PolarHBondContact O-OG1 3.17Å; W1505-T1509 VanDerWaalsContact O-OG1 3.12Å; F1506-T1509 PolarHBondContact O-N 2.8Å; T1509-F1511 PolarHBondContact O-N 3.27Å; T1509-K1512 WeakPolarHBondContact O-CB 3.4Å; T1509-K1512 PolarHBondContact O-N 3.01Å; T1509-E1513 PolarHBondContact O-N 2.89Å
1510	L	86.4	Confident	76	Confident	31 Å²	31	89.7 Å²	89.7	16%	0.162	41%	0.409	C	S	.	.	H	α-helix	trans	-62.4	-26.3	175.7	-165.1	66.9	0	0	0	113.8	F1477 N1481 F1506 R1514	F1477-L1510 HydrophobicContact CE2-CB 4.03Å; F1477-L1510 HydrophobicContact CE2-CD1 4.35Å; F1477-L1510 HydrophobicContact CZ-CB 4.24Å; F1477-L1510 HydrophobicContact CZ-CD1 4.11Å; N1481-L1510 HydrophobicContact CB-CD1 3.81Å; F1506-L1510 VanDerWaalsContact O-CB 3.31Å; F1506-L1510 WeakPolarHBondContact O-CB 3.38Å; F1506-L1510 PolarHBondContact O-N 3.03Å; L1510-R1514 PolarHBondContact O-NE 3.39Å
1511	F	78.7	Confident	73.5	Confident	130 Å²	130	86.9 Å²	86.9	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-76	-36.2	171	-175.5	-96	0	0	0	112.3	R1507 T1509 Q1515	R1507-F1511 WeakPolarHBondContact O-CB 3.44Å; R1507-F1511 PolarHBondContact O-N 3.06Å; R1507-F1511 VanDerWaalsContact O-N 3.1Å; T1509-F1511 PolarHBondContact O-N 3.27Å; F1511-Q1515 HydrophobicContact CD1-CG 4.28Å; F1511-Q1515 HydrophobicContact CE1-CG 3.88Å; F1511-Q1515 HydrophobicContact CZ-CG 4.11Å; F1511-Q1515 VanDerWaalsContact O-CG 3.28Å; F1511-Q1515 WeakPolarHBondContact O-CG 3.46Å; F1511-Q1515 PolarHBondContact O-N 3.4Å
1512	K	78.1	Confident	70.8	Confident	133 Å²	133	94.2 Å²	94.2	58%	0.578	43%	0.434	S	S	*	.	H	α-helix	trans	-68.7	-42.3	177.4	-77	172.2	175.2	-178.1	0	113	N1508 T1509 R1514 Q1515 K1516	N1508-K1512 WeakPolarHBondContact O-CG 3.44Å; N1508-K1512 PolarHBondContact O-N 3.13Å; N1508-K1512 VanDerWaalsContact O-N 3.1Å; T1509-K1512 WeakPolarHBondContact O-CB 3.4Å; T1509-K1512 PolarHBondContact O-N 3.01Å; K1512-R1514 VanDerWaalsContact C-N 3.33Å; K1512-R1514 PolarHBondContact O-N 3.37Å; K1512-Q1515 WeakPolarHBondContact O-CA 3.32Å; K1512-Q1515 PolarHBondContact O-N 3.25Å; K1512-K1516 PolarHBondContact O-N 3.07Å
1513	E	76.6	Confident	68.6	Low	78 Å²	78	96.8 Å²	96.8	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-59.8	-46.5	177.9	-65.4	-51.1	127.4	0	0	110.8	F1477 T1509 Q1515 K1516	F1477-E1513 HydrophobicContact CE1-CG 4.32Å; F1477-E1513 HydrophobicContact CZ-CG 4.37Å; T1509-E1513 PolarHBondContact O-N 2.89Å; E1513-Q1515 PolarHBondContact O-N 3.26Å; E1513-K1516 PolarHBondContact O-N 3.13Å; E1513-K1516 VanDerWaalsContact O-N 3.07Å; E1513-K1516 WeakPolarHBondContact OE1-CE 3.45Å; E1513-K1516 IonicContact OE1-NZ 3.8Å; E1513-K1516 PolarHBondContact OE1-NZ 3.38Å; E1513-K1516 WeakPolarHBondContact OE2-CD 3.35Å; E1513-K1516 WeakPolarHBondContact OE2-CE 3.26Å; E1513-K1516 IonicContact OE2-NZ 3.69Å; E1513-K1516 PolarHBondContact OE2-NZ 3.04Å
1514	R	68.8	Low	65.9	Low	154 Å²	154	101.2 Å²	101.2	58%	0.581	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	3.4	171.5	-70.6	-175.9	-73.3	-162	2.1	115.3	L1510 K1512	L1510-R1514 PolarHBondContact O-NE 3.39Å; K1512-R1514 VanDerWaalsContact C-N 3.33Å; K1512-R1514 PolarHBondContact O-N 3.37Å
1515	Q	64.6	Low	63.3	Low	82 Å²	82	102 Å²	102	38%	0.383	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-0.8	173.5	-72.4	-68.2	-74	0	0	113.4	F1511 K1512 E1513	F1511-Q1515 HydrophobicContact CD1-CG 4.28Å; F1511-Q1515 HydrophobicContact CE1-CG 3.88Å; F1511-Q1515 HydrophobicContact CZ-CG 4.11Å; F1511-Q1515 VanDerWaalsContact O-CG 3.28Å; F1511-Q1515 WeakPolarHBondContact O-CG 3.46Å; F1511-Q1515 PolarHBondContact O-N 3.4Å; K1512-Q1515 WeakPolarHBondContact O-CA 3.32Å; K1512-Q1515 PolarHBondContact O-N 3.25Å; E1513-Q1515 PolarHBondContact O-N 3.26Å
1516	K	61.3	Low	60.7	Low	129 Å²	129	104.8 Å²	104.8	56%	0.561	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-48.6	172.3	-67.9	-179.4	-174.5	164.9	0	111.7	K1512 E1513 K1518	K1512-K1516 PolarHBondContact O-N 3.07Å; E1513-K1516 PolarHBondContact O-N 3.13Å; E1513-K1516 VanDerWaalsContact O-N 3.07Å; E1513-K1516 WeakPolarHBondContact OE1-CE 3.45Å; E1513-K1516 IonicContact OE1-NZ 3.8Å; E1513-K1516 PolarHBondContact OE1-NZ 3.38Å; E1513-K1516 WeakPolarHBondContact OE2-CD 3.35Å; E1513-K1516 WeakPolarHBondContact OE2-CE 3.26Å; E1513-K1516 IonicContact OE2-NZ 3.69Å; E1513-K1516 PolarHBondContact OE2-NZ 3.04Å; K1516-K1518 VanDerWaalsContact C-N 3.26Å; K1516-K1518 PolarHBondContact O-N 3.48Å
1517	N	44.6	Very low	57.6	Low	114 Å²	114	109 Å²	109	61%	0.61	53%	0.528	S	S	*	.	S	Bend	trans	-84.8	70.6	-178.7	-64.2	14.2	0	0	0	109.8	N1523	N1517-N1523 PolarHBondContact O-ND2 3.08Å
1518	K	44	Very low	54.8	Low	138 Å²	138	105.9 Å²	105.9	60%	0.6	53%	0.529	S	S	*	.			trans	-97.2	-10.8	-167.6	-161.4	156.4	-177.3	164.6	0	114.8	K1516	K1516-K1518 VanDerWaalsContact C-N 3.26Å; K1516-K1518 PolarHBondContact O-N 3.48Å
1519	D	40.5	Very low	52.3	Low	163 Å²	163	107.7 Å²	107.7	87%	0.872	55%	0.546	S	S	*	.	S	Bend	trans	-108.6	25.3	-172.1	-51	-53.9	0	0	0	113.1
1520	N	42.2	Very low	49.8	Very low	89 Å²	89	113.1 Å²	113.1	48%	0.476	58%	0.58	S	S	.	*			trans	-125.7	117.3	172.7	-175.2	-24.1	0	0	0	110.5	Y1522	N1520-Y1522 VanDerWaalsContact C-N 3.27Å; N1520-Y1522 PolarHBondContact O-N 2.87Å; N1520-Y1522 PolarHBondContact OD1-N 3.31Å
1521	P	38.1	Very low	47.6	Very low	107 Å²	107	116.1 Å²	116.1	70%	0.695	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-24.1	-173.3	-26	35.1	0	0	0	116.3
1522	Y	34.7	Very low	45.7	Very low	182 Å²	182	116 Å²	116	71%	0.714	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	22.8	-170.2	-74	-84	0	0	0	115	N1520 F1524 S1525	N1520-Y1522 VanDerWaalsContact C-N 3.27Å; N1520-Y1522 PolarHBondContact O-N 2.87Å; N1520-Y1522 PolarHBondContact OD1-N 3.31Å; Y1522-F1524 PolarHBondContact O-N 3.46Å; Y1522-S1525 PolarHBondContact O-N 3.08Å
1523	N	46.2	Very low	44	Very low	53 Å²	53	113.4 Å²	113.4	28%	0.283	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	54.9	177.3	-162.4	3	0	0	0	114.1	N1517	N1517-N1523 PolarHBondContact O-ND2 3.08Å
1524	F	34.9	Very low	42.7	Very low	166 Å²	166	114.9 Å²	114.9	73%	0.728	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	-12.5	164.5	-81.4	-88.5	0	0	0	112.5	K98 Y1522	K98-F1524 HydrophobicContact CD-CE2 4.47Å; Y1522-F1524 PolarHBondContact O-N 3.46Å
1525	S	35.6	Very low	41.7	Very low	106 Å²	106	113.8 Å²	113.8	74%	0.741	61%	0.611	S	S	*	*	S	Bend	trans	-110.5	6.1	-178.5	-51.2	0	0	0	0	113.5	Y1522 P1527	Y1522-S1525 PolarHBondContact O-N 3.08Å; S1525-P1527 VanDerWaalsContact O-CD 3.26Å; S1525-P1527 WeakPolarHBondContact O-CD 3.49Å
1526	I	39.1	Very low	41.1	Very low	96 Å²	96	115.2 Å²	115.2	49%	0.492	62%	0.618	S	S	.	*			trans	-97.7	103.4	178.9	-54.5	176.3	0	0	0	108
1527	P	28.8	Very low	40.6	Very low	98 Å²	98	115.5 Å²	115.5	64%	0.636	62%	0.616	S	S	*	*			trans	-62.7	161.6	166.3	29.2	-34.7	0	0	0	110	S1525 S1529	S1525-P1527 VanDerWaalsContact O-CD 3.26Å; S1525-P1527 WeakPolarHBondContact O-CD 3.49Å; P1527-S1529 PolarHBondContact O-N 2.91Å; P1527-S1529 VanDerWaalsContact O-N 3.1Å
1528	P	30.5	Very low	40.9	Very low	98 Å²	98	117.1 Å²	117.1	64%	0.636	62%	0.62	S	S	*	*			trans	-53.8	124.1	171.7	24.9	-34.2	0	0	0	108.9	T1530	P1528-T1530 PolarHBondContact O-N 3.35Å
1529	S	35.2	Very low	41.6	Very low	97 Å²	97	118.8 Å²	118.8	68%	0.678	63%	0.627	S	S	*	*			trans	-71.6	95.8	-172.9	-167.5	0	0	0	0	110.3	P1527 S1531	P1527-S1529 PolarHBondContact O-N 2.91Å; P1527-S1529 VanDerWaalsContact O-N 3.1Å; S1529-S1531 PolarHBondContact O-N 2.91Å; S1529-S1531 VanDerWaalsContact O-N 3.11Å; S1529-S1531 WeakPolarHBondContact OG-CB 3.19Å; S1529-S1531 PolarHBondContact OG-OG 2.91Å
1530	T	37.4	Very low	42	Very low	132 Å²	132	115.1 Å²	115.1	81%	0.81	61%	0.611	S	S	*	*			trans	-79.8	58.7	158.3	56.1	0	0	0	0	108.3	P1528 L1532	P1528-T1530 PolarHBondContact O-N 3.35Å; T1530-L1532 PolarHBondContact O-N 2.95Å
1531	S	38.8	Very low	41.5	Very low	94 Å²	94	113.9 Å²	113.9	66%	0.657	62%	0.619	S	S	*	*			trans	-71.3	81.9	171.4	51.2	0	0	0	0	108.9	S1529 N1533	S1529-S1531 PolarHBondContact O-N 2.91Å; S1529-S1531 VanDerWaalsContact O-N 3.11Å; S1529-S1531 WeakPolarHBondContact OG-CB 3.19Å; S1529-S1531 PolarHBondContact OG-OG 2.91Å; S1531-N1533 PolarHBondContact O-N 3.21Å
1532	L	39.9	Very low	41.4	Very low	126 Å²	126	117.9 Å²	117.9	66%	0.66	62%	0.62	S	S	*	*			trans	-55	123.2	150	-72.8	168.5	0	0	0	106.5	T1530 I1534 I1543	T1530-L1532 PolarHBondContact O-N 2.95Å; L1532-I1534 PolarHBondContact O-N 3.35Å; L1532-I1534 VanDerWaalsContact O-N 3.14Å; L1532-I1543 HydrophobicContact CD2-CG2 4.42Å
1533	N	42	Very low	41.6	Very low	79 Å²	79	114.3 Å²	114.3	42%	0.422	61%	0.613	S	S	.	*			trans	-72.7	106.6	179	-177.2	7.7	0	0	0	108.5	S1531 E1535 E1536 Y1537	S1531-N1533 PolarHBondContact O-N 3.21Å; N1533-E1535 VanDerWaalsContact C-N 3.27Å; N1533-E1535 PolarHBondContact O-N 3.14Å; N1533-E1535 PolarHBondContact OD1-N 3.23Å; N1533-E1536 HydrophobicContact CB-CB 3.78Å; N1533-E1536 WeakPolarHBondContact CB-OE2 3.29Å; N1533-E1536 WeakPolarHBondContact ND2-CB 3.3Å; N1533-E1536 PolarHBondContact ND2-OE2 3.06Å; N1533-E1536 WeakPolarHBondContact O-CB 3.34Å; N1533-E1536 PolarHBondContact O-N 3.33Å; N1533-E1536 VanDerWaalsContact O-N 3.08Å; N1533-Y1537 PolarHBondContact O-N 2.88Å
1534	I	49.1	Very low	40.9	Very low	109 Å²	109	118.4 Å²	118.4	56%	0.559	63%	0.63	S	S	*	*	H	α-helix	trans	-62.8	-40	-173.6	-61.2	171.5	0	0	0	109.9	L1532 E1536 Y1537 E1538	L1532-I1534 PolarHBondContact O-N 3.35Å; L1532-I1534 VanDerWaalsContact O-N 3.14Å; I1534-E1536 PolarHBondContact O-N 3.45Å; I1534-Y1537 PolarHBondContact O-N 2.98Å; I1534-E1538 HydrophobicContact CG2-CG 4.2Å; I1534-E1538 WeakPolarHBondContact O-CB 3.44Å; I1534-E1538 WeakPolarHBondContact O-CG 3.42Å; I1534-E1538 PolarHBondContact O-N 2.94Å
1535	E	47	Very low	40.5	Very low	131 Å²	131	118.5 Å²	118.5	61%	0.612	64%	0.637	S	S	*	*	H	α-helix	trans	-70.5	-9.2	178.5	-60.9	173.8	97.3	0	0	113.6	N1533 K1539	N1533-E1535 VanDerWaalsContact C-N 3.27Å; N1533-E1535 PolarHBondContact O-N 3.14Å; N1533-E1535 PolarHBondContact OD1-N 3.23Å; E1535-K1539 WeakPolarHBondContact O-CD 3.31Å; E1535-K1539 WeakPolarHBondContact O-CG 3.41Å
1536	E	53.7	Low	40.3	Very low	113 Å²	113	118.9 Å²	118.9	53%	0.528	63%	0.631	S	S	.	*	H	α-helix	trans	-99	-38.4	174.2	-169.9	170.5	176.7	0	0	110.7	N1533 I1534 K1539 T1540	N1533-E1536 HydrophobicContact CB-CB 3.78Å; N1533-E1536 WeakPolarHBondContact CB-OE2 3.29Å; N1533-E1536 WeakPolarHBondContact ND2-CB 3.3Å; N1533-E1536 PolarHBondContact ND2-OE2 3.06Å; N1533-E1536 WeakPolarHBondContact O-CB 3.34Å; N1533-E1536 PolarHBondContact O-N 3.33Å; N1533-E1536 VanDerWaalsContact O-N 3.08Å; I1534-E1536 PolarHBondContact O-N 3.45Å; E1536-K1539 PolarHBondContact O-N 2.98Å; E1536-T1540 WeakPolarHBondContact O-CB 3.49Å; E1536-T1540 WeakPolarHBondContact O-CG2 3.39Å; E1536-T1540 PolarHBondContact O-N 2.9Å; E1536-T1540 PolarHBondContact O-OG1 2.83Å
1537	Y	49.7	Very low	39.5	Very low	134 Å²	134	118.8 Å²	118.8	53%	0.525	63%	0.631	S	S	.	*	H	α-helix	trans	-61.3	-46.4	169.1	178.7	-108.9	0	0	0	111.7	N1533 I1534 K1539 T1540 G1541 I1543	N1533-Y1537 PolarHBondContact O-N 2.88Å; I1534-Y1537 PolarHBondContact O-N 2.98Å; Y1537-K1539 VanDerWaalsContact C-N 3.25Å; Y1537-K1539 PolarHBondContact O-N 2.87Å; Y1537-T1540 PolarHBondContact O-N 2.79Å; Y1537-G1541 PolarHBondContact O-N 2.98Å; Y1537-I1543 HydrophobicContact CD2-CG1 4.01Å; Y1537-I1543 HydrophobicContact CE2-CD1 4.24Å; Y1537-I1543 HydrophobicContact CE2-CG1 4Å
1538	E	51.5	Low	39.3	Very low	148 Å²	148	120.9 Å²	120.9	69%	0.692	64%	0.637	S	S	*	*	H	α-helix	trans	-68.6	-19.8	178.6	-70.8	178.5	167.6	0	0	113.5	I1534	I1534-E1538 HydrophobicContact CG2-CG 4.2Å; I1534-E1538 WeakPolarHBondContact O-CB 3.44Å; I1534-E1538 WeakPolarHBondContact O-CG 3.42Å; I1534-E1538 PolarHBondContact O-N 2.94Å
1539	K	58.9	Low	39.2	Very low	174 Å²	174	123.3 Å²	123.3	76%	0.757	65%	0.645	S	S	*	*	H	α-helix	trans	-95.3	-21.7	175.8	-73.4	178.9	-170.1	166.3	0	114.8	E1535 E1536 Y1537	E1535-K1539 WeakPolarHBondContact O-CD 3.31Å; E1535-K1539 WeakPolarHBondContact O-CG 3.41Å; E1536-K1539 PolarHBondContact O-N 2.98Å; Y1537-K1539 VanDerWaalsContact C-N 3.25Å; Y1537-K1539 PolarHBondContact O-N 2.87Å
1540	T	48	Very low	38.6	Very low	85 Å²	85	123.4 Å²	123.4	52%	0.521	65%	0.646	S	S	.	*	H	α-helix	trans	-119.7	-20.1	-171.6	64.8	0	0	0	0	114.5	E1536 Y1537 R1542	E1536-T1540 WeakPolarHBondContact O-CB 3.49Å; E1536-T1540 WeakPolarHBondContact O-CG2 3.39Å; E1536-T1540 PolarHBondContact O-N 2.9Å; E1536-T1540 PolarHBondContact O-OG1 2.83Å; Y1537-T1540 PolarHBondContact O-N 2.79Å; T1540-R1542 PolarHBondContact O-N 3.45Å; T1540-R1542 VanDerWaalsContact O-N 3.08Å
1541	G	33.2	Very low	38	Very low	63 Å²	63	126.2 Å²	126.2	65%	0.649	65%	0.647	S	S	*	*			trans	63.6	9.8	-179.3	0	0	0	0	0	115.3	Y1537	Y1537-G1541 PolarHBondContact O-N 2.98Å
1542	R	36	Very low	37.5	Very low	191 Å²	191	131.4 Å²	131.4	72%	0.721	66%	0.658	S	S	*	*			trans	-125.9	155	-178.6	-71.6	-173.3	173.3	-167.8	-0.9	111.4	T1540	T1540-R1542 PolarHBondContact O-N 3.45Å; T1540-R1542 VanDerWaalsContact O-N 3.08Å
1543	I	37.3	Very low	36.7	Very low	108 Å²	108	131.8 Å²	131.8	55%	0.554	66%	0.656	S	S	*	*			trans	-115.7	102.5	171.1	-58.8	175.3	0	0	0	107.2	L1532 Y1537	L1532-I1543 HydrophobicContact CD2-CG2 4.42Å; Y1537-I1543 HydrophobicContact CD2-CG1 4.01Å; Y1537-I1543 HydrophobicContact CE2-CD1 4.24Å; Y1537-I1543 HydrophobicContact CE2-CG1 4Å
1544	E	31.7	Very low	35.8	Very low	139 Å²	139	134.2 Å²	134.2	65%	0.65	67%	0.669	S	S	*	*			trans	-84.1	116	174.9	-66.1	-154.8	162.4	0	0	111.6	N1546	E1544-N1546 HydrophobicContact CB-CB 4.28Å; E1544-N1546 PolarHBondContact O-N 2.95Å; E1544-N1546 PolarHBondContact OE2-ND2 2.84Å
1545	L	27.3	Very low	34.6	Very low	167 Å²	167	140.2 Å²	140.2	87%	0.874	69%	0.686	S	S	*	*			trans	-80.1	63.6	169	-70.8	175.3	0	0	0	110.5	N1547	L1545-N1547 VanDerWaalsContact C-N 3.28Å; L1545-N1547 PolarHBondContact O-N 3.4Å
1546	N	30.5	Very low	33.5	Very low	115 Å²	115	142.4 Å²	142.4	62%	0.615	69%	0.694	S	S	*	*			trans	-81.3	66.4	-166.9	-141.7	-36.1	0	0	0	113.4	E1544 N1548	E1544-N1546 HydrophobicContact CB-CB 4.28Å; E1544-N1546 PolarHBondContact O-N 2.95Å; E1544-N1546 PolarHBondContact OE2-ND2 2.84Å; N1546-N1548 VanDerWaalsContact C-N 3.34Å; N1546-N1548 PolarHBondContact O-N 3.46Å
1547	N	23.1	Very low	32.2	Very low	94 Å²	94	143.4 Å²	143.4	50%	0.503	70%	0.702	S	S	.	*			trans	-89.7	63.6	171.3	-175.2	17.1	0	0	0	111.2	L1545	L1545-N1547 VanDerWaalsContact C-N 3.28Å; L1545-N1547 PolarHBondContact O-N 3.4Å
1548	N	25	Very low	31	Very low	141 Å²	141	143 Å²	143	75%	0.754	71%	0.708	S	S	*	*			trans	-157	59	172.1	-116.9	-14.8	0	0	0	114.3	N1546	N1546-N1548 VanDerWaalsContact C-N 3.34Å; N1546-N1548 PolarHBondContact O-N 3.46Å
1549	N	27.3	Very low	29.6	Very low	150 Å²	150	144.9 Å²	144.9	80%	0.802	71%	0.71	S	S	*	*			trans	-150.4	45.1	160.1	-116.7	-37.9	0	0	0	116.1	F1551	N1549-F1551 PolarHBondContact O-N 3.18Å
1550	S	24.3	Very low	28	Very low	99 Å²	99	142 Å²	142	69%	0.692	70%	0.703	S	S	*	*			trans	-82.1	37.3	161.7	-174.9	0	0	0	0	112.1
1551	F	24.5	Very low	27	Very low	191 Å²	191	141.9 Å²	141.9	84%	0.838	70%	0.699	S	S	*	*			trans	-114.8	43.8	-175.4	-118.7	-71.8	0	0	0	114.4	N1549	N1549-F1551 PolarHBondContact O-N 3.18Å
1552	K	27.7	Very low	26.6	Very low	203 Å²	203	144.1 Å²	144.1	88%	0.883	70%	0.696	S	S	*	*			trans	-139.7	103.3	148.7	-111.7	160.5	-171.7	168.9	0	111.1
1553	Q	23.3	Very low	26	Very low	134 Å²	134	141.4 Å²	141.4	63%	0.626	70%	0.696	S	S	*	*			trans	-60.4	176.6	151.3	-67.1	-172.6	-7	0	0	109.8
1554	N	23.3	Very low	25.4	Very low	129 Å²	129	142.5 Å²	142.5	69%	0.69	70%	0.703	S	S	*	*			trans	13.8	112.3	147.3	-58.8	-49	0	0	0	116.4
1555	Y	24.3	Very low	25	Very low	235 Å²	235	142.6 Å²	142.6	92%	0.922	71%	0.708	S	S	*	*				-149	149.1	105.8	-99.7	-66.6	0	0	0	111.3
1556	K	24	Very low	24.8	Very low	178 Å²	178	140.4 Å²	140.4	77%	0.774	70%	0.697	S	S	*	*			trans	-112.5	112.1	-176.4	168.1	-171.2	171	-169	0	107.7
1557	L	25	Very low	24.6	Very low	133 Å²	133	141.8 Å²	141.8	70%	0.696	70%	0.699	S	S	*	*			trans	68.3	153.6	171.5	-52.4	169.1	0	0	0	113.2
1558	L	24.4	Very low	24.7	Very low	125 Å²	125	143.7 Å²	143.7	65%	0.654	71%	0.705	S	S	*	*			cis	-157.8	166.8	-7.8	-121.4	166.6	0	0	0	108.4
1559	Y	23.1	Very low	24.6	Very low	188 Å²	188	141.9 Å²	141.9	74%	0.737	70%	0.696	S	S	*	*			trans	-132.4	126	164.8	-118.4	-67.8	0	0	0	111.9
1560	L	25.7	Very low	24.9	Very low	115 Å²	115	140.9 Å²	140.9	60%	0.602	69%	0.69	S	S	*	*			trans	178.6	87	146.2	-97.2	148.2	0	0	0	104.9	Q1638	L1560-Q1638 HydrophobicContact CB-CG 4.44Å; L1560-Q1638 HydrophobicContact CD2-CG 4.14Å
1561	N	26.7	Very low	24.9	Very low	81 Å²	81	144 Å²	144	43%	0.433	69%	0.691	S	S	.	*				71.9	138.9	97.6	-97.1	49.8	0	0	0	113.3	Q1638	N1561-Q1638 VanDerWaalsContact O-CA 3.3Å; N1561-Q1638 WeakPolarHBondContact O-CA 3.29Å
1562	N	25.5	Very low	25.2	Very low	111 Å²	111	140.7 Å²	140.7	59%	0.594	68%	0.682	S	S	*	*			cis	-169.7	160.8	-16.1	-126	21	0	0	0	107.5
1563	N	23	Very low	25.4	Very low	134 Å²	134	138.6 Å²	138.6	72%	0.717	67%	0.673	S	S	*	*				173.3	145.7	122.5	-91.1	-4.7	0	0	0	113.4
1564	N	25.1	Very low	25.5	Very low	131 Å²	131	138.8 Å²	138.8	70%	0.701	68%	0.676	S	S	*	*			trans	59.1	114.1	161.1	-54.4	-2.6	0	0	0	116.4
1565	N	23	Very low	25.9	Very low	141 Å²	141	138.7 Å²	138.7	75%	0.754	68%	0.675	S	S	*	*				61.4	101.4	51.1	-51.9	-1.1	0	0	0	112.4
1566	N	23.3	Very low	26.2	Very low	121 Å²	121	133.1 Å²	133.1	65%	0.647	66%	0.661	S	S	*	*				-173	143.6	93.1	-103.2	23	0	0	0	111.6
1567	E	25.2	Very low	26.5	Very low	143 Å²	143	131 Å²	131	67%	0.668	66%	0.658	S	S	*	*			trans	59.9	148.7	133.1	-57.3	177.7	129.1	0	0	120.1
1568	Q	26	Very low	26.7	Very low	135 Å²	135	130.8 Å²	130.8	63%	0.631	66%	0.657	S	S	*	*			cis	-147.7	177.3	-2.3	-150.2	56	-65.7	0	0	111.8
1569	N	22.5	Very low	26.7	Very low	103 Å²	103	131.3 Å²	131.3	55%	0.551	66%	0.66	S	S	*	*			trans	-46.9	169.9	165.8	-39.6	-56.6	0	0	0	113.6
1570	D	32.6	Very low	26.7	Very low	129 Å²	129	129.8 Å²	129.8	69%	0.69	66%	0.66	S	S	*	*			cis	-143.2	145.9	30.2	-84.3	-66.3	0	0	0	110.8
1571	K	24.8	Very low	26.7	Very low	164 Å²	164	129.5 Å²	129.5	71%	0.713	66%	0.663	S	S	*	*				54.6	109	69	-66.3	-179.5	-177.2	165.2	0	114.8
1572	D	31.4	Very low	26.6	Very low	121 Å²	121	133.3 Å²	133.3	65%	0.647	68%	0.683	S	S	*	*				-172.7	149	109.5	-113.7	-24.8	0	0	0	114
1573	K	32.2	Very low	26.6	Very low	159 Å²	159	132.8 Å²	132.8	69%	0.691	69%	0.689	S	S	*	*			trans	41.4	144.8	140	-65.6	156.7	-167.9	144.1	0	120.2
1574	M	24.6	Very low	26.9	Very low	138 Å²	138	133.7 Å²	133.7	68%	0.68	69%	0.693	S	S	*	*			cis	-160.4	146	-1.2	-99.6	-95.4	-163.7	0	0	105.1
1575	N	31.5	Very low	27	Very low	127 Å²	127	134 Å²	134	68%	0.679	70%	0.695	S	S	*	*				-168.7	143.2	65.2	-98.3	-55.2	0	0	0	110.7
1576	N	31.5	Very low	27	Very low	118 Å²	118	134 Å²	134	63%	0.631	70%	0.695	S	S	*	*			trans	45.4	135.9	130.7	-59.2	-18.7	0	0	0	121.5
1577	L	30.3	Very low	27.4	Very low	134 Å²	134	134.8 Å²	134.8	70%	0.702	70%	0.697	S	S	*	*			cis	-157.8	139.4	4.8	-113.6	161.3	0	0	0	111.5
1578	N	28.2	Very low	27.4	Very low	128 Å²	128	134.1 Å²	134.1	68%	0.684	70%	0.697	S	S	*	*			trans	10.2	138.1	150.7	-61	2.1	0	0	0	120.6
1579	L	24.5	Very low	27.4	Very low	137 Å²	137	133.4 Å²	133.4	72%	0.717	70%	0.695	S	S	*	*				60.6	133.3	64.3	-80.2	79.6	0	0	0	113.1
1580	E	23.6	Very low	27.6	Very low	156 Å²	156	134.3 Å²	134.3	73%	0.729	69%	0.694	S	S	*	*			cis	-163.3	170.4	-5	-130.3	168.4	-163.4	0	0	113
1581	T	24.9	Very low	27.4	Very low	108 Å²	108	132.3 Å²	132.3	66%	0.663	68%	0.683	S	S	*	*			trans	23.5	122.4	160	56.6	0	0	0	0	121.6
1582	N	26	Very low	27.6	Very low	161 Å²	161	131.9 Å²	131.9	86%	0.861	68%	0.681	S	S	*	*				-169.3	168.3	96.2	-106.7	-50.5	0	0	0	113.7
1583	S	24.5	Very low	27.2	Very low	101 Å²	101	133 Å²	133	71%	0.706	69%	0.685	S	S	*	*			trans	-85	147	-174.9	-51.9	0	0	0	0	114.1
1584	N	29.8	Very low	27	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	69%	0.685	S	S	*	*				-175	132.3	124.7	-91.3	-20.2	0	0	0	113.3
1585	D	26.5	Very low	27	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	69%	0.69	S	S	*	*			trans	28.7	125.3	146.9	-73.8	-6.5	0	0	0	124.1
1586	L	22.6	Very low	26.8	Very low	141 Å²	141	133.8 Å²	133.8	74%	0.738	70%	0.699	S	S	*	*			trans	76.1	161.6	133.7	-98.5	71.6	0	0	0	121.5
1587	I	31.7	Very low	26.6	Very low	137 Å²	137	135.9 Å²	135.9	70%	0.703	71%	0.709	S	S	*	*			trans	69	102.9	160.9	-70.8	155.1	0	0	0	115
1588	I	26	Very low	26.6	Very low	129 Å²	129	136.7 Å²	136.7	66%	0.662	70%	0.704	S	S	*	*				101.5	121.2	56.6	-88.4	173.1	0	0	0	111.5
1589	M	25.4	Very low	26.5	Very low	119 Å²	119	135 Å²	135	59%	0.586	70%	0.703	S	S	*	*			trans	60.7	116.6	154.4	-75.2	-167.4	-72	0	0	117.3
1590	K	27.5	Very low	26.6	Very low	122 Å²	122	135 Å²	135	53%	0.53	70%	0.702	S	S	.	*				113.7	159.7	87.2	-94.9	-178.5	174.6	153.5	0	108.6	D1413	D1413-K1590 IonicContact OD1-NZ 3.85Å; D1413-K1590 PolarHBondContact OD1-NZ 2.8Å
1591	D	28.7	Very low	26.5	Very low	88 Å²	88	133.5 Å²	133.5	47%	0.471	70%	0.699	S	S	.	*			cis	-158.4	149.8	-7.2	-127.8	-24.3	0	0	0	107.8
1592	K	28.1	Very low	26.5	Very low	154 Å²	154	135.3 Å²	135.3	67%	0.67	70%	0.7	S	S	*	*			trans	64.6	173	144.2	-69.7	162.2	-169.2	148.3	0	116.7
1593	M	23.3	Very low	26.7	Very low	146 Å²	146	132.5 Å²	132.5	72%	0.719	69%	0.692	S	S	*	*			cis	-145.5	168.4	5.6	-143.5	139.2	176.1	0	0	112.6
1594	N	28.6	Very low	26.7	Very low	131 Å²	131	134 Å²	134	70%	0.701	69%	0.691	S	S	*	*			trans	62.6	116.1	157.1	-65.4	-19	0	0	0	119.9
1595	N	24.9	Very low	26.6	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	69%	0.688	S	S	*	*				3	125	118.1	-53.9	-8.2	0	0	0	116
1596	D	27.5	Very low	26.5	Very low	161 Å²	161	133.3 Å²	133.3	86%	0.861	68%	0.683	S	S	*	*				-127.9	144.6	119.6	-103.5	-46.7	0	0	0	108.7
1597	L	27.4	Very low	26.7	Very low	162 Å²	162	133.6 Å²	133.6	85%	0.848	68%	0.68	S	S	*	*			trans	-130.7	74.2	173.7	-157.3	170.8	0	0	0	107.3
1598	Y	29.2	Very low	26.4	Very low	151 Å²	151	132.6 Å²	132.6	59%	0.592	68%	0.676	S	S	*	*			trans	-127.3	177.5	173.2	-121.6	-100.5	0	0	0	110	Y1395 I1600	Y1395-Y1598 WeakPolarHBondContact CD1-OH 3.18Å; Y1395-Y1598 HydrophobicContact CE1-CE1 4.09Å; Y1395-Y1598 AromaticContact CE1-CZ 3.85Å; Y1395-Y1598 WeakPolarHBondContact CE1-OH 3.49Å; Y1598-I1600 PolarHBondContact O-N 3.26Å
1599	S	26.8	Very low	26.7	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	68%	0.683	S	S	*	*			trans	-41.3	126.5	-163	-49.6	0	0	0	0	114.3
1600	I	25	Very low	26.9	Very low	137 Å²	137	133.8 Å²	133.8	70%	0.703	68%	0.684	S	S	*	*				63.3	128.7	53	-54.2	168.4	0	0	0	110.8	Y1598	Y1598-I1600 PolarHBondContact O-N 3.26Å
1601	D	23	Very low	27	Very low	124 Å²	124	135.2 Å²	135.2	66%	0.663	70%	0.698	S	S	*	*			trans	73.5	131.4	161.4	-83.4	-43.3	0	0	0	121.3
1602	Q	24.6	Very low	26.9	Very low	146 Å²	146	134.1 Å²	134.1	68%	0.682	71%	0.708	S	S	*	*			trans	73.6	99.3	135.1	-67.3	158.2	35.9	0	0	117.3
1603	S	29.4	Very low	26.6	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	69%	0.689	S	S	*	*				73.4	75.5	67.9	79.7	0	0	0	0	112.5
1604	I	24.7	Very low	26.7	Very low	134 Å²	134	128.4 Å²	128.4	69%	0.687	69%	0.69	S	S	*	*			trans	-139.6	137.6	165.5	-59.7	178.4	0	0	0	104.6
1605	E	28.7	Very low	26.4	Very low	160 Å²	160	126.1 Å²	126.1	75%	0.748	68%	0.677	S	S	*	*			cis	-87.1	155	-15	-97.3	91.5	-149.7	0	0	109.9
1606	N	24.8	Very low	26.2	Very low	116 Å²	116	122.6 Å²	122.6	62%	0.62	66%	0.664	S	S	*	*				57	140.9	61.7	-52.3	-28.8	0	0	0	111.3
1607	E	25	Very low	26	Very low	147 Å²	147	120.7 Å²	120.7	69%	0.687	66%	0.659	S	S	*	*			cis	-160	-173.8	8.8	-137.3	172.9	-135.3	0	0	110.4
1608	N	25.4	Very low	25.9	Very low	116 Å²	116	121.1 Å²	121.1	62%	0.62	66%	0.659	S	S	*	*			trans	20.6	132.2	141.4	-64.6	-33.5	0	0	0	120.4
1609	I	33.1	Very low	26	Very low	155 Å²	155	123.1 Å²	123.1	80%	0.795	67%	0.67	S	S	*	*			trans	137.2	120.9	143.2	-75	158.8	0	0	0	107.8
1610	N	30.5	Very low	26.1	Very low	117 Å²	117	129.6 Å²	129.6	63%	0.626	68%	0.68	S	S	*	*			cis	167.9	160.6	-13.4	-106.3	-19.3	0	0	0	102.8
1611	N	28.3	Very low	26.4	Very low	152 Å²	152	128.2 Å²	128.2	81%	0.813	68%	0.683	S	S	*	*			trans	50.5	116	151.2	-54.3	-7.2	0	0	0	119
1612	G	27.3	Very low	26.3	Very low	66 Å²	66	128.6 Å²	128.6	68%	0.68	69%	0.694	S	S	*	*				131.4	138.6	90.9	0	0	0	0	0	116.6
1613	S	21.5	Very low	26.3	Very low	40 Å²	40	129.4 Å²	129.4	28%	0.28	70%	0.698	S	S	.	*			trans	-54.5	154	150.3	-166.7	0	0	0	0	111	D1874 N1875	S1613-D1874 VanDerWaalsContact CB-CG 3.42Å; S1613-D1874 WeakPolarHBondContact CB-OD1 3.3Å; S1613-D1874 WeakPolarHBondContact CB-OD2 3.31Å; S1613-D1874 VanDerWaalsContact OG-CG 3.26Å; S1613-D1874 PolarHBondContact OG-OD1 3.43Å; S1613-D1874 PolarHBondContact OG-OD2 2.91Å; S1613-N1875 WeakPolarHBondContact CB-OD1 3.31Å
1614	L	25.7	Very low	26.3	Very low	140 Å²	140	131 Å²	131	73%	0.733	70%	0.696	S	S	*	*				-169.8	130.6	113	-102.8	167.6	0	0	0	113.2
1615	N	21.8	Very low	26.4	Very low	82 Å²	82	132.9 Å²	132.9	44%	0.439	70%	0.701	S	S	.	*			trans	-24.1	157.5	134.1	-87.2	-27.9	0	0	0	115.7	N1872 E1873	N1615-N1872 PolarHBondContact ND2-OD1 2.98Å; N1615-E1873 PolarHBondContact ND2-OE1 3.46Å
1616	S	21.7	Very low	26.5	Very low	73 Å²	73	130.7 Å²	130.7	51%	0.51	70%	0.703	S	S	.	*			cis	-179.4	174.6	0.7	50.6	0	0	0	0	111.4
1617	T	22.6	Very low	26.6	Very low	122 Å²	122	131.2 Å²	131.2	75%	0.748	71%	0.706	S	S	*	*			trans	71.5	163.6	153.1	71.1	0	0	0	0	122.6
1618	M	24.6	Very low	26.7	Very low	171 Å²	171	133.1 Å²	133.1	84%	0.842	71%	0.712	S	S	*	*			trans	76.4	82	157	-67	-133	177.2	0	0	121.6
1619	K	32.3	Very low	26.8	Very low	192 Å²	192	135.4 Å²	135.4	84%	0.835	72%	0.722	S	S	*	*				177.9	134.9	108.1	-91.7	163	-177.4	175.4	0	109.1
1620	R	28.9	Very low	26.6	Very low	231 Å²	231	135.1 Å²	135.1	87%	0.872	72%	0.721	S	S	*	*				66.8	126.9	67.9	-76.6	-169.4	174.9	-178.9	-0.3	114.4
1621	S	30.8	Very low	26.5	Very low	108 Å²	108	135.4 Å²	135.4	76%	0.755	72%	0.722	S	S	*	*			trans	62.7	130.8	171.4	-55.8	0	0	0	0	115.2
1622	C	19.9	Very low	26.3	Very low	132 Å²	132	136.4 Å²	136.4	89%	0.892	72%	0.722	S	S	*	*			cis	60.2	61.3	6.4	-147.7	0	0	0	0	115.1
1623	E	25.6	Very low	26	Very low	163 Å²	163	141.1 Å²	141.1	76%	0.762	73%	0.728	S	S	*	*			trans	-166.4	165.9	140.7	-112.2	178.5	172.3	0	0	110.5
1624	M	29.3	Very low	26.3	Very low	135 Å²	135	146.9 Å²	146.9	67%	0.665	75%	0.748	S	S	*	*	S	Bend	trans	10.7	109.8	175.7	-83.2	62.7	78.6	0	0	120.7
1625	E	27.2	Very low	26.1	Very low	173 Å²	173	149.3 Å²	149.3	81%	0.808	75%	0.748	S	S	*	*				54.2	81.9	124.2	-62.2	-176.1	107.3	0	0	119.9
1626	S	30.2	Very low	26.4	Very low	113 Å²	113	150 Å²	150	79%	0.79	75%	0.751	S	S	*	*			trans	-162	165.3	130.4	-80.9	0	0	0	0	112.8
1627	L	26.7	Very low	26.6	Very low	127 Å²	127	151.5 Å²	151.5	67%	0.665	75%	0.753	S	S	*	*				-163	132.1	-53.4	-87.3	-161.3	0	0	0	105.7
1628	K	27.7	Very low	26.8	Very low	188 Å²	188	149.5 Å²	149.5	82%	0.817	74%	0.735	S	S	*	*			cis	-148.6	127.8	-26.4	-101	163.6	-177.4	156.7	0	104.3
1629	I	27.7	Very low	27	Very low	163 Å²	163	145.2 Å²	145.2	84%	0.836	72%	0.716	S	S	*	*			trans	-134.3	158	-167.4	-44.7	-178.2	0	0	0	112
1630	I	28.7	Very low	26.7	Very low	149 Å²	149	143.4 Å²	143.4	76%	0.764	71%	0.708	S	S	*	*			trans	99.2	110.9	166.5	-55.3	-175.1	0	0	0	117.6
1631	D	27	Very low	26.6	Very low	124 Å²	124	142.7 Å²	142.7	66%	0.663	71%	0.705	S	S	*	*			trans	39.7	121.3	147.5	-70	-61.2	0	0	0	126.1
1632	Q	24.7	Very low	26.4	Very low	173 Å²	173	145 Å²	145	81%	0.808	70%	0.704	S	S	*	*				69.9	129.8	125.9	-63.8	176.1	53.9	0	0	123
1633	M	21.3	Very low	26.6	Very low	165 Å²	165	148.3 Å²	148.3	81%	0.813	70%	0.698	S	S	*	*			trans	100.4	89.1	147.6	-156	61.8	146	0	0	120.5
1634	K	27	Very low	26.7	Very low	161 Å²	161	147.1 Å²	147.1	70%	0.7	70%	0.696	S	S	*	*			trans	74.1	122.4	142.6	-93	-170.7	167.4	-160.4	0	122.4
1635	W	22.1	Very low	26.5	Very low	191 Å²	191	147.1 Å²	147.1	72%	0.723	69%	0.694	S	S	*	*			trans	69.2	128.2	135.6	-124.4	53.8	0	0	0	117.8
1636	I	28.3	Very low	26.6	Very low	96 Å²	96	146.5 Å²	146.5	49%	0.492	69%	0.689	S	S	.	*			cis	-177.4	168.8	22.4	-157.7	-166.5	0	0	0	110.3
1637	N	26	Very low	26.5	Very low	104 Å²	104	147 Å²	147	56%	0.556	68%	0.683	S	S	*	*			trans	77	152.4	155.2	-76.1	-13.3	0	0	0	122.5
1638	Q	27.7	Very low	26.6	Very low	80 Å²	80	147.8 Å²	147.8	37%	0.374	69%	0.686	S	S	.	*			cis	170	153.5	-35	-177.8	-175	79.9	0	0	108	L1560 N1561	L1560-Q1638 HydrophobicContact CB-CG 4.44Å; L1560-Q1638 HydrophobicContact CD2-CG 4.14Å; N1561-Q1638 VanDerWaalsContact O-CA 3.3Å; N1561-Q1638 WeakPolarHBondContact O-CA 3.29Å
1639	N	27.1	Very low	26.6	Very low	82 Å²	82	146.9 Å²	146.9	44%	0.439	69%	0.685	S	S	.	*			trans	96.3	141.4	163.9	-56.5	-76.9	0	0	0	115.3
1640	K	27.8	Very low	26.8	Very low	154 Å²	154	144.6 Å²	144.6	67%	0.67	67%	0.674	S	S	*	*			cis	-164.7	158.1	-4.9	-122.5	169.6	-178.1	116.9	0	113.9
1641	R	24.8	Very low	26.9	Very low	215 Å²	215	139 Å²	139	81%	0.811	65%	0.653	S	S	*	*			trans	74.3	154.7	148.8	-69.9	173.3	-175.9	-79.7	5.1	120.7
1642	Q	27.6	Very low	27.1	Very low	157 Å²	157	136.7 Å²	136.7	73%	0.734	65%	0.647	S	S	*	*			trans	76.1	135.4	168.2	-52.3	-156.4	79	0	0	115.6
1643	R	23.7	Very low	27.5	Very low	202 Å²	202	134.7 Å²	134.7	76%	0.762	64%	0.641	S	S	*	*			cis	-167	162	-16.7	-129.1	172.1	177	158.3	-13.7	108.7
1644	L	29.1	Very low	28	Very low	137 Å²	137	131.6 Å²	131.6	72%	0.717	63%	0.628	S	S	*	*			trans	71.2	141.6	170.6	-59.3	158.3	0	0	0	114.1
1645	E	25.1	Very low	28.3	Very low	135 Å²	135	130.2 Å²	130.2	63%	0.631	63%	0.628	S	S	*	*			cis	69	138.5	48.6	-69.9	174.7	-141.5	0	0	112.5
1646	K	29.1	Very low	28.7	Very low	160 Å²	160	128.3 Å²	128.3	70%	0.696	63%	0.627	S	S	*	*			cis	-135.4	163.6	11.5	-104.3	132.1	169.9	143.2	0	110
1647	D	27.9	Very low	28.8	Very low	124 Å²	124	133.4 Å²	133.4	66%	0.663	64%	0.64	S	S	*	*				62	162.6	54.5	-35.1	-54	0	0	0	113.2
1648	I	27.7	Very low	29.1	Very low	143 Å²	143	133.1 Å²	133.1	73%	0.733	64%	0.644	S	S	*	*			cis	-155.9	173.1	-1.2	-135.8	153	0	0	0	108.2
1649	Q	28	Very low	29.1	Very low	169 Å²	169	135.8 Å²	135.8	79%	0.79	67%	0.665	S	S	*	*			trans	-153.1	147.5	161.4	-73.4	-165.5	-97.1	0	0	109.8
1650	D	31.6	Very low	29.1	Very low	116 Å²	116	136.7 Å²	136.7	62%	0.62	68%	0.679	S	S	*	*			cis	-164.7	162.1	-16.3	-77.8	-34.2	0	0	0	106.3	D1668	D1650-D1668 CarbonylContact C-O 3.25Å; D1650-D1668 VanDerWaalsContact C-O 3.25Å
1651	G	31	Very low	29.1	Very low	30 Å²	30	137.7 Å²	137.7	31%	0.309	69%	0.689	S	S	.	*			cis	151.4	122	-15.5	0	0	0	0	0	113.2	S1667 D1668	G1651-S1667 VanDerWaalsContact C-OG 3.25Å; G1651-S1667 WeakPolarHBondContact CA-O 3.33Å; G1651-D1668 VanDerWaalsContact CA-O 3.27Å; G1651-D1668 WeakPolarHBondContact CA-O 3.37Å; G1651-D1668 PolarHBondContact N-O 3.3Å
1652	S	31.9	Very low	29.3	Very low	77 Å²	77	133.6 Å²	133.6	54%	0.538	69%	0.688	S	S	.	*			trans	-160.6	106.7	164.5	-82.6	0	0	0	0	120.1	S1667	S1652-S1667 VanDerWaalsContact CA-OG 3.31Å; S1652-S1667 WeakPolarHBondContact CA-OG 3.23Å; S1652-S1667 VanDerWaalsContact N-CB 3.32Å; S1652-S1667 PolarHBondContact N-OG 3.16Å
1653	L	32.3	Very low	29.4	Very low	130 Å²	130	130.3 Å²	130.3	68%	0.681	68%	0.682	S	S	*	*				85.5	103.3	127.2	-54.5	167.1	0	0	0	122.1	S1667	L1653-S1667 PolarHBondContact N-OG 3.08Å
1654	N	31.9	Very low	29.6	Very low	101 Å²	101	127.2 Å²	127.2	54%	0.54	68%	0.679	S	S	.	*				145.4	133.4	83.9	-101.7	34.8	0	0	0	119.9
1655	D	32.6	Very low	29.5	Very low	131 Å²	131	128.1 Å²	128.1	70%	0.701	68%	0.68	S	S	*	*			trans	78.6	99.7	141.3	-58.2	-32	0	0	0	124.7
1656	E	30.9	Very low	29.7	Very low	152 Å²	152	127 Å²	127	71%	0.71	68%	0.678	S	S	*	*			trans	32.7	147.5	134.8	-66.8	-153.5	174.8	0	0	122.7
1657	R	30.7	Very low	29.7	Very low	203 Å²	203	120.9 Å²	120.9	77%	0.766	66%	0.656	S	S	*	*			cis	-173.8	-179	9.1	-121.7	-173.2	169.5	124.8	-9.2	107.7
1658	P	31.5	Very low	29.6	Very low	97 Å²	97	119.5 Å²	119.5	63%	0.63	65%	0.648	S	S	*	*			cis	-131.5	-163	-26.3	39.3	-20.6	0	0	0	113
1659	T	29	Very low	29.7	Very low	136 Å²	136	119.3 Å²	119.3	83%	0.834	65%	0.647	S	S	*	*	S	Bend	trans	78.6	47.7	156.3	53.5	0	0	0	0	121.9
1660	S	27.6	Very low	29.8	Very low	102 Å²	102	119.5 Å²	119.5	71%	0.713	65%	0.652	S	S	*	*	S	Bend		-158.5	116.9	126.3	57.6	0	0	0	0	111.4
1661	I	27.9	Very low	29.6	Very low	175 Å²	175	122.9 Å²	122.9	90%	0.897	66%	0.657	S	S	*	*	S	Bend	trans	-69.6	129.2	-176.6	-60.7	155.2	0	0	0	108.8
1662	V	28.7	Very low	29.5	Very low	129 Å²	129	126.9 Å²	126.9	78%	0.782	67%	0.672	S	S	*	*	S	Bend	cis	-120.5	142.7	14.5	-176.3	0	0	0	0	111.1
1663	S	29.2	Very low	29.4	Very low	87 Å²	87	131.2 Å²	131.2	61%	0.608	68%	0.677	S	S	*	*			trans	-119.4	150.3	175	-52.9	0	0	0	0	109.7
1664	I	28.8	Very low	29.2	Very low	138 Å²	138	131 Å²	131	71%	0.708	67%	0.671	S	S	*	*				62.4	124.8	51.3	-75.9	167.6	0	0	0	110.7
1665	E	26.6	Very low	29.1	Very low	156 Å²	156	134.9 Å²	134.9	73%	0.729	68%	0.678	S	S	*	*			cis	-132.5	-171	-12.2	-111.2	148.4	-175.9	0	0	107.6
1666	D	28.5	Very low	28.7	Very low	112 Å²	112	136.5 Å²	136.5	60%	0.599	69%	0.687	S	S	*	*				173.5	154.6	74.5	-104.4	-39.2	0	0	0	107.9
1667	S	28.5	Very low	28.5	Very low	31 Å²	31	135.5 Å²	135.5	22%	0.217	69%	0.686	C	S	.	*			cis	-163.1	169.2	16.1	22.1	0	0	0	0	112.1	G1651 S1652 L1653	G1651-S1667 VanDerWaalsContact C-OG 3.25Å; G1651-S1667 WeakPolarHBondContact CA-O 3.33Å; S1652-S1667 VanDerWaalsContact CA-OG 3.31Å; S1652-S1667 WeakPolarHBondContact CA-OG 3.23Å; S1652-S1667 VanDerWaalsContact N-CB 3.32Å; S1652-S1667 PolarHBondContact N-OG 3.16Å; L1653-S1667 PolarHBondContact N-OG 3.08Å
1668	D	26.1	Very low	28.3	Very low	95 Å²	95	134.2 Å²	134.2	51%	0.508	69%	0.688	S	S	.	*			trans	23.6	155.2	147.3	-48.9	-56.2	0	0	0	123.3	D1650 G1651	D1650-D1668 CarbonylContact C-O 3.25Å; D1650-D1668 VanDerWaalsContact C-O 3.25Å; G1651-D1668 VanDerWaalsContact CA-O 3.27Å; G1651-D1668 WeakPolarHBondContact CA-O 3.37Å; G1651-D1668 PolarHBondContact N-O 3.3Å
1669	I	30.6	Very low	28.4	Very low	139 Å²	139	134 Å²	134	71%	0.713	69%	0.686	S	S	*	*			cis	-135.4	124.9	12.7	-55.3	161.5	0	0	0	110
1670	I	30.4	Very low	28.4	Very low	172 Å²	172	133.8 Å²	133.8	88%	0.882	69%	0.685	S	S	*	*			trans	-126.5	121.2	150.9	-69.2	-175.8	0	0	0	109.1
1671	Y	27	Very low	28.5	Very low	188 Å²	188	137.4 Å²	137.4	74%	0.737	69%	0.693	S	S	*	*			trans	-96	157.9	177	-135.2	-112.7	0	0	0	111.2
1672	N	29.6	Very low	28.5	Very low	114 Å²	114	135.2 Å²	135.2	61%	0.61	69%	0.688	S	S	*	*			trans	75.7	89.1	161.9	-73.2	-21.3	0	0	0	121.4
1673	Y	28.3	Very low	28.5	Very low	167 Å²	167	134.9 Å²	134.9	66%	0.655	69%	0.686	S	S	*	*				87.8	128.1	99.1	-88.5	-154.2	0	0	0	121.5
1674	K	28.8	Very low	28.5	Very low	125 Å²	125	136.7 Å²	136.7	54%	0.543	69%	0.694	S	S	.	*				46.6	138.3	119.8	-58.3	-179.5	-170.6	164.7	0	118.9
1675	R	29.5	Very low	28.5	Very low	183 Å²	183	136 Å²	136	69%	0.691	70%	0.696	S	S	*	*			cis	-171.6	159.4	3.5	-119.4	166	-179.3	176.7	-1.3	109.7
1676	N	24.9	Very low	28.7	Very low	166 Å²	166	134.1 Å²	134.1	89%	0.888	70%	0.695	S	S	*	*			trans	-75.4	123.7	145.1	-77.9	-25.5	0	0	0	109
1677	L	26.4	Very low	28.9	Very low	131 Å²	131	134.2 Å²	134.2	69%	0.686	70%	0.7	S	S	*	*			trans	-179.2	112.6	159.2	-98.3	159.2	0	0	0	104.8
1678	H	26.5	Very low	29.3	Very low	175 Å²	175	138.7 Å²	138.7	81%	0.81	73%	0.727	S	S	*	*				67.3	133.3	73.3	-140.2	-99.1	0	0	0	113.2
1679	P	33.4	Very low	30	Very low	93 Å²	93	139.1 Å²	139.1	60%	0.604	73%	0.734	S	S	*	*			trans	-100.7	-176.1	-159.6	41	-37.8	0	0	0	114.5
1680	T	28.6	Very low	29.9	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	73%	0.734	S	S	*	*			trans	68	120.6	158.3	43.1	0	0	0	0	119.5
1681	M	30.2	Very low	30.1	Very low	178 Å²	178	134.2 Å²	134.2	88%	0.877	72%	0.723	S	S	*	*			trans	-0.4	134.7	153.9	-59.5	-68.5	95.4	0	0	119.5
1682	T	28.8	Very low	30.4	Very low	129 Å²	129	132.8 Å²	132.8	79%	0.791	72%	0.723	S	S	*	*			trans	-96.1	132	151.3	45.9	0	0	0	0	109.2
1683	T	28.3	Very low	30.6	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	72%	0.723	S	S	*	*				-162.4	164.8	78.4	27.1	0	0	0	0	112.6
1684	T	28.4	Very low	30.9	Very low	125 Å²	125	129.8 Å²	129.8	77%	0.767	72%	0.723	S	S	*	*			trans	73.9	114.9	174	60.1	0	0	0	0	119.6
1685	T	29.8	Very low	31	Very low	124 Å²	124	131.2 Å²	131.2	76%	0.761	74%	0.736	S	S	*	*			trans	59.2	134.8	140.8	51.1	0	0	0	0	121.7
1686	T	30.1	Very low	31.1	Very low	116 Å²	116	125.6 Å²	125.6	71%	0.712	74%	0.735	S	S	*	*			cis	-168.7	160.5	-17.9	3.1	0	0	0	0	110.3
1687	T	33.2	Very low	31.3	Very low	115 Å²	115	126.8 Å²	126.8	71%	0.706	74%	0.735	S	S	*	*			trans	57.8	103.5	151.8	51.3	0	0	0	0	122.6
1688	T	35.9	Very low	31.5	Very low	125 Å²	125	126.1 Å²	126.1	77%	0.767	74%	0.737	S	S	*	*				41.7	158.7	110.1	55.5	0	0	0	0	123.1
1689	P	41.7	Very low	31.5	Very low	103 Å²	103	125.7 Å²	125.7	67%	0.669	74%	0.735	S	S	*	*			cis	-145.3	-176.2	-24.2	38.9	-19.4	0	0	0	116.6
1690	S	28.6	Very low	31.1	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	73%	0.731	S	S	*	*			trans	73.4	161.7	145.6	76.6	0	0	0	0	119
1691	T	34.6	Very low	31.1	Very low	106 Å²	106	127.8 Å²	127.8	65%	0.65	73%	0.733	S	S	*	*			cis	-152.5	145.6	10.8	19.1	0	0	0	0	110.9
1692	E	32.4	Very low	30.9	Very low	158 Å²	158	124.3 Å²	124.3	74%	0.738	72%	0.721	S	S	*	*			trans	67	155.1	135.9	-65.6	-179.1	-152.1	0	0	120.9
1693	N	34.5	Very low	31	Very low	114 Å²	114	125.9 Å²	125.9	61%	0.61	72%	0.724	S	S	*	*			cis	-159.7	152	-1.9	-116.7	-10	0	0	0	113.8
1694	T	34.9	Very low	31	Very low	105 Å²	105	123.3 Å²	123.3	64%	0.644	72%	0.715	S	S	*	*			trans	39.3	161.3	139.7	65.2	0	0	0	0	124
1695	D	30.2	Very low	31	Very low	155 Å²	155	124 Å²	124	83%	0.829	71%	0.714	S	S	*	*			cis	178.2	170.2	-32.9	-90.5	-25.4	0	0	0	107.8
1696	G	32.3	Very low	30.8	Very low	65 Å²	65	124.4 Å²	124.4	67%	0.67	71%	0.712	S	S	*	*			trans	89.6	112.7	168.6	0	0	0	0	0	114.1
1697	E	29.6	Very low	30.5	Very low	190 Å²	190	122.8 Å²	122.8	89%	0.888	71%	0.705	S	S	*	*			cis	65.8	167.5	26.9	-60.1	-153.1	136.8	0	0	116.8
1698	V	28.9	Very low	30.3	Very low	118 Å²	118	123.8 Å²	123.8	72%	0.715	71%	0.706	S	S	*	*			trans	95.8	85.4	159.9	-171.3	0	0	0	0	118.3
1699	H	27.6	Very low	29.8	Very low	166 Å²	166	124.6 Å²	124.6	77%	0.769	71%	0.706	S	S	*	*				75.5	141.9	122.7	-88.7	-91.3	0	0	0	124.9
1700	S	25	Very low	29.2	Very low	75 Å²	75	124.9 Å²	124.9	52%	0.524	71%	0.71	S	S	.	*			trans	65.1	152.2	143	-58.3	0	0	0	0	118.5
1701	F	28.4	Very low	29.2	Very low	192 Å²	192	127.4 Å²	127.4	84%	0.842	71%	0.71	S	S	*	*			cis	-114.7	147.8	6.8	-74.5	-109.6	0	0	0	109.7
1702	V	26.6	Very low	29	Very low	105 Å²	105	129.7 Å²	129.7	64%	0.636	71%	0.714	S	S	*	*			cis	78.6	130.5	42.2	-179.5	0	0	0	0	112.6
1703	L	30.4	Very low	28.7	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	72%	0.715	S	S	*	*			trans	74.7	149.9	-171.2	-50.3	-175.6	0	0	0	116.3
1704	A	27.8	Very low	28.8	Very low	67 Å²	67	127.5 Å²	127.5	55%	0.554	72%	0.722	S	S	*	*			cis	-171.6	164.4	-30.8	0	0	0	0	0	109
1705	D	28.7	Very low	28.7	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	73%	0.725	S	S	*	*			trans	62.5	163.9	143.3	-68.8	-29	0	0	0	121
1706	N	25	Very low	28.3	Very low	133 Å²	133	125.3 Å²	125.3	71%	0.711	72%	0.721	S	S	*	*				-161	173.4	-52.3	-130.9	-49.4	0	0	0	109.8
1707	S	25	Very low	28.3	Very low	82 Å²	82	130.1 Å²	130.1	57%	0.573	73%	0.729	S	S	*	*			trans	11.8	125.6	155.8	62.4	0	0	0	0	120.4
1708	N	28.9	Very low	28.1	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	72%	0.72	S	S	*	*				177.7	135.1	115	-89.4	-44.9	0	0	0	109.1
1709	N	25.4	Very low	28	Very low	141 Å²	141	125 Å²	125	75%	0.754	72%	0.715	S	S	*	*				61.4	138.6	73.5	-82.3	-33.4	0	0	0	114.9
1710	S	27.9	Very low	28	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	71%	0.707	S	S	*	*			trans	87.8	131	161.6	83	0	0	0	0	119.4
1711	H	29.4	Very low	28.2	Very low	154 Å²	154	125 Å²	125	71%	0.713	72%	0.72	S	S	*	*			trans	51.5	121.8	157.2	-68.3	-78.8	0	0	0	123.1
1712	E	29.6	Very low	28.7	Very low	155 Å²	155	121.2 Å²	121.2	72%	0.724	72%	0.717	S	S	*	*				65.2	113.8	128	-72.9	159.3	-148.5	0	0	121.4
1713	S	26.8	Very low	28.8	Very low	110 Å²	110	121.6 Å²	121.6	77%	0.769	72%	0.722	S	S	*	*				60.1	154.8	104.7	-58	0	0	0	0	120.8
1714	P	36.4	Very low	28.6	Very low	116 Å²	116	118.7 Å²	118.7	75%	0.753	72%	0.715	S	S	*	*			trans	-96.1	-160.9	-149.4	44.2	-40.5	0	0	0	112
1715	P	32	Very low	28.7	Very low	107 Å²	107	123 Å²	123	70%	0.695	73%	0.727	S	S	*	*			cis	-147.8	-175.5	7.8	46.2	-26.1	0	0	0	118.9
1716	S	23.6	Very low	28.5	Very low	106 Å²	106	120.4 Å²	120.4	74%	0.741	72%	0.72	S	S	*	*			trans	49	135.3	144.8	-58.4	0	0	0	0	122.4
1717	I	31.1	Very low	28.8	Very low	166 Å²	166	121.3 Å²	121.3	85%	0.851	72%	0.72	S	S	*	*				-175.4	152.9	100.4	-89.1	164.6	0	0	0	110.6
1718	T	26.1	Very low	29	Very low	115 Å²	115	123.3 Å²	123.3	71%	0.706	73%	0.729	S	S	*	*			trans	-67	140.6	-159.4	53.1	0	0	0	0	120.9
1719	S	26.5	Very low	29.1	Very low	87 Å²	87	122.1 Å²	122.1	61%	0.608	73%	0.728	S	S	*	*				73.9	159.8	121.6	73.6	0	0	0	0	125.8
1720	E	27.3	Very low	29.3	Very low	126 Å²	126	123.1 Å²	123.1	59%	0.589	73%	0.733	S	S	*	*			trans	88.6	97.2	155.2	-70.9	-174.8	-152.2	0	0	123.7	N1831	E1720-N1831 PolarHBondContact OE1-ND2 3.49Å
1721	S	30.4	Very low	29.2	Very low	115 Å²	115	123 Å²	123	80%	0.804	73%	0.732	S	S	*	*				71.8	166.5	127.1	83.2	0	0	0	0	122.5
1722	S	37.1	Very low	29.4	Very low	112 Å²	112	121.5 Å²	121.5	78%	0.783	74%	0.736	S	S	*	*			trans	-120.2	153.7	-166.4	-43.9	0	0	0	0	114.7
1723	P	30.6	Very low	29.2	Very low	113 Å²	113	125.4 Å²	125.4	73%	0.734	74%	0.744	S	S	*	*				-120.3	152.7	126	2.7	18.7	0	0	0	110.4
1724	S	25.4	Very low	29.1	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	75%	0.75	S	S	*	*			cis	81.9	154.4	28.1	93.6	0	0	0	0	115.5
1725	I	30	Very low	28.8	Very low	158 Å²	158	128 Å²	128	81%	0.81	75%	0.748	S	S	*	*			trans	73.1	136.3	-176.9	-53.4	170.5	0	0	0	112.9
1726	S	24.8	Very low	28.5	Very low	85 Å²	85	130.2 Å²	130.2	59%	0.594	75%	0.751	S	S	*	*			cis	176.2	-178.3	-20.4	67.9	0	0	0	0	104.2
1727	E	30.8	Very low	28.5	Very low	153 Å²	153	131.9 Å²	131.9	72%	0.715	75%	0.75	S	S	*	*			cis	-141.7	135.3	-4.3	-110.9	127.8	-115.1	0	0	104.1
1728	T	28.5	Very low	28.5	Very low	123 Å²	123	128.9 Å²	128.9	76%	0.755	74%	0.742	S	S	*	*				51.6	153.5	83.8	79.9	0	0	0	0	115.6
1729	P	32.4	Very low	28.6	Very low	111 Å²	111	132.1 Å²	132.1	72%	0.721	75%	0.749	S	S	*	*			cis	-136.1	-158.9	12.5	37.1	-14.1	0	0	0	115.7
1730	L	28.4	Very low	28.5	Very low	163 Å²	163	135.3 Å²	135.3	85%	0.853	76%	0.758	S	S	*	*			trans	89.3	62.6	165.7	-61.3	169.8	0	0	0	119.8
1731	S	26.3	Very low	28.5	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	77%	0.768	S	S	*	*			trans	-52.2	177.4	139.9	-25.3	0	0	0	0	113.5
1732	P	34.2	Very low	28.4	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	76%	0.758	S	S	*	*			cis	-132.6	145.5	-15.9	27.8	-7.2	0	0	0	114.9
1733	R	25.7	Very low	28.2	Very low	237 Å²	237	135.3 Å²	135.3	89%	0.894	75%	0.75	S	S	*	*			trans	-97.6	154	151	-71.1	175.5	170.7	175.5	-4.1	109
1734	L	24.5	Very low	28	Very low	171 Å²	171	137.3 Å²	137.3	90%	0.895	75%	0.749	S	S	*	*			trans	-172.3	103.4	153.3	-108.4	161.6	0	0	0	111.7
1735	P	29.5	Very low	28	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	75%	0.747	S	S	*	*				-144	-170.7	125.3	39.7	-25.9	0	0	0	113
1736	M	25.3	Very low	27.8	Very low	153 Å²	153	133.1 Å²	133.1	75%	0.754	74%	0.739	S	S	*	*			trans	83.7	102.5	158.4	-66.7	-87	94	0	0	121.3
1737	I	22.8	Very low	27.7	Very low	141 Å²	141	136.2 Å²	136.2	72%	0.723	75%	0.748	S	S	*	*			trans	56.9	-175.8	139	-1.2	-179.7	0	0	0	119.3
1738	P	31.9	Very low	27.5	Very low	103 Å²	103	134.1 Å²	134.1	67%	0.669	76%	0.757	S	S	*	*				-133.5	165.1	-125.5	45.4	-26.5	0	0	0	118.4
1739	E	29.3	Very low	27.4	Very low	183 Å²	183	131.6 Å²	131.6	86%	0.855	75%	0.749	S	S	*	*			trans	-167.2	119.9	145.7	-105.4	156.3	-159.2	0	0	106.5
1740	L	23.4	Very low	26.9	Very low	153 Å²	153	133.8 Å²	133.8	80%	0.801	75%	0.753	S	S	*	*				81.7	152.8	84.4	-102.6	74	0	0	0	115.7
1741	D	26.3	Very low	26.7	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	75%	0.748	S	S	*	*			trans	60.2	72.6	169.5	-66	4.6	0	0	0	120.2
1742	N	30	Very low	26.6	Very low	111 Å²	111	134.9 Å²	134.9	59%	0.594	75%	0.745	S	S	*	*			trans	-53.4	149.6	143	113	130.3	0	0	0	110.4	R1946	N1742-R1946 PolarHBondContact OD1-NH1 3.03Å
1743	P	33.1	Very low	26.1	Very low	94 Å²	94	133.9 Å²	133.9	61%	0.61	73%	0.732	S	S	*	*				-146.2	-172.1	55.3	42.1	-23.8	0	0	0	116
1744	Q	24.6	Very low	26.2	Very low	155 Å²	155	124.6 Å²	124.6	72%	0.724	71%	0.711	S	S	*	*			trans	69.7	132.8	171.2	-116.9	66.8	-14.1	0	0	116
1745	G	26.9	Very low	26.5	Very low	64 Å²	64	122.6 Å²	122.6	66%	0.66	70%	0.697	S	S	*	*			cis	-165.2	152.3	-6.9	0	0	0	0	0	112.7
1746	V	25.5	Very low	26.4	Very low	107 Å²	107	125 Å²	125	65%	0.648	70%	0.698	S	S	*	*	S	Bend	trans	-78.1	150.2	161.5	-179.4	0	0	0	0	108.2	M1950	V1746-M1950 HydrophobicContact CB-CG 4.42Å; V1746-M1950 HydrophobicContact CB-SD 4.32Å; V1746-M1950 HydrophobicContact CG1-CB 4.26Å; V1746-M1950 HydrophobicContact CG1-CG 3.72Å; V1746-M1950 HydrophobicContact CG1-SD 3.76Å; V1746-M1950 HydrophobicContact CG2-SD 4Å
1747	L	22.7	Very low	26.5	Very low	149 Å²	149	122.9 Å²	122.9	78%	0.78	69%	0.69	S	S	*	*			trans	84.5	69.1	178.8	-159.8	76.7	0	0	0	115.1	A1749	L1747-A1749 HydrophobicContact CD1-CB 4.09Å
1748	A	25.7	Very low	26.8	Very low	109 Å²	109	123.7 Å²	123.7	90%	0.901	69%	0.69	S	S	*	*				-102.5	118.3	129.4	0	0	0	0	0	107.3
1749	A	27.2	Very low	26.5	Very low	70 Å²	70	124.5 Å²	124.5	58%	0.579	69%	0.688	S	S	*	*			trans	-135.9	161	172.1	0	0	0	0	0	107.9	L1747	L1747-A1749 HydrophobicContact CD1-CB 4.09Å
1750	L	22.4	Very low	26.3	Very low	157 Å²	157	122.9 Å²	122.9	82%	0.822	68%	0.68	S	S	*	*			trans	78.6	151.2	-176.6	-53.9	163.5	0	0	0	115.9
1751	I	24.1	Very low	26.4	Very low	144 Å²	144	121.8 Å²	121.8	74%	0.738	67%	0.671	S	S	*	*			trans	71.6	137.2	142.7	-78.6	159.6	0	0	0	118.5
1752	H	24.1	Very low	26.3	Very low	151 Å²	151	122.3 Å²	122.3	70%	0.699	67%	0.668	S	S	*	*			cis	-174.3	162.8	-27.6	-137.7	-104.3	0	0	0	108.2
1753	L	24.1	Very low	26	Very low	100 Å²	100	122.3 Å²	122.3	52%	0.524	68%	0.677	S	S	.	*			trans	67	163.3	168.4	-51.3	153.5	0	0	0	114.6	H1755	L1753-H1755 VanDerWaalsContact CD2-CE1 3.44Å; L1753-H1755 WeakPolarHBondContact CD2-CE1 3.48Å
1754	G	27.3	Very low	25.8	Very low	43 Å²	43	127 Å²	127	44%	0.443	69%	0.688	S	S	.	*			cis	-119	154.3	-16.6	0	0	0	0	0	110.6
1755	H	29.4	Very low	25.6	Very low	129 Å²	129	124 Å²	124	60%	0.597	68%	0.684	S	S	*	*				74.9	140.3	75.2	-67.1	139.7	0	0	0	114.4	L1753	L1753-H1755 VanDerWaalsContact CD2-CE1 3.44Å; L1753-H1755 WeakPolarHBondContact CD2-CE1 3.48Å
1756	H	28.5	Very low	25.7	Very low	159 Å²	159	130 Å²	130	74%	0.736	70%	0.695	S	S	*	*			cis	-157.9	159.1	-29.7	-150.9	-126.8	0	0	0	111.6
1757	N	28.1	Very low	25.6	Very low	110 Å²	110	129.5 Å²	129.5	59%	0.588	70%	0.696	S	S	*	*			trans	-41.1	139.9	179.5	-55.2	-86.4	0	0	0	118.6
1758	H	28.9	Very low	25.8	Very low	157 Å²	157	129.4 Å²	129.4	73%	0.727	69%	0.692	S	S	*	*				-156.7	109.1	119.5	-125.2	-108.8	0	0	0	109.4
1759	I	25.9	Very low	26	Very low	121 Å²	121	128.3 Å²	128.3	62%	0.621	67%	0.668	S	S	*	*				60.9	132.2	82.2	-54.5	171.6	0	0	0	113.3
1760	Q	24.5	Very low	26	Very low	148 Å²	148	131.2 Å²	131.2	69%	0.692	67%	0.667	S	S	*	*			trans	101.4	135.8	172.5	-58.5	-155.7	19.2	0	0	115.9
1761	Q	24.3	Very low	26.3	Very low	131 Å²	131	128.4 Å²	128.4	61%	0.612	65%	0.653	S	S	*	*			cis	-166.3	179.7	-15.6	-125.8	174.9	45.8	0	0	112.1
1762	Q	24.8	Very low	26.6	Very low	159 Å²	159	125.8 Å²	125.8	74%	0.743	64%	0.643	S	S	*	*			trans	64.8	89.8	150.2	-72.4	173.7	50.2	0	0	120.6
1763	S	24.7	Very low	26.9	Very low	111 Å²	111	125 Å²	125	78%	0.776	65%	0.645	S	S	*	*			trans	-13.9	136.2	132	55.2	0	0	0	0	120.2
1764	K	27.5	Very low	27	Very low	194 Å²	194	125.2 Å²	125.2	84%	0.843	65%	0.646	S	S	*	*			trans	-147.2	119.6	137.3	-87.5	-170.2	178.1	177.7	0	106.7
1765	S	21.8	Very low	27.9	Very low	90 Å²	90	136 Å²	136	63%	0.629	67%	0.673	S	S	*	*				63.6	99	75.5	76	0	0	0	0	114
1766	E	27.6	Very low	27.5	Very low	191 Å²	191	131.6 Å²	131.6	89%	0.893	66%	0.663	S	S	*	*				-178	-169.8	115.3	-97.7	167.5	-166.4	0	0	111.4
1767	S	23.3	Very low	27.1	Very low	96 Å²	96	132.2 Å²	132.2	67%	0.671	66%	0.663	S	S	*	*			trans	-98.7	172.2	-144.6	48.2	0	0	0	0	117
1768	E	27.4	Very low	26.9	Very low	148 Å²	148	129.4 Å²	129.4	69%	0.692	65%	0.651	S	S	*	*			trans	91.9	145.5	134.4	-119.9	-178.6	-134.8	0	0	120.3
1769	Q	29.7	Very low	26.7	Very low	85 Å²	85	130.6 Å²	130.6	40%	0.397	65%	0.65	S	S	.	*			trans	86.8	126.5	152.9	-39.7	-124.5	-2.9	0	0	120.8	L1780 S1781	Q1769-L1780 HydrophobicContact CB-CB 4.12Å; Q1769-L1780 HydrophobicContact CB-CG 3.78Å; Q1769-L1780 HydrophobicContact CG-CD2 4.3Å; Q1769-L1780 HydrophobicContact CG-CG 4.03Å; Q1769-L1780 VanDerWaalsContact OE1-C 3.25Å; Q1769-L1780 VanDerWaalsContact OE1-CG 3.24Å; Q1769-L1780 PolarHBondContact OE1-O 3.39Å; Q1769-S1781 VanDerWaalsContact CD-OG 3.31Å; Q1769-S1781 PolarHBondContact OE1-OG 2.91Å
1770	K	27.7	Very low	26.6	Very low	131 Å²	131	129.9 Å²	129.9	57%	0.57	65%	0.647	S	S	*	*			trans	-80.6	-177.4	178.3	-71.1	-179.1	176	166	0	114.2	Y1779 L1780 S1781 S1782	K1770-Y1779 CarbonylContact O-C 3.28Å; K1770-L1780 CarbonylContact O-C 3.55Å; K1770-L1780 WeakPolarHBondContact O-CA 3.49Å; K1770-L1780 PolarHBondContact O-N 3.07Å; K1770-S1781 VanDerWaalsContact N-CA 3.34Å; K1770-S1781 PolarHBondContact O-N 3.44Å; K1770-S1781 VanDerWaalsContact O-N 3.12Å; K1770-S1782 WeakPolarHBondContact CD-O 3.38Å; K1770-S1782 WeakPolarHBondContact CE-O 3.27Å; K1770-S1782 PolarHBondContact NZ-O 3.45Å
1771	L	29.1	Very low	26.6	Very low	98 Å²	98	125 Å²	125	51%	0.513	63%	0.629	S	S	.	*			trans	75	131.4	177.4	-69.5	84.1	0	0	0	113.8	P1778 Y1779	L1771-P1778 CarbonylContact C-O 3.29Å; L1771-P1778 WeakPolarHBondContact CB-O 3.4Å; L1771-P1778 HydrophobicContact CD2-CG 4.44Å; L1771-Y1779 WeakPolarHBondContact CB-O 3.39Å
1772	T	29.8	Very low	26.9	Very low	89 Å²	89	122.1 Å²	122.1	55%	0.546	62%	0.624	S	S	.	*			cis	108	158.5	19.6	65.2	0	0	0	0	114.7	L1774 P1778	T1772-L1774 PolarHBondContact O-N 3.15Å; T1772-L1774 VanDerWaalsContact O-N 3.08Å; T1772-P1778 VanDerWaalsContact O-CD 3.24Å; T1772-P1778 WeakPolarHBondContact O-CD 3.35Å
1773	N	29.8	Very low	27.1	Very low	135 Å²	135	120 Å²	120	72%	0.722	62%	0.622	S	S	*	*			trans	38.6	57.1	147.2	-64.4	19.7	0	0	0	118.5	P1778	N1773-P1778 WeakPolarHBondContact O-CD 3.47Å
1774	L	27.3	Very low	27.2	Very low	104 Å²	104	119.8 Å²	119.8	55%	0.545	62%	0.621	S	S	.	*				-143.7	153	87	-145	134	0	0	0	101.8	T1772 G1776 F1777	T1772-L1774 PolarHBondContact O-N 3.15Å; T1772-L1774 VanDerWaalsContact O-N 3.08Å; L1774-G1776 VanDerWaalsContact CA-N 3.26Å; L1774-G1776 VanDerWaalsContact CB-C 3.41Å; L1774-G1776 PolarHBondContact O-N 2.92Å; L1774-F1777 PolarHBondContact O-N 3.5Å
1775	W	45.4	Very low	27.2	Very low	271 Å²	271	115.8 Å²	115.8	100%	1.027	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn		41	-49.3	71.3	-50.4	-35.7	0	0	0	111.2
1776	G	20.5	Very low	27.4	Very low	36 Å²	36	116.9 Å²	116.9	37%	0.371	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-151.6	72.7	145.4	0	0	0	0	0	115.6	L1774	L1774-G1776 VanDerWaalsContact CA-N 3.26Å; L1774-G1776 VanDerWaalsContact CB-C 3.41Å; L1774-G1776 PolarHBondContact O-N 2.92Å
1777	F	22.1	Very low	27.3	Very low	172 Å²	172	112.5 Å²	112.5	75%	0.754	62%	0.615	S	S	*	*			trans	73.9	142.7	160.5	-43.4	-74.5	0	0	0	120	L1774	L1774-F1777 PolarHBondContact O-N 3.5Å
1778	P	22.1	Very low	27.4	Very low	51 Å²	51	113.9 Å²	113.9	33%	0.331	62%	0.62	S	S	.	*				-134.6	156.4	83.7	42.1	-35	0	0	0	118.3	L1771 T1772 N1773	L1771-P1778 CarbonylContact C-O 3.29Å; L1771-P1778 WeakPolarHBondContact CB-O 3.4Å; L1771-P1778 HydrophobicContact CD2-CG 4.44Å; T1772-P1778 VanDerWaalsContact O-CD 3.24Å; T1772-P1778 WeakPolarHBondContact O-CD 3.35Å; N1773-P1778 WeakPolarHBondContact O-CD 3.47Å
1779	Y	24.8	Very low	27.4	Very low	181 Å²	181	114 Å²	114	71%	0.71	62%	0.623	S	S	*	*			trans	22.2	113.4	138.9	-67.6	-90.9	0	0	0	123.3	K1770 L1771	K1770-Y1779 CarbonylContact O-C 3.28Å; L1771-Y1779 WeakPolarHBondContact CB-O 3.39Å
1780	L	25.1	Very low	27.1	Very low	107 Å²	107	121.5 Å²	121.5	56%	0.56	65%	0.648	S	S	*	*				56.2	93.3	108.5	-88.4	82.4	0	0	0	121.9	Q1769 K1770	Q1769-L1780 HydrophobicContact CB-CB 4.12Å; Q1769-L1780 HydrophobicContact CB-CG 3.78Å; Q1769-L1780 HydrophobicContact CG-CD2 4.3Å; Q1769-L1780 HydrophobicContact CG-CG 4.03Å; Q1769-L1780 VanDerWaalsContact OE1-C 3.25Å; Q1769-L1780 VanDerWaalsContact OE1-CG 3.24Å; Q1769-L1780 PolarHBondContact OE1-O 3.39Å; K1770-L1780 CarbonylContact O-C 3.55Å; K1770-L1780 WeakPolarHBondContact O-CA 3.49Å; K1770-L1780 PolarHBondContact O-N 3.07Å
1781	S	24.6	Very low	27	Very low	44 Å²	44	119 Å²	119	31%	0.308	66%	0.66	S	S	.	*			trans	72	141.7	146.8	80.9	0	0	0	0	126.4	Q1769 K1770	Q1769-S1781 VanDerWaalsContact CD-OG 3.31Å; Q1769-S1781 PolarHBondContact OE1-OG 2.91Å; K1770-S1781 VanDerWaalsContact N-CA 3.34Å; K1770-S1781 PolarHBondContact O-N 3.44Å; K1770-S1781 VanDerWaalsContact O-N 3.12Å
1782	S	29.2	Very low	26.7	Very low	72 Å²	72	123.8 Å²	123.8	50%	0.503	68%	0.677	S	S	.	*				165.6	139.2	112.7	41.3	0	0	0	0	108.9	K1770	K1770-S1782 WeakPolarHBondContact CD-O 3.38Å; K1770-S1782 WeakPolarHBondContact CE-O 3.27Å; K1770-S1782 PolarHBondContact NZ-O 3.45Å
1783	T	29.7	Very low	26.3	Very low	114 Å²	114	126.4 Å²	126.4	70%	0.699	69%	0.687	S	S	*	*			cis	-140.2	144.7	-16.2	35.1	0	0	0	0	105.9
1784	S	27.4	Very low	26	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	69%	0.692	S	S	*	*				43	140.7	84	46.3	0	0	0	0	115.8
1785	S	26.8	Very low	25.9	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	70%	0.698	S	S	*	*			cis	-148.6	160.5	4.7	52.2	0	0	0	0	110.1
1786	S	25.3	Very low	25.1	Very low	113 Å²	113	118.4 Å²	118.4	79%	0.79	68%	0.684	S	S	*	*				57.9	146.7	59	-91	0	0	0	0	115.3
1787	S	26.1	Very low	25.2	Very low	99 Å²	99	125.1 Å²	125.1	69%	0.692	71%	0.706	S	S	*	*			cis	-164.9	-175.9	-7.7	62.2	0	0	0	0	108.9
1788	T	25.7	Very low	25.6	Very low	125 Å²	125	121.4 Å²	121.4	77%	0.767	70%	0.697	S	S	*	*			cis	-131	-105.6	9	-46.7	0	0	0	0	113.3
1789	I	27.9	Very low	25.7	Very low	150 Å²	150	127.4 Å²	127.4	77%	0.769	71%	0.714	S	S	*	*			cis	-146.4	170.5	6	-79	178.4	0	0	0	110.3
1790	R	22.7	Very low	25.9	Very low	242 Å²	242	121.6 Å²	121.6	91%	0.913	70%	0.698	S	S	*	*			trans	-54.8	156.4	178.4	-56.1	167.4	171.8	171.6	-5.1	116.6
1791	G	26.3	Very low	26	Very low	79 Å²	79	120.7 Å²	120.7	81%	0.814	69%	0.694	S	S	*	*			trans	-175.1	126.4	155.7	0	0	0	0	0	114.5
1792	F	21	Very low	26.1	Very low	198 Å²	198	121.2 Å²	121.2	87%	0.868	70%	0.696	S	S	*	*			trans	-92.2	151.9	-177.7	-91.2	-104.8	0	0	0	113.6
1793	L	22.6	Very low	26.1	Very low	145 Å²	145	122.9 Å²	122.9	76%	0.759	70%	0.699	S	S	*	*			trans	71.8	157.6	144	-78.3	163.1	0	0	0	121.6
1794	N	23.6	Very low	26.1	Very low	157 Å²	157	125.6 Å²	125.6	84%	0.84	70%	0.701	S	S	*	*			trans	72.7	125	163.4	-62	-11.5	0	0	0	119.8
1795	G	25.3	Very low	26.2	Very low	64 Å²	64	127.5 Å²	127.5	66%	0.66	70%	0.703	S	S	*	*			trans	130.8	115.8	142.2	0	0	0	0	0	116.6
1796	T	27.8	Very low	26.1	Very low	121 Å²	121	127.9 Å²	127.9	74%	0.742	69%	0.692	S	S	*	*			trans	38.8	117.4	132.1	49.9	0	0	0	0	119
1797	E	23.7	Very low	26.1	Very low	177 Å²	177	125 Å²	125	83%	0.827	67%	0.671	S	S	*	*				68.5	137.2	80.8	-68.2	176.7	170.6	0	0	112.8
1798	V	28.8	Very low	26.1	Very low	94 Å²	94	127.3 Å²	127.3	57%	0.57	67%	0.671	S	S	*	*			cis	-164.5	137.1	14.1	100.9	0	0	0	0	113.3	N2027	V1798-N2027 PolarHBondContact O-ND2 3.28Å
1799	Y	25.1	Very low	26	Very low	176 Å²	176	128.1 Å²	128.1	69%	0.69	67%	0.67	S	S	*	*			trans	60.6	170.4	145.1	-78.9	-141	0	0	0	119.7	N2027	Y1799-N2027 WeakPolarHBondContact O-CB 3.46Å; Y1799-N2027 VanDerWaalsContact O-CG 3.3Å; Y1799-N2027 PolarHBondContact O-ND2 3.05Å
1800	T	29.9	Very low	25.9	Very low	60 Å²	60	127.2 Å²	127.2	37%	0.368	67%	0.672	S	S	.	*			cis	-160.5	144.3	-24.1	23.3	0	0	0	0	113.9	Q2028 Q2029	T1800-Q2028 VanDerWaalsContact C-C 3.46Å; T1800-Q2028 CarbonylContact O-C 3.53Å; T1800-Q2028 VanDerWaalsContact O-C 3.28Å; T1800-Q2028 PolarHBondContact O-N 3.21Å; T1800-Q2029 CarbonylContact C-O 3.6Å; T1800-Q2029 VanDerWaalsContact C-O 3.23Å; T1800-Q2029 WeakPolarHBondContact CA-O 3.45Å; T1800-Q2029 PolarHBondContact O-N 3.44Å
1801	D	27.2	Very low	26	Very low	87 Å²	87	120.1 Å²	120.1	47%	0.465	67%	0.665	S	S	.	*	B	Isolated β-bridge	trans	53.2	138.4	155.7	-70.1	12	0	0	0	123.8	N1803 Q2029	D1801-N1803 WeakPolarHBondContact CB-ND2 3.2Å; D1801-N1803 PolarHBondContact OD2-ND2 2.7Å; D1801-Q2029 PolarHBondContact N-O 3Å; D1801-Q2029 PolarHBondContact O-N 2.79Å
1802	P	25	Very low	25.9	Very low	55 Å²	55	123.5 Å²	123.5	36%	0.357	66%	0.663	S	S	.	*			trans	-123.5	82.7	147.4	33.4	-10.9	0	0	0	107.5	Q2029 A2030 T2031	P1802-Q2029 HydrophobicContact CB-CG 4.14Å; P1802-Q2029 HydrophobicContact CG-CB 4.04Å; P1802-Q2029 HydrophobicContact CG-CG 3.95Å; P1802-A2030 VanDerWaalsContact CD-O 3.28Å; P1802-A2030 WeakPolarHBondContact CD-O 3.2Å; P1802-T2031 HydrophobicContact CG-CG2 3.66Å; P1802-T2031 VanDerWaalsContact CG-N 3.33Å
1803	N	29.1	Very low	26.1	Very low	107 Å²	107	121.5 Å²	121.5	57%	0.572	66%	0.659	S	S	*	*			trans	-67	132.3	167.2	-76.3	-76.8	0	0	0	107.7	D1801	D1801-N1803 WeakPolarHBondContact CB-ND2 3.2Å; D1801-N1803 PolarHBondContact OD2-ND2 2.7Å
1804	K	30.4	Very low	26.2	Very low	171 Å²	171	122.5 Å²	122.5	74%	0.743	67%	0.665	S	S	*	*			cis	-161.6	159.2	9.8	-99.8	158.8	-175.5	161.1	0	106.1
1805	L	29.1	Very low	26.3	Very low	148 Å²	148	119.1 Å²	119.1	78%	0.775	66%	0.659	S	S	*	*			cis	-157.2	153	9.7	-99	151.7	0	0	0	104.4
1806	H	25.5	Very low	26.5	Very low	117 Å²	117	121.9 Å²	121.9	54%	0.542	67%	0.668	S	S	.	*			cis	59.9	106.6	30.6	-159.9	86.4	0	0	0	114.2	N2032	H1806-N2032 PolarHBondContact CE1-O 2.82Å; H1806-N2032 PolarHBondContact ND1-O 3.01Å
1807	C	25.5	Very low	26.4	Very low	54 Å²	54	123 Å²	123	37%	0.365	67%	0.668	S	S	.	*			cis	-166.9	166.6	6.8	-169.1	0	0	0	0	109.8	L1809 A2033	C1807-L1809 PolarHBondContact SG-N 3.07Å; C1807-A2033 WeakPolarHBondContact CA-O 3.5Å; C1807-A2033 PolarHBondContact SG-O 3Å
1808	Q	25.4	Very low	26.5	Very low	146 Å²	146	120.1 Å²	120.1	68%	0.682	67%	0.668	S	S	*	*	S	Bend		-145.6	103.6	129.4	-131	169.8	55.4	0	0	115.5	C2034 N2035	Q1808-C2034 PolarHBondContact O-SG 3.29Å; Q1808-N2035 PolarHBondContact O-ND2 3.43Å
1809	L	24	Very low	26.6	Very low	142 Å²	142	126.5 Å²	126.5	74%	0.743	68%	0.682	S	S	*	*			trans	73.2	119.1	148.2	-132.8	73.1	0	0	0	119.5	C1807	C1807-L1809 PolarHBondContact SG-N 3.07Å
1810	T	26.7	Very low	27.1	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	69%	0.69	S	S	*	*			trans	-145.7	160.4	145.7	-67	0	0	0	0	107.2
1811	A	24.2	Very low	27.3	Very low	93 Å²	93	130.7 Å²	130.7	77%	0.769	72%	0.716	S	S	*	*			trans	-74.5	155.2	-153.3	0	0	0	0	0	117.9
1812	L	23.9	Very low	27.5	Very low	150 Å²	150	131.8 Å²	131.8	79%	0.785	73%	0.727	S	S	*	*			trans	-72.2	155.8	148.6	-103.5	80.4	0	0	0	109.4
1813	M	24.3	Very low	27.5	Very low	156 Å²	156	136.3 Å²	136.3	77%	0.768	74%	0.743	S	S	*	*			cis	-164.6	163.5	-8.2	-145.7	177.3	-156.9	0	0	109.1
1814	N	25.7	Very low	27.3	Very low	165 Å²	165	138.1 Å²	138.1	88%	0.882	75%	0.752	S	S	*	*			trans	148.9	147	152.5	-80.4	-18.2	0	0	0	109.1
1815	A	25.4	Very low	27.1	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	75%	0.747	S	S	*	*			cis	-135.7	-178.5	-0.6	0	0	0	0	0	108.3
1816	S	30.4	Very low	26.8	Very low	121 Å²	121	134.9 Å²	134.9	85%	0.846	74%	0.743	S	S	*	*			cis	-159.1	169.7	33.9	-52.9	0	0	0	0	112.2
1817	L	24.9	Very low	26.6	Very low	144 Å²	144	134.6 Å²	134.6	75%	0.754	75%	0.754	S	S	*	*			trans	-147.4	123.3	-175.8	-161	163.9	0	0	0	111.9	R1819	L1817-R1819 HydrophobicContact CD2-CG 4.03Å
1818	S	25.4	Very low	26.7	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	77%	0.767	S	S	*	*			trans	-174.3	113.5	160.8	-78.8	0	0	0	0	107.7
1819	R	31.7	Very low	26.7	Very low	228 Å²	228	135.7 Å²	135.7	86%	0.86	77%	0.768	S	S	*	*				76.6	111	55	-77.9	-162.8	175.2	-154.8	1.5	115.6	L1817	L1817-R1819 HydrophobicContact CD2-CG 4.03Å
1820	T	35.6	Very low	26.7	Very low	139 Å²	139	133.7 Å²	133.7	85%	0.853	77%	0.766	S	S	*	*			trans	-139.9	136.5	149.6	46.6	0	0	0	0	108.7
1821	M	34	Very low	26.8	Very low	185 Å²	185	131.4 Å²	131.4	91%	0.911	75%	0.749	S	S	*	*			trans	-146.5	134.4	169.4	-89.7	-67.4	170.5	0	0	108.4
1822	P	30.4	Very low	26.9	Very low	109 Å²	109	132.4 Å²	132.4	71%	0.708	74%	0.738	S	S	*	*			trans	-91.9	127.2	-178.7	33.3	-31.1	0	0	0	112.9
1823	H	26.4	Very low	27	Very low	151 Å²	151	128.3 Å²	128.3	70%	0.699	73%	0.725	S	S	*	*			trans	62.8	139	164	-71.4	-82.8	0	0	0	117.8	Q1825	H1823-Q1825 PolarHBondContact ND1-OE1 3.29Å
1824	I	25	Very low	27.7	Very low	145 Å²	145	125.5 Å²	125.5	74%	0.744	72%	0.718	S	S	*	*			cis	-123.8	109.4	3.4	-63.7	-180	0	0	0	105.9
1825	Q	24.6	Very low	27.8	Very low	138 Å²	138	124.8 Å²	124.8	65%	0.645	71%	0.714	S	S	*	*				61.7	125.7	93.3	-75	174.2	-37.4	0	0	113.4	H1823	H1823-Q1825 PolarHBondContact ND1-OE1 3.29Å
1826	T	23.5	Very low	27.8	Very low	113 Å²	113	126.6 Å²	126.6	69%	0.693	71%	0.711	S	S	*	*			cis	-152.6	162.8	3.9	45.2	0	0	0	0	111.6
1827	S	22.6	Very low	27.6	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	71%	0.707	S	S	*	*			trans	59.7	162.5	162.8	42.5	0	0	0	0	118.1
1828	S	25.7	Very low	27.7	Very low	91 Å²	91	125.5 Å²	125.5	64%	0.636	70%	0.704	S	S	*	*			cis	-160.5	170.6	-38.2	60.1	0	0	0	0	109.5
1829	D	27.4	Very low	27.9	Very low	133 Å²	133	124.1 Å²	124.1	71%	0.711	70%	0.7	S	S	*	*			trans	58.9	126.5	152.6	-44.9	-41	0	0	0	124.1
1830	S	23.3	Very low	27.8	Very low	100 Å²	100	122.8 Å²	122.8	70%	0.699	70%	0.7	S	S	*	*				83.7	148.6	128.7	76.4	0	0	0	0	124.1
1831	N	28.7	Very low	27.4	Very low	84 Å²	84	121.7 Å²	121.7	45%	0.449	69%	0.694	S	S	.	*			trans	66.8	117.8	143.5	-64.1	3.4	0	0	0	120.4	E1720	E1720-N1831 PolarHBondContact OE1-ND2 3.49Å
1832	E	25.4	Very low	27	Very low	114 Å²	114	118 Å²	118	53%	0.533	68%	0.682	S	S	.	*				74.6	104.6	86.4	-71.7	-148.5	134.8	0	0	113.5
1833	A	27.5	Very low	26.8	Very low	63 Å²	63	121.2 Å²	121.2	52%	0.521	69%	0.687	S	S	.	*				107.9	-176.6	92.7	0	0	0	0	0	110
1834	P	37.9	Very low	26.7	Very low	97 Å²	97	118.8 Å²	118.8	63%	0.63	69%	0.687	S	S	*	*				-127	-169.6	-117.4	33.2	-10.7	0	0	0	115.6
1835	L	28.7	Very low	26.9	Very low	150 Å²	150	116.7 Å²	116.7	79%	0.785	68%	0.676	S	S	*	*			trans	79.5	152.8	174.1	-54.9	135.3	0	0	0	114.3
1836	D	24.3	Very low	27.1	Very low	125 Å²	125	115.2 Å²	115.2	67%	0.668	67%	0.673	S	S	*	*			cis	-148.6	169.8	-1.4	-141.9	-10.5	0	0	0	115.1
1837	L	26	Very low	27.4	Very low	142 Å²	142	111.7 Å²	111.7	74%	0.743	65%	0.651	S	S	*	*			trans	26.7	141.5	152.6	-78.6	162.3	0	0	0	124.6
1838	S	27.9	Very low	27.7	Very low	100 Å²	100	112 Å²	112	70%	0.699	64%	0.644	S	S	*	*			trans	-51.6	160.9	160.7	51.8	0	0	0	0	116.4
1839	A	30.4	Very low	27.7	Very low	89 Å²	89	112.7 Å²	112.7	74%	0.736	65%	0.649	S	S	*	*			cis	179.7	165.2	-12.7	0	0	0	0	0	110.1
1840	K	28.4	Very low	28	Very low	200 Å²	200	112.8 Å²	112.8	87%	0.87	66%	0.655	S	S	*	*			trans	-177.6	125.2	141.4	-105.4	164.3	-176.8	179.9	0	116.3
1841	T	27.6	Very low	28.4	Very low	117 Å²	117	111.1 Å²	111.1	72%	0.718	65%	0.653	S	S	*	*				53.2	94.6	121.3	-49	0	0	0	0	122.4
1842	T	25.8	Very low	28.4	Very low	107 Å²	107	113.7 Å²	113.7	66%	0.656	67%	0.667	S	S	*	*			trans	63.7	126.9	133.3	60.9	0	0	0	0	125.2
1843	Q	25.2	Very low	28.8	Very low	177 Å²	177	113.1 Å²	113.1	83%	0.827	67%	0.667	S	S	*	*			trans	68.2	150.5	131.8	-68.8	177.3	-8.4	0	0	120.3
1844	S	26	Very low	28.9	Very low	99 Å²	99	115.4 Å²	115.4	69%	0.692	67%	0.671	S	S	*	*			cis	-173.5	160.6	-16.4	51.8	0	0	0	0	110.3
1845	I	29.1	Very low	28.7	Very low	101 Å²	101	116.3 Å²	116.3	52%	0.518	68%	0.678	S	S	.	*			trans	-174.4	161.2	152	-103	157.6	0	0	0	112.2	E1864 Q1865	I1845-E1864 HydrophobicContact CG2-CG 4.39Å; I1845-Q1865 HydrophobicContact CG2-CB 4.42Å; I1845-Q1865 HydrophobicContact CG2-CG 3.69Å
1846	N	27.7	Very low	29.2	Very low	107 Å²	107	114.7 Å²	114.7	57%	0.572	67%	0.667	S	S	*	*			trans	-168.2	131.4	-137.4	163.1	87.5	0	0	0	117	Q1865 N1866	N1846-Q1865 CarbonylContact O-C 3.32Å; N1846-Q1865 VanDerWaalsContact O-C 3.29Å; N1846-Q1865 WeakPolarHBondContact O-CA 3.2Å; N1846-Q1865 PolarHBondContact O-N 3.03Å; N1846-N1866 PolarHBondContact O-N 2.71Å
1847	V	30.3	Very low	29.3	Very low	40 Å²	40	114.7 Å²	114.7	24%	0.242	67%	0.666	C	S	.	*			trans	-159.8	143.3	160.2	120.3	0	0	0	0	104.9	L1863 E1864 Q1865	V1847-L1863 CarbonylContact O-C 3.57Å; V1847-L1863 VanDerWaalsContact O-C 3.3Å; V1847-E1864 WeakPolarHBondContact CB-O 3.35Å; V1847-E1864 WeakPolarHBondContact CG1-O 3.47Å; V1847-E1864 WeakPolarHBondContact O-CA 3.42Å; V1847-E1864 PolarHBondContact O-N 3.47Å; V1847-E1864 VanDerWaalsContact O-N 3.15Å; V1847-Q1865 VanDerWaalsContact CB-C 3.45Å; V1847-Q1865 WeakPolarHBondContact CG2-O 3.23Å
1848	N	27.8	Very low	29.4	Very low	117 Å²	117	112.8 Å²	112.8	63%	0.626	67%	0.665	S	S	*	*			cis	81.9	144.3	49.2	-41	-16.6	0	0	0	112.1
1849	S	27.4	Very low	29.3	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	67%	0.67	S	S	*	*			cis	-156.6	176.9	-1.4	-152.7	0	0	0	0	111.2
1850	T	33.3	Very low	29	Very low	136 Å²	136	114.1 Å²	114.1	83%	0.834	67%	0.669	S	S	*	*			trans	67	139.3	-179.4	70	0	0	0	0	114.5
1851	G	30.7	Very low	28.8	Very low	64 Å²	64	113 Å²	113	66%	0.66	67%	0.665	S	S	*	*			cis	100.9	134.9	8.8	0	0	0	0	0	111.6
1852	D	29.9	Very low	28.8	Very low	139 Å²	139	113.6 Å²	113.6	74%	0.743	66%	0.662	S	S	*	*			cis	-169.6	159.5	4.9	-149.1	14.8	0	0	0	110.8
1853	N	33.3	Very low	28.7	Very low	102 Å²	102	114.5 Å²	114.5	55%	0.545	66%	0.662	S	S	.	*			trans	63.5	174.1	148.1	-90	-49.7	0	0	0	119.9
1854	N	29.6	Very low	28.8	Very low	110 Å²	110	110.4 Å²	110.4	59%	0.588	64%	0.643	S	S	*	*	S	Bend	cis	-140.4	136.7	-31.6	-170.6	-91	0	0	0	107.9	Q1856	N1854-Q1856 PolarHBondContact O-NE2 2.93Å; N1854-Q1856 PolarHBondContact O-OE1 3.29Å
1855	C	32.5	Very low	28.8	Very low	116 Å²	116	111 Å²	111	78%	0.784	64%	0.635	S	S	*	*	S	Bend	cis	-59.6	-43.5	8.8	-51.9	0	0	0	0	116.5
1856	Q	39.4	Very low	28.7	Very low	117 Å²	117	110.3 Å²	110.3	55%	0.547	63%	0.632	S	S	.	*			cis	-150.8	-176.6	-19.8	-127.7	166.8	25	0	0	106.3	N1854	N1854-Q1856 PolarHBondContact O-NE2 2.93Å; N1854-Q1856 PolarHBondContact O-OE1 3.29Å
1857	N	27.4	Very low	28.7	Very low	124 Å²	124	108.9 Å²	108.9	66%	0.663	64%	0.635	S	S	*	*			trans	28.3	108.7	144.9	-53.8	-17.9	0	0	0	118.1
1858	S	26.8	Very low	28.6	Very low	103 Å²	103	115.3 Å²	115.3	72%	0.72	66%	0.662	S	S	*	*				72.3	115.6	82.9	-62	0	0	0	0	115.6
1859	S	26.1	Very low	28.6	Very low	115 Å²	115	115.8 Å²	115.8	80%	0.804	66%	0.663	S	S	*	*			trans	60.7	132.9	142.4	62.6	0	0	0	0	122.6
1860	S	25	Very low	28.5	Very low	101 Å²	101	117.2 Å²	117.2	71%	0.706	66%	0.662	S	S	*	*			trans	105.8	116.5	131.6	-147.7	0	0	0	0	121.7
1861	F	25	Very low	28.3	Very low	178 Å²	178	116.1 Å²	116.1	78%	0.781	65%	0.651	S	S	*	*			trans	77.3	116.8	132.8	-87.1	-129.2	0	0	0	125.2
1862	I	26.1	Very low	28.3	Very low	129 Å²	129	117.2 Å²	117.2	66%	0.662	64%	0.642	S	S	*	*				78.7	129.6	119.7	-81.7	-172	0	0	0	125.4
1863	L	24.8	Very low	28.3	Very low	125 Å²	125	116 Å²	116	65%	0.654	63%	0.631	S	S	*	*			trans	47	168.3	154.9	-85.7	88	0	0	0	122.5	V1847	V1847-L1863 CarbonylContact O-C 3.57Å; V1847-L1863 VanDerWaalsContact O-C 3.3Å
1864	E	26	Very low	28.2	Very low	91 Å²	91	115.4 Å²	115.4	43%	0.425	63%	0.628	S	S	.	*			cis	-169.5	157.4	-42.3	-153.7	-167.3	-110.6	0	0	113.4	I1845 V1847	I1845-E1864 HydrophobicContact CG2-CG 4.39Å; V1847-E1864 WeakPolarHBondContact CB-O 3.35Å; V1847-E1864 WeakPolarHBondContact CG1-O 3.47Å; V1847-E1864 WeakPolarHBondContact O-CA 3.42Å; V1847-E1864 PolarHBondContact O-N 3.47Å; V1847-E1864 VanDerWaalsContact O-N 3.15Å
1865	Q	26.9	Very low	28.4	Very low	112 Å²	112	114.2 Å²	114.2	52%	0.523	62%	0.622	S	S	.	*			trans	72.5	100.5	170.5	-45.6	-149.6	15	0	0	127.9	I1845 N1846 V1847	I1845-Q1865 HydrophobicContact CG2-CB 4.42Å; I1845-Q1865 HydrophobicContact CG2-CG 3.69Å; N1846-Q1865 CarbonylContact O-C 3.32Å; N1846-Q1865 VanDerWaalsContact O-C 3.29Å; N1846-Q1865 WeakPolarHBondContact O-CA 3.2Å; N1846-Q1865 PolarHBondContact O-N 3.03Å; V1847-Q1865 VanDerWaalsContact CB-C 3.45Å; V1847-Q1865 WeakPolarHBondContact CG2-O 3.23Å
1866	N	27.1	Very low	28.4	Very low	86 Å²	86	114.5 Å²	114.5	46%	0.46	62%	0.615	S	S	.	*			trans	70	168.5	131.8	-64	-41.4	0	0	0	121.2	N1846	N1846-N1866 PolarHBondContact O-N 2.71Å
1867	A	27.9	Very low	28	Very low	77 Å²	77	114.7 Å²	114.7	64%	0.636	62%	0.62	S	S	*	*			cis	-171.6	172.3	-32.5	0	0	0	0	0	113
1868	Q	27.1	Very low	28	Very low	176 Å²	176	116.9 Å²	116.9	82%	0.822	62%	0.624	S	S	*	*			trans	72.4	159.2	156.3	-73.1	177.1	2.1	0	0	118.5
1869	I	27.6	Very low	28.5	Very low	126 Å²	126	115.2 Å²	115.2	65%	0.646	61%	0.611	S	S	*	*			cis	-161.4	150.7	12.1	-136.7	164	0	0	0	113.8
1870	I	27.2	Very low	28.6	Very low	135 Å²	135	113.7 Å²	113.7	69%	0.692	60%	0.596	S	S	*	*			trans	62.3	141.7	151.8	-75	165	0	0	0	119.9
1871	D	28.3	Very low	28.8	Very low	112 Å²	112	112.8 Å²	112.8	60%	0.599	58%	0.584	S	S	*	*			cis	-161.3	157.9	-5.8	-107.6	-0.5	0	0	0	112.5
1872	N	29.7	Very low	29.4	Very low	88 Å²	88	108.3 Å²	108.3	47%	0.471	57%	0.568	S	S	.	*			trans	38.5	145.7	143.4	-47.8	-26.1	0	0	0	121.4	N1615	N1615-N1872 PolarHBondContact ND2-OD1 2.98Å
1873	E	30.5	Very low	29.6	Very low	113 Å²	113	107.2 Å²	107.2	53%	0.528	56%	0.56	S	S	.	*			cis	-174.9	176.6	10.5	-124.8	149.2	-140.5	0	0	108.7	N1615	N1615-E1873 PolarHBondContact ND2-OE1 3.46Å
1874	D	32.3	Very low	30.1	Very low	89 Å²	89	107.1 Å²	107.1	48%	0.476	56%	0.56	S	S	.	*			cis	-165.9	174.6	-1.7	-152.9	1.9	0	0	0	114.1	S1613	S1613-D1874 VanDerWaalsContact CB-CG 3.42Å; S1613-D1874 WeakPolarHBondContact CB-OD1 3.3Å; S1613-D1874 WeakPolarHBondContact CB-OD2 3.31Å; S1613-D1874 VanDerWaalsContact OG-CG 3.26Å; S1613-D1874 PolarHBondContact OG-OD1 3.43Å; S1613-D1874 PolarHBondContact OG-OD2 2.91Å
1875	N	33.4	Very low	30.3	Very low	86 Å²	86	110.5 Å²	110.5	46%	0.46	58%	0.576	S	S	.	*			trans	53.6	121.5	153.1	-69	-47.1	0	0	0	127.1	S1613	S1613-N1875 WeakPolarHBondContact CB-OD1 3.31Å
1876	N	31.7	Very low	30.7	Very low	121 Å²	121	113.6 Å²	113.6	65%	0.647	59%	0.588	S	S	*	*				63.1	147.8	126.4	-51.7	-7.4	0	0	0	122.8
1877	D	31.7	Very low	30.9	Very low	121 Å²	121	116.5 Å²	116.5	65%	0.647	60%	0.603	S	S	*	*			cis	-165.7	141.4	-10.9	-105.1	-22.7	0	0	0	115
1878	F	27.3	Very low	30.9	Very low	171 Å²	171	116.9 Å²	116.9	75%	0.75	60%	0.601	S	S	*	*			trans	59.8	168.2	150	-77.8	-106.9	0	0	0	122.8	Y1902	F1878-Y1902 PolarHBondContact O-OH 3.45Å
1879	P	36	Very low	31	Very low	67 Å²	67	112.9 Å²	112.9	44%	0.435	59%	0.588	S	S	.	*				-143.5	145.7	-60.6	40.8	-22.4	0	0	0	120.6	Y1902 R1903	P1879-Y1902 VanDerWaalsContact C-CE1 3.48Å; P1879-Y1902 WeakPolarHBondContact O-CE1 3.29Å; P1879-R1903 PolarHBondContact O-NH1 3.4Å
1880	V	30	Very low	31.1	Very low	83 Å²	83	110.1 Å²	110.1	50%	0.503	58%	0.579	S	S	.	*			trans	70.2	153	141.7	166.5	0	0	0	0	120.5	Y1902 R1903	V1880-Y1902 VanDerWaalsContact O-CD1 3.26Å; V1880-Y1902 WeakPolarHBondContact O-CD1 3.41Å; V1880-Y1902 VanDerWaalsContact O-CE1 3.26Å; V1880-Y1902 WeakPolarHBondContact O-CE1 3.45Å; V1880-R1903 WeakPolarHBondContact O-CD 3.48Å; V1880-R1903 WeakPolarHBondContact O-CG 3.43Å; V1880-R1903 PolarHBondContact O-NE 2.94Å; V1880-R1903 PolarHBondContact O-NH1 3.28Å
1881	N	29.2	Very low	31	Very low	83 Å²	83	107 Å²	107	44%	0.444	57%	0.569	S	S	.	*			cis	-176.3	113.3	-28.1	-177	99	0	0	0	114.8	S1904	N1881-S1904 PolarHBondContact O-OG 3.11Å
1882	N	36.9	Very low	30.9	Very low	83 Å²	83	109.5 Å²	109.5	44%	0.444	58%	0.581	S	S	.	*			trans	60.9	140.7	148.5	-46.9	2.2	0	0	0	127	Y1902 R1903 S1904	N1882-Y1902 WeakPolarHBondContact CA-O 3.39Å; N1882-Y1902 PolarHBondContact N-O 3.37Å; N1882-R1903 CarbonylContact C-O 3.55Å; N1882-S1904 WeakPolarHBondContact O-CA 3.07Å
1883	Q	29.7	Very low	31.4	Very low	107 Å²	107	110.6 Å²	110.6	50%	0.5	59%	0.586	S	S	.	*			trans	-140	148.6	151.5	-174.2	171.1	9.6	0	0	110.7	T1905 S1906	Q1883-T1905 VanDerWaalsContact NE2-C 3.33Å; Q1883-T1905 PolarHBondContact NE2-O 3.38Å; Q1883-T1905 PolarHBondContact OE1-O 2.96Å; Q1883-S1906 PolarHBondContact NE2-O 3.28Å
1884	D	35.1	Very low	31.1	Very low	122 Å²	122	113 Å²	113	65%	0.652	60%	0.597	S	S	*	*			trans	-110.4	154.6	-169.3	-49.5	-73.9	0	0	0	115.4
1885	Q	31.7	Very low	31	Very low	162 Å²	162	114.1 Å²	114.1	76%	0.757	61%	0.607	S	S	*	*			trans	159.3	170.3	132.3	-87.7	178.9	25.1	0	0	115
1886	F	34.7	Very low	30.6	Very low	177 Å²	177	117.9 Å²	117.9	78%	0.776	62%	0.622	S	S	*	*			trans	92.8	130.9	163.7	-73.5	-89.4	0	0	0	122.4
1887	L	30	Very low	30.3	Very low	147 Å²	147	120.2 Å²	120.2	77%	0.77	63%	0.629	S	S	*	*			trans	74.9	129.4	149	-67.6	164.9	0	0	0	123.9
1888	S	29.7	Very low	30	Very low	86 Å²	86	118.3 Å²	118.3	60%	0.601	63%	0.63	S	S	*	*			trans	78.4	138.5	148.9	-58.5	0	0	0	0	122.1	N1281	N1281-S1888 CarbonylContact O-C 3.57Å; N1281-S1888 VanDerWaalsContact O-C 3.32Å
1889	V	27.8	Very low	29.9	Very low	92 Å²	92	115.4 Å²	115.4	56%	0.558	63%	0.63	S	S	*	*			trans	-155.6	158.2	-173.9	168.7	0	0	0	0	108.2	P1280 N1281 L1282	P1280-V1889 VanDerWaalsContact CD-O 3.29Å; P1280-V1889 WeakPolarHBondContact CD-O 3.39Å; N1281-V1889 CarbonylContact O-C 3.08Å; N1281-V1889 WeakPolarHBondContact O-CA 3.16Å; N1281-V1889 PolarHBondContact O-N 2.96Å; N1281-V1889 VanDerWaalsContact O-N 3.08Å; L1282-V1889 HydrophobicContact CD1-CG1 4.18Å; L1282-V1889 HydrophobicContact CG-CG1 3.97Å; L1282-V1889 HydrophobicContact CG-CG2 4.14Å
1890	P	29.8	Very low	29.5	Very low	68 Å²	68	116.2 Å²	116.2	44%	0.442	64%	0.638	S	S	.	*			cis	-114.6	170.4	-14.9	39.7	-28.1	0	0	0	115.1	P1280 N1281 L1282	P1280-P1890 CarbonylContact C-O 3.57Å; N1281-P1890 VanDerWaalsContact CA-O 3.25Å; N1281-P1890 WeakPolarHBondContact CA-O 3.36Å; N1281-P1890 PolarHBondContact N-O 3.33Å; L1282-P1890 HydrophobicContact CB-CB 4.45Å; L1282-P1890 HydrophobicContact CD1-CB 4.13Å
1891	S	26.3	Very low	29.5	Very low	69 Å²	69	116.2 Å²	116.2	48%	0.483	64%	0.638	S	S	.	*			trans	-65.5	131.4	-166	-60.1	0	0	0	0	121.4	N1281 L1282	N1281-S1891 VanDerWaalsContact OD1-CA 3.23Å; N1281-S1891 WeakPolarHBondContact OD1-CA 3.24Å; N1281-S1891 VanDerWaalsContact OD1-CB 3.29Å; N1281-S1891 WeakPolarHBondContact OD1-CB 3.42Å; N1281-S1891 PolarHBondContact OD1-OG 3.26Å; L1282-S1891 VanDerWaalsContact CB-OG 3.27Å; L1282-S1891 WeakPolarHBondContact CB-OG 2.96Å; L1282-S1891 PolarHBondContact N-OG 3.43Å
1892	L	25.7	Very low	29.6	Very low	165 Å²	165	117.4 Å²	117.4	86%	0.864	64%	0.637	S	S	*	*			trans	-153.6	27.2	144.2	-144.9	91.8	0	0	0	116.7	P1280	P1280-L1892 PolarHBondContact O-N 2.92Å
1893	I	39.5	Very low	29.2	Very low	111 Å²	111	120.7 Å²	120.7	57%	0.569	64%	0.643	S	S	*	*			trans	-133.4	141.2	-171.2	-68.1	179.4	0	0	0	114	N1281	N1281-I1893 PolarHBondContact ND2-O 3.11Å
1894	Q	25.6	Very low	29.2	Very low	164 Å²	164	118.2 Å²	118.2	77%	0.766	64%	0.638	S	S	*	*			trans	4.6	116.1	157	-76.1	170.3	-27.5	0	0	117.7
1895	T	28.7	Very low	28.9	Very low	112 Å²	112	117 Å²	117	69%	0.687	64%	0.635	S	S	*	*				90.8	110.3	66	55.7	0	0	0	0	115.7
1896	E	25.9	Very low	28.6	Very low	164 Å²	164	113.1 Å²	113.1	77%	0.766	63%	0.626	S	S	*	*			trans	79.1	156.7	140.2	-61.6	-178.3	175.9	0	0	122.8
1897	H	25.6	Very low	28.1	Very low	171 Å²	171	110.6 Å²	110.6	79%	0.792	63%	0.625	S	S	*	*			trans	81.4	106.1	169.3	-58.5	-69.3	0	0	0	122.7
1898	A	25.1	Very low	28.2	Very low	81 Å²	81	109.2 Å²	109.2	67%	0.669	62%	0.623	S	S	*	*				58.5	117.1	124.7	0	0	0	0	0	124
1899	S	25.5	Very low	28.2	Very low	109 Å²	109	110.2 Å²	110.2	76%	0.762	63%	0.63	S	S	*	*				52.2	129.4	127.2	-54.9	0	0	0	0	124.1	L1287	L1287-S1899 VanDerWaalsContact CD1-C 3.41Å; L1287-S1899 VanDerWaalsContact CD1-O 3.3Å; L1287-S1899 WeakPolarHBondContact CD1-O 3.3Å
1900	S	27.2	Very low	28.5	Very low	84 Å²	84	109.9 Å²	109.9	59%	0.587	63%	0.632	S	S	*	*			trans	102.6	97.9	136.6	-146.9	0	0	0	0	123.2	L1287	L1287-S1900 VanDerWaalsContact CD1-C 3.48Å; L1287-S1900 WeakPolarHBondContact CD1-O 3.27Å; L1287-S1900 VanDerWaalsContact CD2-O 3.3Å; L1287-S1900 WeakPolarHBondContact CD2-O 3.3Å
1901	V	30.4	Very low	28.5	Very low	84 Å²	84	113 Å²	113	51%	0.509	65%	0.649	S	S	.	*				82.8	149.9	121.6	167.9	0	0	0	0	124.2	K1288	K1288-V1901 PolarHBondContact NZ-O 3.48Å
1902	Y	30.5	Very low	28.8	Very low	107 Å²	107	117.9 Å²	117.9	42%	0.42	67%	0.67	S	S	.	*			trans	102.6	168.8	158.6	-87.8	-49.3	0	0	0	123.1	F1878 P1879 V1880 N1882	F1878-Y1902 PolarHBondContact O-OH 3.45Å; P1879-Y1902 VanDerWaalsContact C-CE1 3.48Å; P1879-Y1902 WeakPolarHBondContact O-CE1 3.29Å; V1880-Y1902 VanDerWaalsContact O-CD1 3.26Å; V1880-Y1902 WeakPolarHBondContact O-CD1 3.41Å; V1880-Y1902 VanDerWaalsContact O-CE1 3.26Å; V1880-Y1902 WeakPolarHBondContact O-CE1 3.45Å; N1882-Y1902 WeakPolarHBondContact CA-O 3.39Å; N1882-Y1902 PolarHBondContact N-O 3.37Å
1903	R	29.4	Very low	29.1	Very low	152 Å²	152	113.3 Å²	113.3	57%	0.574	66%	0.663	S	S	*	*			trans	-89.1	178.7	-130.1	-151.4	155.1	-158.1	135.7	-8.4	120.5	P1879 V1880 N1882	P1879-R1903 PolarHBondContact O-NH1 3.4Å; V1880-R1903 WeakPolarHBondContact O-CD 3.48Å; V1880-R1903 WeakPolarHBondContact O-CG 3.43Å; V1880-R1903 PolarHBondContact O-NE 2.94Å; V1880-R1903 PolarHBondContact O-NH1 3.28Å; N1882-R1903 CarbonylContact C-O 3.55Å
1904	S	29.7	Very low	28.9	Very low	55 Å²	55	111.6 Å²	111.6	39%	0.385	67%	0.672	S	S	.	*			trans	-68.5	173.8	-172.3	-34.2	0	0	0	0	117.1	N1881 N1882	N1881-S1904 PolarHBondContact O-OG 3.11Å; N1882-S1904 WeakPolarHBondContact O-CA 3.07Å
1905	T	28.3	Very low	29.4	Very low	98 Å²	98	114 Å²	114	60%	0.601	68%	0.675	S	S	*	*			cis	-165.8	158.6	18.7	-21.3	0	0	0	0	114.7	Q1883	Q1883-T1905 VanDerWaalsContact NE2-C 3.33Å; Q1883-T1905 PolarHBondContact NE2-O 3.38Å; Q1883-T1905 PolarHBondContact OE1-O 2.96Å
1906	S	24.6	Very low	30.3	Very low	80 Å²	80	119.9 Å²	119.9	56%	0.559	68%	0.684	S	S	*	*			trans	106.2	141.7	137.4	80.6	0	0	0	0	123	Q1883	Q1883-S1906 PolarHBondContact NE2-O 3.28Å
1907	T	25.8	Very low	31.4	Very low	123 Å²	123	119.6 Å²	119.6	76%	0.755	69%	0.688	S	S	*	*			trans	52.2	114.3	163.5	54.1	0	0	0	0	119.3
1908	T	30.3	Very low	33.2	Very low	118 Å²	118	122.6 Å²	122.6	72%	0.724	69%	0.692	S	S	*	*				-164.7	161	60.4	37.6	0	0	0	0	115.2
1909	S	30.8	Very low	35.7	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	69%	0.686	S	S	*	*			trans	64.2	92.6	158.1	47.4	0	0	0	0	123.5
1910	S	33	Very low	38.3	Very low	86 Å²	86	122.8 Å²	122.8	60%	0.601	69%	0.685	S	S	*	*				65.1	90.4	124.3	64	0	0	0	0	123.4	N1912	S1910-N1912 PolarHBondContact O-N 3.34Å
1911	T	29.7	Very low	41.3	Very low	133 Å²	133	121.4 Å²	121.4	82%	0.816	67%	0.671	S	S	*	*				27.4	82.7	113.3	51.6	0	0	0	0	119.5	G1913	T1911-G1913 PolarHBondContact O-N 3.43Å
1912	N	33.7	Very low	44.2	Very low	171 Å²	171	121 Å²	121	91%	0.914	67%	0.668	S	S	*	*			trans	-75.6	90.8	163.9	-126.8	-31	0	0	0	110.6	S1910 G1914	S1910-N1912 PolarHBondContact O-N 3.34Å; N1912-G1914 PolarHBondContact O-N 2.89Å
1913	G	32.3	Very low	46.9	Very low	69 Å²	69	119.1 Å²	119.1	71%	0.711	68%	0.675	S	S	*	*			trans	-63.3	99.5	-176.3	0	0	0	0	0	113	T1911 R1915	T1911-G1913 PolarHBondContact O-N 3.43Å; G1913-R1915 PolarHBondContact O-N 2.91Å; G1913-R1915 VanDerWaalsContact O-N 3.14Å
1914	G	34.1	Very low	49.7	Very low	75 Å²	75	117.1 Å²	117.1	77%	0.773	68%	0.675	S	S	*	*			trans	-49.3	114.9	-173.9	0	0	0	0	0	113.9	N1912 R1916	N1912-G1914 PolarHBondContact O-N 2.89Å; G1914-R1916 PolarHBondContact O-N 2.88Å
1915	R	37.9	Very low	52.8	Low	215 Å²	215	115.9 Å²	115.9	81%	0.811	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.9	124.5	164.1	-57.5	-179	-169	-179.2	6.4	106.3	G1913 N1917	G1913-R1915 PolarHBondContact O-N 2.91Å; G1913-R1915 VanDerWaalsContact O-N 3.14Å; R1915-N1917 PolarHBondContact O-N 2.84Å; R1915-N1917 VanDerWaalsContact O-N 3.13Å
1916	R	46.7	Very low	55.9	Low	235 Å²	235	112.7 Å²	112.7	89%	0.887	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-55.3	124.5	171.9	-63	-168.5	-168.4	100.5	-5.5	108.1	G1914 R1918	G1914-R1916 PolarHBondContact O-N 2.88Å; R1916-R1918 PolarHBondContact O-N 3.37Å
1917	N	49.1	Very low	59.1	Low	158 Å²	158	117 Å²	117	85%	0.845	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-53.8	125.8	178.1	-77.1	-9.5	0	0	0	109.2	R1915 T1919	R1915-N1917 PolarHBondContact O-N 2.84Å; R1915-N1917 VanDerWaalsContact O-N 3.13Å; N1917-T1919 PolarHBondContact O-N 3.47Å
1918	R	62.8	Low	62.2	Low	235 Å²	235	113 Å²	113	89%	0.887	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-69.2	121.5	177.3	-170.1	-175.6	-162.5	-172.4	5.1	106.6	R1916 S1920	R1916-R1918 PolarHBondContact O-N 3.37Å; R1918-S1920 PolarHBondContact O-N 2.81Å
1919	T	77.7	Confident	65.3	Low	86 Å²	86	107.4 Å²	107.4	53%	0.528	59%	0.591	S	S	.	*			trans	-54.9	108.5	174.3	45.2	0	0	0	0	109.3	N1917 I1921 V1957	N1917-T1919 PolarHBondContact O-N 3.47Å; T1919-I1921 PolarHBondContact O-N 2.85Å; T1919-V1957 HydrophobicContact CG2-CG2 4.32Å
1920	S	80.8	Confident	68.3	Low	107 Å²	107	105.6 Å²	105.6	75%	0.748	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-71.6	119.2	173.3	40.2	0	0	0	0	108.7	R1918	R1918-S1920 PolarHBondContact O-N 2.81Å
1921	I	89.1	Confident	71.1	Confident	56 Å²	56	105.5 Å²	105.5	29%	0.287	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-91.5	124.7	176.2	-60.1	174.8	0	0	0	106.7	T1919 Q1925 S1926 M1929 L1953 V1957	T1919-I1921 PolarHBondContact O-N 2.85Å; I1921-Q1925 HydrophobicContact CG2-CB 3.72Å; I1921-S1926 WeakPolarHBondContact CG2-OG 3.34Å; I1921-M1929 HydrophobicContact CD1-CE 4.31Å; I1921-M1929 HydrophobicContact CG2-CE 3.59Å; I1921-L1953 HydrophobicContact CD1-CD1 4.49Å; I1921-L1953 HydrophobicContact CG1-CD1 4.09Å; I1921-L1953 HydrophobicContact CG2-CD1 4.12Å; I1921-V1957 HydrophobicContact CD1-CG1 3.95Å; I1921-V1957 HydrophobicContact CG1-CG1 4.31Å
1922	T	91.5	Very high	73.9	Confident	74 Å²	74	101.2 Å²	101.2	45%	0.454	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-73.4	165	-178.6	69.2	0	0	0	0	111.6	L1924 Q1925 S1926	T1922-L1924 VanDerWaalsContact C-N 3.26Å; T1922-L1924 PolarHBondContact O-N 3.04Å; T1922-Q1925 PolarHBondContact O-N 2.81Å; T1922-Q1925 VanDerWaalsContact OG1-CG 3.28Å; T1922-Q1925 WeakPolarHBondContact OG1-CG 3.3Å; T1922-Q1925 PolarHBondContact OG1-N 2.84Å; T1922-Q1925 PolarHBondContact OG1-OE1 3.17Å; T1922-S1926 WeakPolarHBondContact O-CB 3.33Å; T1922-S1926 PolarHBondContact O-N 3.24Å; T1922-S1926 PolarHBondContact O-OG 2.73Å
1923	A	87.9	Confident	76.8	Confident	68 Å²	68	93.3 Å²	93.3	56%	0.562	50%	0.499	S	S	*	.	H	α-helix	trans	-61.4	-34.9	176.5	0	0	0	0	0	112.4	R1927	A1923-R1927 WeakPolarHBondContact O-CB 3.34Å; A1923-R1927 PolarHBondContact O-N 3.47Å
1924	L	87.9	Confident	79.5	Confident	111 Å²	111	96 Å²	96	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-68.8	-50.3	175.8	-176.4	64	0	0	0	111.5	T1922 S1926 R1927 C1928	T1922-L1924 VanDerWaalsContact C-N 3.26Å; T1922-L1924 PolarHBondContact O-N 3.04Å; L1924-S1926 PolarHBondContact O-N 3.02Å; L1924-R1927 PolarHBondContact O-N 2.84Å; L1924-C1928 PolarHBondContact O-N 2.66Å; L1924-C1928 PolarHBondContact O-SG 2.89Å; L1924-C1928 VanDerWaalsContact O-SG 3.38Å
1925	Q	94.4	Very high	82.1	Confident	29 Å²	29	102.9 Å²	102.9	14%	0.136	50%	0.502	C	S	.	.	H	α-helix	trans	-54.8	-42.5	175.2	-71.7	170.7	-22.6	0	0	111.6	I1921 T1922 M1929 I1951 L1953	I1921-Q1925 HydrophobicContact CG2-CB 3.72Å; T1922-Q1925 PolarHBondContact O-N 2.81Å; T1922-Q1925 VanDerWaalsContact OG1-CG 3.28Å; T1922-Q1925 WeakPolarHBondContact OG1-CG 3.3Å; T1922-Q1925 PolarHBondContact OG1-N 2.84Å; T1922-Q1925 PolarHBondContact OG1-OE1 3.17Å; Q1925-M1929 HydrophobicContact CB-CE 4.5Å; Q1925-M1929 WeakPolarHBondContact O-CE 3.26Å; Q1925-M1929 WeakPolarHBondContact O-CG 3.49Å; Q1925-M1929 PolarHBondContact O-N 3.26Å; Q1925-M1929 VanDerWaalsContact O-N 3.1Å; Q1925-I1951 HydrophobicContact CG-CB 4.14Å; Q1925-I1951 HydrophobicContact CG-CG1 4.4Å; Q1925-I1951 WeakPolarHBondContact CG-O 3.32Å; Q1925-I1951 PolarHBondContact NE2-O 2.83Å; Q1925-L1953 HydrophobicContact CB-CD1 4.15Å; Q1925-L1953 HydrophobicContact CG-CD1 4.28Å; Q1925-L1953 HydrophobicContact CG-CG 4.46Å
1926	S	93.4	Very high	84.4	Confident	31 Å²	31	95.8 Å²	95.8	22%	0.217	48%	0.477	C	S	.	.	H	α-helix	trans	-64.7	-42.5	176.3	-57.3	0	0	0	0	112.3	I1921 T1922 L1924 M1929 H1930	I1921-S1926 WeakPolarHBondContact CG2-OG 3.34Å; T1922-S1926 WeakPolarHBondContact O-CB 3.33Å; T1922-S1926 PolarHBondContact O-N 3.24Å; T1922-S1926 PolarHBondContact O-OG 2.73Å; L1924-S1926 PolarHBondContact O-N 3.02Å; S1926-M1929 PolarHBondContact O-N 3.15Å; S1926-H1930 WeakPolarHBondContact O-CB 3.26Å; S1926-H1930 PolarHBondContact O-CD2 3.22Å; S1926-H1930 PolarHBondContact O-N 2.86Å
1927	R	91.3	Very high	86.5	Confident	169 Å²	169	88.9 Å²	88.9	64%	0.638	45%	0.454	S	S	*	.	H	α-helix	trans	-62.8	-45.2	176.6	-88.4	-173.2	-96.3	145.9	-13	112.3	A1923 L1924 M1929 H1930 S1931	A1923-R1927 WeakPolarHBondContact O-CB 3.34Å; A1923-R1927 PolarHBondContact O-N 3.47Å; L1924-R1927 PolarHBondContact O-N 2.84Å; R1927-M1929 PolarHBondContact O-N 3.27Å; R1927-H1930 PolarHBondContact O-N 2.87Å; R1927-S1931 PolarHBondContact O-N 3.19Å
1928	C	91.4	Very high	88.6	Confident	40 Å²	40	85.3 Å²	85.3	27%	0.27	44%	0.438	S	S	.	.	H	α-helix	trans	-61	-46.5	176.8	-60.4	0	0	0	0	111.5	L1924 H1930 S1931 I1932 I1951	L1924-C1928 PolarHBondContact O-N 2.66Å; L1924-C1928 PolarHBondContact O-SG 2.89Å; L1924-C1928 VanDerWaalsContact O-SG 3.38Å; C1928-H1930 VanDerWaalsContact C-N 3.34Å; C1928-H1930 PolarHBondContact O-N 3.49Å; C1928-S1931 PolarHBondContact O-N 2.88Å; C1928-I1932 WeakPolarHBondContact O-CD1 3.49Å; C1928-I1932 WeakPolarHBondContact O-CG1 3.4Å; C1928-I1932 PolarHBondContact O-N 3.06Å; C1928-I1951 HydrophobicContact CB-CG2 3.92Å
1929	M	94.9	Very high	89.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-63.8	-36.2	176	-70.4	-173.5	-70.9	0	0	112.8	I1921 Q1925 S1926 R1927 Y1933 L1947 I1951 L1953 V1958 W1961 F1962	I1921-M1929 HydrophobicContact CD1-CE 4.31Å; I1921-M1929 HydrophobicContact CG2-CE 3.59Å; Q1925-M1929 HydrophobicContact CB-CE 4.5Å; Q1925-M1929 WeakPolarHBondContact O-CE 3.26Å; Q1925-M1929 WeakPolarHBondContact O-CG 3.49Å; Q1925-M1929 PolarHBondContact O-N 3.26Å; Q1925-M1929 VanDerWaalsContact O-N 3.1Å; S1926-M1929 PolarHBondContact O-N 3.15Å; R1927-M1929 PolarHBondContact O-N 3.27Å; M1929-Y1933 VanDerWaalsContact O-CB 3.24Å; M1929-Y1933 WeakPolarHBondContact O-CB 3.41Å; M1929-Y1933 PolarHBondContact O-N 2.93Å; M1929-L1947 HydrophobicContact CG-CD2 4.42Å; M1929-I1951 HydrophobicContact CE-CD1 4.14Å; M1929-I1951 HydrophobicContact CG-CD1 3.51Å; M1929-I1951 HydrophobicContact SD-CD1 3.66Å; M1929-L1953 HydrophobicContact CE-CD1 3.95Å; M1929-L1953 HydrophobicContact SD-CD1 4.49Å; M1929-V1958 HydrophobicContact SD-CG1 4.3Å; M1929-V1958 HydrophobicContact SD-CG2 4.33Å; M1929-W1961 HydrophobicContact CB-CD2 3.99Å; M1929-W1961 HydrophobicContact CB-CE3 3.77Å; M1929-W1961 HydrophobicContact CB-CH2 3.73Å; M1929-W1961 HydrophobicContact CB-CZ2 3.91Å; M1929-W1961 HydrophobicContact CB-CZ3 3.65Å; M1929-W1961 HydrophobicContact CE-CB 4.45Å; M1929-W1961 HydrophobicContact CE-CD2 4.01Å; M1929-W1961 HydrophobicContact CE-CG 3.81Å; M1929-W1961 HydrophobicContact CG-CE3 4.44Å; M1929-W1961 HydrophobicContact SD-CB 3.98Å; M1929-W1961 HydrophobicContact SD-CD2 3.8Å; M1929-W1961 HydrophobicContact SD-CE3 4.12Å; M1929-W1961 HydrophobicContact SD-CG 3.74Å; M1929-F1962 HydrophobicContact CB-CE2 4.17Å; M1929-F1962 HydrophobicContact CG-CE2 4.19Å
1930	H	93.9	Very high	90.5	Very high	69 Å²	69	73.2 Å²	73.2	32%	0.319	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-43.4	174.1	-88.2	-63.4	0	0	0	113.2	S1926 R1927 C1928 I1932 Y1933 N1934 W1961	S1926-H1930 WeakPolarHBondContact O-CB 3.26Å; S1926-H1930 PolarHBondContact O-CD2 3.22Å; S1926-H1930 PolarHBondContact O-N 2.86Å; R1927-H1930 PolarHBondContact O-N 2.87Å; C1928-H1930 VanDerWaalsContact C-N 3.34Å; C1928-H1930 PolarHBondContact O-N 3.49Å; H1930-I1932 VanDerWaalsContact C-N 3.26Å; H1930-I1932 PolarHBondContact O-N 3.2Å; H1930-Y1933 WeakPolarHBondContact O-CB 3.37Å; H1930-Y1933 PolarHBondContact O-N 3.21Å; H1930-N1934 VanDerWaalsContact O-CG 3.3Å; H1930-N1934 PolarHBondContact O-N 3.45Å; H1930-N1934 PolarHBondContact O-OD1 3.06Å; H1930-W1961 HydrophobicContact CB-CH2 4.46Å; H1930-W1961 AromaticContact CD2-CZ2 3.71Å; H1930-W1961 AromaticContact CE1-CH2 3.87Å; H1930-W1961 AromaticContact CE1-CZ2 3.78Å; H1930-W1961 AromaticContact CG-CH2 3.84Å; H1930-W1961 AromaticContact CG-CZ2 3.96Å; H1930-W1961 AromaticContact ND1-CH2 3.72Å; H1930-W1961 AromaticContact NE2-CZ2 3.59Å
1931	S	91.9	Very high	91	Very high	85 Å²	85	71.2 Å²	71.2	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-56.4	-44.6	176.4	-169.2	0	0	0	0	111	R1927 C1928 N1934	R1927-S1931 PolarHBondContact O-N 3.19Å; C1928-S1931 PolarHBondContact O-N 2.88Å; S1931-N1934 PolarHBondContact O-N 3.3Å
1932	I	90	Very high	91.1	Very high	43 Å²	43	75.1 Å²	75.1	22%	0.221	39%	0.393	C	S	.	.	H	α-helix	trans	-74.8	-34.8	-179.5	-63.9	156	0	0	0	111	C1928 H1930 N1934 Y1935 H1936 L1947 M1950 F1962	C1928-I1932 WeakPolarHBondContact O-CD1 3.49Å; C1928-I1932 WeakPolarHBondContact O-CG1 3.4Å; C1928-I1932 PolarHBondContact O-N 3.06Å; H1930-I1932 VanDerWaalsContact C-N 3.26Å; H1930-I1932 PolarHBondContact O-N 3.2Å; I1932-N1934 VanDerWaalsContact C-N 3.31Å; I1932-N1934 PolarHBondContact O-N 3.36Å; I1932-Y1935 PolarHBondContact O-N 3.49Å; I1932-H1936 CarbonylContact O-C 3.46Å; I1932-H1936 PolarHBondContact O-N 3.42Å; I1932-L1947 HydrophobicContact CB-CD2 4.26Å; I1932-L1947 HydrophobicContact CD1-CD1 3.93Å; I1932-L1947 HydrophobicContact CD1-CD2 3.76Å; I1932-L1947 HydrophobicContact CD1-CG 3.74Å; I1932-L1947 HydrophobicContact CG2-CD1 4.21Å; I1932-L1947 HydrophobicContact CG2-CD2 4Å; I1932-M1950 HydrophobicContact CD1-CE 3.66Å; I1932-F1962 HydrophobicContact CB-CZ 4.34Å; I1932-F1962 HydrophobicContact CG2-CZ 4.07Å
1933	Y	94.7	Very high	91.1	Very high	5 Å²	5	74.1 Å²	74.1	2%	0.02	38%	0.383	C	S	.	.	H	α-helix	trans	-60.8	-38.2	173.8	-170.6	-85	0	0	0	113.1	M1929 H1930 Y1935 H1936 K1937 W1961 F1962 Q1965 R1966 E1969	M1929-Y1933 VanDerWaalsContact O-CB 3.24Å; M1929-Y1933 WeakPolarHBondContact O-CB 3.41Å; M1929-Y1933 PolarHBondContact O-N 2.93Å; H1930-Y1933 WeakPolarHBondContact O-CB 3.37Å; H1930-Y1933 PolarHBondContact O-N 3.21Å; Y1933-Y1935 VanDerWaalsContact C-N 3.3Å; Y1933-Y1935 PolarHBondContact O-N 2.95Å; Y1933-H1936 CarbonylContact O-C 3.58Å; Y1933-K1937 HydrophobicContact CD1-CG 4.2Å; Y1933-K1937 HydrophobicContact CE1-CB 4.48Å; Y1933-K1937 HydrophobicContact CE1-CD 4.17Å; Y1933-K1937 HydrophobicContact CE1-CG 3.84Å; Y1933-K1937 HydrophobicContact CE2-CB 4.41Å; Y1933-K1937 WeakPolarHBondContact O-CG 3.41Å; Y1933-K1937 PolarHBondContact O-N 3.48Å; Y1933-W1961 AromaticContact CD2-CZ3 3.93Å; Y1933-W1961 HydrophobicContact CD2-CZ3 3.93Å; Y1933-W1961 HydrophobicContact CG-CZ3 4.27Å; Y1933-F1962 AromaticContact CD2-CD1 3.57Å; Y1933-F1962 HydrophobicContact CD2-CD1 3.57Å; Y1933-F1962 AromaticContact CD2-CE1 3.74Å; Y1933-F1962 HydrophobicContact CD2-CE1 3.74Å; Y1933-F1962 HydrophobicContact CD2-CG 4.43Å; Y1933-F1962 HydrophobicContact CE2-CD1 4.24Å; Y1933-F1962 HydrophobicContact CG-CE1 4.31Å; Y1933-Q1965 HydrophobicContact CD1-CG 4.1Å; Y1933-Q1965 HydrophobicContact CD2-CB 4.04Å; Y1933-Q1965 HydrophobicContact CD2-CG 3.66Å; Y1933-Q1965 HydrophobicContact CE1-CG 3.92Å; Y1933-Q1965 HydrophobicContact CE2-CB 3.69Å; Y1933-Q1965 HydrophobicContact CE2-CG 3.46Å; Y1933-Q1965 VanDerWaalsContact CE2-CG 3.46Å; Y1933-Q1965 HydrophobicContact CG-CG 4Å; Y1933-R1966 HydrophobicContact CE2-CG 3.88Å; Y1933-R1966 VanDerWaalsContact OH-CA 3.24Å; Y1933-R1966 WeakPolarHBondContact OH-CA 3.28Å; Y1933-R1966 VanDerWaalsContact OH-CG 3.29Å; Y1933-R1966 WeakPolarHBondContact OH-CG 3.19Å; Y1933-R1966 PolarHBondContact OH-N 2.91Å; Y1933-E1969 VanDerWaalsContact CE1-OE2 3.3Å; Y1933-E1969 WeakPolarHBondContact CE1-OE2 3.32Å; Y1933-E1969 VanDerWaalsContact CZ-OE2 3.32Å; Y1933-E1969 PolarHBondContact OH-OE2 3.19Å
1934	N	89	Confident	91.3	Very high	126 Å²	126	71 Å²	71	67%	0.674	36%	0.357	S	S	*	.	H	α-helix	trans	-67.3	-32	179.5	-69.8	-0.5	0	0	0	112.1	H1930 S1931 I1932	H1930-N1934 VanDerWaalsContact O-CG 3.3Å; H1930-N1934 PolarHBondContact O-N 3.45Å; H1930-N1934 PolarHBondContact O-OD1 3.06Å; S1931-N1934 PolarHBondContact O-N 3.3Å; I1932-N1934 VanDerWaalsContact C-N 3.31Å; I1932-N1934 PolarHBondContact O-N 3.36Å
1935	Y	87.4	Confident	91.6	Very high	219 Å²	219	68.4 Å²	68.4	86%	0.859	34%	0.343	S	S	*	.	H	α-helix	trans	-84.5	-49.3	176	-170.5	-98.4	0	0	0	112.4	I1932 Y1933	I1932-Y1935 PolarHBondContact O-N 3.49Å; Y1933-Y1935 VanDerWaalsContact C-N 3.3Å; Y1933-Y1935 PolarHBondContact O-N 2.95Å
1936	H	86.4	Confident	91.5	Very high	65 Å²	65	72.8 Å²	72.8	30%	0.301	36%	0.359	S	S	.	.			trans	-133.9	100.7	-178.5	-170	-152	0	0	0	110.9	I1932 Y1933 T1938 P1939 E1943	I1932-H1936 CarbonylContact O-C 3.46Å; I1932-H1936 PolarHBondContact O-N 3.42Å; Y1933-H1936 CarbonylContact O-C 3.58Å; H1936-T1938 PolarHBondContact CE1-O 3.36Å; H1936-T1938 VanDerWaalsContact CE1-O 3.23Å; H1936-T1938 PolarHBondContact NE2-O 3.42Å; H1936-T1938 PolarHBondContact NE2-OG1 3.48Å; H1936-T1938 PolarHBondContact O-N 2.85Å; H1936-P1939 WeakPolarHBondContact O-CD 3.27Å; H1936-E1943 IonicContact CE1-OE1 2.79Å; H1936-E1943 IonicContact CE1-OE2 3.5Å; H1936-E1943 IonicContact ND1-OE1 3.88Å; H1936-E1943 PolarHBondContact ND1-OE1 3.42Å; H1936-E1943 IonicContact ND1-OE2 2.83Å
1937	K	91.4	Very high	91.5	Very high	91 Å²	91	72 Å²	72	40%	0.396	35%	0.352	S	S	.	.	S	Bend	trans	-69.1	-15.6	-177.6	-64.2	-178.8	-177.8	-178.2	0	113.7	Y1933 R1966 E1969	Y1933-K1937 HydrophobicContact CD1-CG 4.2Å; Y1933-K1937 HydrophobicContact CE1-CB 4.48Å; Y1933-K1937 HydrophobicContact CE1-CD 4.17Å; Y1933-K1937 HydrophobicContact CE1-CG 3.84Å; Y1933-K1937 HydrophobicContact CE2-CB 4.41Å; Y1933-K1937 WeakPolarHBondContact O-CG 3.41Å; Y1933-K1937 PolarHBondContact O-N 3.48Å; K1937-R1966 WeakPolarHBondContact O-CD 3.44Å; K1937-R1966 PolarHBondContact O-NH1 3.42Å; K1937-E1969 IonicContact NZ-OE1 3.02Å; K1937-E1969 PolarHBondContact NZ-OE1 3.23Å; K1937-E1969 IonicContact NZ-OE2 3.85Å
1938	T	92.5	Very high	91.7	Very high	82 Å²	82	64.1 Å²	64.1	50%	0.503	32%	0.323	S	S	.	.	S	Bend	trans	-131.9	55.5	-170.6	43.1	0	0	0	0	113.4	H1936 S1940	H1936-T1938 PolarHBondContact CE1-O 3.36Å; H1936-T1938 VanDerWaalsContact CE1-O 3.23Å; H1936-T1938 PolarHBondContact NE2-O 3.42Å; H1936-T1938 PolarHBondContact NE2-OG1 3.48Å; H1936-T1938 PolarHBondContact O-N 2.85Å; T1938-S1940 PolarHBondContact O-N 3.33Å
1939	P	88.6	Confident	91.8	Very high	15 Å²	15	69.1 Å²	69.1	10%	0.097	34%	0.343	C	S	.	.			trans	-56.5	137.6	179.4	25.4	-35.2	0	0	0	111.9	H1936 E1943 F1962	H1936-P1939 WeakPolarHBondContact O-CD 3.27Å; P1939-E1943 HydrophobicContact CB-CB 3.63Å; P1939-E1943 HydrophobicContact CB-CG 4.5Å; P1939-F1962 HydrophobicContact CG-CB 4.44Å; P1939-F1962 HydrophobicContact CG-CD1 3.42Å; P1939-F1962 VanDerWaalsContact CG-CD1 3.42Å; P1939-F1962 HydrophobicContact CG-CD2 4.14Å; P1939-F1962 HydrophobicContact CG-CE1 3.54Å; P1939-F1962 HydrophobicContact CG-CE2 4.27Å; P1939-F1962 HydrophobicContact CG-CG 3.74Å; P1939-F1962 HydrophobicContact CG-CZ 3.99Å
1940	S	92.9	Very high	91.6	Very high	53 Å²	53	72.5 Å²	72.5	37%	0.371	36%	0.359	S	S	.	.			trans	-58.7	171	172.9	65.5	0	0	0	0	112.1	T1938 H1942 E1943 C1944	T1938-S1940 PolarHBondContact O-N 3.33Å; S1940-H1942 VanDerWaalsContact C-N 3.27Å; S1940-H1942 PolarHBondContact O-N 3.49Å; S1940-E1943 WeakPolarHBondContact CB-OE2 3.15Å; S1940-E1943 PolarHBondContact N-OE2 2.97Å; S1940-E1943 PolarHBondContact O-N 2.93Å; S1940-E1943 WeakPolarHBondContact OG-CG 3.43Å; S1940-E1943 PolarHBondContact OG-N 3.39Å; S1940-E1943 VanDerWaalsContact OG-N 3.16Å; S1940-E1943 PolarHBondContact OG-OE2 3.42Å; S1940-C1944 WeakPolarHBondContact O-CB 3.31Å; S1940-C1944 PolarHBondContact O-N 3.5Å; S1940-C1944 PolarHBondContact O-SG 2.84Å
1941	V	90.7	Very high	91.5	Very high	64 Å²	64	70 Å²	70	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-40.5	175.7	-174.5	0	0	0	0	110.9	C1944 D1945	V1941-C1944 WeakPolarHBondContact O-CB 3.36Å; V1941-C1944 PolarHBondContact O-N 3.28Å; V1941-D1945 PolarHBondContact O-N 3.04Å
1942	H	91.5	Very high	91.6	Very high	139 Å²	139	69 Å²	69	64%	0.644	35%	0.351	S	S	*	.	H	α-helix	trans	-71.1	-36.1	179.5	-61.4	-72.9	0	0	0	113.2	S1940 D1945 R1946	S1940-H1942 VanDerWaalsContact C-N 3.27Å; S1940-H1942 PolarHBondContact O-N 3.49Å; H1942-D1945 PolarHBondContact O-N 3.46Å; H1942-R1946 WeakPolarHBondContact O-CG 3.26Å; H1942-R1946 PolarHBondContact O-N 3.27Å
1943	E	90.3	Very high	91.8	Very high	53 Å²	53	67.9 Å²	67.9	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-41.7	169.1	-73	161.1	93.1	0	0	111	H1936 P1939 S1940 D1945 R1946 L1947	H1936-E1943 IonicContact CE1-OE1 2.79Å; H1936-E1943 IonicContact CE1-OE2 3.5Å; H1936-E1943 IonicContact ND1-OE1 3.88Å; H1936-E1943 PolarHBondContact ND1-OE1 3.42Å; H1936-E1943 IonicContact ND1-OE2 2.83Å; P1939-E1943 HydrophobicContact CB-CB 3.63Å; P1939-E1943 HydrophobicContact CB-CG 4.5Å; S1940-E1943 WeakPolarHBondContact CB-OE2 3.15Å; S1940-E1943 PolarHBondContact N-OE2 2.97Å; S1940-E1943 PolarHBondContact O-N 2.93Å; S1940-E1943 WeakPolarHBondContact OG-CG 3.43Å; S1940-E1943 PolarHBondContact OG-N 3.39Å; S1940-E1943 VanDerWaalsContact OG-N 3.16Å; S1940-E1943 PolarHBondContact OG-OE2 3.42Å; E1943-D1945 VanDerWaalsContact C-N 3.32Å; E1943-D1945 PolarHBondContact O-N 3.19Å; E1943-R1946 PolarHBondContact O-N 3.18Å; E1943-L1947 WeakPolarHBondContact O-CB 3.46Å; E1943-L1947 WeakPolarHBondContact O-CD1 3.49Å; E1943-L1947 PolarHBondContact O-N 2.94Å
1944	C	93.1	Very high	91.7	Very high	3 Å²	3	71.2 Å²	71.2	2%	0.02	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-33.7	176.4	-69.5	0	0	0	0	113.1	S1940 V1941 G1948 R1955 V1958	S1940-C1944 WeakPolarHBondContact O-CB 3.31Å; S1940-C1944 PolarHBondContact O-N 3.5Å; S1940-C1944 PolarHBondContact O-SG 2.84Å; V1941-C1944 WeakPolarHBondContact O-CB 3.36Å; V1941-C1944 PolarHBondContact O-N 3.28Å; C1944-G1948 PolarHBondContact O-N 3.38Å; C1944-R1955 HydrophobicContact CB-CG 3.83Å; C1944-V1958 HydrophobicContact CB-CG1 4.47Å
1945	D	93.9	Very high	91.9	Very high	56 Å²	56	70.1 Å²	70.1	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-66.4	-52.9	171.5	-89.9	-54.5	0	0	0	110	V1941 H1942 E1943 L1947 G1948 E1949 R1955	V1941-D1945 PolarHBondContact O-N 3.04Å; H1942-D1945 PolarHBondContact O-N 3.46Å; E1943-D1945 VanDerWaalsContact C-N 3.32Å; E1943-D1945 PolarHBondContact O-N 3.19Å; D1945-L1947 PolarHBondContact O-N 3.2Å; D1945-G1948 WeakPolarHBondContact O-CA 3.48Å; D1945-G1948 PolarHBondContact O-N 3.38Å; D1945-E1949 PolarHBondContact O-N 3.28Å; D1945-R1955 WeakPolarHBondContact OD1-CB 3.32Å; D1945-R1955 WeakPolarHBondContact OD1-CD 3.12Å; D1945-R1955 IonicContact OD1-NH1 3.58Å; D1945-R1955 WeakPolarHBondContact OD2-CD 3.18Å; D1945-R1955 IonicContact OD2-CZ 3.19Å; D1945-R1955 IonicContact OD2-NE 2.86Å; D1945-R1955 IonicContact OD2-NH1 3.17Å; D1945-R1955 PolarHBondContact OD2-NH1 3.45Å
1946	R	92.5	Very high	92.2	Very high	120 Å²	120	68.4 Å²	68.4	45%	0.453	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-38.7	179.9	-72.2	-168.1	-75.5	-167	0.2	114	N1742 H1942 E1943 G1948 M1950	N1742-R1946 PolarHBondContact OD1-NH1 3.03Å; H1942-R1946 WeakPolarHBondContact O-CG 3.26Å; H1942-R1946 PolarHBondContact O-N 3.27Å; E1943-R1946 PolarHBondContact O-N 3.18Å; R1946-G1948 VanDerWaalsContact C-N 3.3Å; R1946-G1948 PolarHBondContact O-N 3.42Å; R1946-M1950 WeakPolarHBondContact O-CB 3.19Å; R1946-M1950 PolarHBondContact O-N 3.35Å
1947	L	93.4	Very high	92.6	Very high	14 Å²	14	66.6 Å²	66.6	7%	0.073	34%	0.342	C	S	.	.	H	α-helix	trans	-61.1	-42.3	170.4	-97.9	75.7	0	0	0	111.2	M1929 I1932 E1943 D1945 M1950 I1951 V1958 F1962	M1929-L1947 HydrophobicContact CG-CD2 4.42Å; I1932-L1947 HydrophobicContact CB-CD2 4.26Å; I1932-L1947 HydrophobicContact CD1-CD1 3.93Å; I1932-L1947 HydrophobicContact CD1-CD2 3.76Å; I1932-L1947 HydrophobicContact CD1-CG 3.74Å; I1932-L1947 HydrophobicContact CG2-CD1 4.21Å; I1932-L1947 HydrophobicContact CG2-CD2 4Å; E1943-L1947 WeakPolarHBondContact O-CB 3.46Å; E1943-L1947 WeakPolarHBondContact O-CD1 3.49Å; E1943-L1947 PolarHBondContact O-N 2.94Å; D1945-L1947 PolarHBondContact O-N 3.2Å; L1947-M1950 HydrophobicContact CD1-CE 4.36Å; L1947-M1950 HydrophobicContact CG-CE 3.92Å; L1947-M1950 PolarHBondContact O-N 2.82Å; L1947-I1951 VanDerWaalsContact O-CG1 3.22Å; L1947-I1951 WeakPolarHBondContact O-CG1 3.46Å; L1947-I1951 PolarHBondContact O-N 3.06Å; L1947-V1958 HydrophobicContact CB-CG1 3.89Å; L1947-V1958 HydrophobicContact CD2-CG1 4.01Å; L1947-F1962 HydrophobicContact CD2-CE2 3.56Å; L1947-F1962 HydrophobicContact CD2-CZ 3.77Å
1948	G	94.6	Very high	92.7	Very high	4 Å²	4	62.2 Å²	62.2	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-45.3	-179	0	0	0	0	0	112.5	C1944 D1945 R1946 G1952 L1953	C1944-G1948 PolarHBondContact O-N 3.38Å; D1945-G1948 WeakPolarHBondContact O-CA 3.48Å; D1945-G1948 PolarHBondContact O-N 3.38Å; R1946-G1948 VanDerWaalsContact C-N 3.3Å; R1946-G1948 PolarHBondContact O-N 3.42Å; G1948-G1952 PolarHBondContact O-N 3.26Å; G1948-L1953 CarbonylContact C-O 3.57Å; G1948-L1953 WeakPolarHBondContact CA-O 3.44Å; G1948-L1953 PolarHBondContact O-N 2.62Å
1949	E	93.6	Very high	92.8	Very high	146 Å²	146	61 Å²	61	68%	0.682	31%	0.311	S	S	*	.	H	α-helix	trans	-65.3	-46.5	175	-65.7	-174.8	141.9	0	0	111.4	D1945 I1951 G1952	D1945-E1949 PolarHBondContact O-N 3.28Å; E1949-I1951 VanDerWaalsContact C-N 3.33Å; E1949-I1951 PolarHBondContact O-N 3.09Å; E1949-G1952 PolarHBondContact O-N 2.78Å
1950	M	90.3	Very high	93.1	Very high	70 Å²	70	62.8 Å²	62.8	35%	0.345	32%	0.322	S	S	.	.	H	α-helix	trans	-54.9	-42	175.9	167.1	174.8	53.2	0	0	113.7	V1746 I1932 R1946 L1947	V1746-M1950 HydrophobicContact CB-CG 4.42Å; V1746-M1950 HydrophobicContact CB-SD 4.32Å; V1746-M1950 HydrophobicContact CG1-CB 4.26Å; V1746-M1950 HydrophobicContact CG1-CG 3.72Å; V1746-M1950 HydrophobicContact CG1-SD 3.76Å; V1746-M1950 HydrophobicContact CG2-SD 4Å; I1932-M1950 HydrophobicContact CD1-CE 3.66Å; R1946-M1950 WeakPolarHBondContact O-CB 3.19Å; R1946-M1950 PolarHBondContact O-N 3.35Å; L1947-M1950 HydrophobicContact CD1-CE 4.36Å; L1947-M1950 HydrophobicContact CG-CE 3.92Å; L1947-M1950 PolarHBondContact O-N 2.82Å
1951	I	93.5	Very high	93.3	Very high	17 Å²	17	61.7 Å²	61.7	9%	0.087	31%	0.31	C	S	.	.	H	α-helix	trans	-104.7	4.3	-171.2	79.1	-165.7	0	0	0	113.7	Q1925 C1928 M1929 L1947 E1949 L1953 V1958	Q1925-I1951 HydrophobicContact CG-CB 4.14Å; Q1925-I1951 HydrophobicContact CG-CG1 4.4Å; Q1925-I1951 WeakPolarHBondContact CG-O 3.32Å; Q1925-I1951 PolarHBondContact NE2-O 2.83Å; C1928-I1951 HydrophobicContact CB-CG2 3.92Å; M1929-I1951 HydrophobicContact CE-CD1 4.14Å; M1929-I1951 HydrophobicContact CG-CD1 3.51Å; M1929-I1951 HydrophobicContact SD-CD1 3.66Å; L1947-I1951 VanDerWaalsContact O-CG1 3.22Å; L1947-I1951 WeakPolarHBondContact O-CG1 3.46Å; L1947-I1951 PolarHBondContact O-N 3.06Å; E1949-I1951 VanDerWaalsContact C-N 3.33Å; E1949-I1951 PolarHBondContact O-N 3.09Å; I1951-L1953 HydrophobicContact CD1-CB 4.41Å; I1951-L1953 HydrophobicContact CD1-CD1 3.89Å; I1951-L1953 HydrophobicContact CD1-CG 4.4Å; I1951-L1953 HydrophobicContact CG1-CB 3.97Å; I1951-L1953 HydrophobicContact CG1-CD1 3.98Å; I1951-L1953 HydrophobicContact CG1-CG 3.96Å; I1951-V1958 HydrophobicContact CD1-CG2 4.04Å
1952	G	92.8	Very high	93.5	Very high	64 Å²	64	58.8 Å²	58.8	66%	0.66	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	35.4	-179.2	0	0	0	0	0	114.2	G1948 E1949	G1948-G1952 PolarHBondContact O-N 3.26Å; E1949-G1952 PolarHBondContact O-N 2.78Å
1953	L	94.2	Very high	93.6	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.099	28%	0.283	C	S	.	.			trans	-126.3	139.3	176.6	-68.4	178.8	0	0	0	110.5	I1921 Q1925 M1929 G1948 I1951 R1955 V1957 V1958	I1921-L1953 HydrophobicContact CD1-CD1 4.49Å; I1921-L1953 HydrophobicContact CG1-CD1 4.09Å; I1921-L1953 HydrophobicContact CG2-CD1 4.12Å; Q1925-L1953 HydrophobicContact CB-CD1 4.15Å; Q1925-L1953 HydrophobicContact CG-CD1 4.28Å; Q1925-L1953 HydrophobicContact CG-CG 4.46Å; M1929-L1953 HydrophobicContact CE-CD1 3.95Å; M1929-L1953 HydrophobicContact SD-CD1 4.49Å; G1948-L1953 CarbonylContact C-O 3.57Å; G1948-L1953 WeakPolarHBondContact CA-O 3.44Å; G1948-L1953 PolarHBondContact O-N 2.62Å; I1951-L1953 HydrophobicContact CD1-CB 4.41Å; I1951-L1953 HydrophobicContact CD1-CD1 3.89Å; I1951-L1953 HydrophobicContact CD1-CG 4.4Å; I1951-L1953 HydrophobicContact CG1-CB 3.97Å; I1951-L1953 HydrophobicContact CG1-CD1 3.98Å; I1951-L1953 HydrophobicContact CG1-CG 3.96Å; L1953-R1955 PolarHBondContact O-N 2.88Å; L1953-V1957 HydrophobicContact CB-CB 4.47Å; L1953-V1957 HydrophobicContact CB-CG1 4.39Å; L1953-V1957 HydrophobicContact CD1-CG1 4.11Å; L1953-V1957 HydrophobicContact CD2-CG1 4.33Å; L1953-V1958 HydrophobicContact CB-CG2 4.13Å
1954	S	92.9	Very high	93.8	Very high	76 Å²	76	59 Å²	59	53%	0.531	30%	0.297	S	S	.	.			trans	-58.4	143.6	175.1	72.5	0	0	0	0	111.3	R1956 V1957 V1958	S1954-R1956 PolarHBondContact O-N 2.98Å; S1954-V1957 WeakPolarHBondContact O-CA 3.32Å; S1954-V1957 WeakPolarHBondContact O-CB 3.3Å; S1954-V1957 PolarHBondContact O-N 2.75Å; S1954-V1957 WeakPolarHBondContact OG-CG2 3.35Å; S1954-V1957 PolarHBondContact OG-N 3.44Å; S1954-V1958 PolarHBondContact O-N 2.65Å
1955	R	93.5	Very high	93.9	Very high	102 Å²	102	60.6 Å²	60.6	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-43.1	-41.2	173.5	-178.6	-174.1	95.9	-159.6	3	113.1	C1944 D1945 L1953 V1957 V1958 Q1959	C1944-R1955 HydrophobicContact CB-CG 3.83Å; D1945-R1955 WeakPolarHBondContact OD1-CB 3.32Å; D1945-R1955 WeakPolarHBondContact OD1-CD 3.12Å; D1945-R1955 IonicContact OD1-NH1 3.58Å; D1945-R1955 WeakPolarHBondContact OD2-CD 3.18Å; D1945-R1955 IonicContact OD2-CZ 3.19Å; D1945-R1955 IonicContact OD2-NE 2.86Å; D1945-R1955 IonicContact OD2-NH1 3.17Å; D1945-R1955 PolarHBondContact OD2-NH1 3.45Å; L1953-R1955 PolarHBondContact O-N 2.88Å; R1955-V1957 VanDerWaalsContact C-N 3.3Å; R1955-V1957 PolarHBondContact O-N 3.49Å; R1955-V1958 PolarHBondContact O-N 2.66Å; R1955-Q1959 WeakPolarHBondContact O-CB 3.01Å; R1955-Q1959 PolarHBondContact O-N 3.08Å
1956	R	93.7	Very high	93.9	Very high	184 Å²	184	61.3 Å²	61.3	69%	0.694	30%	0.302	S	S	*	.	H	α-helix	trans	-63.1	-36	-179.7	-169.8	175.8	-174.4	82.6	8.2	112.3	S1954 V1960	S1954-R1956 PolarHBondContact O-N 2.98Å; R1956-V1960 HydrophobicContact CG-CG2 4.44Å; R1956-V1960 WeakPolarHBondContact O-CB 2.98Å; R1956-V1960 WeakPolarHBondContact O-CG2 3.27Å; R1956-V1960 PolarHBondContact O-N 3.16Å
1957	V	94.3	Very high	93.7	Very high	26 Å²	26	57.8 Å²	57.8	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-44.4	174.5	173.5	0	0	0	0	110.4	T1919 I1921 L1953 S1954 R1955 V1960 W1961	T1919-V1957 HydrophobicContact CG2-CG2 4.32Å; I1921-V1957 HydrophobicContact CD1-CG1 3.95Å; I1921-V1957 HydrophobicContact CG1-CG1 4.31Å; L1953-V1957 HydrophobicContact CB-CB 4.47Å; L1953-V1957 HydrophobicContact CB-CG1 4.39Å; L1953-V1957 HydrophobicContact CD1-CG1 4.11Å; L1953-V1957 HydrophobicContact CD2-CG1 4.33Å; S1954-V1957 WeakPolarHBondContact O-CA 3.32Å; S1954-V1957 WeakPolarHBondContact O-CB 3.3Å; S1954-V1957 PolarHBondContact O-N 2.75Å; S1954-V1957 WeakPolarHBondContact OG-CG2 3.35Å; S1954-V1957 PolarHBondContact OG-N 3.44Å; R1955-V1957 VanDerWaalsContact C-N 3.3Å; R1955-V1957 PolarHBondContact O-N 3.49Å; V1957-V1960 PolarHBondContact O-N 3.22Å; V1957-W1961 WeakPolarHBondContact O-CB 3.46Å; V1957-W1961 PolarHBondContact O-N 3.48Å
1958	V	94.8	Very high	93.5	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-52.2	175.8	-178.5	0	0	0	0	111.2	M1929 C1944 L1947 I1951 L1953 S1954 R1955 V1960 W1961 F1962	M1929-V1958 HydrophobicContact SD-CG1 4.3Å; M1929-V1958 HydrophobicContact SD-CG2 4.33Å; C1944-V1958 HydrophobicContact CB-CG1 4.47Å; L1947-V1958 HydrophobicContact CB-CG1 3.89Å; L1947-V1958 HydrophobicContact CD2-CG1 4.01Å; I1951-V1958 HydrophobicContact CD1-CG2 4.04Å; L1953-V1958 HydrophobicContact CB-CG2 4.13Å; S1954-V1958 PolarHBondContact O-N 2.65Å; R1955-V1958 PolarHBondContact O-N 2.66Å; V1958-V1960 VanDerWaalsContact C-N 3.29Å; V1958-V1960 PolarHBondContact O-N 3.27Å; V1958-W1961 WeakPolarHBondContact O-CA 2.96Å; V1958-W1961 WeakPolarHBondContact O-CB 3.44Å; V1958-W1961 PolarHBondContact O-N 3.01Å; V1958-F1962 HydrophobicContact CG1-CD2 3.82Å; V1958-F1962 HydrophobicContact CG1-CE2 3.88Å; V1958-F1962 WeakPolarHBondContact O-CD2 3.41Å; V1958-F1962 PolarHBondContact O-N 3.27Å
1959	Q	94.7	Very high	93.2	Very high	55 Å²	55	65.1 Å²	65.1	26%	0.257	33%	0.33	S	S	.	.	H	α-helix	trans	-57.8	-40.5	178.7	-169.8	178.6	30.9	0	0	111.9	R1955 Q1963	R1955-Q1959 WeakPolarHBondContact O-CB 3.01Å; R1955-Q1959 PolarHBondContact O-N 3.08Å; Q1959-Q1963 WeakPolarHBondContact O-CB 3.42Å; Q1959-Q1963 VanDerWaalsContact O-CG 3.25Å; Q1959-Q1963 WeakPolarHBondContact O-CG 3.49Å; Q1959-Q1963 PolarHBondContact O-N 3.37Å
1960	V	94.2	Very high	92.7	Very high	53 Å²	53	65.6 Å²	65.6	32%	0.321	33%	0.33	S	S	.	.	H	α-helix	trans	-71.8	-33.5	174.2	167.2	0	0	0	0	112	R1956 V1957 V1958 N1964	R1956-V1960 HydrophobicContact CG-CG2 4.44Å; R1956-V1960 WeakPolarHBondContact O-CB 2.98Å; R1956-V1960 WeakPolarHBondContact O-CG2 3.27Å; R1956-V1960 PolarHBondContact O-N 3.16Å; V1957-V1960 PolarHBondContact O-N 3.22Å; V1958-V1960 VanDerWaalsContact C-N 3.29Å; V1958-V1960 PolarHBondContact O-N 3.27Å; V1960-N1964 WeakPolarHBondContact CG1-ND2 3.44Å; V1960-N1964 VanDerWaalsContact O-CB 3.25Å; V1960-N1964 WeakPolarHBondContact O-CB 3.21Å; V1960-N1964 PolarHBondContact O-N 3.29Å; V1960-N1964 PolarHBondContact O-ND2 2.81Å
1961	W	95.8	Very high	92	Very high	31 Å²	31	69.5 Å²	69.5	12%	0.117	35%	0.345	C	S	.	.	H	α-helix	trans	-63.5	-49.5	173.2	-173.4	100.4	0	0	0	110.6	M1929 H1930 Y1933 V1957 V1958 Q1963 N1964 Q1965	M1929-W1961 HydrophobicContact CB-CD2 3.99Å; M1929-W1961 HydrophobicContact CB-CE3 3.77Å; M1929-W1961 HydrophobicContact CB-CH2 3.73Å; M1929-W1961 HydrophobicContact CB-CZ2 3.91Å; M1929-W1961 HydrophobicContact CB-CZ3 3.65Å; M1929-W1961 HydrophobicContact CE-CB 4.45Å; M1929-W1961 HydrophobicContact CE-CD2 4.01Å; M1929-W1961 HydrophobicContact CE-CG 3.81Å; M1929-W1961 HydrophobicContact CG-CE3 4.44Å; M1929-W1961 HydrophobicContact SD-CB 3.98Å; M1929-W1961 HydrophobicContact SD-CD2 3.8Å; M1929-W1961 HydrophobicContact SD-CE3 4.12Å; M1929-W1961 HydrophobicContact SD-CG 3.74Å; H1930-W1961 HydrophobicContact CB-CH2 4.46Å; H1930-W1961 AromaticContact CD2-CZ2 3.71Å; H1930-W1961 AromaticContact CE1-CH2 3.87Å; H1930-W1961 AromaticContact CE1-CZ2 3.78Å; H1930-W1961 AromaticContact CG-CH2 3.84Å; H1930-W1961 AromaticContact CG-CZ2 3.96Å; H1930-W1961 AromaticContact ND1-CH2 3.72Å; H1930-W1961 AromaticContact NE2-CZ2 3.59Å; Y1933-W1961 AromaticContact CD2-CZ3 3.93Å; Y1933-W1961 HydrophobicContact CD2-CZ3 3.93Å; Y1933-W1961 HydrophobicContact CG-CZ3 4.27Å; V1957-W1961 WeakPolarHBondContact O-CB 3.46Å; V1957-W1961 PolarHBondContact O-N 3.48Å; V1958-W1961 WeakPolarHBondContact O-CA 2.96Å; V1958-W1961 WeakPolarHBondContact O-CB 3.44Å; V1958-W1961 PolarHBondContact O-N 3.01Å; W1961-Q1963 PolarHBondContact O-N 2.97Å; W1961-N1964 CarbonylContact O-C 3.48Å; W1961-N1964 PolarHBondContact O-N 3.3Å; W1961-Q1965 HydrophobicContact CE3-CB 4.22Å; W1961-Q1965 HydrophobicContact CH2-CB 4.31Å; W1961-Q1965 HydrophobicContact CH2-CG 4.02Å; W1961-Q1965 HydrophobicContact CZ3-CB 4.04Å; W1961-Q1965 HydrophobicContact CZ3-CG 4.11Å; W1961-Q1965 WeakPolarHBondContact O-CB 3.27Å; W1961-Q1965 PolarHBondContact O-N 3.11Å
1962	F	96.7	Very high	91.2	Very high	2 Å²	2	73.8 Å²	73.8	1%	0.009	37%	0.366	C	S	.	.	H	α-helix	trans	-63.7	-38.4	176.8	-86.1	-97.3	0	0	0	112.4	M1929 I1932 Y1933 P1939 L1947 V1958 Q1965 R1966	M1929-F1962 HydrophobicContact CB-CE2 4.17Å; M1929-F1962 HydrophobicContact CG-CE2 4.19Å; I1932-F1962 HydrophobicContact CB-CZ 4.34Å; I1932-F1962 HydrophobicContact CG2-CZ 4.07Å; Y1933-F1962 AromaticContact CD2-CD1 3.57Å; Y1933-F1962 HydrophobicContact CD2-CD1 3.57Å; Y1933-F1962 AromaticContact CD2-CE1 3.74Å; Y1933-F1962 HydrophobicContact CD2-CE1 3.74Å; Y1933-F1962 HydrophobicContact CD2-CG 4.43Å; Y1933-F1962 HydrophobicContact CE2-CD1 4.24Å; Y1933-F1962 HydrophobicContact CG-CE1 4.31Å; P1939-F1962 HydrophobicContact CG-CB 4.44Å; P1939-F1962 HydrophobicContact CG-CD1 3.42Å; P1939-F1962 VanDerWaalsContact CG-CD1 3.42Å; P1939-F1962 HydrophobicContact CG-CD2 4.14Å; P1939-F1962 HydrophobicContact CG-CE1 3.54Å; P1939-F1962 HydrophobicContact CG-CE2 4.27Å; P1939-F1962 HydrophobicContact CG-CG 3.74Å; P1939-F1962 HydrophobicContact CG-CZ 3.99Å; L1947-F1962 HydrophobicContact CD2-CE2 3.56Å; L1947-F1962 HydrophobicContact CD2-CZ 3.77Å; V1958-F1962 HydrophobicContact CG1-CD2 3.82Å; V1958-F1962 HydrophobicContact CG1-CE2 3.88Å; V1958-F1962 WeakPolarHBondContact O-CD2 3.41Å; V1958-F1962 PolarHBondContact O-N 3.27Å; F1962-Q1965 PolarHBondContact O-N 2.96Å; F1962-R1966 WeakPolarHBondContact O-CG 3.44Å; F1962-R1966 PolarHBondContact O-N 3.43Å
1963	Q	93	Very high	90.1	Very high	97 Å²	97	73.1 Å²	73.1	45%	0.453	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-45.4	171.1	-76.9	174.4	-3.4	0	0	112.3	Q1959 W1961 Q1965 A1967	Q1959-Q1963 WeakPolarHBondContact O-CB 3.42Å; Q1959-Q1963 VanDerWaalsContact O-CG 3.25Å; Q1959-Q1963 WeakPolarHBondContact O-CG 3.49Å; Q1959-Q1963 PolarHBondContact O-N 3.37Å; W1961-Q1963 PolarHBondContact O-N 2.97Å; Q1963-Q1965 VanDerWaalsContact C-N 3.34Å; Q1963-A1967 VanDerWaalsContact O-CB 3.32Å; Q1963-A1967 WeakPolarHBondContact O-CB 3.35Å; Q1963-A1967 PolarHBondContact O-N 3.48Å
1964	N	94.5	Very high	88.8	Confident	101 Å²	101	81.9 Å²	81.9	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-36.2	177.6	-75.6	-33	0	0	0	112.1	V1960 W1961 A1967 K1968	V1960-N1964 WeakPolarHBondContact CG1-ND2 3.44Å; V1960-N1964 VanDerWaalsContact O-CB 3.25Å; V1960-N1964 WeakPolarHBondContact O-CB 3.21Å; V1960-N1964 PolarHBondContact O-N 3.29Å; V1960-N1964 PolarHBondContact O-ND2 2.81Å; W1961-N1964 CarbonylContact O-C 3.48Å; W1961-N1964 PolarHBondContact O-N 3.3Å; N1964-A1967 CarbonylContact O-C 3.53Å; N1964-A1967 PolarHBondContact O-N 3.09Å; N1964-K1968 WeakPolarHBondContact O-CB 3.24Å; N1964-K1968 PolarHBondContact O-N 2.98Å
1965	Q	94.3	Very high	87.2	Confident	35 Å²	35	82.7 Å²	82.7	16%	0.164	39%	0.387	C	S	.	.	H	α-helix	trans	-72.8	-41.2	179.6	-173.8	59.8	12.5	0	0	111	Y1933 W1961 F1962 Q1963 A1967 K1968 E1969	Y1933-Q1965 HydrophobicContact CD1-CG 4.1Å; Y1933-Q1965 HydrophobicContact CD2-CB 4.04Å; Y1933-Q1965 HydrophobicContact CD2-CG 3.66Å; Y1933-Q1965 HydrophobicContact CE1-CG 3.92Å; Y1933-Q1965 HydrophobicContact CE2-CB 3.69Å; Y1933-Q1965 HydrophobicContact CE2-CG 3.46Å; Y1933-Q1965 VanDerWaalsContact CE2-CG 3.46Å; Y1933-Q1965 HydrophobicContact CG-CG 4Å; W1961-Q1965 HydrophobicContact CE3-CB 4.22Å; W1961-Q1965 HydrophobicContact CH2-CB 4.31Å; W1961-Q1965 HydrophobicContact CH2-CG 4.02Å; W1961-Q1965 HydrophobicContact CZ3-CB 4.04Å; W1961-Q1965 HydrophobicContact CZ3-CG 4.11Å; W1961-Q1965 WeakPolarHBondContact O-CB 3.27Å; W1961-Q1965 PolarHBondContact O-N 3.11Å; F1962-Q1965 PolarHBondContact O-N 2.96Å; Q1963-Q1965 VanDerWaalsContact C-N 3.34Å; Q1965-A1967 VanDerWaalsContact C-N 3.29Å; Q1965-A1967 PolarHBondContact O-N 3.23Å; Q1965-K1968 WeakPolarHBondContact O-CB 3.41Å; Q1965-K1968 PolarHBondContact O-N 3.39Å; Q1965-K1968 VanDerWaalsContact O-N 3.11Å; Q1965-E1969 WeakPolarHBondContact O-CB 3.49Å; Q1965-E1969 PolarHBondContact O-N 3.03Å
1966	R	95.4	Very high	85.3	Confident	71 Å²	71	80.3 Å²	80.3	27%	0.268	39%	0.386	S	S	.	.	H	α-helix	trans	-59.9	-37.8	167.1	-71.9	-167.3	-61.8	-87.1	8	112.4	Y1933 K1937 F1962 K1970	Y1933-R1966 HydrophobicContact CE2-CG 3.88Å; Y1933-R1966 VanDerWaalsContact OH-CA 3.24Å; Y1933-R1966 WeakPolarHBondContact OH-CA 3.28Å; Y1933-R1966 VanDerWaalsContact OH-CG 3.29Å; Y1933-R1966 WeakPolarHBondContact OH-CG 3.19Å; Y1933-R1966 PolarHBondContact OH-N 2.91Å; K1937-R1966 WeakPolarHBondContact O-CD 3.44Å; K1937-R1966 PolarHBondContact O-NH1 3.42Å; F1962-R1966 WeakPolarHBondContact O-CG 3.44Å; F1962-R1966 PolarHBondContact O-N 3.43Å; R1966-K1970 WeakPolarHBondContact O-CB 3.3Å; R1966-K1970 WeakPolarHBondContact O-CG 3.2Å; R1966-K1970 PolarHBondContact O-N 2.87Å
1967	A	88.1	Confident	83	Confident	47 Å²	47	75.3 Å²	75.3	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-72.5	-26	175.3	0	0	0	0	0	113.4	Q1963 N1964 Q1965 K1971	Q1963-A1967 VanDerWaalsContact O-CB 3.32Å; Q1963-A1967 WeakPolarHBondContact O-CB 3.35Å; Q1963-A1967 PolarHBondContact O-N 3.48Å; N1964-A1967 CarbonylContact O-C 3.53Å; N1964-A1967 PolarHBondContact O-N 3.09Å; Q1965-A1967 VanDerWaalsContact C-N 3.29Å; Q1965-A1967 PolarHBondContact O-N 3.23Å; A1967-K1971 VanDerWaalsContact O-CG 3.26Å; A1967-K1971 WeakPolarHBondContact O-CG 3.12Å; A1967-K1971 PolarHBondContact O-N 3.47Å
1968	K	89.3	Confident	80.2	Confident	101 Å²	101	76.7 Å²	76.7	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-74	-47.5	172.5	-172	-170.1	177.4	-170.6	0	110.2	N1964 Q1965 K1971 M1972	N1964-K1968 WeakPolarHBondContact O-CB 3.24Å; N1964-K1968 PolarHBondContact O-N 2.98Å; Q1965-K1968 WeakPolarHBondContact O-CB 3.41Å; Q1965-K1968 PolarHBondContact O-N 3.39Å; Q1965-K1968 VanDerWaalsContact O-N 3.11Å; K1968-K1971 WeakPolarHBondContact O-CB 3.38Å; K1968-K1971 PolarHBondContact O-N 3.17Å; K1968-M1972 HydrophobicContact CD-SD 4.3Å; K1968-M1972 HydrophobicContact CG-SD 3.93Å; K1968-M1972 WeakPolarHBondContact O-CG 3.32Å; K1968-M1972 PolarHBondContact O-N 2.97Å
1969	E	88.7	Confident	77.5	Confident	71 Å²	71	80.9 Å²	80.9	33%	0.332	42%	0.419	S	S	.	.	H	α-helix	trans	-58.1	-49.5	174.7	-172.3	177.2	174.6	0	0	111.1	Y1933 K1937 Q1965 K1971 M1972 A1973	Y1933-E1969 VanDerWaalsContact CE1-OE2 3.3Å; Y1933-E1969 WeakPolarHBondContact CE1-OE2 3.32Å; Y1933-E1969 VanDerWaalsContact CZ-OE2 3.32Å; Y1933-E1969 PolarHBondContact OH-OE2 3.19Å; K1937-E1969 IonicContact NZ-OE1 3.02Å; K1937-E1969 PolarHBondContact NZ-OE1 3.23Å; K1937-E1969 IonicContact NZ-OE2 3.85Å; Q1965-E1969 WeakPolarHBondContact O-CB 3.49Å; Q1965-E1969 PolarHBondContact O-N 3.03Å; E1969-K1971 PolarHBondContact O-N 3Å; E1969-K1971 VanDerWaalsContact O-N 3.15Å; E1969-M1972 PolarHBondContact O-N 3.01Å; E1969-A1973 WeakPolarHBondContact O-CB 3.42Å; E1969-A1973 PolarHBondContact O-N 3.29Å
1970	K	82.2	Confident	74.4	Confident	155 Å²	155	85.9 Å²	85.9	67%	0.674	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-18.1	174.8	-72.4	-167.9	-178.3	-161.5	0	114.7	R1966 R1974	R1966-K1970 WeakPolarHBondContact O-CB 3.3Å; R1966-K1970 WeakPolarHBondContact O-CG 3.2Å; R1966-K1970 PolarHBondContact O-N 2.87Å; K1970-R1974 WeakPolarHBondContact O-CG 3.22Å
1971	K	76.1	Confident	71.3	Confident	152 Å²	152	90.5 Å²	90.5	66%	0.661	46%	0.459	S	S	*	.	H	α-helix	trans	-84.5	-44.8	171	-79.2	174.6	178.4	-171.3	0	111.7	A1967 K1968 E1969 R1974 V1975	A1967-K1971 VanDerWaalsContact O-CG 3.26Å; A1967-K1971 WeakPolarHBondContact O-CG 3.12Å; A1967-K1971 PolarHBondContact O-N 3.47Å; K1968-K1971 WeakPolarHBondContact O-CB 3.38Å; K1968-K1971 PolarHBondContact O-N 3.17Å; E1969-K1971 PolarHBondContact O-N 3Å; E1969-K1971 VanDerWaalsContact O-N 3.15Å; K1971-R1974 PolarHBondContact O-N 2.98Å; K1971-V1975 PolarHBondContact O-N 3.39Å; K1971-V1975 VanDerWaalsContact O-N 3.11Å
1972	M	75.6	Confident	68	Low	107 Å²	107	93.8 Å²	93.8	53%	0.527	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-46.2	175.9	-71.9	169.3	133.2	0	0	110.6	K1968 E1969 R1974 V1975 S1976	K1968-M1972 HydrophobicContact CD-SD 4.3Å; K1968-M1972 HydrophobicContact CG-SD 3.93Å; K1968-M1972 WeakPolarHBondContact O-CG 3.32Å; K1968-M1972 PolarHBondContact O-N 2.97Å; E1969-M1972 PolarHBondContact O-N 3.01Å; M1972-R1974 VanDerWaalsContact C-N 3.29Å; M1972-R1974 PolarHBondContact O-N 3.01Å; M1972-V1975 PolarHBondContact O-N 3.17Å; M1972-S1976 PolarHBondContact O-N 3Å; M1972-S1976 PolarHBondContact O-OG 3.48Å
1973	A	71.2	Confident	64.7	Low	51 Å²	51	96.2 Å²	96.2	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-55.5	-39.7	173.8	0	0	0	0	0	112.9	E1969 S1976 S1977	E1969-A1973 WeakPolarHBondContact O-CB 3.42Å; E1969-A1973 PolarHBondContact O-N 3.29Å; A1973-S1976 PolarHBondContact O-N 2.95Å; A1973-S1977 WeakPolarHBondContact O-CB 3.35Å; A1973-S1977 PolarHBondContact O-N 3.02Å; A1973-S1977 PolarHBondContact O-OG 3.25Å
1974	R	66.1	Low	61.6	Low	202 Å²	202	97.9 Å²	97.9	76%	0.762	51%	0.512	S	S	*	.	H	α-helix	trans	-68.8	-34.6	175.4	-74.4	175.3	-176.2	-163.5	-2.4	113.5	K1970 K1971 M1972 G1978	K1970-R1974 WeakPolarHBondContact O-CG 3.22Å; K1971-R1974 PolarHBondContact O-N 2.98Å; M1972-R1974 VanDerWaalsContact C-N 3.29Å; M1972-R1974 PolarHBondContact O-N 3.01Å; R1974-G1978 PolarHBondContact O-N 3.13Å
1975	V	60.2	Low	58.3	Low	93 Å²	93	100.8 Å²	100.8	56%	0.564	53%	0.528	S	S	*	.	H	α-helix	trans	-67	-46.9	174.2	175.6	0	0	0	0	109.5	K1971 M1972 G1978 Q1979	K1971-V1975 PolarHBondContact O-N 3.39Å; K1971-V1975 VanDerWaalsContact O-N 3.11Å; M1972-V1975 PolarHBondContact O-N 3.17Å; V1975-G1978 CarbonylContact O-C 3.54Å; V1975-G1978 WeakPolarHBondContact O-CA 3.48Å; V1975-G1978 PolarHBondContact O-N 2.63Å; V1975-Q1979 WeakPolarHBondContact O-CG 3.01Å; V1975-Q1979 PolarHBondContact O-N 2.77Å; V1975-Q1979 PolarHBondContact O-OE1 3.43Å
1976	S	51.8	Low	55	Low	52 Å²	52	104 Å²	104	36%	0.364	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-42.4	176.9	-55.6	0	0	0	0	113.1	M1972 A1973 G1978 Q1979 Y1980	M1972-S1976 PolarHBondContact O-N 3Å; M1972-S1976 PolarHBondContact O-OG 3.48Å; A1973-S1976 PolarHBondContact O-N 2.95Å; S1976-G1978 VanDerWaalsContact C-N 3.26Å; S1976-G1978 PolarHBondContact O-N 3.49Å; S1976-Q1979 CarbonylContact O-C 3.56Å; S1976-Q1979 WeakPolarHBondContact O-CA 3.49Å; S1976-Q1979 WeakPolarHBondContact O-CB 3.45Å; S1976-Q1979 PolarHBondContact O-N 2.97Å; S1976-Y1980 WeakPolarHBondContact O-CD2 3.48Å; S1976-Y1980 PolarHBondContact O-N 3.42Å; S1976-Y1980 VanDerWaalsContact O-N 3.15Å
1977	S	46.2	Very low	51.8	Low	79 Å²	79	105.5 Å²	105.5	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-62.4	-34.3	172.4	-63.6	0	0	0	0	112	A1973 Q1979 Y1980	A1973-S1977 WeakPolarHBondContact O-CB 3.35Å; A1973-S1977 PolarHBondContact O-N 3.02Å; A1973-S1977 PolarHBondContact O-OG 3.25Å; S1977-Q1979 PolarHBondContact O-N 3.28Å; S1977-Y1980 PolarHBondContact O-N 3.44Å
1978	G	36	Very low	48.8	Very low	55 Å²	55	111.4 Å²	111.4	57%	0.567	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	2.2	169	0	0	0	0	0	115	R1974 V1975 S1976	R1974-G1978 PolarHBondContact O-N 3.13Å; V1975-G1978 CarbonylContact O-C 3.54Å; V1975-G1978 WeakPolarHBondContact O-CA 3.48Å; V1975-G1978 PolarHBondContact O-N 2.63Å; S1976-G1978 VanDerWaalsContact C-N 3.26Å; S1976-G1978 PolarHBondContact O-N 3.49Å
1979	Q	38.2	Very low	45.7	Very low	89 Å²	89	114 Å²	114	42%	0.416	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	-9.4	171	-65.9	174.3	-77.2	0	0	112.4	V1975 S1976 S1977 N1981 L1982	V1975-Q1979 WeakPolarHBondContact O-CG 3.01Å; V1975-Q1979 PolarHBondContact O-N 2.77Å; V1975-Q1979 PolarHBondContact O-OE1 3.43Å; S1976-Q1979 CarbonylContact O-C 3.56Å; S1976-Q1979 WeakPolarHBondContact O-CA 3.49Å; S1976-Q1979 WeakPolarHBondContact O-CB 3.45Å; S1976-Q1979 PolarHBondContact O-N 2.97Å; S1977-Q1979 PolarHBondContact O-N 3.28Å; Q1979-N1981 VanDerWaalsContact C-N 3.35Å; Q1979-L1982 PolarHBondContact O-N 2.85Å
1980	Y	30	Very low	42.7	Very low	160 Å²	160	116.7 Å²	116.7	63%	0.627	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	3.6	176.6	-77	-63.1	0	0	0	114.7	S1976 S1977 L1982	S1976-Y1980 WeakPolarHBondContact O-CD2 3.48Å; S1976-Y1980 PolarHBondContact O-N 3.42Å; S1976-Y1980 VanDerWaalsContact O-N 3.15Å; S1977-Y1980 PolarHBondContact O-N 3.44Å; Y1980-L1982 VanDerWaalsContact C-N 3.28Å
1981	N	28.6	Very low	40	Very low	150 Å²	150	118.4 Å²	118.4	80%	0.802	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	25.3	157.3	-79.8	13.5	0	0	0	111.8	Q1979	Q1979-N1981 VanDerWaalsContact C-N 3.35Å
1982	L	26.8	Very low	37.6	Very low	100 Å²	100	119.1 Å²	119.1	52%	0.524	65%	0.653	S	S	.	*	S	Bend	trans	-141.2	38	171.2	-148.8	81	0	0	0	112.3	Q1979 Y1980	Q1979-L1982 PolarHBondContact O-N 2.85Å; Y1980-L1982 VanDerWaalsContact C-N 3.28Å
1983	S	27	Very low	35.2	Very low	53 Å²	53	121.7 Å²	121.7	37%	0.371	67%	0.667	S	S	.	*			trans	-144.6	40.9	174.5	73.7	0	0	0	0	113.4
1984	V	27.9	Very low	32.8	Very low	131 Å²	131	124 Å²	124	79%	0.794	68%	0.681	S	S	*	*	S	Bend	trans	-123.4	57.2	166.1	-168.8	0	0	0	0	109.1
1985	N	24.9	Very low	31	Very low	163 Å²	163	120.1 Å²	120.1	87%	0.872	68%	0.682	S	S	*	*	S	Bend	trans	-175.8	50.7	156.5	-94.1	-18.2	0	0	0	109.5
1986	S	25.6	Very low	29.4	Very low	103 Å²	103	123.1 Å²	123.1	72%	0.72	69%	0.693	S	S	*	*			trans	-157.4	47.2	173.1	-69.5	0	0	0	0	110
1987	S	27.6	Very low	28	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	71%	0.711	S	S	*	*			trans	-138.6	24.4	-178.6	-49.9	0	0	0	0	113.1
1988	L	24.6	Very low	26.9	Very low	172 Å²	172	128.5 Å²	128.5	90%	0.901	72%	0.72	S	S	*	*	S	Bend	trans	-93	130.4	150.3	-97.4	160.6	0	0	0	105.7
1989	L	24	Very low	26.3	Very low	156 Å²	156	131.4 Å²	131.4	82%	0.817	73%	0.731	S	S	*	*	S	Bend	trans	64.8	109.3	-153.7	-42.1	175.2	0	0	0	110
1990	T	25.8	Very low	25.9	Very low	126 Å²	126	132.9 Å²	132.9	77%	0.773	75%	0.751	S	S	*	*			cis	-155.5	131.7	18.4	47.9	0	0	0	0	111.3
1991	E	25	Very low	25.6	Very low	192 Å²	192	130.2 Å²	130.2	90%	0.897	76%	0.755	S	S	*	*			trans	-161	85.9	143.8	-137.6	176.3	-137	0	0	113.4
1992	K	26.8	Very low	25.5	Very low	167 Å²	167	130.6 Å²	130.6	73%	0.726	76%	0.755	S	S	*	*			trans	-179.6	101.8	143.2	-106.1	174	-176.2	176	0	110.5
1993	L	24.2	Very low	25.5	Very low	160 Å²	160	132.8 Å²	132.8	84%	0.838	77%	0.767	S	S	*	*			trans	-170.7	111.8	139.5	-105	163.1	0	0	0	108.7
1994	S	21.9	Very low	25.8	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	78%	0.78	S	S	*	*			trans	-68.3	159.9	164.9	48.2	0	0	0	0	110.2
1995	P	28.4	Very low	26.4	Very low	121 Å²	121	133.2 Å²	133.2	79%	0.786	77%	0.768	S	S	*	*			trans	-66.4	145.2	-165	27	-36	0	0	0	113.3
1996	I	26.2	Very low	27.1	Very low	156 Å²	156	130.8 Å²	130.8	80%	0.8	75%	0.75	S	S	*	*			trans	-112.4	121.2	161.6	-64.2	177.3	0	0	0	106.5
1997	D	21.5	Very low	28.9	Very low	138 Å²	138	126.5 Å²	126.5	74%	0.738	72%	0.72	S	S	*	*			trans	-76.3	157.7	176.5	-81.8	-58.3	0	0	0	112.4
1998	S	23.4	Very low	30	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	73%	0.728	S	S	*	*			trans	66.4	110	157.1	59.2	0	0	0	0	120.3
1999	S	24.1	Very low	31.5	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	70%	0.703	S	S	*	*			trans	59.5	100.9	133.9	62.6	0	0	0	0	121.2
2000	S	28.6	Very low	33.6	Very low	120 Å²	120	119.3 Å²	119.3	84%	0.839	67%	0.67	S	S	*	*				-150.3	146.8	109.7	63.4	0	0	0	0	111.5
2001	C	24.3	Very low	34.8	Very low	104 Å²	104	117.1 Å²	117.1	70%	0.703	66%	0.66	S	S	*	*			trans	-66.8	167.5	170.2	51	0	0	0	0	111.1
2002	I	27	Very low	35.9	Very low	159 Å²	159	112.3 Å²	112.3	82%	0.815	64%	0.639	S	S	*	*				-147.2	146.8	75.7	-80.3	154.8	0	0	0	111.7
2003	D	27	Very low	36.6	Very low	145 Å²	145	107 Å²	107	78%	0.775	62%	0.623	S	S	*	*			trans	-63.9	135.7	175.2	-54.5	-98.6	0	0	0	114
2004	S	32.6	Very low	37.7	Very low	91 Å²	91	102.6 Å²	102.6	64%	0.636	60%	0.6	S	S	*	*			trans	-153.4	122.6	149.3	62.2	0	0	0	0	110.5	F2006	S2004-F2006 PolarHBondContact O-N 3.38Å
2005	N	40.7	Very low	38.5	Very low	103 Å²	103	105.4 Å²	105.4	55%	0.551	60%	0.602	S	S	*	*			trans	-76.2	42.9	178.2	-70.9	-46.3	0	0	0	112.1	S2013 I2014	N2005-S2013 CarbonylContact O-C 3.45Å; N2005-S2013 VanDerWaalsContact O-CA 3.24Å; N2005-S2013 WeakPolarHBondContact O-CA 3.46Å; N2005-I2014 PolarHBondContact O-N 2.97Å
2006	F	40	Very low	38.5	Very low	112 Å²	112	108.2 Å²	108.2	49%	0.491	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.2	124.4	-165.3	-131.5	-108.5	0	0	0	111.5	S2004 Q2008 S2011	S2004-F2006 PolarHBondContact O-N 3.38Å; F2006-Q2008 PolarHBondContact O-N 3.09Å; F2006-S2011 VanDerWaalsContact CE1-O 3.28Å; F2006-S2011 WeakPolarHBondContact CE1-O 3.49Å; F2006-S2011 VanDerWaalsContact CZ-O 3.28Å; F2006-S2011 WeakPolarHBondContact CZ-O 3.46Å
2007	C	62.3	Low	38.6	Very low	12 Å²	12	106 Å²	106	8%	0.081	60%	0.6	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.8	114.6	175.1	-179.5	0	0	0	0	110.7	I2009 C2010 S2011 I2012 I2014 H2049 H2055	C2007-I2009 PolarHBondContact O-N 3.05Å; C2007-I2009 VanDerWaalsContact O-N 3.14Å; C2007-C2010 PolarHBondContact O-N 3.08Å; C2007-S2011 WeakPolarHBondContact O-CA 3.4Å; C2007-S2011 PolarHBondContact O-N 3.32Å; C2007-I2012 PolarHBondContact N-O 3.47Å; C2007-I2012 VanDerWaalsContact N-O 3.09Å; C2007-I2014 HydrophobicContact CB-CD1 4.39Å; C2007-H2049 WeakPolarHBondContact CB-NE2 3.42Å; C2007-H2055 PolarHBondContact SG-CE1 3.38Å
2008	Q	52.1	Low	38.8	Very low	187 Å²	187	107.8 Å²	107.8	87%	0.874	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-21.4	-177.6	-69.2	175.1	-29.2	0	0	114.2	F2006	F2006-Q2008 PolarHBondContact O-N 3.09Å
2009	I	56.3	Low	38.9	Very low	73 Å²	73	109 Å²	109	37%	0.374	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	-32.1	-177.4	-49.8	175.1	0	0	0	111.5	C2007 L2050 H2055 K2058	C2007-I2009 PolarHBondContact O-N 3.05Å; C2007-I2009 VanDerWaalsContact O-N 3.14Å; I2009-L2050 HydrophobicContact CD1-CD2 4.15Å; I2009-H2055 WeakPolarHBondContact CB-NE2 3.29Å; I2009-H2055 VanDerWaalsContact CG2-CD2 3.48Å; I2009-H2055 WeakPolarHBondContact CG2-CD2 2.93Å; I2009-K2058 HydrophobicContact CG2-CB 4.39Å; I2009-K2058 HydrophobicContact CG2-CD 4.32Å; I2009-K2058 WeakPolarHBondContact O-CD 3.33Å; I2009-K2058 WeakPolarHBondContact O-CE 3.37Å; I2009-K2058 PolarHBondContact O-NZ 2.67Å
2010	C	67.3	Low	39.1	Very low	18 Å²	18	110.4 Å²	110.4	12%	0.122	61%	0.605	C	S	.	*	T	Hydrogen-bonded Turn	trans	-115.2	-11.8	178.6	60.7	0	0	0	0	115.7	C2007 I2012 H2049 V2054 H2055	C2007-C2010 PolarHBondContact O-N 3.08Å; C2010-I2012 VanDerWaalsContact C-N 3.33Å; C2010-I2012 HydrophobicContact CB-CD1 4.09Å; C2010-I2012 HydrophobicContact CB-CG1 4.13Å; C2010-H2049 PolarHBondContact SG-CE1 3.11Å; C2010-H2049 PolarHBondContact SG-NE2 3.5Å; C2010-V2054 HydrophobicContact CB-CG1 4.48Å; C2010-H2055 WeakPolarHBondContact CB-NE2 3.33Å; C2010-H2055 PolarHBondContact N-NE2 3.35Å; C2010-H2055 PolarHBondContact SG-CE1 3.07Å; C2010-H2055 PolarHBondContact SG-NE2 2.96Å
2011	S	50.9	Low	38.9	Very low	80 Å²	80	110.8 Å²	110.8	56%	0.559	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.3	38.8	-173.7	-56.8	0	0	0	0	113.8	F2006 C2007	F2006-S2011 VanDerWaalsContact CE1-O 3.28Å; F2006-S2011 WeakPolarHBondContact CE1-O 3.49Å; F2006-S2011 VanDerWaalsContact CZ-O 3.28Å; F2006-S2011 WeakPolarHBondContact CZ-O 3.46Å; C2007-S2011 WeakPolarHBondContact O-CA 3.4Å; C2007-S2011 PolarHBondContact O-N 3.32Å
2012	I	48.4	Very low	39.1	Very low	91 Å²	91	113.1 Å²	113.1	47%	0.467	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.7	139.8	177.2	-59.8	175.3	0	0	0	110.1	C2007 C2010	C2007-I2012 PolarHBondContact N-O 3.47Å; C2007-I2012 VanDerWaalsContact N-O 3.09Å; C2010-I2012 VanDerWaalsContact C-N 3.33Å; C2010-I2012 HydrophobicContact CB-CD1 4.09Å; C2010-I2012 HydrophobicContact CB-CG1 4.13Å
2013	S	41.7	Very low	38.9	Very low	55 Å²	55	110.4 Å²	110.4	39%	0.385	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.7	119.4	174.4	179.8	0	0	0	0	111.6	N2005 Q2015	N2005-S2013 CarbonylContact O-C 3.45Å; N2005-S2013 VanDerWaalsContact O-CA 3.24Å; N2005-S2013 WeakPolarHBondContact O-CA 3.46Å; S2013-Q2015 PolarHBondContact O-N 3.17Å
2014	I	46.6	Very low	39.1	Very low	69 Å²	69	109.5 Å²	109.5	35%	0.354	60%	0.598	S	S	.	*			trans	-83.7	88.2	172.2	-53.1	178.6	0	0	0	108.1	N2005 C2007 K2016	N2005-I2014 PolarHBondContact O-N 2.97Å; C2007-I2014 HydrophobicContact CB-CD1 4.39Å; I2014-K2016 PolarHBondContact O-N 2.91Å
2015	Q	38.9	Very low	38.9	Very low	158 Å²	158	111.8 Å²	111.8	74%	0.738	60%	0.602	S	S	*	*			trans	-71.8	128.4	179.6	-71.1	-170.9	-15	0	0	112	S2013	S2013-Q2015 PolarHBondContact O-N 3.17Å
2016	K	29.2	Very low	38.3	Very low	180 Å²	180	111.8 Å²	111.8	78%	0.783	61%	0.606	S	S	*	*			trans	-75.6	132.4	151.2	-71.4	-178.3	177.2	-179.4	0	108.5	I2014	I2014-K2016 PolarHBondContact O-N 2.91Å
2017	S	27.1	Very low	37.7	Very low	111 Å²	111	110.2 Å²	110.2	78%	0.776	60%	0.603	S	S	*	*			trans	-123	83.8	171.2	44.2	0	0	0	0	110.6	I2019	S2017-I2019 PolarHBondContact O-N 3.42Å
2018	E	26.8	Very low	36	Very low	174 Å²	174	115.8 Å²	115.8	81%	0.813	63%	0.627	S	S	*	*			trans	-83.9	101.7	168.8	-75.9	-177	165.1	0	0	110.6
2019	I	26	Very low	34.8	Very low	131 Å²	131	112.6 Å²	112.6	67%	0.672	61%	0.612	S	S	*	*			trans	39.2	103.2	137.6	-50.3	173	0	0	0	116.9	S2017 N2021	S2017-I2019 PolarHBondContact O-N 3.42Å; I2019-N2021 HydrophobicContact CG2-CB 4.13Å; I2019-N2021 WeakPolarHBondContact CG2-ND2 3.31Å; I2019-N2021 WeakPolarHBondContact CG2-OD1 3.4Å
2020	T	27.2	Very low	33.5	Very low	145 Å²	145	112.1 Å²	112.1	89%	0.89	62%	0.619	S	S	*	*			trans	-95.8	113	144.9	52.1	0	0	0	0	108.9
2021	N	25.4	Very low	31.5	Very low	128 Å²	128	115.2 Å²	115.2	68%	0.684	64%	0.638	S	S	*	*			trans	-87.1	165.5	-176.9	-97.2	-26.2	0	0	0	113.6	I2019	I2019-N2021 HydrophobicContact CG2-CB 4.13Å; I2019-N2021 WeakPolarHBondContact CG2-ND2 3.31Å; I2019-N2021 WeakPolarHBondContact CG2-OD1 3.4Å
2022	N	26.6	Very low	30.3	Very low	154 Å²	154	117.6 Å²	117.6	82%	0.824	64%	0.644	S	S	*	*			trans	93.2	133.9	170.7	-52.4	-24.8	0	0	0	115.4
2023	S	24.8	Very low	29.1	Very low	101 Å²	101	115.9 Å²	115.9	71%	0.706	64%	0.644	S	S	*	*			cis	-174.7	174.7	-11.6	46.9	0	0	0	0	109.2
2024	V	30.7	Very low	28.2	Very low	127 Å²	127	115.8 Å²	115.8	77%	0.77	64%	0.643	S	S	*	*			trans	88.3	112.9	174.3	-174.6	0	0	0	0	113.9
2025	L	27.3	Very low	27.1	Very low	138 Å²	138	117.9 Å²	117.9	72%	0.723	65%	0.654	S	S	*	*			cis	-152.6	123.1	-6.3	-145.8	61.4	0	0	0	111.9
2026	T	28.1	Very low	26.4	Very low	103 Å²	103	119.6 Å²	119.6	63%	0.632	66%	0.662	S	S	*	*			trans	55.8	141.6	137.2	62	0	0	0	0	121.9
2027	N	28.7	Very low	26.1	Very low	80 Å²	80	115.6 Å²	115.6	43%	0.428	66%	0.657	S	S	.	*			cis	-167.2	-178.7	-4.3	-113.9	2.7	0	0	0	109.9	V1798 Y1799	V1798-N2027 PolarHBondContact O-ND2 3.28Å; Y1799-N2027 WeakPolarHBondContact O-CB 3.46Å; Y1799-N2027 VanDerWaalsContact O-CG 3.3Å; Y1799-N2027 PolarHBondContact O-ND2 3.05Å
2028	Q	26.8	Very low	25.9	Very low	128 Å²	128	115.9 Å²	115.9	60%	0.598	65%	0.654	S	S	*	*				166.9	82.8	-53.5	-178.4	160.8	-138.6	0	0	111.8	T1800	T1800-Q2028 VanDerWaalsContact C-C 3.46Å; T1800-Q2028 CarbonylContact O-C 3.53Å; T1800-Q2028 VanDerWaalsContact O-C 3.28Å; T1800-Q2028 PolarHBondContact O-N 3.21Å
2029	Q	25.9	Very low	26	Very low	121 Å²	121	113.2 Å²	113.2	57%	0.565	65%	0.645	S	S	*	*	B	Isolated β-bridge	trans	72.9	153.8	151.1	-51.8	-178.1	-3.1	0	0	117	T1800 D1801 P1802	T1800-Q2029 CarbonylContact C-O 3.6Å; T1800-Q2029 VanDerWaalsContact C-O 3.23Å; T1800-Q2029 WeakPolarHBondContact CA-O 3.45Å; T1800-Q2029 PolarHBondContact O-N 3.44Å; D1801-Q2029 PolarHBondContact N-O 3Å; D1801-Q2029 PolarHBondContact O-N 2.79Å; P1802-Q2029 HydrophobicContact CB-CG 4.14Å; P1802-Q2029 HydrophobicContact CG-CB 4.04Å; P1802-Q2029 HydrophobicContact CG-CG 3.95Å
2030	A	28.4	Very low	26	Very low	63 Å²	63	115.6 Å²	115.6	52%	0.521	65%	0.651	S	S	.	*			cis	-134.9	142.7	44.6	0	0	0	0	0	113.1	P1802	P1802-A2030 VanDerWaalsContact CD-O 3.28Å; P1802-A2030 WeakPolarHBondContact CD-O 3.2Å
2031	T	25.7	Very low	26.1	Very low	83 Å²	83	114.4 Å²	114.4	51%	0.509	65%	0.649	S	S	.	*				56	135	71.8	70.9	0	0	0	0	113.7	P1802	P1802-T2031 HydrophobicContact CG-CG2 3.66Å; P1802-T2031 VanDerWaalsContact CG-N 3.33Å
2032	N	26.1	Very low	27	Very low	130 Å²	130	111.5 Å²	111.5	70%	0.695	64%	0.639	S	S	*	*				-161.1	148.8	51.7	-82.4	-63.9	0	0	0	113.7	H1806	H1806-N2032 PolarHBondContact CE1-O 2.82Å; H1806-N2032 PolarHBondContact ND1-O 3.01Å
2033	A	24.3	Very low	27.4	Very low	55 Å²	55	110.2 Å²	110.2	46%	0.455	63%	0.627	S	S	.	*				143.9	133.6	122.8	0	0	0	0	0	117.8	C1807	C1807-A2033 WeakPolarHBondContact CA-O 3.5Å; C1807-A2033 PolarHBondContact SG-O 3Å
2034	C	21.4	Very low	28.1	Very low	53 Å²	53	107.7 Å²	107.7	36%	0.358	61%	0.613	S	S	.	*			trans	67.2	130.6	153.2	-148.4	0	0	0	0	121.9	Q1808	Q1808-C2034 PolarHBondContact O-SG 3.29Å
2035	N	24.3	Very low	28.8	Very low	112 Å²	112	104.8 Å²	104.8	60%	0.599	60%	0.598	S	S	*	*			trans	68	96.5	164.7	-66.1	-35.4	0	0	0	120.1	Q1808	Q1808-N2035 PolarHBondContact O-ND2 3.43Å
2036	Q	23.9	Very low	29.9	Very low	195 Å²	195	103 Å²	103	91%	0.911	58%	0.584	S	S	*	*				-169.3	-176.5	125.3	-110.1	156.7	82.7	0	0	113.7
2037	S	22.3	Very low	31.3	Very low	95 Å²	95	100.4 Å²	100.4	66%	0.664	57%	0.569	S	S	*	*			trans	-59.9	176.8	-177.7	45.7	0	0	0	0	116
2038	T	24.1	Very low	32.7	Very low	118 Å²	118	102.1 Å²	102.1	72%	0.724	58%	0.578	S	S	*	*			trans	82.9	147.2	177.8	75.3	0	0	0	0	115.1
2039	N	28.3	Very low	34.9	Very low	117 Å²	117	97.8 Å²	97.8	63%	0.626	56%	0.557	S	S	*	*			cis	-157	149.5	-18	-109.8	-7.9	0	0	0	110.2	S2041	N2039-S2041 PolarHBondContact O-N 3.4Å
2040	F	26.1	Very low	36.5	Very low	181 Å²	181	93.9 Å²	93.9	79%	0.794	54%	0.54	S	S	*	.			trans	-73.5	113.3	143.4	-98.8	-85.9	0	0	0	106.8	S2042 H2043	F2040-S2042 PolarHBondContact O-N 3.08Å; F2040-H2043 PolarHBondContact O-N 3.01Å
2041	S	29.3	Very low	38	Very low	121 Å²	121	97.4 Å²	97.4	85%	0.846	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	57.1	-173.5	-161.3	0	0	0	0	112.7	N2039	N2039-S2041 PolarHBondContact O-N 3.4Å
2042	S	44.6	Very low	40.1	Very low	66 Å²	66	95.1 Å²	95.1	46%	0.462	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.5	-34.3	179.6	56.4	0	0	0	0	112.4	F2040 S2045 F2046	F2040-S2042 PolarHBondContact O-N 3.08Å; S2042-S2045 PolarHBondContact O-OG 2.87Å; S2042-F2046 WeakPolarHBondContact O-CB 3.4Å; S2042-F2046 PolarHBondContact O-N 3.16Å
2043	H	35.6	Very low	41.6	Very low	127 Å²	127	92.9 Å²	92.9	59%	0.588	53%	0.531	S	S	*	.	H	α-helix	trans	-71	-38	-173.6	-158.1	-7.7	0	0	0	112.7	F2040 V2047	F2040-H2043 PolarHBondContact O-N 3.01Å; H2043-V2047 WeakPolarHBondContact ND1-CG2 2.99Å; H2043-V2047 VanDerWaalsContact O-CB 3.3Å; H2043-V2047 WeakPolarHBondContact O-CB 3.05Å; H2043-V2047 WeakPolarHBondContact O-CG2 2.88Å; H2043-V2047 PolarHBondContact O-N 3.06Å
2044	A	38	Very low	43.2	Very low	48 Å²	48	94.2 Å²	94.2	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-52.1	178	0	0	0	0	0	111.8	F2046 V2047 D2048	A2044-F2046 VanDerWaalsContact C-N 3.31Å; A2044-F2046 PolarHBondContact O-N 3.48Å; A2044-V2047 CarbonylContact O-C 3.6Å; A2044-V2047 PolarHBondContact O-N 2.77Å; A2044-V2047 VanDerWaalsContact O-N 3.09Å; A2044-D2048 PolarHBondContact O-N 3.33Å
2045	S	46.2	Very low	45.5	Very low	67 Å²	67	91.8 Å²	91.8	47%	0.469	52%	0.517	S	S	.	.	H	α-helix	trans	-64.8	-33.1	177.7	50.1	0	0	0	0	113	S2042 H2049	S2042-S2045 PolarHBondContact O-OG 2.87Å; S2045-H2049 WeakPolarHBondContact O-CB 3.39Å; S2045-H2049 PolarHBondContact O-N 3.37Å
2046	F	49.4	Very low	47.5	Very low	99 Å²	99	89.8 Å²	89.8	43%	0.434	51%	0.506	S	S	.	.	H	α-helix	trans	-67.6	-36.6	171.8	-177.6	-113	0	0	0	112.6	S2042 A2044 L2050	S2042-F2046 WeakPolarHBondContact O-CB 3.4Å; S2042-F2046 PolarHBondContact O-N 3.16Å; A2044-F2046 VanDerWaalsContact C-N 3.31Å; A2044-F2046 PolarHBondContact O-N 3.48Å; F2046-L2050 HydrophobicContact CD1-CD1 3.84Å; F2046-L2050 HydrophobicContact CE1-CD1 3.45Å; F2046-L2050 VanDerWaalsContact CE1-CD1 3.45Å; F2046-L2050 HydrophobicContact CE1-CG 4.47Å; F2046-L2050 HydrophobicContact CE2-CD1 4.3Å; F2046-L2050 HydrophobicContact CG-CD1 4.43Å; F2046-L2050 HydrophobicContact CZ-CD1 3.71Å; F2046-L2050 HydrophobicContact CZ-CG 4.39Å; F2046-L2050 WeakPolarHBondContact O-CB 3.34Å; F2046-L2050 WeakPolarHBondContact O-CG 3.24Å; F2046-L2050 PolarHBondContact O-N 2.98Å
2047	V	58.5	Low	49.1	Very low	50 Å²	50	87.7 Å²	87.7	30%	0.303	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-48.5	174.7	163.8	0	0	0	0	111	H2043 A2044 H2049 L2050 F2051	H2043-V2047 WeakPolarHBondContact ND1-CG2 2.99Å; H2043-V2047 VanDerWaalsContact O-CB 3.3Å; H2043-V2047 WeakPolarHBondContact O-CB 3.05Å; H2043-V2047 WeakPolarHBondContact O-CG2 2.88Å; H2043-V2047 PolarHBondContact O-N 3.06Å; A2044-V2047 CarbonylContact O-C 3.6Å; A2044-V2047 PolarHBondContact O-N 2.77Å; A2044-V2047 VanDerWaalsContact O-N 3.09Å; V2047-H2049 PolarHBondContact O-N 2.93Å; V2047-L2050 CarbonylContact O-C 3.58Å; V2047-L2050 PolarHBondContact O-N 3.12Å; V2047-L2050 VanDerWaalsContact O-N 3.1Å; V2047-F2051 HydrophobicContact CG1-CD2 3.77Å; V2047-F2051 HydrophobicContact CG1-CE2 4.14Å; V2047-F2051 WeakPolarHBondContact O-CD2 3.46Å; V2047-F2051 PolarHBondContact O-N 2.84Å
2048	D	58.7	Low	50.7	Low	116 Å²	116	87.7 Å²	87.7	62%	0.62	48%	0.482	S	S	*	.	H	α-helix	trans	-61.1	-32.3	175.1	-66.4	-33.5	0	0	0	111.6	A2044 S2052	A2044-D2048 PolarHBondContact O-N 3.33Å; D2048-S2052 WeakPolarHBondContact O-CB 3.4Å; D2048-S2052 PolarHBondContact O-N 3.32Å
2049	H	71	Confident	52.3	Low	36 Å²	36	85.4 Å²	85.4	17%	0.167	47%	0.465	C	S	.	.	H	α-helix	trans	-68.4	-49.5	171	-172.9	54.6	0	0	0	111.5	C2007 C2010 S2045 V2047 F2051 S2052 H2055	C2007-H2049 WeakPolarHBondContact CB-NE2 3.42Å; C2010-H2049 PolarHBondContact SG-CE1 3.11Å; C2010-H2049 PolarHBondContact SG-NE2 3.5Å; S2045-H2049 WeakPolarHBondContact O-CB 3.39Å; S2045-H2049 PolarHBondContact O-N 3.37Å; V2047-H2049 PolarHBondContact O-N 2.93Å; H2049-F2051 PolarHBondContact O-N 3.46Å; H2049-S2052 WeakPolarHBondContact O-CB 3.18Å; H2049-S2052 PolarHBondContact O-N 2.84Å; H2049-S2052 PolarHBondContact O-OG 3.34Å; H2049-H2055 AromaticContact CD2-CE1 3.64Å; H2049-H2055 AromaticContact CE1-CE1 3.66Å; H2049-H2055 AromaticContact CG-CE1 3.92Å; H2049-H2055 AromaticContact ND1-CE1 3.93Å; H2049-H2055 AromaticContact NE2-CE1 3.46Å; H2049-H2055 PolarHBondContact NE2-CE1 3.05Å; H2049-H2055 PolarHBondContact O-ND1 2.92Å
2050	L	60.6	Low	53.2	Low	40 Å²	40	82.8 Å²	82.8	21%	0.209	45%	0.45	C	S	.	.	H	α-helix	trans	-64	-34.1	177.5	-82.7	169.9	0	0	0	114.2	I2009 F2046 V2047 H2055	I2009-L2050 HydrophobicContact CD1-CD2 4.15Å; F2046-L2050 HydrophobicContact CD1-CD1 3.84Å; F2046-L2050 HydrophobicContact CE1-CD1 3.45Å; F2046-L2050 VanDerWaalsContact CE1-CD1 3.45Å; F2046-L2050 HydrophobicContact CE1-CG 4.47Å; F2046-L2050 HydrophobicContact CE2-CD1 4.3Å; F2046-L2050 HydrophobicContact CG-CD1 4.43Å; F2046-L2050 HydrophobicContact CZ-CD1 3.71Å; F2046-L2050 HydrophobicContact CZ-CG 4.39Å; F2046-L2050 WeakPolarHBondContact O-CB 3.34Å; F2046-L2050 WeakPolarHBondContact O-CG 3.24Å; F2046-L2050 PolarHBondContact O-N 2.98Å; V2047-L2050 CarbonylContact O-C 3.58Å; V2047-L2050 PolarHBondContact O-N 3.12Å; V2047-L2050 VanDerWaalsContact O-N 3.1Å; L2050-H2055 WeakPolarHBondContact O-CB 3.31Å
2051	F	59.5	Low	53.8	Low	137 Å²	137	79.8 Å²	79.8	60%	0.601	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	8.8	175	-69.8	-78.5	0	0	0	113.2	V2047 H2049 L2056	V2047-F2051 HydrophobicContact CG1-CD2 3.77Å; V2047-F2051 HydrophobicContact CG1-CE2 4.14Å; V2047-F2051 WeakPolarHBondContact O-CD2 3.46Å; V2047-F2051 PolarHBondContact O-N 2.84Å; H2049-F2051 PolarHBondContact O-N 3.46Å; F2051-L2056 HydrophobicContact CD1-CD1 4.41Å; F2051-L2056 HydrophobicContact CD1-CD2 4.46Å; F2051-L2056 HydrophobicContact CD1-CG 4.47Å; F2051-L2056 WeakPolarHBondContact O-CD1 3.13Å
2052	S	70.3	Confident	54.4	Low	35 Å²	35	83.9 Å²	83.9	25%	0.245	43%	0.431	C	S	.	.	S	Bend	trans	-60.2	149.9	166.8	72.1	0	0	0	0	110.3	D2048 H2049 V2054 H2055 L2056	D2048-S2052 WeakPolarHBondContact O-CB 3.4Å; D2048-S2052 PolarHBondContact O-N 3.32Å; H2049-S2052 WeakPolarHBondContact O-CB 3.18Å; H2049-S2052 PolarHBondContact O-N 2.84Å; H2049-S2052 PolarHBondContact O-OG 3.34Å; S2052-V2054 PolarHBondContact O-N 3.17Å; S2052-H2055 PolarHBondContact O-N 3.31Å; S2052-H2055 PolarHBondContact OG-N 3.01Å; S2052-L2056 PolarHBondContact O-N 2.94Å
2053	A	58	Low	53.9	Low	83 Å²	83	85.9 Å²	85.9	69%	0.686	44%	0.444	S	S	*	.	H	α-helix	trans	-56.5	-26.5	179.8	0	0	0	0	0	113.1	K2057	A2053-K2057 WeakPolarHBondContact O-CB 3.2Å; A2053-K2057 PolarHBondContact O-N 3.23Å; A2053-K2057 VanDerWaalsContact O-N 3.13Å
2054	V	57.7	Low	53.8	Low	83 Å²	83	83 Å²	83	50%	0.503	44%	0.435	S	S	.	.	H	α-helix	trans	-70.3	-46.2	176.4	-178.4	0	0	0	0	111.5	C2010 S2052 K2058	C2010-V2054 HydrophobicContact CB-CG1 4.48Å; S2052-V2054 PolarHBondContact O-N 3.17Å; V2054-K2058 PolarHBondContact O-N 2.88Å
2055	H	69.9	Low	53.5	Low	1 Å²	1	85.8 Å²	85.8	1%	0.005	44%	0.441	C	S	.	.	H	α-helix	trans	-75.1	-40.5	178.7	-80.3	146.4	0	0	0	113	C2007 I2009 C2010 H2049 L2050 S2052 K2057 K2058 L2059	C2007-H2055 PolarHBondContact SG-CE1 3.38Å; I2009-H2055 WeakPolarHBondContact CB-NE2 3.29Å; I2009-H2055 VanDerWaalsContact CG2-CD2 3.48Å; I2009-H2055 WeakPolarHBondContact CG2-CD2 2.93Å; C2010-H2055 WeakPolarHBondContact CB-NE2 3.33Å; C2010-H2055 PolarHBondContact N-NE2 3.35Å; C2010-H2055 PolarHBondContact SG-CE1 3.07Å; C2010-H2055 PolarHBondContact SG-NE2 2.96Å; H2049-H2055 AromaticContact CD2-CE1 3.64Å; H2049-H2055 AromaticContact CE1-CE1 3.66Å; H2049-H2055 AromaticContact CG-CE1 3.92Å; H2049-H2055 AromaticContact ND1-CE1 3.93Å; H2049-H2055 AromaticContact NE2-CE1 3.46Å; H2049-H2055 PolarHBondContact NE2-CE1 3.05Å; H2049-H2055 PolarHBondContact O-ND1 2.92Å; L2050-H2055 WeakPolarHBondContact O-CB 3.31Å; S2052-H2055 PolarHBondContact O-N 3.31Å; S2052-H2055 PolarHBondContact OG-N 3.01Å; H2055-K2057 VanDerWaalsContact C-N 3.27Å; H2055-K2057 PolarHBondContact O-N 3.14Å; H2055-K2058 PolarHBondContact O-N 2.92Å; H2055-K2058 VanDerWaalsContact O-N 3.08Å; H2055-L2059 WeakPolarHBondContact O-CB 3.38Å; H2055-L2059 PolarHBondContact O-N 2.83Å
2056	L	65.6	Low	52.5	Low	71 Å²	71	90 Å²	90	37%	0.372	46%	0.458	S	S	.	.	H	α-helix	trans	-56.9	-42.4	172.1	-90.2	166.6	0	0	0	111.5	F2051 S2052 K2058 L2059 L2060	F2051-L2056 HydrophobicContact CD1-CD1 4.41Å; F2051-L2056 HydrophobicContact CD1-CD2 4.46Å; F2051-L2056 HydrophobicContact CD1-CG 4.47Å; F2051-L2056 WeakPolarHBondContact O-CD1 3.13Å; S2052-L2056 PolarHBondContact O-N 2.94Å; L2056-K2058 VanDerWaalsContact C-N 3.3Å; L2056-K2058 PolarHBondContact O-N 2.75Å; L2056-L2059 PolarHBondContact O-N 2.84Å; L2056-L2060 HydrophobicContact CD2-CD1 4.15Å; L2056-L2060 WeakPolarHBondContact O-CB 3.31Å; L2056-L2060 WeakPolarHBondContact O-CD1 3.32Å; L2056-L2060 PolarHBondContact O-N 3.06Å
2057	K	56.4	Low	51.3	Low	150 Å²	150	91.4 Å²	91.4	65%	0.652	48%	0.475	S	S	*	.	H	α-helix	trans	-68.9	-24.8	177.9	-165.5	172.6	-174.7	179.7	0	113.3	A2053 H2055 R2061	A2053-K2057 WeakPolarHBondContact O-CB 3.2Å; A2053-K2057 PolarHBondContact O-N 3.23Å; A2053-K2057 VanDerWaalsContact O-N 3.13Å; H2055-K2057 VanDerWaalsContact C-N 3.27Å; H2055-K2057 PolarHBondContact O-N 3.14Å; K2057-R2061 WeakPolarHBondContact O-CB 3.24Å
2058	K	56.7	Low	49.8	Very low	96 Å²	96	98.3 Å²	98.3	42%	0.417	52%	0.518	S	S	.	.	H	α-helix	trans	-82.5	-41	171.3	-82	-174.9	161.9	-177.1	0	113.2	I2009 V2054 H2055 L2056 R2061 W2062	I2009-K2058 HydrophobicContact CG2-CB 4.39Å; I2009-K2058 HydrophobicContact CG2-CD 4.32Å; I2009-K2058 WeakPolarHBondContact O-CD 3.33Å; I2009-K2058 WeakPolarHBondContact O-CE 3.37Å; I2009-K2058 PolarHBondContact O-NZ 2.67Å; V2054-K2058 PolarHBondContact O-N 2.88Å; H2055-K2058 PolarHBondContact O-N 2.92Å; H2055-K2058 VanDerWaalsContact O-N 3.08Å; L2056-K2058 VanDerWaalsContact C-N 3.3Å; L2056-K2058 PolarHBondContact O-N 2.75Å; K2058-R2061 WeakPolarHBondContact O-CB 3.13Å; K2058-R2061 PolarHBondContact O-N 2.67Å; K2058-R2061 VanDerWaalsContact O-N 3.17Å; K2058-W2062 PolarHBondContact O-N 2.73Å; K2058-W2062 VanDerWaalsContact O-N 3.12Å
2059	L	57.4	Low	49.3	Very low	69 Å²	69	97.5 Å²	97.5	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-44.8	176.8	-78.1	162.9	0	0	0	111.5	H2055 L2056 R2061 W2062 C2063	H2055-L2059 WeakPolarHBondContact O-CB 3.38Å; H2055-L2059 PolarHBondContact O-N 2.83Å; L2056-L2059 PolarHBondContact O-N 2.84Å; L2059-R2061 PolarHBondContact O-N 3.21Å; L2059-W2062 PolarHBondContact O-N 3.14Å; L2059-C2063 PolarHBondContact O-N 2.69Å; L2059-C2063 PolarHBondContact O-SG 3.32Å; L2059-C2063 VanDerWaalsContact O-SG 3.38Å
2060	L	47.1	Very low	48.2	Very low	63 Å²	63	100.7 Å²	100.7	33%	0.33	53%	0.531	S	S	.	.	H	α-helix	trans	-61.1	-31.4	172.4	-90.6	89.3	0	0	0	112.7	L2056 T2064	L2056-L2060 HydrophobicContact CD2-CD1 4.15Å; L2056-L2060 WeakPolarHBondContact O-CB 3.31Å; L2056-L2060 WeakPolarHBondContact O-CD1 3.32Å; L2056-L2060 PolarHBondContact O-N 3.06Å; L2060-T2064 WeakPolarHBondContact O-CG2 3.21Å; L2060-T2064 PolarHBondContact O-N 2.74Å; L2060-T2064 PolarHBondContact O-OG1 3.22Å; L2060-T2064 VanDerWaalsContact O-OG1 3.09Å
2061	R	39.6	Very low	47.5	Very low	117 Å²	117	104.1 Å²	104.1	44%	0.442	55%	0.549	S	S	.	.	H	α-helix	trans	-69.6	-33	177.2	-177.8	77.3	165.7	-124.4	-9.3	112	L1091 K2057 K2058 L2059 T2064 M2065	L1091-R2061 VanDerWaalsContact CD2-NH1 3.34Å; K2057-R2061 WeakPolarHBondContact O-CB 3.24Å; K2058-R2061 WeakPolarHBondContact O-CB 3.13Å; K2058-R2061 PolarHBondContact O-N 2.67Å; K2058-R2061 VanDerWaalsContact O-N 3.17Å; L2059-R2061 PolarHBondContact O-N 3.21Å; R2061-T2064 PolarHBondContact O-OG1 2.98Å; R2061-T2064 VanDerWaalsContact O-OG1 3.08Å; R2061-M2065 VanDerWaalsContact O-CG 3.29Å; R2061-M2065 WeakPolarHBondContact O-CG 3.49Å
2062	W	41.3	Very low	46.8	Very low	207 Å²	207	102.1 Å²	102.1	78%	0.784	55%	0.546	S	S	*	.	H	α-helix	trans	-72.6	-47.3	172.1	-88.5	16.7	0	0	0	111.7	K2058 L2059 T2064 M2065	K2058-W2062 PolarHBondContact O-N 2.73Å; K2058-W2062 VanDerWaalsContact O-N 3.12Å; L2059-W2062 PolarHBondContact O-N 3.14Å; W2062-T2064 PolarHBondContact O-N 3.38Å; W2062-M2065 PolarHBondContact O-N 2.91Å; W2062-M2065 VanDerWaalsContact O-N 3.08Å
2063	C	33.6	Very low	45.3	Very low	109 Å²	109	106.3 Å²	106.3	74%	0.736	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-7.9	178.7	-60.3	0	0	0	0	114.8	L2059	L2059-C2063 PolarHBondContact O-N 2.69Å; L2059-C2063 PolarHBondContact O-SG 3.32Å; L2059-C2063 VanDerWaalsContact O-SG 3.38Å
2064	T	34.4	Very low	44.5	Very low	65 Å²	65	107.9 Å²	107.9	40%	0.399	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	11.7	175.7	53.8	0	0	0	0	114.2	L2060 R2061 W2062	L2060-T2064 WeakPolarHBondContact O-CG2 3.21Å; L2060-T2064 PolarHBondContact O-N 2.74Å; L2060-T2064 PolarHBondContact O-OG1 3.22Å; L2060-T2064 VanDerWaalsContact O-OG1 3.09Å; R2061-T2064 PolarHBondContact O-OG1 2.98Å; R2061-T2064 VanDerWaalsContact O-OG1 3.08Å; W2062-T2064 PolarHBondContact O-N 3.38Å
2065	M	31.4	Very low	43.5	Very low	108 Å²	108	109.6 Å²	109.6	53%	0.532	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.3	-17.9	-179.9	-61.8	-89.7	60.7	0	0	114.3	R2061 W2062 T2067	R2061-M2065 VanDerWaalsContact O-CG 3.29Å; R2061-M2065 WeakPolarHBondContact O-CG 3.49Å; W2062-M2065 PolarHBondContact O-N 2.91Å; W2062-M2065 VanDerWaalsContact O-N 3.08Å; M2065-T2067 PolarHBondContact O-N 3.1Å
2066	D	25.2	Very low	41.5	Very low	154 Å²	154	118 Å²	118	82%	0.824	60%	0.603	S	S	*	*	S	Bend	trans	-98.7	55.7	178.9	-68.5	-39.4	0	0	0	113
2067	T	25.2	Very low	39.5	Very low	130 Å²	130	121.9 Å²	121.9	80%	0.798	62%	0.623	S	S	*	*			trans	-144.6	87.6	161.1	56	0	0	0	0	111.3	M2065	M2065-T2067 PolarHBondContact O-N 3.1Å
2068	T	25.9	Very low	38	Very low	195 Å²	195	119.4 Å²	119.4	100%	1.196	62%	0.62	S	S	*	*			trans	-134.8	0	163.7	56.9	0	0	0	0	109.1

Retrieved 2,068 of 2,068 residues in 844 ms (Link to these results)

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