A0A5K4F8G4_SCHMA Loading...

Helicase ATP-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F8G4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,290 aa.

						>A0A5K4F8G4_SCHMA|A0A5K4F8G4
MTGDHYDIVIPENRIMKTDEQSVKDSTLMSEGMVSVIEAPDYLASFNIDAGGEAEGSSMPHYIVNLNMYNTTTDMDASTTLPVHSQVPGIGESSASLPTPDMNSPVIMNENVGLMCGVNSTGQGQQFFTPTMRSKARGRGRFSSVPLDDVMEKKIRTYEGKDCVQELGKLLKLFPRFKRAYINRVFTRNMLSYERSYEQLKEEDDRERERCSKVRLIQAPKAESKRSIESKTHSRPELPLQSQAFLCMGLPLGRCPPHVANSLYRRVIVTPEGAVESADEHEQKFLDSTGLSSSALETPSSHCEPPRPRPSLFTGLRISPVSTIMPPIHQLAEFKQSPPRPSEERTLISDNNIETLNSEDTTIQQSGNKFFRTDHVSEAQKKKRGYINREMRTSTVSTSVSRIKITASEVRSDLNSEDSTGKPGDAVKYLAKVGVVSNSVSRKRSTRRGGKSTRPKLTTEIQGVGNETGTSPAVEVIKEDDGLDLTNEERRHLLSFFNDAVLEELTLVPGCSWKTAQAIINMRPFKNTKDLIFQMSGVRHLSSNLYECCKDILEVRTSVIRLLNKCERLTEQVASHATRLLENTIDLPENAITDQNQSDGVVDEHDGFTINKANGYPVQLVTQQPAILNPLRELKPYQLVGLNWLRLLHHEQVNGILADEMGLGKTVQAIAFLASLWESGNRGPHLIICPSSTQDSWQRELSLWCPHLKVLVYQGSAEQRKAIRLKIYESESQPDFNILLTSYAVGTSAIEDRTLMKRVNFRYGIFDEAHMLKNMTSQRYRNLMNFRVQRRLLLTGTPIQNNLLELISLLSFVMPEMFLKSTDLLKRIFQIYSKPMNSREEDQSANNSPIRSSFEEERLVQAKGLLQPFCLRRLKSQVLGQLPPKTTEVVSVTMTKSQATHYYDLVKRLRSQRSVKDTNSNSQDSSLLLNSECDDGDENADPDANDRKVNGTKSFPVTSRSISESLQSPCNMVTALRKAANHQALFSGLAYTDSNLRDIAESLHLDPSHSNADPNLIYEDLRAMNDHQIHKLCQLYEVLSPYTLSPESIISGSGKIQWLNDNLPKLISEGHRILIFSQFVIMLDILEEFLRITNRRYIRMDGSTPVSERQTLIDRFNSSSIEVFLLSTRAGGLGINLTGADTVIIHDIDFNPYNDKQAEDRCHRLGQKNPVHVIRLISEGTLEEGMLRIASEKLQMEQNVTGCVSGYNTEQTEESEKTARVSSRRRRSKSANILPCSSLDGMTENGNVFKVLGNLNPTASDLSLSIVNPISSSRISERDVRSLLSDALKL
					

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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	30.2	Very low	33.7	Very low	243 Å²	243	149.5 Å²	149.5	100%	1.197	81%	0.808	S	S	*	*				0	160.8	0	-75.3	168.4	164.4	0	0	107.5
2	T	33.3	Very low	33.6	Very low	147 Å²	147	150.7 Å²	150.7	90%	0.902	81%	0.805	S	S	*	*			trans	-26.3	132.7	-178.8	46.6	0	0	0	0	116.3
3	G	36.5	Very low	33.8	Very low	73 Å²	73	148.1 Å²	148.1	75%	0.753	79%	0.791	S	S	*	*			trans	-159.6	138	169.1	0	0	0	0	0	110.8
4	D	32.4	Very low	33.6	Very low	155 Å²	155	151.9 Å²	151.9	83%	0.829	79%	0.789	S	S	*	*			trans	-110.1	138.8	-176.8	-55.3	-64	0	0	0	110.9
5	H	36.8	Very low	33.6	Very low	177 Å²	177	153.3 Å²	153.3	82%	0.819	80%	0.796	S	S	*	*			trans	-153.9	123.6	160.1	-92.4	-81.4	0	0	0	106.8
6	Y	33	Very low	33.3	Very low	197 Å²	197	153.2 Å²	153.2	77%	0.773	79%	0.792	S	S	*	*				79.1	141.4	73	-91	-79.8	0	0	0	114.2
7	D	35.1	Very low	33.4	Very low	128 Å²	128	155.6 Å²	155.6	68%	0.684	80%	0.796	S	S	*	*			trans	74.7	151.7	158.9	-56	-23.4	0	0	0	119.5
8	I	33.1	Very low	33.4	Very low	145 Å²	145	153 Å²	153	74%	0.744	79%	0.788	S	S	*	*			cis	-156.7	155.9	-22.5	-114	162.7	0	0	0	111.2
9	V	30.2	Very low	33.5	Very low	115 Å²	115	152.7 Å²	152.7	70%	0.697	79%	0.788	S	S	*	*			trans	-51.5	154.7	170.4	169.5	0	0	0	0	116.8
10	I	33	Very low	33.5	Very low	161 Å²	161	152.8 Å²	152.8	83%	0.826	79%	0.785	S	S	*	*			trans	-171.2	139.5	136.2	-95.7	149.3	0	0	0	112.3
11	P	36.8	Very low	33.5	Very low	103 Å²	103	152.8 Å²	152.8	67%	0.669	78%	0.781	S	S	*	*			trans	-125.5	-152.2	178.3	44.7	-31.8	0	0	0	114.9
12	E	33.1	Very low	33.4	Very low	164 Å²	164	145.6 Å²	145.6	77%	0.766	76%	0.755	S	S	*	*			trans	83.2	157.2	176.9	-44.2	-164.9	166	0	0	117
13	N	35.4	Very low	33.5	Very low	117 Å²	117	144 Å²	144	63%	0.626	75%	0.745	S	S	*	*			cis	-136.7	152.2	-2.2	-95	-64.1	0	0	0	107.8
14	R	31.2	Very low	33.4	Very low	201 Å²	201	149 Å²	149	76%	0.758	75%	0.746	S	S	*	*			cis	94.8	100.2	31.2	-172.4	-160.1	-175.1	176.2	3.6	115.2
15	I	33.5	Very low	33.4	Very low	174 Å²	174	148.1 Å²	148.1	89%	0.892	74%	0.741	S	S	*	*			trans	-139.5	147.9	146.6	-64.4	-171.3	0	0	0	108.4
16	M	28.7	Very low	33	Very low	151 Å²	151	144.1 Å²	144.1	74%	0.744	73%	0.733	S	S	*	*			trans	-126.9	153.8	-178.6	-70	167.4	144.9	0	0	111.9
17	K	35.9	Very low	32.9	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	73%	0.732	S	S	*	*			trans	179.4	117.4	141.1	-95	156.3	-179.2	-171.9	0	107.3
18	T	32.9	Very low	32.8	Very low	108 Å²	108	140.3 Å²	140.3	66%	0.663	73%	0.73	S	S	*	*				58.8	126.5	69.8	69.1	0	0	0	0	113.2
19	D	34.6	Very low	32.6	Very low	148 Å²	148	139.5 Å²	139.5	79%	0.791	73%	0.725	S	S	*	*			cis	-163.9	-169	-2.7	-102.5	-29.6	0	0	0	107.8
20	E	33.8	Very low	32.6	Very low	153 Å²	153	138.5 Å²	138.5	72%	0.715	72%	0.723	S	S	*	*			cis	-153.1	-72.3	18.2	-154.3	-173.5	169.3	0	0	115.4
21	Q	33.3	Very low	32.4	Very low	153 Å²	153	140.4 Å²	140.4	72%	0.715	73%	0.728	S	S	*	*			trans	-157	172.4	-157.8	-79.7	158.4	40.5	0	0	111.5
22	S	29.8	Very low	32.1	Very low	93 Å²	93	139.4 Å²	139.4	65%	0.65	74%	0.737	S	S	*	*			cis	179	179.6	-37.2	68.8	0	0	0	0	108.6
23	V	33.8	Very low	31.8	Very low	112 Å²	112	140.3 Å²	140.3	68%	0.679	74%	0.743	S	S	*	*			trans	77.7	113.8	149.9	161.7	0	0	0	0	120.4
24	K	34.6	Very low	31.3	Very low	179 Å²	179	140.8 Å²	140.8	78%	0.778	75%	0.75	S	S	*	*			trans	72.6	158.2	144.9	-69.9	179.9	-169	170	0	120.3
25	D	31.8	Very low	31	Very low	137 Å²	137	136 Å²	136	73%	0.733	75%	0.747	S	S	*	*			cis	-146.2	-177	-16.4	-129.5	-42.2	0	0	0	113.5
26	S	30	Very low	30.6	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	74%	0.742	S	S	*	*			trans	-97.8	159.5	-158.4	-46.2	0	0	0	0	116.8
27	T	30.9	Very low	30.6	Very low	120 Å²	120	133.6 Å²	133.6	74%	0.736	74%	0.742	S	S	*	*			trans	94.6	144.9	138.3	3.1	0	0	0	0	123.7
28	L	31.9	Very low	30.3	Very low	125 Å²	125	132.7 Å²	132.7	65%	0.654	74%	0.741	S	S	*	*			trans	91.5	107.3	150.5	-66.8	168.4	0	0	0	122.2
29	M	29.2	Very low	30	Very low	128 Å²	128	132 Å²	132	63%	0.631	75%	0.746	S	S	*	*				95.8	141.2	122.7	-74.6	-70.1	162.6	0	0	124	E304	M29-E304 WeakPolarHBondContact CE-OE2 3.41Å
30	S	30	Very low	29.9	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	75%	0.746	S	S	*	*			trans	60.5	113.2	149.9	57.2	0	0	0	0	121.5
31	E	28.7	Very low	29.7	Very low	202 Å²	202	130.3 Å²	130.3	94%	0.944	75%	0.749	S	S	*	*			trans	68.2	161.4	136.7	-59.3	178.8	-176.7	0	0	118.6
32	G	30.1	Very low	29.5	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	76%	0.759	S	S	*	*			trans	128.3	113.4	178.2	0	0	0	0	0	114
33	M	27	Very low	29.3	Very low	183 Å²	183	137.9 Å²	137.9	90%	0.901	77%	0.77	S	S	*	*			trans	-83.1	146.9	171.7	-85.8	-179.9	165.1	0	0	112
34	V	25.3	Very low	29	Very low	127 Å²	127	137.3 Å²	137.3	77%	0.77	78%	0.777	S	S	*	*			trans	77.2	153.5	142.2	167.1	0	0	0	0	119.1
35	S	25.3	Very low	28.8	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	77%	0.774	S	S	*	*			trans	74.2	114.7	167.8	45.1	0	0	0	0	120.2
36	V	24.7	Very low	28.7	Very low	130 Å²	130	136.6 Å²	136.6	79%	0.788	78%	0.78	S	S	*	*				41	121.1	126.3	-170.6	0	0	0	0	118.6
37	I	29.9	Very low	28.7	Very low	146 Å²	146	139 Å²	139	75%	0.749	79%	0.786	S	S	*	*				-169	140.8	125.1	-96.6	152.2	0	0	0	110.5
38	E	28.6	Very low	28.5	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	79%	0.786	S	S	*	*			trans	-5.6	159.9	166.6	-64.1	134.1	-165.9	0	0	123.1
39	A	27	Very low	28.4	Very low	94 Å²	94	142.2 Å²	142.2	78%	0.777	80%	0.798	S	S	*	*			trans	-114.9	160.7	165.7	0	0	0	0	0	110.6
40	P	33.1	Very low	28.4	Very low	122 Å²	122	140.3 Å²	140.3	79%	0.792	80%	0.803	S	S	*	*			trans	-126.3	166.9	157.1	37.4	-26.4	0	0	0	114
41	D	27.9	Very low	28.4	Very low	143 Å²	143	140 Å²	140	77%	0.765	81%	0.814	S	S	*	*			trans	-75	161.3	-165.1	-56.6	-86.1	0	0	0	117.4
42	Y	29.4	Very low	28.4	Very low	237 Å²	237	134.4 Å²	134.4	93%	0.929	81%	0.811	S	S	*	*			trans	-140.4	107.6	153	-91.2	-85.5	0	0	0	111
43	L	26.2	Very low	28.2	Very low	167 Å²	167	140.2 Å²	140.2	87%	0.874	82%	0.816	S	S	*	*			trans	-119	177.4	168	-92.8	173.7	0	0	0	110.5
44	A	27.8	Very low	28.5	Very low	100 Å²	100	136.3 Å²	136.3	83%	0.826	81%	0.812	S	S	*	*			trans	73.8	74.9	169.1	0	0	0	0	0	118.8
45	S	29.6	Very low	28.5	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	82%	0.822	S	S	*	*			trans	-161.2	141.6	135.2	69.4	0	0	0	0	108.7
46	F	29.1	Very low	28.7	Very low	200 Å²	200	138.6 Å²	138.6	88%	0.877	82%	0.822	S	S	*	*			cis	-126.8	162.5	4.2	-88.2	-96.7	0	0	0	111.6
47	N	30.4	Very low	28.9	Very low	144 Å²	144	138.4 Å²	138.4	77%	0.77	83%	0.826	S	S	*	*			trans	-97.6	140.6	176.5	-94.6	-17.9	0	0	0	113.3
48	I	27.9	Very low	28.8	Very low	143 Å²	143	137.2 Å²	137.2	73%	0.733	83%	0.831	S	S	*	*			trans	37	123.7	130.8	-49.7	168.7	0	0	0	118.4	A50	I48-A50 HydrophobicContact CG2-CB 4.48Å
49	D	29.1	Very low	28.6	Very low	168 Å²	168	135.6 Å²	135.6	90%	0.898	83%	0.825	S	S	*	*			trans	-136.6	156.8	130.7	-146.1	-19.1	0	0	0	108.8
50	A	29.3	Very low	28.6	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	82%	0.815	S	S	*	*			trans	-142.2	143.1	-161	0	0	0	0	0	116.5	I48	I48-A50 HydrophobicContact CG2-CB 4.48Å
51	G	28.9	Very low	28.3	Very low	86 Å²	86	136.3 Å²	136.3	89%	0.887	81%	0.809	S	S	*	*			trans	140.7	116.5	163	0	0	0	0	0	114.9
52	G	29.6	Very low	28.3	Very low	85 Å²	85	137.3 Å²	137.3	88%	0.876	80%	0.803	S	S	*	*			trans	159.4	85.9	174.3	0	0	0	0	0	114.1
53	E	26.2	Very low	28.2	Very low	204 Å²	204	131.6 Å²	131.6	95%	0.953	79%	0.788	S	S	*	*			trans	-82.8	135.8	178.3	-62.7	179.9	137.3	0	0	112.6
54	A	32.5	Very low	28.2	Very low	100 Å²	100	129 Å²	129	83%	0.826	78%	0.779	S	S	*	*			trans	-153.5	126.6	161.6	0	0	0	0	0	110
55	E	26.3	Very low	28.2	Very low	207 Å²	207	127.7 Å²	127.7	97%	0.967	76%	0.758	S	S	*	*			trans	-76.6	141.5	-174.3	-57.6	178.6	112.9	0	0	112.7
56	G	28.8	Very low	28.2	Very low	68 Å²	68	126.4 Å²	126.4	70%	0.701	74%	0.743	S	S	*	*			trans	-172.1	44.5	-172.7	0	0	0	0	0	118.2
57	S	28.2	Very low	28.2	Very low	125 Å²	125	122.8 Å²	122.8	87%	0.874	73%	0.732	S	S	*	*			trans	42	90.3	163.9	62.5	0	0	0	0	117.8
58	S	28	Very low	28	Very low	122 Å²	122	122.1 Å²	122.1	85%	0.853	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-77.9	141.1	174.6	59.3	0	0	0	0	113.8
59	M	24.9	Very low	28	Very low	142 Å²	142	125 Å²	125	70%	0.7	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-103.5	135.5	161.9	-132.3	-171.5	179.1	0	0	109.1	H61 V860	M59-H61 PolarHBondContact O-N 3.32Å; M59-V860 HydrophobicContact CE-CG1 4.32Å
60	P	27.9	Very low	27.8	Very low	88 Å²	88	124.1 Å²	124.1	57%	0.571	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-72.7	121.3	-169.7	27.3	-35	0	0	0	113.1	Y62	P60-Y62 HydrophobicContact CB-CD2 4.12Å; P60-Y62 HydrophobicContact CB-CE2 3.62Å; P60-Y62 HydrophobicContact CG-CD2 4.24Å; P60-Y62 HydrophobicContact CG-CE2 3.66Å; P60-Y62 PolarHBondContact O-N 2.95Å; P60-Y62 VanDerWaalsContact O-N 3.07Å
61	H	25.9	Very low	27.8	Very low	143 Å²	143	126.2 Å²	126.2	66%	0.662	73%	0.728	S	S	*	*			trans	-78.4	83.8	176	-79.6	-92.4	0	0	0	111.8	M59 I63	M59-H61 PolarHBondContact O-N 3.32Å; H61-I63 VanDerWaalsContact C-N 3.25Å; H61-I63 PolarHBondContact O-N 3.38Å
62	Y	28.6	Very low	27.8	Very low	163 Å²	163	128.5 Å²	128.5	64%	0.639	73%	0.725	S	S	*	*			trans	-74.4	77.6	171.4	-70.2	-68.9	0	0	0	112.4	P60	P60-Y62 HydrophobicContact CB-CD2 4.12Å; P60-Y62 HydrophobicContact CB-CE2 3.62Å; P60-Y62 HydrophobicContact CG-CD2 4.24Å; P60-Y62 HydrophobicContact CG-CE2 3.66Å; P60-Y62 PolarHBondContact O-N 2.95Å; P60-Y62 VanDerWaalsContact O-N 3.07Å
63	I	26.7	Very low	27.7	Very low	117 Å²	117	130.2 Å²	130.2	60%	0.6	72%	0.719	S	S	*	*			trans	-61.3	128.2	151.4	-56.8	176.4	0	0	0	106.6	H61 N65	H61-I63 VanDerWaalsContact C-N 3.25Å; H61-I63 PolarHBondContact O-N 3.38Å; I63-N65 HydrophobicContact CB-CB 4.35Å; I63-N65 HydrophobicContact CG2-CB 3.98Å; I63-N65 PolarHBondContact O-N 3.24Å
64	V	27.4	Very low	28	Very low	113 Å²	113	128.7 Å²	128.7	69%	0.685	72%	0.717	S	S	*	*			trans	-73	83.9	165.2	179.6	0	0	0	0	106.8	L66	V64-L66 VanDerWaalsContact C-N 3.31Å; V64-L66 HydrophobicContact CG1-CD1 4.19Å; V64-L66 HydrophobicContact CG1-CG 4.21Å; V64-L66 PolarHBondContact O-N 3.18Å
65	N	26.2	Very low	27.8	Very low	73 Å²	73	132.2 Å²	132.2	39%	0.39	72%	0.719	S	S	.	*			trans	-86.4	73.4	-163.8	-158.8	-8.4	0	0	0	111.4	I63 N67 M68	I63-N65 HydrophobicContact CB-CB 4.35Å; I63-N65 HydrophobicContact CG2-CB 3.98Å; I63-N65 PolarHBondContact O-N 3.24Å; N65-N67 PolarHBondContact O-N 2.66Å; N65-M68 HydrophobicContact CB-CB 4.42Å; N65-M68 VanDerWaalsContact ND2-CG 3.26Å; N65-M68 WeakPolarHBondContact ND2-CG 3.47Å; N65-M68 PolarHBondContact ND2-SD 2.75Å; N65-M68 PolarHBondContact O-N 2.88Å
66	L	31.3	Very low	28	Very low	75 Å²	75	130.5 Å²	130.5	39%	0.393	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	6.9	178.1	-76.2	157.9	0	0	0	114.6	V64 L581 V640	V64-L66 VanDerWaalsContact C-N 3.31Å; V64-L66 HydrophobicContact CG1-CD1 4.19Å; V64-L66 HydrophobicContact CG1-CG 4.21Å; V64-L66 PolarHBondContact O-N 3.18Å; L66-L581 HydrophobicContact CD2-CD1 3.72Å; L66-L581 HydrophobicContact CD2-CD2 3.42Å; L66-L581 VanDerWaalsContact CD2-CD2 3.42Å; L66-L581 HydrophobicContact CD2-CG 4.18Å; L66-V640 HydrophobicContact CB-CG2 4.29Å; L66-V640 HydrophobicContact CD1-CB 4.4Å; L66-V640 HydrophobicContact CD1-CG1 3.56Å; L66-V640 HydrophobicContact CD1-CG2 4.14Å
67	N	27.6	Very low	28	Very low	124 Å²	124	131.1 Å²	131.1	66%	0.663	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	16.3	-176.6	-76	80.8	0	0	0	112.9	N65	N65-N67 PolarHBondContact O-N 2.66Å
68	M	26.7	Very low	28.1	Very low	130 Å²	130	130.6 Å²	130.6	64%	0.64	71%	0.711	S	S	*	*			trans	-121.5	70.4	174.3	-87.6	-164.4	70.9	0	0	113.5	N65	N65-M68 HydrophobicContact CB-CB 4.42Å; N65-M68 VanDerWaalsContact ND2-CG 3.26Å; N65-M68 WeakPolarHBondContact ND2-CG 3.47Å; N65-M68 PolarHBondContact ND2-SD 2.75Å; N65-M68 PolarHBondContact O-N 2.88Å
69	Y	27.4	Very low	28.2	Very low	203 Å²	203	130.8 Å²	130.8	80%	0.796	71%	0.707	S	S	*	*			trans	-144.9	81.3	147.8	-72.6	-66.1	0	0	0	107.4
70	N	24.7	Very low	28.5	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	71%	0.708	S	S	*	*			trans	-159.1	73.7	169.7	-114.9	27.9	0	0	0	109
71	T	29.7	Very low	28.6	Very low	134 Å²	134	133.2 Å²	133.2	82%	0.822	72%	0.722	S	S	*	*			trans	-137.9	112.3	166.2	46.5	0	0	0	0	106.3
72	T	30	Very low	28.9	Very low	134 Å²	134	132 Å²	132	82%	0.822	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-65.1	149.7	-172.6	31.3	0	0	0	0	112.6
73	T	27.5	Very low	29	Very low	121 Å²	121	131.5 Å²	131.5	74%	0.742	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-82.2	124.2	173.1	50	0	0	0	0	110.9
74	D	30.9	Very low	29.2	Very low	172 Å²	172	134.8 Å²	134.8	92%	0.92	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-93.8	139.9	147.7	-88.3	-47.4	0	0	0	108.7
75	M	28.9	Very low	29.3	Very low	173 Å²	173	134.6 Å²	134.6	85%	0.852	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-95.3	148.2	-179.9	-61.5	-171.4	-174.7	0	0	111.1
76	D	31.2	Very low	29.6	Very low	172 Å²	172	139.6 Å²	139.6	92%	0.92	78%	0.777	S	S	*	*			trans	-151	157.4	132.1	-126.6	-31.2	0	0	0	112.6
77	A	28.9	Very low	29.8	Very low	81 Å²	81	142.1 Å²	142.1	67%	0.669	80%	0.796	S	S	*	*			trans	-103.1	172.5	-144.4	0	0	0	0	0	118.3
78	S	30.2	Very low	30.2	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	80%	0.803	S	S	*	*			trans	82.3	153.1	159.1	92.6	0	0	0	0	116.9
79	T	30.2	Very low	30.6	Very low	126 Å²	126	139.4 Å²	139.4	77%	0.773	81%	0.807	S	S	*	*			cis	-141.5	157	6.1	-64.1	0	0	0	0	112.3
80	T	29.9	Very low	30.9	Very low	116 Å²	116	138.4 Å²	138.4	71%	0.712	81%	0.813	S	S	*	*			trans	-66.8	156.4	-172.2	49.5	0	0	0	0	119.4
81	L	29.8	Very low	31.3	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	81%	0.808	S	S	*	*				162.7	135.6	111.6	-85.1	178	0	0	0	115.9
82	P	32.8	Very low	31.2	Very low	118 Å²	118	136.9 Å²	136.9	77%	0.766	81%	0.81	S	S	*	*			trans	-128.2	167.5	173.9	42.1	-30.5	0	0	0	116.6
83	V	31.4	Very low	31.2	Very low	153 Å²	153	134.5 Å²	134.5	93%	0.927	80%	0.799	S	S	*	*			trans	-146.1	154.3	172.7	-175.6	0	0	0	0	113.1
84	H	30	Very low	31.4	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.856	80%	0.801	S	S	*	*			trans	-113.8	154.9	-170.5	-83.2	-69.3	0	0	0	117.3
85	S	30.4	Very low	31.3	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	79%	0.794	S	S	*	*			trans	179.3	126	137.6	54.6	0	0	0	0	110.5
86	Q	31.8	Very low	31.5	Very low	177 Å²	177	127.3 Å²	127.3	83%	0.827	79%	0.79	S	S	*	*				66.6	140.1	65.1	-66.8	-165.4	3.5	0	0	114.6
87	V	34.8	Very low	31.4	Very low	129 Å²	129	125 Å²	125	78%	0.782	78%	0.776	S	S	*	*			cis	-157.6	170.4	13.4	106.1	0	0	0	0	112.4
88	P	37.5	Very low	31.8	Very low	127 Å²	127	125.6 Å²	125.6	83%	0.825	77%	0.774	S	S	*	*			trans	-131	-166.8	-158.8	47.1	-34.9	0	0	0	119.6
89	G	34.6	Very low	32.1	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	77%	0.769	S	S	*	*			trans	170.8	179.9	164.2	0	0	0	0	0	111.9
90	I	33.8	Very low	32.4	Very low	182 Å²	182	125.1 Å²	125.1	93%	0.933	77%	0.768	S	S	*	*			cis	-171.7	158	-20	-90.2	165.3	0	0	0	105.1
91	G	32.2	Very low	32.5	Very low	66 Å²	66	126.5 Å²	126.5	68%	0.68	77%	0.771	S	S	*	*			cis	-171.2	-151.2	11	0	0	0	0	0	113.1
92	E	29.1	Very low	32.9	Very low	185 Å²	185	125.7 Å²	125.7	86%	0.864	77%	0.765	S	S	*	*			trans	-152.7	173.3	-160.7	-87.2	-153.6	69.8	0	0	115.5
93	S	29.3	Very low	33.1	Very low	84 Å²	84	126.5 Å²	126.5	59%	0.587	76%	0.763	S	S	*	*			cis	-175.7	160.9	-28	65.3	0	0	0	0	114.7
94	S	30.7	Very low	33.1	Very low	114 Å²	114	123.8 Å²	123.8	80%	0.797	75%	0.751	S	S	*	*			trans	74.8	136.6	150.4	73.3	0	0	0	0	127
95	A	30.7	Very low	33.7	Very low	93 Å²	93	120.3 Å²	120.3	77%	0.769	74%	0.744	S	S	*	*			trans	95	126.7	136.2	0	0	0	0	0	128.1
96	S	31.2	Very low	33.6	Very low	109 Å²	109	121.1 Å²	121.1	76%	0.762	74%	0.744	S	S	*	*			trans	67.9	116.8	137.8	59.8	0	0	0	0	128.7
97	L	30.1	Very low	33.5	Very low	122 Å²	122	118.4 Å²	118.4	64%	0.639	73%	0.734	S	S	*	*				35.6	160.8	121.1	-74.8	152.7	0	0	0	123.5	E467	L97-E467 WeakPolarHBondContact CA-OE2 3.49Å; L97-E467 VanDerWaalsContact CD2-OE2 3.32Å; L97-E467 WeakPolarHBondContact CD2-OE2 3.36Å
98	P	37	Very low	33.1	Very low	94 Å²	94	119.5 Å²	119.5	61%	0.61	73%	0.733	S	S	*	*			cis	-141.7	176	-20.4	41.8	-23	0	0	0	118.4
99	T	36.2	Very low	32.7	Very low	113 Å²	113	119.8 Å²	119.8	69%	0.693	73%	0.727	S	S	*	*			trans	8.9	158.7	149.4	64.3	0	0	0	0	124
100	P	36.4	Very low	32.4	Very low	117 Å²	117	123.5 Å²	123.5	76%	0.76	73%	0.726	S	S	*	*			cis	-158	177.2	39.4	45.8	-23.1	0	0	0	122.7
101	D	32.5	Very low	32.3	Very low	145 Å²	145	121.2 Å²	121.2	78%	0.775	72%	0.716	S	S	*	*			trans	43.3	141.4	147.8	-90.6	-29.3	0	0	0	128.1
102	M	38.8	Very low	32	Very low	148 Å²	148	123.9 Å²	123.9	73%	0.729	72%	0.719	S	S	*	*				172.2	137.8	114.1	-92.3	-66.8	162	0	0	117.1
103	N	36.8	Very low	32	Very low	134 Å²	134	118.7 Å²	118.7	72%	0.717	72%	0.715	S	S	*	*			trans	56.2	126.5	156.3	-63.1	-45.1	0	0	0	122.3
104	S	32.3	Very low	31.9	Very low	97 Å²	97	122 Å²	122	68%	0.678	73%	0.725	S	S	*	*			cis	91.1	156.7	30.7	88.7	0	0	0	0	115.1
105	P	41.2	Very low	31.7	Very low	111 Å²	111	124.6 Å²	124.6	72%	0.721	73%	0.727	S	S	*	*			cis	-140.6	-147.2	-30.2	34.7	-11.3	0	0	0	113.8
106	V	29.4	Very low	31.4	Very low	127 Å²	127	125.5 Å²	125.5	77%	0.77	73%	0.726	S	S	*	*			trans	84.4	142.6	153	145.3	0	0	0	0	119
107	I	29.1	Very low	31.2	Very low	120 Å²	120	123.9 Å²	123.9	62%	0.615	73%	0.727	S	S	*	*			cis	-168.9	148.8	-22.8	-150.1	176	0	0	0	113.4
108	M	27.2	Very low	31.1	Very low	152 Å²	152	123.7 Å²	123.7	75%	0.749	73%	0.73	S	S	*	*			trans	57.4	160.9	153.1	-77.8	161.7	-166.4	0	0	122.3
109	N	29.2	Very low	30.6	Very low	133 Å²	133	125.9 Å²	125.9	71%	0.711	74%	0.737	S	S	*	*			cis	-152.3	178.2	-8.2	-128.9	3.7	0	0	0	115.9
110	E	28	Very low	30.4	Very low	148 Å²	148	125.8 Å²	125.8	69%	0.692	74%	0.741	S	S	*	*			trans	-52.6	164.8	173.1	-48.9	169.6	150.6	0	0	116.1
111	N	29.9	Very low	30	Very low	133 Å²	133	126.7 Å²	126.7	71%	0.711	75%	0.745	S	S	*	*				-176.9	179.9	69.2	-122.8	-55.4	0	0	0	118.1
112	V	27.8	Very low	29.9	Very low	122 Å²	122	123.7 Å²	123.7	74%	0.739	75%	0.748	S	S	*	*			trans	-60.7	157.4	-170.8	170	0	0	0	0	118.6	L114	V112-L114 HydrophobicContact CG1-CD1 3.89Å
113	G	29.1	Very low	29.3	Very low	77 Å²	77	126.6 Å²	126.6	79%	0.794	76%	0.76	S	S	*	*			trans	-163.8	136.1	159.6	0	0	0	0	0	115.2
114	L	25.8	Very low	29	Very low	152 Å²	152	124.2 Å²	124.2	80%	0.796	77%	0.766	S	S	*	*			trans	-107.5	159.8	-179.7	-74.2	72.6	0	0	0	112.2	V112	V112-L114 HydrophobicContact CG1-CD1 3.89Å
115	M	26.2	Very low	28.6	Very low	170 Å²	170	128 Å²	128	84%	0.837	77%	0.773	S	S	*	*				165.1	168.2	110.5	-83	-148.5	80.8	0	0	115.9
116	C	24.6	Very low	28.1	Very low	112 Å²	112	132 Å²	132	76%	0.757	78%	0.783	S	S	*	*			trans	-59.9	169.2	-168.3	-54	0	0	0	0	118.9
117	G	28.3	Very low	27.8	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	78%	0.782	S	S	*	*			trans	-153.4	1	-177.6	0	0	0	0	0	121.3
118	V	27.7	Very low	27.7	Very low	117 Å²	117	137 Å²	137	71%	0.709	79%	0.79	S	S	*	*			trans	53.3	115.5	150.6	-167.5	0	0	0	0	122.4
119	N	27	Very low	27.6	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	79%	0.79	S	S	*	*			trans	42.8	135.6	142.6	-52.1	-9.7	0	0	0	125.3
120	S	31.4	Very low	27.4	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	80%	0.797	S	S	*	*				179.6	109.1	116.1	31.2	0	0	0	0	110.2
121	T	27.5	Very low	27.4	Very low	137 Å²	137	134.8 Å²	134.8	84%	0.84	80%	0.803	S	S	*	*				79.3	118.4	70	57.8	0	0	0	0	116.1
122	G	31.6	Very low	27.4	Very low	82 Å²	82	136.8 Å²	136.8	85%	0.845	81%	0.81	S	S	*	*			trans	-176	108.7	168.7	0	0	0	0	0	110.2
123	Q	26.2	Very low	27.5	Very low	209 Å²	209	139.3 Å²	139.3	98%	0.977	81%	0.806	S	S	*	*			trans	-104.1	163.1	-171.1	-69.8	177.3	-31.1	0	0	112.8
124	G	29.7	Very low	27.4	Very low	83 Å²	83	139.5 Å²	139.5	86%	0.856	80%	0.796	S	S	*	*			trans	176.1	78.3	172.7	0	0	0	0	0	113.4
125	Q	24.5	Very low	27.8	Very low	176 Å²	176	142.7 Å²	142.7	82%	0.822	80%	0.803	S	S	*	*			trans	-91	143.7	169.1	-72.9	-179.8	-34.7	0	0	110.8
126	Q	29	Very low	27.9	Very low	196 Å²	196	139.1 Å²	139.1	92%	0.916	80%	0.801	S	S	*	*			trans	-161.4	172.9	135.3	-110.3	169.6	39.8	0	0	111.1
127	F	25	Very low	28.2	Very low	172 Å²	172	146 Å²	146	75%	0.754	81%	0.811	S	S	*	*			trans	-111.3	169.7	-156.9	-90.9	-110.8	0	0	0	114.9
128	F	25.2	Very low	28.3	Very low	181 Å²	181	146 Å²	146	79%	0.794	81%	0.81	S	S	*	*			trans	92.7	135.4	155.4	-76	-71.4	0	0	0	122
129	T	25.1	Very low	28.4	Very low	121 Å²	121	150 Å²	150	74%	0.742	81%	0.813	S	S	*	*			trans	53.6	114.2	156.7	52.4	0	0	0	0	120.9
130	P	26.8	Very low	28.5	Very low	131 Å²	131	146.5 Å²	146.5	85%	0.851	81%	0.81	S	S	*	*			trans	-111	137.7	159.9	36.2	-26	0	0	0	113.2
131	T	28	Very low	28.6	Very low	133 Å²	133	152.2 Å²	152.2	82%	0.816	82%	0.815	S	S	*	*			trans	-135.8	139.7	171.6	-20.6	0	0	0	0	110.1
132	M	28.6	Very low	28.7	Very low	176 Å²	176	155.4 Å²	155.4	87%	0.867	82%	0.817	S	S	*	*			trans	8.5	141.6	166	-61.4	-59.7	176.2	0	0	119.9
133	R	29.7	Very low	28.7	Very low	174 Å²	174	156.2 Å²	156.2	66%	0.657	81%	0.81	S	S	*	*				-159.6	-170.8	50.5	-153.5	167.1	175.7	166.4	-2.4	113.4	E359	R133-E359 IonicContact CZ-OE2 3.27Å; R133-E359 VanDerWaalsContact CZ-OE2 3.27Å; R133-E359 IonicContact NE-OE2 3.01Å; R133-E359 PolarHBondContact NE-OE2 2.87Å; R133-E359 IonicContact NH2-OE2 2.69Å; R133-E359 PolarHBondContact NH2-OE2 3.3Å
134	S	28.2	Very low	29.2	Very low	82 Å²	82	152.1 Å²	152.1	57%	0.573	80%	0.804	S	S	*	*			trans	-91.2	163	-155.7	59.2	0	0	0	0	117.5
135	K	33.1	Very low	29.8	Very low	218 Å²	218	152.1 Å²	152.1	95%	0.948	79%	0.788	S	S	*	*			trans	-156.5	127.2	139.5	-108.7	168.9	-174.5	174.1	0	108.6
136	A	28.5	Very low	31	Very low	96 Å²	96	147.1 Å²	147.1	79%	0.793	77%	0.771	S	S	*	*			trans	-122.4	149.3	-160	0	0	0	0	0	115.2
137	R	32.3	Very low	31.9	Very low	256 Å²	256	143.5 Å²	143.5	97%	0.966	76%	0.757	S	S	*	*			trans	-167	138.8	160.5	-111.6	175.7	-176.8	-164	0.3	112.4
138	G	30.1	Very low	33.3	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	74%	0.738	S	S	*	*			trans	95.5	71.4	152.8	0	0	0	0	0	119.5
139	R	29.5	Very low	34.8	Very low	202 Å²	202	134.2 Å²	134.2	76%	0.762	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-52.5	131.5	175.8	-66.5	172.5	172.6	174.9	-6.2	114.7
140	G	28.3	Very low	36.4	Very low	68 Å²	68	131.4 Å²	131.4	70%	0.701	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-87.6	152.2	156.8	0	0	0	0	0	112
141	R	32.8	Very low	37.9	Very low	229 Å²	229	126.7 Å²	126.7	86%	0.864	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-103.3	129.6	179.7	-78	-178.4	166.7	172.2	-5.4	112
142	F	30.4	Very low	39.5	Very low	204 Å²	204	122.9 Å²	122.9	90%	0.895	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-67.3	147.2	-179.1	-73.3	-98	0	0	0	113.4
143	S	30.8	Very low	41.1	Very low	100 Å²	100	122.1 Å²	122.1	70%	0.699	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-79.3	142.8	156.6	50.3	0	0	0	0	110	V145	S143-V145 PolarHBondContact O-N 3.14Å
144	S	37.2	Very low	42.5	Very low	122 Å²	122	119.6 Å²	119.6	85%	0.853	63%	0.631	S	S	*	*			trans	-74.8	96.5	177.3	55.2	0	0	0	0	110.7
145	V	43.3	Very low	44	Very low	83 Å²	83	116.1 Å²	116.1	50%	0.503	61%	0.606	S	S	.	*			trans	-62.3	138.7	161.7	-178.3	0	0	0	0	108.1	S143 D149 V150	S143-V145 PolarHBondContact O-N 3.14Å; V145-D149 HydrophobicContact CG1-CB 3.65Å; V145-V150 HydrophobicContact CB-CG2 3.91Å; V145-V150 HydrophobicContact CG1-CG2 3.74Å
146	P	49.6	Very low	45.3	Very low	72 Å²	72	114.5 Å²	114.5	47%	0.468	59%	0.594	S	S	.	*			trans	-51.3	142.3	174.3	-28.5	36	0	0	0	112.4	D148 D149 V150	P146-D148 PolarHBondContact O-N 2.96Å; P146-D149 HydrophobicContact CB-CB 4.3Å; P146-D149 VanDerWaalsContact CD-OD2 3.29Å; P146-D149 WeakPolarHBondContact CD-OD2 3.44Å; P146-D149 VanDerWaalsContact CG-OD2 3.3Å; P146-D149 WeakPolarHBondContact CG-OD2 3.47Å; P146-D149 PolarHBondContact O-N 3.3Å; P146-D149 VanDerWaalsContact O-N 3.14Å; P146-V150 PolarHBondContact O-N 2.88Å; P146-V150 VanDerWaalsContact O-N 3.16Å
147	L	46.9	Very low	46.7	Very low	119 Å²	119	115.1 Å²	115.1	62%	0.623	59%	0.588	S	S	*	*	H	α-helix	trans	-61	-36.6	-178.7	-163.5	75.1	0	0	0	111.1	V150 M151	L147-V150 PolarHBondContact O-N 2.75Å; L147-M151 HydrophobicContact CG-CG 4.32Å; L147-M151 WeakPolarHBondContact O-CB 3.44Å; L147-M151 WeakPolarHBondContact O-CG 3.28Å; L147-M151 PolarHBondContact O-N 3.17Å
148	D	54.5	Low	47.9	Very low	66 Å²	66	110.4 Å²	110.4	35%	0.353	57%	0.572	S	S	.	*	H	α-helix	trans	-62.8	-42.5	175.4	-63.1	-70.8	0	0	0	112.5	P146 V150 M151 E152	P146-D148 PolarHBondContact O-N 2.96Å; D148-V150 VanDerWaalsContact C-N 3.31Å; D148-V150 PolarHBondContact O-N 2.84Å; D148-M151 PolarHBondContact O-N 3.25Å; D148-E152 WeakPolarHBondContact O-CB 3.26Å; D148-E152 PolarHBondContact O-N 3.07Å
149	D	58.1	Low	48.7	Very low	92 Å²	92	114.6 Å²	114.6	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-63.2	-36.1	175.2	-77	-32.3	0	0	0	112.3	V145 P146 K153	V145-D149 HydrophobicContact CG1-CB 3.65Å; P146-D149 HydrophobicContact CB-CB 4.3Å; P146-D149 VanDerWaalsContact CD-OD2 3.29Å; P146-D149 WeakPolarHBondContact CD-OD2 3.44Å; P146-D149 VanDerWaalsContact CG-OD2 3.3Å; P146-D149 WeakPolarHBondContact CG-OD2 3.47Å; P146-D149 PolarHBondContact O-N 3.3Å; P146-D149 VanDerWaalsContact O-N 3.14Å; D149-K153 WeakPolarHBondContact O-CB 3.44Å; D149-K153 PolarHBondContact O-N 3.23Å
150	V	57.8	Low	49.9	Very low	63 Å²	63	107.9 Å²	107.9	38%	0.382	57%	0.565	S	S	.	*	H	α-helix	trans	-71.6	-43.9	177.3	177.6	0	0	0	0	111.1	V145 P146 L147 D148 K154	V145-V150 HydrophobicContact CB-CG2 3.91Å; V145-V150 HydrophobicContact CG1-CG2 3.74Å; P146-V150 PolarHBondContact O-N 2.88Å; P146-V150 VanDerWaalsContact O-N 3.16Å; L147-V150 PolarHBondContact O-N 2.75Å; D148-V150 VanDerWaalsContact C-N 3.31Å; D148-V150 PolarHBondContact O-N 2.84Å; V150-K154 PolarHBondContact O-N 3.09Å
151	M	57.3	Low	51.1	Low	32 Å²	32	113.1 Å²	113.1	16%	0.158	57%	0.568	C	S	.	*	H	α-helix	trans	-67.8	-41.9	177.6	-67.1	-74.7	-74.3	0	0	111	L147 D148 K154 I155 N183 T187	L147-M151 HydrophobicContact CG-CG 4.32Å; L147-M151 WeakPolarHBondContact O-CB 3.44Å; L147-M151 WeakPolarHBondContact O-CG 3.28Å; L147-M151 PolarHBondContact O-N 3.17Å; D148-M151 PolarHBondContact O-N 3.25Å; M151-K154 WeakPolarHBondContact O-CB 3.43Å; M151-K154 PolarHBondContact O-N 2.82Å; M151-K154 VanDerWaalsContact O-N 3.14Å; M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.49Å; M151-I155 PolarHBondContact O-N 2.89Å; M151-N183 HydrophobicContact CE-CB 4.43Å; M151-N183 WeakPolarHBondContact CE-O 3.49Å; M151-T187 HydrophobicContact CE-CG2 4.03Å; M151-T187 WeakPolarHBondContact CE-OG1 3.35Å
152	E	61.9	Low	52.8	Low	52 Å²	52	107.1 Å²	107.1	24%	0.243	55%	0.554	C	S	.	*	H	α-helix	trans	-71.2	-32.6	178.7	-170.5	163.8	155.4	0	0	112	D148 R156 R179	D148-E152 WeakPolarHBondContact O-CB 3.26Å; D148-E152 PolarHBondContact O-N 3.07Å; E152-R156 WeakPolarHBondContact O-CB 3.26Å; E152-R156 WeakPolarHBondContact O-CD 3.28Å; E152-R156 WeakPolarHBondContact O-CG 3.43Å; E152-R156 PolarHBondContact O-N 2.92Å; E152-R156 IonicContact OE1-CZ 3.71Å; E152-R156 IonicContact OE1-NE 3.65Å; E152-R156 PolarHBondContact OE1-NE 3.32Å; E152-R156 IonicContact OE1-NH2 2.75Å; E152-R156 PolarHBondContact OE1-NH2 3.23Å; E152-R179 IonicContact OE1-NH2 3.88Å; E152-R179 IonicContact OE2-CZ 3.73Å; E152-R179 IonicContact OE2-NH2 2.75Å; E152-R179 PolarHBondContact OE2-NH2 3.04Å
153	K	62.1	Low	54.7	Low	160 Å²	160	98.5 Å²	98.5	70%	0.696	52%	0.518	S	S	*	.	H	α-helix	trans	-59.8	-48.6	163.9	-96.9	-170.7	170.6	-175.1	0	111.8	D149 I155 R156 T157	D149-K153 WeakPolarHBondContact O-CB 3.44Å; D149-K153 PolarHBondContact O-N 3.23Å; K153-I155 PolarHBondContact O-N 3.11Å; K153-R156 CarbonylContact O-C 3.54Å; K153-R156 PolarHBondContact O-N 3.48Å; K153-R156 VanDerWaalsContact O-N 3.16Å; K153-T157 WeakPolarHBondContact O-CG2 3.23Å; K153-T157 PolarHBondContact O-N 2.8Å; K153-T157 PolarHBondContact O-OG1 3.36Å
154	K	60	Low	56.7	Low	121 Å²	121	97.7 Å²	97.7	53%	0.526	51%	0.509	S	S	.	.	H	α-helix	trans	-58.1	-48.3	178.9	-78.3	-169.1	171.9	-163.8	0	112.3	V150 M151 R156 T157 Y158	V150-K154 PolarHBondContact O-N 3.09Å; M151-K154 WeakPolarHBondContact O-CB 3.43Å; M151-K154 PolarHBondContact O-N 2.82Å; M151-K154 VanDerWaalsContact O-N 3.14Å; K154-R156 VanDerWaalsContact C-N 3.26Å; K154-R156 PolarHBondContact O-N 3.16Å; K154-T157 WeakPolarHBondContact CA-OG1 3.49Å; K154-T157 PolarHBondContact O-N 3.41Å; K154-T157 PolarHBondContact O-OG1 3.06Å; K154-Y158 PolarHBondContact O-N 2.93Å
155	I	60.1	Low	58.7	Low	9 Å²	9	97.3 Å²	97.3	5%	0.046	49%	0.493	C	S	.	.	H	α-helix	trans	-63.6	-29.6	178	-65.6	162	0	0	0	111.8	M151 K153 L167 L191	M151-I155 VanDerWaalsContact O-CG1 3.29Å; M151-I155 WeakPolarHBondContact O-CG1 3.49Å; M151-I155 PolarHBondContact O-N 2.89Å; K153-I155 PolarHBondContact O-N 3.11Å; I155-L167 HydrophobicContact CD1-CD2 4.28Å; I155-L167 HydrophobicContact CG2-CD2 4.46Å; I155-L191 HydrophobicContact CG1-CD2 4.24Å
156	R	58.8	Low	60.7	Low	184 Å²	184	95.5 Å²	95.5	69%	0.694	48%	0.479	S	S	*	.	H	α-helix	trans	-83.3	-8.3	173.1	-69.3	170.9	-176.7	-128.9	11.2	114.3	E152 K153 K154	E152-R156 WeakPolarHBondContact O-CB 3.26Å; E152-R156 WeakPolarHBondContact O-CD 3.28Å; E152-R156 WeakPolarHBondContact O-CG 3.43Å; E152-R156 PolarHBondContact O-N 2.92Å; E152-R156 IonicContact OE1-CZ 3.71Å; E152-R156 IonicContact OE1-NE 3.65Å; E152-R156 PolarHBondContact OE1-NE 3.32Å; E152-R156 IonicContact OE1-NH2 2.75Å; E152-R156 PolarHBondContact OE1-NH2 3.23Å; K153-R156 CarbonylContact O-C 3.54Å; K153-R156 PolarHBondContact O-N 3.48Å; K153-R156 VanDerWaalsContact O-N 3.16Å; K154-R156 VanDerWaalsContact C-N 3.26Å; K154-R156 PolarHBondContact O-N 3.16Å
157	T	59.8	Low	62.3	Low	109 Å²	109	92.6 Å²	92.6	67%	0.669	46%	0.46	S	S	*	.	H	α-helix	trans	-110.7	-17	178.4	51.9	0	0	0	0	114.3	K153 K154	K153-T157 WeakPolarHBondContact O-CG2 3.23Å; K153-T157 PolarHBondContact O-N 2.8Å; K153-T157 PolarHBondContact O-OG1 3.36Å; K154-T157 WeakPolarHBondContact CA-OG1 3.49Å; K154-T157 PolarHBondContact O-N 3.41Å; K154-T157 PolarHBondContact O-OG1 3.06Å
158	Y	56.4	Low	64.1	Low	157 Å²	157	88.5 Å²	88.5	62%	0.616	45%	0.446	S	S	*	.	S	Bend	trans	-94.6	105.7	166.8	-94.1	-97.5	0	0	0	109.4	K154 L191	K154-Y158 PolarHBondContact O-N 2.93Å; Y158-L191 HydrophobicContact CG-CD1 4.48Å
159	E	47.4	Very low	65.8	Low	163 Å²	163	90.1 Å²	90.1	76%	0.762	45%	0.451	S	S	*	.	S	Bend	trans	45	114.3	154.8	-60.9	-177.5	159.1	0	0	119.5	C163	E159-C163 PolarHBondContact O-SG 3.05Å
160	G	54.3	Low	67.3	Low	60 Å²	60	85.8 Å²	85.8	62%	0.619	43%	0.427	S	S	*	.			trans	88	154.6	154.1	0	0	0	0	0	117	D162	G160-D162 VanDerWaalsContact C-N 3.26Å
161	K	54.5	Low	68.8	Low	179 Å²	179	85.3 Å²	85.3	78%	0.778	42%	0.422	S	S	*	.	S	Bend	trans	-72.6	-24.8	167.9	-72.6	178.2	178.3	173.6	0	111.5	V164	K161-V164 PolarHBondContact O-N 2.86Å
162	D	68.1	Low	70.3	Confident	103 Å²	103	92.4 Å²	92.4	55%	0.551	45%	0.452	S	S	*	.	H	α-helix	trans	-73	-39.1	-170.5	-55.8	-41.2	0	0	0	112	G160 V164 Q165 E166	G160-D162 VanDerWaalsContact C-N 3.26Å; D162-V164 PolarHBondContact O-N 3.29Å; D162-Q165 CarbonylContact O-C 3.54Å; D162-Q165 WeakPolarHBondContact O-CA 3.48Å; D162-Q165 WeakPolarHBondContact O-CB 3.46Å; D162-Q165 PolarHBondContact O-N 3.28Å; D162-Q165 PolarHBondContact OD1-NE2 2.91Å; D162-E166 WeakPolarHBondContact O-CG 3.32Å; D162-E166 PolarHBondContact O-N 2.82Å
163	C	70.2	Confident	71.7	Confident	23 Å²	23	94 Å²	94	16%	0.155	46%	0.462	C	S	.	.	H	α-helix	trans	-52.2	-30.9	175	-67.6	0	0	0	0	113.8	E159 L167 F186	E159-C163 PolarHBondContact O-SG 3.05Å; C163-L167 WeakPolarHBondContact O-CB 3.49Å; C163-L167 PolarHBondContact O-N 3.44Å; C163-F186 WeakPolarHBondContact O-CE1 3.33Å
164	V	73.2	Confident	73	Confident	82 Å²	82	86.9 Å²	86.9	50%	0.497	43%	0.431	S	S	.	.	H	α-helix	trans	-77.7	-34.7	175.1	-176.4	0	0	0	0	111.9	K161 D162 G168	K161-V164 PolarHBondContact O-N 2.86Å; D162-V164 PolarHBondContact O-N 3.29Å; V164-G168 PolarHBondContact O-N 2.86Å; V164-G168 VanDerWaalsContact O-N 3.13Å
165	Q	78.6	Confident	74.3	Confident	114 Å²	114	86 Å²	86	53%	0.533	44%	0.438	S	S	.	.	H	α-helix	trans	-70.6	-44.3	173.2	-59.4	-172.7	51.7	0	0	111.7	D162 L167 G168 K169	D162-Q165 CarbonylContact O-C 3.54Å; D162-Q165 WeakPolarHBondContact O-CA 3.48Å; D162-Q165 WeakPolarHBondContact O-CB 3.46Å; D162-Q165 PolarHBondContact O-N 3.28Å; D162-Q165 PolarHBondContact OD1-NE2 2.91Å; Q165-L167 PolarHBondContact O-N 2.85Å; Q165-G168 CarbonylContact O-C 3.56Å; Q165-G168 VanDerWaalsContact O-CA 3.3Å; Q165-G168 WeakPolarHBondContact O-CA 3.37Å; Q165-G168 PolarHBondContact O-N 2.98Å; Q165-K169 PolarHBondContact O-N 2.88Å
166	E	84.8	Confident	75.3	Confident	45 Å²	45	92 Å²	92	21%	0.21	46%	0.46	C	S	.	.	H	α-helix	trans	-58.2	-47.5	176.6	-64.1	-64	67.2	0	0	111.2	D162 G168 K169 L170 F186 Y193	D162-E166 WeakPolarHBondContact O-CG 3.32Å; D162-E166 PolarHBondContact O-N 2.82Å; E166-G168 VanDerWaalsContact C-N 3.26Å; E166-G168 PolarHBondContact O-N 3.48Å; E166-K169 WeakPolarHBondContact O-CB 2.95Å; E166-K169 PolarHBondContact O-N 3.1Å; E166-K169 VanDerWaalsContact O-N 3.15Å; E166-K169 VanDerWaalsContact OE1-CD 3.31Å; E166-K169 WeakPolarHBondContact OE1-CD 3.08Å; E166-K169 WeakPolarHBondContact OE1-CE 3.45Å; E166-K169 IonicContact OE1-NZ 3.38Å; E166-K169 PolarHBondContact OE1-NZ 3.39Å; E166-L170 WeakPolarHBondContact O-CG 3.14Å; E166-L170 PolarHBondContact O-N 3.37Å; E166-F186 HydrophobicContact CB-CE2 4.15Å; E166-F186 HydrophobicContact CB-CZ 3.91Å; E166-Y193 HydrophobicContact CB-CD2 4.12Å; E166-Y193 WeakPolarHBondContact OE2-CB 3.13Å
167	L	84.6	Confident	76.7	Confident	11 Å²	11	85.4 Å²	85.4	6%	0.058	44%	0.436	C	S	.	.	H	α-helix	trans	-60	-37.5	172.4	-174.8	67.1	0	0	0	111.7	I155 C163 Q165 L170 L171 I182 F186	I155-L167 HydrophobicContact CD1-CD2 4.28Å; I155-L167 HydrophobicContact CG2-CD2 4.46Å; C163-L167 WeakPolarHBondContact O-CB 3.49Å; C163-L167 PolarHBondContact O-N 3.44Å; Q165-L167 PolarHBondContact O-N 2.85Å; L167-L170 PolarHBondContact O-N 2.87Å; L167-L171 HydrophobicContact CG-CD1 4.03Å; L167-L171 WeakPolarHBondContact O-CB 3.26Å; L167-L171 WeakPolarHBondContact O-CD1 3.41Å; L167-L171 VanDerWaalsContact O-CG 3.25Å; L167-L171 WeakPolarHBondContact O-CG 3.37Å; L167-L171 PolarHBondContact O-N 2.92Å; L167-I182 HydrophobicContact CD1-CG2 3.97Å; L167-F186 HydrophobicContact CB-CD1 4.31Å; L167-F186 HydrophobicContact CB-CE1 4.07Å; L167-F186 HydrophobicContact CD1-CB 4.26Å; L167-F186 HydrophobicContact CD1-CD1 3.89Å; L167-F186 HydrophobicContact CD1-CE1 4.5Å; L167-F186 HydrophobicContact CD1-CG 4.17Å
168	G	84.8	Confident	77.9	Confident	33 Å²	33	85.8 Å²	85.8	34%	0.34	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-37.7	173.7	0	0	0	0	0	114	V164 Q165 E166 K172	V164-G168 PolarHBondContact O-N 2.86Å; V164-G168 VanDerWaalsContact O-N 3.13Å; Q165-G168 CarbonylContact O-C 3.56Å; Q165-G168 VanDerWaalsContact O-CA 3.3Å; Q165-G168 WeakPolarHBondContact O-CA 3.37Å; Q165-G168 PolarHBondContact O-N 2.98Å; E166-G168 VanDerWaalsContact C-N 3.26Å; E166-G168 PolarHBondContact O-N 3.48Å; G168-K172 PolarHBondContact O-N 3.39Å
169	K	88.2	Confident	79.2	Confident	101 Å²	101	83.1 Å²	83.1	44%	0.439	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-50.5	172	-65.8	174.6	-168.3	169.1	0	110.4	Q165 E166 L171 K172 L173 Y193	Q165-K169 PolarHBondContact O-N 2.88Å; E166-K169 WeakPolarHBondContact O-CB 2.95Å; E166-K169 PolarHBondContact O-N 3.1Å; E166-K169 VanDerWaalsContact O-N 3.15Å; E166-K169 VanDerWaalsContact OE1-CD 3.31Å; E166-K169 WeakPolarHBondContact OE1-CD 3.08Å; E166-K169 WeakPolarHBondContact OE1-CE 3.45Å; E166-K169 IonicContact OE1-NZ 3.38Å; E166-K169 PolarHBondContact OE1-NZ 3.39Å; K169-L171 VanDerWaalsContact C-N 3.32Å; K169-L171 PolarHBondContact O-N 3.02Å; K169-K172 PolarHBondContact O-N 3.47Å; K169-L173 WeakPolarHBondContact O-CG 3.32Å; K169-L173 PolarHBondContact O-N 3.47Å; K169-Y193 HydrophobicContact CB-CD2 4.5Å; K169-Y193 HydrophobicContact CB-CE2 3.65Å; K169-Y193 HydrophobicContact CD-CE2 4Å
170	L	91.3	Very high	80.7	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-58.9	-41.2	178.9	-65.8	173.6	0	0	0	112.2	E166 L167 K172 L173 F174 I182 F186 Y193 L200	E166-L170 WeakPolarHBondContact O-CG 3.14Å; E166-L170 PolarHBondContact O-N 3.37Å; L167-L170 PolarHBondContact O-N 2.87Å; L170-K172 VanDerWaalsContact C-N 3.29Å; L170-K172 PolarHBondContact O-N 3Å; L170-L173 PolarHBondContact O-N 2.72Å; L170-F174 HydrophobicContact CD2-CD2 4.22Å; L170-F174 HydrophobicContact CD2-CE2 3.91Å; L170-F174 WeakPolarHBondContact O-CD2 3.43Å; L170-F174 PolarHBondContact O-N 3.15Å; L170-I182 HydrophobicContact CB-CG2 3.97Å; L170-F186 HydrophobicContact CD1-CD2 3.54Å; L170-F186 HydrophobicContact CD1-CE2 4.02Å; L170-F186 HydrophobicContact CD1-CG 4.26Å; L170-Y193 HydrophobicContact CD1-CD2 4.27Å; L170-Y193 HydrophobicContact CD2-CD2 3.8Å; L170-Y193 HydrophobicContact CD2-CE2 3.62Å; L170-Y193 HydrophobicContact CG-CD2 3.77Å; L170-Y193 HydrophobicContact CG-CE2 3.82Å; L170-L200 HydrophobicContact CD2-CD1 4.37Å
171	L	89.1	Confident	82.2	Confident	53 Å²	53	78.8 Å²	78.8	28%	0.277	39%	0.386	S	S	.	.	H	α-helix	trans	-66.1	-26	176.3	-74.3	163.4	0	0	0	113.8	L167 K169 R179 I182	L167-L171 HydrophobicContact CG-CD1 4.03Å; L167-L171 WeakPolarHBondContact O-CB 3.26Å; L167-L171 WeakPolarHBondContact O-CD1 3.41Å; L167-L171 VanDerWaalsContact O-CG 3.25Å; L167-L171 WeakPolarHBondContact O-CG 3.37Å; L167-L171 PolarHBondContact O-N 2.92Å; K169-L171 VanDerWaalsContact C-N 3.32Å; K169-L171 PolarHBondContact O-N 3.02Å; L171-R179 VanDerWaalsContact CD1-NH1 3.28Å; L171-R179 HydrophobicContact CD2-CB 4.08Å; L171-R179 HydrophobicContact CD2-CG 4.2Å; L171-I182 HydrophobicContact CD2-CB 4.45Å; L171-I182 HydrophobicContact CD2-CD1 3.81Å; L171-I182 HydrophobicContact CD2-CG2 4.41Å; L171-I182 HydrophobicContact CG-CG2 4.44Å
172	K	89.1	Confident	83.9	Confident	182 Å²	182	70.3 Å²	70.3	79%	0.791	35%	0.349	S	S	*	.	H	α-helix	trans	-80.4	-36.7	170.9	-81.3	-171.8	173	-175	0	113	G168 K169 L170	G168-K172 PolarHBondContact O-N 3.39Å; K169-K172 PolarHBondContact O-N 3.47Å; L170-K172 VanDerWaalsContact C-N 3.29Å; L170-K172 PolarHBondContact O-N 3Å
173	L	89.6	Confident	84.6	Confident	84 Å²	84	65.5 Å²	65.5	44%	0.44	32%	0.323	S	S	.	.	H	α-helix	trans	-76.6	-30.7	-175.1	-71.4	163.9	0	0	0	113.2	K169 L170 P175 Y193 Y197	K169-L173 WeakPolarHBondContact O-CG 3.32Å; K169-L173 PolarHBondContact O-N 3.47Å; L170-L173 PolarHBondContact O-N 2.72Å; L173-P175 VanDerWaalsContact O-CD 3.27Å; L173-P175 WeakPolarHBondContact O-CD 3.46Å; L173-Y193 HydrophobicContact CD1-CE2 4.48Å; L173-Y193 WeakPolarHBondContact CD1-OH 3.47Å; L173-Y197 HydrophobicContact CD1-CD2 4Å; L173-Y197 HydrophobicContact CD1-CE2 4.03Å
174	F	91.4	Very high	85.2	Confident	11 Å²	11	72.4 Å²	72.4	5%	0.048	35%	0.346	C	S	.	.			trans	-121.6	55.1	-170.7	-61.7	-68.1	0	0	0	114.2	L170 R176 F177 I182 Y197 L200 K201	L170-F174 HydrophobicContact CD2-CD2 4.22Å; L170-F174 HydrophobicContact CD2-CE2 3.91Å; L170-F174 WeakPolarHBondContact O-CD2 3.43Å; L170-F174 PolarHBondContact O-N 3.15Å; F174-R176 PolarHBondContact O-N 3.12Å; F174-R176 VanDerWaalsContact O-N 3.07Å; F174-F177 HydrophobicContact CB-CD2 3.99Å; F174-F177 PolarHBondContact O-N 3.17Å; F174-I182 HydrophobicContact CB-CD1 4.29Å; F174-Y197 AromaticContact CE2-CD2 3.66Å; F174-Y197 HydrophobicContact CE2-CD2 3.66Å; F174-Y197 HydrophobicContact CE2-CE2 4.26Å; F174-Y197 HydrophobicContact CE2-CG 4.46Å; F174-Y197 AromaticContact CZ-CD2 3.61Å; F174-Y197 HydrophobicContact CZ-CD2 3.61Å; F174-Y197 AromaticContact CZ-CE2 3.88Å; F174-Y197 HydrophobicContact CZ-CE2 3.88Å; F174-Y197 HydrophobicContact CZ-CG 4.36Å; F174-L200 HydrophobicContact CD1-CB 3.85Å; F174-L200 HydrophobicContact CD2-CB 3.66Å; F174-L200 HydrophobicContact CD2-CD1 3.64Å; F174-L200 HydrophobicContact CD2-CG 4.26Å; F174-L200 HydrophobicContact CE1-CB 3.79Å; F174-L200 HydrophobicContact CE2-CB 3.58Å; F174-L200 HydrophobicContact CE2-CD1 4.05Å; F174-L200 HydrophobicContact CE2-CG 4.47Å; F174-L200 HydrophobicContact CG-CB 3.79Å; F174-L200 HydrophobicContact CG-CD1 4.2Å; F174-L200 HydrophobicContact CG-CG 4.5Å; F174-L200 HydrophobicContact CZ-CB 3.65Å; F174-K201 HydrophobicContact CE1-CB 4.19Å; F174-K201 HydrophobicContact CZ-CB 4.14Å
175	P	86.4	Confident	85.9	Confident	103 Å²	103	68.8 Å²	68.8	67%	0.669	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.6	-172.7	28.5	-36.8	0	0	0	114.8	L173 F177	L173-P175 VanDerWaalsContact O-CD 3.27Å; L173-P175 WeakPolarHBondContact O-CD 3.46Å; P175-F177 VanDerWaalsContact C-N 3.27Å; P175-F177 PolarHBondContact O-N 3.46Å
176	R	81.3	Confident	86.4	Confident	135 Å²	135	63.3 Å²	63.3	51%	0.509	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-18.1	174.2	-65.3	176.6	77.2	-155.2	9.3	112.9	F174 D204	F174-R176 PolarHBondContact O-N 3.12Å; F174-R176 VanDerWaalsContact O-N 3.07Å; R176-D204 WeakPolarHBondContact CD-OD1 3.44Å; R176-D204 IonicContact CZ-OD1 3.34Å; R176-D204 IonicContact NE-OD1 2.67Å; R176-D204 IonicContact NH1-OD1 3.9Å; R176-D204 PolarHBondContact NH1-OD1 3.28Å
177	F	87.6	Confident	86.3	Confident	45 Å²	45	63.4 Å²	63.4	20%	0.197	30%	0.302	C	S	.	.	S	Bend	trans	-100.4	144.5	-179	-64.3	-93.3	0	0	0	112.4	F174 P175 Y181 I182 L200 E203 D204	F174-F177 HydrophobicContact CB-CD2 3.99Å; F174-F177 PolarHBondContact O-N 3.17Å; P175-F177 VanDerWaalsContact C-N 3.27Å; P175-F177 PolarHBondContact O-N 3.46Å; F177-Y181 HydrophobicContact CB-CD1 4.35Å; F177-Y181 AromaticContact CD1-CD1 3.47Å; F177-Y181 HydrophobicContact CD1-CD1 3.47Å; F177-Y181 VanDerWaalsContact CD1-CD1 3.47Å; F177-Y181 AromaticContact CD1-CE1 3.78Å; F177-Y181 HydrophobicContact CD1-CE1 3.78Å; F177-Y181 HydrophobicContact CD1-CG 4.4Å; F177-Y181 HydrophobicContact CE1-CD1 4.14Å; F177-Y181 AromaticContact CE1-CE1 3.95Å; F177-Y181 HydrophobicContact CE1-CE1 3.95Å; F177-Y181 HydrophobicContact CG-CD1 4.24Å; F177-I182 HydrophobicContact CB-CD1 4.04Å; F177-I182 HydrophobicContact CB-CG1 3.98Å; F177-L200 HydrophobicContact CD1-CD2 4.29Å; F177-L200 HydrophobicContact CD2-CD2 4.31Å; F177-L200 HydrophobicContact CE1-CD2 4.47Å; F177-L200 HydrophobicContact CE2-CD2 4.48Å; F177-L200 HydrophobicContact CG-CD2 4.19Å; F177-E203 HydrophobicContact CE1-CB 4.42Å; F177-E203 HydrophobicContact CE1-CG 4.01Å; F177-E203 HydrophobicContact CZ-CB 4.01Å; F177-E203 HydrophobicContact CZ-CG 4.02Å; F177-D204 HydrophobicContact CE2-CB 4.02Å; F177-D204 HydrophobicContact CZ-CB 4.47Å
178	K	84.3	Confident	86.3	Confident	117 Å²	117	71.9 Å²	71.9	51%	0.509	33%	0.334	S	S	.	.			trans	-64	144.1	173.4	-68.8	178.2	177.9	172.6	0	111.1	A180 Y181 I182 P251	K178-A180 PolarHBondContact O-N 3.24Å; K178-Y181 WeakPolarHBondContact O-CA 3.25Å; K178-Y181 WeakPolarHBondContact O-CB 3.35Å; K178-Y181 PolarHBondContact O-N 3.48Å; K178-I182 PolarHBondContact O-N 3.04Å; K178-I182 VanDerWaalsContact O-N 3.08Å; K178-P251 VanDerWaalsContact CE-CB 3.48Å
179	R	85	Confident	86.4	Confident	101 Å²	101	71.4 Å²	71.4	38%	0.381	32%	0.323	S	S	.	.	H	α-helix	trans	-47.2	-45.5	167.3	177.1	178.1	176.1	83.6	-7.2	112.3	E152 L171 Y181 I182 N183	E152-R179 IonicContact OE1-NH2 3.88Å; E152-R179 IonicContact OE2-CZ 3.73Å; E152-R179 IonicContact OE2-NH2 2.75Å; E152-R179 PolarHBondContact OE2-NH2 3.04Å; L171-R179 VanDerWaalsContact CD1-NH1 3.28Å; L171-R179 HydrophobicContact CD2-CB 4.08Å; L171-R179 HydrophobicContact CD2-CG 4.2Å; R179-Y181 PolarHBondContact O-N 2.92Å; R179-I182 PolarHBondContact O-N 2.99Å; R179-N183 VanDerWaalsContact O-CB 3.31Å; R179-N183 WeakPolarHBondContact O-CB 3.42Å; R179-N183 PolarHBondContact O-N 3.23Å; R179-N183 PolarHBondContact O-OD1 2.87Å
180	A	78.1	Confident	86.1	Confident	47 Å²	47	74.3 Å²	74.3	39%	0.388	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-20.7	177.8	0	0	0	0	0	114.4	K178 R184	K178-A180 PolarHBondContact O-N 3.24Å; A180-R184 WeakPolarHBondContact O-CB 3.46Å
181	Y	86.2	Confident	85.7	Confident	85 Å²	85	75.9 Å²	75.9	33%	0.333	35%	0.348	S	S	.	.	H	α-helix	trans	-82.1	-49.9	171.2	-168.3	-106.1	0	0	0	111.1	F177 K178 R179 N183 R184 V185 L200 E203	F177-Y181 HydrophobicContact CB-CD1 4.35Å; F177-Y181 AromaticContact CD1-CD1 3.47Å; F177-Y181 HydrophobicContact CD1-CD1 3.47Å; F177-Y181 VanDerWaalsContact CD1-CD1 3.47Å; F177-Y181 AromaticContact CD1-CE1 3.78Å; F177-Y181 HydrophobicContact CD1-CE1 3.78Å; F177-Y181 HydrophobicContact CD1-CG 4.4Å; F177-Y181 HydrophobicContact CE1-CD1 4.14Å; F177-Y181 AromaticContact CE1-CE1 3.95Å; F177-Y181 HydrophobicContact CE1-CE1 3.95Å; F177-Y181 HydrophobicContact CG-CD1 4.24Å; K178-Y181 WeakPolarHBondContact O-CA 3.25Å; K178-Y181 WeakPolarHBondContact O-CB 3.35Å; K178-Y181 PolarHBondContact O-N 3.48Å; R179-Y181 PolarHBondContact O-N 2.92Å; Y181-N183 VanDerWaalsContact C-N 3.34Å; Y181-N183 PolarHBondContact O-N 2.75Å; Y181-R184 CarbonylContact O-C 3.51Å; Y181-R184 WeakPolarHBondContact O-CA 3.43Å; Y181-R184 VanDerWaalsContact O-CB 3.27Å; Y181-R184 WeakPolarHBondContact O-CB 3.38Å; Y181-R184 PolarHBondContact O-N 3.16Å; Y181-V185 HydrophobicContact CD1-CG2 4.03Å; Y181-V185 HydrophobicContact CE1-CG2 3.66Å; Y181-V185 PolarHBondContact O-N 3.09Å; Y181-L200 HydrophobicContact CD1-CD2 4.08Å; Y181-L200 HydrophobicContact CE1-CD2 4.07Å; Y181-E203 WeakPolarHBondContact CE1-OE2 3.42Å; Y181-E203 VanDerWaalsContact CZ-OE2 3.3Å; Y181-E203 PolarHBondContact OH-OE2 3.26Å
182	I	89.4	Confident	85.4	Confident	1 Å²	1	75 Å²	75	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-58.5	-45.4	178.3	-65	166.2	0	0	0	110.6	L167 L170 L171 F174 F177 K178 R179 R184 V185 F186 L200	L167-I182 HydrophobicContact CD1-CG2 3.97Å; L170-I182 HydrophobicContact CB-CG2 3.97Å; L171-I182 HydrophobicContact CD2-CB 4.45Å; L171-I182 HydrophobicContact CD2-CD1 3.81Å; L171-I182 HydrophobicContact CD2-CG2 4.41Å; L171-I182 HydrophobicContact CG-CG2 4.44Å; F174-I182 HydrophobicContact CB-CD1 4.29Å; F177-I182 HydrophobicContact CB-CD1 4.04Å; F177-I182 HydrophobicContact CB-CG1 3.98Å; K178-I182 PolarHBondContact O-N 3.04Å; K178-I182 VanDerWaalsContact O-N 3.08Å; R179-I182 PolarHBondContact O-N 2.99Å; I182-R184 PolarHBondContact O-N 2.85Å; I182-V185 PolarHBondContact O-N 3.34Å; I182-F186 VanDerWaalsContact O-CB 3.27Å; I182-F186 WeakPolarHBondContact O-CB 3.27Å; I182-F186 PolarHBondContact O-N 2.91Å; I182-L200 HydrophobicContact CG1-CD1 4.11Å; I182-L200 HydrophobicContact CG1-CD2 4.31Å; I182-L200 HydrophobicContact CG2-CD1 4.27Å
183	N	82.7	Confident	85.4	Confident	2 Å²	2	68.9 Å²	68.9	1%	0.011	32%	0.319	C	S	.	.	H	α-helix	trans	-53.6	-37.8	172	-72.6	-5.1	0	0	0	112	M151 R179 Y181 T187	M151-N183 HydrophobicContact CE-CB 4.43Å; M151-N183 WeakPolarHBondContact CE-O 3.49Å; R179-N183 VanDerWaalsContact O-CB 3.31Å; R179-N183 WeakPolarHBondContact O-CB 3.42Å; R179-N183 PolarHBondContact O-N 3.23Å; R179-N183 PolarHBondContact O-OD1 2.87Å; Y181-N183 VanDerWaalsContact C-N 3.34Å; Y181-N183 PolarHBondContact O-N 2.75Å; N183-T187 VanDerWaalsContact O-CB 3.29Å; N183-T187 WeakPolarHBondContact O-CB 3.27Å; N183-T187 PolarHBondContact O-N 3.29Å; N183-T187 PolarHBondContact O-OG1 2.71Å
184	R	84.1	Confident	85.3	Confident	168 Å²	168	71.8 Å²	71.8	63%	0.634	33%	0.33	S	S	*	.	H	α-helix	trans	-77.3	-40	-176.7	-153	179.4	-160	178.1	4.3	111.9	A180 Y181 I182 R188	A180-R184 WeakPolarHBondContact O-CB 3.46Å; Y181-R184 CarbonylContact O-C 3.51Å; Y181-R184 WeakPolarHBondContact O-CA 3.43Å; Y181-R184 VanDerWaalsContact O-CB 3.27Å; Y181-R184 WeakPolarHBondContact O-CB 3.38Å; Y181-R184 PolarHBondContact O-N 3.16Å; I182-R184 PolarHBondContact O-N 2.85Å; R184-R188 WeakPolarHBondContact O-CB 3.49Å; R184-R188 PolarHBondContact O-N 3.21Å
185	V	86.6	Confident	85.1	Confident	6 Å²	6	78.8 Å²	78.8	4%	0.036	36%	0.357	C	S	.	.	H	α-helix	trans	-63.9	-51.7	172.2	173.3	0	0	0	0	110.1	Y181 I182 T187 R188 N189 Q199 L200	Y181-V185 HydrophobicContact CD1-CG2 4.03Å; Y181-V185 HydrophobicContact CE1-CG2 3.66Å; Y181-V185 PolarHBondContact O-N 3.09Å; I182-V185 PolarHBondContact O-N 3.34Å; V185-T187 VanDerWaalsContact C-N 3.32Å; V185-T187 PolarHBondContact O-N 3.21Å; V185-R188 WeakPolarHBondContact O-CB 3.36Å; V185-R188 PolarHBondContact O-N 2.84Å; V185-R188 VanDerWaalsContact O-N 3.08Å; V185-N189 WeakPolarHBondContact O-CB 3.22Å; V185-N189 PolarHBondContact O-N 3.27Å; V185-Q199 HydrophobicContact CG1-CB 4.39Å; V185-Q199 HydrophobicContact CG1-CG 4.43Å; V185-L200 HydrophobicContact CG1-CG 4.22Å; V185-L200 HydrophobicContact CG2-CD2 4.26Å
186	F	90.8	Very high	85.3	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-41.8	179.7	-166.9	-120.4	0	0	0	112.4	C163 E166 L167 L170 I182 L191 S196	C163-F186 WeakPolarHBondContact O-CE1 3.33Å; E166-F186 HydrophobicContact CB-CE2 4.15Å; E166-F186 HydrophobicContact CB-CZ 3.91Å; L167-F186 HydrophobicContact CB-CD1 4.31Å; L167-F186 HydrophobicContact CB-CE1 4.07Å; L167-F186 HydrophobicContact CD1-CB 4.26Å; L167-F186 HydrophobicContact CD1-CD1 3.89Å; L167-F186 HydrophobicContact CD1-CE1 4.5Å; L167-F186 HydrophobicContact CD1-CG 4.17Å; L170-F186 HydrophobicContact CD1-CD2 3.54Å; L170-F186 HydrophobicContact CD1-CE2 4.02Å; L170-F186 HydrophobicContact CD1-CG 4.26Å; I182-F186 VanDerWaalsContact O-CB 3.27Å; I182-F186 WeakPolarHBondContact O-CB 3.27Å; I182-F186 PolarHBondContact O-N 2.91Å; F186-L191 HydrophobicContact CD1-CD2 3.6Å; F186-L191 HydrophobicContact CE1-CB 4.18Å; F186-L191 HydrophobicContact CE1-CD2 3.53Å; F186-L191 HydrophobicContact CE1-CG 4.47Å; F186-L191 WeakPolarHBondContact CE2-O 3.44Å; F186-L191 HydrophobicContact CG-CD2 4.45Å; F186-L191 HydrophobicContact CZ-CB 4.12Å; F186-L191 HydrophobicContact CZ-CD2 4.32Å; F186-L191 VanDerWaalsContact CZ-O 3.29Å; F186-L191 WeakPolarHBondContact CZ-O 3.26Å; F186-L191 WeakPolarHBondContact O-CA 3.48Å; F186-L191 PolarHBondContact O-N 3.02Å; F186-S196 WeakPolarHBondContact CA-OG 3.27Å
187	T	81.9	Confident	85.9	Confident	46 Å²	46	71.7 Å²	71.7	28%	0.282	32%	0.317	S	S	.	.	H	α-helix	trans	-72.8	-33.9	175.6	-50.4	0	0	0	0	112.8	M151 N183 V185 N189 M190	M151-T187 HydrophobicContact CE-CG2 4.03Å; M151-T187 WeakPolarHBondContact CE-OG1 3.35Å; N183-T187 VanDerWaalsContact O-CB 3.29Å; N183-T187 WeakPolarHBondContact O-CB 3.27Å; N183-T187 PolarHBondContact O-N 3.29Å; N183-T187 PolarHBondContact O-OG1 2.71Å; V185-T187 VanDerWaalsContact C-N 3.32Å; V185-T187 PolarHBondContact O-N 3.21Å; T187-N189 VanDerWaalsContact C-N 3.32Å; T187-M190 PolarHBondContact O-N 2.79Å
188	R	85.1	Confident	86.1	Confident	190 Å²	190	75.6 Å²	75.6	72%	0.717	34%	0.336	S	S	*	.	H	α-helix	trans	-65.8	-36.6	174.7	179.1	-178.9	-177.4	175.7	0.8	111.5	R184 V185 M190	R184-R188 WeakPolarHBondContact O-CB 3.49Å; R184-R188 PolarHBondContact O-N 3.21Å; V185-R188 WeakPolarHBondContact O-CB 3.36Å; V185-R188 PolarHBondContact O-N 2.84Å; V185-R188 VanDerWaalsContact O-N 3.08Å; R188-M190 PolarHBondContact O-N 3.14Å
189	N	86	Confident	86.5	Confident	23 Å²	23	72.4 Å²	72.4	12%	0.123	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	25.4	-177.4	-63.5	-12.5	0	0	0	112.5	V185 T187 L191 S192 R195 Q199	V185-N189 WeakPolarHBondContact O-CB 3.22Å; V185-N189 PolarHBondContact O-N 3.27Å; T187-N189 VanDerWaalsContact C-N 3.32Å; N189-L191 VanDerWaalsContact C-N 3.27Å; N189-L191 PolarHBondContact O-N 2.93Å; N189-S192 VanDerWaalsContact O-CB 3.23Å; N189-S192 WeakPolarHBondContact O-CB 3.38Å; N189-S192 PolarHBondContact O-N 3.01Å; N189-R195 HydrophobicContact CB-CB 4.04Å; N189-R195 PolarHBondContact ND2-O 3.05Å; N189-Q199 PolarHBondContact ND2-OE1 3.35Å; N189-Q199 PolarHBondContact OD1-OE1 2.95Å
190	M	83	Confident	86.9	Confident	162 Å²	162	67.6 Å²	67.6	80%	0.798	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	39	175.4	-57.2	-71.3	-77.6	0	0	113.2	T187 R188 S192	T187-M190 PolarHBondContact O-N 2.79Å; R188-M190 PolarHBondContact O-N 3.14Å; M190-S192 PolarHBondContact O-N 3.49Å; M190-S192 VanDerWaalsContact O-N 3.12Å
191	L	81.1	Confident	87.6	Confident	32 Å²	32	70.2 Å²	70.2	17%	0.168	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	9.7	-177.5	-51.1	169.8	0	0	0	114.8	I155 Y158 F186 N189 Y193	I155-L191 HydrophobicContact CG1-CD2 4.24Å; Y158-L191 HydrophobicContact CG-CD1 4.48Å; F186-L191 HydrophobicContact CD1-CD2 3.6Å; F186-L191 HydrophobicContact CE1-CB 4.18Å; F186-L191 HydrophobicContact CE1-CD2 3.53Å; F186-L191 HydrophobicContact CE1-CG 4.47Å; F186-L191 WeakPolarHBondContact CE2-O 3.44Å; F186-L191 HydrophobicContact CG-CD2 4.45Å; F186-L191 HydrophobicContact CZ-CB 4.12Å; F186-L191 HydrophobicContact CZ-CD2 4.32Å; F186-L191 VanDerWaalsContact CZ-O 3.29Å; F186-L191 WeakPolarHBondContact CZ-O 3.26Å; F186-L191 WeakPolarHBondContact O-CA 3.48Å; F186-L191 PolarHBondContact O-N 3.02Å; N189-L191 VanDerWaalsContact C-N 3.27Å; N189-L191 PolarHBondContact O-N 2.93Å; L191-Y193 PolarHBondContact O-N 3.19Å
192	S	84.3	Confident	87.8	Confident	35 Å²	35	71.7 Å²	71.7	25%	0.245	32%	0.317	C	S	.	.			trans	-68.5	119.6	173.5	175.3	0	0	0	0	110.9	N189 M190 R195 S196	N189-S192 VanDerWaalsContact O-CB 3.23Å; N189-S192 WeakPolarHBondContact O-CB 3.38Å; N189-S192 PolarHBondContact O-N 3.01Å; M190-S192 PolarHBondContact O-N 3.49Å; M190-S192 VanDerWaalsContact O-N 3.12Å; S192-R195 PolarHBondContact OG-N 3Å; S192-S196 VanDerWaalsContact O-CB 3.28Å; S192-S196 WeakPolarHBondContact O-CB 3.25Å; S192-S196 PolarHBondContact O-N 2.97Å; S192-S196 PolarHBondContact O-OG 3.15Å
193	Y	88.7	Confident	87.7	Confident	53 Å²	53	73.4 Å²	73.4	21%	0.208	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-48.1	174.4	173.6	-96.5	0	0	0	112.1	E166 K169 L170 L173 L191 S196 Y197	E166-Y193 HydrophobicContact CB-CD2 4.12Å; E166-Y193 WeakPolarHBondContact OE2-CB 3.13Å; K169-Y193 HydrophobicContact CB-CD2 4.5Å; K169-Y193 HydrophobicContact CB-CE2 3.65Å; K169-Y193 HydrophobicContact CD-CE2 4Å; L170-Y193 HydrophobicContact CD1-CD2 4.27Å; L170-Y193 HydrophobicContact CD2-CD2 3.8Å; L170-Y193 HydrophobicContact CD2-CE2 3.62Å; L170-Y193 HydrophobicContact CG-CD2 3.77Å; L170-Y193 HydrophobicContact CG-CE2 3.82Å; L173-Y193 HydrophobicContact CD1-CE2 4.48Å; L173-Y193 WeakPolarHBondContact CD1-OH 3.47Å; L191-Y193 PolarHBondContact O-N 3.19Å; Y193-S196 CarbonylContact O-C 3.58Å; Y193-S196 PolarHBondContact O-N 3.26Å; Y193-Y197 VanDerWaalsContact O-CB 3.3Å; Y193-Y197 WeakPolarHBondContact O-CB 3.36Å; Y193-Y197 PolarHBondContact O-N 2.85Å
194	E	87.4	Confident	88	Confident	145 Å²	145	73.9 Å²	73.9	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-57.1	-56.2	-177.5	-66.8	-179.8	130.7	0	0	111.9	S196 Y197 E198	E194-S196 PolarHBondContact O-N 2.99Å; E194-Y197 WeakPolarHBondContact O-CB 3.34Å; E194-Y197 PolarHBondContact O-N 3.28Å; E194-E198 WeakPolarHBondContact O-CG 3.32Å; E194-E198 PolarHBondContact O-N 3.24Å
195	R	86.5	Confident	88.1	Confident	159 Å²	159	68.8 Å²	68.8	60%	0.6	31%	0.313	S	S	*	.	H	α-helix	trans	-59.3	-34.2	178.5	-68.7	-179.9	175.9	176.5	-1.1	112.7	N189 S192 Q199	N189-R195 HydrophobicContact CB-CB 4.04Å; N189-R195 PolarHBondContact ND2-O 3.05Å; S192-R195 PolarHBondContact OG-N 3Å; R195-Q199 VanDerWaalsContact O-CB 3.27Å; R195-Q199 WeakPolarHBondContact O-CB 3.32Å; R195-Q199 PolarHBondContact O-N 3.2Å; R195-Q199 VanDerWaalsContact O-N 3.11Å
196	S	90.9	Very high	87.9	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-74.2	-35.9	177.2	-57.2	0	0	0	0	112.5	F186 S192 Y193 E194 L200	F186-S196 WeakPolarHBondContact CA-OG 3.27Å; S192-S196 VanDerWaalsContact O-CB 3.28Å; S192-S196 WeakPolarHBondContact O-CB 3.25Å; S192-S196 PolarHBondContact O-N 2.97Å; S192-S196 PolarHBondContact O-OG 3.15Å; Y193-S196 CarbonylContact O-C 3.58Å; Y193-S196 PolarHBondContact O-N 3.26Å; E194-S196 PolarHBondContact O-N 2.99Å; S196-L200 VanDerWaalsContact O-CB 3.28Å; S196-L200 WeakPolarHBondContact O-CB 3.31Å; S196-L200 WeakPolarHBondContact O-CD1 3.4Å; S196-L200 VanDerWaalsContact O-CG 3.23Å; S196-L200 WeakPolarHBondContact O-CG 3.47Å; S196-L200 PolarHBondContact O-N 3.36Å
197	Y	94.9	Very high	87	Confident	88 Å²	88	77.1 Å²	77.1	35%	0.345	35%	0.347	S	S	.	.	H	α-helix	trans	-69.5	-46.7	175.4	173.4	-97.1	0	0	0	111.1	L173 F174 Y193 E194 L200 K201	L173-Y197 HydrophobicContact CD1-CD2 4Å; L173-Y197 HydrophobicContact CD1-CE2 4.03Å; F174-Y197 AromaticContact CE2-CD2 3.66Å; F174-Y197 HydrophobicContact CE2-CD2 3.66Å; F174-Y197 HydrophobicContact CE2-CE2 4.26Å; F174-Y197 HydrophobicContact CE2-CG 4.46Å; F174-Y197 AromaticContact CZ-CD2 3.61Å; F174-Y197 HydrophobicContact CZ-CD2 3.61Å; F174-Y197 AromaticContact CZ-CE2 3.88Å; F174-Y197 HydrophobicContact CZ-CE2 3.88Å; F174-Y197 HydrophobicContact CZ-CG 4.36Å; Y193-Y197 VanDerWaalsContact O-CB 3.3Å; Y193-Y197 WeakPolarHBondContact O-CB 3.36Å; Y193-Y197 PolarHBondContact O-N 2.85Å; E194-Y197 WeakPolarHBondContact O-CB 3.34Å; E194-Y197 PolarHBondContact O-N 3.28Å; Y197-L200 PolarHBondContact O-N 3.01Å; Y197-K201 HydrophobicContact CE1-CD 4.38Å; Y197-K201 WeakPolarHBondContact O-CB 3.45Å; Y197-K201 PolarHBondContact O-N 3.32Å
198	E	91.4	Very high	86.6	Confident	128 Å²	128	81.6 Å²	81.6	60%	0.598	36%	0.359	S	S	*	.	H	α-helix	trans	-58.1	-50.1	174.5	-70.8	-178.3	137.9	0	0	111.3	E194 K201 E202	E194-E198 WeakPolarHBondContact O-CG 3.32Å; E194-E198 PolarHBondContact O-N 3.24Å; E198-K201 PolarHBondContact O-N 3.07Å; E198-E202 WeakPolarHBondContact O-CB 3.31Å; E198-E202 PolarHBondContact O-N 2.86Å
199	Q	92.1	Very high	86.2	Confident	50 Å²	50	77.4 Å²	77.4	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-179.6	-174.2	167.1	29.6	0	0	112.6	V185 N189 R195 K201 E203	V185-Q199 HydrophobicContact CG1-CB 4.39Å; V185-Q199 HydrophobicContact CG1-CG 4.43Å; N189-Q199 PolarHBondContact ND2-OE1 3.35Å; N189-Q199 PolarHBondContact OD1-OE1 2.95Å; R195-Q199 VanDerWaalsContact O-CB 3.27Å; R195-Q199 WeakPolarHBondContact O-CB 3.32Å; R195-Q199 PolarHBondContact O-N 3.2Å; R195-Q199 VanDerWaalsContact O-N 3.11Å; Q199-K201 VanDerWaalsContact C-N 3.34Å; Q199-E203 WeakPolarHBondContact O-CB 3.41Å; Q199-E203 PolarHBondContact O-N 2.86Å; Q199-E203 VanDerWaalsContact O-N 3.14Å
200	L	94.1	Very high	85.3	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-70	-30.8	177	-72.7	167.5	0	0	0	112.5	L170 F174 F177 Y181 I182 V185 S196 Y197 D204	L170-L200 HydrophobicContact CD2-CD1 4.37Å; F174-L200 HydrophobicContact CD1-CB 3.85Å; F174-L200 HydrophobicContact CD2-CB 3.66Å; F174-L200 HydrophobicContact CD2-CD1 3.64Å; F174-L200 HydrophobicContact CD2-CG 4.26Å; F174-L200 HydrophobicContact CE1-CB 3.79Å; F174-L200 HydrophobicContact CE2-CB 3.58Å; F174-L200 HydrophobicContact CE2-CD1 4.05Å; F174-L200 HydrophobicContact CE2-CG 4.47Å; F174-L200 HydrophobicContact CG-CB 3.79Å; F174-L200 HydrophobicContact CG-CD1 4.2Å; F174-L200 HydrophobicContact CG-CG 4.5Å; F174-L200 HydrophobicContact CZ-CB 3.65Å; F177-L200 HydrophobicContact CD1-CD2 4.29Å; F177-L200 HydrophobicContact CD2-CD2 4.31Å; F177-L200 HydrophobicContact CE1-CD2 4.47Å; F177-L200 HydrophobicContact CE2-CD2 4.48Å; F177-L200 HydrophobicContact CG-CD2 4.19Å; Y181-L200 HydrophobicContact CD1-CD2 4.08Å; Y181-L200 HydrophobicContact CE1-CD2 4.07Å; I182-L200 HydrophobicContact CG1-CD1 4.11Å; I182-L200 HydrophobicContact CG1-CD2 4.31Å; I182-L200 HydrophobicContact CG2-CD1 4.27Å; V185-L200 HydrophobicContact CG1-CG 4.22Å; V185-L200 HydrophobicContact CG2-CD2 4.26Å; S196-L200 VanDerWaalsContact O-CB 3.28Å; S196-L200 WeakPolarHBondContact O-CB 3.31Å; S196-L200 WeakPolarHBondContact O-CD1 3.4Å; S196-L200 VanDerWaalsContact O-CG 3.23Å; S196-L200 WeakPolarHBondContact O-CG 3.47Å; S196-L200 PolarHBondContact O-N 3.36Å; Y197-L200 PolarHBondContact O-N 3.01Å; L200-D204 WeakPolarHBondContact O-CB 3.42Å; L200-D204 PolarHBondContact O-N 3.04Å
201	K	91.8	Very high	84.3	Confident	101 Å²	101	80.1 Å²	80.1	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-69.8	-51.9	175.2	-177.5	-168.9	171	-160.5	0	111.5	F174 Y197 E198 Q199 E203 D204 D205	F174-K201 HydrophobicContact CE1-CB 4.19Å; F174-K201 HydrophobicContact CZ-CB 4.14Å; Y197-K201 HydrophobicContact CE1-CD 4.38Å; Y197-K201 WeakPolarHBondContact O-CB 3.45Å; Y197-K201 PolarHBondContact O-N 3.32Å; E198-K201 PolarHBondContact O-N 3.07Å; Q199-K201 VanDerWaalsContact C-N 3.34Å; K201-E203 PolarHBondContact O-N 2.81Å; K201-D204 PolarHBondContact O-N 2.84Å; K201-D204 VanDerWaalsContact O-N 3.17Å; K201-D205 WeakPolarHBondContact O-CB 3.34Å; K201-D205 PolarHBondContact O-N 3.02Å
202	E	90.8	Very high	83.6	Confident	116 Å²	116	82.6 Å²	82.6	54%	0.542	38%	0.376	S	S	.	.	H	α-helix	trans	-58.2	-33.1	177.4	-167.2	-155.6	-115.2	0	0	111.2	E198 R206	E198-E202 WeakPolarHBondContact O-CB 3.31Å; E198-E202 PolarHBondContact O-N 2.86Å; E202-R206 VanDerWaalsContact O-CB 3.3Å; E202-R206 WeakPolarHBondContact O-CB 3.48Å; E202-R206 WeakPolarHBondContact O-CG 3.43Å; E202-R206 PolarHBondContact O-N 3.46Å; E202-R206 PolarHBondContact O-NE 2.85Å; E202-R206 IonicContact OE2-CZ 2.7Å; E202-R206 IonicContact OE2-NE 3.84Å; E202-R206 PolarHBondContact OE2-NE 3.45Å; E202-R206 IonicContact OE2-NH2 3.62Å; E202-R206 PolarHBondContact OE2-NH2 2.99Å
203	E	87.6	Confident	82.2	Confident	37 Å²	37	87.6 Å²	87.6	17%	0.173	39%	0.394	C	S	.	.	H	α-helix	trans	-78.3	-35.5	178	-157.8	137.8	-97.5	0	0	113.5	F177 Y181 Q199 K201 R206 E207	F177-E203 HydrophobicContact CE1-CB 4.42Å; F177-E203 HydrophobicContact CE1-CG 4.01Å; F177-E203 HydrophobicContact CZ-CB 4.01Å; F177-E203 HydrophobicContact CZ-CG 4.02Å; Y181-E203 WeakPolarHBondContact CE1-OE2 3.42Å; Y181-E203 VanDerWaalsContact CZ-OE2 3.3Å; Y181-E203 PolarHBondContact OH-OE2 3.26Å; Q199-E203 WeakPolarHBondContact O-CB 3.41Å; Q199-E203 PolarHBondContact O-N 2.86Å; Q199-E203 VanDerWaalsContact O-N 3.14Å; K201-E203 PolarHBondContact O-N 2.81Å; E203-R206 IonicContact OE1-CZ 2.66Å; E203-R206 IonicContact OE1-NH1 3.88Å; E203-R206 PolarHBondContact OE1-NH1 3.19Å; E203-R206 IonicContact OE1-NH2 3.44Å; E203-R206 PolarHBondContact OE1-NH2 3.43Å; E203-R206 VanDerWaalsContact OE1-NH2 3.08Å; E203-E207 WeakPolarHBondContact O-CB 3.39Å; E203-E207 PolarHBondContact O-N 3.37Å; E203-E207 VanDerWaalsContact O-N 3.08Å
204	D	88.3	Confident	79.9	Confident	13 Å²	13	90.2 Å²	90.2	7%	0.07	42%	0.415	C	S	.	.	H	α-helix	trans	-68.5	-40.8	169.6	-165.3	43	0	0	0	111.5	R176 F177 L200 K201 E207 R208	R176-D204 WeakPolarHBondContact CD-OD1 3.44Å; R176-D204 IonicContact CZ-OD1 3.34Å; R176-D204 IonicContact NE-OD1 2.67Å; R176-D204 IonicContact NH1-OD1 3.9Å; R176-D204 PolarHBondContact NH1-OD1 3.28Å; F177-D204 HydrophobicContact CE2-CB 4.02Å; F177-D204 HydrophobicContact CZ-CB 4.47Å; L200-D204 WeakPolarHBondContact O-CB 3.42Å; L200-D204 PolarHBondContact O-N 3.04Å; K201-D204 PolarHBondContact O-N 2.84Å; K201-D204 VanDerWaalsContact O-N 3.17Å; D204-E207 CarbonylContact O-C 3.59Å; D204-E207 PolarHBondContact O-N 3Å; D204-R208 WeakPolarHBondContact O-CB 3.33Å; D204-R208 VanDerWaalsContact O-CG 3.23Å; D204-R208 WeakPolarHBondContact O-CG 3.39Å; D204-R208 PolarHBondContact O-N 2.92Å; D204-R208 IonicContact OD2-CZ 3.38Å; D204-R208 IonicContact OD2-NE 2.89Å; D204-R208 PolarHBondContact OD2-NE 2.83Å; D204-R208 IonicContact OD2-NH2 3.08Å; D204-R208 PolarHBondContact OD2-NH2 3.34Å
205	D	86.5	Confident	77.3	Confident	61 Å²	61	94.1 Å²	94.1	33%	0.326	42%	0.423	S	S	.	.	H	α-helix	trans	-67.2	-40	177.4	-73.5	-31	0	0	0	111.1	K201 E207 R208 E209	K201-D205 WeakPolarHBondContact O-CB 3.34Å; K201-D205 PolarHBondContact O-N 3.02Å; D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 PolarHBondContact O-N 2.7Å; D205-R208 PolarHBondContact O-N 3.36Å; D205-R208 WeakPolarHBondContact OD1-CD 3.48Å; D205-R208 IonicContact OD1-CZ 2.89Å; D205-R208 IonicContact OD1-NE 3.85Å; D205-R208 IonicContact OD1-NH1 3.79Å; D205-R208 PolarHBondContact OD1-NH1 3.32Å; D205-E209 WeakPolarHBondContact O-CB 3.4Å; D205-E209 PolarHBondContact O-N 3.41Å
206	R	81.9	Confident	74.8	Confident	106 Å²	106	94.3 Å²	94.3	40%	0.4	44%	0.435	S	S	.	.	H	α-helix	trans	-56.9	-42.4	167.7	-85.8	-175.9	-85.6	118.3	-7.6	112.3	E202 E203 E209 R210	E202-R206 VanDerWaalsContact O-CB 3.3Å; E202-R206 WeakPolarHBondContact O-CB 3.48Å; E202-R206 WeakPolarHBondContact O-CG 3.43Å; E202-R206 PolarHBondContact O-N 3.46Å; E202-R206 PolarHBondContact O-NE 2.85Å; E202-R206 IonicContact OE2-CZ 2.7Å; E202-R206 IonicContact OE2-NE 3.84Å; E202-R206 PolarHBondContact OE2-NE 3.45Å; E202-R206 IonicContact OE2-NH2 3.62Å; E202-R206 PolarHBondContact OE2-NH2 2.99Å; E203-R206 IonicContact OE1-CZ 2.66Å; E203-R206 IonicContact OE1-NH1 3.88Å; E203-R206 PolarHBondContact OE1-NH1 3.19Å; E203-R206 IonicContact OE1-NH2 3.44Å; E203-R206 PolarHBondContact OE1-NH2 3.43Å; E203-R206 VanDerWaalsContact OE1-NH2 3.08Å; R206-E209 PolarHBondContact O-N 3.48Å; R206-R210 PolarHBondContact O-N 3.39Å
207	E	72.6	Confident	72.1	Confident	74 Å²	74	101.7 Å²	101.7	35%	0.346	47%	0.473	S	S	.	.	H	α-helix	trans	-77.1	-30.4	-179.5	-164.1	66.3	177	0	0	112.6	E203 D204 D205 R210 C211	E203-E207 WeakPolarHBondContact O-CB 3.39Å; E203-E207 PolarHBondContact O-N 3.37Å; E203-E207 VanDerWaalsContact O-N 3.08Å; D204-E207 CarbonylContact O-C 3.59Å; D204-E207 PolarHBondContact O-N 3Å; D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 PolarHBondContact O-N 2.7Å; E207-R210 WeakPolarHBondContact O-CB 3.38Å; E207-R210 PolarHBondContact O-N 3.04Å; E207-R210 WeakPolarHBondContact OE2-CD 3.47Å; E207-C211 PolarHBondContact O-N 3.46Å; E207-C211 PolarHBondContact O-SG 2.87Å
208	R	74.4	Confident	68.9	Low	140 Å²	140	106.3 Å²	106.3	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-42.6	168	-72.1	167.9	-167.4	-172.5	-3.5	111.1	D204 D205 R210 C211 S212	D204-R208 WeakPolarHBondContact O-CB 3.33Å; D204-R208 VanDerWaalsContact O-CG 3.23Å; D204-R208 WeakPolarHBondContact O-CG 3.39Å; D204-R208 PolarHBondContact O-N 2.92Å; D204-R208 IonicContact OD2-CZ 3.38Å; D204-R208 IonicContact OD2-NE 2.89Å; D204-R208 PolarHBondContact OD2-NE 2.83Å; D204-R208 IonicContact OD2-NH2 3.08Å; D204-R208 PolarHBondContact OD2-NH2 3.34Å; D205-R208 PolarHBondContact O-N 3.36Å; D205-R208 WeakPolarHBondContact OD1-CD 3.48Å; D205-R208 IonicContact OD1-CZ 2.89Å; D205-R208 IonicContact OD1-NE 3.85Å; D205-R208 IonicContact OD1-NH1 3.79Å; D205-R208 PolarHBondContact OD1-NH1 3.32Å; R208-R210 VanDerWaalsContact C-N 3.31Å; R208-C211 PolarHBondContact O-N 3.23Å; R208-S212 WeakPolarHBondContact O-CB 3.34Å; R208-S212 PolarHBondContact O-N 3.06Å; R208-S212 PolarHBondContact O-OG 3.03Å
209	E	75.7	Confident	66	Low	102 Å²	102	104.3 Å²	104.3	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-34.6	176	-152.6	-148	179.6	0	0	111.6	D205 R206 S212 K213	D205-E209 WeakPolarHBondContact O-CB 3.4Å; D205-E209 PolarHBondContact O-N 3.41Å; R206-E209 PolarHBondContact O-N 3.48Å; E209-S212 WeakPolarHBondContact CA-OG 3.46Å; E209-S212 PolarHBondContact O-OG 3.28Å; E209-K213 WeakPolarHBondContact O-CD 3.19Å; E209-K213 VanDerWaalsContact O-CG 3.3Å; E209-K213 WeakPolarHBondContact O-CG 3.36Å; E209-K213 PolarHBondContact O-N 3.36Å; E209-K213 WeakPolarHBondContact OE1-CE 3.43Å; E209-K213 IonicContact OE1-NZ 3.9Å; E209-K213 PolarHBondContact OE1-NZ 2.87Å; E209-K213 IonicContact OE2-NZ 2.72Å; E209-K213 PolarHBondContact OE2-NZ 3.5Å
210	R	67.9	Low	63	Low	178 Å²	178	107.8 Å²	107.8	67%	0.672	53%	0.53	S	S	*	.	H	α-helix	trans	-62.6	-44.8	170.1	-131	-177.9	-173.4	96	7.7	111.8	R206 E207 R208	R206-R210 PolarHBondContact O-N 3.39Å; E207-R210 WeakPolarHBondContact O-CB 3.38Å; E207-R210 PolarHBondContact O-N 3.04Å; E207-R210 WeakPolarHBondContact OE2-CD 3.47Å; R208-R210 VanDerWaalsContact C-N 3.31Å
211	C	62.2	Low	60	Low	65 Å²	65	117.6 Å²	117.6	44%	0.439	57%	0.573	S	S	.	*	H	α-helix	trans	-67.7	-39.7	176.4	-67.1	0	0	0	0	112.9	E207 R208 K213 V214	E207-C211 PolarHBondContact O-N 3.46Å; E207-C211 PolarHBondContact O-SG 2.87Å; R208-C211 PolarHBondContact O-N 3.23Å; C211-K213 VanDerWaalsContact C-N 3.31Å; C211-K213 PolarHBondContact O-N 2.99Å; C211-V214 PolarHBondContact O-N 3.13Å
212	S	64.7	Low	57.2	Low	83 Å²	83	117.6 Å²	117.6	58%	0.58	59%	0.592	S	S	*	*	H	α-helix	trans	-71.7	-24.8	-177.4	69.5	0	0	0	0	113.4	R208 E209 V214	R208-S212 WeakPolarHBondContact O-CB 3.34Å; R208-S212 PolarHBondContact O-N 3.06Å; R208-S212 PolarHBondContact O-OG 3.03Å; E209-S212 WeakPolarHBondContact CA-OG 3.46Å; E209-S212 PolarHBondContact O-OG 3.28Å; S212-V214 PolarHBondContact O-N 3.34Å
213	K	55	Low	54.2	Low	141 Å²	141	119.9 Å²	119.9	61%	0.613	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-16.3	169.5	-72.1	167.1	-175.4	169.3	0	113	E209 C211 R215	E209-K213 WeakPolarHBondContact O-CD 3.19Å; E209-K213 VanDerWaalsContact O-CG 3.3Å; E209-K213 WeakPolarHBondContact O-CG 3.36Å; E209-K213 PolarHBondContact O-N 3.36Å; E209-K213 WeakPolarHBondContact OE1-CE 3.43Å; E209-K213 IonicContact OE1-NZ 3.9Å; E209-K213 PolarHBondContact OE1-NZ 2.87Å; E209-K213 IonicContact OE2-NZ 2.72Å; E209-K213 PolarHBondContact OE2-NZ 3.5Å; C211-K213 VanDerWaalsContact C-N 3.31Å; C211-K213 PolarHBondContact O-N 2.99Å; K213-R215 PolarHBondContact O-N 2.82Å
214	V	40.7	Very low	51.7	Low	107 Å²	107	124 Å²	124	65%	0.648	64%	0.635	S	S	*	*			trans	-90.2	83.5	173.3	-175.4	0	0	0	0	110.1	C211 S212 L216	C211-V214 PolarHBondContact O-N 3.13Å; S212-V214 PolarHBondContact O-N 3.34Å; V214-L216 PolarHBondContact O-N 2.93Å; V214-L216 VanDerWaalsContact O-N 3.14Å
215	R	33.8	Very low	49.1	Very low	227 Å²	227	131.2 Å²	131.2	86%	0.857	67%	0.666	S	S	*	*			trans	-72.3	101.8	169.2	-76.4	-175.4	173.8	179.4	-1.8	110.5	K213 I217	K213-R215 PolarHBondContact O-N 2.82Å; R215-I217 PolarHBondContact O-N 3.39Å
216	L	34.5	Very low	46.4	Very low	164 Å²	164	139.9 Å²	139.9	86%	0.859	69%	0.694	S	S	*	*			trans	-64.2	110.5	158.3	-88	165	0	0	0	108.7	V214 Q218	V214-L216 PolarHBondContact O-N 2.93Å; V214-L216 VanDerWaalsContact O-N 3.14Å; L216-Q218 PolarHBondContact O-N 3.34Å
217	I	32.5	Very low	44	Very low	155 Å²	155	139.3 Å²	139.3	80%	0.795	71%	0.706	S	S	*	*			trans	-72.4	111.3	174.3	-59.6	174.5	0	0	0	107.6	R215 A219	R215-I217 PolarHBondContact O-N 3.39Å; I217-A219 PolarHBondContact O-N 2.91Å
218	Q	28.2	Very low	42.1	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	73%	0.726	S	S	*	*			trans	-69	115.1	165.1	-84.1	-174.1	-25.2	0	0	108.8	L216	L216-Q218 PolarHBondContact O-N 3.34Å
219	A	30.4	Very low	40.1	Very low	85 Å²	85	144.8 Å²	144.8	70%	0.702	74%	0.741	S	S	*	*			trans	-61.3	139.6	164.2	0	0	0	0	0	109.4	I217	I217-A219 PolarHBondContact O-N 2.91Å
220	P	29.7	Very low	38.1	Very low	124 Å²	124	144.2 Å²	144.2	81%	0.805	75%	0.748	S	S	*	*			trans	-68	139.7	-174.9	27.7	-34.6	0	0	0	111.4	A222	P220-A222 PolarHBondContact O-N 3.07Å
221	K	30.5	Very low	36.6	Very low	206 Å²	206	144.6 Å²	144.6	90%	0.896	76%	0.755	S	S	*	*			trans	-68.4	113.6	166.6	-74.3	-174.3	175.1	-176.3	0	108.9	E223	K221-E223 PolarHBondContact O-N 3.14Å
222	A	34.2	Very low	35.2	Very low	101 Å²	101	146.5 Å²	146.5	84%	0.835	77%	0.765	S	S	*	*			trans	-65.8	128.3	170.4	0	0	0	0	0	110.3	P220 S224	P220-A222 PolarHBondContact O-N 3.07Å; A222-S224 PolarHBondContact O-N 3.34Å
223	E	27.7	Very low	34	Very low	164 Å²	164	150.2 Å²	150.2	77%	0.766	77%	0.772	S	S	*	*			trans	-76	114.6	174.7	-64.1	-170.9	155.7	0	0	110.7	K221 K225	K221-E223 PolarHBondContact O-N 3.14Å; E223-K225 IonicContact OE2-NZ 2.74Å
224	S	33.7	Very low	33	Very low	122 Å²	122	148.2 Å²	148.2	85%	0.853	78%	0.776	S	S	*	*			trans	-96.1	128.5	163.8	-173.4	0	0	0	0	110.2	A222	A222-S224 PolarHBondContact O-N 3.34Å
225	K	33.3	Very low	32.6	Very low	165 Å²	165	154.3 Å²	154.3	72%	0.717	79%	0.788	S	S	*	*			trans	-107.8	108.9	-170.9	-77.2	172.9	174.8	161.1	0	112.3	E223	E223-K225 IonicContact OE2-NZ 2.74Å
226	R	30.5	Very low	32.7	Very low	243 Å²	243	148.8 Å²	148.8	92%	0.917	78%	0.781	S	S	*	*			trans	69.3	158.2	163.2	-53.5	178.4	172.4	177.7	-3.6	113.5
227	S	31.3	Very low	32.4	Very low	95 Å²	95	149.8 Å²	149.8	66%	0.664	78%	0.782	S	S	*	*			cis	-150.5	151	17.2	51.7	0	0	0	0	113.3
228	I	32.6	Very low	32.5	Very low	147 Å²	147	150.4 Å²	150.4	75%	0.754	79%	0.785	S	S	*	*			trans	49	127.1	131.6	-57.7	167.6	0	0	0	117.2
229	E	32.7	Very low	32.5	Very low	182 Å²	182	147.2 Å²	147.2	85%	0.85	78%	0.781	S	S	*	*			cis	-141.9	-154.6	27.1	-152.2	137.1	-122.9	0	0	114.5
230	S	34.9	Very low	32.4	Very low	90 Å²	90	151.8 Å²	151.8	63%	0.629	79%	0.793	S	S	*	*			trans	-151.3	159	-158.1	63.4	0	0	0	0	115.6
231	K	35.1	Very low	32.4	Very low	186 Å²	186	155 Å²	155	81%	0.809	80%	0.797	S	S	*	*			trans	141	144.9	145.9	-81.4	159.4	-174	172.2	0	114.4
232	T	33.9	Very low	32.4	Very low	105 Å²	105	150.1 Å²	150.1	64%	0.644	79%	0.789	S	S	*	*			cis	-163.9	167.7	-21	11.7	0	0	0	0	111.7
233	H	38	Very low	32	Very low	160 Å²	160	154.7 Å²	154.7	74%	0.741	79%	0.793	S	S	*	*			trans	79.2	123.1	166.4	-51.4	-60.9	0	0	0	117.6
234	S	34.2	Very low	32.1	Very low	100 Å²	100	151.9 Å²	151.9	70%	0.699	80%	0.798	S	S	*	*			cis	82.5	135.7	27.3	86.6	0	0	0	0	114.4
235	R	32.1	Very low	31.9	Very low	234 Å²	234	156 Å²	156	88%	0.883	80%	0.801	S	S	*	*			cis	-164	-177.6	18.5	-134.7	-171.1	158.8	-174.4	-5.2	107.4
236	P	37.2	Very low	31.6	Very low	111 Å²	111	156.4 Å²	156.4	72%	0.721	81%	0.809	S	S	*	*			cis	-131	178.6	-9	42.6	-25.2	0	0	0	116.2
237	E	28.5	Very low	31.4	Very low	186 Å²	186	151.1 Å²	151.1	87%	0.869	81%	0.809	S	S	*	*			trans	-106.5	164.5	-177.7	-57.2	179.3	130.8	0	0	114.2
238	L	33.4	Very low	31.4	Very low	167 Å²	167	155.3 Å²	155.3	87%	0.874	82%	0.82	S	S	*	*			trans	-134.1	156.5	153.2	-87.9	173	0	0	0	109
239	P	29	Very low	31.3	Very low	119 Å²	119	152.1 Å²	152.1	77%	0.773	82%	0.823	S	S	*	*			trans	-83.8	139.1	-144.2	30	-37	0	0	0	116.4	Q241	P239-Q241 PolarHBondContact O-N 2.93Å
240	L	27.2	Very low	31.3	Very low	180 Å²	180	150.2 Å²	150.2	94%	0.942	82%	0.818	S	S	*	*			trans	-76.9	110.2	164.7	-82.7	161.3	0	0	0	110.7
241	Q	31.3	Very low	31.3	Very low	193 Å²	193	149.9 Å²	149.9	90%	0.902	81%	0.814	S	S	*	*			trans	-93.8	129.6	168.9	-158.2	169.1	20.6	0	0	110.3	P239	P239-Q241 PolarHBondContact O-N 2.93Å
242	S	28.8	Very low	31	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	82%	0.816	S	S	*	*			trans	-85.2	115.1	-168.7	53.8	0	0	0	0	113.7
243	Q	27.3	Very low	30.9	Very low	197 Å²	197	146.7 Å²	146.7	92%	0.921	82%	0.815	S	S	*	*			trans	175.8	104.4	151.2	-101.5	158.6	60.8	0	0	111.2
244	A	29.4	Very low	30.5	Very low	105 Å²	105	151.2 Å²	151.2	87%	0.868	83%	0.826	S	S	*	*			trans	179.5	46	158.3	0	0	0	0	0	114.4
245	F	28.7	Very low	30.3	Very low	209 Å²	209	151 Å²	151	92%	0.917	82%	0.823	S	S	*	*			trans	-80.3	156	158.4	-89	-93	0	0	0	109.5
246	L	27.9	Very low	30.2	Very low	172 Å²	172	141.6 Å²	141.6	90%	0.901	79%	0.792	S	S	*	*			trans	75.1	87.5	177	-52.2	169.1	0	0	0	117
247	C	25.7	Very low	30.1	Very low	133 Å²	133	141.9 Å²	141.9	90%	0.899	79%	0.794	S	S	*	*			trans	-157	54.7	153.5	-137.5	0	0	0	0	114.7
248	M	32.4	Very low	30.7	Very low	182 Å²	182	140.8 Å²	140.8	90%	0.897	79%	0.789	S	S	*	*			trans	-96	94.8	170.3	-75	-65.1	-75.2	0	0	110.5	L250	M248-L250 PolarHBondContact O-N 3.23Å; M248-L250 VanDerWaalsContact O-N 3.09Å
249	G	29.1	Very low	30.9	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	77%	0.767	S	S	*	*			trans	-77.1	88.4	-174	0	0	0	0	0	114.3
250	L	34.4	Very low	31.1	Very low	141 Å²	141	133.1 Å²	133.1	74%	0.738	75%	0.752	S	S	*	*			trans	-83.2	133.4	171.6	-81.1	172.7	0	0	0	112.5	M248 L252	M248-L250 PolarHBondContact O-N 3.23Å; M248-L250 VanDerWaalsContact O-N 3.09Å; L250-L252 PolarHBondContact O-N 2.84Å
251	P	34.2	Very low	31.4	Very low	83 Å²	83	129.4 Å²	129.4	54%	0.539	73%	0.733	S	S	.	*			trans	-79.7	111.1	178.7	30.1	-32.8	0	0	0	111.9	K178 G253	K178-P251 VanDerWaalsContact CE-CB 3.48Å; P251-G253 PolarHBondContact O-N 2.36Å
252	L	28.7	Very low	31.8	Very low	165 Å²	165	124.6 Å²	124.6	86%	0.864	72%	0.721	S	S	*	*			trans	-51.7	122.9	172.5	-79.8	167.9	0	0	0	112.6	L250	L250-L252 PolarHBondContact O-N 2.84Å
253	G	30.5	Very low	32.1	Very low	60 Å²	60	126.5 Å²	126.5	62%	0.619	72%	0.722	S	S	*	*	S	Bend	trans	175.9	130.4	176.6	0	0	0	0	0	107.4	P251 C255	P251-G253 PolarHBondContact O-N 2.36Å; G253-C255 PolarHBondContact O-N 3.19Å; G253-C255 VanDerWaalsContact O-N 3.15Å
254	R	31.3	Very low	32.3	Very low	255 Å²	255	125.1 Å²	125.1	96%	0.962	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-60.8	119.5	-172.2	-69	-172.3	179.5	-161.1	1.6	110.4
255	C	28.4	Very low	32.8	Very low	96 Å²	96	129.4 Å²	129.4	65%	0.649	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71	136.8	169.9	-75.1	0	0	0	0	109.7	G253	G253-C255 PolarHBondContact O-N 3.19Å; G253-C255 VanDerWaalsContact O-N 3.15Å
256	P	31.1	Very low	33.5	Very low	36 Å²	36	126.5 Å²	126.5	23%	0.234	69%	0.686	C	S	.	*	P	Polyproline II helix	trans	-60.6	144.2	166.1	-19	31.3	0	0	0	110	H258 V259 D374	P256-H258 PolarHBondContact O-N 2.6Å; P256-V259 HydrophobicContact CB-CG2 4.13Å; P256-V259 HydrophobicContact CG-CG2 4.12Å; P256-V259 PolarHBondContact O-N 2.76Å; P256-D374 HydrophobicContact CG-CB 3.99Å
257	P	34.7	Very low	34.9	Very low	117 Å²	117	121.7 Å²	121.7	76%	0.76	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-26.5	-171.7	20.3	-32.1	0	0	0	114.1	V259	P257-V259 VanDerWaalsContact C-N 3.34Å; P257-V259 PolarHBondContact O-N 3.29Å
258	H	40.4	Very low	36.8	Very low	162 Å²	162	118 Å²	118	75%	0.75	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-11	175.9	-102.8	-76	0	0	0	115.7	P256	P256-H258 PolarHBondContact O-N 2.6Å
259	V	37.6	Very low	38.7	Very low	70 Å²	70	114 Å²	114	42%	0.424	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-19.7	-175	-176.8	0	0	0	0	112.3	P256 P257 N261 S262	P256-V259 HydrophobicContact CB-CG2 4.13Å; P256-V259 HydrophobicContact CG-CG2 4.12Å; P256-V259 PolarHBondContact O-N 2.76Å; P257-V259 VanDerWaalsContact C-N 3.34Å; P257-V259 PolarHBondContact O-N 3.29Å; V259-N261 VanDerWaalsContact C-N 3.32Å; V259-N261 PolarHBondContact O-N 3.4Å; V259-S262 PolarHBondContact O-OG 3.21Å
260	A	33.1	Very low	40.7	Very low	55 Å²	55	110.9 Å²	110.9	46%	0.455	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-65.7	-31.4	-177.9	0	0	0	0	0	113.7	S262	A260-S262 VanDerWaalsContact C-N 3.33Å; A260-S262 PolarHBondContact O-N 3.25Å
261	N	34.8	Very low	42.3	Very low	103 Å²	103	111 Å²	111	55%	0.551	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-80.5	-2	-173.4	-69.3	5	0	0	0	114.6	V259	V259-N261 VanDerWaalsContact C-N 3.32Å; V259-N261 PolarHBondContact O-N 3.4Å
262	S	38.6	Very low	44.1	Very low	91 Å²	91	115.6 Å²	115.6	64%	0.636	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-100	-5.6	-177.6	65.8	0	0	0	0	115.2	V259 A260	V259-S262 PolarHBondContact O-OG 3.21Å; A260-S262 VanDerWaalsContact C-N 3.33Å; A260-S262 PolarHBondContact O-N 3.25Å
263	L	34.9	Very low	45.7	Very low	143 Å²	143	110 Å²	110	75%	0.749	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	-6.7	-179.2	-69.3	173.4	0	0	0	113.9
264	Y	32.1	Very low	47.5	Very low	169 Å²	169	109.2 Å²	109.2	66%	0.663	58%	0.578	S	S	*	*	S	Bend	trans	-137	115.7	176.5	-64	-82.5	0	0	0	109	R266	Y264-R266 PolarHBondContact O-N 2.98Å
265	R	40.2	Very low	49.4	Very low	194 Å²	194	102.3 Å²	102.3	73%	0.732	56%	0.564	S	S	*	*			trans	-70.2	120.7	168.9	-158	176.1	-166.6	175.2	2.4	107	V267	R265-V267 HydrophobicContact CB-CG2 4.44Å; R265-V267 HydrophobicContact CG-CG2 4.43Å; R265-V267 PolarHBondContact O-N 2.9Å
266	R	43.2	Very low	51.3	Low	148 Å²	148	99 Å²	99	56%	0.558	54%	0.539	S	S	*	.			trans	-69.4	130.4	168.6	-68	-174.7	-175.6	-177.9	1.3	107.5	Y264 A278	Y264-R266 PolarHBondContact O-N 2.98Å; R266-A278 HydrophobicContact CB-CB 3.41Å; R266-A278 VanDerWaalsContact CB-CB 3.41Å; R266-A278 PolarHBondContact O-N 3.24Å
267	V	57.7	Low	53.4	Low	71 Å²	71	97.6 Å²	97.6	43%	0.43	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	130.8	-177	172	0	0	0	0	107.2	R265 V275 E276	R265-V267 HydrophobicContact CB-CG2 4.44Å; R265-V267 HydrophobicContact CG-CG2 4.43Å; R265-V267 PolarHBondContact O-N 2.9Å; V267-V275 HydrophobicContact CG1-CG1 3.42Å; V267-V275 VanDerWaalsContact CG1-CG1 3.42Å; V267-E276 CarbonylContact C-O 3.54Å; V267-E276 WeakPolarHBondContact CA-O 3.45Å; V267-E276 WeakPolarHBondContact CG1-O 3.31Å
268	I	66.1	Low	55.1	Low	57 Å²	57	92.3 Å²	92.3	29%	0.292	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132	175.2	-65.8	-177.4	0	0	0	107.8	E276 A278 H281	I268-E276 PolarHBondContact N-O 2.62Å; I268-E276 PolarHBondContact O-N 2.84Å; I268-A278 HydrophobicContact CD1-CB 4.11Å; I268-A278 HydrophobicContact CG1-CB 4.12Å; I268-H281 HydrophobicContact CB-CB 4.14Å; I268-H281 HydrophobicContact CD1-CB 3.98Å; I268-H281 HydrophobicContact CG1-CB 4.49Å; I268-H281 HydrophobicContact CG2-CB 4.47Å
269	V	72.3	Confident	56.5	Low	98 Å²	98	89.5 Å²	89.5	59%	0.594	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.4	174.9	-177.8	0	0	0	0	107.1	A274	V269-A274 CarbonylContact C-O 3.54Å; V269-A274 VanDerWaalsContact CA-O 3.28Å; V269-A274 WeakPolarHBondContact CA-O 3.47Å
270	T	69.3	Low	58.1	Low	14 Å²	14	90.7 Å²	90.7	9%	0.086	49%	0.488	C	S	.	.			trans	-70.5	162.9	-179.9	72.3	0	0	0	0	110.6	E272 G273 A274 E276	T270-E272 PolarHBondContact O-N 3.07Å; T270-E272 PolarHBondContact OG1-N 3.21Å; T270-G273 PolarHBondContact O-N 2.84Å; T270-A274 HydrophobicContact CG2-CB 4.08Å; T270-A274 PolarHBondContact N-O 2.9Å; T270-A274 WeakPolarHBondContact OG1-CB 3.48Å; T270-A274 PolarHBondContact OG1-N 3.38Å; T270-A274 VanDerWaalsContact OG1-N 3.17Å; T270-E276 VanDerWaalsContact CG2-CD 3.44Å; T270-E276 HydrophobicContact CG2-CG 3.92Å; T270-E276 WeakPolarHBondContact CG2-OE2 3.47Å
271	P	68.7	Low	60.1	Low	144 Å²	144	90.6 Å²	90.6	94%	0.935	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.6	171.1	-26	36.5	0	0	0	114
272	E	71.4	Confident	61.8	Low	180 Å²	180	91 Å²	91	84%	0.841	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.6	178	-59.2	159.7	170.1	0	0	112.8	T270	T270-E272 PolarHBondContact O-N 3.07Å; T270-E272 PolarHBondContact OG1-N 3.21Å
273	G	63.1	Low	63.2	Low	48 Å²	48	92.5 Å²	92.5	50%	0.495	47%	0.474	S	S	.	.			trans	84.9	7.6	-178.3	0	0	0	0	0	115.1	T270	T270-G273 PolarHBondContact O-N 2.84Å
274	A	68.9	Low	65	Low	42 Å²	42	91.1 Å²	91.1	35%	0.347	46%	0.461	S	S	.	.			trans	-70.6	149.6	173.2	0	0	0	0	0	110.9	V269 T270	V269-A274 CarbonylContact C-O 3.54Å; V269-A274 VanDerWaalsContact CA-O 3.28Å; V269-A274 WeakPolarHBondContact CA-O 3.47Å; T270-A274 HydrophobicContact CG2-CB 4.08Å; T270-A274 PolarHBondContact N-O 2.9Å; T270-A274 WeakPolarHBondContact OG1-CB 3.48Å; T270-A274 PolarHBondContact OG1-N 3.38Å; T270-A274 VanDerWaalsContact OG1-N 3.17Å
275	V	70.5	Confident	66.7	Low	111 Å²	111	89.1 Å²	89.1	67%	0.673	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	94.2	-170.6	-179.4	0	0	0	0	108.7	V267	V267-V275 HydrophobicContact CG1-CG1 3.42Å; V267-V275 VanDerWaalsContact CG1-CG1 3.42Å
276	E	68.6	Low	67.8	Low	25 Å²	25	84.9 Å²	84.9	12%	0.117	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	151.8	-169.5	-52	-170.4	139.8	0	0	111.5	V267 I268 T270 H281 K284	V267-E276 CarbonylContact C-O 3.54Å; V267-E276 WeakPolarHBondContact CA-O 3.45Å; V267-E276 WeakPolarHBondContact CG1-O 3.31Å; I268-E276 PolarHBondContact N-O 2.62Å; I268-E276 PolarHBondContact O-N 2.84Å; T270-E276 VanDerWaalsContact CG2-CD 3.44Å; T270-E276 HydrophobicContact CG2-CG 3.92Å; T270-E276 WeakPolarHBondContact CG2-OE2 3.47Å; E276-H281 IonicContact OE2-CE1 2.64Å; E276-H281 IonicContact OE2-CG 3.18Å; E276-H281 IonicContact OE2-ND1 3.95Å; E276-H281 PolarHBondContact OE2-ND1 2.98Å; E276-K284 IonicContact OE1-NZ 3.83Å; E276-K284 PolarHBondContact OE1-NZ 3.37Å
277	S	76.3	Confident	68.7	Low	8 Å²	8	83.1 Å²	83.1	6%	0.056	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	143.6	165.9	-152.1	0	0	0	0	109	D279 E280 H281	S277-D279 PolarHBondContact O-N 3.19Å; S277-D279 PolarHBondContact OG-OD2 3.47Å; S277-E280 VanDerWaalsContact CB-CD 3.47Å; S277-E280 WeakPolarHBondContact CB-OE2 3.46Å; S277-E280 PolarHBondContact N-OE2 3.02Å; S277-E280 WeakPolarHBondContact O-CB 3.46Å; S277-E280 PolarHBondContact O-N 3.29Å; S277-E280 VanDerWaalsContact O-N 3.11Å; S277-H281 PolarHBondContact O-N 3.41Å
278	A	69.5	Low	68.9	Low	5 Å²	5	84 Å²	84	4%	0.041	46%	0.458	C	S	.	.	H	α-helix	trans	-61.1	-29.5	174	0	0	0	0	0	112	R266 I268 H281 E282	R266-A278 HydrophobicContact CB-CB 3.41Å; R266-A278 VanDerWaalsContact CB-CB 3.41Å; R266-A278 PolarHBondContact O-N 3.24Å; I268-A278 HydrophobicContact CD1-CB 4.11Å; I268-A278 HydrophobicContact CG1-CB 4.12Å; A278-H281 PolarHBondContact O-N 2.83Å; A278-E282 WeakPolarHBondContact O-CB 3.39Å; A278-E282 WeakPolarHBondContact O-CG 3.13Å; A278-E282 PolarHBondContact O-N 2.92Å
279	D	69.6	Low	67.9	Low	104 Å²	104	84 Å²	84	56%	0.556	46%	0.461	S	S	*	.	H	α-helix	trans	-67.7	-41	175.2	-30.1	-80.5	0	0	0	111.4	S277 H281 Q283	S277-D279 PolarHBondContact O-N 3.19Å; S277-D279 PolarHBondContact OG-OD2 3.47Å; D279-H281 VanDerWaalsContact C-N 3.32Å; D279-Q283 WeakPolarHBondContact O-CG 3.5Å; D279-Q283 PolarHBondContact O-N 3Å
280	E	71.2	Confident	66.4	Low	94 Å²	94	82.3 Å²	82.3	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-37.1	175.7	-67.2	161.2	175	0	0	110.9	S277 K284	S277-E280 VanDerWaalsContact CB-CD 3.47Å; S277-E280 WeakPolarHBondContact CB-OE2 3.46Å; S277-E280 PolarHBondContact N-OE2 3.02Å; S277-E280 WeakPolarHBondContact O-CB 3.46Å; S277-E280 PolarHBondContact O-N 3.29Å; S277-E280 VanDerWaalsContact O-N 3.11Å; E280-K284 WeakPolarHBondContact O-CG 3.28Å; E280-K284 PolarHBondContact O-N 3.19Å
281	H	76	Confident	65	Low	53 Å²	53	89 Å²	89	25%	0.245	50%	0.498	C	S	.	.	H	α-helix	trans	-76.8	-36.9	178.9	-164.1	85.9	0	0	0	112.7	I268 E276 S277 A278 D279 Q283 K284 F285	I268-H281 HydrophobicContact CB-CB 4.14Å; I268-H281 HydrophobicContact CD1-CB 3.98Å; I268-H281 HydrophobicContact CG1-CB 4.49Å; I268-H281 HydrophobicContact CG2-CB 4.47Å; E276-H281 IonicContact OE2-CE1 2.64Å; E276-H281 IonicContact OE2-CG 3.18Å; E276-H281 IonicContact OE2-ND1 3.95Å; E276-H281 PolarHBondContact OE2-ND1 2.98Å; S277-H281 PolarHBondContact O-N 3.41Å; A278-H281 PolarHBondContact O-N 2.83Å; D279-H281 VanDerWaalsContact C-N 3.32Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-K284 PolarHBondContact O-N 3.01Å; H281-F285 VanDerWaalsContact O-CB 3.3Å; H281-F285 WeakPolarHBondContact O-CB 3.41Å; H281-F285 PolarHBondContact O-N 3.38Å
282	E	69.6	Low	63.4	Low	111 Å²	111	85.7 Å²	85.7	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-38.9	169.7	-79.1	179.2	-164.8	0	0	110.7	A278 F285 L286	A278-E282 WeakPolarHBondContact O-CB 3.39Å; A278-E282 WeakPolarHBondContact O-CG 3.13Å; A278-E282 PolarHBondContact O-N 2.92Å; E282-F285 PolarHBondContact O-N 3.29Å; E282-L286 VanDerWaalsContact O-CG 3.27Å; E282-L286 WeakPolarHBondContact O-CG 3.27Å; E282-L286 PolarHBondContact O-N 3.07Å
283	Q	68.8	Low	61.5	Low	123 Å²	123	82.3 Å²	82.3	58%	0.575	48%	0.475	S	S	*	.	H	α-helix	trans	-62.7	-52.2	171.1	-73.5	-174.4	-72	0	0	112	D279 H281 F285 L286 D287	D279-Q283 WeakPolarHBondContact O-CG 3.5Å; D279-Q283 PolarHBondContact O-N 3Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; Q283-F285 PolarHBondContact O-N 2.83Å; Q283-L286 WeakPolarHBondContact O-CB 3.31Å; Q283-L286 PolarHBondContact O-N 2.91Å; Q283-D287 VanDerWaalsContact O-CG 3.26Å; Q283-D287 PolarHBondContact O-N 2.74Å
284	K	71.6	Confident	60.1	Low	114 Å²	114	85.3 Å²	85.3	50%	0.496	49%	0.488	S	S	.	.	H	α-helix	trans	-56.5	-34.7	175.5	-75	179.2	179.9	-168.5	0	113.1	E276 E280 H281 S288	E276-K284 IonicContact OE1-NZ 3.83Å; E276-K284 PolarHBondContact OE1-NZ 3.37Å; E280-K284 WeakPolarHBondContact O-CG 3.28Å; E280-K284 PolarHBondContact O-N 3.19Å; H281-K284 PolarHBondContact O-N 3.01Å; K284-S288 VanDerWaalsContact O-CB 3.23Å; K284-S288 WeakPolarHBondContact O-CB 3.36Å; K284-S288 PolarHBondContact O-N 2.82Å; K284-S288 PolarHBondContact O-OG 3.07Å
285	F	67.6	Low	58.4	Low	127 Å²	127	87.6 Å²	87.6	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-68.5	-45.1	175.6	-173.6	-97.2	0	0	0	111.6	H281 E282 Q283 D287 S288 T289	H281-F285 VanDerWaalsContact O-CB 3.3Å; H281-F285 WeakPolarHBondContact O-CB 3.41Å; H281-F285 PolarHBondContact O-N 3.38Å; E282-F285 PolarHBondContact O-N 3.29Å; Q283-F285 PolarHBondContact O-N 2.83Å; F285-D287 VanDerWaalsContact C-N 3.35Å; F285-D287 PolarHBondContact O-N 3.24Å; F285-S288 WeakPolarHBondContact CA-OG 3.47Å; F285-S288 PolarHBondContact O-N 2.86Å; F285-S288 PolarHBondContact O-OG 2.9Å; F285-T289 HydrophobicContact CD1-CG2 4.2Å; F285-T289 HydrophobicContact CE1-CG2 3.81Å; F285-T289 HydrophobicContact CE2-CG2 4.27Å; F285-T289 HydrophobicContact CZ-CG2 3.85Å; F285-T289 WeakPolarHBondContact O-CB 3.38Å; F285-T289 WeakPolarHBondContact O-CG2 3.42Å; F285-T289 PolarHBondContact O-N 3.35Å; F285-T289 PolarHBondContact O-OG1 3.17Å
286	L	63.7	Low	56.6	Low	106 Å²	106	90.7 Å²	90.7	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-61.1	-41.5	173.9	-70.6	165.8	0	0	0	112.1	E282 Q283 T289	E282-L286 VanDerWaalsContact O-CG 3.27Å; E282-L286 WeakPolarHBondContact O-CG 3.27Å; E282-L286 PolarHBondContact O-N 3.07Å; Q283-L286 WeakPolarHBondContact O-CB 3.31Å; Q283-L286 PolarHBondContact O-N 2.91Å; L286-T289 WeakPolarHBondContact CA-OG1 3.32Å; L286-T289 PolarHBondContact O-N 2.77Å; L286-T289 PolarHBondContact O-OG1 2.96Å; L286-T289 VanDerWaalsContact O-OG1 3.14Å
287	D	62	Low	54.8	Low	111 Å²	111	97.8 Å²	97.8	59%	0.594	55%	0.552	S	S	*	*	H	α-helix	trans	-64.9	-39.2	175.1	-63.6	-31.8	0	0	0	111.8	Q283 F285	Q283-D287 VanDerWaalsContact O-CG 3.26Å; Q283-D287 PolarHBondContact O-N 2.74Å; F285-D287 VanDerWaalsContact C-N 3.35Å; F285-D287 PolarHBondContact O-N 3.24Å
288	S	63	Low	52.5	Low	88 Å²	88	104.1 Å²	104.1	62%	0.615	59%	0.59	S	S	*	*	H	α-helix	trans	-74	-21.2	178.5	74.7	0	0	0	0	115.1	K284 F285	K284-S288 VanDerWaalsContact O-CB 3.23Å; K284-S288 WeakPolarHBondContact O-CB 3.36Å; K284-S288 PolarHBondContact O-N 2.82Å; K284-S288 PolarHBondContact O-OG 3.07Å; F285-S288 WeakPolarHBondContact CA-OG 3.47Å; F285-S288 PolarHBondContact O-N 2.86Å; F285-S288 PolarHBondContact O-OG 2.9Å
289	T	44.2	Very low	50.9	Low	58 Å²	58	109.7 Å²	109.7	36%	0.356	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	0.2	-174.7	42.7	0	0	0	0	113.5	F285 L286 L291	F285-T289 HydrophobicContact CD1-CG2 4.2Å; F285-T289 HydrophobicContact CE1-CG2 3.81Å; F285-T289 HydrophobicContact CE2-CG2 4.27Å; F285-T289 HydrophobicContact CZ-CG2 3.85Å; F285-T289 WeakPolarHBondContact O-CB 3.38Å; F285-T289 WeakPolarHBondContact O-CG2 3.42Å; F285-T289 PolarHBondContact O-N 3.35Å; F285-T289 PolarHBondContact O-OG1 3.17Å; L286-T289 WeakPolarHBondContact CA-OG1 3.32Å; L286-T289 PolarHBondContact O-N 2.77Å; L286-T289 PolarHBondContact O-OG1 2.96Å; L286-T289 VanDerWaalsContact O-OG1 3.14Å; T289-L291 PolarHBondContact O-N 3.21Å
290	G	41.2	Very low	49	Very low	62 Å²	62	109.9 Å²	109.9	64%	0.639	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.4	10.9	171.5	0	0	0	0	0	115.1	S292	G290-S292 VanDerWaalsContact C-N 3.3Å; G290-S292 PolarHBondContact O-N 2.76Å
291	L	40.2	Very low	47.2	Very low	156 Å²	156	110.4 Å²	110.4	82%	0.817	65%	0.65	S	S	*	*			trans	-95.4	34	-177.7	-70.5	170	0	0	0	112.6	T289	T289-L291 PolarHBondContact O-N 3.21Å
292	S	33.9	Very low	45.2	Very low	73 Å²	73	116 Å²	116	51%	0.51	68%	0.676	S	S	.	*			trans	-133.8	60.1	-177.3	49.6	0	0	0	0	112	G290 S294	G290-S292 VanDerWaalsContact C-N 3.3Å; G290-S292 PolarHBondContact O-N 2.76Å; S292-S294 PolarHBondContact O-N 3.23Å
293	S	32.7	Very low	43.4	Very low	110 Å²	110	115.7 Å²	115.7	77%	0.769	69%	0.685	S	S	*	*			trans	-65.4	124.1	178.4	57.6	0	0	0	0	112.9
294	S	33.2	Very low	41.7	Very low	111 Å²	111	116.3 Å²	116.3	78%	0.776	69%	0.687	S	S	*	*			trans	54.4	91.8	175.5	55.4	0	0	0	0	114.9	S292	S292-S294 PolarHBondContact O-N 3.23Å
295	A	31.9	Very low	40.3	Very low	90 Å²	90	116 Å²	116	74%	0.744	70%	0.698	S	S	*	*				69	118.9	63.2	0	0	0	0	0	115
296	L	32.9	Very low	38.9	Very low	175 Å²	175	114.8 Å²	114.8	92%	0.916	70%	0.702	S	S	*	*				-164.8	141.1	109.7	-104.3	162.4	0	0	0	111.3
297	E	30.6	Very low	37.6	Very low	174 Å²	174	120.9 Å²	120.9	81%	0.813	72%	0.718	S	S	*	*			trans	-88.5	162.4	-179	-58.1	161.3	116.7	0	0	111.2
298	T	29.9	Very low	36.4	Very low	141 Å²	141	120.4 Å²	120.4	87%	0.865	72%	0.721	S	S	*	*			trans	-133.9	98.8	160.1	55.6	0	0	0	0	109.9
299	P	34.4	Very low	35	Very low	122 Å²	122	127.2 Å²	127.2	79%	0.792	73%	0.733	S	S	*	*			trans	-72.1	162.8	170.2	31.9	-34.8	0	0	0	110.9
300	S	30.9	Very low	34.7	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	75%	0.747	S	S	*	*			trans	-90.2	147.4	-177	48.2	0	0	0	0	113.7
301	S	33.6	Very low	34.3	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	75%	0.751	S	S	*	*			trans	85.5	145.8	156.5	78.8	0	0	0	0	120.7
302	H	33.3	Very low	34.1	Very low	171 Å²	171	131 Å²	131	79%	0.792	75%	0.75	S	S	*	*			trans	75.4	114.2	165.9	-68.7	-75.6	0	0	0	122.7
303	C	31.2	Very low	34	Very low	105 Å²	105	135.6 Å²	135.6	71%	0.709	76%	0.761	S	S	*	*			trans	71.3	92	136.8	-61.1	0	0	0	0	122.4
304	E	33.1	Very low	34.1	Very low	135 Å²	135	136.4 Å²	136.4	63%	0.631	76%	0.762	S	S	*	*			trans	72.2	158.3	131.9	-69.6	-154.8	139	0	0	123.3	M29	M29-E304 WeakPolarHBondContact CE-OE2 3.41Å
305	P	41.8	Very low	34	Very low	109 Å²	109	134.4 Å²	134.4	71%	0.708	76%	0.758	S	S	*	*			trans	-114.4	-161.4	-165.3	43.4	-26.8	0	0	0	111.7
306	P	38.9	Very low	34.1	Very low	100 Å²	100	138.8 Å²	138.8	65%	0.649	77%	0.768	S	S	*	*			cis	-149.4	171.9	8.6	44.5	-23.7	0	0	0	121.1
307	R	36.3	Very low	33.9	Very low	234 Å²	234	141.5 Å²	141.5	88%	0.883	77%	0.766	S	S	*	*			trans	76.7	160.2	139.9	-83.2	173.4	-160.7	-114.4	3.7	120.6
308	P	37.9	Very low	34.1	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	77%	0.77	S	S	*	*				-145	-170.6	-127.5	47	-28.5	0	0	0	119.1
309	R	33.6	Very low	34.1	Very low	231 Å²	231	139.9 Å²	139.9	87%	0.872	77%	0.765	S	S	*	*			trans	77.3	165.4	155.6	-76.8	-175.9	-171.4	-158.1	4.1	118.1
310	P	37.3	Very low	34.2	Very low	101 Å²	101	140 Å²	140	66%	0.656	77%	0.765	S	S	*	*			cis	-144.7	160.9	-33	37.6	-19.4	0	0	0	118
311	S	32.8	Very low	34.3	Very low	102 Å²	102	141.5 Å²	141.5	71%	0.713	77%	0.769	S	S	*	*			trans	70.2	175.2	138.9	71.9	0	0	0	0	122.8
312	L	35.2	Very low	34	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	77%	0.77	S	S	*	*			trans	86.2	139.6	179.2	-56.5	-177.3	0	0	0	116.8
313	F	33.6	Very low	34	Very low	170 Å²	170	140.2 Å²	140.2	75%	0.746	77%	0.774	S	S	*	*			cis	-166.5	149.1	-21.8	-155.5	-117.4	0	0	0	110.6
314	T	34.7	Very low	34	Very low	127 Å²	127	142.5 Å²	142.5	78%	0.779	78%	0.778	S	S	*	*			trans	55.8	149.7	166.5	39.3	0	0	0	0	120
315	G	30.4	Very low	33.9	Very low	68 Å²	68	144 Å²	144	70%	0.701	79%	0.786	S	S	*	*			cis	131.6	120.3	-11	0	0	0	0	0	114.7
316	L	34	Very low	33.6	Very low	182 Å²	182	143.5 Å²	143.5	95%	0.953	78%	0.783	S	S	*	*			trans	-161.1	157.3	159.8	-111	168.1	0	0	0	110.7
317	R	27.6	Very low	33.6	Very low	232 Å²	232	144.7 Å²	144.7	88%	0.875	79%	0.791	S	S	*	*			trans	-116.6	159.1	-177.7	-65	174.7	173.2	169.5	-3.8	111
318	I	35.9	Very low	33.6	Very low	174 Å²	174	140.7 Å²	140.7	89%	0.892	79%	0.785	S	S	*	*			trans	-166.7	159.1	134.8	-99.9	150.8	0	0	0	110.3
319	S	29.1	Very low	33.6	Very low	108 Å²	108	143.2 Å²	143.2	76%	0.755	79%	0.788	S	S	*	*			trans	-92	169.5	-162.3	-39.2	0	0	0	0	114.7
320	P	38	Very low	33.6	Very low	123 Å²	123	139.5 Å²	139.5	80%	0.799	78%	0.781	S	S	*	*			trans	-94.8	167.1	-169.4	38.2	-36.3	0	0	0	115.3
321	V	32.8	Very low	33.4	Very low	142 Å²	142	143.1 Å²	143.1	86%	0.861	79%	0.794	S	S	*	*			trans	-139	144.1	168.9	178.5	0	0	0	0	110.2
322	S	27.5	Very low	33.4	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	79%	0.792	S	S	*	*			trans	-99.7	142.2	-180	54.6	0	0	0	0	113.5
323	T	32.1	Very low	33.3	Very low	140 Å²	140	143.5 Å²	143.5	86%	0.859	79%	0.794	S	S	*	*			trans	-151.6	158.6	165.1	-65.7	0	0	0	0	110.2
324	I	30.7	Very low	33.1	Very low	154 Å²	154	143.5 Å²	143.5	79%	0.79	79%	0.794	S	S	*	*			trans	-122.2	168.2	-166.7	-54.6	170.1	0	0	0	109.9
325	M	31.4	Very low	33.1	Very low	165 Å²	165	147.1 Å²	147.1	81%	0.813	80%	0.799	S	S	*	*			trans	88.1	164.1	166.7	-53.6	-171.8	70.4	0	0	117.1
326	P	36.3	Very low	33	Very low	99 Å²	99	152.4 Å²	152.4	64%	0.643	81%	0.805	S	S	*	*			cis	-134.3	175.7	-45.2	36.5	-20.3	0	0	0	113.9
327	P	39.2	Very low	33	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	80%	0.798	S	S	*	*			trans	-94	162.5	179.4	37.2	-35.9	0	0	0	115.3
328	I	35.9	Very low	33.4	Very low	149 Å²	149	143.8 Å²	143.8	76%	0.764	79%	0.793	S	S	*	*			trans	-142.3	122.3	-173.2	-74.5	-179.4	0	0	0	113.4
329	H	38	Very low	33.2	Very low	156 Å²	156	141.4 Å²	141.4	72%	0.722	79%	0.789	S	S	*	*			trans	52.4	158.5	144	-73.5	-119.3	0	0	0	122.6
330	Q	32.2	Very low	33.2	Very low	153 Å²	153	147.8 Å²	147.8	72%	0.715	80%	0.797	S	S	*	*			cis	179	148.5	-22.3	173.7	177.5	39.4	0	0	109.6
331	L	33.3	Very low	32.9	Very low	177 Å²	177	147.9 Å²	147.9	93%	0.927	80%	0.797	S	S	*	*			trans	-169.8	164.2	142.4	-104.1	165.3	0	0	0	110.8
332	A	33.9	Very low	32.7	Very low	82 Å²	82	146.4 Å²	146.4	68%	0.678	79%	0.793	S	S	*	*			trans	-118.2	-177.3	-164.3	0	0	0	0	0	112.2
333	E	33	Very low	33	Very low	180 Å²	180	150.7 Å²	150.7	84%	0.841	80%	0.802	S	S	*	*			cis	-152.6	157.9	30	-65.5	-175.5	125.9	0	0	116.6
334	F	30	Very low	32.6	Very low	170 Å²	170	150.7 Å²	150.7	75%	0.746	79%	0.792	S	S	*	*			trans	7.1	130.6	151.6	-77	-95.4	0	0	0	123.2
335	K	33.5	Very low	32.4	Very low	203 Å²	203	153.2 Å²	153.2	88%	0.883	79%	0.791	S	S	*	*				-164.7	171.2	97	-104.7	168.9	-174.9	171.8	0	113.3
336	Q	29.5	Very low	32.1	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	79%	0.785	S	S	*	*			trans	-106.6	168.4	-156.7	-68.7	167.6	-33.3	0	0	115.5
337	S	33.2	Very low	31.5	Very low	113 Å²	113	153.7 Å²	153.7	79%	0.79	80%	0.795	S	S	*	*			trans	-105.5	172.5	-177	56.1	0	0	0	0	114.2
338	P	35	Very low	30.9	Very low	120 Å²	120	155.1 Å²	155.1	78%	0.779	79%	0.794	S	S	*	*			trans	-131.6	164.9	144.5	24.1	-4.4	0	0	0	114.2
339	P	31.7	Very low	30.4	Very low	125 Å²	125	151.9 Å²	151.9	81%	0.812	79%	0.785	S	S	*	*			trans	-101.3	178	-168	39.8	-37.2	0	0	0	116.3
340	R	30.8	Very low	30.1	Very low	241 Å²	241	151.7 Å²	151.7	91%	0.909	79%	0.789	S	S	*	*			trans	-73.4	155.7	172.2	-70.6	-173.9	178.2	-168.6	0.8	113.6
341	P	31.9	Very low	29.8	Very low	126 Å²	126	150.8 Å²	150.8	82%	0.818	79%	0.789	S	S	*	*			trans	-113	178	142	37.6	-29.3	0	0	0	112.6
342	S	28	Very low	29.7	Very low	111 Å²	111	149.1 Å²	149.1	78%	0.776	78%	0.781	S	S	*	*			trans	-152.8	132.8	-177.6	54.9	0	0	0	0	112
343	E	32.7	Very low	29.3	Very low	197 Å²	197	152.2 Å²	152.2	92%	0.921	79%	0.785	S	S	*	*			trans	-177.4	176.3	172	-107.2	161.1	-138.9	0	0	108.4
344	E	25.1	Very low	29	Very low	139 Å²	139	152.8 Å²	152.8	65%	0.65	79%	0.787	S	S	*	*				-155.3	165.6	-70	-157.4	-174	-130	0	0	107.8
345	R	26.6	Very low	28.6	Very low	207 Å²	207	150.5 Å²	150.5	78%	0.781	79%	0.788	S	S	*	*			trans	70.4	159.9	162	-57.8	178.5	-163.5	-165.5	1.4	119.5
346	T	23.4	Very low	28.3	Very low	110 Å²	110	149.4 Å²	149.4	68%	0.675	79%	0.791	S	S	*	*			cis	-168.3	141.6	-41.9	34.6	0	0	0	0	109.8
347	L	24	Very low	28	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	79%	0.786	S	S	*	*			trans	64.9	162.5	158	-59.2	164.1	0	0	0	114.6
348	I	27.6	Very low	27.6	Very low	157 Å²	157	147 Å²	147	81%	0.805	78%	0.783	S	S	*	*			cis	-134.8	170.9	30.3	-73.1	167.2	0	0	0	111.2
349	S	25.6	Very low	27.1	Very low	81 Å²	81	147.6 Å²	147.6	57%	0.566	78%	0.775	S	S	*	*			trans	-74.2	169.2	-180	56	0	0	0	0	115.4
350	D	31.1	Very low	26.7	Very low	151 Å²	151	149 Å²	149	81%	0.807	78%	0.776	S	S	*	*				-165.6	162.2	105.7	-93	-3	0	0	0	113.3
351	N	26.7	Very low	26.4	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	77%	0.774	S	S	*	*			trans	-109.2	155.7	-169.2	-62.3	-72.5	0	0	0	112.5
352	N	29.6	Very low	26	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	76%	0.762	S	S	*	*			trans	163.8	122.8	133.4	-80.7	-21.8	0	0	0	109.2
353	I	26.6	Very low	25.8	Very low	148 Å²	148	144.1 Å²	144.1	76%	0.759	76%	0.76	S	S	*	*				61.7	117	91.8	-61.1	169.4	0	0	0	110
354	E	26.2	Very low	25.4	Very low	191 Å²	191	142.7 Å²	142.7	89%	0.893	75%	0.753	S	S	*	*			cis	-131.5	168.1	45.7	-67	-177.1	134.7	0	0	117
355	T	22.8	Very low	25.5	Very low	123 Å²	123	143.1 Å²	143.1	76%	0.755	76%	0.755	S	S	*	*			trans	-95.7	142.1	177	51.2	0	0	0	0	114
356	L	25.9	Very low	25.5	Very low	180 Å²	180	137.4 Å²	137.4	94%	0.942	75%	0.747	S	S	*	*			trans	-148.2	136	149.1	-103.3	174.5	0	0	0	111.2
357	N	23.1	Very low	25.6	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	74%	0.742	S	S	*	*			trans	-109	129.6	-168.8	-78.1	-58.1	0	0	0	113.9
358	S	24.8	Very low	25.9	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	72%	0.716	S	S	*	*			trans	-167.2	105.2	147.7	33.3	0	0	0	0	115.6
359	E	24.3	Very low	26.6	Very low	131 Å²	131	130.5 Å²	130.5	61%	0.612	71%	0.713	S	S	*	*			trans	18.6	108.1	131	-55.5	168.3	123.2	0	0	119.5	R133	R133-E359 IonicContact CZ-OE2 3.27Å; R133-E359 VanDerWaalsContact CZ-OE2 3.27Å; R133-E359 IonicContact NE-OE2 3.01Å; R133-E359 PolarHBondContact NE-OE2 2.87Å; R133-E359 IonicContact NH2-OE2 2.69Å; R133-E359 PolarHBondContact NH2-OE2 3.3Å
360	D	23.5	Very low	27.1	Very low	154 Å²	154	130.4 Å²	130.4	82%	0.824	70%	0.703	S	S	*	*				178.4	71.1	122.9	-111.8	-18.2	0	0	0	113.8	T362	D360-T362 PolarHBondContact O-N 3.29Å; D360-T362 VanDerWaalsContact O-N 3.16Å
361	T	24.8	Very low	27.5	Very low	142 Å²	142	124.6 Å²	124.6	87%	0.871	67%	0.67	S	S	*	*			trans	-84.7	88.5	174.9	38.3	0	0	0	0	112.5	I363	T361-I363 PolarHBondContact O-N 3.1Å
362	T	23.8	Very low	27.9	Very low	92 Å²	92	126.8 Å²	126.8	56%	0.564	67%	0.669	S	S	*	*			trans	-64.7	100.4	172.1	47.9	0	0	0	0	112.1	D360 Q364	D360-T362 PolarHBondContact O-N 3.29Å; D360-T362 VanDerWaalsContact O-N 3.16Å; T362-Q364 PolarHBondContact O-N 2.98Å
363	I	23.9	Very low	28	Very low	143 Å²	143	124.3 Å²	124.3	73%	0.733	66%	0.659	S	S	*	*			trans	-56.6	108.3	167.9	-58.9	174.8	0	0	0	108.5	T361	T361-I363 PolarHBondContact O-N 3.1Å
364	Q	24.7	Very low	28.2	Very low	167 Å²	167	121.9 Å²	121.9	78%	0.78	65%	0.647	S	S	*	*			trans	-82	125.4	170.8	-62.5	-172.8	14.5	0	0	108	T362 S366	T362-Q364 PolarHBondContact O-N 2.98Å; Q364-S366 PolarHBondContact O-N 2.86Å; Q364-S366 VanDerWaalsContact O-N 3.09Å
365	Q	25.8	Very low	28.6	Very low	148 Å²	148	119.3 Å²	119.3	69%	0.692	64%	0.635	S	S	*	*			trans	-68.2	108.3	168.4	-72.9	176.9	-43.3	0	0	107.9	G367	Q365-G367 PolarHBondContact O-N 3.11Å
366	S	26.3	Very low	29.3	Very low	87 Å²	87	115.8 Å²	115.8	61%	0.608	61%	0.613	S	S	*	*			trans	-53.9	131.1	173.7	31.2	0	0	0	0	109.7	Q364 N368	Q364-S366 PolarHBondContact O-N 2.86Å; Q364-S366 VanDerWaalsContact O-N 3.09Å; S366-N368 PolarHBondContact O-N 3.19Å; S366-N368 PolarHBondContact O-OD1 2.77Å
367	G	26.7	Very low	29.8	Very low	56 Å²	56	109.3 Å²	109.3	58%	0.577	58%	0.583	S	S	*	*			trans	-85.7	84.6	177.7	0	0	0	0	0	110.4	Q365 K369	Q365-G367 PolarHBondContact O-N 3.11Å; G367-K369 WeakPolarHBondContact O-CB 3.38Å; G367-K369 WeakPolarHBondContact O-CD 3.35Å; G367-K369 WeakPolarHBondContact O-CG 3.42Å; G367-K369 PolarHBondContact O-N 2.96Å
368	N	30.5	Very low	30.6	Very low	56 Å²	56	108 Å²	108	30%	0.299	57%	0.572	S	S	.	*			trans	-42	130.6	177.2	-75.4	70.2	0	0	0	112.4	S366 R372 D1020	S366-N368 PolarHBondContact O-N 3.19Å; S366-N368 PolarHBondContact O-OD1 2.77Å; N368-R372 PolarHBondContact O-NH1 2.96Å; N368-D1020 VanDerWaalsContact CB-OD1 3.23Å; N368-D1020 WeakPolarHBondContact CB-OD1 3.45Å; N368-D1020 PolarHBondContact ND2-OD1 3.41Å
369	K	41.1	Very low	31.4	Very low	173 Å²	173	106.3 Å²	106.3	75%	0.752	57%	0.565	S	S	*	*			trans	-150.7	-5.4	-155.1	-106.9	175	-177.1	-179.4	0	114	G367	G367-K369 WeakPolarHBondContact O-CB 3.38Å; G367-K369 WeakPolarHBondContact O-CD 3.35Å; G367-K369 WeakPolarHBondContact O-CG 3.42Å; G367-K369 PolarHBondContact O-N 2.96Å
370	F	36.5	Very low	32.4	Very low	80 Å²	80	102.4 Å²	102.4	35%	0.351	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-55.5	-162.3	-147.6	-94.6	0	0	0	111.2	R372 A1012 I1017 D1020	F370-R372 PolarHBondContact O-N 3.45Å; F370-A1012 HydrophobicContact CE1-CB 3.46Å; F370-A1012 VanDerWaalsContact CE1-CB 3.46Å; F370-A1012 HydrophobicContact CE2-CB 4.11Å; F370-A1012 HydrophobicContact CZ-CB 3.21Å; F370-I1017 HydrophobicContact CD1-CG1 3.92Å; F370-I1017 HydrophobicContact CE1-CD1 4.32Å; F370-I1017 HydrophobicContact CE1-CG1 3.94Å; F370-D1020 WeakPolarHBondContact CA-OD2 3.3Å; F370-D1020 VanDerWaalsContact CB-OD2 3.29Å; F370-D1020 WeakPolarHBondContact CB-OD2 3.33Å; F370-D1020 PolarHBondContact N-OD2 3.05Å
371	F	40.7	Very low	33.5	Very low	29 Å²	29	99.1 Å²	99.1	13%	0.127	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	22.9	177.1	-69.2	-85.2	0	0	0	114.1	T373 L1003 H1009 I1017 D1020 M1024 L1032	F371-T373 VanDerWaalsContact C-N 3.25Å; F371-T373 PolarHBondContact O-N 3.34Å; F371-T373 VanDerWaalsContact O-N 3.15Å; F371-L1003 HydrophobicContact CE1-CD1 4.17Å; F371-L1003 HydrophobicContact CZ-CD1 3.85Å; F371-H1009 AromaticContact CE1-NE2 3.97Å; F371-I1017 HydrophobicContact CE2-CB 4.02Å; F371-I1017 HydrophobicContact CE2-CG1 3.88Å; F371-I1017 HydrophobicContact CE2-CG2 3.68Å; F371-I1017 HydrophobicContact CZ-CB 4.39Å; F371-I1017 HydrophobicContact CZ-CD1 4.45Å; F371-I1017 HydrophobicContact CZ-CG1 4.03Å; F371-I1017 HydrophobicContact CZ-CG2 3.8Å; F371-D1020 HydrophobicContact CD2-CB 3.7Å; F371-D1020 HydrophobicContact CE2-CB 4.41Å; F371-D1020 PolarHBondContact N-OD2 3.17Å; F371-M1024 HydrophobicContact CB-SD 4.42Å; F371-L1032 HydrophobicContact CD1-CD1 4.03Å; F371-L1032 HydrophobicContact CD1-CD2 4.21Å; F371-L1032 HydrophobicContact CE1-CD1 4.38Å
372	R	34.6	Very low	34.7	Very low	181 Å²	181	98.8 Å²	98.8	68%	0.683	51%	0.511	S	S	*	.			trans	-88.5	61.7	172.5	-73.5	-170.2	167.3	131.1	4.9	111.5	N368 F370	N368-R372 PolarHBondContact O-NH1 2.96Å; F370-R372 PolarHBondContact O-N 3.45Å
373	T	31.4	Very low	35.8	Very low	89 Å²	89	99.9 Å²	99.9	55%	0.546	51%	0.508	S	S	.	.			trans	-58.1	140.2	162.2	51.1	0	0	0	0	109.7	F371 H375	F371-T373 VanDerWaalsContact C-N 3.25Å; F371-T373 PolarHBondContact O-N 3.34Å; F371-T373 VanDerWaalsContact O-N 3.15Å; T373-H375 PolarHBondContact O-N 2.94Å
374	D	30.5	Very low	37	Very low	97 Å²	97	100.9 Å²	100.9	52%	0.519	50%	0.503	S	S	.	.	S	Bend	trans	-84.7	40.6	-154.2	-117.1	-31.7	0	0	0	115	P256 V376 K381	P256-D374 HydrophobicContact CG-CB 3.99Å; D374-V376 VanDerWaalsContact C-N 3.3Å; D374-V376 PolarHBondContact O-N 2.88Å; D374-K381 IonicContact OD1-NZ 2.62Å; D374-K381 PolarHBondContact OD1-NZ 3.47Å
375	H	35.7	Very low	38.1	Very low	137 Å²	137	94.5 Å²	94.5	63%	0.634	48%	0.481	S	S	*	.			trans	-78.6	-6.9	179.9	-63.8	-80.7	0	0	0	114.3	T373 S377	T373-H375 PolarHBondContact O-N 2.94Å; H375-S377 PolarHBondContact O-N 2.82Å
376	V	36.6	Very low	39	Very low	48 Å²	48	92.5 Å²	92.5	29%	0.291	47%	0.468	S	S	.	.	S	Bend	trans	-73.9	96.7	169.7	-173.1	0	0	0	0	108.1	D374 Q380 K381	D374-V376 VanDerWaalsContact C-N 3.3Å; D374-V376 PolarHBondContact O-N 2.88Å; V376-Q380 HydrophobicContact CG1-CB 3.67Å; V376-K381 HydrophobicContact CB-CG 4.36Å; V376-K381 HydrophobicContact CG1-CG 3.81Å; V376-K381 WeakPolarHBondContact O-CE 3.46Å
377	S	36.9	Very low	39.9	Very low	45 Å²	45	92.2 Å²	92.2	32%	0.315	46%	0.459	S	S	.	.			trans	-53.7	154.1	-175.3	74.6	0	0	0	0	112.6	H375 A379 Q380 K381	H375-S377 PolarHBondContact O-N 2.82Å; S377-A379 PolarHBondContact O-N 2.9Å; S377-A379 VanDerWaalsContact O-N 3.11Å; S377-Q380 CarbonylContact O-C 3.58Å; S377-Q380 WeakPolarHBondContact O-CA 3.29Å; S377-Q380 WeakPolarHBondContact O-CB 3.45Å; S377-Q380 PolarHBondContact O-N 3.48Å; S377-Q380 PolarHBondContact OG-N 3.23Å; S377-K381 PolarHBondContact O-N 3.46Å
378	E	40.2	Very low	40.7	Very low	108 Å²	108	93.6 Å²	93.6	51%	0.505	45%	0.454	S	S	.	.	H	α-helix	trans	-53.8	-34	175.4	-105.4	-68.5	104.8	0	0	112	K381 K382	E378-K381 PolarHBondContact O-N 2.89Å; E378-K382 VanDerWaalsContact O-CB 3.23Å; E378-K382 WeakPolarHBondContact O-CB 3.36Å; E378-K382 WeakPolarHBondContact O-CD 3.5Å; E378-K382 VanDerWaalsContact O-CG 3.28Å; E378-K382 WeakPolarHBondContact O-CG 3.36Å; E378-K382 PolarHBondContact O-N 2.93Å; E378-K382 WeakPolarHBondContact OE2-CE 3.25Å; E378-K382 IonicContact OE2-NZ 2.96Å; E378-K382 PolarHBondContact OE2-NZ 3.43Å
379	A	42	Very low	41.4	Very low	70 Å²	70	99.2 Å²	99.2	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-65.3	-42.4	172.2	0	0	0	0	0	112.7	S377 K383	S377-A379 PolarHBondContact O-N 2.9Å; S377-A379 VanDerWaalsContact O-N 3.11Å; A379-K383 WeakPolarHBondContact O-CB 3.44Å; A379-K383 PolarHBondContact O-N 3.24Å
380	Q	43.8	Very low	41.4	Very low	49 Å²	49	94.9 Å²	94.9	23%	0.229	45%	0.453	C	S	.	.	H	α-helix	trans	-68.6	-39.3	173.6	-74.4	-173.8	-8.7	0	0	112.8	V376 S377 K383 R384 S1103	V376-Q380 HydrophobicContact CG1-CB 3.67Å; S377-Q380 CarbonylContact O-C 3.58Å; S377-Q380 WeakPolarHBondContact O-CA 3.29Å; S377-Q380 WeakPolarHBondContact O-CB 3.45Å; S377-Q380 PolarHBondContact O-N 3.48Å; S377-Q380 PolarHBondContact OG-N 3.23Å; Q380-K383 PolarHBondContact O-N 3.16Å; Q380-R384 WeakPolarHBondContact O-CB 3.3Å; Q380-R384 PolarHBondContact O-N 3.39Å; Q380-S1103 VanDerWaalsContact NE2-CB 3.27Å; Q380-S1103 PolarHBondContact NE2-OG 2.9Å
381	K	47.2	Very low	41.4	Very low	84 Å²	84	95 Å²	95	37%	0.365	46%	0.456	S	S	.	.	H	α-helix	trans	-61.2	-46.9	173.4	-72.5	174.5	178.1	164.3	0	110.5	D374 V376 S377 E378 G385	D374-K381 IonicContact OD1-NZ 2.62Å; D374-K381 PolarHBondContact OD1-NZ 3.47Å; V376-K381 HydrophobicContact CB-CG 4.36Å; V376-K381 HydrophobicContact CG1-CG 3.81Å; V376-K381 WeakPolarHBondContact O-CE 3.46Å; S377-K381 PolarHBondContact O-N 3.46Å; E378-K381 PolarHBondContact O-N 2.89Å; K381-G385 PolarHBondContact O-N 2.94Å
382	K	51	Low	41.1	Very low	135 Å²	135	101.9 Å²	101.9	59%	0.587	48%	0.481	S	S	*	.	H	α-helix	trans	-63	-40.8	172.9	-77.1	162.9	169.6	146.4	0	112.7	E378 G385 Y386	E378-K382 VanDerWaalsContact O-CB 3.23Å; E378-K382 WeakPolarHBondContact O-CB 3.36Å; E378-K382 WeakPolarHBondContact O-CD 3.5Å; E378-K382 VanDerWaalsContact O-CG 3.28Å; E378-K382 WeakPolarHBondContact O-CG 3.36Å; E378-K382 PolarHBondContact O-N 2.93Å; E378-K382 WeakPolarHBondContact OE2-CE 3.25Å; E378-K382 IonicContact OE2-NZ 2.96Å; E378-K382 PolarHBondContact OE2-NZ 3.43Å; K382-G385 CarbonylContact O-C 3.52Å; K382-G385 WeakPolarHBondContact O-CA 3.47Å; K382-G385 PolarHBondContact O-N 2.72Å; K382-Y386 WeakPolarHBondContact O-CB 3.43Å; K382-Y386 PolarHBondContact O-N 3.1Å
383	K	46.7	Very low	41.2	Very low	115 Å²	115	98.4 Å²	98.4	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-67.7	-43.7	177.7	-172.8	172.9	-178	176.3	0	112.2	A379 Q380 G385 Y386 I387	A379-K383 WeakPolarHBondContact O-CB 3.44Å; A379-K383 PolarHBondContact O-N 3.24Å; Q380-K383 PolarHBondContact O-N 3.16Å; K383-G385 VanDerWaalsContact C-N 3.31Å; K383-G385 PolarHBondContact O-N 3.08Å; K383-Y386 PolarHBondContact O-N 2.85Å; K383-I387 HydrophobicContact CG-CD1 3.99Å; K383-I387 WeakPolarHBondContact O-CB 3.42Å; K383-I387 VanDerWaalsContact O-CG1 3.3Å; K383-I387 WeakPolarHBondContact O-CG1 2.91Å; K383-I387 PolarHBondContact O-N 3.05Å
384	R	48.1	Very low	41.2	Very low	165 Å²	165	97 Å²	97	62%	0.623	47%	0.474	S	S	*	.	H	α-helix	trans	-61.8	-39.4	168.7	-80.1	-177.9	166.5	176.4	-2.4	111.2	Q380 N388	Q380-R384 WeakPolarHBondContact O-CB 3.3Å; Q380-R384 PolarHBondContact O-N 3.39Å; R384-N388 WeakPolarHBondContact O-CB 3.29Å; R384-N388 PolarHBondContact O-N 2.62Å; R384-N388 PolarHBondContact O-ND2 3.25Å
385	G	47.3	Very low	41.2	Very low	32 Å²	32	96.4 Å²	96.4	33%	0.33	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-39.8	173.7	0	0	0	0	0	113.6	K381 K382 K383 R389	K381-G385 PolarHBondContact O-N 2.94Å; K382-G385 CarbonylContact O-C 3.52Å; K382-G385 WeakPolarHBondContact O-CA 3.47Å; K382-G385 PolarHBondContact O-N 2.72Å; K383-G385 VanDerWaalsContact C-N 3.31Å; K383-G385 PolarHBondContact O-N 3.08Å; G385-R389 VanDerWaalsContact O-CB 3.26Å; G385-R389 WeakPolarHBondContact O-CB 3.49Å; G385-R389 PolarHBondContact O-N 3.25Å
386	Y	45.8	Very low	40.8	Very low	106 Å²	106	96 Å²	96	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-71.8	-50	176.4	-166.5	-82	0	0	0	111.2	K382 K383 N388 R389 E390	K382-Y386 WeakPolarHBondContact O-CB 3.43Å; K382-Y386 PolarHBondContact O-N 3.1Å; K383-Y386 PolarHBondContact O-N 2.85Å; Y386-N388 VanDerWaalsContact C-N 3.33Å; Y386-N388 PolarHBondContact O-N 3.23Å; Y386-R389 CarbonylContact O-C 3.58Å; Y386-R389 WeakPolarHBondContact O-CA 3.39Å; Y386-R389 WeakPolarHBondContact O-CB 3.41Å; Y386-R389 PolarHBondContact O-N 2.85Å; Y386-E390 HydrophobicContact CE1-CB 4.49Å; Y386-E390 WeakPolarHBondContact O-CB 3.33Å; Y386-E390 PolarHBondContact O-N 3.15Å
387	I	44.1	Very low	40.3	Very low	81 Å²	81	98 Å²	98	42%	0.415	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-43.6	176.6	-67.7	167.1	0	0	0	110.4	K383 R389 E390 M391	K383-I387 HydrophobicContact CG-CD1 3.99Å; K383-I387 WeakPolarHBondContact O-CB 3.42Å; K383-I387 VanDerWaalsContact O-CG1 3.3Å; K383-I387 WeakPolarHBondContact O-CG1 2.91Å; K383-I387 PolarHBondContact O-N 3.05Å; I387-R389 VanDerWaalsContact C-N 3.27Å; I387-R389 PolarHBondContact O-N 2.89Å; I387-E390 PolarHBondContact O-N 2.87Å; I387-M391 HydrophobicContact CG2-CG 4.11Å; I387-M391 WeakPolarHBondContact O-CB 3.36Å; I387-M391 WeakPolarHBondContact O-CG 3.4Å; I387-M391 PolarHBondContact O-N 3.33Å
388	N	45	Very low	39.8	Very low	86 Å²	86	102.8 Å²	102.8	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-29.3	174.7	-75.2	-27.2	0	0	0	112.6	R384 Y386 R392	R384-N388 WeakPolarHBondContact O-CB 3.29Å; R384-N388 PolarHBondContact O-N 2.62Å; R384-N388 PolarHBondContact O-ND2 3.25Å; Y386-N388 VanDerWaalsContact C-N 3.33Å; Y386-N388 PolarHBondContact O-N 3.23Å; N388-R392 WeakPolarHBondContact O-CB 3.46Å; N388-R392 VanDerWaalsContact O-CD 3.25Å; N388-R392 WeakPolarHBondContact O-CD 3.5Å; N388-R392 WeakPolarHBondContact O-CG 3.22Å; N388-R392 PolarHBondContact O-N 3.35Å
389	R	43.8	Very low	39	Very low	174 Å²	174	103.2 Å²	103.2	66%	0.657	54%	0.539	S	S	*	.	H	α-helix	trans	-73.5	-44.4	174.4	-168	-179.8	-57.7	-171.6	0.3	111.3	G385 Y386 I387 R392 T393	G385-R389 VanDerWaalsContact O-CB 3.26Å; G385-R389 WeakPolarHBondContact O-CB 3.49Å; G385-R389 PolarHBondContact O-N 3.25Å; Y386-R389 CarbonylContact O-C 3.58Å; Y386-R389 WeakPolarHBondContact O-CA 3.39Å; Y386-R389 WeakPolarHBondContact O-CB 3.41Å; Y386-R389 PolarHBondContact O-N 2.85Å; I387-R389 VanDerWaalsContact C-N 3.27Å; I387-R389 PolarHBondContact O-N 2.89Å; R389-R392 PolarHBondContact O-N 3.29Å; R389-T393 WeakPolarHBondContact O-CG2 3.47Å; R389-T393 PolarHBondContact O-N 3.17Å; R389-T393 PolarHBondContact O-OG1 3.17Å; R389-T393 VanDerWaalsContact O-OG1 3.07Å
390	E	41.6	Very low	38.4	Very low	81 Å²	81	106.9 Å²	106.9	38%	0.379	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-37.1	179.5	-162.9	170.9	-144	0	0	111.9	Y386 I387 T393 S394 R779	Y386-E390 HydrophobicContact CE1-CB 4.49Å; Y386-E390 WeakPolarHBondContact O-CB 3.33Å; Y386-E390 PolarHBondContact O-N 3.15Å; I387-E390 PolarHBondContact O-N 2.87Å; E390-T393 WeakPolarHBondContact CA-OG1 3.44Å; E390-T393 PolarHBondContact O-OG1 2.9Å; E390-T393 VanDerWaalsContact O-OG1 3.11Å; E390-S394 WeakPolarHBondContact O-CB 3.37Å; E390-S394 PolarHBondContact O-N 3.12Å; E390-S394 PolarHBondContact O-OG 3.27Å; E390-R779 IonicContact OE1-NH2 2.68Å
391	M	37.2	Very low	37.5	Very low	84 Å²	84	109.5 Å²	109.5	41%	0.414	58%	0.578	S	S	.	*	H	α-helix	trans	-62.8	-51.9	167.1	-70.1	-74.1	-81.5	0	0	110.3	I387 T393 S394 T395	I387-M391 HydrophobicContact CG2-CG 4.11Å; I387-M391 WeakPolarHBondContact O-CB 3.36Å; I387-M391 WeakPolarHBondContact O-CG 3.4Å; I387-M391 PolarHBondContact O-N 3.33Å; M391-T393 VanDerWaalsContact C-N 3.29Å; M391-T393 PolarHBondContact O-N 2.88Å; M391-S394 CarbonylContact O-C 3.52Å; M391-S394 WeakPolarHBondContact O-CA 3.49Å; M391-S394 PolarHBondContact O-N 3.04Å; M391-S394 PolarHBondContact O-OG 2.82Å; M391-T395 WeakPolarHBondContact O-CG2 3.4Å; M391-T395 PolarHBondContact O-N 3.5Å; M391-T395 PolarHBondContact O-OG1 2.97Å
392	R	33.9	Very low	36.4	Very low	173 Å²	173	117.3 Å²	117.3	65%	0.653	61%	0.605	S	S	*	*	H	α-helix	trans	-59	-35.8	176.7	-75.1	166.9	-172.2	-174.7	1	112.9	N388 R389 S394 V396	N388-R392 WeakPolarHBondContact O-CB 3.46Å; N388-R392 VanDerWaalsContact O-CD 3.25Å; N388-R392 WeakPolarHBondContact O-CD 3.5Å; N388-R392 WeakPolarHBondContact O-CG 3.22Å; N388-R392 PolarHBondContact O-N 3.35Å; R389-R392 PolarHBondContact O-N 3.29Å; R392-S394 VanDerWaalsContact C-N 3.3Å; R392-S394 PolarHBondContact O-N 3.3Å; R392-V396 WeakPolarHBondContact O-CB 3.48Å; R392-V396 WeakPolarHBondContact O-CG2 3.2Å; R392-V396 PolarHBondContact O-N 3.32Å
393	T	35.7	Very low	35.2	Very low	108 Å²	108	118.2 Å²	118.2	66%	0.663	62%	0.615	S	S	*	*	H	α-helix	trans	-78.3	-8.6	173.6	53	0	0	0	0	114.4	R389 E390 M391	R389-T393 WeakPolarHBondContact O-CG2 3.47Å; R389-T393 PolarHBondContact O-N 3.17Å; R389-T393 PolarHBondContact O-OG1 3.17Å; R389-T393 VanDerWaalsContact O-OG1 3.07Å; E390-T393 WeakPolarHBondContact CA-OG1 3.44Å; E390-T393 PolarHBondContact O-OG1 2.9Å; E390-T393 VanDerWaalsContact O-OG1 3.11Å; M391-T393 VanDerWaalsContact C-N 3.29Å; M391-T393 PolarHBondContact O-N 2.88Å
394	S	33.1	Very low	34.1	Very low	60 Å²	60	122.3 Å²	122.3	42%	0.42	63%	0.632	S	S	.	*	H	α-helix	trans	-111.8	-2	173.6	56.6	0	0	0	0	114.4	E390 M391 R392 R1274	E390-S394 WeakPolarHBondContact O-CB 3.37Å; E390-S394 PolarHBondContact O-N 3.12Å; E390-S394 PolarHBondContact O-OG 3.27Å; M391-S394 CarbonylContact O-C 3.52Å; M391-S394 WeakPolarHBondContact O-CA 3.49Å; M391-S394 PolarHBondContact O-N 3.04Å; M391-S394 PolarHBondContact O-OG 2.82Å; R392-S394 VanDerWaalsContact C-N 3.3Å; R392-S394 PolarHBondContact O-N 3.3Å; S394-R1274 PolarHBondContact OG-NH2 2.88Å
395	T	29.7	Very low	33.1	Very low	84 Å²	84	122.2 Å²	122.2	52%	0.515	64%	0.642	S	S	.	*	H	α-helix	trans	-120	0.1	172.6	68.4	0	0	0	0	113.9	M391 S397	M391-T395 WeakPolarHBondContact O-CG2 3.4Å; M391-T395 PolarHBondContact O-N 3.5Å; M391-T395 PolarHBondContact O-OG1 2.97Å; T395-S397 VanDerWaalsContact C-N 3.3Å; T395-S397 PolarHBondContact O-N 2.96Å; T395-S397 VanDerWaalsContact O-N 3.09Å
396	V	26.8	Very low	31.9	Very low	129 Å²	129	127.1 Å²	127.1	78%	0.782	67%	0.666	S	S	*	*			trans	-83.2	80.7	170.1	171.2	0	0	0	0	109.5	R392	R392-V396 WeakPolarHBondContact O-CB 3.48Å; R392-V396 WeakPolarHBondContact O-CG2 3.2Å; R392-V396 PolarHBondContact O-N 3.32Å
397	S	26.4	Very low	31	Very low	90 Å²	90	127.2 Å²	127.2	63%	0.629	69%	0.689	S	S	*	*	S	Bend	trans	-142.8	135.8	161.1	47.2	0	0	0	0	108.2	T395	T395-S397 VanDerWaalsContact C-N 3.3Å; T395-S397 PolarHBondContact O-N 2.96Å; T395-S397 VanDerWaalsContact O-N 3.09Å
398	T	26.2	Very low	30.2	Very low	145 Å²	145	128.2 Å²	128.2	89%	0.89	70%	0.703	S	S	*	*	S	Bend	trans	58	70.4	176.9	38.6	0	0	0	0	117.7
399	S	24.2	Very low	29.3	Very low	116 Å²	116	132.5 Å²	132.5	81%	0.811	72%	0.72	S	S	*	*			trans	-162.6	82.1	147.1	66.3	0	0	0	0	113.3
400	V	28.9	Very low	28.6	Very low	148 Å²	148	130.5 Å²	130.5	90%	0.897	73%	0.727	S	S	*	*			trans	-137.6	123.4	165.9	-177.7	0	0	0	0	109.3
401	S	25.6	Very low	27.9	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	75%	0.749	S	S	*	*			trans	-84.5	158.8	178.9	39	0	0	0	0	112.3	I403	S401-I403 PolarHBondContact O-N 3.02Å
402	R	22.8	Very low	27.4	Very low	248 Å²	248	137.4 Å²	137.4	94%	0.936	76%	0.759	S	S	*	*			trans	-66.4	129.6	179.5	-63.4	174.8	-179.2	160.4	-1.1	111.2
403	I	26.6	Very low	27.4	Very low	154 Å²	154	136.3 Å²	136.3	79%	0.79	77%	0.766	S	S	*	*			trans	-129.7	121.6	150.5	-61.6	-178.4	0	0	0	107.2	S401	S401-I403 PolarHBondContact O-N 3.02Å
404	K	22.6	Very low	27	Very low	201 Å²	201	138.7 Å²	138.7	87%	0.874	77%	0.773	S	S	*	*			trans	-85.3	140.9	162.5	-71.5	179.6	174.8	-177.2	0	107.7
405	I	26.8	Very low	26.7	Very low	162 Å²	162	143.3 Å²	143.3	83%	0.831	79%	0.794	S	S	*	*			trans	-154.4	144.4	144.1	-99.4	140.9	0	0	0	107.2
406	T	23.3	Very low	26.7	Very low	136 Å²	136	144.6 Å²	144.6	83%	0.834	81%	0.806	S	S	*	*			trans	-87.3	152.9	-177.5	42.6	0	0	0	0	111.7
407	A	27.5	Very low	26.8	Very low	108 Å²	108	146.8 Å²	146.8	89%	0.893	81%	0.807	S	S	*	*			trans	-137.3	138.8	163	0	0	0	0	0	108.8
408	S	25.6	Very low	26.8	Very low	101 Å²	101	149.4 Å²	149.4	71%	0.706	82%	0.815	S	S	*	*			trans	-145.4	152.4	179.6	50.9	0	0	0	0	108.7
409	E	26.3	Very low	26.8	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	80%	0.8	S	S	*	*			trans	69.5	151.9	-179.8	-41.2	-169	128	0	0	113.1
410	V	29.9	Very low	26.9	Very low	133 Å²	133	147.8 Å²	147.8	81%	0.806	80%	0.803	S	S	*	*			cis	-124.4	155.4	12.1	-170.3	0	0	0	0	111.6
411	R	26.2	Very low	26.8	Very low	222 Å²	222	144.3 Å²	144.3	84%	0.838	80%	0.797	S	S	*	*			trans	-43.8	173.3	155.8	-69.4	175.7	179.4	118.3	-3	113.6
412	S	27.5	Very low	27	Very low	88 Å²	88	148.8 Å²	148.8	62%	0.615	80%	0.804	S	S	*	*			cis	-171.8	166	-26.6	51.8	0	0	0	0	106.1
413	D	32.8	Very low	27.2	Very low	149 Å²	149	144 Å²	144	80%	0.797	81%	0.805	S	S	*	*				169.8	167.5	125.5	-80.8	-3.3	0	0	0	109.8
414	L	28.1	Very low	27.3	Very low	158 Å²	158	140.1 Å²	140.1	83%	0.827	80%	0.802	S	S	*	*			trans	-134.6	162.6	-158.3	-77.7	169.7	0	0	0	113.3
415	N	27.1	Very low	27.7	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	78%	0.784	S	S	*	*			trans	74.4	151.1	172.1	-46.3	-29.8	0	0	0	114.3
416	S	30.5	Very low	27.8	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	78%	0.778	S	S	*	*			cis	-133.7	-176.4	7	61.3	0	0	0	0	113.2
417	E	27.6	Very low	28.1	Very low	175 Å²	175	131 Å²	131	82%	0.818	78%	0.777	S	S	*	*			trans	-51.3	161.7	167.8	-64.7	142.9	156.4	0	0	112
418	D	27.6	Very low	28.3	Very low	146 Å²	146	132.9 Å²	132.9	78%	0.781	76%	0.764	S	S	*	*			cis	-164.5	161.1	41.5	-161.6	3	0	0	0	115.4
419	S	25.5	Very low	28.6	Very low	83 Å²	83	137.9 Å²	137.9	58%	0.58	77%	0.769	S	S	*	*			trans	57	137.1	152.2	85.8	0	0	0	0	123.7
420	T	26.8	Very low	28.8	Very low	143 Å²	143	136.7 Å²	136.7	88%	0.877	77%	0.767	S	S	*	*			trans	67.8	119.8	159.7	74.8	0	0	0	0	119.9
421	G	26.9	Very low	28.9	Very low	75 Å²	75	134.7 Å²	134.7	77%	0.773	77%	0.765	S	S	*	*			trans	163.3	89.7	164.9	0	0	0	0	0	119.7
422	K	29.5	Very low	29.1	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.865	77%	0.766	S	S	*	*			trans	37.2	123.7	144.9	-62.8	168.5	-177.3	168.2	0	120	G424	K422-G424 PolarHBondContact O-N 3.11Å; K422-G424 VanDerWaalsContact O-N 3.15Å
423	P	27.2	Very low	29.1	Very low	147 Å²	147	134.7 Å²	134.7	96%	0.955	77%	0.769	S	S	*	*	S	Bend	trans	-70	110.9	176.3	29.7	-34.2	0	0	0	112.1
424	G	28.4	Very low	28.7	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	77%	0.771	S	S	*	*			trans	-145.4	1.6	-161.1	0	0	0	0	0	120.8	K422	K422-G424 PolarHBondContact O-N 3.11Å; K422-G424 VanDerWaalsContact O-N 3.15Å
425	D	29.9	Very low	28.7	Very low	92 Å²	92	129.5 Å²	129.5	49%	0.492	77%	0.766	S	S	.	*			trans	-138.3	8.9	-173.3	-126.8	-15.8	0	0	0	118.1	V427 K428	D425-V427 PolarHBondContact O-N 3.29Å; D425-K428 PolarHBondContact O-N 2.95Å; D425-K428 VanDerWaalsContact O-N 3.13Å; D425-K428 VanDerWaalsContact OD1-CD 3.27Å; D425-K428 WeakPolarHBondContact OD1-CD 3.04Å; D425-K428 WeakPolarHBondContact OD1-CE 3.08Å; D425-K428 WeakPolarHBondContact OD1-CG 3.22Å; D425-K428 IonicContact OD1-NZ 3.25Å; D425-K428 PolarHBondContact OD1-NZ 3.3Å; D425-K428 IonicContact OD2-NZ 2.7Å; D425-K428 PolarHBondContact OD2-NZ 3.47Å
426	A	29.7	Very low	28.5	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	77%	0.767	S	S	*	*	H	α-helix	trans	-58.9	-18.9	176.5	0	0	0	0	0	114.3
427	V	29.6	Very low	28.4	Very low	131 Å²	131	128.4 Å²	128.4	79%	0.794	76%	0.764	S	S	*	*	H	α-helix	trans	-76.6	-21.4	-179.3	-177.9	0	0	0	0	112.7	D425	D425-V427 PolarHBondContact O-N 3.29Å
428	K	32.7	Very low	28.2	Very low	146 Å²	146	127.4 Å²	127.4	64%	0.635	76%	0.764	S	S	*	*	H	α-helix	trans	-76	-30.2	-179.2	-96.5	-171.8	-159.1	112.7	0	114.3	D425	D425-K428 PolarHBondContact O-N 2.95Å; D425-K428 VanDerWaalsContact O-N 3.13Å; D425-K428 VanDerWaalsContact OD1-CD 3.27Å; D425-K428 WeakPolarHBondContact OD1-CD 3.04Å; D425-K428 WeakPolarHBondContact OD1-CE 3.08Å; D425-K428 WeakPolarHBondContact OD1-CG 3.22Å; D425-K428 IonicContact OD1-NZ 3.25Å; D425-K428 PolarHBondContact OD1-NZ 3.3Å; D425-K428 IonicContact OD2-NZ 2.7Å; D425-K428 PolarHBondContact OD2-NZ 3.47Å
429	Y	30.7	Very low	28.2	Very low	207 Å²	207	125.4 Å²	125.4	81%	0.812	76%	0.762	S	S	*	*	H	α-helix	trans	-81.2	-35	-173	-115	-89.1	0	0	0	113.8	A431	Y429-A431 PolarHBondContact O-N 2.92Å
430	L	31.4	Very low	28.2	Very low	150 Å²	150	128.4 Å²	128.4	79%	0.785	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-75.1	-7.1	-179.1	-75.1	164.9	0	0	0	114.1	K432	L430-K432 PolarHBondContact O-N 3.39Å
431	A	31	Very low	28.1	Very low	91 Å²	91	127.1 Å²	127.1	75%	0.752	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-77	-0.5	178.1	0	0	0	0	0	114.5	Y429	Y429-A431 PolarHBondContact O-N 2.92Å
432	K	30.5	Very low	28	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-119.4	-1.4	-168.1	-148.2	172	-176.7	179.6	0	115.4	L430	L430-K432 PolarHBondContact O-N 3.39Å
433	V	27.1	Very low	27.9	Very low	114 Å²	114	134.6 Å²	134.6	69%	0.691	78%	0.778	S	S	*	*			trans	-120.6	80.9	-175.6	-170.7	0	0	0	0	110.5	V435	V433-V435 HydrophobicContact CG1-CG2 4.18Å
434	G	25.6	Very low	27.8	Very low	81 Å²	81	139.1 Å²	139.1	84%	0.835	78%	0.776	S	S	*	*			trans	-92.3	117.7	173.8	0	0	0	0	0	111.4
435	V	27.4	Very low	27.8	Very low	118 Å²	118	140.7 Å²	140.7	72%	0.715	78%	0.776	S	S	*	*			trans	-123.5	118.2	-179.6	-179.7	0	0	0	0	110.7	V433	V433-V435 HydrophobicContact CG1-CG2 4.18Å
436	V	24	Very low	27.7	Very low	145 Å²	145	142.8 Å²	142.8	88%	0.879	79%	0.792	S	S	*	*			trans	-145.5	118.2	162.1	178.6	0	0	0	0	108
437	S	26.9	Very low	27.7	Very low	99 Å²	99	150.2 Å²	150.2	69%	0.692	80%	0.802	S	S	*	*			trans	-160.6	111.7	166.2	54	0	0	0	0	111.4
438	N	24.2	Very low	27.6	Very low	154 Å²	154	155.7 Å²	155.7	82%	0.824	81%	0.808	S	S	*	*			trans	-97.2	106.8	161.2	-94	-39.1	0	0	0	108.5
439	S	27.9	Very low	27.3	Very low	105 Å²	105	152.5 Å²	152.5	73%	0.734	82%	0.817	S	S	*	*			trans	-164.1	100.7	161.9	45	0	0	0	0	111	S441	S439-S441 PolarHBondContact O-N 2.88Å
440	V	24.1	Very low	27.2	Very low	145 Å²	145	146.5 Å²	146.5	88%	0.879	82%	0.818	S	S	*	*			trans	-84.5	105	173.3	177.6	0	0	0	0	109
441	S	26.2	Very low	27.1	Very low	117 Å²	117	149.8 Å²	149.8	82%	0.818	83%	0.826	S	S	*	*			trans	-133.1	123	167.7	-84.6	0	0	0	0	110.3	S439	S439-S441 PolarHBondContact O-N 2.88Å
442	R	24.1	Very low	26.9	Very low	217 Å²	217	150.9 Å²	150.9	82%	0.819	83%	0.828	S	S	*	*			trans	-77.3	140	-174.5	-64.8	171	172.5	157.7	-4.2	111.8
443	K	27.2	Very low	26.8	Very low	213 Å²	213	148 Å²	148	93%	0.926	83%	0.827	S	S	*	*			trans	-150.6	127.8	147.6	-121.3	173.5	-176.4	177.6	0	112.5
444	R	24.9	Very low	26.8	Very low	242 Å²	242	153.3 Å²	153.3	91%	0.913	84%	0.835	S	S	*	*			trans	-66.5	161.2	157	-70.4	171.4	168.9	172.1	-6	108.1
445	S	28.2	Very low	26.8	Very low	106 Å²	106	155.3 Å²	155.3	74%	0.741	83%	0.833	S	S	*	*			cis	-155.6	175.9	4.7	33.7	0	0	0	0	106.6
446	T	29.4	Very low	26.8	Very low	135 Å²	135	158.2 Å²	158.2	83%	0.828	84%	0.836	S	S	*	*			cis	-157.8	172	45.8	46.3	0	0	0	0	112.8
447	R	28.4	Very low	26.8	Very low	242 Å²	242	158.8 Å²	158.8	91%	0.913	83%	0.833	S	S	*	*			trans	-82.8	144	178.3	-71.4	168.3	157	169.9	-9.3	113
448	R	28.1	Very low	26.8	Very low	247 Å²	247	160.3 Å²	160.3	93%	0.932	84%	0.839	S	S	*	*				-171	164.7	120.6	-103	170.8	176.8	-173.5	-1.9	111
449	G	27	Very low	27	Very low	79 Å²	79	158 Å²	158	81%	0.814	83%	0.83	S	S	*	*			trans	-51.7	157.5	-165.7	0	0	0	0	0	116.1
450	G	27.7	Very low	26.9	Very low	81 Å²	81	162.3 Å²	162.3	84%	0.835	84%	0.839	S	S	*	*				111.7	147	54	0	0	0	0	0	107.5
451	K	30.1	Very low	27.1	Very low	218 Å²	218	162.1 Å²	162.1	95%	0.948	83%	0.831	S	S	*	*			cis	-122.9	175.1	12.2	-65	172.5	175.8	175.6	0	111.2
452	S	26.5	Very low	27.2	Very low	114 Å²	114	166.3 Å²	166.3	80%	0.797	84%	0.838	S	S	*	*			trans	-103.3	145.8	176.2	178.8	0	0	0	0	112.2
453	T	28.2	Very low	27.4	Very low	137 Å²	137	158.6 Å²	158.6	84%	0.84	83%	0.826	S	S	*	*			trans	-136	130.6	164.5	33.4	0	0	0	0	110.8
454	R	26.2	Very low	27.4	Very low	225 Å²	225	156.2 Å²	156.2	85%	0.849	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-66.2	157.1	171.8	-85.7	173.3	160.7	168.5	-8.4	111.5
455	P	26.8	Very low	27.6	Very low	123 Å²	123	148.3 Å²	148.3	80%	0.799	82%	0.823	S	S	*	*	P	Polyproline II helix		-101.6	154.9	122.2	30.9	-32.5	0	0	0	111.2
456	K	26.1	Very low	27.6	Very low	179 Å²	179	150.4 Å²	150.4	78%	0.778	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-86.8	159.3	-179.7	-64.8	178.1	177.5	176.2	0	111.4
457	L	24.7	Very low	27.7	Very low	157 Å²	157	148.6 Å²	148.6	82%	0.822	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.9	138.5	147	-90.1	68.7	0	0	0	108.7
458	T	27.4	Very low	27.8	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	80%	0.803	S	S	*	*			trans	-133.7	109.5	151.6	42.2	0	0	0	0	107.2
459	T	27.3	Very low	27.8	Very low	105 Å²	105	135.5 Å²	135.5	64%	0.644	80%	0.798	S	S	*	*			trans	-87.8	125.7	174.1	-43.5	0	0	0	0	108.1	I461	T459-I461 HydrophobicContact CG2-CD1 4.09Å; T459-I461 HydrophobicContact CG2-CG1 3.85Å; T459-I461 PolarHBondContact O-N 2.71Å
460	E	25.7	Very low	27.8	Very low	195 Å²	195	138.3 Å²	138.3	91%	0.911	80%	0.8	S	S	*	*			trans	-81	114.9	164.9	-69.2	-177.1	151.9	0	0	108.6
461	I	29.4	Very low	27.8	Very low	141 Å²	141	139.8 Å²	139.8	72%	0.723	80%	0.798	S	S	*	*			trans	-132	110.1	165.4	-60.4	-178.3	0	0	0	107.6	T459	T459-I461 HydrophobicContact CG2-CD1 4.09Å; T459-I461 HydrophobicContact CG2-CG1 3.85Å; T459-I461 PolarHBondContact O-N 2.71Å
462	Q	28.7	Very low	27.8	Very low	206 Å²	206	134.9 Å²	134.9	96%	0.963	79%	0.788	S	S	*	*			trans	-116.7	123.5	152.7	-67.5	178.9	-9	0	0	105.7
463	G	27.2	Very low	27.8	Very low	55 Å²	55	134.3 Å²	134.3	57%	0.567	79%	0.79	S	S	*	*			cis	174.6	-160.7	-6.2	0	0	0	0	0	111.2
464	V	27.8	Very low	27.9	Very low	163 Å²	163	134 Å²	134	99%	0.988	79%	0.788	S	S	*	*			trans	72.7	129.6	166.8	-167.8	0	0	0	0	116.7
465	G	29.1	Very low	27.9	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	79%	0.787	S	S	*	*			trans	128.1	69.8	163.8	0	0	0	0	0	116.4
466	N	28.9	Very low	28.2	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	78%	0.781	S	S	*	*			trans	-95.4	154.2	166.8	-92.3	-11.1	0	0	0	111.2
467	E	31.6	Very low	28.6	Very low	97 Å²	97	129.7 Å²	129.7	45%	0.453	78%	0.78	S	S	.	*			trans	161.1	92.6	134.2	-88.7	174	-162.3	0	0	108.7	L97	L97-E467 WeakPolarHBondContact CA-OE2 3.49Å; L97-E467 VanDerWaalsContact CD2-OE2 3.32Å; L97-E467 WeakPolarHBondContact CD2-OE2 3.36Å
468	T	28.6	Very low	29	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	78%	0.781	S	S	*	*				73.9	112.6	91	54	0	0	0	0	115.6
469	G	29.9	Very low	29.6	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	77%	0.772	S	S	*	*			trans	-165.8	111.2	169.6	0	0	0	0	0	110
470	T	26.4	Very low	30.3	Very low	138 Å²	138	134.1 Å²	134.1	85%	0.847	78%	0.782	S	S	*	*			trans	-92.3	139.5	-160.7	-54.6	0	0	0	0	114.2
471	S	27.9	Very low	31.4	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	75%	0.749	S	S	*	*			trans	-145.7	153.3	149.2	-94.2	0	0	0	0	110.5
472	P	29.7	Very low	32.5	Very low	116 Å²	116	123.5 Å²	123.5	75%	0.753	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-78.7	158.8	-154.4	29.7	-36.4	0	0	0	114.7
473	A	26.7	Very low	33.6	Very low	101 Å²	101	115.7 Å²	115.7	84%	0.835	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-69.1	134.6	176.1	0	0	0	0	0	111.9
474	V	29.7	Very low	35	Very low	131 Å²	131	121 Å²	121	79%	0.794	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-92.9	122.6	164.7	177.6	0	0	0	0	108.1	V476	V474-V476 PolarHBondContact O-N 3.04Å
475	E	27	Very low	36.6	Very low	178 Å²	178	114.2 Å²	114.2	83%	0.832	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-67.2	116.8	178.7	-64.8	-169.4	125.1	0	0	111.2	I477	E475-I477 PolarHBondContact O-N 2.77Å; E475-I477 VanDerWaalsContact O-N 3.16Å
476	V	33.3	Very low	38.5	Very low	111 Å²	111	114.2 Å²	114.2	67%	0.673	67%	0.673	S	S	*	*			trans	-83.7	93.3	174.1	-177.1	0	0	0	0	109	V474 K478	V474-V476 PolarHBondContact O-N 3.04Å; V476-K478 PolarHBondContact O-N 2.72Å
477	I	34.8	Very low	40.4	Very low	148 Å²	148	111.2 Å²	111.2	76%	0.759	66%	0.657	S	S	*	*			trans	-54.8	125	170.7	-60.9	174.7	0	0	0	109	E475	E475-I477 PolarHBondContact O-N 2.77Å; E475-I477 VanDerWaalsContact O-N 3.16Å
478	K	32.3	Very low	42.1	Very low	195 Å²	195	112.2 Å²	112.2	85%	0.848	66%	0.662	S	S	*	*			trans	-93.4	98.6	178.6	-63.8	-178.9	-176.9	176.2	0	110	V476	V476-K478 PolarHBondContact O-N 2.72Å
479	E	40.8	Very low	43.9	Very low	130 Å²	130	108.5 Å²	108.5	61%	0.607	64%	0.635	S	S	*	*			trans	-73.6	133.1	156	-72	-167	-161	0	0	109.7	D481 K529	E479-D481 WeakPolarHBondContact CB-OD1 3.37Å; E479-D481 PolarHBondContact O-N 2.63Å; E479-D481 VanDerWaalsContact O-N 3.16Å; E479-K529 IonicContact OE2-NZ 2.79Å; E479-K529 PolarHBondContact OE2-NZ 3.05Å
480	D	40.6	Very low	45.8	Very low	160 Å²	160	107.2 Å²	107.2	86%	0.856	61%	0.605	S	S	*	*			trans	-87	82.8	-171.5	-167.8	13	0	0	0	111.2
481	D	49.2	Very low	48	Very low	42 Å²	42	108 Å²	108	23%	0.225	59%	0.592	C	S	.	*			trans	-94.1	-1.7	-168.7	-77.1	29.9	0	0	0	114.2	E479 L483 K529	E479-D481 WeakPolarHBondContact CB-OD1 3.37Å; E479-D481 PolarHBondContact O-N 2.63Å; E479-D481 VanDerWaalsContact O-N 3.16Å; D481-L483 PolarHBondContact O-N 3.07Å; D481-L483 VanDerWaalsContact O-N 3.15Å; D481-K529 WeakPolarHBondContact OD1-CE 3.32Å; D481-K529 IonicContact OD1-NZ 2.98Å; D481-K529 PolarHBondContact OD1-NZ 2.84Å; D481-K529 WeakPolarHBondContact OD2-CE 3.42Å; D481-K529 IonicContact OD2-NZ 2.76Å
482	G	52.1	Low	50.1	Low	71 Å²	71	107.2 Å²	107.2	73%	0.732	58%	0.576	S	S	*	*	S	Bend	trans	65.2	11.5	-179.4	0	0	0	0	0	116
483	L	52.2	Low	52.2	Low	43 Å²	43	102 Å²	102	23%	0.225	54%	0.542	C	S	.	.	S	Bend	trans	-134.6	126.9	179.5	-68.9	178.8	0	0	0	112.4	D481 L485 I532 Y546	D481-L483 PolarHBondContact O-N 3.07Å; D481-L483 VanDerWaalsContact O-N 3.15Å; L483-L485 HydrophobicContact CB-CD1 4.08Å; L483-L485 HydrophobicContact CB-CG 4.29Å; L483-L485 HydrophobicContact CD1-CD1 3.88Å; L483-L485 PolarHBondContact O-N 3.45Å; L483-I532 HydrophobicContact CD1-CD1 3.42Å; L483-I532 VanDerWaalsContact CD1-CD1 3.42Å; L483-I532 HydrophobicContact CD1-CG1 4.39Å; L483-Y546 HydrophobicContact CD2-CE1 4.41Å; L483-Y546 HydrophobicContact CD2-CE2 4.33Å
484	D	57.1	Low	54.7	Low	167 Å²	167	98.8 Å²	98.8	89%	0.893	51%	0.511	S	S	*	.			trans	-71.2	77.9	167.9	-78.6	-33.9	0	0	0	110.7
485	L	60	Low	57	Low	19 Å²	19	95.2 Å²	95.2	10%	0.099	49%	0.491	C	S	.	.			trans	-129.1	129	173.5	-70.9	168.4	0	0	0	109.6	L483 E489 R490 T528 K550	L483-L485 HydrophobicContact CB-CD1 4.08Å; L483-L485 HydrophobicContact CB-CG 4.29Å; L483-L485 HydrophobicContact CD1-CD1 3.88Å; L483-L485 PolarHBondContact O-N 3.45Å; L485-E489 HydrophobicContact CD2-CB 4.01Å; L485-R490 HydrophobicContact CB-CG 3.87Å; L485-R490 HydrophobicContact CD1-CG 4.5Å; L485-R490 PolarHBondContact O-NE 3.49Å; L485-T528 HydrophobicContact CD1-CG2 4.43Å; L485-K550 HydrophobicContact CD2-CD 4.03Å
486	T	69.9	Low	59.4	Low	77 Å²	77	87.6 Å²	87.6	47%	0.472	46%	0.455	S	S	.	.			trans	-66	157.3	169.3	61	0	0	0	0	111.2	E488 E489 R490	T486-E488 PolarHBondContact O-N 3.46Å; T486-E488 VanDerWaalsContact O-N 3.13Å; T486-E489 WeakPolarHBondContact CB-OE2 3.32Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.23Å; T486-E489 PolarHBondContact N-OE2 3.24Å; T486-E489 PolarHBondContact O-N 2.91Å; T486-E489 VanDerWaalsContact OG1-CG 3.25Å; T486-E489 WeakPolarHBondContact OG1-CG 3.34Å; T486-E489 PolarHBondContact OG1-N 2.84Å; T486-E489 PolarHBondContact OG1-OE2 3.18Å; T486-R490 VanDerWaalsContact O-CG 3.32Å; T486-R490 WeakPolarHBondContact O-CG 3.44Å; T486-R490 PolarHBondContact O-N 2.94Å
487	N	69	Low	61.6	Low	85 Å²	85	82.4 Å²	82.4	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-17.8	176.6	-73.2	-20.4	0	0	0	113.6	R490 R491	N487-R490 PolarHBondContact OD1-NH1 3.4Å; N487-R491 PolarHBondContact O-NE 2.97Å
488	E	67.9	Low	63.9	Low	119 Å²	119	77.2 Å²	77.2	56%	0.556	40%	0.397	S	S	*	.	H	α-helix	trans	-81.1	-48.1	173.7	-172.7	165.1	-128.4	0	0	111.6	T486 R490 R491 H492	T486-E488 PolarHBondContact O-N 3.46Å; T486-E488 VanDerWaalsContact O-N 3.13Å; E488-R490 VanDerWaalsContact C-N 3.29Å; E488-R490 PolarHBondContact O-N 3.01Å; E488-R491 PolarHBondContact O-N 2.82Å; E488-R491 VanDerWaalsContact O-N 3.11Å; E488-H492 PolarHBondContact O-CD2 2.92Å; E488-H492 VanDerWaalsContact O-CD2 3.24Å; E488-H492 PolarHBondContact O-N 2.94Å
489	E	66	Low	66	Low	55 Å²	55	73 Å²	73	26%	0.257	39%	0.385	S	S	.	.	H	α-helix	trans	-58.2	-40.5	172.4	-70.4	166	109.6	0	0	112.2	L485 T486 R491 H492 L493 K550	L485-E489 HydrophobicContact CD2-CB 4.01Å; T486-E489 WeakPolarHBondContact CB-OE2 3.32Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.23Å; T486-E489 PolarHBondContact N-OE2 3.24Å; T486-E489 PolarHBondContact O-N 2.91Å; T486-E489 VanDerWaalsContact OG1-CG 3.25Å; T486-E489 WeakPolarHBondContact OG1-CG 3.34Å; T486-E489 PolarHBondContact OG1-N 2.84Å; T486-E489 PolarHBondContact OG1-OE2 3.18Å; E489-R491 VanDerWaalsContact C-N 3.3Å; E489-R491 PolarHBondContact O-N 2.76Å; E489-H492 PolarHBondContact O-N 2.94Å; E489-L493 VanDerWaalsContact O-CB 3.23Å; E489-L493 WeakPolarHBondContact O-CB 3.46Å; E489-L493 PolarHBondContact O-N 2.96Å; E489-K550 WeakPolarHBondContact OE1-CE 3.45Å; E489-K550 IonicContact OE1-NZ 2.96Å; E489-K550 PolarHBondContact OE1-NZ 3.32Å; E489-K550 IonicContact OE2-NZ 3.7Å
490	R	68.9	Low	67.5	Low	53 Å²	53	67 Å²	67	20%	0.2	36%	0.356	C	S	.	.	H	α-helix	trans	-56.7	-42.8	175.1	-72.7	171.9	-178.2	169.6	-8.1	111.7	L485 T486 N487 E488 L494	L485-R490 HydrophobicContact CB-CG 3.87Å; L485-R490 HydrophobicContact CD1-CG 4.5Å; L485-R490 PolarHBondContact O-NE 3.49Å; T486-R490 VanDerWaalsContact O-CG 3.32Å; T486-R490 WeakPolarHBondContact O-CG 3.44Å; T486-R490 PolarHBondContact O-N 2.94Å; N487-R490 PolarHBondContact OD1-NH1 3.4Å; E488-R490 VanDerWaalsContact C-N 3.29Å; E488-R490 PolarHBondContact O-N 3.01Å; R490-L494 VanDerWaalsContact O-CB 3.31Å; R490-L494 WeakPolarHBondContact O-CB 3.38Å; R490-L494 PolarHBondContact O-N 3.11Å; R490-L494 VanDerWaalsContact O-N 3.12Å
491	R	73.1	Confident	69.2	Low	155 Å²	155	63.2 Å²	63.2	59%	0.585	34%	0.339	S	S	*	.	H	α-helix	trans	-69.6	-47.4	177.9	-80.3	-174.2	-97.2	104	-8.3	112.4	N487 E488 E489 L493 L494 S495	N487-R491 PolarHBondContact O-NE 2.97Å; E488-R491 PolarHBondContact O-N 2.82Å; E488-R491 VanDerWaalsContact O-N 3.11Å; E489-R491 VanDerWaalsContact C-N 3.3Å; E489-R491 PolarHBondContact O-N 2.76Å; R491-L493 VanDerWaalsContact C-N 3.34Å; R491-L493 PolarHBondContact O-N 2.95Å; R491-L494 PolarHBondContact O-N 3.14Å; R491-S495 PolarHBondContact O-N 2.87Å
492	H	70.8	Confident	70.3	Confident	96 Å²	96	63.6 Å²	63.6	44%	0.444	34%	0.341	S	S	.	.	H	α-helix	trans	-64.9	-36.9	179.5	-71.8	-60.4	0	0	0	113.1	E488 E489 F496 L553	E488-H492 PolarHBondContact O-CD2 2.92Å; E488-H492 VanDerWaalsContact O-CD2 3.24Å; E488-H492 PolarHBondContact O-N 2.94Å; E489-H492 PolarHBondContact O-N 2.94Å; H492-F496 WeakPolarHBondContact O-CB 3.11Å; H492-F496 PolarHBondContact O-N 2.86Å; H492-L553 HydrophobicContact CB-CD1 4.44Å
493	L	74.9	Confident	70.9	Confident	5 Å²	5	64.9 Å²	64.9	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-70.2	-39.2	176.7	-171.1	146.7	0	0	0	111.6	E489 R491 F497 L531 L553	E489-L493 VanDerWaalsContact O-CB 3.23Å; E489-L493 WeakPolarHBondContact O-CB 3.46Å; E489-L493 PolarHBondContact O-N 2.96Å; R491-L493 VanDerWaalsContact C-N 3.34Å; R491-L493 PolarHBondContact O-N 2.95Å; L493-F497 HydrophobicContact CD2-CD2 3.8Å; L493-F497 HydrophobicContact CD2-CE2 4.1Å; L493-F497 HydrophobicContact CG-CD2 4.01Å; L493-F497 HydrophobicContact CG-CE2 4.11Å; L493-F497 WeakPolarHBondContact O-CD2 3.11Å; L493-F497 PolarHBondContact O-N 2.96Å; L493-L531 HydrophobicContact CD2-CD2 3.37Å; L493-L553 HydrophobicContact CB-CD1 3.97Å; L493-L553 HydrophobicContact CG-CD1 4.45Å
494	L	78.9	Confident	71.6	Confident	35 Å²	35	64.2 Å²	64.2	18%	0.183	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-45.4	176	-172.8	66.4	0	0	0	112.4	R490 R491 F497 N498 F525 K526	R490-L494 VanDerWaalsContact O-CB 3.31Å; R490-L494 WeakPolarHBondContact O-CB 3.38Å; R490-L494 PolarHBondContact O-N 3.11Å; R490-L494 VanDerWaalsContact O-N 3.12Å; R491-L494 PolarHBondContact O-N 3.14Å; L494-F497 PolarHBondContact O-N 2.81Å; L494-N498 PolarHBondContact O-N 3.09Å; L494-N498 VanDerWaalsContact O-N 3.09Å; L494-F525 HydrophobicContact CD1-CB 3.91Å; L494-K526 WeakPolarHBondContact CD2-O 3.37Å
495	S	77.9	Confident	72.3	Confident	56 Å²	56	56.2 Å²	56.2	39%	0.392	28%	0.281	S	S	.	.	H	α-helix	trans	-57.7	-55.2	172.7	159.8	0	0	0	0	110.6	R491 F497 N498 D499	R491-S495 PolarHBondContact O-N 2.87Å; S495-F497 VanDerWaalsContact C-N 3.29Å; S495-F497 PolarHBondContact O-N 2.82Å; S495-F497 VanDerWaalsContact O-N 3.16Å; S495-N498 PolarHBondContact O-N 2.85Å; S495-D499 WeakPolarHBondContact CA-OD2 3.36Å; S495-D499 WeakPolarHBondContact CB-OD2 3.4Å; S495-D499 VanDerWaalsContact O-CB 3.32Å; S495-D499 WeakPolarHBondContact O-CB 3.31Å; S495-D499 PolarHBondContact O-N 2.89Å; S495-D499 PolarHBondContact OG-OD2 2.82Å
496	F	77.2	Confident	72.8	Confident	17 Å²	17	56.3 Å²	56.3	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-42.8	179.6	-179.8	-97.3	0	0	0	113.1	H492 N498 A500 E504 L505 V508 C549 L553	H492-F496 WeakPolarHBondContact O-CB 3.11Å; H492-F496 PolarHBondContact O-N 2.86Å; F496-N498 PolarHBondContact O-N 3.29Å; F496-A500 HydrophobicContact CD2-CB 3.87Å; F496-A500 HydrophobicContact CE1-CB 4.38Å; F496-A500 HydrophobicContact CE2-CB 3.62Å; F496-A500 HydrophobicContact CG-CB 4.35Å; F496-A500 HydrophobicContact CZ-CB 3.9Å; F496-A500 WeakPolarHBondContact O-CB 3.02Å; F496-A500 PolarHBondContact O-N 2.88Å; F496-A500 VanDerWaalsContact O-N 3.08Å; F496-E504 HydrophobicContact CE2-CB 4.43Å; F496-L505 HydrophobicContact CE1-CD2 4.18Å; F496-V508 HydrophobicContact CE1-CG2 4.01Å; F496-V508 HydrophobicContact CZ-CG2 4.13Å; F496-C549 WeakPolarHBondContact CD1-SG 3.48Å; F496-L553 HydrophobicContact CB-CD2 4.25Å; F496-L553 HydrophobicContact CG-CD2 4.43Å
497	F	79.8	Confident	72.5	Confident	3 Å²	3	54.7 Å²	54.7	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-72.9	-22.9	178.9	-85.3	-69.8	0	0	0	114.7	L493 L494 S495 L505 I519 R523 F525 L531 M535 C549	L493-F497 HydrophobicContact CD2-CD2 3.8Å; L493-F497 HydrophobicContact CD2-CE2 4.1Å; L493-F497 HydrophobicContact CG-CD2 4.01Å; L493-F497 HydrophobicContact CG-CE2 4.11Å; L493-F497 WeakPolarHBondContact O-CD2 3.11Å; L493-F497 PolarHBondContact O-N 2.96Å; L494-F497 PolarHBondContact O-N 2.81Å; S495-F497 VanDerWaalsContact C-N 3.29Å; S495-F497 PolarHBondContact O-N 2.82Å; S495-F497 VanDerWaalsContact O-N 3.16Å; F497-L505 HydrophobicContact CD1-CD2 4.23Å; F497-L505 HydrophobicContact CE1-CD2 4.29Å; F497-I519 HydrophobicContact CD1-CG2 3.93Å; F497-I519 HydrophobicContact CE1-CD1 4.23Å; F497-I519 HydrophobicContact CE1-CG2 4.45Å; F497-R523 VanDerWaalsContact O-CZ 3.25Å; F497-R523 PolarHBondContact O-NE 3.09Å; F497-R523 PolarHBondContact O-NH2 3.11Å; F497-F525 HydrophobicContact CB-CD2 4.14Å; F497-F525 HydrophobicContact CB-CE2 4.2Å; F497-L531 HydrophobicContact CB-CD1 4.05Å; F497-L531 HydrophobicContact CB-CD2 4.02Å; F497-L531 HydrophobicContact CD1-CD1 4.4Å; F497-L531 HydrophobicContact CD2-CD1 4.47Å; F497-L531 HydrophobicContact CD2-CD2 3.63Å; F497-L531 HydrophobicContact CE2-CD2 4.36Å; F497-L531 HydrophobicContact CG-CD1 4.05Å; F497-L531 HydrophobicContact CG-CD2 3.95Å; F497-M535 HydrophobicContact CD1-CE 3.94Å; F497-M535 HydrophobicContact CE1-CE 3.44Å; F497-M535 VanDerWaalsContact CE1-CE 3.44Å; F497-M535 HydrophobicContact CZ-CE 3.84Å; F497-C549 HydrophobicContact CE2-CB 3.79Å; F497-C549 VanDerWaalsContact CE2-SG 3.54Å; F497-C549 HydrophobicContact CZ-CB 3.98Å
498	N	82.2	Confident	72.5	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.203	25%	0.25	C	S	.	.	H	α-helix	trans	-85.6	-36	172.2	-79.6	-27.1	0	0	0	113.4	L494 S495 F496 R523 P524 F525	L494-N498 PolarHBondContact O-N 3.09Å; L494-N498 VanDerWaalsContact O-N 3.09Å; S495-N498 PolarHBondContact O-N 2.85Å; F496-N498 PolarHBondContact O-N 3.29Å; N498-R523 VanDerWaalsContact C-CZ 3.46Å; N498-R523 VanDerWaalsContact O-CD 3.24Å; N498-R523 WeakPolarHBondContact O-CD 3.26Å; N498-R523 PolarHBondContact O-NE 2.85Å; N498-R523 PolarHBondContact O-NH1 3.25Å; N498-R523 VanDerWaalsContact O-NH1 3.14Å; N498-P524 WeakPolarHBondContact OD1-CA 3.33Å; N498-F525 PolarHBondContact ND2-O 3.48Å; N498-F525 VanDerWaalsContact OD1-CD2 3.31Å; N498-F525 WeakPolarHBondContact OD1-CD2 3.47Å; N498-F525 PolarHBondContact OD1-N 3.2Å
499	D	77.9	Confident	72.3	Confident	108 Å²	108	48.3 Å²	48.3	58%	0.578	24%	0.244	S	C	*	.	H	α-helix	trans	-101.2	-33.1	-163.8	-51	-30	0	0	0	112.8	S495	S495-D499 WeakPolarHBondContact CA-OD2 3.36Å; S495-D499 WeakPolarHBondContact CB-OD2 3.4Å; S495-D499 VanDerWaalsContact O-CB 3.32Å; S495-D499 WeakPolarHBondContact O-CB 3.31Å; S495-D499 PolarHBondContact O-N 2.89Å; S495-D499 PolarHBondContact OG-OD2 2.82Å
500	A	72.6	Confident	72.4	Confident	2 Å²	2	49.1 Å²	49.1	2%	0.017	27%	0.267	C	S	.	.			trans	-60.8	140.9	-170.4	0	0	0	0	0	113.6	F496 E504 L505 R523	F496-A500 HydrophobicContact CD2-CB 3.87Å; F496-A500 HydrophobicContact CE1-CB 4.38Å; F496-A500 HydrophobicContact CE2-CB 3.62Å; F496-A500 HydrophobicContact CG-CB 4.35Å; F496-A500 HydrophobicContact CZ-CB 3.9Å; F496-A500 WeakPolarHBondContact O-CB 3.02Å; F496-A500 PolarHBondContact O-N 2.88Å; F496-A500 VanDerWaalsContact O-N 3.08Å; A500-E504 WeakPolarHBondContact CA-OE2 3.4Å; A500-E504 HydrophobicContact CB-CB 3.97Å; A500-L505 HydrophobicContact CB-CD2 4.21Å; A500-L505 HydrophobicContact CB-CG 4.26Å; A500-R523 VanDerWaalsContact O-CZ 3.23Å; A500-R523 PolarHBondContact O-NH1 3.37Å; A500-R523 PolarHBondContact O-NH2 3.27Å
501	V	75.6	Confident	72.5	Confident	82 Å²	82	47 Å²	47	50%	0.497	26%	0.261	S	S	.	.			trans	-72	164.6	176.9	-65.5	0	0	0	0	112.4	E503 E504 L505	V501-E503 HydrophobicContact CG2-CB 4.32Å; V501-E503 PolarHBondContact O-N 2.84Å; V501-E504 HydrophobicContact CG2-CB 4.04Å; V501-E504 HydrophobicContact CG2-CG 3.99Å; V501-E504 PolarHBondContact O-N 3.04Å; V501-E504 VanDerWaalsContact O-N 3.15Å; V501-L505 PolarHBondContact O-N 2.95Å
502	L	72	Confident	72.6	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.257	25%	0.252	S	S	.	.	H	α-helix	trans	-52.1	-40.3	179.6	-178.5	66.7	0	0	0	112.2	T506 A516 Q517 I520	L502-T506 WeakPolarHBondContact O-CG2 3.36Å; L502-T506 PolarHBondContact O-N 2.88Å; L502-T506 VanDerWaalsContact O-N 3.16Å; L502-A516 HydrophobicContact CD1-CB 3.69Å; L502-Q517 HydrophobicContact CD1-CB 4.44Å; L502-I520 HydrophobicContact CB-CD1 3.79Å; L502-I520 HydrophobicContact CD1-CD1 3.77Å; L502-I520 HydrophobicContact CG-CD1 4.37Å
503	E	65	Low	72.7	Confident	98 Å²	98	44 Å²	44	46%	0.458	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-52.4	177.5	-60.1	-178.9	177	0	0	111.6	V501 L505 T506 L507	V501-E503 HydrophobicContact CG2-CB 4.32Å; V501-E503 PolarHBondContact O-N 2.84Å; E503-L505 VanDerWaalsContact C-N 3.27Å; E503-L505 PolarHBondContact O-N 2.96Å; E503-T506 WeakPolarHBondContact O-CA 3.37Å; E503-T506 PolarHBondContact O-N 2.83Å; E503-T506 PolarHBondContact O-OG1 3.14Å; E503-L507 PolarHBondContact O-N 3.43Å
504	E	66.1	Low	72.8	Confident	29 Å²	29	51.1 Å²	51.1	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-55.3	-40.3	175.8	-85.6	-165.9	125.4	0	0	112.4	F496 A500 V501 T506 L507 R556 F854	F496-E504 HydrophobicContact CE2-CB 4.43Å; A500-E504 WeakPolarHBondContact CA-OE2 3.4Å; A500-E504 HydrophobicContact CB-CB 3.97Å; V501-E504 HydrophobicContact CG2-CB 4.04Å; V501-E504 HydrophobicContact CG2-CG 3.99Å; V501-E504 PolarHBondContact O-N 3.04Å; V501-E504 VanDerWaalsContact O-N 3.15Å; E504-T506 VanDerWaalsContact C-N 3.34Å; E504-T506 PolarHBondContact O-N 3.26Å; E504-L507 WeakPolarHBondContact O-CB 3.24Å; E504-L507 PolarHBondContact O-N 2.86Å; E504-R556 IonicContact OE1-NH1 2.72Å; E504-R556 PolarHBondContact OE1-NH1 3Å; E504-F854 HydrophobicContact CG-CD2 4.22Å; E504-F854 HydrophobicContact CG-CE2 3.48Å; E504-F854 VanDerWaalsContact CG-CE2 3.48Å; E504-F854 HydrophobicContact CG-CZ 3.8Å
505	L	71.7	Confident	72.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-36.4	175.3	-72.2	177.6	0	0	0	112.4	F496 F497 A500 V501 E503 L507 V508 C511 A516 I519 I520	F496-L505 HydrophobicContact CE1-CD2 4.18Å; F497-L505 HydrophobicContact CD1-CD2 4.23Å; F497-L505 HydrophobicContact CE1-CD2 4.29Å; A500-L505 HydrophobicContact CB-CD2 4.21Å; A500-L505 HydrophobicContact CB-CG 4.26Å; V501-L505 PolarHBondContact O-N 2.95Å; E503-L505 VanDerWaalsContact C-N 3.27Å; E503-L505 PolarHBondContact O-N 2.96Å; L505-L507 VanDerWaalsContact C-N 3.28Å; L505-L507 PolarHBondContact O-N 3.39Å; L505-V508 WeakPolarHBondContact O-CB 3.14Å; L505-V508 PolarHBondContact O-N 3.45Å; L505-C511 WeakPolarHBondContact O-CB 3.44Å; L505-C511 PolarHBondContact O-SG 3.3Å; L505-A516 HydrophobicContact CB-CB 3.71Å; L505-A516 HydrophobicContact CD1-CB 4.4Å; L505-I519 HydrophobicContact CD1-CB 4.2Å; L505-I519 HydrophobicContact CD1-CG2 3.81Å; L505-I519 HydrophobicContact CD2-CG2 4.14Å; L505-I520 HydrophobicContact CD1-CD1 4.13Å; L505-I520 HydrophobicContact CD1-CG1 3.68Å
506	T	70.9	Confident	72.9	Confident	21 Å²	21	47.5 Å²	47.5	13%	0.129	26%	0.262	C	S	.	.	H	α-helix	trans	-74	-14.4	176	57.9	0	0	0	0	114.6	L502 E503 E504 V508 W513 A516 M836	L502-T506 WeakPolarHBondContact O-CG2 3.36Å; L502-T506 PolarHBondContact O-N 2.88Å; L502-T506 VanDerWaalsContact O-N 3.16Å; E503-T506 WeakPolarHBondContact O-CA 3.37Å; E503-T506 PolarHBondContact O-N 2.83Å; E503-T506 PolarHBondContact O-OG1 3.14Å; E504-T506 VanDerWaalsContact C-N 3.34Å; E504-T506 PolarHBondContact O-N 3.26Å; T506-V508 PolarHBondContact O-N 2.8Å; T506-W513 HydrophobicContact CG2-CB 4.37Å; T506-A516 HydrophobicContact CG2-CB 3.73Å; T506-M836 HydrophobicContact CG2-CE 3.9Å; T506-M836 HydrophobicContact CG2-SD 4.33Å; T506-M836 PolarHBondContact OG1-SD 3.46Å
507	L	63.7	Low	73.1	Confident	43 Å²	43	49.6 Å²	49.6	23%	0.225	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-13.5	171.5	-60.7	173.4	0	0	0	112.6	E503 E504 L505 P509 I831 Y832 F854	E503-L507 PolarHBondContact O-N 3.43Å; E504-L507 WeakPolarHBondContact O-CB 3.24Å; E504-L507 PolarHBondContact O-N 2.86Å; L505-L507 VanDerWaalsContact C-N 3.28Å; L505-L507 PolarHBondContact O-N 3.39Å; L507-P509 WeakPolarHBondContact O-CD 3.31Å; L507-I831 WeakPolarHBondContact O-CG2 3.34Å; L507-Y832 HydrophobicContact CB-CE1 4.38Å; L507-Y832 HydrophobicContact CD1-CD1 4.12Å; L507-Y832 HydrophobicContact CD1-CE1 3.83Å; L507-Y832 HydrophobicContact CD2-CD1 4.2Å; L507-Y832 HydrophobicContact CG-CE1 4.47Å; L507-F854 HydrophobicContact CD1-CD1 4.26Å; L507-F854 HydrophobicContact CD1-CE1 3.38Å; L507-F854 HydrophobicContact CD1-CZ 3.76Å
508	V	69.5	Low	73.2	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.03	28%	0.283	C	S	.	.	S	Bend	trans	-74.3	122.7	176.5	-176.6	0	0	0	0	110.5	F496 L505 T506 G510 C511 L545 C548 I552	F496-V508 HydrophobicContact CE1-CG2 4.01Å; F496-V508 HydrophobicContact CZ-CG2 4.13Å; L505-V508 WeakPolarHBondContact O-CB 3.14Å; L505-V508 PolarHBondContact O-N 3.45Å; T506-V508 PolarHBondContact O-N 2.8Å; V508-G510 PolarHBondContact O-N 2.82Å; V508-C511 HydrophobicContact CB-CB 3.96Å; V508-C511 VanDerWaalsContact O-CB 3.24Å; V508-C511 WeakPolarHBondContact O-CB 3.5Å; V508-C511 PolarHBondContact O-N 3.3Å; V508-L545 HydrophobicContact CG1-CD2 4.29Å; V508-C548 HydrophobicContact CG1-CB 4.06Å; V508-I552 HydrophobicContact CB-CD1 4.22Å; V508-I552 HydrophobicContact CG1-CD1 4.35Å; V508-I552 HydrophobicContact CG2-CD1 4.01Å
509	P	64.6	Low	73.1	Confident	64 Å²	64	49.1 Å²	49.1	42%	0.416	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	122.5	177.4	-29.4	34.8	0	0	0	113.2	L507 C548	L507-P509 WeakPolarHBondContact O-CD 3.31Å; P509-C548 HydrophobicContact CB-CB 4.25Å
510	G	67.5	Low	73.4	Confident	72 Å²	72	46.2 Å²	46.2	74%	0.742	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-10.3	-176.7	0	0	0	0	0	114.7	V508 S512	V508-G510 PolarHBondContact O-N 2.82Å; G510-S512 PolarHBondContact O-N 3.13Å
511	C	71.4	Confident	73.9	Confident	10 Å²	10	51.9 Å²	51.9	7%	0.068	29%	0.288	C	S	.	.			trans	-84.8	102.2	173.3	-162.8	0	0	0	0	110.8	L505 V508 L545	L505-C511 WeakPolarHBondContact O-CB 3.44Å; L505-C511 PolarHBondContact O-SG 3.3Å; V508-C511 HydrophobicContact CB-CB 3.96Å; V508-C511 VanDerWaalsContact O-CB 3.24Å; V508-C511 WeakPolarHBondContact O-CB 3.5Å; V508-C511 PolarHBondContact O-N 3.3Å; C511-L545 HydrophobicContact CB-CD2 4.04Å
512	S	75.2	Confident	74.1	Confident	57 Å²	57	49.8 Å²	49.8	40%	0.399	27%	0.273	S	S	.	.			trans	-71.4	160.5	166	71.4	0	0	0	0	111.7	G510 K514 T515 A516	G510-S512 PolarHBondContact O-N 3.13Å; S512-K514 PolarHBondContact O-N 3.33Å; S512-T515 WeakPolarHBondContact CA-OG1 3.34Å; S512-T515 PolarHBondContact N-OG1 3.24Å; S512-T515 PolarHBondContact O-N 3.26Å; S512-T515 PolarHBondContact O-OG1 3.14Å; S512-T515 PolarHBondContact OG-N 2.87Å; S512-T515 VanDerWaalsContact OG-N 3.17Å; S512-T515 PolarHBondContact OG-OG1 2.59Å; S512-A516 PolarHBondContact O-N 3.01Å
513	W	73.1	Confident	74.6	Confident	129 Å²	129	50.6 Å²	50.6	49%	0.489	27%	0.272	S	S	.	.	H	α-helix	trans	-50.2	-41.4	170.8	-177.3	90.5	0	0	0	112.9	T506 T515 A516 Q517	T506-W513 HydrophobicContact CG2-CB 4.37Å; W513-T515 PolarHBondContact O-N 2.76Å; W513-A516 PolarHBondContact O-N 3.11Å; W513-Q517 PolarHBondContact O-N 3.13Å
514	K	76.8	Confident	75.4	Confident	156 Å²	156	50.9 Å²	50.9	68%	0.678	28%	0.283	S	S	*	.	H	α-helix	trans	-65.6	-36.1	177.4	-67.7	-172.5	176.9	-174.8	0	113.2	S512 A518	S512-K514 PolarHBondContact O-N 3.33Å; K514-A518 WeakPolarHBondContact O-CB 3.37Å; K514-A518 PolarHBondContact O-N 2.86Å; K514-A518 VanDerWaalsContact O-N 3.07Å
515	T	79.5	Confident	76.2	Confident	14 Å²	14	49.8 Å²	49.8	9%	0.086	28%	0.277	C	S	.	.	H	α-helix	trans	-78.8	-31.9	176.5	44.8	0	0	0	0	112.1	S512 W513 A518 I519 L541	S512-T515 WeakPolarHBondContact CA-OG1 3.34Å; S512-T515 PolarHBondContact N-OG1 3.24Å; S512-T515 PolarHBondContact O-N 3.26Å; S512-T515 PolarHBondContact O-OG1 3.14Å; S512-T515 PolarHBondContact OG-N 2.87Å; S512-T515 VanDerWaalsContact OG-N 3.17Å; S512-T515 PolarHBondContact OG-OG1 2.59Å; W513-T515 PolarHBondContact O-N 2.76Å; T515-A518 PolarHBondContact O-N 3.16Å; T515-I519 WeakPolarHBondContact O-CD1 3.26Å; T515-I519 VanDerWaalsContact O-CG1 3.22Å; T515-I519 WeakPolarHBondContact O-CG1 3.42Å; T515-I519 PolarHBondContact O-N 3.28Å; T515-L541 HydrophobicContact CG2-CD1 4.01Å
516	A	79	Confident	76.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.2	-46.4	171.3	0	0	0	0	0	111	L502 L505 T506 S512 W513 A518 I519 I520	L502-A516 HydrophobicContact CD1-CB 3.69Å; L505-A516 HydrophobicContact CB-CB 3.71Å; L505-A516 HydrophobicContact CD1-CB 4.4Å; T506-A516 HydrophobicContact CG2-CB 3.73Å; S512-A516 PolarHBondContact O-N 3.01Å; W513-A516 PolarHBondContact O-N 3.11Å; A516-A518 VanDerWaalsContact C-N 3.34Å; A516-A518 PolarHBondContact O-N 3.36Å; A516-I519 WeakPolarHBondContact O-CB 3.49Å; A516-I519 PolarHBondContact O-N 2.82Å; A516-I520 WeakPolarHBondContact O-CG1 3.4Å; A516-I520 PolarHBondContact O-N 3.17Å
517	Q	80.9	Confident	77	Confident	62 Å²	62	61.4 Å²	61.4	29%	0.29	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-41.5	173	-168	64.4	55.8	0	0	112	L502 W513 I519 I520 N521	L502-Q517 HydrophobicContact CD1-CB 4.44Å; W513-Q517 PolarHBondContact O-N 3.13Å; Q517-I519 VanDerWaalsContact C-N 3.32Å; Q517-I519 PolarHBondContact O-N 2.85Å; Q517-I520 PolarHBondContact O-N 3.14Å; Q517-N521 PolarHBondContact NE2-OD1 2.71Å; Q517-N521 WeakPolarHBondContact O-CB 3.35Å; Q517-N521 PolarHBondContact O-N 3.38Å; Q517-N521 PolarHBondContact O-OD1 3.45Å
518	A	81.1	Confident	77.4	Confident	30 Å²	30	60.2 Å²	60.2	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-37.4	175.2	0	0	0	0	0	112.7	K514 T515 A516 N521 M522 L541	K514-A518 WeakPolarHBondContact O-CB 3.37Å; K514-A518 PolarHBondContact O-N 2.86Å; K514-A518 VanDerWaalsContact O-N 3.07Å; T515-A518 PolarHBondContact O-N 3.16Å; A516-A518 VanDerWaalsContact C-N 3.34Å; A516-A518 PolarHBondContact O-N 3.36Å; A518-N521 PolarHBondContact O-N 3.31Å; A518-M522 WeakPolarHBondContact O-CE 3.42Å; A518-M522 WeakPolarHBondContact O-CG 3.23Å; A518-M522 PolarHBondContact O-N 3.15Å; A518-L541 HydrophobicContact CB-CD1 4.31Å
519	I	81.1	Confident	77.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-64.8	-46	175.2	-72.4	160.3	0	0	0	110.8	F497 L505 T515 A516 Q517 N521 M522 F525 M535 L541	F497-I519 HydrophobicContact CD1-CG2 3.93Å; F497-I519 HydrophobicContact CE1-CD1 4.23Å; F497-I519 HydrophobicContact CE1-CG2 4.45Å; L505-I519 HydrophobicContact CD1-CB 4.2Å; L505-I519 HydrophobicContact CD1-CG2 3.81Å; L505-I519 HydrophobicContact CD2-CG2 4.14Å; T515-I519 WeakPolarHBondContact O-CD1 3.26Å; T515-I519 VanDerWaalsContact O-CG1 3.22Å; T515-I519 WeakPolarHBondContact O-CG1 3.42Å; T515-I519 PolarHBondContact O-N 3.28Å; A516-I519 WeakPolarHBondContact O-CB 3.49Å; A516-I519 PolarHBondContact O-N 2.82Å; Q517-I519 VanDerWaalsContact C-N 3.32Å; Q517-I519 PolarHBondContact O-N 2.85Å; I519-N521 VanDerWaalsContact C-N 3.32Å; I519-N521 PolarHBondContact O-N 2.87Å; I519-M522 HydrophobicContact CG1-CE 4.4Å; I519-M522 PolarHBondContact O-N 3.11Å; I519-M522 VanDerWaalsContact O-N 3.12Å; I519-F525 HydrophobicContact CG2-CE2 4.29Å; I519-F525 HydrophobicContact CG2-CZ 4.37Å; I519-M535 HydrophobicContact CD1-CE 3.85Å; I519-M535 HydrophobicContact CG1-CE 3.96Å; I519-L541 HydrophobicContact CD1-CD2 4.5Å; I519-L541 HydrophobicContact CG1-CD2 4.02Å
520	I	83.2	Confident	78.4	Confident	47 Å²	47	62.8 Å²	62.8	24%	0.241	33%	0.331	C	S	.	.	H	α-helix	trans	-59.1	-45.3	176.3	-68.3	171.9	0	0	0	110.6	L502 L505 A516 Q517 M522 R523	L502-I520 HydrophobicContact CB-CD1 3.79Å; L502-I520 HydrophobicContact CD1-CD1 3.77Å; L502-I520 HydrophobicContact CG-CD1 4.37Å; L505-I520 HydrophobicContact CD1-CD1 4.13Å; L505-I520 HydrophobicContact CD1-CG1 3.68Å; A516-I520 WeakPolarHBondContact O-CG1 3.4Å; A516-I520 PolarHBondContact O-N 3.17Å; Q517-I520 PolarHBondContact O-N 3.14Å; I520-M522 PolarHBondContact O-N 3.46Å; I520-M522 VanDerWaalsContact O-N 3.11Å; I520-R523 WeakPolarHBondContact O-CB 3.32Å; I520-R523 PolarHBondContact O-N 3.31Å; I520-R523 VanDerWaalsContact O-N 3.13Å
521	N	83.8	Confident	78.9	Confident	121 Å²	121	59.6 Å²	59.6	65%	0.647	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.1	179.3	-66.3	13.9	0	0	0	114.3	Q517 A518 I519	Q517-N521 PolarHBondContact NE2-OD1 2.71Å; Q517-N521 WeakPolarHBondContact O-CB 3.35Å; Q517-N521 PolarHBondContact O-N 3.38Å; Q517-N521 PolarHBondContact O-OD1 3.45Å; A518-N521 PolarHBondContact O-N 3.31Å; I519-N521 VanDerWaalsContact C-N 3.32Å; I519-N521 PolarHBondContact O-N 2.87Å
522	M	80.4	Confident	79	Confident	37 Å²	37	62.4 Å²	62.4	18%	0.182	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	2.7	175.7	-69.5	-176	-59.6	0	0	113.5	A518 I519 I520 F525 Q534 V538 L541	A518-M522 WeakPolarHBondContact O-CE 3.42Å; A518-M522 WeakPolarHBondContact O-CG 3.23Å; A518-M522 PolarHBondContact O-N 3.15Å; I519-M522 HydrophobicContact CG1-CE 4.4Å; I519-M522 PolarHBondContact O-N 3.11Å; I519-M522 VanDerWaalsContact O-N 3.12Å; I520-M522 PolarHBondContact O-N 3.46Å; I520-M522 VanDerWaalsContact O-N 3.11Å; M522-F525 HydrophobicContact CB-CE1 3.72Å; M522-F525 HydrophobicContact CB-CZ 3.78Å; M522-Q534 HydrophobicContact SD-CB 4.17Å; M522-V538 HydrophobicContact CE-CG2 4.46Å; M522-V538 HydrophobicContact SD-CG2 3.73Å; M522-L541 HydrophobicContact CE-CD2 3.85Å
523	R	83.2	Confident	79	Confident	66 Å²	66	66.7 Å²	66.7	25%	0.249	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-74.1	153.4	177.2	-69.3	174.8	172.6	178.1	-4.5	111.9	F497 N498 A500 I520 F525	F497-R523 VanDerWaalsContact O-CZ 3.25Å; F497-R523 PolarHBondContact O-NE 3.09Å; F497-R523 PolarHBondContact O-NH2 3.11Å; N498-R523 VanDerWaalsContact C-CZ 3.46Å; N498-R523 VanDerWaalsContact O-CD 3.24Å; N498-R523 WeakPolarHBondContact O-CD 3.26Å; N498-R523 PolarHBondContact O-NE 2.85Å; N498-R523 PolarHBondContact O-NH1 3.25Å; N498-R523 VanDerWaalsContact O-NH1 3.14Å; A500-R523 VanDerWaalsContact O-CZ 3.23Å; A500-R523 PolarHBondContact O-NH1 3.37Å; A500-R523 PolarHBondContact O-NH2 3.27Å; I520-R523 WeakPolarHBondContact O-CB 3.32Å; I520-R523 PolarHBondContact O-N 3.31Å; I520-R523 VanDerWaalsContact O-N 3.13Å; R523-F525 HydrophobicContact CG-CD2 4.42Å; R523-F525 HydrophobicContact CG-CE2 3.96Å
524	P	81.5	Confident	79.2	Confident	105 Å²	105	64.1 Å²	64.1	68%	0.682	32%	0.316	S	S	*	.	P	Polyproline II helix	cis	-87.8	139.6	-5.1	33.8	-32.9	0	0	0	112.6	N498	N498-P524 WeakPolarHBondContact OD1-CA 3.33Å
525	F	82.9	Confident	78.9	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.022	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-79.4	132	169.9	-51.2	-74.2	0	0	0	109.8	L494 F497 N498 I519 M522 R523 L531 Q534	L494-F525 HydrophobicContact CD1-CB 3.91Å; F497-F525 HydrophobicContact CB-CD2 4.14Å; F497-F525 HydrophobicContact CB-CE2 4.2Å; N498-F525 PolarHBondContact ND2-O 3.48Å; N498-F525 VanDerWaalsContact OD1-CD2 3.31Å; N498-F525 WeakPolarHBondContact OD1-CD2 3.47Å; N498-F525 PolarHBondContact OD1-N 3.2Å; I519-F525 HydrophobicContact CG2-CE2 4.29Å; I519-F525 HydrophobicContact CG2-CZ 4.37Å; M522-F525 HydrophobicContact CB-CE1 3.72Å; M522-F525 HydrophobicContact CB-CZ 3.78Å; R523-F525 HydrophobicContact CG-CD2 4.42Å; R523-F525 HydrophobicContact CG-CE2 3.96Å; F525-L531 HydrophobicContact CB-CB 4.11Å; F525-L531 HydrophobicContact CD1-CB 4.18Å; F525-L531 HydrophobicContact CD1-CD1 3.74Å; F525-L531 HydrophobicContact CD2-CD1 3.73Å; F525-L531 HydrophobicContact CE1-CD1 3.76Å; F525-L531 HydrophobicContact CE2-CD1 3.76Å; F525-L531 HydrophobicContact CG-CB 4.12Å; F525-L531 HydrophobicContact CG-CD1 3.72Å; F525-L531 HydrophobicContact CG-CG 4.5Å; F525-L531 HydrophobicContact CZ-CD1 3.78Å; F525-Q534 HydrophobicContact CD1-CB 4.34Å; F525-Q534 HydrophobicContact CD1-CG 4.16Å; F525-Q534 HydrophobicContact CE1-CB 3.99Å; F525-Q534 HydrophobicContact CE1-CG 4.2Å
526	K	77.9	Confident	78.4	Confident	166 Å²	166	61 Å²	61	72%	0.722	31%	0.313	S	S	*	.			trans	-81.7	-48.9	-174.4	-62.5	178	-178.1	178	0	113.2	L494 D530	L494-K526 WeakPolarHBondContact CD2-O 3.37Å; K526-D530 HydrophobicContact CB-CB 4.43Å; K526-D530 PolarHBondContact N-OD2 3.26Å
527	N	80.4	Confident	77.9	Confident	100 Å²	100	64 Å²	64	54%	0.535	34%	0.344	S	S	.	.	S	Bend	trans	-138.5	163.6	-176.2	-63.8	52.7	0	0	0	108.8	K529 D530 L531	N527-K529 PolarHBondContact O-N 2.9Å; N527-D530 WeakPolarHBondContact O-CB 3.49Å; N527-D530 PolarHBondContact O-N 3.28Å; N527-L531 PolarHBondContact O-N 2.97Å
528	T	71.6	Confident	77.5	Confident	17 Å²	17	63.4 Å²	63.4	10%	0.104	35%	0.345	C	S	.	.	H	α-helix	trans	-55.1	-36.4	173.6	-37.9	0	0	0	0	112.1	L485 D530 L531 I532	L485-T528 HydrophobicContact CD1-CG2 4.43Å; T528-D530 PolarHBondContact O-N 3.01Å; T528-L531 PolarHBondContact O-N 3.47Å; T528-I532 HydrophobicContact CG2-CD1 4.17Å; T528-I532 VanDerWaalsContact O-CD1 3.25Å; T528-I532 WeakPolarHBondContact O-CD1 3.37Å; T528-I532 WeakPolarHBondContact O-CG1 3.33Å; T528-I532 PolarHBondContact O-N 3.36Å
529	K	74.6	Confident	76.4	Confident	89 Å²	89	73.2 Å²	73.2	39%	0.387	38%	0.375	S	S	.	.	H	α-helix	trans	-57	-46.3	173.1	-63.3	-179.5	-178.9	-175.2	0	112.8	E479 D481 N527 I532 F533	E479-K529 IonicContact OE2-NZ 2.79Å; E479-K529 PolarHBondContact OE2-NZ 3.05Å; D481-K529 WeakPolarHBondContact OD1-CE 3.32Å; D481-K529 IonicContact OD1-NZ 2.98Å; D481-K529 PolarHBondContact OD1-NZ 2.84Å; D481-K529 WeakPolarHBondContact OD2-CE 3.42Å; D481-K529 IonicContact OD2-NZ 2.76Å; N527-K529 PolarHBondContact O-N 2.9Å; K529-I532 PolarHBondContact O-N 2.85Å; K529-F533 WeakPolarHBondContact O-CB 3.4Å; K529-F533 PolarHBondContact O-N 2.71Å
530	D	80.5	Confident	75.4	Confident	34 Å²	34	80.8 Å²	80.8	18%	0.182	41%	0.41	C	S	.	.	H	α-helix	trans	-67.6	-46.8	-179.5	178.2	39.1	0	0	0	110.6	K526 N527 T528 I532 F533 Q534	K526-D530 HydrophobicContact CB-CB 4.43Å; K526-D530 PolarHBondContact N-OD2 3.26Å; N527-D530 WeakPolarHBondContact O-CB 3.49Å; N527-D530 PolarHBondContact O-N 3.28Å; T528-D530 PolarHBondContact O-N 3.01Å; D530-I532 VanDerWaalsContact C-N 3.33Å; D530-I532 PolarHBondContact O-N 3.46Å; D530-F533 WeakPolarHBondContact O-CB 3.41Å; D530-F533 PolarHBondContact O-N 2.88Å; D530-F533 VanDerWaalsContact O-N 3.1Å; D530-Q534 VanDerWaalsContact O-CG 3.25Å; D530-Q534 WeakPolarHBondContact O-CG 3.48Å; D530-Q534 PolarHBondContact O-N 2.85Å; D530-Q534 PolarHBondContact OD1-NE2 2.9Å
531	L	78	Confident	74.6	Confident	5 Å²	5	79.6 Å²	79.6	3%	0.026	40%	0.404	C	S	.	.	H	α-helix	trans	-53	-47.4	172.6	174.6	64.2	0	0	0	112.5	L493 F497 F525 N527 T528 M535	L493-L531 HydrophobicContact CD2-CD2 3.37Å; F497-L531 HydrophobicContact CB-CD1 4.05Å; F497-L531 HydrophobicContact CB-CD2 4.02Å; F497-L531 HydrophobicContact CD1-CD1 4.4Å; F497-L531 HydrophobicContact CD2-CD1 4.47Å; F497-L531 HydrophobicContact CD2-CD2 3.63Å; F497-L531 HydrophobicContact CE2-CD2 4.36Å; F497-L531 HydrophobicContact CG-CD1 4.05Å; F497-L531 HydrophobicContact CG-CD2 3.95Å; F525-L531 HydrophobicContact CB-CB 4.11Å; F525-L531 HydrophobicContact CD1-CB 4.18Å; F525-L531 HydrophobicContact CD1-CD1 3.74Å; F525-L531 HydrophobicContact CD2-CD1 3.73Å; F525-L531 HydrophobicContact CE1-CD1 3.76Å; F525-L531 HydrophobicContact CE2-CD1 3.76Å; F525-L531 HydrophobicContact CG-CB 4.12Å; F525-L531 HydrophobicContact CG-CD1 3.72Å; F525-L531 HydrophobicContact CG-CG 4.5Å; F525-L531 HydrophobicContact CZ-CD1 3.78Å; N527-L531 PolarHBondContact O-N 2.97Å; T528-L531 PolarHBondContact O-N 3.47Å; L531-M535 HydrophobicContact CD1-CE 4.17Å; L531-M535 HydrophobicContact CD1-CG 4.16Å; L531-M535 HydrophobicContact CD1-SD 4.5Å; L531-M535 WeakPolarHBondContact O-CB 3.37Å; L531-M535 VanDerWaalsContact O-CG 3.3Å; L531-M535 WeakPolarHBondContact O-CG 3.4Å; L531-M535 PolarHBondContact O-N 3.16Å
532	I	75	Confident	73.6	Confident	69 Å²	69	75.5 Å²	75.5	35%	0.354	39%	0.385	S	S	.	.	H	α-helix	trans	-63.7	-43.5	177.9	-64.5	156.9	0	0	0	110.8	L483 T528 K529 D530 M535 S536	L483-I532 HydrophobicContact CD1-CD1 3.42Å; L483-I532 VanDerWaalsContact CD1-CD1 3.42Å; L483-I532 HydrophobicContact CD1-CG1 4.39Å; T528-I532 HydrophobicContact CG2-CD1 4.17Å; T528-I532 VanDerWaalsContact O-CD1 3.25Å; T528-I532 WeakPolarHBondContact O-CD1 3.37Å; T528-I532 WeakPolarHBondContact O-CG1 3.33Å; T528-I532 PolarHBondContact O-N 3.36Å; K529-I532 PolarHBondContact O-N 2.85Å; D530-I532 VanDerWaalsContact C-N 3.33Å; D530-I532 PolarHBondContact O-N 3.46Å; I532-M535 PolarHBondContact O-N 2.85Å; I532-S536 VanDerWaalsContact O-CB 3.31Å; I532-S536 WeakPolarHBondContact O-CB 3.31Å; I532-S536 PolarHBondContact O-N 2.72Å; I532-S536 PolarHBondContact O-OG 3.36Å
533	F	75.3	Confident	72.7	Confident	148 Å²	148	77.6 Å²	77.6	65%	0.649	40%	0.403	S	S	*	.	H	α-helix	trans	-61.3	-52.7	179.3	-175.2	-100.7	0	0	0	111.4	K529 D530 M535 S536 G537	K529-F533 WeakPolarHBondContact O-CB 3.4Å; K529-F533 PolarHBondContact O-N 2.71Å; D530-F533 WeakPolarHBondContact O-CB 3.41Å; D530-F533 PolarHBondContact O-N 2.88Å; D530-F533 VanDerWaalsContact O-N 3.1Å; F533-M535 PolarHBondContact O-N 2.79Å; F533-S536 PolarHBondContact O-N 3.17Å; F533-S536 VanDerWaalsContact O-N 3.1Å; F533-S536 PolarHBondContact O-OG 3.18Å; F533-G537 PolarHBondContact O-N 3.36Å; F533-G537 VanDerWaalsContact O-N 3.13Å
534	Q	75.9	Confident	71.9	Confident	75 Å²	75	78.6 Å²	78.6	35%	0.35	41%	0.413	S	S	.	.	H	α-helix	trans	-57	-48.9	175.8	-61.1	-67.4	-8.7	0	0	111.3	M522 F525 D530 S536 G537	M522-Q534 HydrophobicContact SD-CB 4.17Å; F525-Q534 HydrophobicContact CD1-CB 4.34Å; F525-Q534 HydrophobicContact CD1-CG 4.16Å; F525-Q534 HydrophobicContact CE1-CB 3.99Å; F525-Q534 HydrophobicContact CE1-CG 4.2Å; D530-Q534 VanDerWaalsContact O-CG 3.25Å; D530-Q534 WeakPolarHBondContact O-CG 3.48Å; D530-Q534 PolarHBondContact O-N 2.85Å; D530-Q534 PolarHBondContact OD1-NE2 2.9Å; Q534-S536 VanDerWaalsContact C-N 3.26Å; Q534-S536 PolarHBondContact O-N 3.27Å; Q534-G537 PolarHBondContact O-N 3.11Å
535	M	71.4	Confident	71.4	Confident	13 Å²	13	73.8 Å²	73.8	6%	0.064	38%	0.382	C	S	.	.	H	α-helix	trans	-61.1	-32.2	177	-76.3	-152.2	162.4	0	0	113.3	F497 I519 L531 I532 F533 L541 L545	F497-M535 HydrophobicContact CD1-CE 3.94Å; F497-M535 HydrophobicContact CE1-CE 3.44Å; F497-M535 VanDerWaalsContact CE1-CE 3.44Å; F497-M535 HydrophobicContact CZ-CE 3.84Å; I519-M535 HydrophobicContact CD1-CE 3.85Å; I519-M535 HydrophobicContact CG1-CE 3.96Å; L531-M535 HydrophobicContact CD1-CE 4.17Å; L531-M535 HydrophobicContact CD1-CG 4.16Å; L531-M535 HydrophobicContact CD1-SD 4.5Å; L531-M535 WeakPolarHBondContact O-CB 3.37Å; L531-M535 VanDerWaalsContact O-CG 3.3Å; L531-M535 WeakPolarHBondContact O-CG 3.4Å; L531-M535 PolarHBondContact O-N 3.16Å; I532-M535 PolarHBondContact O-N 2.85Å; F533-M535 PolarHBondContact O-N 2.79Å; M535-L541 HydrophobicContact CB-CD2 4.09Å; M535-L541 HydrophobicContact CE-CD2 4.02Å; M535-L541 HydrophobicContact CG-CD2 3.66Å; M535-L541 HydrophobicContact SD-CD2 4.1Å; M535-L545 HydrophobicContact CE-CB 4.44Å; M535-L545 HydrophobicContact CE-CD1 4.33Å; M535-L545 HydrophobicContact SD-CB 4.29Å; M535-L545 HydrophobicContact SD-CD1 4.46Å
536	S	69.6	Low	70.8	Confident	90 Å²	90	77 Å²	77	63%	0.629	39%	0.394	S	S	*	.	H	α-helix	trans	-76.3	-25.3	179	77.2	0	0	0	0	113.9	I532 F533 Q534	I532-S536 VanDerWaalsContact O-CB 3.31Å; I532-S536 WeakPolarHBondContact O-CB 3.31Å; I532-S536 PolarHBondContact O-N 2.72Å; I532-S536 PolarHBondContact O-OG 3.36Å; F533-S536 PolarHBondContact O-N 3.17Å; F533-S536 VanDerWaalsContact O-N 3.1Å; F533-S536 PolarHBondContact O-OG 3.18Å; Q534-S536 VanDerWaalsContact C-N 3.26Å; Q534-S536 PolarHBondContact O-N 3.27Å
537	G	68.2	Low	70.3	Confident	63 Å²	63	74.2 Å²	74.2	65%	0.649	38%	0.384	S	S	*	.	H	α-helix	trans	-74.9	-25.7	179.9	0	0	0	0	0	114.3	F533 Q534	F533-G537 PolarHBondContact O-N 3.36Å; F533-G537 VanDerWaalsContact O-N 3.13Å; Q534-G537 PolarHBondContact O-N 3.11Å
538	V	71.5	Confident	69.6	Low	51 Å²	51	71.3 Å²	71.3	31%	0.309	37%	0.371	S	S	.	.	S	Bend	trans	-90.6	115.8	-173.9	-177	0	0	0	0	111.6	M522 H540 L541	M522-V538 HydrophobicContact CE-CG2 4.46Å; M522-V538 HydrophobicContact SD-CG2 3.73Å; V538-H540 PolarHBondContact O-N 2.91Å; V538-L541 HydrophobicContact CB-CB 4.49Å; V538-L541 HydrophobicContact CB-CD1 4.11Å; V538-L541 HydrophobicContact CG1-CD1 3.81Å; V538-L541 PolarHBondContact O-N 3.16Å
539	R	58.1	Low	69.5	Low	236 Å²	236	70.5 Å²	70.5	89%	0.891	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-9.3	-177.8	-71.2	-174.7	175.1	-175.1	-0.2	117
540	H	61.3	Low	69.3	Low	159 Å²	159	69.6 Å²	69.6	74%	0.736	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	-0.3	-176.5	-59.1	-43.6	0	0	0	114.3	V538	V538-H540 PolarHBondContact O-N 2.91Å
541	L	65.6	Low	68.6	Low	23 Å²	23	71.5 Å²	71.5	12%	0.12	37%	0.372	C	S	.	.			trans	-90.9	160.7	165.8	-88.9	72.6	0	0	0	110.2	T515 A518 I519 M522 M535 V538 L545	T515-L541 HydrophobicContact CG2-CD1 4.01Å; A518-L541 HydrophobicContact CB-CD1 4.31Å; I519-L541 HydrophobicContact CD1-CD2 4.5Å; I519-L541 HydrophobicContact CG1-CD2 4.02Å; M522-L541 HydrophobicContact CE-CD2 3.85Å; M535-L541 HydrophobicContact CB-CD2 4.09Å; M535-L541 HydrophobicContact CE-CD2 4.02Å; M535-L541 HydrophobicContact CG-CD2 3.66Å; M535-L541 HydrophobicContact SD-CD2 4.1Å; V538-L541 HydrophobicContact CB-CB 4.49Å; V538-L541 HydrophobicContact CB-CD1 4.11Å; V538-L541 HydrophobicContact CG1-CD1 3.81Å; V538-L541 PolarHBondContact O-N 3.16Å; L541-L545 HydrophobicContact CB-CD1 4.41Å; L541-L545 HydrophobicContact CD2-CD1 4.32Å; L541-L545 HydrophobicContact CG-CD1 4.05Å
542	S	63.4	Low	68	Low	35 Å²	35	72.1 Å²	72.1	25%	0.245	38%	0.375	C	S	.	.			trans	-132.6	137.2	173.9	58.4	0	0	0	0	110	N544 L545	S542-N544 PolarHBondContact O-N 3.12Å; S542-L545 WeakPolarHBondContact O-CB 3.42Å; S542-L545 WeakPolarHBondContact O-CG 3.11Å; S542-L545 PolarHBondContact O-N 2.84Å
543	S	61.5	Low	67.7	Low	80 Å²	80	70.1 Å²	70.1	56%	0.559	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-36.3	175.5	48.1	0	0	0	0	113.1	L545 Y546	S543-L545 PolarHBondContact O-N 3Å; S543-Y546 WeakPolarHBondContact O-CD1 3.35Å; S543-Y546 WeakPolarHBondContact O-CE1 3.21Å; S543-Y546 PolarHBondContact O-N 3.46Å
544	N	65.5	Low	67.2	Low	87 Å²	87	68.5 Å²	68.5	47%	0.465	36%	0.36	S	S	.	.	H	α-helix	trans	-48.9	-19.3	174.6	-61	75.3	0	0	0	115.3	S542 Y546 E547 C548	S542-N544 PolarHBondContact O-N 3.12Å; N544-Y546 VanDerWaalsContact C-N 3.32Å; N544-Y546 PolarHBondContact O-N 3Å; N544-E547 PolarHBondContact O-N 3.03Å; N544-C548 PolarHBondContact O-N 3.07Å; N544-C548 PolarHBondContact O-SG 3.49Å
545	L	70.9	Confident	66.4	Low	4 Å²	4	65.3 Å²	65.3	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-34.1	173.6	-71.6	169.1	0	0	0	113	V508 C511 M535 L541 S542 S543 E547 C549	V508-L545 HydrophobicContact CG1-CD2 4.29Å; C511-L545 HydrophobicContact CB-CD2 4.04Å; M535-L545 HydrophobicContact CE-CB 4.44Å; M535-L545 HydrophobicContact CE-CD1 4.33Å; M535-L545 HydrophobicContact SD-CB 4.29Å; M535-L545 HydrophobicContact SD-CD1 4.46Å; L541-L545 HydrophobicContact CB-CD1 4.41Å; L541-L545 HydrophobicContact CD2-CD1 4.32Å; L541-L545 HydrophobicContact CG-CD1 4.05Å; S542-L545 WeakPolarHBondContact O-CB 3.42Å; S542-L545 WeakPolarHBondContact O-CG 3.11Å; S542-L545 PolarHBondContact O-N 2.84Å; S543-L545 PolarHBondContact O-N 3Å; L545-E547 VanDerWaalsContact C-N 3.29Å; L545-E547 PolarHBondContact O-N 3.27Å; L545-C549 WeakPolarHBondContact O-CB 3.33Å; L545-C549 PolarHBondContact O-N 2.98Å
546	Y	69.8	Low	66	Low	72 Å²	72	69.8 Å²	69.8	28%	0.282	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-37.2	175.1	81	-108.9	0	0	0	110.9	L483 S543 N544 C549 K550	L483-Y546 HydrophobicContact CD2-CE1 4.41Å; L483-Y546 HydrophobicContact CD2-CE2 4.33Å; S543-Y546 WeakPolarHBondContact O-CD1 3.35Å; S543-Y546 WeakPolarHBondContact O-CE1 3.21Å; S543-Y546 PolarHBondContact O-N 3.46Å; N544-Y546 VanDerWaalsContact C-N 3.32Å; N544-Y546 PolarHBondContact O-N 3Å; Y546-C549 PolarHBondContact O-N 3.05Å; Y546-K550 PolarHBondContact O-N 2.88Å
547	E	67.8	Low	65.8	Low	108 Å²	108	68 Å²	68	51%	0.505	35%	0.347	S	S	.	.	H	α-helix	trans	-73.4	-43.8	-175.6	-159.4	171.1	-155.2	0	0	110.1	N544 L545 C549 K550 D551	N544-E547 PolarHBondContact O-N 3.03Å; L545-E547 VanDerWaalsContact C-N 3.29Å; L545-E547 PolarHBondContact O-N 3.27Å; E547-C549 VanDerWaalsContact C-N 3.27Å; E547-C549 PolarHBondContact O-N 2.89Å; E547-K550 PolarHBondContact O-N 3.27Å; E547-D551 PolarHBondContact O-N 3.33Å; E547-D551 VanDerWaalsContact O-N 3.11Å
548	C	65.9	Low	65.6	Low	39 Å²	39	65.6 Å²	65.6	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-27.8	169.8	-63.9	0	0	0	0	113.4	V508 P509 N544 I552	V508-C548 HydrophobicContact CG1-CB 4.06Å; P509-C548 HydrophobicContact CB-CB 4.25Å; N544-C548 PolarHBondContact O-N 3.07Å; N544-C548 PolarHBondContact O-SG 3.49Å; C548-I552 WeakPolarHBondContact O-CG1 3.33Å; C548-I552 PolarHBondContact O-N 2.82Å
549	C	70.7	Confident	65.1	Low	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-75.7	-39.6	173.5	-174.2	0	0	0	0	112.2	F496 F497 L545 Y546 E547 D551 I552 L553	F496-C549 WeakPolarHBondContact CD1-SG 3.48Å; F497-C549 HydrophobicContact CE2-CB 3.79Å; F497-C549 VanDerWaalsContact CE2-SG 3.54Å; F497-C549 HydrophobicContact CZ-CB 3.98Å; L545-C549 WeakPolarHBondContact O-CB 3.33Å; L545-C549 PolarHBondContact O-N 2.98Å; Y546-C549 PolarHBondContact O-N 3.05Å; E547-C549 VanDerWaalsContact C-N 3.27Å; E547-C549 PolarHBondContact O-N 2.89Å; C549-D551 VanDerWaalsContact C-N 3.33Å; C549-D551 PolarHBondContact O-N 3.31Å; C549-I552 CarbonylContact O-C 3.51Å; C549-I552 WeakPolarHBondContact O-CA 3.44Å; C549-I552 WeakPolarHBondContact O-CB 3.36Å; C549-I552 PolarHBondContact O-N 3.01Å; C549-L553 WeakPolarHBondContact O-CG 3.46Å; C549-L553 PolarHBondContact O-N 3.08Å
550	K	69.4	Low	65.4	Low	71 Å²	71	57 Å²	57	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-44.7	172.7	175.5	161.3	169.9	153.8	0	111.4	L485 E489 Y546 E547 I552 L553 E554	L485-K550 HydrophobicContact CD2-CD 4.03Å; E489-K550 WeakPolarHBondContact OE1-CE 3.45Å; E489-K550 IonicContact OE1-NZ 2.96Å; E489-K550 PolarHBondContact OE1-NZ 3.32Å; E489-K550 IonicContact OE2-NZ 3.7Å; Y546-K550 PolarHBondContact O-N 2.88Å; E547-K550 PolarHBondContact O-N 3.27Å; K550-I552 PolarHBondContact O-N 3.1Å; K550-L553 PolarHBondContact O-N 3.15Å; K550-L553 VanDerWaalsContact O-N 3.15Å; K550-E554 PolarHBondContact O-N 2.93Å
551	D	64.8	Low	65.7	Low	73 Å²	73	57 Å²	57	39%	0.39	28%	0.284	S	S	.	.	H	α-helix	trans	-54	-38	172.4	-121.6	54.4	0	0	0	111.8	E547 C549 V555 R827	E547-D551 PolarHBondContact O-N 3.33Å; E547-D551 VanDerWaalsContact O-N 3.11Å; C549-D551 VanDerWaalsContact C-N 3.33Å; C549-D551 PolarHBondContact O-N 3.31Å; D551-V555 WeakPolarHBondContact O-CB 3.41Å; D551-V555 WeakPolarHBondContact O-CG2 3.19Å; D551-V555 PolarHBondContact O-N 2.83Å; D551-R827 IonicContact OD1-NH1 3.76Å; D551-R827 IonicContact OD2-CZ 3.9Å; D551-R827 IonicContact OD2-NH1 2.68Å; D551-R827 PolarHBondContact OD2-NH1 3.11Å
552	I	66.1	Low	65.7	Low	18 Å²	18	56.8 Å²	56.8	9%	0.092	28%	0.283	C	S	.	.	H	α-helix	trans	-78.2	-33.1	178	-74.1	169.8	0	0	0	113.2	V508 C548 C549 K550 V555 R556	V508-I552 HydrophobicContact CB-CD1 4.22Å; V508-I552 HydrophobicContact CG1-CD1 4.35Å; V508-I552 HydrophobicContact CG2-CD1 4.01Å; C548-I552 WeakPolarHBondContact O-CG1 3.33Å; C548-I552 PolarHBondContact O-N 2.82Å; C549-I552 CarbonylContact O-C 3.51Å; C549-I552 WeakPolarHBondContact O-CA 3.44Å; C549-I552 WeakPolarHBondContact O-CB 3.36Å; C549-I552 PolarHBondContact O-N 3.01Å; K550-I552 PolarHBondContact O-N 3.1Å; I552-V555 WeakPolarHBondContact O-CB 3.32Å; I552-V555 WeakPolarHBondContact O-CG1 3.34Å; I552-V555 PolarHBondContact O-N 3.3Å; I552-R556 WeakPolarHBondContact O-CB 3.15Å; I552-R556 PolarHBondContact O-N 2.88Å
553	L	68.5	Low	65.7	Low	27 Å²	27	56.7 Å²	56.7	14%	0.141	28%	0.279	C	S	.	.	H	α-helix	trans	-76.5	-39	179.1	-68.9	171.1	0	0	0	111.5	H492 L493 F496 C549 K550 V555 R556 T557	H492-L553 HydrophobicContact CB-CD1 4.44Å; L493-L553 HydrophobicContact CB-CD1 3.97Å; L493-L553 HydrophobicContact CG-CD1 4.45Å; F496-L553 HydrophobicContact CB-CD2 4.25Å; F496-L553 HydrophobicContact CG-CD2 4.43Å; C549-L553 WeakPolarHBondContact O-CG 3.46Å; C549-L553 PolarHBondContact O-N 3.08Å; K550-L553 PolarHBondContact O-N 3.15Å; K550-L553 VanDerWaalsContact O-N 3.15Å; L553-V555 VanDerWaalsContact C-N 3.27Å; L553-V555 PolarHBondContact O-N 2.93Å; L553-R556 PolarHBondContact O-N 3.15Å; L553-T557 WeakPolarHBondContact O-CB 3.44Å; L553-T557 PolarHBondContact O-N 3.41Å; L553-T557 PolarHBondContact O-OG1 3.18Å
554	E	65.4	Low	66.1	Low	114 Å²	114	56.2 Å²	56.2	53%	0.533	27%	0.271	S	S	.	.	H	α-helix	trans	-61.1	-40	169.7	-174.1	-179.8	-173.6	0	0	110.9	K550 S558 L824	K550-E554 PolarHBondContact O-N 2.93Å; E554-S558 WeakPolarHBondContact O-CB 3.35Å; E554-S558 PolarHBondContact O-N 3.36Å; E554-S558 PolarHBondContact O-OG 3.24Å; E554-L824 HydrophobicContact CG-CD1 4.5Å
555	V	59.4	Low	66.3	Low	8 Å²	8	58.4 Å²	58.4	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-53.4	-57.7	170	135.8	0	0	0	0	112.4	D551 I552 L553 T557 S558 V559 L824 I828	D551-V555 WeakPolarHBondContact O-CB 3.41Å; D551-V555 WeakPolarHBondContact O-CG2 3.19Å; D551-V555 PolarHBondContact O-N 2.83Å; I552-V555 WeakPolarHBondContact O-CB 3.32Å; I552-V555 WeakPolarHBondContact O-CG1 3.34Å; I552-V555 PolarHBondContact O-N 3.3Å; L553-V555 VanDerWaalsContact C-N 3.27Å; L553-V555 PolarHBondContact O-N 2.93Å; V555-T557 PolarHBondContact O-N 2.87Å; V555-S558 PolarHBondContact O-N 2.85Å; V555-V559 PolarHBondContact O-N 3.28Å; V555-L824 HydrophobicContact CG2-CD1 4.24Å; V555-L824 HydrophobicContact CG2-CD2 4.36Å; V555-L824 HydrophobicContact CG2-CG 3.85Å; V555-I828 HydrophobicContact CB-CD1 3.96Å; V555-I828 HydrophobicContact CB-CG1 3.94Å; V555-I828 HydrophobicContact CG1-CD1 3.56Å; V555-I828 HydrophobicContact CG1-CG1 3.41Å; V555-I828 VanDerWaalsContact CG1-CG1 3.41Å; V555-I828 HydrophobicContact CG2-CD1 3.81Å; V555-I828 HydrophobicContact CG2-CG1 3.48Å; V555-I828 VanDerWaalsContact CG2-CG1 3.48Å
556	R	62.6	Low	66.1	Low	108 Å²	108	58.3 Å²	58.3	41%	0.408	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-45	-176.1	-174.2	174.9	-178.9	146.4	-0.1	110.2	E504 I552 L553 S558 V559 I560	E504-R556 IonicContact OE1-NH1 2.72Å; E504-R556 PolarHBondContact OE1-NH1 3Å; I552-R556 WeakPolarHBondContact O-CB 3.15Å; I552-R556 PolarHBondContact O-N 2.88Å; L553-R556 PolarHBondContact O-N 3.15Å; R556-S558 PolarHBondContact O-N 3.3Å; R556-V559 PolarHBondContact O-N 3.49Å; R556-I560 HydrophobicContact CG-CD1 4.03Å; R556-I560 WeakPolarHBondContact O-CG1 3.41Å; R556-I560 PolarHBondContact O-N 3.42Å
557	T	65.7	Low	66.1	Low	53 Å²	53	59.2 Å²	59.2	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-63.1	-40.7	177.7	-48.1	0	0	0	0	111.8	L553 V555 I560 R561	L553-T557 WeakPolarHBondContact O-CB 3.44Å; L553-T557 PolarHBondContact O-N 3.41Å; L553-T557 PolarHBondContact O-OG1 3.18Å; V555-T557 PolarHBondContact O-N 2.87Å; T557-I560 PolarHBondContact O-N 2.85Å; T557-R561 WeakPolarHBondContact O-CG 3.28Å; T557-R561 PolarHBondContact O-N 3.06Å
558	S	64.1	Low	66.4	Low	12 Å²	12	62 Å²	62	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-68.7	-33.7	178	-63.9	0	0	0	0	112.7	E554 V555 R556 L562	E554-S558 WeakPolarHBondContact O-CB 3.35Å; E554-S558 PolarHBondContact O-N 3.36Å; E554-S558 PolarHBondContact O-OG 3.24Å; V555-S558 PolarHBondContact O-N 2.85Å; R556-S558 PolarHBondContact O-N 3.3Å; S558-L562 WeakPolarHBondContact O-CG 3.29Å; S558-L562 PolarHBondContact O-N 2.99Å
559	V	61	Low	66.7	Low	31 Å²	31	62.5 Å²	62.5	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-64.6	-52.3	169.7	171.6	0	0	0	0	110.2	V555 R556 R561 L562 L563 L825 I828	V555-V559 PolarHBondContact O-N 3.28Å; R556-V559 PolarHBondContact O-N 3.49Å; V559-R561 VanDerWaalsContact C-N 3.33Å; V559-R561 PolarHBondContact O-N 3.11Å; V559-L562 CarbonylContact O-C 3.58Å; V559-L562 WeakPolarHBondContact O-CA 3.32Å; V559-L562 WeakPolarHBondContact O-CB 3.41Å; V559-L562 PolarHBondContact O-N 2.97Å; V559-L563 HydrophobicContact CG1-CD1 4.35Å; V559-L563 HydrophobicContact CG1-CD2 3.85Å; V559-L563 HydrophobicContact CG1-CG 4.02Å; V559-L563 WeakPolarHBondContact O-CG 3.49Å; V559-L563 PolarHBondContact O-N 3.38Å; V559-L825 HydrophobicContact CG2-CD2 3.98Å; V559-I828 HydrophobicContact CG2-CD1 3.44Å; V559-I828 VanDerWaalsContact CG2-CD1 3.44Å
560	I	63.4	Low	66.4	Low	75 Å²	75	64.4 Å²	64.4	39%	0.385	30%	0.3	S	S	.	.	H	α-helix	trans	-56.7	-44.8	-178.8	-66.5	164.6	0	0	0	111.2	R556 T557 L562 L563 N564	R556-I560 HydrophobicContact CG-CD1 4.03Å; R556-I560 WeakPolarHBondContact O-CG1 3.41Å; R556-I560 PolarHBondContact O-N 3.42Å; T557-I560 PolarHBondContact O-N 2.85Å; I560-L562 PolarHBondContact O-N 3.13Å; I560-L562 VanDerWaalsContact O-N 3.11Å; I560-L563 HydrophobicContact CG1-CD1 4.37Å; I560-L563 WeakPolarHBondContact O-CB 3.28Å; I560-L563 PolarHBondContact O-N 2.83Å; I560-N564 WeakPolarHBondContact CG2-OD1 3.31Å; I560-N564 PolarHBondContact O-N 3.3Å; I560-N564 PolarHBondContact O-OD1 3.16Å
561	R	68.3	Low	66.5	Low	159 Å²	159	66 Å²	66	60%	0.6	31%	0.308	S	S	*	.	H	α-helix	trans	-59	-24.2	173.4	-69	178.8	-157.9	142	-0.3	114.4	T557 V559 K565	T557-R561 WeakPolarHBondContact O-CG 3.28Å; T557-R561 PolarHBondContact O-N 3.06Å; V559-R561 VanDerWaalsContact C-N 3.33Å; V559-R561 PolarHBondContact O-N 3.11Å; R561-K565 WeakPolarHBondContact O-CG 3.33Å
562	L	65.9	Low	66.7	Low	18 Å²	18	67.5 Å²	67.5	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-85.5	-37.8	172.3	-67.5	167.8	0	0	0	111.6	S558 V559 I560 K565 C566 M817 F818 L825	S558-L562 WeakPolarHBondContact O-CG 3.29Å; S558-L562 PolarHBondContact O-N 2.99Å; V559-L562 CarbonylContact O-C 3.58Å; V559-L562 WeakPolarHBondContact O-CA 3.32Å; V559-L562 WeakPolarHBondContact O-CB 3.41Å; V559-L562 PolarHBondContact O-N 2.97Å; I560-L562 PolarHBondContact O-N 3.13Å; I560-L562 VanDerWaalsContact O-N 3.11Å; L562-K565 PolarHBondContact O-N 2.66Å; L562-C566 PolarHBondContact O-N 2.88Å; L562-C566 PolarHBondContact O-SG 3.06Å; L562-M817 HydrophobicContact CD2-CB 4.42Å; L562-M817 WeakPolarHBondContact CD2-O 3.35Å; L562-F818 HydrophobicContact CD1-CD1 4.13Å; L562-F818 HydrophobicContact CD1-CE1 4.09Å; L562-L825 HydrophobicContact CD1-CD1 4.24Å
563	L	63.6	Low	66.8	Low	33 Å²	33	67.1 Å²	67.1	17%	0.173	31%	0.311	C	S	.	.	H	α-helix	trans	-55	-58.7	173.4	-52.2	-175.7	0	0	0	109.8	V559 I560 K565 C566 E567 L865	V559-L563 HydrophobicContact CG1-CD1 4.35Å; V559-L563 HydrophobicContact CG1-CD2 3.85Å; V559-L563 HydrophobicContact CG1-CG 4.02Å; V559-L563 WeakPolarHBondContact O-CG 3.49Å; V559-L563 PolarHBondContact O-N 3.38Å; I560-L563 HydrophobicContact CG1-CD1 4.37Å; I560-L563 WeakPolarHBondContact O-CB 3.28Å; I560-L563 PolarHBondContact O-N 2.83Å; L563-K565 PolarHBondContact O-N 2.78Å; L563-C566 WeakPolarHBondContact O-CB 3.33Å; L563-C566 PolarHBondContact O-N 3.49Å; L563-E567 WeakPolarHBondContact O-CB 3.49Å; L563-E567 PolarHBondContact O-N 2.97Å; L563-L865 HydrophobicContact CB-CD2 4.3Å; L563-L865 HydrophobicContact CD2-CD1 3.53Å; L563-L865 HydrophobicContact CD2-CD2 3.6Å; L563-L865 HydrophobicContact CD2-CG 3.92Å
564	N	68.4	Low	66.7	Low	71 Å²	71	68 Å²	68	38%	0.38	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-10.2	-178.3	-57.4	44.3	0	0	0	113.4	I560 R568	I560-N564 WeakPolarHBondContact CG2-OD1 3.31Å; I560-N564 PolarHBondContact O-N 3.3Å; I560-N564 PolarHBondContact O-OD1 3.16Å; N564-R568 WeakPolarHBondContact O-CD 3.31Å; N564-R568 WeakPolarHBondContact O-CG 3.32Å; N564-R568 PolarHBondContact O-NE 2.94Å
565	K	71.4	Confident	66.8	Low	132 Å²	132	65.1 Å²	65.1	57%	0.574	32%	0.315	S	S	*	.	H	α-helix	trans	-91.6	-40.2	169.5	-87.9	-166.1	170.4	-160.3	0	112.6	R561 L562 L563 E567 L569 M817	R561-K565 WeakPolarHBondContact O-CG 3.33Å; L562-K565 PolarHBondContact O-N 2.66Å; L563-K565 PolarHBondContact O-N 2.78Å; K565-E567 VanDerWaalsContact C-N 3.33Å; K565-L569 WeakPolarHBondContact O-CG 3.43Å; K565-L569 PolarHBondContact O-N 3.45Å; K565-M817 HydrophobicContact CB-CE 3.9Å
566	C	66.5	Low	67	Low	3 Å²	3	67.6 Å²	67.6	2%	0.02	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-46	170.5	-69.7	0	0	0	0	110.3	L562 L563 R568 L569 T570 M817 L865 F869	L562-C566 PolarHBondContact O-N 2.88Å; L562-C566 PolarHBondContact O-SG 3.06Å; L563-C566 WeakPolarHBondContact O-CB 3.33Å; L563-C566 PolarHBondContact O-N 3.49Å; C566-R568 PolarHBondContact O-N 3.18Å; C566-L569 CarbonylContact O-C 3.54Å; C566-L569 WeakPolarHBondContact O-CA 3.31Å; C566-L569 WeakPolarHBondContact O-CB 3.38Å; C566-L569 PolarHBondContact O-N 2.91Å; C566-T570 PolarHBondContact O-N 2.61Å; C566-T570 PolarHBondContact O-OG1 3.28Å; C566-M817 WeakPolarHBondContact SG-CE 3.24Å; C566-L865 HydrophobicContact CB-CD2 3.63Å; C566-F869 HydrophobicContact CB-CE2 4.28Å
567	E	68.1	Low	66.9	Low	91 Å²	91	63.9 Å²	63.9	43%	0.425	32%	0.319	S	S	.	.	H	α-helix	trans	-55	-47.2	179.9	-171.4	168.2	-128.5	0	0	112.6	L563 K565 L569 T570 E571	L563-E567 WeakPolarHBondContact O-CB 3.49Å; L563-E567 PolarHBondContact O-N 2.97Å; K565-E567 VanDerWaalsContact C-N 3.33Å; E567-L569 VanDerWaalsContact C-N 3.3Å; E567-L569 PolarHBondContact O-N 3.46Å; E567-T570 CarbonylContact O-C 3.58Å; E567-T570 WeakPolarHBondContact O-CA 3.46Å; E567-T570 WeakPolarHBondContact O-CB 3.38Å; E567-T570 PolarHBondContact O-N 3.23Å; E567-E571 WeakPolarHBondContact O-CG 3.32Å; E567-E571 PolarHBondContact O-N 3.35Å
568	R	74.1	Confident	66.6	Low	167 Å²	167	64.7 Å²	64.7	63%	0.63	32%	0.323	S	S	*	.	H	α-helix	trans	-62.1	-35	174.4	-69.4	172.1	-172.3	-164.1	-0.6	113.6	N564 C566 E571 Q572	N564-R568 WeakPolarHBondContact O-CD 3.31Å; N564-R568 WeakPolarHBondContact O-CG 3.32Å; N564-R568 PolarHBondContact O-NE 2.94Å; C566-R568 PolarHBondContact O-N 3.18Å; R568-E571 WeakPolarHBondContact CA-OE2 3.08Å; R568-Q572 WeakPolarHBondContact O-CB 3.36Å; R568-Q572 VanDerWaalsContact O-CG 3.25Å; R568-Q572 WeakPolarHBondContact O-CG 3.45Å; R568-Q572 PolarHBondContact O-N 3.39Å; R568-Q572 PolarHBondContact O-OE1 2.94Å
569	L	72.1	Confident	66.2	Low	48 Å²	48	71 Å²	71	25%	0.251	35%	0.345	S	S	.	.	H	α-helix	trans	-71	-34.2	172.6	-65.1	167.4	0	0	0	111	K565 C566 E567 V573 M817 F869	K565-L569 WeakPolarHBondContact O-CG 3.43Å; K565-L569 PolarHBondContact O-N 3.45Å; C566-L569 CarbonylContact O-C 3.54Å; C566-L569 WeakPolarHBondContact O-CA 3.31Å; C566-L569 WeakPolarHBondContact O-CB 3.38Å; C566-L569 PolarHBondContact O-N 2.91Å; E567-L569 VanDerWaalsContact C-N 3.3Å; E567-L569 PolarHBondContact O-N 3.46Å; L569-V573 WeakPolarHBondContact O-CB 3.42Å; L569-V573 VanDerWaalsContact O-CG2 3.31Å; L569-V573 WeakPolarHBondContact O-CG2 3.49Å; L569-V573 PolarHBondContact O-N 3.08Å; L569-M817 HydrophobicContact CD1-CE 4.07Å; L569-M817 HydrophobicContact CD1-SD 3.9Å; L569-F869 HydrophobicContact CB-CE1 4.48Å; L569-F869 HydrophobicContact CB-CZ 4.11Å; L569-F869 HydrophobicContact CD1-CZ 4.31Å
570	T	66	Low	65.9	Low	40 Å²	40	71.4 Å²	71.4	25%	0.245	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-51.1	170.4	-45.7	0	0	0	0	110.6	C566 E567 Q572 V573 A574 P868	C566-T570 PolarHBondContact O-N 2.61Å; C566-T570 PolarHBondContact O-OG1 3.28Å; E567-T570 CarbonylContact O-C 3.58Å; E567-T570 WeakPolarHBondContact O-CA 3.46Å; E567-T570 WeakPolarHBondContact O-CB 3.38Å; E567-T570 PolarHBondContact O-N 3.23Å; T570-Q572 VanDerWaalsContact C-N 3.33Å; T570-Q572 PolarHBondContact O-N 3.22Å; T570-V573 PolarHBondContact O-N 2.99Å; T570-A574 WeakPolarHBondContact O-CB 3.22Å; T570-A574 PolarHBondContact O-N 3.4Å; T570-P868 HydrophobicContact CG2-CB 4.1Å; T570-P868 HydrophobicContact CG2-CG 4.01Å; T570-P868 WeakPolarHBondContact OG1-CG 3.23Å
571	E	70.4	Confident	65.3	Low	105 Å²	105	70.6 Å²	70.6	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-41.1	179.6	-68.5	169	153.2	0	0	111.8	E567 R568 S575	E567-E571 WeakPolarHBondContact O-CG 3.32Å; E567-E571 PolarHBondContact O-N 3.35Å; R568-E571 WeakPolarHBondContact CA-OE2 3.08Å; E571-S575 VanDerWaalsContact O-CB 3.26Å; E571-S575 WeakPolarHBondContact O-CB 3.47Å; E571-S575 PolarHBondContact O-N 2.91Å; E571-S575 PolarHBondContact O-OG 2.86Å
572	Q	70.5	Confident	64	Low	105 Å²	105	68.6 Å²	68.6	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-53.2	175.2	-74.5	174.1	-42.4	0	0	111.8	R568 T570 A574 S575 H576	R568-Q572 WeakPolarHBondContact O-CB 3.36Å; R568-Q572 VanDerWaalsContact O-CG 3.25Å; R568-Q572 WeakPolarHBondContact O-CG 3.45Å; R568-Q572 PolarHBondContact O-N 3.39Å; R568-Q572 PolarHBondContact O-OE1 2.94Å; T570-Q572 VanDerWaalsContact C-N 3.33Å; T570-Q572 PolarHBondContact O-N 3.22Å; Q572-A574 VanDerWaalsContact C-N 3.32Å; Q572-A574 PolarHBondContact O-N 2.92Å; Q572-S575 PolarHBondContact O-N 2.86Å; Q572-S575 PolarHBondContact O-OG 2.79Å; Q572-H576 WeakPolarHBondContact O-CB 3.08Å; Q572-H576 PolarHBondContact O-CD2 2.8Å; Q572-H576 PolarHBondContact O-N 3.3Å
573	V	67.2	Low	62.6	Low	9 Å²	9	73.8 Å²	73.8	6%	0.055	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-39	178.7	173.5	0	0	0	0	111.6	L569 T570 A577 L647 L648 E651 V653	L569-V573 WeakPolarHBondContact O-CB 3.42Å; L569-V573 VanDerWaalsContact O-CG2 3.31Å; L569-V573 WeakPolarHBondContact O-CG2 3.49Å; L569-V573 PolarHBondContact O-N 3.08Å; T570-V573 PolarHBondContact O-N 2.99Å; V573-A577 WeakPolarHBondContact O-CB 3.4Å; V573-A577 PolarHBondContact O-N 3.32Å; V573-L647 HydrophobicContact CG1-CD2 3.97Å; V573-L647 HydrophobicContact CG1-CG 4.42Å; V573-L648 HydrophobicContact CG1-CD2 4.27Å; V573-L648 HydrophobicContact CG2-CD2 4.48Å; V573-E651 HydrophobicContact CG2-CB 4.2Å; V573-E651 HydrophobicContact CG2-CG 4.19Å; V573-V653 HydrophobicContact CG2-CG2 4.21Å
574	A	65.8	Low	61.4	Low	47 Å²	47	75.8 Å²	75.8	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-69.7	-48	179.1	0	0	0	0	0	112.3	T570 Q572 H576 A577 T578	T570-A574 WeakPolarHBondContact O-CB 3.22Å; T570-A574 PolarHBondContact O-N 3.4Å; Q572-A574 VanDerWaalsContact C-N 3.32Å; Q572-A574 PolarHBondContact O-N 2.92Å; A574-H576 VanDerWaalsContact C-N 3.28Å; A574-H576 PolarHBondContact O-N 3.44Å; A574-A577 WeakPolarHBondContact O-CB 3.19Å; A574-A577 PolarHBondContact O-N 3.42Å; A574-A577 VanDerWaalsContact O-N 3.1Å; A574-T578 PolarHBondContact O-N 2.64Å; A574-T578 PolarHBondContact O-OG1 3.06Å; A574-T578 VanDerWaalsContact O-OG1 3.07Å
575	S	67.9	Low	59.8	Low	52 Å²	52	77.5 Å²	77.5	36%	0.364	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-33.2	177.8	57.4	0	0	0	0	112.6	E571 Q572 R579	E571-S575 VanDerWaalsContact O-CB 3.26Å; E571-S575 WeakPolarHBondContact O-CB 3.47Å; E571-S575 PolarHBondContact O-N 2.91Å; E571-S575 PolarHBondContact O-OG 2.86Å; Q572-S575 PolarHBondContact O-N 2.86Å; Q572-S575 PolarHBondContact O-OG 2.79Å; S575-R579 WeakPolarHBondContact O-CB 3.37Å; S575-R579 WeakPolarHBondContact O-CD 3.36Å; S575-R579 VanDerWaalsContact O-CG 3.26Å; S575-R579 WeakPolarHBondContact O-CG 3.35Å; S575-R579 PolarHBondContact O-N 3Å; S575-R579 VanDerWaalsContact O-N 3.09Å
576	H	64.3	Low	57.9	Low	61 Å²	61	78.6 Å²	78.6	28%	0.282	40%	0.402	S	S	.	.	H	α-helix	trans	-69.7	-39.8	170.3	-82.1	-130	0	0	0	112	Q572 A574 R579 L580 L647 E651	Q572-H576 WeakPolarHBondContact O-CB 3.08Å; Q572-H576 PolarHBondContact O-CD2 2.8Å; Q572-H576 PolarHBondContact O-N 3.3Å; A574-H576 VanDerWaalsContact C-N 3.28Å; A574-H576 PolarHBondContact O-N 3.44Å; H576-R579 PolarHBondContact O-N 2.99Å; H576-L580 VanDerWaalsContact O-CG 3.28Å; H576-L580 WeakPolarHBondContact O-CG 3.25Å; H576-L580 PolarHBondContact O-N 3.11Å; H576-L580 VanDerWaalsContact O-N 3.11Å; H576-L647 HydrophobicContact CB-CD1 4.15Å; H576-E651 IonicContact CE1-OE1 3.65Å; H576-E651 IonicContact CE1-OE2 3.99Å; H576-E651 IonicContact CG-OE1 3.55Å; H576-E651 IonicContact ND1-OE1 2.82Å; H576-E651 PolarHBondContact ND1-OE1 3.07Å; H576-E651 IonicContact ND1-OE2 3.67Å
577	A	60.9	Low	56.1	Low	30 Å²	30	85.8 Å²	85.8	25%	0.248	44%	0.439	C	S	.	.	H	α-helix	trans	-60.5	-46.5	173.1	0	0	0	0	0	112.3	V573 A574 L580 L581 L647	V573-A577 WeakPolarHBondContact O-CB 3.4Å; V573-A577 PolarHBondContact O-N 3.32Å; A574-A577 WeakPolarHBondContact O-CB 3.19Å; A574-A577 PolarHBondContact O-N 3.42Å; A574-A577 VanDerWaalsContact O-N 3.1Å; A577-L580 PolarHBondContact O-N 3.19Å; A577-L581 WeakPolarHBondContact O-CG 3.25Å; A577-L581 PolarHBondContact O-N 3.4Å; A577-L647 HydrophobicContact CB-CD2 3.82Å
578	T	59.3	Low	54.3	Low	69 Å²	69	86.8 Å²	86.8	42%	0.423	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-47	178.3	-50.5	0	0	0	0	111.2	A574 L580 L581 E582	A574-T578 PolarHBondContact O-N 2.64Å; A574-T578 PolarHBondContact O-OG1 3.06Å; A574-T578 VanDerWaalsContact O-OG1 3.07Å; T578-L580 PolarHBondContact O-N 3.16Å; T578-L581 WeakPolarHBondContact O-CA 3.43Å; T578-L581 PolarHBondContact O-N 3.13Å; T578-E582 HydrophobicContact CG2-CG 4.14Å; T578-E582 WeakPolarHBondContact O-CG 3.21Å; T578-E582 PolarHBondContact O-N 3.19Å
579	R	56.3	Low	52.1	Low	145 Å²	145	86.4 Å²	86.4	55%	0.547	46%	0.459	S	S	.	.	H	α-helix	trans	-59.5	-31.7	176.5	-76.5	170.7	173.2	174.9	-3	113.7	S575 H576 L581 N583	S575-R579 WeakPolarHBondContact O-CB 3.37Å; S575-R579 WeakPolarHBondContact O-CD 3.36Å; S575-R579 VanDerWaalsContact O-CG 3.26Å; S575-R579 WeakPolarHBondContact O-CG 3.35Å; S575-R579 PolarHBondContact O-N 3Å; S575-R579 VanDerWaalsContact O-N 3.09Å; H576-R579 PolarHBondContact O-N 2.99Å; R579-L581 VanDerWaalsContact C-N 3.27Å; R579-N583 PolarHBondContact O-ND2 3.16Å
580	L	53.4	Low	49.9	Very low	39 Å²	39	91.5 Å²	91.5	20%	0.204	49%	0.486	C	S	.	.	H	α-helix	trans	-74.1	-19.8	175.5	-67.8	173.2	0	0	0	112.9	H576 A577 T578 V618 L620 L647	H576-L580 VanDerWaalsContact O-CG 3.28Å; H576-L580 WeakPolarHBondContact O-CG 3.25Å; H576-L580 PolarHBondContact O-N 3.11Å; H576-L580 VanDerWaalsContact O-N 3.11Å; A577-L580 PolarHBondContact O-N 3.19Å; T578-L580 PolarHBondContact O-N 3.16Å; L580-V618 HydrophobicContact CD1-CB 3.77Å; L580-V618 HydrophobicContact CD1-CG1 3.97Å; L580-V618 HydrophobicContact CD2-CB 3.95Å; L580-V618 WeakPolarHBondContact CD2-O 3.02Å; L580-L620 HydrophobicContact CB-CD1 4.22Å; L580-L620 HydrophobicContact CB-CD2 4.44Å; L580-L620 HydrophobicContact CB-CG 4.35Å; L580-L620 VanDerWaalsContact O-CD1 3.28Å; L580-L620 WeakPolarHBondContact O-CD1 3.44Å; L580-L647 HydrophobicContact CD1-CD1 4.03Å
581	L	50.2	Low	48.2	Very low	58 Å²	58	94 Å²	94	30%	0.304	51%	0.512	S	S	.	.	H	α-helix	trans	-95.9	-37.6	179.5	-63.9	170.7	0	0	0	112.8	L66 A577 T578 R579 N583 T584 L620	L66-L581 HydrophobicContact CD2-CD1 3.72Å; L66-L581 HydrophobicContact CD2-CD2 3.42Å; L66-L581 VanDerWaalsContact CD2-CD2 3.42Å; L66-L581 HydrophobicContact CD2-CG 4.18Å; A577-L581 WeakPolarHBondContact O-CG 3.25Å; A577-L581 PolarHBondContact O-N 3.4Å; T578-L581 WeakPolarHBondContact O-CA 3.43Å; T578-L581 PolarHBondContact O-N 3.13Å; R579-L581 VanDerWaalsContact C-N 3.27Å; L581-N583 PolarHBondContact O-N 2.93Å; L581-T584 WeakPolarHBondContact CA-OG1 3.2Å; L581-T584 PolarHBondContact O-N 3.42Å; L581-T584 PolarHBondContact O-OG1 2.89Å; L581-L620 HydrophobicContact CD2-CD1 4.05Å
582	E	41.8	Very low	46.3	Very low	117 Å²	117	96.9 Å²	96.9	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-54.4	-41.1	171.6	-71.2	167.2	158	0	0	110.9	T578 T584	T578-E582 HydrophobicContact CG2-CG 4.14Å; T578-E582 WeakPolarHBondContact O-CG 3.21Å; T578-E582 PolarHBondContact O-N 3.19Å; E582-T584 PolarHBondContact O-N 3.36Å; E582-T584 VanDerWaalsContact O-N 3.14Å
583	N	35.6	Very low	44.3	Very low	128 Å²	128	98.5 Å²	98.5	68%	0.684	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	12.3	176.1	-71.2	-69.4	0	0	0	114.9	R579 L581	R579-N583 PolarHBondContact O-ND2 3.16Å; L581-N583 PolarHBondContact O-N 2.93Å
584	T	39.1	Very low	42.7	Very low	75 Å²	75	106 Å²	106	46%	0.46	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.2	7.2	176.3	49.9	0	0	0	0	114.6	L581 E582 L620	L581-T584 WeakPolarHBondContact CA-OG1 3.2Å; L581-T584 PolarHBondContact O-N 3.42Å; L581-T584 PolarHBondContact O-OG1 2.89Å; E582-T584 PolarHBondContact O-N 3.36Å; E582-T584 VanDerWaalsContact O-N 3.14Å; T584-L620 HydrophobicContact CG2-CD1 4.1Å
585	I	34.3	Very low	41	Very low	106 Å²	106	111.4 Å²	111.4	54%	0.544	60%	0.602	S	S	.	*	S	Bend	trans	-96.5	-19	-174.3	-68.1	169.7	0	0	0	112.8	L587	I585-L587 PolarHBondContact O-N 3.08Å
586	D	31.3	Very low	39.2	Very low	155 Å²	155	114.5 Å²	114.5	83%	0.829	62%	0.615	S	S	*	*			trans	-88.5	77.7	175	-71.2	-40.1	0	0	0	112.4
587	L	29.5	Very low	37.5	Very low	154 Å²	154	119.8 Å²	119.8	81%	0.806	64%	0.64	S	S	*	*			trans	-131.3	110.3	166.2	-82.2	171.9	0	0	0	110.3	I585	I585-L587 PolarHBondContact O-N 3.08Å
588	P	29.7	Very low	36.2	Very low	112 Å²	112	124 Å²	124	73%	0.727	67%	0.668	S	S	*	*			trans	-76.1	127	-176.6	29	-33.4	0	0	0	112.2	N590	P588-N590 PolarHBondContact O-N 3.2Å
589	E	27.8	Very low	34.7	Very low	159 Å²	159	129 Å²	129	74%	0.743	69%	0.692	S	S	*	*	S	Bend	trans	-76.9	23.3	-169.6	-154.5	167.3	-145.4	0	0	115
590	N	26.5	Very low	33.5	Very low	155 Å²	155	125.8 Å²	125.8	83%	0.829	70%	0.703	S	S	*	*			trans	-140.1	84.5	-172.6	-76.1	-77.9	0	0	0	112.2	P588	P588-N590 PolarHBondContact O-N 3.2Å
591	A	30.3	Very low	32.2	Very low	94 Å²	94	131.1 Å²	131.1	78%	0.777	74%	0.737	S	S	*	*			trans	-153.4	4	-179.7	0	0	0	0	0	117.8
592	I	31	Very low	31.2	Very low	165 Å²	165	134.7 Å²	134.7	85%	0.846	76%	0.761	S	S	*	*			trans	-133.3	69.1	178.9	-46.4	-178.1	0	0	0	111.6
593	T	28.9	Very low	30.6	Very low	138 Å²	138	136.2 Å²	136.2	85%	0.847	77%	0.773	S	S	*	*			trans	-151.9	74.6	161.3	-16.4	0	0	0	0	111.2
594	D	32.5	Very low	30.2	Very low	166 Å²	166	139.5 Å²	139.5	89%	0.888	78%	0.784	S	S	*	*			trans	-170.3	168.1	131.8	-114.4	-33.9	0	0	0	112.9
595	Q	29.4	Very low	29.8	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.752	80%	0.802	S	S	*	*			trans	-108.9	166.1	-169	-59.2	177.1	-0.8	0	0	114
596	N	30	Very low	29.6	Very low	118 Å²	118	147.3 Å²	147.3	63%	0.631	82%	0.818	S	S	*	*			trans	88.8	120.1	154.2	-63.3	-66.9	0	0	0	121
597	Q	30.6	Very low	29.6	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	80%	0.801	S	S	*	*			trans	67.5	100.8	131.5	-61.3	167.4	41.7	0	0	120.7
598	S	32.2	Very low	29.6	Very low	120 Å²	120	142.8 Å²	142.8	84%	0.839	80%	0.798	S	S	*	*				-169.8	147.8	118	59.5	0	0	0	0	111.9
599	D	28.3	Very low	29.6	Very low	174 Å²	174	142.4 Å²	142.4	93%	0.93	79%	0.794	S	S	*	*			trans	-70.4	143.1	-177.1	-53.3	-89.4	0	0	0	114.8
600	G	30.9	Very low	29.7	Very low	76 Å²	76	140.5 Å²	140.5	78%	0.784	79%	0.788	S	S	*	*			trans	-175.8	117.6	171.1	0	0	0	0	0	114.1
601	V	26.7	Very low	29.9	Very low	152 Å²	152	138.7 Å²	138.7	92%	0.921	78%	0.778	S	S	*	*			trans	-89.5	111.3	-175.2	177.4	0	0	0	0	112.4
602	V	28.1	Very low	29.9	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	78%	0.782	S	S	*	*			trans	-149.9	155.3	159.2	-175.4	0	0	0	0	109.7
603	D	28.9	Very low	29.9	Very low	149 Å²	149	140 Å²	140	80%	0.797	78%	0.776	S	S	*	*			trans	-45.7	138.1	-177.1	-69.3	-59.8	0	0	0	117.6
604	E	27.5	Very low	29.9	Very low	196 Å²	196	141.8 Å²	141.8	92%	0.916	78%	0.78	S	S	*	*			trans	-88.5	102.8	162.3	-70.8	-171.6	143.7	0	0	111
605	H	32.1	Very low	29.9	Very low	181 Å²	181	136.7 Å²	136.7	84%	0.838	77%	0.767	S	S	*	*			trans	-148.5	37.3	175.1	-125.8	-36	0	0	0	114.8	G607	H605-G607 PolarHBondContact O-N 3.37Å
606	D	29.5	Very low	30	Very low	164 Å²	164	139 Å²	139	88%	0.877	77%	0.771	S	S	*	*			trans	-92.6	73.6	-172.5	-137.8	-21.9	0	0	0	114.3
607	G	30.3	Very low	30.5	Very low	46 Å²	46	137.9 Å²	137.9	47%	0.474	77%	0.77	S	S	.	*			trans	-90.8	110.2	162.5	0	0	0	0	0	109.8	H605 T609	H605-G607 PolarHBondContact O-N 3.37Å; G607-T609 WeakPolarHBondContact O-CB 3.31Å; G607-T609 PolarHBondContact O-N 2.94Å; G607-T609 PolarHBondContact O-OG1 3.41Å
608	F	30.5	Very low	31.3	Very low	169 Å²	169	130.6 Å²	130.6	74%	0.741	74%	0.737	S	S	*	*			trans	-51.8	99.2	-171.9	-164.9	-105	0	0	0	113.4	I610	F608-I610 HydrophobicContact CD1-CG1 4.29Å; F608-I610 HydrophobicContact CE1-CD1 3.94Å; F608-I610 HydrophobicContact CE1-CG1 3.88Å
609	T	28.9	Very low	32.2	Very low	103 Å²	103	130.9 Å²	130.9	63%	0.632	73%	0.725	S	S	*	*			trans	-115.8	87.5	-169.1	-59.5	0	0	0	0	111.6	G607 N611	G607-T609 WeakPolarHBondContact O-CB 3.31Å; G607-T609 PolarHBondContact O-N 2.94Å; G607-T609 PolarHBondContact O-OG1 3.41Å; T609-N611 WeakPolarHBondContact CG2-ND2 3.33Å; T609-N611 PolarHBondContact O-N 3.42Å; T609-N611 PolarHBondContact O-ND2 3.4Å
610	I	31	Very low	33.6	Very low	120 Å²	120	125 Å²	125	62%	0.615	69%	0.693	S	S	*	*			trans	-65.4	123.2	170.1	-56	179.4	0	0	0	109.2	F608	F608-I610 HydrophobicContact CD1-CG1 4.29Å; F608-I610 HydrophobicContact CE1-CD1 3.94Å; F608-I610 HydrophobicContact CE1-CG1 3.88Å
611	N	30.3	Very low	35	Very low	117 Å²	117	122.1 Å²	122.1	63%	0.626	66%	0.66	S	S	*	*			trans	-113.5	131	-172.1	-100.2	-68.4	0	0	0	112.8	T609	T609-N611 WeakPolarHBondContact CG2-ND2 3.33Å; T609-N611 PolarHBondContact O-N 3.42Å; T609-N611 PolarHBondContact O-ND2 3.4Å
612	K	30.3	Very low	36.5	Very low	199 Å²	199	120.6 Å²	120.6	87%	0.865	65%	0.651	S	S	*	*			trans	75.9	140.4	171.6	-51.7	158.4	-173.7	169.9	0	114.2
613	A	30.9	Very low	38.2	Very low	86 Å²	86	122.1 Å²	122.1	71%	0.711	65%	0.65	S	S	*	*	S	Bend	cis	-137.9	154.6	4.1	0	0	0	0	0	112.7
614	N	29	Very low	40.6	Very low	176 Å²	176	117.3 Å²	117.3	94%	0.941	62%	0.623	S	S	*	*	S	Bend	trans	59	52.5	168.7	-64.1	-7.4	0	0	0	117.7
615	G	32	Very low	43.1	Very low	60 Å²	60	108.2 Å²	108.2	62%	0.619	58%	0.58	S	S	*	*	S	Bend	trans	167.3	138.1	165.8	0	0	0	0	0	110.6
616	Y	32	Very low	45.3	Very low	209 Å²	209	104 Å²	104	82%	0.82	58%	0.578	S	S	*	*			trans	-73.5	125.3	173.1	-69.1	-88.4	0	0	0	108.3	V618	Y616-V618 PolarHBondContact O-N 3Å
617	P	39.8	Very low	47.8	Very low	95 Å²	95	96.9 Å²	96.9	62%	0.617	54%	0.539	S	S	*	.			trans	-62.5	128.8	-177.3	24	-32.8	0	0	0	110.7	Q619	P617-Q619 PolarHBondContact O-N 3.25Å
618	V	48.6	Very low	50.3	Low	17 Å²	17	94.9 Å²	94.9	10%	0.103	52%	0.517	C	S	.	.			trans	-77.8	72	171.6	-172.6	0	0	0	0	108.2	L580 Y616 L620 R646 H650	L580-V618 HydrophobicContact CD1-CB 3.77Å; L580-V618 HydrophobicContact CD1-CG1 3.97Å; L580-V618 HydrophobicContact CD2-CB 3.95Å; L580-V618 WeakPolarHBondContact CD2-O 3.02Å; Y616-V618 PolarHBondContact O-N 3Å; V618-L620 PolarHBondContact O-N 2.98Å; V618-R646 HydrophobicContact CG1-CG 4.09Å; V618-H650 HydrophobicContact CG2-CB 3.62Å; V618-H650 VanDerWaalsContact CG2-CD2 3.46Å; V618-H650 WeakPolarHBondContact CG2-CD2 3.41Å
619	Q	51.7	Low	52.8	Low	126 Å²	126	88.8 Å²	88.8	59%	0.589	49%	0.493	S	S	*	.			trans	-49.9	115.8	176.5	-166.3	179.4	28.2	0	0	109.5	P617 V621 R646	P617-Q619 PolarHBondContact O-N 3.25Å; Q619-V621 PolarHBondContact O-N 2.68Å; Q619-R646 PolarHBondContact O-NE 2.92Å; Q619-R646 PolarHBondContact O-NH1 3.41Å; Q619-R646 PolarHBondContact O-NH2 2.76Å
620	L	56.8	Low	55.1	Low	51 Å²	51	89.1 Å²	89.1	27%	0.267	50%	0.496	S	S	.	.			trans	-65.5	130.7	179.2	-73.1	174.6	0	0	0	109.1	L580 L581 T584 V618 T622 N643	L580-L620 HydrophobicContact CB-CD1 4.22Å; L580-L620 HydrophobicContact CB-CD2 4.44Å; L580-L620 HydrophobicContact CB-CG 4.35Å; L580-L620 VanDerWaalsContact O-CD1 3.28Å; L580-L620 WeakPolarHBondContact O-CD1 3.44Å; L581-L620 HydrophobicContact CD2-CD1 4.05Å; T584-L620 HydrophobicContact CG2-CD1 4.1Å; V618-L620 PolarHBondContact O-N 2.98Å; L620-T622 PolarHBondContact O-N 3.01Å; L620-T622 VanDerWaalsContact O-N 3.16Å; L620-N643 HydrophobicContact CD2-CB 4.3Å
621	V	59.6	Low	57.3	Low	15 Å²	15	91 Å²	91	9%	0.091	51%	0.507	C	S	.	.			trans	-83.4	93.3	-176.2	-177.1	0	0	0	0	107.8	Q619 Q623 L642 N643	Q619-V621 PolarHBondContact O-N 2.68Å; V621-Q623 WeakPolarHBondContact CG1-O 3.25Å; V621-L642 HydrophobicContact CB-CD2 4.49Å; V621-L642 HydrophobicContact CG1-CD2 3.9Å; V621-N643 WeakPolarHBondContact CA-OD1 3.35Å; V621-N643 VanDerWaalsContact CB-OD1 3.23Å; V621-N643 WeakPolarHBondContact CB-OD1 3.31Å; V621-N643 PolarHBondContact N-OD1 3.14Å; V621-N643 PolarHBondContact O-ND2 3.06Å
622	T	58.7	Low	59.7	Low	120 Å²	120	89.3 Å²	89.3	74%	0.736	49%	0.492	S	S	*	.	S	Bend	trans	-77.9	-43.8	173.2	50.9	0	0	0	0	111.2	L620	L620-T622 PolarHBondContact O-N 3.01Å; L620-T622 VanDerWaalsContact O-N 3.16Å
623	Q	63.3	Low	62.3	Low	165 Å²	165	87.7 Å²	87.7	77%	0.771	49%	0.487	S	S	*	.	S	Bend	trans	-101	145.5	174.8	-60.8	-177.6	3.8	0	0	110.9	V621	V621-Q623 WeakPolarHBondContact CG1-O 3.25Å
624	Q	80	Confident	64.8	Low	48 Å²	48	84.2 Å²	84.2	22%	0.224	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-64	150.6	-177.5	68.3	-178.9	15.3	0	0	113.4	A626 L628 R632 L634 L639	Q624-A626 PolarHBondContact O-N 2.65Å; Q624-L628 HydrophobicContact CB-CD1 4.35Å; Q624-R632 PolarHBondContact NE2-O 2.97Å; Q624-R632 PolarHBondContact OE1-O 3.13Å; Q624-L634 HydrophobicContact CB-CD1 3.81Å; Q624-L634 HydrophobicContact CB-CG 4.15Å; Q624-L639 HydrophobicContact CB-CD2 4.26Å
625	P	79.2	Confident	67.4	Low	5 Å²	5	79.1 Å²	79.1	3%	0.032	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-47.8	125.3	175.1	-32	37.4	0	0	0	113	I627 L628 L642 A674 E678	P625-I627 HydrophobicContact CB-CG2 4.48Å; P625-I627 PolarHBondContact O-N 3.08Å; P625-L628 HydrophobicContact CB-CD1 4.18Å; P625-L628 HydrophobicContact CB-CG 4.17Å; P625-L628 HydrophobicContact CG-CD1 4.26Å; P625-L628 VanDerWaalsContact O-CB 3.27Å; P625-L628 WeakPolarHBondContact O-CB 3.44Å; P625-L628 PolarHBondContact O-N 2.8Å; P625-L642 HydrophobicContact CG-CD2 3.89Å; P625-A674 HydrophobicContact CB-CB 3.98Å; P625-A674 HydrophobicContact CG-CB 4.48Å; P625-E678 VanDerWaalsContact C-OE1 3.26Å; P625-E678 WeakPolarHBondContact CA-OE1 3.24Å; P625-E678 WeakPolarHBondContact CB-OE1 3.38Å; P625-E678 WeakPolarHBondContact CB-OE2 3.38Å
626	A	78.3	Confident	69.7	Low	94 Å²	94	80.7 Å²	80.7	78%	0.777	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.7	-173.8	0	0	0	0	0	114.1	Q624 L628 E678	Q624-A626 PolarHBondContact O-N 2.65Å; A626-L628 VanDerWaalsContact C-N 3.26Å; A626-E678 PolarHBondContact N-OE1 3.48Å
627	I	82.2	Confident	72	Confident	13 Å²	13	71.9 Å²	71.9	7%	0.067	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.3	171	-164.4	168.8	0	0	0	113.6	P625 A674 W677 E678 H707	P625-I627 HydrophobicContact CB-CG2 4.48Å; P625-I627 PolarHBondContact O-N 3.08Å; I627-A674 HydrophobicContact CG2-CB 3.43Å; I627-A674 VanDerWaalsContact CG2-CB 3.43Å; I627-W677 HydrophobicContact CD1-CD2 3.33Å; I627-W677 HydrophobicContact CD1-CE3 3.34Å; I627-W677 HydrophobicContact CD1-CG 3.93Å; I627-W677 HydrophobicContact CD1-CH2 3.9Å; I627-W677 HydrophobicContact CD1-CZ2 3.9Å; I627-W677 HydrophobicContact CD1-CZ3 3.63Å; I627-E678 HydrophobicContact CG2-CG 4.16Å; I627-E678 WeakPolarHBondContact CG2-OE1 3.39Å; I627-E678 PolarHBondContact N-OE1 3.41Å; I627-H707 HydrophobicContact CD1-CB 3.7Å; I627-H707 HydrophobicContact CG1-CB 3.75Å
628	L	83.7	Confident	74.2	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.021	36%	0.364	C	S	.	.	S	Bend	trans	-73.3	146.5	169.8	-64.3	173.9	0	0	0	110.6	Q624 P625 A626 P630 L634 I670 A671 A674 W704 C705	Q624-L628 HydrophobicContact CB-CD1 4.35Å; P625-L628 HydrophobicContact CB-CD1 4.18Å; P625-L628 HydrophobicContact CB-CG 4.17Å; P625-L628 HydrophobicContact CG-CD1 4.26Å; P625-L628 VanDerWaalsContact O-CB 3.27Å; P625-L628 WeakPolarHBondContact O-CB 3.44Å; P625-L628 PolarHBondContact O-N 2.8Å; A626-L628 VanDerWaalsContact C-N 3.26Å; L628-P630 WeakPolarHBondContact O-CD 3.41Å; L628-P630 VanDerWaalsContact O-N 3.14Å; L628-L634 HydrophobicContact CD1-CD1 3.94Å; L628-L634 HydrophobicContact CD1-CG 4.31Å; L628-I670 HydrophobicContact CD2-CG2 4.24Å; L628-A671 HydrophobicContact CD1-CB 3.9Å; L628-A674 HydrophobicContact CD2-CB 3.86Å; L628-A674 HydrophobicContact CG-CB 4.07Å; L628-W704 CarbonylContact C-O 3.59Å; L628-W704 VanDerWaalsContact CA-O 3.27Å; L628-W704 WeakPolarHBondContact CA-O 3.42Å; L628-W704 HydrophobicContact CD2-CB 4.4Å; L628-W704 WeakPolarHBondContact CD2-O 3.36Å; L628-C705 HydrophobicContact CD2-CB 4.19Å
629	N	83.1	Confident	75.9	Confident	42 Å²	42	68.6 Å²	68.6	23%	0.225	37%	0.367	C	S	.	.			trans	-55.7	114.2	178.3	-177.3	-11	0	0	0	111.1	L631 R632 L703 W704	N629-L631 PolarHBondContact O-N 3.09Å; N629-L631 WeakPolarHBondContact OD1-CB 3.11Å; N629-L631 PolarHBondContact OD1-N 3.48Å; N629-R632 PolarHBondContact O-N 2.98Å; N629-L703 WeakPolarHBondContact CB-O 3.37Å; N629-L703 PolarHBondContact ND2-O 3.19Å; N629-W704 PolarHBondContact N-O 2.98Å
630	P	76.9	Confident	77.3	Confident	109 Å²	109	64.3 Å²	64.3	71%	0.708	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.1	-175.2	-27.1	36.5	0	0	0	114.8	L628 R632	L628-P630 WeakPolarHBondContact O-CD 3.41Å; L628-P630 VanDerWaalsContact O-N 3.14Å; P630-R632 PolarHBondContact O-N 3.16Å; P630-R632 VanDerWaalsContact O-N 3.14Å
631	L	78.1	Confident	78.7	Confident	159 Å²	159	61.9 Å²	61.9	83%	0.832	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	8.4	175.9	-57.4	176.5	0	0	0	113.7	N629	N629-L631 PolarHBondContact O-N 3.09Å; N629-L631 WeakPolarHBondContact OD1-CB 3.11Å; N629-L631 PolarHBondContact OD1-N 3.48Å
632	R	80.7	Confident	80.1	Confident	83 Å²	83	61.1 Å²	61.1	31%	0.313	33%	0.332	S	S	.	.	S	Bend	trans	-143.9	124.7	-176.2	-61.7	-175.5	170.4	-123.3	-12	111	Q624 N629 P630 W704	Q624-R632 PolarHBondContact NE2-O 2.97Å; Q624-R632 PolarHBondContact OE1-O 3.13Å; N629-R632 PolarHBondContact O-N 2.98Å; P630-R632 PolarHBondContact O-N 3.16Å; P630-R632 VanDerWaalsContact O-N 3.14Å; R632-W704 HydrophobicContact CB-CD2 4.44Å; R632-W704 HydrophobicContact CB-CE3 3.83Å; R632-W704 HydrophobicContact CB-CH2 3.81Å; R632-W704 HydrophobicContact CB-CZ2 4.41Å; R632-W704 HydrophobicContact CB-CZ3 3.49Å; R632-W704 VanDerWaalsContact CB-CZ3 3.49Å
633	E	83.5	Confident	81.4	Confident	165 Å²	165	56.8 Å²	56.8	77%	0.771	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-102.7	141.7	-178.7	-66.3	173.8	174.2	0	0	112.4
634	L	84.4	Confident	82.4	Confident	13 Å²	13	51 Å²	51	7%	0.068	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-77.2	128.5	166.9	-63.2	178.9	0	0	0	110.3	Q624 L628 Q638 L639 L642 V667 A671 W704	Q624-L634 HydrophobicContact CB-CD1 3.81Å; Q624-L634 HydrophobicContact CB-CG 4.15Å; L628-L634 HydrophobicContact CD1-CD1 3.94Å; L628-L634 HydrophobicContact CD1-CG 4.31Å; L634-Q638 HydrophobicContact CB-CB 4.3Å; L634-L639 HydrophobicContact CB-CD2 3.92Å; L634-L639 HydrophobicContact CB-CG 4Å; L634-L639 HydrophobicContact CD1-CD2 3.75Å; L634-L639 HydrophobicContact CG-CD2 4.47Å; L634-L642 HydrophobicContact CD1-CD2 4.22Å; L634-V667 HydrophobicContact CD2-CG1 3.49Å; L634-V667 VanDerWaalsContact CD2-CG1 3.49Å; L634-A671 HydrophobicContact CD1-CB 3.72Å; L634-A671 HydrophobicContact CD2-CB 4.22Å; L634-W704 HydrophobicContact CD2-CH2 4.47Å; L634-W704 HydrophobicContact CD2-CZ3 4.01Å
635	K	83.1	Confident	82.8	Confident	69 Å²	69	48.9 Å²	48.9	30%	0.3	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-65	153.2	173.6	-69.7	-159.5	166.7	-149	0	110.7	Y637 Q638 L639 L879 Q881	K635-Y637 VanDerWaalsContact C-N 3.32Å; K635-Y637 HydrophobicContact CB-CD1 3.72Å; K635-Y637 HydrophobicContact CB-CE1 3.51Å; K635-Y637 HydrophobicContact CD-CE1 3.97Å; K635-Y637 HydrophobicContact CG-CE1 4.27Å; K635-Y637 PolarHBondContact O-N 3.45Å; K635-Y637 VanDerWaalsContact O-N 3.12Å; K635-Q638 HydrophobicContact CB-CG 4.28Å; K635-Q638 WeakPolarHBondContact O-CA 3.42Å; K635-Q638 VanDerWaalsContact O-CB 3.25Å; K635-Q638 WeakPolarHBondContact O-CB 3.18Å; K635-Q638 PolarHBondContact O-N 3.43Å; K635-L639 PolarHBondContact O-N 2.99Å; K635-L879 HydrophobicContact CD-CD2 4.33Å; K635-Q881 VanDerWaalsContact NZ-OE1 3.15Å
636	P	79.2	Confident	83.2	Confident	92 Å²	92	51 Å²	51	60%	0.597	27%	0.273	S	S	*	.	H	α-helix	trans	-51.9	-42.4	-174.4	-31.3	36.3	0	0	0	115.1	Q638 L639 V640	P636-Q638 VanDerWaalsContact C-N 3.25Å; P636-Q638 PolarHBondContact O-N 3.34Å; P636-L639 WeakPolarHBondContact O-CB 3.35Å; P636-L639 PolarHBondContact O-N 3.12Å; P636-L639 VanDerWaalsContact O-N 3.17Å; P636-V640 PolarHBondContact O-N 3.39Å
637	Y	81.4	Confident	83.4	Confident	25 Å²	25	47.1 Å²	47.1	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-27.8	174.9	77.4	-87.3	0	0	0	113.6	K635 V640 G641 L663 R873 V878 L879	K635-Y637 VanDerWaalsContact C-N 3.32Å; K635-Y637 HydrophobicContact CB-CD1 3.72Å; K635-Y637 HydrophobicContact CB-CE1 3.51Å; K635-Y637 HydrophobicContact CD-CE1 3.97Å; K635-Y637 HydrophobicContact CG-CE1 4.27Å; K635-Y637 PolarHBondContact O-N 3.45Å; K635-Y637 VanDerWaalsContact O-N 3.12Å; Y637-V640 PolarHBondContact O-N 3.39Å; Y637-G641 PolarHBondContact O-N 3.22Å; Y637-L663 HydrophobicContact CE2-CB 3.99Å; Y637-L663 HydrophobicContact CE2-CD2 4.29Å; Y637-L663 WeakPolarHBondContact CE2-O 3.47Å; Y637-L663 PolarHBondContact OH-O 3.07Å; Y637-R873 PolarHBondContact O-NH1 3.12Å; Y637-V878 HydrophobicContact CD1-CG1 3.12Å; Y637-V878 HydrophobicContact CD2-CG1 3.59Å; Y637-V878 HydrophobicContact CE1-CG1 3.36Å; Y637-V878 HydrophobicContact CE2-CG1 3.82Å; Y637-V878 HydrophobicContact CG-CG1 3.22Å; Y637-L879 HydrophobicContact CE1-CD2 4.39Å
638	Q	86.3	Confident	83.6	Confident	11 Å²	11	46.7 Å²	46.7	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-74.2	-33.9	177.1	-58.8	178	-33.6	0	0	110.6	L634 K635 P636 G641 L642 Q668	L634-Q638 HydrophobicContact CB-CB 4.3Å; K635-Q638 HydrophobicContact CB-CG 4.28Å; K635-Q638 WeakPolarHBondContact O-CA 3.42Å; K635-Q638 VanDerWaalsContact O-CB 3.25Å; K635-Q638 WeakPolarHBondContact O-CB 3.18Å; K635-Q638 PolarHBondContact O-N 3.43Å; P636-Q638 VanDerWaalsContact C-N 3.25Å; P636-Q638 PolarHBondContact O-N 3.34Å; Q638-G641 PolarHBondContact O-N 2.96Å; Q638-L642 WeakPolarHBondContact O-CB 3.4Å; Q638-L642 PolarHBondContact O-N 3.04Å; Q638-Q668 HydrophobicContact CB-CG 3.87Å; Q638-Q668 HydrophobicContact CG-CG 4.02Å
639	L	83.7	Confident	83.8	Confident	31 Å²	31	48 Å²	48	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-43.3	168.7	-64.6	168.7	0	0	0	111.4	Q624 L634 K635 P636 G641 L642 N643	Q624-L639 HydrophobicContact CB-CD2 4.26Å; L634-L639 HydrophobicContact CB-CD2 3.92Å; L634-L639 HydrophobicContact CB-CG 4Å; L634-L639 HydrophobicContact CD1-CD2 3.75Å; L634-L639 HydrophobicContact CG-CD2 4.47Å; K635-L639 PolarHBondContact O-N 2.99Å; P636-L639 WeakPolarHBondContact O-CB 3.35Å; P636-L639 PolarHBondContact O-N 3.12Å; P636-L639 VanDerWaalsContact O-N 3.17Å; L639-G641 VanDerWaalsContact C-N 3.29Å; L639-G641 PolarHBondContact O-N 2.88Å; L639-L642 WeakPolarHBondContact O-CB 3.49Å; L639-L642 PolarHBondContact O-N 2.91Å; L639-L642 VanDerWaalsContact O-N 3.16Å; L639-N643 PolarHBondContact O-N 2.9Å; L639-N643 PolarHBondContact O-ND2 3.32Å
640	V	81.9	Confident	83.8	Confident	36 Å²	36	49.3 Å²	49.3	22%	0.218	25%	0.248	C	C	.	.	H	α-helix	trans	-56.8	-42.2	170.4	165.8	0	0	0	0	111.8	L66 P636 Y637 N643 W644	L66-V640 HydrophobicContact CB-CG2 4.29Å; L66-V640 HydrophobicContact CD1-CB 4.4Å; L66-V640 HydrophobicContact CD1-CG1 3.56Å; L66-V640 HydrophobicContact CD1-CG2 4.14Å; P636-V640 PolarHBondContact O-N 3.39Å; Y637-V640 PolarHBondContact O-N 3.39Å; V640-N643 PolarHBondContact O-N 3.22Å; V640-W644 PolarHBondContact O-N 3.24Å
641	G	86	Confident	84	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.6	-38	176	0	0	0	0	0	113.3	Y637 Q638 L639 L645	Y637-G641 PolarHBondContact O-N 3.22Å; Q638-G641 PolarHBondContact O-N 2.96Å; L639-G641 VanDerWaalsContact C-N 3.29Å; L639-G641 PolarHBondContact O-N 2.88Å; G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 3.21Å
642	L	88.8	Confident	84.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-45.9	174	176.6	60.8	0	0	0	111.6	V621 P625 L634 Q638 L639 L645 R646 A671 F672	V621-L642 HydrophobicContact CB-CD2 4.49Å; V621-L642 HydrophobicContact CG1-CD2 3.9Å; P625-L642 HydrophobicContact CG-CD2 3.89Å; L634-L642 HydrophobicContact CD1-CD2 4.22Å; Q638-L642 WeakPolarHBondContact O-CB 3.4Å; Q638-L642 PolarHBondContact O-N 3.04Å; L639-L642 WeakPolarHBondContact O-CB 3.49Å; L639-L642 PolarHBondContact O-N 2.91Å; L639-L642 VanDerWaalsContact O-N 3.16Å; L642-L645 PolarHBondContact O-N 2.88Å; L642-R646 WeakPolarHBondContact O-CB 3.05Å; L642-R646 PolarHBondContact O-N 3.02Å; L642-A671 HydrophobicContact CD1-CB 4.22Å; L642-A671 HydrophobicContact CD2-CB 4.26Å; L642-F672 VanDerWaalsContact CD1-CA 3.48Å; L642-F672 HydrophobicContact CD1-CB 4.04Å; L642-F672 HydrophobicContact CD1-CD2 4.48Å
643	N	85.6	Confident	84.4	Confident	29 Å²	29	40.4 Å²	40.4	16%	0.155	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-41.4	177.8	-78.7	-42.1	0	0	0	112.1	L620 V621 L639 V640 L645 R646 L647	L620-N643 HydrophobicContact CD2-CB 4.3Å; V621-N643 WeakPolarHBondContact CA-OD1 3.35Å; V621-N643 VanDerWaalsContact CB-OD1 3.23Å; V621-N643 WeakPolarHBondContact CB-OD1 3.31Å; V621-N643 PolarHBondContact N-OD1 3.14Å; V621-N643 PolarHBondContact O-ND2 3.06Å; L639-N643 PolarHBondContact O-N 2.9Å; L639-N643 PolarHBondContact O-ND2 3.32Å; V640-N643 PolarHBondContact O-N 3.22Å; N643-L645 PolarHBondContact O-N 3.47Å; N643-R646 PolarHBondContact O-N 3.44Å; N643-L647 PolarHBondContact O-N 2.96Å
644	W	84.9	Confident	84.7	Confident	42 Å²	42	33.3 Å²	33.3	16%	0.159	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-44	171.8	-179.6	77.2	0	0	0	112.3	V640 R646 L647 L648 I656 P868 L871	V640-W644 PolarHBondContact O-N 3.24Å; W644-R646 PolarHBondContact O-N 3.15Å; W644-L647 PolarHBondContact O-N 2.86Å; W644-L648 HydrophobicContact CD2-CD1 4.16Å; W644-L648 HydrophobicContact CE3-CD1 4.21Å; W644-L648 HydrophobicContact CH2-CD1 3.67Å; W644-L648 HydrophobicContact CZ2-CD1 3.6Å; W644-L648 HydrophobicContact CZ2-CG 4.48Å; W644-L648 HydrophobicContact CZ3-CD1 3.98Å; W644-L648 WeakPolarHBondContact O-CG 3.37Å; W644-L648 PolarHBondContact O-N 2.64Å; W644-I656 WeakPolarHBondContact CH2-O 3.36Å; W644-P868 WeakPolarHBondContact CZ2-O 2.99Å; W644-L871 HydrophobicContact CB-CD2 4.13Å; W644-L871 HydrophobicContact CD2-CB 3.81Å; W644-L871 HydrophobicContact CD2-CD2 3.85Å; W644-L871 HydrophobicContact CD2-CG 4.41Å; W644-L871 HydrophobicContact CE3-CB 3.69Å; W644-L871 HydrophobicContact CE3-CD2 3.7Å; W644-L871 HydrophobicContact CE3-CG 4.36Å; W644-L871 HydrophobicContact CG-CD2 4.05Å; W644-L871 HydrophobicContact CH2-CB 3.66Å; W644-L871 HydrophobicContact CZ2-CB 3.77Å; W644-L871 HydrophobicContact CZ3-CB 3.62Å; W644-L871 HydrophobicContact CZ3-CD2 4.38Å
645	L	89	Confident	84.8	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-36.1	175.3	-68.9	173.3	0	0	0	112.8	G641 L642 N643 L648 H649 F672 L792	G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 3.21Å; L642-L645 PolarHBondContact O-N 2.88Å; N643-L645 PolarHBondContact O-N 3.47Å; L645-L648 PolarHBondContact O-N 3.26Å; L645-H649 PolarHBondContact O-N 2.7Å; L645-F672 HydrophobicContact CB-CB 4.42Å; L645-F672 HydrophobicContact CB-CD2 3.5Å; L645-F672 HydrophobicContact CB-CE2 3.82Å; L645-F672 HydrophobicContact CB-CG 3.92Å; L645-F672 HydrophobicContact CB-CZ 4.46Å; L645-F672 HydrophobicContact CD1-CB 3.87Å; L645-F672 HydrophobicContact CD1-CD1 4.47Å; L645-F672 HydrophobicContact CD1-CD2 4.45Å; L645-F672 HydrophobicContact CD1-CG 4.02Å; L645-F672 VanDerWaalsContact O-CE2 3.31Å; L645-F672 WeakPolarHBondContact O-CE2 3.44Å; L645-L792 HydrophobicContact CD1-CD2 4.35Å; L645-L792 HydrophobicContact CD2-CD1 3.65Å; L645-L792 HydrophobicContact CD2-CD2 4.09Å
646	R	85.7	Confident	85.1	Confident	49 Å²	49	29.8 Å²	29.8	19%	0.185	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-41.3	175.2	-173.9	178.6	171.9	158.9	-2.5	111.4	V618 Q619 L642 N643 W644 H649 H650	V618-R646 HydrophobicContact CG1-CG 4.09Å; Q619-R646 PolarHBondContact O-NE 2.92Å; Q619-R646 PolarHBondContact O-NH1 3.41Å; Q619-R646 PolarHBondContact O-NH2 2.76Å; L642-R646 WeakPolarHBondContact O-CB 3.05Å; L642-R646 PolarHBondContact O-N 3.02Å; N643-R646 PolarHBondContact O-N 3.44Å; W644-R646 PolarHBondContact O-N 3.15Å; R646-H649 PolarHBondContact O-N 2.81Å; R646-H650 PolarHBondContact O-N 2.76Å; R646-H650 VanDerWaalsContact O-N 3.09Å
647	L	83.6	Confident	85.6	Confident	13 Å²	13	25.4 Å²	25.4	7%	0.068	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-50.3	172.8	177.4	63	0	0	0	111.4	V573 H576 A577 L580 N643 W644 H649 H650 E651	V573-L647 HydrophobicContact CG1-CD2 3.97Å; V573-L647 HydrophobicContact CG1-CG 4.42Å; H576-L647 HydrophobicContact CB-CD1 4.15Å; A577-L647 HydrophobicContact CB-CD2 3.82Å; L580-L647 HydrophobicContact CD1-CD1 4.03Å; N643-L647 PolarHBondContact O-N 2.96Å; W644-L647 PolarHBondContact O-N 2.86Å; L647-H649 PolarHBondContact O-N 3Å; L647-H650 WeakPolarHBondContact O-CB 3.32Å; L647-H650 PolarHBondContact O-N 3.38Å; L647-E651 HydrophobicContact CD1-CG 4.01Å; L647-E651 HydrophobicContact CG-CG 4.48Å; L647-E651 PolarHBondContact O-N 3.34Å
648	L	85.9	Confident	85.8	Confident	5 Å²	5	24.2 Å²	24.2	3%	0.026	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-33.3	177.6	-66.4	-172.7	0	0	0	113.1	V573 W644 L645 Q652 V653	V573-L648 HydrophobicContact CG1-CD2 4.27Å; V573-L648 HydrophobicContact CG2-CD2 4.48Å; W644-L648 HydrophobicContact CD2-CD1 4.16Å; W644-L648 HydrophobicContact CE3-CD1 4.21Å; W644-L648 HydrophobicContact CH2-CD1 3.67Å; W644-L648 HydrophobicContact CZ2-CD1 3.6Å; W644-L648 HydrophobicContact CZ2-CG 4.48Å; W644-L648 HydrophobicContact CZ3-CD1 3.98Å; W644-L648 WeakPolarHBondContact O-CG 3.37Å; W644-L648 PolarHBondContact O-N 2.64Å; L645-L648 PolarHBondContact O-N 3.26Å; L648-Q652 PolarHBondContact O-N 3.26Å; L648-V653 HydrophobicContact CD2-CB 4.09Å; L648-V653 HydrophobicContact CD2-CG1 3.82Å; L648-V653 PolarHBondContact O-N 2.94Å
649	H	87.6	Confident	85.7	Confident	30 Å²	30	23.7 Å²	23.7	14%	0.139	11%	0.113	C	C	.	.	H	α-helix	trans	-66.7	-40	172.8	174.1	-117.9	0	0	0	112.6	L645 R646 L647 Q652 F672 L676 Y763	L645-H649 PolarHBondContact O-N 2.7Å; R646-H649 PolarHBondContact O-N 2.81Å; L647-H649 PolarHBondContact O-N 3Å; H649-Q652 PolarHBondContact O-NE2 2.83Å; H649-F672 HydrophobicContact CB-CE2 4.1Å; H649-F672 HydrophobicContact CB-CZ 4.07Å; H649-L676 HydrophobicContact CB-CD2 4.42Å; H649-L676 VanDerWaalsContact CE1-CD2 3.43Å; H649-L676 WeakPolarHBondContact CE1-CD2 3.3Å; H649-L676 WeakPolarHBondContact ND1-CD2 3.29Å; H649-Y763 WeakPolarHBondContact CB-OH 3.45Å; H649-Y763 AromaticContact CD2-CE2 3.69Å; H649-Y763 AromaticContact CD2-CZ 3.95Å; H649-Y763 PolarHBondContact CD2-OH 3.09Å; H649-Y763 VanDerWaalsContact CD2-OH 3.28Å
650	H	82.9	Confident	85.5	Confident	71 Å²	71	23.5 Å²	23.5	33%	0.329	11%	0.112	S	C	.	.	H	α-helix	trans	-63.3	-55.1	176.1	-176.3	-96.8	0	0	0	110.7	V618 R646 L647 Q652	V618-H650 HydrophobicContact CG2-CB 3.62Å; V618-H650 VanDerWaalsContact CG2-CD2 3.46Å; V618-H650 WeakPolarHBondContact CG2-CD2 3.41Å; R646-H650 PolarHBondContact O-N 2.76Å; R646-H650 VanDerWaalsContact O-N 3.09Å; L647-H650 WeakPolarHBondContact O-CB 3.32Å; L647-H650 PolarHBondContact O-N 3.38Å; H650-Q652 PolarHBondContact O-N 2.8Å; H650-Q652 PolarHBondContact O-NE2 2.98Å
651	E	80.9	Confident	85.4	Confident	44 Å²	44	22.7 Å²	22.7	21%	0.206	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	3.5	-178.2	-60.3	-47.8	124.6	0	0	114.6	V573 H576 L647 V653	V573-E651 HydrophobicContact CG2-CB 4.2Å; V573-E651 HydrophobicContact CG2-CG 4.19Å; H576-E651 IonicContact CE1-OE1 3.65Å; H576-E651 IonicContact CE1-OE2 3.99Å; H576-E651 IonicContact CG-OE1 3.55Å; H576-E651 IonicContact ND1-OE1 2.82Å; H576-E651 PolarHBondContact ND1-OE1 3.07Å; H576-E651 IonicContact ND1-OE2 3.67Å; L647-E651 HydrophobicContact CD1-CG 4.01Å; L647-E651 HydrophobicContact CG-CG 4.48Å; L647-E651 PolarHBondContact O-N 3.34Å; E651-V653 HydrophobicContact CB-CG2 4.12Å; E651-V653 PolarHBondContact O-N 3.39Å
652	Q	84.3	Confident	84.9	Confident	107 Å²	107	23.6 Å²	23.6	50%	0.5	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	32.9	179.5	-63.8	-49	-53.8	0	0	113.2	L648 H649 H650 R790	L648-Q652 PolarHBondContact O-N 3.26Å; H649-Q652 PolarHBondContact O-NE2 2.83Å; H650-Q652 PolarHBondContact O-N 2.8Å; H650-Q652 PolarHBondContact O-NE2 2.98Å; Q652-R790 VanDerWaalsContact C-CZ 3.47Å; Q652-R790 VanDerWaalsContact CB-NH2 3.34Å; Q652-R790 PolarHBondContact O-NH1 3.23Å; Q652-R790 PolarHBondContact O-NH2 3.08Å; Q652-R790 VanDerWaalsContact O-NH2 3.17Å; Q652-R790 VanDerWaalsContact OE1-CZ 3.31Å
653	V	83.5	Confident	84.6	Confident	12 Å²	12	23.6 Å²	23.6	7%	0.073	12%	0.115	C	C	.	.			trans	-102	159.6	179.8	174.1	0	0	0	0	110.9	V573 L648 E651 F869	V573-V653 HydrophobicContact CG2-CG2 4.21Å; L648-V653 HydrophobicContact CD2-CB 4.09Å; L648-V653 HydrophobicContact CD2-CG1 3.82Å; L648-V653 PolarHBondContact O-N 2.94Å; E651-V653 HydrophobicContact CB-CG2 4.12Å; E651-V653 PolarHBondContact O-N 3.39Å; V653-F869 HydrophobicContact CG1-CD1 3.53Å; V653-F869 HydrophobicContact CG1-CE1 3.59Å
654	N	90	Very high	84.5	Confident	16 Å²	16	23 Å²	23	9%	0.086	12%	0.116	C	C	.	.			trans	-113.4	146.3	175.6	-69.3	-22	0	0	0	109.4	R790 R791 V813	N654-R790 VanDerWaalsContact OD1-CA 3.32Å; N654-R790 WeakPolarHBondContact OD1-CA 3.37Å; N654-R790 PolarHBondContact OD1-NH1 3Å; N654-R791 WeakPolarHBondContact CA-O 3.26Å; N654-R791 HydrophobicContact CB-CB 4.32Å; N654-R791 VanDerWaalsContact CB-O 3.31Å; N654-R791 WeakPolarHBondContact CB-O 3.38Å; N654-R791 PolarHBondContact OD1-N 2.98Å; N654-V813 VanDerWaalsContact C-CG1 3.43Å; N654-V813 HydrophobicContact CB-CG1 3.45Å; N654-V813 VanDerWaalsContact CB-CG1 3.45Å; N654-V813 WeakPolarHBondContact CB-O 3.3Å; N654-V813 PolarHBondContact ND2-O 3.11Å; N654-V813 VanDerWaalsContact O-CG1 3.28Å; N654-V813 WeakPolarHBondContact O-CG1 3.34Å
655	G	86.5	Confident	84.8	Confident	3 Å²	3	22.1 Å²	22.1	3%	0.031	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	168.2	-166.9	0	0	0	0	0	116.1	R791 L792 L793 F869	G655-R791 PolarHBondContact N-O 3.27Å; G655-L792 WeakPolarHBondContact O-CA 3.29Å; G655-L793 PolarHBondContact O-N 2.92Å; G655-F869 CarbonylContact C-O 3.55Å
656	I	88.8	Confident	85	Confident	5 Å²	5	23.4 Å²	23.4	3%	0.026	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114.7	176.4	-48.8	-179.7	0	0	0	108.6	W644 A658 L793 T795 L809 V813 F869 C870 L871	W644-I656 WeakPolarHBondContact CH2-O 3.36Å; I656-A658 HydrophobicContact CG2-CB 4.17Å; I656-A658 PolarHBondContact O-N 3.29Å; I656-L793 CarbonylContact C-O 3.51Å; I656-L793 WeakPolarHBondContact CA-O 3.39Å; I656-L793 HydrophobicContact CB-CB 4.42Å; I656-L793 HydrophobicContact CD1-CD1 4.46Å; I656-L793 HydrophobicContact CG1-CB 4.21Å; I656-L793 HydrophobicContact CG1-CD1 4.31Å; I656-L793 HydrophobicContact CG2-CB 4.14Å; I656-T795 HydrophobicContact CG2-CG2 4.1Å; I656-L809 HydrophobicContact CD1-CB 4.47Å; I656-V813 HydrophobicContact CD1-CG2 3.99Å; I656-V813 HydrophobicContact CG1-CG2 3.74Å; I656-F869 WeakPolarHBondContact CB-O 3.5Å; I656-F869 PolarHBondContact N-O 3.34Å; I656-C870 HydrophobicContact CB-CB 4.47Å; I656-C870 WeakPolarHBondContact O-CA 3.45Å; I656-L871 PolarHBondContact O-N 3.38Å
657	L	90.2	Very high	85.2	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	102.1	167.8	-171.1	63.1	0	0	0	108.6	K665 Q668 L793 L794 T795 L871	L657-K665 HydrophobicContact CD2-CB 3.98Å; L657-K665 HydrophobicContact CD2-CD 4.34Å; L657-K665 HydrophobicContact CD2-CG 3.79Å; L657-K665 HydrophobicContact CG-CD 4.08Å; L657-K665 HydrophobicContact CG-CG 3.96Å; L657-K665 WeakPolarHBondContact O-CD 3.38Å; L657-Q668 HydrophobicContact CD2-CB 3.99Å; L657-L793 PolarHBondContact N-O 2.99Å; L657-L794 HydrophobicContact CB-CD2 3.78Å; L657-L794 HydrophobicContact CD2-CD2 4.15Å; L657-T795 PolarHBondContact O-N 3.41Å; L657-L871 HydrophobicContact CD1-CB 4.18Å; L657-L871 HydrophobicContact CD1-CD2 3.93Å; L657-L871 HydrophobicContact CD1-CG 4.17Å
658	A	86.3	Confident	85.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.114	C	C	.	.			trans	-109.8	16.7	-170.3	0	0	0	0	0	113.8	I656 T795 P798 C870 L871 R872	I656-A658 HydrophobicContact CG2-CB 4.17Å; I656-A658 PolarHBondContact O-N 3.29Å; A658-T795 HydrophobicContact CB-CG2 4.03Å; A658-P798 HydrophobicContact CB-CB 3.92Å; A658-P798 HydrophobicContact CB-CG 4.03Å; A658-C870 VanDerWaalsContact CB-SG 3.57Å; A658-L871 CarbonylContact C-O 3.42Å; A658-L871 WeakPolarHBondContact CA-O 3.28Å; A658-L871 PolarHBondContact N-O 3.18Å; A658-R872 HydrophobicContact CB-CB 4.08Å; A658-R872 WeakPolarHBondContact O-CG 3.45Å
659	D	84.8	Confident	86	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.			trans	-42.4	153.4	168.2	-78.6	-17.1	0	0	0	112.9	L663 K665 Q668 L871 R873	D659-L663 HydrophobicContact CB-CB 4.14Å; D659-L663 HydrophobicContact CB-CD1 4.07Å; D659-K665 HydrophobicContact CB-CD 4.02Å; D659-K665 HydrophobicContact CB-CG 3.84Å; D659-K665 PolarHBondContact O-NZ 2.83Å; D659-Q668 PolarHBondContact OD2-NE2 2.8Å; D659-L871 PolarHBondContact N-O 3.02Å; D659-R873 WeakPolarHBondContact OD1-CB 3.24Å; D659-R873 IonicContact OD1-CZ 3.46Å; D659-R873 PolarHBondContact OD1-N 3.3Å; D659-R873 VanDerWaalsContact OD1-N 3.17Å; D659-R873 IonicContact OD1-NE 2.82Å; D659-R873 PolarHBondContact OD1-NE 2.82Å; D659-R873 IonicContact OD1-NH2 3.24Å; D659-R873 PolarHBondContact OD1-NH2 3.22Å; D659-R873 IonicContact OD2-CZ 3.65Å; D659-R873 IonicContact OD2-NE 3.73Å; D659-R873 IonicContact OD2-NH2 2.74Å; D659-R873 PolarHBondContact OD2-NH2 3.08Å
660	E	78.4	Confident	86.3	Confident	27 Å²	27	19.5 Å²	19.5	13%	0.126	11%	0.106	C	C	.	.			trans	-60.9	163.2	173.7	-168.9	156.8	-139.7	0	0	113.1	G662 L663 K665 R873 K875 K1156	E660-G662 PolarHBondContact O-N 2.8Å; E660-L663 HydrophobicContact CB-CD1 4.17Å; E660-K665 PolarHBondContact O-NZ 2.71Å; E660-R873 PolarHBondContact N-O 3.42Å; E660-K875 HydrophobicContact CB-CG 4.5Å; E660-K875 HydrophobicContact CG-CD 4.49Å; E660-K875 HydrophobicContact CG-CG 4.2Å; E660-K875 WeakPolarHBondContact OE2-CB 3.42Å; E660-K875 WeakPolarHBondContact OE2-CG 3.36Å; E660-K875 PolarHBondContact OE2-N 3.34Å; E660-K1156 WeakPolarHBondContact OE1-CE 3.5Å; E660-K1156 IonicContact OE1-NZ 2.94Å; E660-K1156 PolarHBondContact OE1-NZ 3.18Å
661	M	79.4	Confident	86.8	Confident	20 Å²	20	16.1 Å²	16.1	10%	0.099	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	131.4	176.9	-61.5	-164.3	-167.5	0	0	110.6	T797 K875 Q1157 D1160	M661-T797 HydrophobicContact CE-CG2 4.07Å; M661-K875 WeakPolarHBondContact O-CE 3.46Å; M661-Q1157 HydrophobicContact CE-CB 4.07Å; M661-Q1157 HydrophobicContact CE-CG 4.12Å; M661-Q1157 VanDerWaalsContact CE-NE2 3.34Å; M661-Q1157 HydrophobicContact SD-CB 3.88Å; M661-Q1157 HydrophobicContact SD-CG 3.68Å; M661-Q1157 PolarHBondContact SD-NE2 2.74Å; M661-D1160 HydrophobicContact CB-CB 4.44Å
662	G	76.4	Confident	87.4	Confident	19 Å²	19	14.1 Å²	14.1	20%	0.196	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.7	-20.5	-179.3	0	0	0	0	0	115.6	E660 G664	E660-G662 PolarHBondContact O-N 2.8Å; G662-G664 PolarHBondContact O-N 2.7Å
663	L	81.6	Confident	87.8	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.058	C	C	.	.	S	Bend	trans	-71.4	23.6	-179.1	-65.4	-175.2	0	0	0	115.5	Y637 D659 E660 K665 Q668 R873 K875 V878 L879	Y637-L663 HydrophobicContact CE2-CB 3.99Å; Y637-L663 HydrophobicContact CE2-CD2 4.29Å; Y637-L663 WeakPolarHBondContact CE2-O 3.47Å; Y637-L663 PolarHBondContact OH-O 3.07Å; D659-L663 HydrophobicContact CB-CB 4.14Å; D659-L663 HydrophobicContact CB-CD1 4.07Å; E660-L663 HydrophobicContact CB-CD1 4.17Å; L663-K665 PolarHBondContact O-N 3.08Å; L663-Q668 PolarHBondContact O-NE2 2.68Å; L663-Q668 VanDerWaalsContact O-NE2 3.1Å; L663-R873 HydrophobicContact CD1-CB 4.28Å; L663-R873 VanDerWaalsContact CD1-O 3.31Å; L663-R873 WeakPolarHBondContact CD1-O 3.44Å; L663-K875 HydrophobicContact CD2-CG 4.47Å; L663-V878 HydrophobicContact CD1-CG2 4.46Å; L663-V878 HydrophobicContact CD2-CB 4.23Å; L663-V878 HydrophobicContact CD2-CG1 3.99Å; L663-L879 HydrophobicContact CD2-CD1 3.64Å; L663-L879 HydrophobicContact CD2-CG 4.18Å
664	G	85.1	Confident	88.2	Confident	17 Å²	17	8.5 Å²	8.5	18%	0.175	5%	0.054	C	C	.	.			trans	64.9	29.7	171.7	0	0	0	0	0	116.1	G662 T666 V667 Q668	G662-G664 PolarHBondContact O-N 2.7Å; G664-T666 PolarHBondContact O-N 3.45Å; G664-T666 VanDerWaalsContact O-N 3.11Å; G664-V667 WeakPolarHBondContact O-CA 3.45Å; G664-V667 WeakPolarHBondContact O-CB 3.37Å; G664-V667 PolarHBondContact O-N 3.36Å; G664-Q668 PolarHBondContact O-N 3.06Å
665	K	90.4	Very high	88.1	Confident	22 Å²	22	8 Å²	8	10%	0.096	5%	0.051	C	C	.	.	H	α-helix	trans	-48.6	-38.1	176.1	-71.6	-169.4	-74.8	-82.6	0	114	L657 D659 E660 L663 Q668 A669 T795	L657-K665 HydrophobicContact CD2-CB 3.98Å; L657-K665 HydrophobicContact CD2-CD 4.34Å; L657-K665 HydrophobicContact CD2-CG 3.79Å; L657-K665 HydrophobicContact CG-CD 4.08Å; L657-K665 HydrophobicContact CG-CG 3.96Å; L657-K665 WeakPolarHBondContact O-CD 3.38Å; D659-K665 HydrophobicContact CB-CD 4.02Å; D659-K665 HydrophobicContact CB-CG 3.84Å; D659-K665 PolarHBondContact O-NZ 2.83Å; E660-K665 PolarHBondContact O-NZ 2.71Å; L663-K665 PolarHBondContact O-N 3.08Å; K665-Q668 PolarHBondContact O-N 3.38Å; K665-A669 WeakPolarHBondContact O-CB 3.4Å; K665-A669 PolarHBondContact O-N 3.19Å; K665-T795 WeakPolarHBondContact CD-O 3.21Å; K665-T795 VanDerWaalsContact CE-C 3.49Å; K665-T795 WeakPolarHBondContact CE-O 3.32Å; K665-T795 PolarHBondContact NZ-O 3.4Å; K665-T795 VanDerWaalsContact NZ-O 3.07Å
666	T	92	Very high	88.3	Confident	32 Å²	32	7.9 Å²	7.9	20%	0.196	5%	0.05	C	C	.	.	H	α-helix	trans	-58.9	-45.6	173.4	-53.4	0	0	0	0	111.8	G664 A669 I670 W697 E700	G664-T666 PolarHBondContact O-N 3.45Å; G664-T666 VanDerWaalsContact O-N 3.11Å; T666-A669 PolarHBondContact O-N 3.07Å; T666-I670 HydrophobicContact CG2-CD1 4.04Å; T666-I670 VanDerWaalsContact O-CG1 3.27Å; T666-I670 WeakPolarHBondContact O-CG1 3.42Å; T666-I670 PolarHBondContact O-N 2.64Å; T666-W697 HydrophobicContact CG2-CD2 3.91Å; T666-W697 HydrophobicContact CG2-CE3 3.79Å; T666-W697 HydrophobicContact CG2-CH2 3.93Å; T666-W697 HydrophobicContact CG2-CZ2 4.02Å; T666-W697 HydrophobicContact CG2-CZ3 3.81Å; T666-E700 HydrophobicContact CG2-CB 4.12Å; T666-E700 HydrophobicContact CG2-CG 4.22Å
667	V	91.4	Very high	88.3	Confident	14 Å²	14	11 Å²	11	9%	0.085	6%	0.062	C	C	.	.	H	α-helix	trans	-66.9	-45	178.4	-176.2	0	0	0	0	110.6	L634 G664 A669 I670 A671 W704	L634-V667 HydrophobicContact CD2-CG1 3.49Å; L634-V667 VanDerWaalsContact CD2-CG1 3.49Å; G664-V667 WeakPolarHBondContact O-CA 3.45Å; G664-V667 WeakPolarHBondContact O-CB 3.37Å; G664-V667 PolarHBondContact O-N 3.36Å; V667-A669 VanDerWaalsContact C-N 3.28Å; V667-A669 PolarHBondContact O-N 2.92Å; V667-I670 PolarHBondContact O-N 3.26Å; V667-I670 VanDerWaalsContact O-N 3.13Å; V667-A671 WeakPolarHBondContact O-CB 3.31Å; V667-A671 PolarHBondContact O-N 2.85Å; V667-W704 HydrophobicContact CB-CZ2 4.36Å; V667-W704 HydrophobicContact CG1-CD2 3.86Å; V667-W704 HydrophobicContact CG1-CE3 3.92Å; V667-W704 HydrophobicContact CG1-CH2 3.64Å; V667-W704 HydrophobicContact CG1-CZ2 3.58Å; V667-W704 HydrophobicContact CG1-CZ3 3.8Å; V667-W704 HydrophobicContact CG2-CZ2 3.8Å
668	Q	91.9	Very high	88.2	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-57.8	-40.2	174.3	-67	178.7	63.7	0	0	111.9	Q638 L657 D659 L663 G664 K665 F672	Q638-Q668 HydrophobicContact CB-CG 3.87Å; Q638-Q668 HydrophobicContact CG-CG 4.02Å; L657-Q668 HydrophobicContact CD2-CB 3.99Å; D659-Q668 PolarHBondContact OD2-NE2 2.8Å; L663-Q668 PolarHBondContact O-NE2 2.68Å; L663-Q668 VanDerWaalsContact O-NE2 3.1Å; G664-Q668 PolarHBondContact O-N 3.06Å; K665-Q668 PolarHBondContact O-N 3.38Å; Q668-F672 WeakPolarHBondContact O-CB 3.46Å; Q668-F672 PolarHBondContact O-N 2.82Å
669	A	94.3	Very high	88.1	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-69.6	-34.5	175.8	0	0	0	0	0	113.5	K665 T666 V667 L673 W697 I765 L794	K665-A669 WeakPolarHBondContact O-CB 3.4Å; K665-A669 PolarHBondContact O-N 3.19Å; T666-A669 PolarHBondContact O-N 3.07Å; V667-A669 VanDerWaalsContact C-N 3.28Å; V667-A669 PolarHBondContact O-N 2.92Å; A669-L673 WeakPolarHBondContact O-CG 3.29Å; A669-L673 PolarHBondContact O-N 3.18Å; A669-W697 HydrophobicContact CB-CH2 3.96Å; A669-W697 HydrophobicContact CB-CZ3 4.4Å; A669-I765 HydrophobicContact CB-CD1 4.29Å; A669-L794 HydrophobicContact CB-CD1 4.06Å; A669-L794 HydrophobicContact CB-CD2 4.49Å
670	I	94.1	Very high	87.9	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70.7	-45.5	174.2	-66.9	165.4	0	0	0	110.4	L628 T666 V667 F672 L673 A674 W697 E700 L701 W704 C705	L628-I670 HydrophobicContact CD2-CG2 4.24Å; T666-I670 HydrophobicContact CG2-CD1 4.04Å; T666-I670 VanDerWaalsContact O-CG1 3.27Å; T666-I670 WeakPolarHBondContact O-CG1 3.42Å; T666-I670 PolarHBondContact O-N 2.64Å; V667-I670 PolarHBondContact O-N 3.26Å; V667-I670 VanDerWaalsContact O-N 3.13Å; I670-F672 PolarHBondContact O-N 3.37Å; I670-L673 PolarHBondContact O-N 3.28Å; I670-L673 VanDerWaalsContact O-N 3.14Å; I670-A674 WeakPolarHBondContact O-CB 3.47Å; I670-A674 PolarHBondContact O-N 2.94Å; I670-W697 HydrophobicContact CG1-CZ3 4.36Å; I670-E700 HydrophobicContact CD1-CB 3.74Å; I670-L701 HydrophobicContact CD1-CD2 4.19Å; I670-L701 HydrophobicContact CD1-CG 4.14Å; I670-L701 HydrophobicContact CG1-CD2 3.82Å; I670-L701 HydrophobicContact CG1-CG 4.27Å; I670-L701 HydrophobicContact CG2-CD2 4.4Å; I670-W704 HydrophobicContact CG2-CB 3.99Å; I670-C705 HydrophobicContact CG2-CB 3.94Å
671	A	92.3	Very high	88.1	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-58.6	-37.2	173.6	0	0	0	0	0	112	L628 L634 L642 V667 A674 S675	L628-A671 HydrophobicContact CD1-CB 3.9Å; L634-A671 HydrophobicContact CD1-CB 3.72Å; L634-A671 HydrophobicContact CD2-CB 4.22Å; L642-A671 HydrophobicContact CD1-CB 4.22Å; L642-A671 HydrophobicContact CD2-CB 4.26Å; V667-A671 WeakPolarHBondContact O-CB 3.31Å; V667-A671 PolarHBondContact O-N 2.85Å; A671-A674 WeakPolarHBondContact O-CB 3.39Å; A671-A674 PolarHBondContact O-N 2.89Å; A671-S675 PolarHBondContact O-N 3.24Å
672	F	93.4	Very high	88.3	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-48.3	173	177.2	-116.9	0	0	0	111.9	L642 L645 H649 Q668 I670 A674 S675 L676 Y763 L792	L642-F672 VanDerWaalsContact CD1-CA 3.48Å; L642-F672 HydrophobicContact CD1-CB 4.04Å; L642-F672 HydrophobicContact CD1-CD2 4.48Å; L645-F672 HydrophobicContact CB-CB 4.42Å; L645-F672 HydrophobicContact CB-CD2 3.5Å; L645-F672 HydrophobicContact CB-CE2 3.82Å; L645-F672 HydrophobicContact CB-CG 3.92Å; L645-F672 HydrophobicContact CB-CZ 4.46Å; L645-F672 HydrophobicContact CD1-CB 3.87Å; L645-F672 HydrophobicContact CD1-CD1 4.47Å; L645-F672 HydrophobicContact CD1-CD2 4.45Å; L645-F672 HydrophobicContact CD1-CG 4.02Å; L645-F672 VanDerWaalsContact O-CE2 3.31Å; L645-F672 WeakPolarHBondContact O-CE2 3.44Å; H649-F672 HydrophobicContact CB-CE2 4.1Å; H649-F672 HydrophobicContact CB-CZ 4.07Å; Q668-F672 WeakPolarHBondContact O-CB 3.46Å; Q668-F672 PolarHBondContact O-N 2.82Å; I670-F672 PolarHBondContact O-N 3.37Å; F672-A674 VanDerWaalsContact C-N 3.27Å; F672-A674 PolarHBondContact O-N 2.97Å; F672-S675 PolarHBondContact O-N 3.34Å; F672-S675 PolarHBondContact O-OG 3.1Å; F672-L676 HydrophobicContact CD1-CD1 4.19Å; F672-L676 HydrophobicContact CD2-CG 4.42Å; F672-L676 HydrophobicContact CE1-CD1 3.63Å; F672-L676 HydrophobicContact CE1-CG 4.31Å; F672-L676 HydrophobicContact CE2-CD1 4.22Å; F672-L676 HydrophobicContact CE2-CD2 4.12Å; F672-L676 HydrophobicContact CE2-CG 4.04Å; F672-L676 HydrophobicContact CZ-CD1 3.66Å; F672-L676 HydrophobicContact CZ-CD2 4.13Å; F672-L676 HydrophobicContact CZ-CG 3.99Å; F672-L676 WeakPolarHBondContact O-CG 3.3Å; F672-L676 PolarHBondContact O-N 2.91Å; F672-Y763 AromaticContact CE1-CD1 3.93Å; F672-Y763 HydrophobicContact CE1-CD1 3.93Å; F672-Y763 AromaticContact CE1-CE1 3.55Å; F672-Y763 HydrophobicContact CE1-CE1 3.55Å; F672-Y763 HydrophobicContact CE1-CE2 4.27Å; F672-Y763 HydrophobicContact CE1-CG 4.43Å; F672-Y763 AromaticContact CE1-CZ 3.76Å; F672-Y763 AromaticContact CZ-CE1 3.81Å; F672-Y763 HydrophobicContact CZ-CE1 3.81Å; F672-Y763 HydrophobicContact CZ-CE2 4.13Å; F672-Y763 AromaticContact CZ-CZ 3.57Å; F672-L792 HydrophobicContact CD1-CD2 4.29Å
673	L	93.3	Very high	88.6	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-32.9	175	-70.1	176.7	0	0	0	113	A669 I670 L676 W677 H685 I687 I738 I765	A669-L673 WeakPolarHBondContact O-CG 3.29Å; A669-L673 PolarHBondContact O-N 3.18Å; I670-L673 PolarHBondContact O-N 3.28Å; I670-L673 VanDerWaalsContact O-N 3.14Å; L673-L676 HydrophobicContact CD2-CD1 4.34Å; L673-W677 WeakPolarHBondContact O-CB 3.42Å; L673-W677 PolarHBondContact O-N 3.13Å; L673-H685 HydrophobicContact CD2-CB 4.15Å; L673-I687 HydrophobicContact CD1-CD1 4.03Å; L673-I738 HydrophobicContact CD1-CD1 3.74Å; L673-I738 HydrophobicContact CD1-CG1 4.31Å; L673-I765 HydrophobicContact CD1-CD1 3.8Å; L673-I765 HydrophobicContact CD2-CD1 4.12Å; L673-I765 HydrophobicContact CG-CD1 3.95Å
674	A	91.4	Very high	89.1	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.2	-52.8	171.1	0	0	0	0	0	111.7	P625 I627 L628 I670 A671 F672 L676 W677 E678	P625-A674 HydrophobicContact CB-CB 3.98Å; P625-A674 HydrophobicContact CG-CB 4.48Å; I627-A674 HydrophobicContact CG2-CB 3.43Å; I627-A674 VanDerWaalsContact CG2-CB 3.43Å; L628-A674 HydrophobicContact CD2-CB 3.86Å; L628-A674 HydrophobicContact CG-CB 4.07Å; I670-A674 WeakPolarHBondContact O-CB 3.47Å; I670-A674 PolarHBondContact O-N 2.94Å; A671-A674 WeakPolarHBondContact O-CB 3.39Å; A671-A674 PolarHBondContact O-N 2.89Å; F672-A674 VanDerWaalsContact C-N 3.27Å; F672-A674 PolarHBondContact O-N 2.97Å; A674-L676 PolarHBondContact O-N 3.25Å; A674-W677 WeakPolarHBondContact O-CA 3.42Å; A674-W677 WeakPolarHBondContact O-CB 3.38Å; A674-W677 PolarHBondContact O-N 3.11Å; A674-E678 PolarHBondContact O-N 3.36Å
675	S	88.9	Confident	89.5	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-32.3	177.1	71.8	0	0	0	0	113	A671 F672 S679	A671-S675 PolarHBondContact O-N 3.24Å; F672-S675 PolarHBondContact O-N 3.34Å; F672-S675 PolarHBondContact O-OG 3.1Å; S675-S679 VanDerWaalsContact O-CB 3.27Å; S675-S679 WeakPolarHBondContact O-CB 3.48Å; S675-S679 PolarHBondContact O-N 2.98Å; S675-S679 PolarHBondContact O-OG 3.12Å
676	L	90.1	Very high	89.7	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-67.2	-42.7	171.6	-72.7	-176.4	0	0	0	111.7	H649 F672 L673 A674 E678 S679 N681 Y763	H649-L676 HydrophobicContact CB-CD2 4.42Å; H649-L676 VanDerWaalsContact CE1-CD2 3.43Å; H649-L676 WeakPolarHBondContact CE1-CD2 3.3Å; H649-L676 WeakPolarHBondContact ND1-CD2 3.29Å; F672-L676 HydrophobicContact CD1-CD1 4.19Å; F672-L676 HydrophobicContact CD2-CG 4.42Å; F672-L676 HydrophobicContact CE1-CD1 3.63Å; F672-L676 HydrophobicContact CE1-CG 4.31Å; F672-L676 HydrophobicContact CE2-CD1 4.22Å; F672-L676 HydrophobicContact CE2-CD2 4.12Å; F672-L676 HydrophobicContact CE2-CG 4.04Å; F672-L676 HydrophobicContact CZ-CD1 3.66Å; F672-L676 HydrophobicContact CZ-CD2 4.13Å; F672-L676 HydrophobicContact CZ-CG 3.99Å; F672-L676 WeakPolarHBondContact O-CG 3.3Å; F672-L676 PolarHBondContact O-N 2.91Å; L673-L676 HydrophobicContact CD2-CD1 4.34Å; A674-L676 PolarHBondContact O-N 3.25Å; L676-E678 VanDerWaalsContact C-N 3.34Å; L676-E678 PolarHBondContact O-N 2.78Å; L676-S679 CarbonylContact O-C 3.56Å; L676-S679 PolarHBondContact O-N 3.01Å; L676-N681 HydrophobicContact CB-CB 4.16Å; L676-N681 WeakPolarHBondContact O-CA 3.3Å; L676-N681 VanDerWaalsContact O-CB 3.26Å; L676-N681 WeakPolarHBondContact O-CB 3.4Å; L676-N681 PolarHBondContact O-N 2.92Å; L676-Y763 HydrophobicContact CD1-CD2 3.62Å; L676-Y763 HydrophobicContact CD1-CE2 3.64Å; L676-Y763 HydrophobicContact CD1-CG 4.34Å
677	W	89.5	Confident	89.9	Confident	69 Å²	69	20.8 Å²	20.8	26%	0.261	12%	0.121	S	C	.	.	H	α-helix	trans	-58.9	-46.8	176.9	-172.9	106.6	0	0	0	110.7	I627 L673 A674 G680 R682 L708	I627-W677 HydrophobicContact CD1-CD2 3.33Å; I627-W677 HydrophobicContact CD1-CE3 3.34Å; I627-W677 HydrophobicContact CD1-CG 3.93Å; I627-W677 HydrophobicContact CD1-CH2 3.9Å; I627-W677 HydrophobicContact CD1-CZ2 3.9Å; I627-W677 HydrophobicContact CD1-CZ3 3.63Å; L673-W677 WeakPolarHBondContact O-CB 3.42Å; L673-W677 PolarHBondContact O-N 3.13Å; A674-W677 WeakPolarHBondContact O-CA 3.42Å; A674-W677 WeakPolarHBondContact O-CB 3.38Å; A674-W677 PolarHBondContact O-N 3.11Å; W677-G680 PolarHBondContact O-N 2.9Å; W677-R682 VanDerWaalsContact CH2-NH2 3.33Å; W677-R682 PolarHBondContact O-NE 2.87Å; W677-R682 PolarHBondContact O-NH1 2.91Å; W677-R682 PolarHBondContact O-NH2 2.9Å; W677-L708 HydrophobicContact CB-CD2 4.34Å; W677-L708 HydrophobicContact CG-CD2 4.04Å
678	E	86.6	Confident	90.1	Very high	75 Å²	75	20.1 Å²	20.1	35%	0.35	12%	0.117	S	C	.	.	H	α-helix	trans	-59.6	-46.1	175	-69.7	167.2	175.1	0	0	111.1	P625 A626 I627 A674 L676 G680	P625-E678 VanDerWaalsContact C-OE1 3.26Å; P625-E678 WeakPolarHBondContact CA-OE1 3.24Å; P625-E678 WeakPolarHBondContact CB-OE1 3.38Å; P625-E678 WeakPolarHBondContact CB-OE2 3.38Å; A626-E678 PolarHBondContact N-OE1 3.48Å; I627-E678 HydrophobicContact CG2-CG 4.16Å; I627-E678 WeakPolarHBondContact CG2-OE1 3.39Å; I627-E678 PolarHBondContact N-OE1 3.41Å; A674-E678 PolarHBondContact O-N 3.36Å; L676-E678 VanDerWaalsContact C-N 3.34Å; L676-E678 PolarHBondContact O-N 2.78Å; E678-G680 PolarHBondContact O-N 3.07Å
679	S	84.1	Confident	90.1	Very high	65 Å²	65	20.1 Å²	20.1	46%	0.455	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	25.9	175.2	-53.5	0	0	0	0	115	S675 L676 N681	S675-S679 VanDerWaalsContact O-CB 3.27Å; S675-S679 WeakPolarHBondContact O-CB 3.48Å; S675-S679 PolarHBondContact O-N 2.98Å; S675-S679 PolarHBondContact O-OG 3.12Å; L676-S679 CarbonylContact O-C 3.56Å; L676-S679 PolarHBondContact O-N 3.01Å; S679-N681 PolarHBondContact O-N 2.79Å; S679-N681 VanDerWaalsContact O-N 3.15Å
680	G	82.2	Confident	89.7	Confident	48 Å²	48	21 Å²	21	50%	0.495	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-17	178.5	0	0	0	0	0	115.6	W677 E678 R682	W677-G680 PolarHBondContact O-N 2.9Å; E678-G680 PolarHBondContact O-N 3.07Å; G680-R682 PolarHBondContact O-N 2.89Å
681	N	82.8	Confident	89.2	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.011	14%	0.144	C	C	.	.			trans	-84.5	77.7	-171.2	-178.2	10.4	0	0	0	112.6	L676 S679 G683 H685 R762	L676-N681 HydrophobicContact CB-CB 4.16Å; L676-N681 WeakPolarHBondContact O-CA 3.3Å; L676-N681 VanDerWaalsContact O-CB 3.26Å; L676-N681 WeakPolarHBondContact O-CB 3.4Å; L676-N681 PolarHBondContact O-N 2.92Å; S679-N681 PolarHBondContact O-N 2.79Å; S679-N681 VanDerWaalsContact O-N 3.15Å; N681-G683 PolarHBondContact O-N 3.31Å; N681-H685 PolarHBondContact ND2-CE1 3.38Å; N681-H685 PolarHBondContact O-NE2 3.31Å; N681-H685 PolarHBondContact OD1-CE1 2.92Å; N681-R762 PolarHBondContact ND2-NE 2.98Å; N681-R762 WeakPolarHBondContact OD1-CD 3.49Å; N681-R762 PolarHBondContact OD1-NE 3.11Å; N681-R762 PolarHBondContact OD1-NH1 3.38Å
682	R	83.2	Confident	88.4	Confident	105 Å²	105	26.6 Å²	26.6	40%	0.396	16%	0.161	S	C	.	.			trans	-73.6	0.9	-176.8	-58.6	-49.2	-160.5	-78.3	23.4	116	W677 G680 N737	W677-R682 VanDerWaalsContact CH2-NH2 3.33Å; W677-R682 PolarHBondContact O-NE 2.87Å; W677-R682 PolarHBondContact O-NH1 2.91Å; W677-R682 PolarHBondContact O-NH2 2.9Å; G680-R682 PolarHBondContact O-N 2.89Å; R682-N737 PolarHBondContact O-ND2 3.25Å
683	G	82.8	Confident	87.9	Confident	27 Å²	27	27.3 Å²	27.3	28%	0.278	17%	0.166	S	C	.	.			trans	103.4	-158.4	179.9	0	0	0	0	0	114.3	N681 H685	N681-G683 PolarHBondContact O-N 3.31Å; G683-H685 PolarHBondContact N-NE2 3.49Å; G683-H685 VanDerWaalsContact N-NE2 3.19Å
684	P	91.3	Very high	87.6	Confident	21 Å²	21	27.4 Å²	27.4	14%	0.136	17%	0.166	C	C	.	.			cis	-71.8	140.4	0.7	30.3	-35.9	0	0	0	112.4	P734 F736 V759 F761 R762	P684-P734 HydrophobicContact CB-CG 3.87Å; P684-P734 HydrophobicContact CG-CG 3.92Å; P684-F736 HydrophobicContact CB-CD2 4.49Å; P684-F736 HydrophobicContact CB-CE2 3.87Å; P684-V759 HydrophobicContact CG-CG1 4.12Å; P684-F761 HydrophobicContact CB-CD1 4.17Å; P684-F761 HydrophobicContact CG-CD1 4.43Å; P684-F761 CarbonylContact O-C 3.32Å; P684-F761 WeakPolarHBondContact O-CA 3.25Å; P684-R762 PolarHBondContact O-N 2.9Å
685	H	94.2	Very high	87.2	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	152.7	174.3	-52.9	-62.9	0	0	0	110.4	L673 N681 G683 N737 I738 L739 Y763	L673-H685 HydrophobicContact CD2-CB 4.15Å; N681-H685 PolarHBondContact ND2-CE1 3.38Å; N681-H685 PolarHBondContact O-NE2 3.31Å; N681-H685 PolarHBondContact OD1-CE1 2.92Å; G683-H685 PolarHBondContact N-NE2 3.49Å; G683-H685 VanDerWaalsContact N-NE2 3.19Å; H685-N737 PolarHBondContact CD2-O 3.08Å; H685-N737 PolarHBondContact N-O 3.16Å; H685-I738 HydrophobicContact CB-CG1 4.38Å; H685-I738 CarbonylContact O-C 3.51Å; H685-I738 WeakPolarHBondContact O-CA 3.07Å; H685-L739 PolarHBondContact O-N 3.11Å; H685-Y763 CarbonylContact C-O 3.53Å; H685-Y763 WeakPolarHBondContact CA-O 3.21Å; H685-Y763 PolarHBondContact ND1-N 2.69Å
686	L	94.6	Very high	86.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.4	179.1	177.9	63.4	0	0	0	109.6	I688 L739 T741 M756 F761 Y763 G764 I765 F786 V788	L686-I688 HydrophobicContact CD1-CG1 4.2Å; L686-I688 HydrophobicContact CD2-CD1 3.97Å; L686-I688 HydrophobicContact CD2-CG1 4.09Å; L686-I688 HydrophobicContact CG-CD1 4.33Å; L686-I688 HydrophobicContact CG-CG1 3.88Å; L686-L739 HydrophobicContact CD1-CB 4.19Å; L686-L739 HydrophobicContact CD1-CD2 4.14Å; L686-L739 HydrophobicContact CD1-CG 4.37Å; L686-T741 HydrophobicContact CD1-CG2 4.13Å; L686-M756 HydrophobicContact CD1-CE 4.39Å; L686-M756 HydrophobicContact CD1-SD 4Å; L686-M756 HydrophobicContact CD2-SD 4.33Å; L686-F761 HydrophobicContact CB-CB 4.17Å; L686-F761 HydrophobicContact CB-CD1 3.67Å; L686-F761 HydrophobicContact CB-CD2 4.17Å; L686-F761 HydrophobicContact CB-CE1 4.01Å; L686-F761 HydrophobicContact CB-CE2 4.47Å; L686-F761 HydrophobicContact CB-CG 3.75Å; L686-F761 HydrophobicContact CB-CZ 4.39Å; L686-F761 HydrophobicContact CD1-CE1 4.32Å; L686-F761 HydrophobicContact CD1-CZ 4.16Å; L686-F761 HydrophobicContact CD2-CD2 3.98Å; L686-F761 HydrophobicContact CD2-CE2 4.01Å; L686-F761 HydrophobicContact CD2-CG 4.4Å; L686-F761 HydrophobicContact CD2-CZ 4.45Å; L686-Y763 PolarHBondContact N-O 2.62Å; L686-G764 CarbonylContact O-C 3.6Å; L686-G764 WeakPolarHBondContact O-CA 3.32Å; L686-I765 PolarHBondContact O-N 3.42Å; L686-F786 HydrophobicContact CD2-CD2 3.9Å; L686-F786 HydrophobicContact CD2-CE2 4.36Å; L686-V788 HydrophobicContact CD2-CG2 4.3Å
687	I	96	Very high	87	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.6	169.8	-57.2	178.2	0	0	0	108	L673 W697 L701 I738 L739 L740 T741 I765	L673-I687 HydrophobicContact CD1-CD1 4.03Å; I687-W697 HydrophobicContact CD1-CE3 4.05Å; I687-W697 HydrophobicContact CD1-CZ3 4.04Å; I687-W697 HydrophobicContact CG2-CD2 4.14Å; I687-W697 HydrophobicContact CG2-CE3 4.07Å; I687-W697 HydrophobicContact CG2-CZ3 4.29Å; I687-L701 HydrophobicContact CD1-CD1 4.17Å; I687-I738 HydrophobicContact CD1-CG2 3.66Å; I687-I738 HydrophobicContact CG1-CG2 3.92Å; I687-L739 PolarHBondContact N-O 2.94Å; I687-L740 HydrophobicContact CB-CD1 3.86Å; I687-L740 HydrophobicContact CG2-CD1 3.68Å; I687-T741 PolarHBondContact O-N 3.15Å; I687-I765 WeakPolarHBondContact CA-O 3.5Å; I687-I765 HydrophobicContact CG1-CB 4.34Å
688	I	94.4	Very high	87	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123	173.3	-47.8	-169.7	0	0	0	109.1	L686 T741 Y743 I765 F766 D767 L783 F786	L686-I688 HydrophobicContact CD1-CG1 4.2Å; L686-I688 HydrophobicContact CD2-CD1 3.97Å; L686-I688 HydrophobicContact CD2-CG1 4.09Å; L686-I688 HydrophobicContact CG-CD1 4.33Å; L686-I688 HydrophobicContact CG-CG1 3.88Å; I688-T741 WeakPolarHBondContact CA-O 3.35Å; I688-T741 HydrophobicContact CG1-CG2 4.15Å; I688-Y743 HydrophobicContact CB-CE1 4.42Å; I688-Y743 HydrophobicContact CG2-CD1 3.48Å; I688-Y743 VanDerWaalsContact CG2-CD1 3.48Å; I688-Y743 HydrophobicContact CG2-CD2 4.3Å; I688-Y743 HydrophobicContact CG2-CE1 3.71Å; I688-Y743 HydrophobicContact CG2-CE2 4.49Å; I688-Y743 HydrophobicContact CG2-CG 3.81Å; I688-I765 PolarHBondContact N-O 2.85Å; I688-F766 HydrophobicContact CB-CD1 4.16Å; I688-F766 HydrophobicContact CD1-CD1 4.01Å; I688-F766 HydrophobicContact CD1-CE1 3.62Å; I688-F766 HydrophobicContact CG1-CD1 4.27Å; I688-F766 HydrophobicContact CG1-CE1 4.22Å; I688-D767 PolarHBondContact O-N 2.8Å; I688-L783 HydrophobicContact CD1-CD2 3.55Å; I688-F786 HydrophobicContact CD1-CD2 4.14Å; I688-F786 HydrophobicContact CD1-CE2 3.74Å
689	C	91.9	Very high	87.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	169.1	-178.2	60.6	0	0	0	0	112.4	T741 S742 Y743 D767	C689-T741 PolarHBondContact N-O 2.86Å; C689-T741 VanDerWaalsContact N-O 3.08Å; C689-T741 PolarHBondContact SG-O 3Å; C689-T741 VanDerWaalsContact SG-O 3.39Å; C689-S742 WeakPolarHBondContact O-CA 3.03Å; C689-S742 WeakPolarHBondContact O-CB 3.25Å; C689-Y743 WeakPolarHBondContact O-CD2 3.14Å; C689-Y743 PolarHBondContact O-N 3.23Å; C689-Y743 VanDerWaalsContact O-N 3.1Å; C689-D767 HydrophobicContact CB-CB 3.99Å
690	P	86.6	Confident	87.4	Confident	17 Å²	17	33.4 Å²	33.4	11%	0.11	19%	0.192	C	C	.	.			trans	-56.8	138.8	158.7	-23.4	32.6	0	0	0	111.5	S692 T693 Q694 E768 M771	P690-S692 PolarHBondContact O-N 2.76Å; P690-T693 WeakPolarHBondContact CD-OG1 3.43Å; P690-T693 PolarHBondContact O-N 2.71Å; P690-T693 PolarHBondContact O-OG1 2.97Å; P690-Q694 PolarHBondContact O-N 3.11Å; P690-E768 HydrophobicContact CG-CB 3.82Å; P690-E768 HydrophobicContact CG-CG 4.05Å; P690-M771 HydrophobicContact CB-SD 4.44Å; P690-M771 HydrophobicContact CG-SD 3.97Å
691	S	83	Confident	87.9	Confident	67 Å²	67	31.2 Å²	31.2	47%	0.469	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-6.1	174	-84.1	0	0	0	0	114.5	S742	S691-S742 WeakPolarHBondContact OG-CB 3.2Å; S691-S742 PolarHBondContact OG-OG 3.44Å
692	S	76.3	Confident	88.3	Confident	52 Å²	52	34.6 Å²	34.6	36%	0.364	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-8.7	174.8	54.5	0	0	0	0	114.6	P690	P690-S692 PolarHBondContact O-N 2.76Å
693	T	83.1	Confident	88.5	Confident	18 Å²	18	32.4 Å²	32.4	11%	0.11	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-8.8	171.9	62	0	0	0	0	111.9	P690 D695 S696 W697 D767	P690-T693 WeakPolarHBondContact CD-OG1 3.43Å; P690-T693 PolarHBondContact O-N 2.71Å; P690-T693 PolarHBondContact O-OG1 2.97Å; T693-D695 PolarHBondContact O-N 3.31Å; T693-S696 CarbonylContact O-C 3.54Å; T693-S696 WeakPolarHBondContact O-CA 3.19Å; T693-S696 VanDerWaalsContact O-CB 3.32Å; T693-S696 WeakPolarHBondContact O-CB 3.47Å; T693-S696 PolarHBondContact O-N 2.93Å; T693-W697 PolarHBondContact O-N 3.1Å; T693-D767 PolarHBondContact OG1-OD2 3.02Å
694	Q	85.9	Confident	88.8	Confident	3 Å²	3	32.1 Å²	32.1	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-54.3	-46.6	-178	-171.5	168	-12.3	0	0	113.7	P690 S696 W697 Q698 V712 L740	P690-Q694 PolarHBondContact O-N 3.11Å; Q694-S696 VanDerWaalsContact C-N 3.27Å; Q694-S696 PolarHBondContact O-N 2.87Å; Q694-W697 PolarHBondContact O-N 3.12Å; Q694-Q698 PolarHBondContact O-N 2.99Å; Q694-V712 HydrophobicContact CG-CG1 4.49Å; Q694-V712 VanDerWaalsContact NE2-CG1 3.33Å; Q694-L740 HydrophobicContact CG-CD2 4.19Å; Q694-L740 HydrophobicContact CG-CG 4.19Å
695	D	83	Confident	88.7	Confident	69 Å²	69	31.2 Å²	31.2	37%	0.369	17%	0.172	S	C	.	.	H	α-helix	trans	-68.7	-27.8	177.5	-51.6	-53	0	0	0	112.3	T693 R699	T693-D695 PolarHBondContact O-N 3.31Å; D695-R699 WeakPolarHBondContact O-CB 3.45Å; D695-R699 PolarHBondContact O-N 3.34Å
696	S	84.5	Confident	88.3	Confident	39 Å²	39	35.1 Å²	35.1	27%	0.273	20%	0.198	S	C	.	.	H	α-helix	trans	-73	-42.7	173.1	-174.4	0	0	0	0	111	T693 Q694 Q698 R699 E700	T693-S696 CarbonylContact O-C 3.54Å; T693-S696 WeakPolarHBondContact O-CA 3.19Å; T693-S696 VanDerWaalsContact O-CB 3.32Å; T693-S696 WeakPolarHBondContact O-CB 3.47Å; T693-S696 PolarHBondContact O-N 2.93Å; Q694-S696 VanDerWaalsContact C-N 3.27Å; Q694-S696 PolarHBondContact O-N 2.87Å; S696-Q698 PolarHBondContact O-N 2.75Å; S696-R699 PolarHBondContact O-N 3.22Å; S696-E700 WeakPolarHBondContact O-CG 3.26Å; S696-E700 PolarHBondContact O-N 3.29Å
697	W	91.1	Very high	87.9	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.011	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-44.5	172.3	-86.3	97	0	0	0	111.8	T666 A669 I670 I687 T693 Q694 L701 L740 D767 L794	T666-W697 HydrophobicContact CG2-CD2 3.91Å; T666-W697 HydrophobicContact CG2-CE3 3.79Å; T666-W697 HydrophobicContact CG2-CH2 3.93Å; T666-W697 HydrophobicContact CG2-CZ2 4.02Å; T666-W697 HydrophobicContact CG2-CZ3 3.81Å; A669-W697 HydrophobicContact CB-CH2 3.96Å; A669-W697 HydrophobicContact CB-CZ3 4.4Å; I670-W697 HydrophobicContact CG1-CZ3 4.36Å; I687-W697 HydrophobicContact CD1-CE3 4.05Å; I687-W697 HydrophobicContact CD1-CZ3 4.04Å; I687-W697 HydrophobicContact CG2-CD2 4.14Å; I687-W697 HydrophobicContact CG2-CE3 4.07Å; I687-W697 HydrophobicContact CG2-CZ3 4.29Å; T693-W697 PolarHBondContact O-N 3.1Å; Q694-W697 PolarHBondContact O-N 3.12Å; W697-L701 VanDerWaalsContact O-CB 3.29Å; W697-L701 WeakPolarHBondContact O-CB 3.45Å; W697-L701 WeakPolarHBondContact O-CD1 3.48Å; W697-L701 VanDerWaalsContact O-CG 3.25Å; W697-L701 WeakPolarHBondContact O-CG 3.15Å; W697-L701 PolarHBondContact O-N 3.49Å; W697-L740 HydrophobicContact CB-CD1 3.99Å; W697-L740 HydrophobicContact CB-CD2 4.03Å; W697-L740 HydrophobicContact CG-CD1 4.44Å; W697-D767 HydrophobicContact CZ2-CB 3.93Å; W697-D767 PolarHBondContact NE1-OD2 3.14Å; W697-L794 HydrophobicContact CH2-CD1 3.67Å; W697-L794 HydrophobicContact CZ2-CD1 3.67Å
698	Q	90.4	Very high	87.5	Confident	82 Å²	82	41.8 Å²	41.8	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-44.8	175.5	-177.1	177.9	-21.9	0	0	111.6	Q694 S696 S702 V712 L740	Q694-Q698 PolarHBondContact O-N 2.99Å; S696-Q698 PolarHBondContact O-N 2.75Å; Q698-S702 PolarHBondContact O-N 3.35Å; Q698-S702 VanDerWaalsContact O-N 3.08Å; Q698-S702 PolarHBondContact O-OG 3.44Å; Q698-V712 HydrophobicContact CG-CG2 4.32Å; Q698-L740 HydrophobicContact CB-CD2 4.1Å
699	R	87.8	Confident	87.3	Confident	104 Å²	104	46.8 Å²	46.8	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-53.3	177.7	-167.2	-172.4	-51.4	173.8	9	111.7	D695 S696 L701 S702 L703	D695-R699 WeakPolarHBondContact O-CB 3.45Å; D695-R699 PolarHBondContact O-N 3.34Å; S696-R699 PolarHBondContact O-N 3.22Å; R699-L701 VanDerWaalsContact C-N 3.33Å; R699-L701 PolarHBondContact O-N 3.31Å; R699-S702 PolarHBondContact O-N 3.17Å; R699-S702 VanDerWaalsContact O-N 3.16Å; R699-S702 PolarHBondContact O-OG 3.27Å; R699-L703 HydrophobicContact CG-CD1 3.88Å; R699-L703 HydrophobicContact CG-CG 4.42Å; R699-L703 WeakPolarHBondContact O-CB 3.44Å; R699-L703 WeakPolarHBondContact O-CG 3.44Å; R699-L703 PolarHBondContact O-N 3.48Å
700	E	90.3	Very high	87.3	Confident	44 Å²	44	49 Å²	49	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-40.8	179.8	-65.5	-57.6	118.9	0	0	111.6	T666 I670 S696 S702 L703 W704	T666-E700 HydrophobicContact CG2-CB 4.12Å; T666-E700 HydrophobicContact CG2-CG 4.22Å; I670-E700 HydrophobicContact CD1-CB 3.74Å; S696-E700 WeakPolarHBondContact O-CG 3.26Å; S696-E700 PolarHBondContact O-N 3.29Å; E700-S702 PolarHBondContact O-N 2.95Å; E700-L703 PolarHBondContact O-N 3.17Å; E700-W704 WeakPolarHBondContact O-CB 3.26Å; E700-W704 VanDerWaalsContact O-CD1 3.28Å; E700-W704 PolarHBondContact O-N 3.34Å; E700-W704 VanDerWaalsContact OE2-CD1 3.29Å; E700-W704 PolarHBondContact OE2-NE1 3.18Å
701	L	92.2	Very high	87.6	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-57.4	-47.3	174	-79.2	162.4	0	0	0	111.7	I670 I687 W697 R699 L703 C705 V710 I738	I670-L701 HydrophobicContact CD1-CD2 4.19Å; I670-L701 HydrophobicContact CD1-CG 4.14Å; I670-L701 HydrophobicContact CG1-CD2 3.82Å; I670-L701 HydrophobicContact CG1-CG 4.27Å; I670-L701 HydrophobicContact CG2-CD2 4.4Å; I687-L701 HydrophobicContact CD1-CD1 4.17Å; W697-L701 VanDerWaalsContact O-CB 3.29Å; W697-L701 WeakPolarHBondContact O-CB 3.45Å; W697-L701 WeakPolarHBondContact O-CD1 3.48Å; W697-L701 VanDerWaalsContact O-CG 3.25Å; W697-L701 WeakPolarHBondContact O-CG 3.15Å; W697-L701 PolarHBondContact O-N 3.49Å; R699-L701 VanDerWaalsContact C-N 3.33Å; R699-L701 PolarHBondContact O-N 3.31Å; L701-L703 PolarHBondContact O-N 2.92Å; L701-C705 CarbonylContact O-C 3.55Å; L701-C705 PolarHBondContact O-N 3.25Å; L701-V710 HydrophobicContact CB-CG2 4.14Å; L701-V710 HydrophobicContact CD1-CG1 4.08Å; L701-V710 HydrophobicContact CD1-CG2 3.95Å; L701-V710 HydrophobicContact CD2-CG2 4.4Å; L701-V710 HydrophobicContact CG-CG2 4.39Å; L701-I738 HydrophobicContact CD2-CD1 3.75Å
702	S	91	Very high	88	Confident	72 Å²	72	48.5 Å²	48.5	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-67.4	-30.1	177.6	62.8	0	0	0	0	114.4	Q698 R699 E700	Q698-S702 PolarHBondContact O-N 3.35Å; Q698-S702 VanDerWaalsContact O-N 3.08Å; Q698-S702 PolarHBondContact O-OG 3.44Å; R699-S702 PolarHBondContact O-N 3.17Å; R699-S702 VanDerWaalsContact O-N 3.16Å; R699-S702 PolarHBondContact O-OG 3.27Å; E700-S702 PolarHBondContact O-N 2.95Å
703	L	88.7	Confident	88.6	Confident	59 Å²	59	46 Å²	46	31%	0.309	24%	0.239	S	C	.	.	H	α-helix	trans	-82.2	-37.9	-178.9	-74	174.3	0	0	0	113.2	N629 R699 E700 L701	N629-L703 WeakPolarHBondContact CB-O 3.37Å; N629-L703 PolarHBondContact ND2-O 3.19Å; R699-L703 HydrophobicContact CG-CD1 3.88Å; R699-L703 HydrophobicContact CG-CG 4.42Å; R699-L703 WeakPolarHBondContact O-CB 3.44Å; R699-L703 WeakPolarHBondContact O-CG 3.44Å; R699-L703 PolarHBondContact O-N 3.48Å; E700-L703 PolarHBondContact O-N 3.17Å; L701-L703 PolarHBondContact O-N 2.92Å
704	W	89.2	Confident	88.8	Confident	22 Å²	22	48.7 Å²	48.7	8%	0.083	25%	0.25	C	C	.	.	H	α-helix	trans	-94.1	-32.6	-175.5	-73.5	92.9	0	0	0	113.4	L628 N629 R632 L634 V667 I670 E700	L628-W704 CarbonylContact C-O 3.59Å; L628-W704 VanDerWaalsContact CA-O 3.27Å; L628-W704 WeakPolarHBondContact CA-O 3.42Å; L628-W704 HydrophobicContact CD2-CB 4.4Å; L628-W704 WeakPolarHBondContact CD2-O 3.36Å; N629-W704 PolarHBondContact N-O 2.98Å; R632-W704 HydrophobicContact CB-CD2 4.44Å; R632-W704 HydrophobicContact CB-CE3 3.83Å; R632-W704 HydrophobicContact CB-CH2 3.81Å; R632-W704 HydrophobicContact CB-CZ2 4.41Å; R632-W704 HydrophobicContact CB-CZ3 3.49Å; R632-W704 VanDerWaalsContact CB-CZ3 3.49Å; L634-W704 HydrophobicContact CD2-CH2 4.47Å; L634-W704 HydrophobicContact CD2-CZ3 4.01Å; V667-W704 HydrophobicContact CB-CZ2 4.36Å; V667-W704 HydrophobicContact CG1-CD2 3.86Å; V667-W704 HydrophobicContact CG1-CE3 3.92Å; V667-W704 HydrophobicContact CG1-CH2 3.64Å; V667-W704 HydrophobicContact CG1-CZ2 3.58Å; V667-W704 HydrophobicContact CG1-CZ3 3.8Å; V667-W704 HydrophobicContact CG2-CZ2 3.8Å; I670-W704 HydrophobicContact CG2-CB 3.99Å; E700-W704 WeakPolarHBondContact O-CB 3.26Å; E700-W704 VanDerWaalsContact O-CD1 3.28Å; E700-W704 PolarHBondContact O-N 3.34Å; E700-W704 VanDerWaalsContact OE2-CD1 3.29Å; E700-W704 PolarHBondContact OE2-NE1 3.18Å
705	C	88.7	Confident	88.6	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	27%	0.27	C	S	.	.			trans	-147	68.2	-173.8	-163.6	0	0	0	0	112.2	L628 I670 L701 H707 L708	L628-C705 HydrophobicContact CD2-CB 4.19Å; I670-C705 HydrophobicContact CG2-CB 3.94Å; L701-C705 CarbonylContact O-C 3.55Å; L701-C705 PolarHBondContact O-N 3.25Å; C705-H707 PolarHBondContact O-N 2.61Å; C705-H707 VanDerWaalsContact O-N 3.07Å; C705-L708 HydrophobicContact CB-CD1 3.9Å; C705-L708 HydrophobicContact CB-CG 4.45Å; C705-L708 PolarHBondContact O-N 2.76Å; C705-L708 WeakPolarHBondContact SG-CD1 3.16Å; C705-L708 VanDerWaalsContact SG-CG 3.58Å
706	P	86.6	Confident	88.7	Confident	83 Å²	83	49.5 Å²	49.5	54%	0.539	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.9	-173.9	26.5	-36	0	0	0	114.3	L708	P706-L708 VanDerWaalsContact C-N 3.27Å; P706-L708 PolarHBondContact O-N 2.81Å
707	H	85.3	Confident	88.8	Confident	129 Å²	129	50.7 Å²	50.7	60%	0.597	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-13.1	178	-64.9	-78	0	0	0	114.7	I627 C705	I627-H707 HydrophobicContact CD1-CB 3.7Å; I627-H707 HydrophobicContact CG1-CB 3.75Å; C705-H707 PolarHBondContact O-N 2.61Å; C705-H707 VanDerWaalsContact O-N 3.07Å
708	L	87.2	Confident	88.6	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	31%	0.314	C	S	.	.	S	Bend	trans	-86.4	122.7	-179	-69.8	170	0	0	0	111.5	W677 C705 P706 V710 N737 I738	W677-L708 HydrophobicContact CB-CD2 4.34Å; W677-L708 HydrophobicContact CG-CD2 4.04Å; C705-L708 HydrophobicContact CB-CD1 3.9Å; C705-L708 HydrophobicContact CB-CG 4.45Å; C705-L708 PolarHBondContact O-N 2.76Å; C705-L708 WeakPolarHBondContact SG-CD1 3.16Å; C705-L708 VanDerWaalsContact SG-CG 3.58Å; P706-L708 VanDerWaalsContact C-N 3.27Å; P706-L708 PolarHBondContact O-N 2.81Å; L708-V710 PolarHBondContact O-N 3.29Å; L708-N737 HydrophobicContact CD2-CB 4.04Å; L708-I738 HydrophobicContact CB-CD1 4.33Å; L708-I738 HydrophobicContact CD1-CD1 3.91Å
709	K	90.3	Very high	88.5	Confident	104 Å²	104	59.3 Å²	59.3	45%	0.452	32%	0.321	S	S	.	.			trans	-69.2	103.2	171.3	-68.6	-167.2	177.6	-170.3	0	110.3	D735 N737 I738	K709-D735 VanDerWaalsContact CD-O 3.3Å; K709-D735 WeakPolarHBondContact CD-O 3.41Å; K709-D735 IonicContact NZ-OD1 2.62Å; K709-D735 PolarHBondContact NZ-OD1 3.39Å; K709-D735 IonicContact NZ-OD2 2.84Å; K709-D735 PolarHBondContact NZ-OD2 3.38Å; K709-N737 WeakPolarHBondContact CB-OD1 3.43Å; K709-N737 PolarHBondContact N-OD1 3.01Å; K709-N737 PolarHBondContact O-N 3.09Å; K709-I738 PolarHBondContact O-N 3.4Å; K709-I738 VanDerWaalsContact O-N 3.1Å
710	V	92.6	Very high	88.6	Confident	46 Å²	46	56.2 Å²	56.2	28%	0.279	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.2	176.9	-176.4	0	0	0	0	110.7	L701 L708 V712 I738 L740	L701-V710 HydrophobicContact CB-CG2 4.14Å; L701-V710 HydrophobicContact CD1-CG1 4.08Å; L701-V710 HydrophobicContact CD1-CG2 3.95Å; L701-V710 HydrophobicContact CD2-CG2 4.4Å; L701-V710 HydrophobicContact CG-CG2 4.39Å; L708-V710 PolarHBondContact O-N 3.29Å; V710-V712 HydrophobicContact CG1-CG2 4.2Å; V710-I738 HydrophobicContact CG1-CG2 4.32Å; V710-I738 HydrophobicContact CG2-CB 4.29Å; V710-I738 HydrophobicContact CG2-CD1 4.34Å; V710-L740 HydrophobicContact CG1-CB 4.08Å
711	L	91.7	Very high	88.5	Confident	48 Å²	48	59.9 Å²	59.9	25%	0.251	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117.1	171.9	-179.9	57.4	0	0	0	110.3	I723 I727 F736 I738 L739 L740	L711-I723 HydrophobicContact CD1-CG2 4.22Å; L711-I723 HydrophobicContact CD2-CG2 4Å; L711-I723 HydrophobicContact CG-CG2 4.35Å; L711-I727 HydrophobicContact CD2-CD1 3.85Å; L711-I727 HydrophobicContact CD2-CG1 4.09Å; L711-F736 HydrophobicContact CB-CB 3.79Å; L711-F736 HydrophobicContact CB-CD1 4.11Å; L711-F736 HydrophobicContact CB-CD2 4.48Å; L711-F736 HydrophobicContact CB-CG 3.87Å; L711-F736 HydrophobicContact CD2-CD1 3.45Å; L711-F736 VanDerWaalsContact CD2-CD1 3.45Å; L711-F736 HydrophobicContact CD2-CE1 3.79Å; L711-F736 HydrophobicContact CD2-CG 4.1Å; L711-F736 HydrophobicContact CG-CD1 4.44Å; L711-I738 PolarHBondContact N-O 3.45Å; L711-L739 HydrophobicContact CB-CD1 4.07Å; L711-L739 HydrophobicContact CD2-CD1 3.87Å; L711-L739 HydrophobicContact CG-CD1 3.86Å; L711-L740 PolarHBondContact O-N 2.97Å
712	V	91.8	Very high	88.4	Confident	27 Å²	27	62.2 Å²	62.2	16%	0.164	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	105.8	-177	-167.8	0	0	0	0	110.7	Q694 Q698 V710 Q714 L740	Q694-V712 HydrophobicContact CG-CG1 4.49Å; Q694-V712 VanDerWaalsContact NE2-CG1 3.33Å; Q698-V712 HydrophobicContact CG-CG2 4.32Å; V710-V712 HydrophobicContact CG1-CG2 4.2Å; V712-Q714 HydrophobicContact CG1-CG 3.93Å; V712-Q714 PolarHBondContact O-N 3.38Å; V712-Q714 VanDerWaalsContact O-N 3.11Å; V712-L740 HydrophobicContact CG1-CD2 4.43Å; V712-L740 HydrophobicContact CG2-CD2 4.4Å
713	Y	89.9	Confident	88.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.328	C	S	.	.			trans	-86.4	82.5	-175.6	-166.4	-101.1	0	0	0	111.8	R720 I723 R724 L740 T741 V745 D752 L755 M756	Y713-R720 HydrophobicContact CE1-CG 4.41Å; Y713-R720 HydrophobicContact CE2-CB 4.26Å; Y713-R720 HydrophobicContact CE2-CG 4.46Å; Y713-I723 HydrophobicContact CD2-CB 4.23Å; Y713-I723 HydrophobicContact CD2-CG2 3.67Å; Y713-I723 HydrophobicContact CE2-CB 4.17Å; Y713-I723 HydrophobicContact CE2-CG2 3.95Å; Y713-R724 HydrophobicContact CE2-CG 4.19Å; Y713-R724 WeakPolarHBondContact OH-CD 3.45Å; Y713-R724 WeakPolarHBondContact OH-CG 3.35Å; Y713-R724 PolarHBondContact OH-NH1 2.99Å; Y713-L740 PolarHBondContact N-O 3.32Å; Y713-T741 PolarHBondContact O-OG1 3.21Å; Y713-V745 HydrophobicContact CD1-CG1 3.65Å; Y713-V745 HydrophobicContact CE1-CG1 3.68Å; Y713-D752 VanDerWaalsContact CE1-OD1 3.27Å; Y713-D752 WeakPolarHBondContact CE1-OD1 3.46Å; Y713-D752 PolarHBondContact OH-OD1 3.01Å; Y713-L755 HydrophobicContact CD2-CD2 4.31Å; Y713-L755 HydrophobicContact CE2-CD2 3.8Å; Y713-M756 HydrophobicContact CD1-CE 4.34Å
714	Q	85.8	Confident	88.2	Confident	73 Å²	73	58.1 Å²	58.1	34%	0.341	32%	0.315	S	S	.	.			trans	-142.1	-175.2	-179.9	67.2	-178.7	-8.4	0	0	113.4	V712 R720	V712-Q714 HydrophobicContact CG1-CG 3.93Å; V712-Q714 PolarHBondContact O-N 3.38Å; V712-Q714 VanDerWaalsContact O-N 3.11Å; Q714-R720 WeakPolarHBondContact O-CG 3.39Å
715	G	82.8	Confident	88	Confident	43 Å²	43	60.9 Å²	60.9	44%	0.443	33%	0.331	S	S	.	.	S	Bend	trans	94.8	-165.6	175.3	0	0	0	0	0	115.6	Q719 R720	G715-Q719 VanDerWaalsContact CA-OE1 3.26Å; G715-R720 PolarHBondContact O-NE 3.13Å; G715-R720 VanDerWaalsContact O-NE 3.15Å
716	S	85.7	Confident	87.9	Confident	46 Å²	46	68 Å²	68	32%	0.322	36%	0.362	S	S	.	.			trans	-60.7	167.2	-178.4	87.2	0	0	0	0	112.3	E718 Q719 R720	S716-E718 PolarHBondContact O-N 3.02Å; S716-E718 PolarHBondContact OG-N 2.97Å; S716-Q719 PolarHBondContact O-N 2.86Å; S716-Q719 PolarHBondContact OG-N 3.04Å; S716-R720 WeakPolarHBondContact O-CB 3.32Å; S716-R720 WeakPolarHBondContact O-CG 3.38Å; S716-R720 PolarHBondContact O-N 2.63Å; S716-R720 PolarHBondContact O-NE 2.84Å
717	A	85.7	Confident	87.8	Confident	65 Å²	65	64.8 Å²	64.8	54%	0.537	34%	0.341	S	S	.	.	H	α-helix	trans	-60.9	-32	174.3	0	0	0	0	0	112.1	K721	A717-K721 WeakPolarHBondContact O-CB 3.46Å; A717-K721 PolarHBondContact O-N 2.82Å
718	E	87.4	Confident	87.7	Confident	153 Å²	153	61.8 Å²	61.8	72%	0.715	32%	0.324	S	S	*	.	H	α-helix	trans	-76.2	-46.3	179	-62.2	148.5	169.9	0	0	111.5	S716 R720 K721 A722	S716-E718 PolarHBondContact O-N 3.02Å; S716-E718 PolarHBondContact OG-N 2.97Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.17Å; E718-K721 CarbonylContact O-C 3.56Å; E718-K721 WeakPolarHBondContact O-CA 3.27Å; E718-K721 WeakPolarHBondContact O-CB 3.37Å; E718-K721 PolarHBondContact O-N 3.28Å; E718-A722 PolarHBondContact O-N 3.45Å
719	Q	88.1	Confident	87.3	Confident	113 Å²	113	67.5 Å²	67.5	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-56.7	-46.1	174	-72.5	172.1	-38.2	0	0	110.5	G715 S716 K721 A722 I723	G715-Q719 VanDerWaalsContact CA-OE1 3.26Å; S716-Q719 PolarHBondContact O-N 2.86Å; S716-Q719 PolarHBondContact OG-N 3.04Å; Q719-K721 VanDerWaalsContact C-N 3.34Å; Q719-K721 PolarHBondContact O-N 3.47Å; Q719-A722 PolarHBondContact O-N 2.96Å; Q719-I723 WeakPolarHBondContact O-CG1 3.48Å; Q719-I723 PolarHBondContact O-N 2.79Å
720	R	90	Very high	86.5	Confident	38 Å²	38	64.4 Å²	64.4	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-69.3	-27.5	175.8	-66.8	-175.6	-63.7	110.6	-4.3	113.4	Y713 Q714 G715 S716 E718 R724 D752	Y713-R720 HydrophobicContact CE1-CG 4.41Å; Y713-R720 HydrophobicContact CE2-CB 4.26Å; Y713-R720 HydrophobicContact CE2-CG 4.46Å; Q714-R720 WeakPolarHBondContact O-CG 3.39Å; G715-R720 PolarHBondContact O-NE 3.13Å; G715-R720 VanDerWaalsContact O-NE 3.15Å; S716-R720 WeakPolarHBondContact O-CB 3.32Å; S716-R720 WeakPolarHBondContact O-CG 3.38Å; S716-R720 PolarHBondContact O-N 2.63Å; S716-R720 PolarHBondContact O-NE 2.84Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.17Å; R720-R724 WeakPolarHBondContact O-CB 3.47Å; R720-R724 WeakPolarHBondContact O-CG 3.33Å; R720-R724 PolarHBondContact O-N 3.18Å; R720-R724 PolarHBondContact O-NH1 3.15Å; R720-D752 IonicContact CZ-OD2 3.18Å; R720-D752 IonicContact NH1-OD1 3.95Å; R720-D752 PolarHBondContact NH1-OD1 3.08Å; R720-D752 IonicContact NH1-OD2 2.64Å; R720-D752 PolarHBondContact NH1-OD2 2.95Å
721	K	88.6	Confident	85.1	Confident	121 Å²	121	70.2 Å²	70.2	53%	0.526	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-45	170.3	-175	-175.4	176.3	-172.6	0	111	A717 E718 Q719 I723 R724 L725	A717-K721 WeakPolarHBondContact O-CB 3.46Å; A717-K721 PolarHBondContact O-N 2.82Å; E718-K721 CarbonylContact O-C 3.56Å; E718-K721 WeakPolarHBondContact O-CA 3.27Å; E718-K721 WeakPolarHBondContact O-CB 3.37Å; E718-K721 PolarHBondContact O-N 3.28Å; Q719-K721 VanDerWaalsContact C-N 3.34Å; Q719-K721 PolarHBondContact O-N 3.47Å; K721-I723 VanDerWaalsContact C-N 3.34Å; K721-I723 PolarHBondContact O-N 2.82Å; K721-R724 PolarHBondContact O-N 3.05Å; K721-L725 HydrophobicContact CG-CD1 4.42Å; K721-L725 WeakPolarHBondContact O-CG 3.4Å; K721-L725 PolarHBondContact O-N 2.93Å
722	A	88.6	Confident	83.7	Confident	51 Å²	51	73.7 Å²	73.7	42%	0.421	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-41.2	175.5	0	0	0	0	0	111.8	E718 Q719 L725 K726	E718-A722 PolarHBondContact O-N 3.45Å; Q719-A722 PolarHBondContact O-N 2.96Å; A722-L725 PolarHBondContact O-N 2.78Å; A722-K726 PolarHBondContact O-N 3.06Å; A722-K726 VanDerWaalsContact O-N 3.13Å
723	I	87.3	Confident	82.4	Confident	32 Å²	32	80.1 Å²	80.1	16%	0.164	42%	0.423	C	S	.	.	H	α-helix	trans	-64.9	-41.9	173.5	-60.8	161.8	0	0	0	111.2	L711 Y713 Q719 K721 L725 K726 I727	L711-I723 HydrophobicContact CD1-CG2 4.22Å; L711-I723 HydrophobicContact CD2-CG2 4Å; L711-I723 HydrophobicContact CG-CG2 4.35Å; Y713-I723 HydrophobicContact CD2-CB 4.23Å; Y713-I723 HydrophobicContact CD2-CG2 3.67Å; Y713-I723 HydrophobicContact CE2-CB 4.17Å; Y713-I723 HydrophobicContact CE2-CG2 3.95Å; Q719-I723 WeakPolarHBondContact O-CG1 3.48Å; Q719-I723 PolarHBondContact O-N 2.79Å; K721-I723 VanDerWaalsContact C-N 3.34Å; K721-I723 PolarHBondContact O-N 2.82Å; I723-L725 VanDerWaalsContact C-N 3.33Å; I723-L725 PolarHBondContact O-N 2.99Å; I723-K726 PolarHBondContact O-N 3.05Å; I723-I727 HydrophobicContact CG2-CD1 3.83Å; I723-I727 HydrophobicContact CG2-CG1 4.45Å; I723-I727 VanDerWaalsContact O-CG1 3.28Å; I723-I727 WeakPolarHBondContact O-CG1 3.41Å; I723-I727 PolarHBondContact O-N 3.49Å; I723-I727 VanDerWaalsContact O-N 3.16Å
724	R	88.4	Confident	81.5	Confident	13 Å²	13	82 Å²	82	5%	0.049	44%	0.435	C	S	.	.	H	α-helix	trans	-59	-41.8	174.3	-78.6	-173.1	-57.8	-86.4	6.2	112.6	Y713 R720 K721 I727 Y728 E751 D752 L755	Y713-R724 HydrophobicContact CE2-CG 4.19Å; Y713-R724 WeakPolarHBondContact OH-CD 3.45Å; Y713-R724 WeakPolarHBondContact OH-CG 3.35Å; Y713-R724 PolarHBondContact OH-NH1 2.99Å; R720-R724 WeakPolarHBondContact O-CB 3.47Å; R720-R724 WeakPolarHBondContact O-CG 3.33Å; R720-R724 PolarHBondContact O-N 3.18Å; R720-R724 PolarHBondContact O-NH1 3.15Å; K721-R724 PolarHBondContact O-N 3.05Å; R724-I727 PolarHBondContact O-N 2.75Å; R724-Y728 HydrophobicContact CB-CE2 4.24Å; R724-Y728 VanDerWaalsContact O-CD2 3.31Å; R724-Y728 WeakPolarHBondContact O-CD2 3.48Å; R724-Y728 PolarHBondContact O-N 2.67Å; R724-Y728 VanDerWaalsContact O-N 3.08Å; R724-E751 IonicContact CZ-OE2 2.65Å; R724-E751 IonicContact NE-OE2 3.11Å; R724-E751 PolarHBondContact NE-OE2 3.19Å; R724-E751 IonicContact NH2-OE2 2.99Å; R724-E751 PolarHBondContact NH2-OE2 2.76Å; R724-D752 IonicContact NH1-OD1 2.65Å; R724-D752 PolarHBondContact NH1-OD1 3.46Å; R724-L755 HydrophobicContact CG-CD1 4.45Å; R724-L755 HydrophobicContact CG-CD2 4.11Å
725	L	85.9	Confident	81.3	Confident	80 Å²	80	84.2 Å²	84.2	42%	0.419	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-50.1	178.1	-71.6	169.3	0	0	0	111.2	K721 A722 I723 I727 Y728 E729	K721-L725 HydrophobicContact CG-CD1 4.42Å; K721-L725 WeakPolarHBondContact O-CG 3.4Å; K721-L725 PolarHBondContact O-N 2.93Å; A722-L725 PolarHBondContact O-N 2.78Å; I723-L725 VanDerWaalsContact C-N 3.33Å; I723-L725 PolarHBondContact O-N 2.99Å; L725-I727 VanDerWaalsContact C-N 3.27Å; L725-I727 PolarHBondContact O-N 2.94Å; L725-Y728 CarbonylContact O-C 3.56Å; L725-Y728 WeakPolarHBondContact O-CA 3.47Å; L725-Y728 PolarHBondContact O-N 3.29Å; L725-E729 WeakPolarHBondContact O-CG 3.48Å; L725-E729 PolarHBondContact O-N 3.26Å
726	K	85.6	Confident	81.6	Confident	151 Å²	151	82.9 Å²	82.9	66%	0.657	43%	0.431	S	S	*	.	H	α-helix	trans	-54.8	-38.7	175.3	-70.1	-172.6	174.4	-164.7	0	113.8	A722 I723 Y728 E729 S730	A722-K726 PolarHBondContact O-N 3.06Å; A722-K726 VanDerWaalsContact O-N 3.13Å; I723-K726 PolarHBondContact O-N 3.05Å; K726-Y728 VanDerWaalsContact C-N 3.32Å; K726-E729 WeakPolarHBondContact CA-OE2 3.43Å; K726-S730 PolarHBondContact O-N 3.23Å; K726-S730 PolarHBondContact O-OG 3.47Å
727	I	85.2	Confident	81.7	Confident	16 Å²	16	81.9 Å²	81.9	8%	0.082	42%	0.422	C	S	.	.	H	α-helix	trans	-74.7	-22.1	177.6	-58	167.4	0	0	0	112.1	L711 I723 R724 L725 S730 F736 L755 V759	L711-I727 HydrophobicContact CD2-CD1 3.85Å; L711-I727 HydrophobicContact CD2-CG1 4.09Å; I723-I727 HydrophobicContact CG2-CD1 3.83Å; I723-I727 HydrophobicContact CG2-CG1 4.45Å; I723-I727 VanDerWaalsContact O-CG1 3.28Å; I723-I727 WeakPolarHBondContact O-CG1 3.41Å; I723-I727 PolarHBondContact O-N 3.49Å; I723-I727 VanDerWaalsContact O-N 3.16Å; R724-I727 PolarHBondContact O-N 2.75Å; L725-I727 VanDerWaalsContact C-N 3.27Å; L725-I727 PolarHBondContact O-N 2.94Å; I727-S730 PolarHBondContact O-OG 3.18Å; I727-F736 HydrophobicContact CD1-CE1 4.16Å; I727-F736 HydrophobicContact CG1-CE1 4.01Å; I727-F736 HydrophobicContact CG2-CE1 4.36Å; I727-L755 HydrophobicContact CB-CD1 4.18Å; I727-L755 HydrophobicContact CD1-CD1 4.18Å; I727-L755 HydrophobicContact CD1-CD2 4.13Å; I727-L755 HydrophobicContact CG2-CD1 3.85Å; I727-V759 HydrophobicContact CG2-CG2 4.06Å
728	Y	82.3	Confident	82.1	Confident	65 Å²	65	78.8 Å²	78.8	26%	0.255	40%	0.397	S	S	.	.	H	α-helix	trans	-88.3	-26	174.7	-63.7	-22.2	0	0	0	113.1	R724 L725 K726 L755	R724-Y728 HydrophobicContact CB-CE2 4.24Å; R724-Y728 VanDerWaalsContact O-CD2 3.31Å; R724-Y728 WeakPolarHBondContact O-CD2 3.48Å; R724-Y728 PolarHBondContact O-N 2.67Å; R724-Y728 VanDerWaalsContact O-N 3.08Å; L725-Y728 CarbonylContact O-C 3.56Å; L725-Y728 WeakPolarHBondContact O-CA 3.47Å; L725-Y728 PolarHBondContact O-N 3.29Å; K726-Y728 VanDerWaalsContact C-N 3.32Å; Y728-L755 HydrophobicContact CD1-CD1 4.38Å; Y728-L755 HydrophobicContact CE1-CD1 3.64Å
729	E	80	Confident	82.4	Confident	133 Å²	133	71.6 Å²	71.6	62%	0.621	36%	0.363	S	S	*	.	H	α-helix	trans	-72.2	-30.8	172.6	-71.2	152.8	-162.9	0	0	111.8	L725 K726 E731	L725-E729 WeakPolarHBondContact O-CG 3.48Å; L725-E729 PolarHBondContact O-N 3.26Å; K726-E729 WeakPolarHBondContact CA-OE2 3.43Å; E729-E731 VanDerWaalsContact C-N 3.32Å; E729-E731 PolarHBondContact O-N 2.71Å
730	S	73.3	Confident	82.7	Confident	38 Å²	38	66.2 Å²	66.2	27%	0.266	34%	0.338	S	S	.	.			trans	-77.9	74.9	172	65	0	0	0	0	111.5	K726 I727 S732 Q733	K726-S730 PolarHBondContact O-N 3.23Å; K726-S730 PolarHBondContact O-OG 3.47Å; I727-S730 PolarHBondContact O-OG 3.18Å; S730-S732 PolarHBondContact O-N 2.96Å; S730-Q733 WeakPolarHBondContact CB-O 3.31Å
731	E	62.8	Low	82.9	Confident	169 Å²	169	64.4 Å²	64.4	79%	0.79	33%	0.331	S	S	*	.			trans	-64.9	-31.4	-166.3	-64.2	-158	125.5	0	0	115.7	E729	E729-E731 VanDerWaalsContact C-N 3.32Å; E729-E731 PolarHBondContact O-N 2.71Å
732	S	61.6	Low	83	Confident	121 Å²	121	58.6 Å²	58.6	85%	0.846	31%	0.306	S	S	*	.	S	Bend	trans	-105.9	-38.5	-174	-55.3	0	0	0	0	115.2	S730	S730-S732 PolarHBondContact O-N 2.96Å
733	Q	66	Low	83	Confident	162 Å²	162	56.4 Å²	56.4	76%	0.757	29%	0.287	S	S	*	.	S	Bend	trans	-144.8	137.3	175.3	-66.9	-170.8	4.4	0	0	110.1	S730	S730-Q733 WeakPolarHBondContact CB-O 3.31Å
734	P	69.7	Low	83	Confident	39 Å²	39	56.9 Å²	56.9	25%	0.253	30%	0.296	S	S	.	.			trans	-73.5	138.7	175.5	28.9	-32.4	0	0	0	111.6	P684 F736	P684-P734 HydrophobicContact CB-CG 3.87Å; P684-P734 HydrophobicContact CG-CG 3.92Å; P734-F736 HydrophobicContact CB-CD1 3.74Å; P734-F736 HydrophobicContact CB-CE1 3.4Å; P734-F736 VanDerWaalsContact CB-CE1 3.4Å; P734-F736 HydrophobicContact CB-CE2 4.36Å; P734-F736 HydrophobicContact CB-CG 4.37Å; P734-F736 HydrophobicContact CB-CZ 3.75Å; P734-F736 HydrophobicContact CG-CE1 4.38Å; P734-F736 HydrophobicContact CG-CZ 4.27Å; P734-F736 PolarHBondContact O-N 2.89Å
735	D	82.7	Confident	82.9	Confident	120 Å²	120	57.5 Å²	57.5	64%	0.642	30%	0.301	S	S	*	.	S	Bend	trans	-76.2	35.6	176.8	-165.2	44.7	0	0	0	113.9	K709	K709-D735 VanDerWaalsContact CD-O 3.3Å; K709-D735 WeakPolarHBondContact CD-O 3.41Å; K709-D735 IonicContact NZ-OD1 2.62Å; K709-D735 PolarHBondContact NZ-OD1 3.39Å; K709-D735 IonicContact NZ-OD2 2.84Å; K709-D735 PolarHBondContact NZ-OD2 3.38Å
736	F	87.8	Confident	82.8	Confident	14 Å²	14	53.8 Å²	53.8	6%	0.061	28%	0.282	C	S	.	.			trans	-144.6	140.9	176.1	64.5	-97.2	0	0	0	111.2	P684 L711 I727 P734 L739 F761	P684-F736 HydrophobicContact CB-CD2 4.49Å; P684-F736 HydrophobicContact CB-CE2 3.87Å; L711-F736 HydrophobicContact CB-CB 3.79Å; L711-F736 HydrophobicContact CB-CD1 4.11Å; L711-F736 HydrophobicContact CB-CD2 4.48Å; L711-F736 HydrophobicContact CB-CG 3.87Å; L711-F736 HydrophobicContact CD2-CD1 3.45Å; L711-F736 VanDerWaalsContact CD2-CD1 3.45Å; L711-F736 HydrophobicContact CD2-CE1 3.79Å; L711-F736 HydrophobicContact CD2-CG 4.1Å; L711-F736 HydrophobicContact CG-CD1 4.44Å; I727-F736 HydrophobicContact CD1-CE1 4.16Å; I727-F736 HydrophobicContact CG1-CE1 4.01Å; I727-F736 HydrophobicContact CG2-CE1 4.36Å; P734-F736 HydrophobicContact CB-CD1 3.74Å; P734-F736 HydrophobicContact CB-CE1 3.4Å; P734-F736 VanDerWaalsContact CB-CE1 3.4Å; P734-F736 HydrophobicContact CB-CE2 4.36Å; P734-F736 HydrophobicContact CB-CG 4.37Å; P734-F736 HydrophobicContact CB-CZ 3.75Å; P734-F736 HydrophobicContact CG-CE1 4.38Å; P734-F736 HydrophobicContact CG-CZ 4.27Å; P734-F736 PolarHBondContact O-N 2.89Å; F736-L739 HydrophobicContact CD2-CB 4.2Å; F736-L739 HydrophobicContact CE2-CB 3.67Å; F736-L739 HydrophobicContact CE2-CD1 4.37Å; F736-L739 HydrophobicContact CE2-CG 4.5Å; F736-L739 HydrophobicContact CZ-CB 4.24Å; F736-L739 HydrophobicContact CZ-CD1 4.26Å; F736-F761 HydrophobicContact CE2-CE1 4.42Å
737	N	89.8	Confident	82.7	Confident	26 Å²	26	47.1 Å²	47.1	14%	0.139	25%	0.254	C	S	.	.	S	Bend	trans	-81.5	-34.2	173	-54.1	110.6	0	0	0	110.9	R682 H685 L708 K709	R682-N737 PolarHBondContact O-ND2 3.25Å; H685-N737 PolarHBondContact CD2-O 3.08Å; H685-N737 PolarHBondContact N-O 3.16Å; L708-N737 HydrophobicContact CD2-CB 4.04Å; K709-N737 WeakPolarHBondContact CB-OD1 3.43Å; K709-N737 PolarHBondContact N-OD1 3.01Å; K709-N737 PolarHBondContact O-N 3.09Å
738	I	93.5	Very high	82.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	127.7	-174.8	-64.3	171.4	0	0	0	110.4	L673 H685 I687 L701 L708 K709 V710 L711	L673-I738 HydrophobicContact CD1-CD1 3.74Å; L673-I738 HydrophobicContact CD1-CG1 4.31Å; H685-I738 HydrophobicContact CB-CG1 4.38Å; H685-I738 CarbonylContact O-C 3.51Å; H685-I738 WeakPolarHBondContact O-CA 3.07Å; I687-I738 HydrophobicContact CD1-CG2 3.66Å; I687-I738 HydrophobicContact CG1-CG2 3.92Å; L701-I738 HydrophobicContact CD2-CD1 3.75Å; L708-I738 HydrophobicContact CB-CD1 4.33Å; L708-I738 HydrophobicContact CD1-CD1 3.91Å; K709-I738 PolarHBondContact O-N 3.4Å; K709-I738 VanDerWaalsContact O-N 3.1Å; V710-I738 HydrophobicContact CG1-CG2 4.32Å; V710-I738 HydrophobicContact CG2-CB 4.29Å; V710-I738 HydrophobicContact CG2-CD1 4.34Å; L711-I738 PolarHBondContact N-O 3.45Å
739	L	93.7	Very high	82.4	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.4	163.9	-167.5	67.9	0	0	0	109.2	H685 L686 I687 L711 F736 M756 F761	H685-L739 PolarHBondContact O-N 3.11Å; L686-L739 HydrophobicContact CD1-CB 4.19Å; L686-L739 HydrophobicContact CD1-CD2 4.14Å; L686-L739 HydrophobicContact CD1-CG 4.37Å; I687-L739 PolarHBondContact N-O 2.94Å; L711-L739 HydrophobicContact CB-CD1 4.07Å; L711-L739 HydrophobicContact CD2-CD1 3.87Å; L711-L739 HydrophobicContact CG-CD1 3.86Å; F736-L739 HydrophobicContact CD2-CB 4.2Å; F736-L739 HydrophobicContact CE2-CB 3.67Å; F736-L739 HydrophobicContact CE2-CD1 4.37Å; F736-L739 HydrophobicContact CE2-CG 4.5Å; F736-L739 HydrophobicContact CZ-CB 4.24Å; F736-L739 HydrophobicContact CZ-CD1 4.26Å; L739-M756 HydrophobicContact CD2-CE 3.65Å; L739-M756 HydrophobicContact CD2-SD 4.04Å; L739-F761 HydrophobicContact CB-CE1 4.02Å; L739-F761 HydrophobicContact CD2-CE1 3.97Å; L739-F761 HydrophobicContact CD2-CZ 3.68Å
740	L	94.3	Very high	82.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.2	175.2	178.6	61.7	0	0	0	109.6	I687 Q694 W697 Q698 V710 L711 V712 Y713	I687-L740 HydrophobicContact CB-CD1 3.86Å; I687-L740 HydrophobicContact CG2-CD1 3.68Å; Q694-L740 HydrophobicContact CG-CD2 4.19Å; Q694-L740 HydrophobicContact CG-CG 4.19Å; W697-L740 HydrophobicContact CB-CD1 3.99Å; W697-L740 HydrophobicContact CB-CD2 4.03Å; W697-L740 HydrophobicContact CG-CD1 4.44Å; Q698-L740 HydrophobicContact CB-CD2 4.1Å; V710-L740 HydrophobicContact CG1-CB 4.08Å; L711-L740 PolarHBondContact O-N 2.97Å; V712-L740 HydrophobicContact CG1-CD2 4.43Å; V712-L740 HydrophobicContact CG2-CD2 4.4Å; Y713-L740 PolarHBondContact N-O 3.32Å
741	T	92.9	Very high	83	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	175.6	177.6	-159.3	0	0	0	0	112.1	L686 I687 I688 C689 Y713 M756	L686-T741 HydrophobicContact CD1-CG2 4.13Å; I687-T741 PolarHBondContact O-N 3.15Å; I688-T741 WeakPolarHBondContact CA-O 3.35Å; I688-T741 HydrophobicContact CG1-CG2 4.15Å; C689-T741 PolarHBondContact N-O 2.86Å; C689-T741 VanDerWaalsContact N-O 3.08Å; C689-T741 PolarHBondContact SG-O 3Å; C689-T741 VanDerWaalsContact SG-O 3.39Å; Y713-T741 PolarHBondContact O-OG1 3.21Å; T741-M756 HydrophobicContact CG2-CE 3.93Å
742	S	91.3	Very high	84.1	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	155	176.7	97.2	0	0	0	0	113.7	C689 S691 A744 V745 G746	C689-S742 WeakPolarHBondContact O-CA 3.03Å; C689-S742 WeakPolarHBondContact O-CB 3.25Å; S691-S742 WeakPolarHBondContact OG-CB 3.2Å; S691-S742 PolarHBondContact OG-OG 3.44Å; S742-A744 PolarHBondContact O-N 2.96Å; S742-A744 VanDerWaalsContact O-N 3.12Å; S742-A744 PolarHBondContact OG-N 3.42Å; S742-V745 PolarHBondContact O-N 3.28Å; S742-V745 VanDerWaalsContact O-N 3.14Å; S742-V745 PolarHBondContact OG-N 2.87Å; S742-G746 PolarHBondContact O-N 3.02Å
743	Y	89.3	Confident	85.2	Confident	4 Å²	4	40 Å²	40	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-50.8	-34.8	172.4	-72.9	-65.1	0	0	0	113.4	I688 C689 T747 F766 D767 M771 L772 R779 L783	I688-Y743 HydrophobicContact CB-CE1 4.42Å; I688-Y743 HydrophobicContact CG2-CD1 3.48Å; I688-Y743 VanDerWaalsContact CG2-CD1 3.48Å; I688-Y743 HydrophobicContact CG2-CD2 4.3Å; I688-Y743 HydrophobicContact CG2-CE1 3.71Å; I688-Y743 HydrophobicContact CG2-CE2 4.49Å; I688-Y743 HydrophobicContact CG2-CG 3.81Å; C689-Y743 WeakPolarHBondContact O-CD2 3.14Å; C689-Y743 PolarHBondContact O-N 3.23Å; C689-Y743 VanDerWaalsContact O-N 3.1Å; Y743-T747 WeakPolarHBondContact O-CB 2.97Å; Y743-T747 WeakPolarHBondContact O-CG2 2.81Å; Y743-T747 PolarHBondContact O-OG1 3.4Å; Y743-F766 HydrophobicContact CE1-CD1 4.48Å; Y743-D767 WeakPolarHBondContact CE2-O 3.4Å; Y743-D767 PolarHBondContact OH-O 2.85Å; Y743-M771 HydrophobicContact CD2-CB 4.41Å; Y743-M771 HydrophobicContact CD2-CE 3.71Å; Y743-M771 HydrophobicContact CD2-SD 3.47Å; Y743-M771 WeakPolarHBondContact CD2-SD 3.37Å; Y743-M771 HydrophobicContact CE2-CB 4.06Å; Y743-M771 HydrophobicContact CE2-CE 4.41Å; Y743-M771 HydrophobicContact CE2-CG 4.34Å; Y743-M771 HydrophobicContact CE2-SD 3.67Å; Y743-M771 HydrophobicContact CG-CE 4.08Å; Y743-M771 HydrophobicContact CG-SD 4.38Å; Y743-L772 HydrophobicContact CE1-CD2 3.95Å; Y743-R779 HydrophobicContact CD1-CG 4.47Å; Y743-L783 HydrophobicContact CD1-CD1 3.8Å; Y743-L783 HydrophobicContact CE1-CD1 3.82Å
744	A	86.1	Confident	86.1	Confident	43 Å²	43	35.6 Å²	35.6	36%	0.355	20%	0.202	S	C	.	.	H	α-helix	trans	-74	-47.4	179.6	0	0	0	0	0	111.2	S742 S748	S742-A744 PolarHBondContact O-N 2.96Å; S742-A744 VanDerWaalsContact O-N 3.12Å; S742-A744 PolarHBondContact OG-N 3.42Å; A744-S748 WeakPolarHBondContact O-CB 3.32Å; A744-S748 PolarHBondContact O-N 3.04Å; A744-S748 VanDerWaalsContact O-N 3.15Å; A744-S748 PolarHBondContact O-OG 3.09Å
745	V	86.9	Confident	86.8	Confident	26 Å²	26	33.7 Å²	33.7	16%	0.158	19%	0.19	C	C	.	.	H	α-helix	trans	-67.7	-56.8	-177.6	-179.5	0	0	0	0	110.6	Y713 S742 T747 S748	Y713-V745 HydrophobicContact CD1-CG1 3.65Å; Y713-V745 HydrophobicContact CE1-CG1 3.68Å; S742-V745 PolarHBondContact O-N 3.28Å; S742-V745 VanDerWaalsContact O-N 3.14Å; S742-V745 PolarHBondContact OG-N 2.87Å; V745-T747 PolarHBondContact O-N 3.35Å; V745-T747 VanDerWaalsContact O-N 3.07Å; V745-S748 PolarHBondContact O-N 2.85Å; V745-S748 VanDerWaalsContact O-N 3.14Å
746	G	83.4	Confident	87	Confident	1 Å²	1	28 Å²	28	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-23.3	-175.3	0	0	0	0	0	114.6	S742 F786	S742-G746 PolarHBondContact O-N 3.02Å; G746-F786 WeakPolarHBondContact O-CZ 3.17Å
747	T	84.1	Confident	86.8	Confident	11 Å²	11	31.8 Å²	31.8	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-105.1	-4.3	178.7	72.9	0	0	0	0	115	Y743 V745 R753 R779 N782 L783	Y743-T747 WeakPolarHBondContact O-CB 2.97Å; Y743-T747 WeakPolarHBondContact O-CG2 2.81Å; Y743-T747 PolarHBondContact O-OG1 3.4Å; V745-T747 PolarHBondContact O-N 3.35Å; V745-T747 VanDerWaalsContact O-N 3.07Å; T747-R753 VanDerWaalsContact O-CZ 3.23Å; T747-R753 PolarHBondContact O-NE 2.86Å; T747-R753 PolarHBondContact O-NH2 3.21Å; T747-R779 HydrophobicContact CG2-CG 4.34Å; T747-N782 HydrophobicContact CG2-CB 3.95Å; T747-N782 PolarHBondContact O-ND2 3.46Å; T747-L783 HydrophobicContact CG2-CD2 3.64Å; T747-L783 HydrophobicContact CG2-CG 3.83Å
748	S	79.5	Confident	86.6	Confident	63 Å²	63	37.4 Å²	37.4	44%	0.441	20%	0.195	S	C	.	.	H	α-helix	trans	-77.9	-76.7	-175.4	-76.5	0	0	0	0	114	A744 V745 R753	A744-S748 WeakPolarHBondContact O-CB 3.32Å; A744-S748 PolarHBondContact O-N 3.04Å; A744-S748 VanDerWaalsContact O-N 3.15Å; A744-S748 PolarHBondContact O-OG 3.09Å; V745-S748 PolarHBondContact O-N 2.85Å; V745-S748 VanDerWaalsContact O-N 3.14Å; S748-R753 PolarHBondContact O-NH2 3Å
749	A	81.6	Confident	86.2	Confident	35 Å²	35	38.3 Å²	38.3	29%	0.289	20%	0.201	S	C	.	.	S	Bend	trans	-81.2	157.3	-172.4	0	0	0	0	0	112.2	E751 D752 R753	A749-E751 VanDerWaalsContact C-N 3.29Å; A749-E751 PolarHBondContact O-N 2.91Å; A749-D752 WeakPolarHBondContact CB-OD2 3.5Å; A749-D752 PolarHBondContact N-OD2 2.94Å; A749-D752 PolarHBondContact O-N 3.14Å; A749-R753 WeakPolarHBondContact O-CG 3.45Å; A749-R753 PolarHBondContact O-N 3.33Å
750	I	82.4	Confident	85.9	Confident	133 Å²	133	42.7 Å²	42.7	68%	0.682	22%	0.224	S	C	*	.	H	α-helix	trans	-63.2	-40.1	175.8	-59.9	174.2	0	0	0	110	D752 R753 T754	I750-D752 VanDerWaalsContact C-N 3.32Å; I750-D752 PolarHBondContact O-N 2.62Å; I750-R753 PolarHBondContact O-N 3.43Å; I750-T754 PolarHBondContact O-N 3.08Å; I750-T754 PolarHBondContact O-OG1 2.85Å
751	E	83.1	Confident	85.8	Confident	103 Å²	103	42.7 Å²	42.7	48%	0.481	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-31.6	176.6	-63.9	173.5	-115.9	0	0	114.1	R724 A749 T754 L755	R724-E751 IonicContact CZ-OE2 2.65Å; R724-E751 IonicContact NE-OE2 3.11Å; R724-E751 PolarHBondContact NE-OE2 3.19Å; R724-E751 IonicContact NH2-OE2 2.99Å; R724-E751 PolarHBondContact NH2-OE2 2.76Å; A749-E751 VanDerWaalsContact C-N 3.29Å; A749-E751 PolarHBondContact O-N 2.91Å; E751-T754 WeakPolarHBondContact CA-OG1 3.2Å; E751-T754 PolarHBondContact O-OG1 3.33Å; E751-T754 VanDerWaalsContact O-OG1 3.09Å; E751-L755 PolarHBondContact O-N 2.78Å
752	D	85.8	Confident	85.7	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-72.1	-41.6	174.9	-60.2	-49.4	0	0	0	109.8	Y713 R720 R724 A749 I750 T754 L755 M756	Y713-D752 VanDerWaalsContact CE1-OD1 3.27Å; Y713-D752 WeakPolarHBondContact CE1-OD1 3.46Å; Y713-D752 PolarHBondContact OH-OD1 3.01Å; R720-D752 IonicContact CZ-OD2 3.18Å; R720-D752 IonicContact NH1-OD1 3.95Å; R720-D752 PolarHBondContact NH1-OD1 3.08Å; R720-D752 IonicContact NH1-OD2 2.64Å; R720-D752 PolarHBondContact NH1-OD2 2.95Å; R724-D752 IonicContact NH1-OD1 2.65Å; R724-D752 PolarHBondContact NH1-OD1 3.46Å; A749-D752 WeakPolarHBondContact CB-OD2 3.5Å; A749-D752 PolarHBondContact N-OD2 2.94Å; A749-D752 PolarHBondContact O-N 3.14Å; I750-D752 VanDerWaalsContact C-N 3.32Å; I750-D752 PolarHBondContact O-N 2.62Å; D752-T754 PolarHBondContact O-N 3.18Å; D752-L755 PolarHBondContact O-N 3.03Å; D752-M756 VanDerWaalsContact O-CG 3.26Å; D752-M756 WeakPolarHBondContact O-CG 3.49Å; D752-M756 PolarHBondContact O-N 3.03Å; D752-M756 VanDerWaalsContact O-N 3.16Å
753	R	84.9	Confident	85.9	Confident	57 Å²	57	47.4 Å²	47.4	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-68.9	-28.4	176.9	-62.2	174.5	-163.7	177.6	6.1	113.2	T747 S748 A749 I750 K757 N782	T747-R753 VanDerWaalsContact O-CZ 3.23Å; T747-R753 PolarHBondContact O-NE 2.86Å; T747-R753 PolarHBondContact O-NH2 3.21Å; S748-R753 PolarHBondContact O-NH2 3Å; A749-R753 WeakPolarHBondContact O-CG 3.45Å; A749-R753 PolarHBondContact O-N 3.33Å; I750-R753 PolarHBondContact O-N 3.43Å; R753-K757 WeakPolarHBondContact O-CB 3.47Å; R753-K757 VanDerWaalsContact O-CG 3.26Å; R753-K757 WeakPolarHBondContact O-CG 3.44Å; R753-K757 PolarHBondContact O-N 3.12Å; R753-N782 PolarHBondContact NE-ND2 3.17Å; R753-N782 PolarHBondContact NH1-OD1 2.76Å; R753-N782 PolarHBondContact NH2-ND2 3.45Å
754	T	84.8	Confident	86.1	Confident	70 Å²	70	47.2 Å²	47.2	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-76.1	-37.7	175.2	51	0	0	0	0	111.8	I750 E751 D752 K757 R758	I750-T754 PolarHBondContact O-N 3.08Å; I750-T754 PolarHBondContact O-OG1 2.85Å; E751-T754 WeakPolarHBondContact CA-OG1 3.2Å; E751-T754 PolarHBondContact O-OG1 3.33Å; E751-T754 VanDerWaalsContact O-OG1 3.09Å; D752-T754 PolarHBondContact O-N 3.18Å; T754-K757 PolarHBondContact O-N 3.21Å; T754-R758 PolarHBondContact O-N 2.89Å
755	L	84.7	Confident	86.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-55.5	-53.2	170	-179	72.8	0	0	0	111	Y713 R724 I727 Y728 E751 D752 K757 R758 V759	Y713-L755 HydrophobicContact CD2-CD2 4.31Å; Y713-L755 HydrophobicContact CE2-CD2 3.8Å; R724-L755 HydrophobicContact CG-CD1 4.45Å; R724-L755 HydrophobicContact CG-CD2 4.11Å; I727-L755 HydrophobicContact CB-CD1 4.18Å; I727-L755 HydrophobicContact CD1-CD1 4.18Å; I727-L755 HydrophobicContact CD1-CD2 4.13Å; I727-L755 HydrophobicContact CG2-CD1 3.85Å; Y728-L755 HydrophobicContact CD1-CD1 4.38Å; Y728-L755 HydrophobicContact CE1-CD1 3.64Å; E751-L755 PolarHBondContact O-N 2.78Å; D752-L755 PolarHBondContact O-N 3.03Å; L755-K757 PolarHBondContact O-N 2.94Å; L755-R758 PolarHBondContact O-N 2.81Å; L755-V759 HydrophobicContact CD1-CG2 4.25Å; L755-V759 PolarHBondContact O-N 2.84Å
756	M	86.2	Confident	86.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-5.2	-179.2	-58.5	-69.2	173	0	0	114.4	L686 Y713 L739 T741 D752 F761 F786 R787	L686-M756 HydrophobicContact CD1-CE 4.39Å; L686-M756 HydrophobicContact CD1-SD 4Å; L686-M756 HydrophobicContact CD2-SD 4.33Å; Y713-M756 HydrophobicContact CD1-CE 4.34Å; L739-M756 HydrophobicContact CD2-CE 3.65Å; L739-M756 HydrophobicContact CD2-SD 4.04Å; T741-M756 HydrophobicContact CG2-CE 3.93Å; D752-M756 VanDerWaalsContact O-CG 3.26Å; D752-M756 WeakPolarHBondContact O-CG 3.49Å; D752-M756 PolarHBondContact O-N 3.03Å; D752-M756 VanDerWaalsContact O-N 3.16Å; M756-F761 HydrophobicContact SD-CE2 4.01Å; M756-F761 HydrophobicContact SD-CZ 4.02Å; M756-F786 HydrophobicContact CB-CD1 3.76Å; M756-F786 HydrophobicContact CB-CD2 3.89Å; M756-F786 HydrophobicContact CB-CE1 3.59Å; M756-F786 HydrophobicContact CB-CE2 3.7Å; M756-F786 HydrophobicContact CB-CG 3.92Å; M756-F786 HydrophobicContact CB-CZ 3.55Å; M756-F786 HydrophobicContact CG-CD2 4.35Å; M756-F786 HydrophobicContact CG-CE1 4.21Å; M756-F786 HydrophobicContact CG-CE2 3.75Å; M756-F786 HydrophobicContact CG-CZ 3.67Å; M756-F786 HydrophobicContact SD-CE2 4.17Å; M756-R787 PolarHBondContact O-N 2.67Å
757	K	84.9	Confident	87.4	Confident	93 Å²	93	44.7 Å²	44.7	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-102.4	-22.3	170.7	-80.3	-178.8	170	-154.6	0	113.7	R753 T754 L755 N785 R787	R753-K757 WeakPolarHBondContact O-CB 3.47Å; R753-K757 VanDerWaalsContact O-CG 3.26Å; R753-K757 WeakPolarHBondContact O-CG 3.44Å; R753-K757 PolarHBondContact O-N 3.12Å; T754-K757 PolarHBondContact O-N 3.21Å; L755-K757 PolarHBondContact O-N 2.94Å; K757-N785 WeakPolarHBondContact CE-O 3.5Å; K757-N785 WeakPolarHBondContact CG-O 3.47Å; K757-R787 VanDerWaalsContact O-CD 3.28Å; K757-R787 WeakPolarHBondContact O-CD 3.45Å; K757-R787 PolarHBondContact O-NE 2.78Å
758	R	84.4	Confident	87.5	Confident	144 Å²	144	45.3 Å²	45.3	54%	0.543	22%	0.223	S	C	.	.	H	α-helix	trans	-86.4	-41.7	179.5	-173	178.5	179	-172.5	-1.5	111.3	T754 L755	T754-R758 PolarHBondContact O-N 2.89Å; L755-R758 PolarHBondContact O-N 2.81Å
759	V	85.5	Confident	87.8	Confident	19 Å²	19	42.3 Å²	42.3	12%	0.115	20%	0.202	C	C	.	.	S	Bend	trans	-75.4	127.7	175.7	-175.6	0	0	0	0	109.5	P684 I727 L755 F761	P684-V759 HydrophobicContact CG-CG1 4.12Å; I727-V759 HydrophobicContact CG2-CG2 4.06Å; L755-V759 HydrophobicContact CD1-CG2 4.25Å; L755-V759 PolarHBondContact O-N 2.84Å; V759-F761 HydrophobicContact CB-CD2 4.4Å; V759-F761 HydrophobicContact CB-CE1 4.26Å; V759-F761 HydrophobicContact CB-CE2 3.78Å; V759-F761 HydrophobicContact CB-CZ 3.71Å; V759-F761 HydrophobicContact CG1-CD1 3.91Å; V759-F761 HydrophobicContact CG1-CD2 4.22Å; V759-F761 HydrophobicContact CG1-CE1 3.54Å; V759-F761 HydrophobicContact CG1-CE2 3.88Å; V759-F761 HydrophobicContact CG1-CG 4.25Å; V759-F761 HydrophobicContact CG1-CZ 3.53Å; V759-F761 HydrophobicContact CG2-CZ 4.44Å
760	N	88.4	Confident	87.6	Confident	93 Å²	93	43 Å²	43	50%	0.497	20%	0.199	S	C	.	.			trans	-92	102.5	173.8	-63.3	-21.4	0	0	0	108.6	R787	N760-R787 WeakPolarHBondContact OD1-CD 3.31Å; N760-R787 PolarHBondContact OD1-NH1 3.16Å
761	F	91.5	Very high	87.4	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.8	179.8	-59.4	-81.4	0	0	0	111.6	P684 L686 F736 L739 M756 V759 R787 V788 Q789	P684-F761 HydrophobicContact CB-CD1 4.17Å; P684-F761 HydrophobicContact CG-CD1 4.43Å; P684-F761 CarbonylContact O-C 3.32Å; P684-F761 WeakPolarHBondContact O-CA 3.25Å; L686-F761 HydrophobicContact CB-CB 4.17Å; L686-F761 HydrophobicContact CB-CD1 3.67Å; L686-F761 HydrophobicContact CB-CD2 4.17Å; L686-F761 HydrophobicContact CB-CE1 4.01Å; L686-F761 HydrophobicContact CB-CE2 4.47Å; L686-F761 HydrophobicContact CB-CG 3.75Å; L686-F761 HydrophobicContact CB-CZ 4.39Å; L686-F761 HydrophobicContact CD1-CE1 4.32Å; L686-F761 HydrophobicContact CD1-CZ 4.16Å; L686-F761 HydrophobicContact CD2-CD2 3.98Å; L686-F761 HydrophobicContact CD2-CE2 4.01Å; L686-F761 HydrophobicContact CD2-CG 4.4Å; L686-F761 HydrophobicContact CD2-CZ 4.45Å; F736-F761 HydrophobicContact CE2-CE1 4.42Å; L739-F761 HydrophobicContact CB-CE1 4.02Å; L739-F761 HydrophobicContact CD2-CE1 3.97Å; L739-F761 HydrophobicContact CD2-CZ 3.68Å; M756-F761 HydrophobicContact SD-CE2 4.01Å; M756-F761 HydrophobicContact SD-CZ 4.02Å; V759-F761 HydrophobicContact CB-CD2 4.4Å; V759-F761 HydrophobicContact CB-CE1 4.26Å; V759-F761 HydrophobicContact CB-CE2 3.78Å; V759-F761 HydrophobicContact CB-CZ 3.71Å; V759-F761 HydrophobicContact CG1-CD1 3.91Å; V759-F761 HydrophobicContact CG1-CD2 4.22Å; V759-F761 HydrophobicContact CG1-CE1 3.54Å; V759-F761 HydrophobicContact CG1-CE2 3.88Å; V759-F761 HydrophobicContact CG1-CG 4.25Å; V759-F761 HydrophobicContact CG1-CZ 3.53Å; V759-F761 HydrophobicContact CG2-CZ 4.44Å; F761-R787 PolarHBondContact N-O 3.14Å; F761-V788 HydrophobicContact CB-CG2 4.32Å; F761-V788 HydrophobicContact CD2-CG2 4.47Å; F761-V788 WeakPolarHBondContact O-CA 3.09Å; F761-Q789 PolarHBondContact O-N 2.88Å
762	R	91.6	Very high	87.3	Confident	92 Å²	92	34 Å²	34	35%	0.347	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-45.9	178.7	-175.7	145.1	169.1	-153.9	-2.9	112.1	N681 P684 R790	N681-R762 PolarHBondContact ND2-NE 2.98Å; N681-R762 WeakPolarHBondContact OD1-CD 3.49Å; N681-R762 PolarHBondContact OD1-NE 3.11Å; N681-R762 PolarHBondContact OD1-NH1 3.38Å; P684-R762 PolarHBondContact O-N 2.9Å; R762-R790 WeakPolarHBondContact O-CB 3.47Å; R762-R790 PolarHBondContact O-N 3.07Å
763	Y	94.1	Very high	86.9	Confident	8 Å²	8	35.2 Å²	35.2	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.6	165.4	-91.8	-94.4	0	0	0	112.2	H649 F672 L676 H685 L686 R790	H649-Y763 WeakPolarHBondContact CB-OH 3.45Å; H649-Y763 AromaticContact CD2-CE2 3.69Å; H649-Y763 AromaticContact CD2-CZ 3.95Å; H649-Y763 PolarHBondContact CD2-OH 3.09Å; H649-Y763 VanDerWaalsContact CD2-OH 3.28Å; F672-Y763 AromaticContact CE1-CD1 3.93Å; F672-Y763 HydrophobicContact CE1-CD1 3.93Å; F672-Y763 AromaticContact CE1-CE1 3.55Å; F672-Y763 HydrophobicContact CE1-CE1 3.55Å; F672-Y763 HydrophobicContact CE1-CE2 4.27Å; F672-Y763 HydrophobicContact CE1-CG 4.43Å; F672-Y763 AromaticContact CE1-CZ 3.76Å; F672-Y763 AromaticContact CZ-CE1 3.81Å; F672-Y763 HydrophobicContact CZ-CE1 3.81Å; F672-Y763 HydrophobicContact CZ-CE2 4.13Å; F672-Y763 AromaticContact CZ-CZ 3.57Å; L676-Y763 HydrophobicContact CD1-CD2 3.62Å; L676-Y763 HydrophobicContact CD1-CE2 3.64Å; L676-Y763 HydrophobicContact CD1-CG 4.34Å; H685-Y763 CarbonylContact C-O 3.53Å; H685-Y763 WeakPolarHBondContact CA-O 3.21Å; H685-Y763 PolarHBondContact ND1-N 2.69Å; L686-Y763 PolarHBondContact N-O 2.62Å; Y763-R790 CarbonylContact C-O 3.52Å; Y763-R790 WeakPolarHBondContact CA-O 3.3Å; Y763-R790 HydrophobicContact CD1-CB 3.58Å; Y763-R790 HydrophobicContact CD2-CB 3.82Å; Y763-R790 HydrophobicContact CD2-CG 4.27Å; Y763-R790 HydrophobicContact CE1-CB 3.34Å; Y763-R790 HydrophobicContact CE1-CG 4.18Å; Y763-R790 HydrophobicContact CE2-CB 3.58Å; Y763-R790 HydrophobicContact CE2-CG 3.69Å; Y763-R790 HydrophobicContact CG-CB 3.81Å
764	G	94.2	Very high	86.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.4	162.6	0	0	0	0	0	109.8	L686 F766 V788 R790 L792	L686-G764 CarbonylContact O-C 3.6Å; L686-G764 WeakPolarHBondContact O-CA 3.32Å; G764-F766 VanDerWaalsContact O-CD2 3.31Å; G764-F766 WeakPolarHBondContact O-CD2 3.16Å; G764-F766 VanDerWaalsContact O-CE2 3.26Å; G764-F766 WeakPolarHBondContact O-CE2 3.45Å; G764-V788 VanDerWaalsContact N-CG1 3.34Å; G764-R790 PolarHBondContact N-O 3.38Å; G764-L792 PolarHBondContact O-N 3.28Å
765	I	95.8	Very high	86	Confident	1 Å²	1	34 Å²	34	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.3	174.4	-51.6	-173.6	0	0	0	108.1	A669 L673 L686 I687 I688 L792 L794	A669-I765 HydrophobicContact CB-CD1 4.29Å; L673-I765 HydrophobicContact CD1-CD1 3.8Å; L673-I765 HydrophobicContact CD2-CD1 4.12Å; L673-I765 HydrophobicContact CG-CD1 3.95Å; L686-I765 PolarHBondContact O-N 3.42Å; I687-I765 WeakPolarHBondContact CA-O 3.5Å; I687-I765 HydrophobicContact CG1-CB 4.34Å; I688-I765 PolarHBondContact N-O 2.85Å; I765-L792 WeakPolarHBondContact CA-O 3.41Å; I765-L792 HydrophobicContact CD1-CD2 4.34Å; I765-L792 HydrophobicContact CG1-CB 4.38Å; I765-L792 HydrophobicContact CG1-CD2 4.38Å; I765-L792 HydrophobicContact CG2-CD2 4.46Å; I765-L794 HydrophobicContact CG2-CD1 3.67Å; I765-L794 HydrophobicContact CG2-CD2 4.46Å; I765-L794 HydrophobicContact CG2-CG 3.91Å
766	F	94.4	Very high	85.7	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	101.4	-177.5	-57.1	-98.4	0	0	0	108.9	I688 Y743 G764 L772 L783 R791 L792 L793 L794 F812	I688-F766 HydrophobicContact CB-CD1 4.16Å; I688-F766 HydrophobicContact CD1-CD1 4.01Å; I688-F766 HydrophobicContact CD1-CE1 3.62Å; I688-F766 HydrophobicContact CG1-CD1 4.27Å; I688-F766 HydrophobicContact CG1-CE1 4.22Å; Y743-F766 HydrophobicContact CE1-CD1 4.48Å; G764-F766 VanDerWaalsContact O-CD2 3.31Å; G764-F766 WeakPolarHBondContact O-CD2 3.16Å; G764-F766 VanDerWaalsContact O-CE2 3.26Å; G764-F766 WeakPolarHBondContact O-CE2 3.45Å; F766-L772 HydrophobicContact CB-CD1 4.45Å; F766-L783 HydrophobicContact CE1-CD2 4.47Å; F766-R791 HydrophobicContact CE2-CG 4.37Å; F766-L792 PolarHBondContact N-O 3.37Å; F766-L793 HydrophobicContact CB-CD2 3.68Å; F766-L793 HydrophobicContact CD2-CD2 3.98Å; F766-L793 HydrophobicContact CG-CD2 4.07Å; F766-L794 PolarHBondContact O-N 2.75Å; F766-F812 HydrophobicContact CD1-CE1 4.1Å; F766-F812 HydrophobicContact CD1-CZ 4.06Å; F766-F812 AromaticContact CD2-CE1 3.85Å; F766-F812 HydrophobicContact CD2-CE1 3.85Å; F766-F812 AromaticContact CE1-CE1 3.94Å; F766-F812 HydrophobicContact CE1-CE1 3.94Å; F766-F812 AromaticContact CE1-CZ 3.63Å; F766-F812 HydrophobicContact CE1-CZ 3.63Å; F766-F812 AromaticContact CE2-CE1 3.7Å; F766-F812 HydrophobicContact CE2-CE1 3.7Å; F766-F812 HydrophobicContact CE2-CZ 4.14Å; F766-F812 HydrophobicContact CG-CE1 4.06Å; F766-F812 HydrophobicContact CG-CZ 4.49Å; F766-F812 AromaticContact CZ-CE1 3.75Å; F766-F812 HydrophobicContact CZ-CE1 3.75Å; F766-F812 AromaticContact CZ-CZ 3.68Å; F766-F812 HydrophobicContact CZ-CZ 3.68Å
767	D	92.6	Very high	85.5	Confident	14 Å²	14	39.3 Å²	39.3	8%	0.075	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	149.5	179	-177.7	35.2	0	0	0	111.3	I688 C689 T693 W697 Y743 A769	I688-D767 PolarHBondContact O-N 2.8Å; C689-D767 HydrophobicContact CB-CB 3.99Å; T693-D767 PolarHBondContact OG1-OD2 3.02Å; W697-D767 HydrophobicContact CZ2-CB 3.93Å; W697-D767 PolarHBondContact NE1-OD2 3.14Å; Y743-D767 WeakPolarHBondContact CE2-O 3.4Å; Y743-D767 PolarHBondContact OH-O 2.85Å; D767-A769 VanDerWaalsContact C-N 3.33Å; D767-A769 PolarHBondContact O-N 2.91Å
768	E	86.5	Confident	85.4	Confident	25 Å²	25	41 Å²	41	12%	0.117	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.7	54.9	-170.9	-71.7	-69.2	-168.4	0	0	113.2	P690 H770 M771 L794 Q1157	P690-E768 HydrophobicContact CG-CB 3.82Å; P690-E768 HydrophobicContact CG-CG 4.05Å; E768-H770 PolarHBondContact O-N 2.76Å; E768-H770 IonicContact OE2-CE1 3.69Å; E768-H770 PolarHBondContact OE2-CE1 2.65Å; E768-H770 VanDerWaalsContact OE2-CE1 3.24Å; E768-H770 IonicContact OE2-ND1 3.71Å; E768-H770 PolarHBondContact OE2-ND1 2.74Å; E768-M771 WeakPolarHBondContact O-CB 3.33Å; E768-M771 WeakPolarHBondContact O-CG 3.17Å; E768-M771 PolarHBondContact O-N 3.49Å; E768-L794 PolarHBondContact N-O 3.4Å; E768-Q1157 PolarHBondContact OE1-NE2 2.83Å
769	A	86.4	Confident	85.5	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-57.8	-12.9	-174.9	0	0	0	0	0	114.7	D767 M771 L772 L793 L794 L809	D767-A769 VanDerWaalsContact C-N 3.33Å; D767-A769 PolarHBondContact O-N 2.91Å; A769-M771 PolarHBondContact O-N 3.13Å; A769-M771 VanDerWaalsContact O-N 3.08Å; A769-L772 HydrophobicContact CB-CD1 4.48Å; A769-L772 VanDerWaalsContact O-CB 3.29Å; A769-L772 WeakPolarHBondContact O-CB 3.47Å; A769-L772 PolarHBondContact O-N 2.92Å; A769-L793 HydrophobicContact CB-CB 3.79Å; A769-L793 HydrophobicContact CB-CD1 4.17Å; A769-L793 HydrophobicContact CB-CD2 4.01Å; A769-L793 HydrophobicContact CB-CG 4.21Å; A769-L794 WeakPolarHBondContact CB-O 3.39Å; A769-L794 PolarHBondContact N-O 3.28Å; A769-L809 WeakPolarHBondContact O-CD2 3.49Å
770	H	78.1	Confident	85.6	Confident	50 Å²	50	36.7 Å²	36.7	23%	0.231	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-53.1	-25.4	165.7	79.4	-103.9	0	0	0	112.1	E768 L772 K773	E768-H770 PolarHBondContact O-N 2.76Å; E768-H770 IonicContact OE2-CE1 3.69Å; E768-H770 PolarHBondContact OE2-CE1 2.65Å; E768-H770 VanDerWaalsContact OE2-CE1 3.24Å; E768-H770 IonicContact OE2-ND1 3.71Å; E768-H770 PolarHBondContact OE2-ND1 2.74Å; H770-L772 PolarHBondContact O-N 2.94Å; H770-L772 VanDerWaalsContact O-N 3.13Å; H770-K773 WeakPolarHBondContact O-CB 3.08Å; H770-K773 VanDerWaalsContact O-CD 3.3Å; H770-K773 WeakPolarHBondContact O-CD 3.31Å; H770-K773 VanDerWaalsContact O-CG 3.26Å; H770-K773 WeakPolarHBondContact O-CG 3.48Å; H770-K773 PolarHBondContact O-N 3.04Å
771	M	78.4	Confident	85.4	Confident	47 Å²	47	39.6 Å²	39.6	23%	0.232	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-64.5	-9	172.3	-70.6	-166.8	64.7	0	0	115	P690 Y743 E768 A769 R779	P690-M771 HydrophobicContact CB-SD 4.44Å; P690-M771 HydrophobicContact CG-SD 3.97Å; Y743-M771 HydrophobicContact CD2-CB 4.41Å; Y743-M771 HydrophobicContact CD2-CE 3.71Å; Y743-M771 HydrophobicContact CD2-SD 3.47Å; Y743-M771 WeakPolarHBondContact CD2-SD 3.37Å; Y743-M771 HydrophobicContact CE2-CB 4.06Å; Y743-M771 HydrophobicContact CE2-CE 4.41Å; Y743-M771 HydrophobicContact CE2-CG 4.34Å; Y743-M771 HydrophobicContact CE2-SD 3.67Å; Y743-M771 HydrophobicContact CG-CE 4.08Å; Y743-M771 HydrophobicContact CG-SD 4.38Å; E768-M771 WeakPolarHBondContact O-CB 3.33Å; E768-M771 WeakPolarHBondContact O-CG 3.17Å; E768-M771 PolarHBondContact O-N 3.49Å; A769-M771 PolarHBondContact O-N 3.13Å; A769-M771 VanDerWaalsContact O-N 3.08Å; M771-R779 PolarHBondContact O-NH1 2.71Å
772	L	81	Confident	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-98.8	-10.1	178.3	-56	-179.7	0	0	0	114	Y743 F766 A769 H770 N774 Y780 L783 L793 L809 F812	Y743-L772 HydrophobicContact CE1-CD2 3.95Å; F766-L772 HydrophobicContact CB-CD1 4.45Å; A769-L772 HydrophobicContact CB-CD1 4.48Å; A769-L772 VanDerWaalsContact O-CB 3.29Å; A769-L772 WeakPolarHBondContact O-CB 3.47Å; A769-L772 PolarHBondContact O-N 2.92Å; H770-L772 PolarHBondContact O-N 2.94Å; H770-L772 VanDerWaalsContact O-N 3.13Å; L772-N774 CarbonylContact O-C 3.59Å; L772-N774 PolarHBondContact O-N 2.88Å; L772-Y780 HydrophobicContact CB-CD2 4.46Å; L772-Y780 WeakPolarHBondContact O-CD2 3.29Å; L772-L783 HydrophobicContact CD2-CD1 3.43Å; L772-L783 VanDerWaalsContact CD2-CD1 3.43Å; L772-L793 HydrophobicContact CD1-CD2 3.87Å; L772-L809 HydrophobicContact CB-CD2 4.22Å; L772-F812 HydrophobicContact CD1-CD1 3.83Å; L772-F812 HydrophobicContact CD1-CD2 4.35Å; L772-F812 HydrophobicContact CD1-CE1 3.82Å; L772-F812 HydrophobicContact CD1-CE2 4.36Å; L772-F812 HydrophobicContact CD1-CG 4.1Å; L772-F812 HydrophobicContact CD1-CZ 4.1Å
773	K	75.8	Confident	85.1	Confident	25 Å²	25	36.2 Å²	36.2	11%	0.109	17%	0.173	C	C	.	.			trans	-55.9	-7.4	-164.6	75.7	-169.3	-150.5	139	0	118.3	H770 E805 S808 S1273	H770-K773 WeakPolarHBondContact O-CB 3.08Å; H770-K773 VanDerWaalsContact O-CD 3.3Å; H770-K773 WeakPolarHBondContact O-CD 3.31Å; H770-K773 VanDerWaalsContact O-CG 3.26Å; H770-K773 WeakPolarHBondContact O-CG 3.48Å; H770-K773 PolarHBondContact O-N 3.04Å; K773-E805 HydrophobicContact CB-CB 4.05Å; K773-E805 HydrophobicContact CB-CG 3.95Å; K773-E805 WeakPolarHBondContact CD-OE1 3.48Å; K773-E805 WeakPolarHBondContact CE-OE1 3.22Å; K773-E805 HydrophobicContact CG-CG 4.28Å; K773-E805 VanDerWaalsContact NZ-CD 3.3Å; K773-E805 IonicContact NZ-OE1 3.39Å; K773-E805 PolarHBondContact NZ-OE1 3.24Å; K773-E805 IonicContact NZ-OE2 3.84Å; K773-E805 PolarHBondContact NZ-OE2 2.91Å; K773-E805 VanDerWaalsContact NZ-OE2 3.16Å; K773-S808 VanDerWaalsContact CA-OG 3.29Å; K773-S808 WeakPolarHBondContact CA-OG 3.37Å; K773-S808 PolarHBondContact O-OG 2.86Å; K773-S808 VanDerWaalsContact O-OG 3.11Å; K773-S1273 WeakPolarHBondContact CE-OG 3.05Å
774	N	76.1	Confident	84.7	Confident	81 Å²	81	38.2 Å²	38.2	43%	0.433	18%	0.183	S	C	.	.			trans	-119.9	101.6	174.2	-175.6	-10.4	0	0	0	110.6	L772 T776 S777	L772-N774 CarbonylContact O-C 3.59Å; L772-N774 PolarHBondContact O-N 2.88Å; N774-T776 PolarHBondContact ND2-OG1 3.34Å; N774-T776 PolarHBondContact O-N 3.46Å; N774-T776 VanDerWaalsContact O-N 3.13Å; N774-T776 WeakPolarHBondContact OD1-CB 3.39Å; N774-T776 PolarHBondContact OD1-N 3.16Å; N774-T776 PolarHBondContact OD1-OG1 3.35Å; N774-S777 WeakPolarHBondContact O-CB 3.12Å; N774-S777 PolarHBondContact O-N 3.45Å; N774-S777 PolarHBondContact O-OG 2.91Å
775	M	76.2	Confident	84.3	Confident	22 Å²	22	42.5 Å²	42.5	11%	0.108	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-21.1	176	55.5	173.9	70.2	0	0	114.9	S777 Y780 I807 K826	M775-S777 VanDerWaalsContact C-N 3.33Å; M775-Y780 HydrophobicContact CB-CD1 4.08Å; M775-Y780 HydrophobicContact CB-CD2 4.49Å; M775-Y780 HydrophobicContact CB-CE1 3.73Å; M775-Y780 HydrophobicContact CB-CE2 4.16Å; M775-Y780 HydrophobicContact CB-CG 4.44Å; M775-Y780 VanDerWaalsContact O-CD1 3.32Å; M775-Y780 WeakPolarHBondContact O-CD1 3.48Å; M775-I807 HydrophobicContact CE-CB 4.41Å; M775-I807 HydrophobicContact CE-CG2 4.03Å; M775-K826 HydrophobicContact SD-CD 3.87Å; M775-K826 WeakPolarHBondContact SD-CE 3.28Å; M775-K826 HydrophobicContact SD-CG 3.55Å; M775-K826 VanDerWaalsContact SD-CG 3.55Å
776	T	77.4	Confident	83.9	Confident	79 Å²	79	42.9 Å²	42.9	49%	0.485	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.4	174.7	73.1	0	0	0	0	112.8	N774 R781	N774-T776 PolarHBondContact ND2-OG1 3.34Å; N774-T776 PolarHBondContact O-N 3.46Å; N774-T776 VanDerWaalsContact O-N 3.13Å; N774-T776 WeakPolarHBondContact OD1-CB 3.39Å; N774-T776 PolarHBondContact OD1-N 3.16Å; N774-T776 PolarHBondContact OD1-OG1 3.35Å; T776-R781 VanDerWaalsContact O-CZ 3.31Å; T776-R781 PolarHBondContact O-NE 3.2Å; T776-R781 PolarHBondContact O-NH2 3.25Å
777	S	81.8	Confident	83.5	Confident	31 Å²	31	49.7 Å²	49.7	22%	0.217	23%	0.233	C	C	.	.	S	Bend	trans	-64.3	147.6	-174.9	71.6	0	0	0	0	112.9	N774 M775 R779 Y780 R781	N774-S777 WeakPolarHBondContact O-CB 3.12Å; N774-S777 PolarHBondContact O-N 3.45Å; N774-S777 PolarHBondContact O-OG 2.91Å; M775-S777 VanDerWaalsContact C-N 3.33Å; S777-R779 PolarHBondContact O-N 3.14Å; S777-Y780 PolarHBondContact O-N 2.9Å; S777-Y780 VanDerWaalsContact OG-CB 3.28Å; S777-Y780 WeakPolarHBondContact OG-CB 3Å; S777-Y780 PolarHBondContact OG-N 3.39Å; S777-Y780 VanDerWaalsContact OG-N 3.16Å; S777-R781 WeakPolarHBondContact O-CG 3.49Å; S777-R781 PolarHBondContact O-N 3.47Å; S777-R781 VanDerWaalsContact O-N 3.14Å
778	Q	83.5	Confident	83.3	Confident	129 Å²	129	49.9 Å²	49.9	60%	0.603	23%	0.234	S	C	*	.	H	α-helix	trans	-62.7	-33.7	176.1	-161.5	-173.1	25.4	0	0	111.4	R781 N782	Q778-R781 PolarHBondContact O-N 2.83Å; Q778-N782 WeakPolarHBondContact O-CB 3.38Å; Q778-N782 PolarHBondContact O-N 2.91Å; Q778-N782 PolarHBondContact O-ND2 3.42Å; Q778-N782 VanDerWaalsContact O-ND2 3.17Å
779	R	85.7	Confident	83.4	Confident	59 Å²	59	54.5 Å²	54.5	22%	0.223	26%	0.256	C	S	.	.	H	α-helix	trans	-57	-56.1	174.5	-171.8	-172.9	-58.7	140.3	4.7	111	E390 Y743 T747 M771 S777 R781 N782 L783	E390-R779 IonicContact OE1-NH2 2.68Å; Y743-R779 HydrophobicContact CD1-CG 4.47Å; T747-R779 HydrophobicContact CG2-CG 4.34Å; M771-R779 PolarHBondContact O-NH1 2.71Å; S777-R779 PolarHBondContact O-N 3.14Å; R779-R781 PolarHBondContact O-N 2.8Å; R779-N782 PolarHBondContact O-N 3.07Å; R779-L783 HydrophobicContact CG-CD1 3.91Å; R779-L783 VanDerWaalsContact O-CG 3.3Å; R779-L783 WeakPolarHBondContact O-CG 3.25Å; R779-L783 PolarHBondContact O-N 2.81Å
780	Y	87.5	Confident	83.7	Confident	14 Å²	14	56.7 Å²	56.7	6%	0.055	26%	0.264	C	S	.	.	H	α-helix	trans	-55.9	-49.8	178.4	-178.2	-85.8	0	0	0	111.9	L772 M775 S777 N782 L783 M784 S808 S811 F812	L772-Y780 HydrophobicContact CB-CD2 4.46Å; L772-Y780 WeakPolarHBondContact O-CD2 3.29Å; M775-Y780 HydrophobicContact CB-CD1 4.08Å; M775-Y780 HydrophobicContact CB-CD2 4.49Å; M775-Y780 HydrophobicContact CB-CE1 3.73Å; M775-Y780 HydrophobicContact CB-CE2 4.16Å; M775-Y780 HydrophobicContact CB-CG 4.44Å; M775-Y780 VanDerWaalsContact O-CD1 3.32Å; M775-Y780 WeakPolarHBondContact O-CD1 3.48Å; S777-Y780 PolarHBondContact O-N 2.9Å; S777-Y780 VanDerWaalsContact OG-CB 3.28Å; S777-Y780 WeakPolarHBondContact OG-CB 3Å; S777-Y780 PolarHBondContact OG-N 3.39Å; S777-Y780 VanDerWaalsContact OG-N 3.16Å; Y780-N782 VanDerWaalsContact C-N 3.33Å; Y780-N782 PolarHBondContact O-N 2.79Å; Y780-L783 PolarHBondContact O-N 2.98Å; Y780-M784 HydrophobicContact CD1-CG 4.02Å; Y780-M784 HydrophobicContact CE1-CE 4.01Å; Y780-M784 HydrophobicContact CE1-CG 3.74Å; Y780-M784 WeakPolarHBondContact O-CB 3.42Å; Y780-M784 PolarHBondContact O-N 2.96Å; Y780-M784 WeakPolarHBondContact OH-CE 3.39Å; Y780-S808 WeakPolarHBondContact CE2-O 3.4Å; Y780-S808 PolarHBondContact OH-O 3.39Å; Y780-S811 VanDerWaalsContact OH-CB 3.29Å; Y780-S811 WeakPolarHBondContact OH-CB 3.4Å; Y780-F812 HydrophobicContact CD2-CD2 4.11Å; Y780-F812 HydrophobicContact CE2-CB 3.96Å; Y780-F812 AromaticContact CE2-CD2 3.91Å; Y780-F812 HydrophobicContact CE2-CD2 3.91Å; Y780-F812 HydrophobicContact CE2-CG 4.38Å
781	R	85.4	Confident	84.4	Confident	153 Å²	153	55 Å²	55	58%	0.577	26%	0.256	S	S	*	.	H	α-helix	trans	-61.5	-38.5	179.1	-64.4	-171.1	-128.8	-173.8	1.2	112.6	T776 S777 Q778 R779 N785	T776-R781 VanDerWaalsContact O-CZ 3.31Å; T776-R781 PolarHBondContact O-NE 3.2Å; T776-R781 PolarHBondContact O-NH2 3.25Å; S777-R781 WeakPolarHBondContact O-CG 3.49Å; S777-R781 PolarHBondContact O-N 3.47Å; S777-R781 VanDerWaalsContact O-N 3.14Å; Q778-R781 PolarHBondContact O-N 2.83Å; R779-R781 PolarHBondContact O-N 2.8Å; R781-N785 PolarHBondContact O-ND2 3.3Å
782	N	86.5	Confident	85.1	Confident	21 Å²	21	53 Å²	53	11%	0.112	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-46.2	176.9	-73.7	-28	0	0	0	111.9	T747 R753 Q778 R779 Y780 N785 F786	T747-N782 HydrophobicContact CG2-CB 3.95Å; T747-N782 PolarHBondContact O-ND2 3.46Å; R753-N782 PolarHBondContact NE-ND2 3.17Å; R753-N782 PolarHBondContact NH1-OD1 2.76Å; R753-N782 PolarHBondContact NH2-ND2 3.45Å; Q778-N782 WeakPolarHBondContact O-CB 3.38Å; Q778-N782 PolarHBondContact O-N 2.91Å; Q778-N782 PolarHBondContact O-ND2 3.42Å; Q778-N782 VanDerWaalsContact O-ND2 3.17Å; R779-N782 PolarHBondContact O-N 3.07Å; Y780-N782 VanDerWaalsContact C-N 3.33Å; Y780-N782 PolarHBondContact O-N 2.79Å; N782-N785 WeakPolarHBondContact O-CB 2.88Å; N782-N785 PolarHBondContact O-N 2.96Å; N782-F786 VanDerWaalsContact O-CD1 3.24Å; N782-F786 WeakPolarHBondContact O-CD1 3.41Å; N782-F786 WeakPolarHBondContact O-CE1 3.22Å
783	L	89	Confident	85.7	Confident	1 Å²	1	53 Å²	53	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-69.9	-35.9	-177.9	-64.7	172.7	0	0	0	112.7	I688 Y743 T747 F766 L772 R779 Y780 N785 F786 F812	I688-L783 HydrophobicContact CD1-CD2 3.55Å; Y743-L783 HydrophobicContact CD1-CD1 3.8Å; Y743-L783 HydrophobicContact CE1-CD1 3.82Å; T747-L783 HydrophobicContact CG2-CD2 3.64Å; T747-L783 HydrophobicContact CG2-CG 3.83Å; F766-L783 HydrophobicContact CE1-CD2 4.47Å; L772-L783 HydrophobicContact CD2-CD1 3.43Å; L772-L783 VanDerWaalsContact CD2-CD1 3.43Å; R779-L783 HydrophobicContact CG-CD1 3.91Å; R779-L783 VanDerWaalsContact O-CG 3.3Å; R779-L783 WeakPolarHBondContact O-CG 3.25Å; R779-L783 PolarHBondContact O-N 2.81Å; Y780-L783 PolarHBondContact O-N 2.98Å; L783-N785 PolarHBondContact O-N 2.6Å; L783-N785 VanDerWaalsContact O-N 3.15Å; L783-F786 HydrophobicContact CD2-CD2 4.08Å; L783-F786 HydrophobicContact CD2-CE1 4.44Å; L783-F786 HydrophobicContact CD2-CE2 3.54Å; L783-F786 HydrophobicContact CD2-CZ 3.75Å; L783-F786 WeakPolarHBondContact O-CB 3.01Å; L783-F786 PolarHBondContact O-N 3.15Å; L783-F812 HydrophobicContact CB-CE2 3.82Å; L783-F812 HydrophobicContact CB-CZ 4.02Å
784	M	85.9	Confident	86.5	Confident	50 Å²	50	51.8 Å²	51.8	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-29.3	172.4	-90.6	-65.7	-143	0	0	113.3	Y780 F786 R791 S811 F812 P815	Y780-M784 HydrophobicContact CD1-CG 4.02Å; Y780-M784 HydrophobicContact CE1-CE 4.01Å; Y780-M784 HydrophobicContact CE1-CG 3.74Å; Y780-M784 WeakPolarHBondContact O-CB 3.42Å; Y780-M784 PolarHBondContact O-N 2.96Å; Y780-M784 WeakPolarHBondContact OH-CE 3.39Å; M784-F786 VanDerWaalsContact C-N 3.34Å; M784-R791 PolarHBondContact O-NH2 3.13Å; M784-R791 PolarHBondContact SD-NH1 3.15Å; M784-S811 WeakPolarHBondContact CE-O 3.44Å; M784-F812 HydrophobicContact CE-CD2 4.43Å; M784-F812 HydrophobicContact CG-CD2 3.9Å; M784-F812 HydrophobicContact CG-CE2 4.11Å; M784-F812 HydrophobicContact SD-CD2 3.9Å; M784-F812 HydrophobicContact SD-CE2 4.32Å; M784-P815 HydrophobicContact CE-CB 4.32Å; M784-P815 HydrophobicContact CE-CG 4.21Å; M784-P815 HydrophobicContact SD-CB 4.48Å; M784-P815 HydrophobicContact SD-CG 4.06Å
785	N	85.5	Confident	87	Confident	90 Å²	90	48 Å²	48	48%	0.481	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	3	-179.9	-86.5	-83.5	0	0	0	114	K757 R781 N782 L783	K757-N785 WeakPolarHBondContact CE-O 3.5Å; K757-N785 WeakPolarHBondContact CG-O 3.47Å; R781-N785 PolarHBondContact O-ND2 3.3Å; N782-N785 WeakPolarHBondContact O-CB 2.88Å; N782-N785 PolarHBondContact O-N 2.96Å; L783-N785 PolarHBondContact O-N 2.6Å; L783-N785 VanDerWaalsContact O-N 3.15Å
786	F	87.6	Confident	87	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.035	22%	0.219	C	C	.	.	S	Bend	trans	-80.6	143.5	177	-71.3	9.6	0	0	0	110.7	L686 I688 G746 M756 N782 L783 M784 V788	L686-F786 HydrophobicContact CD2-CD2 3.9Å; L686-F786 HydrophobicContact CD2-CE2 4.36Å; I688-F786 HydrophobicContact CD1-CD2 4.14Å; I688-F786 HydrophobicContact CD1-CE2 3.74Å; G746-F786 WeakPolarHBondContact O-CZ 3.17Å; M756-F786 HydrophobicContact CB-CD1 3.76Å; M756-F786 HydrophobicContact CB-CD2 3.89Å; M756-F786 HydrophobicContact CB-CE1 3.59Å; M756-F786 HydrophobicContact CB-CE2 3.7Å; M756-F786 HydrophobicContact CB-CG 3.92Å; M756-F786 HydrophobicContact CB-CZ 3.55Å; M756-F786 HydrophobicContact CG-CD2 4.35Å; M756-F786 HydrophobicContact CG-CE1 4.21Å; M756-F786 HydrophobicContact CG-CE2 3.75Å; M756-F786 HydrophobicContact CG-CZ 3.67Å; M756-F786 HydrophobicContact SD-CE2 4.17Å; N782-F786 VanDerWaalsContact O-CD1 3.24Å; N782-F786 WeakPolarHBondContact O-CD1 3.41Å; N782-F786 WeakPolarHBondContact O-CE1 3.22Å; L783-F786 HydrophobicContact CD2-CD2 4.08Å; L783-F786 HydrophobicContact CD2-CE1 4.44Å; L783-F786 HydrophobicContact CD2-CE2 3.54Å; L783-F786 HydrophobicContact CD2-CZ 3.75Å; L783-F786 WeakPolarHBondContact O-CB 3.01Å; L783-F786 PolarHBondContact O-N 3.15Å; M784-F786 VanDerWaalsContact C-N 3.34Å; F786-V788 HydrophobicContact CB-CG2 4.02Å; F786-V788 PolarHBondContact O-N 3.37Å; F786-V788 VanDerWaalsContact O-N 3.09Å
787	R	85.6	Confident	86.7	Confident	144 Å²	144	44 Å²	44	54%	0.543	20%	0.199	S	C	.	.			trans	-81.6	91.4	176.9	-72	-167.6	178.6	171.3	-3.2	110.3	M756 K757 N760 F761	M756-R787 PolarHBondContact O-N 2.67Å; K757-R787 VanDerWaalsContact O-CD 3.28Å; K757-R787 WeakPolarHBondContact O-CD 3.45Å; K757-R787 PolarHBondContact O-NE 2.78Å; N760-R787 WeakPolarHBondContact OD1-CD 3.31Å; N760-R787 PolarHBondContact OD1-NH1 3.16Å; F761-R787 PolarHBondContact N-O 3.14Å
788	V	90.1	Very high	85.8	Confident	18 Å²	18	43.1 Å²	43.1	11%	0.109	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	119	-177.2	175.7	0	0	0	0	108.3	L686 F761 G764 F786 R790 R791	L686-V788 HydrophobicContact CD2-CG2 4.3Å; F761-V788 HydrophobicContact CB-CG2 4.32Å; F761-V788 HydrophobicContact CD2-CG2 4.47Å; F761-V788 WeakPolarHBondContact O-CA 3.09Å; G764-V788 VanDerWaalsContact N-CG1 3.34Å; F786-V788 HydrophobicContact CB-CG2 4.02Å; F786-V788 PolarHBondContact O-N 3.37Å; F786-V788 VanDerWaalsContact O-N 3.09Å; V788-R790 WeakPolarHBondContact CG1-O 3.44Å; V788-R791 HydrophobicContact CG1-CG 3.85Å
789	Q	88.9	Confident	84.9	Confident	123 Å²	123	37.8 Å²	37.8	58%	0.575	17%	0.168	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	-58.3	-179.3	-63.7	174.2	-28.7	0	0	111.6	F761	F761-Q789 PolarHBondContact O-N 2.88Å
790	R	90.9	Very high	83.5	Confident	46 Å²	46	35.9 Å²	35.9	17%	0.174	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141	-180	-62.7	-84.2	143.7	-120	-3.2	111.1	Q652 N654 R762 Y763 G764 V788	Q652-R790 VanDerWaalsContact C-CZ 3.47Å; Q652-R790 VanDerWaalsContact CB-NH2 3.34Å; Q652-R790 PolarHBondContact O-NH1 3.23Å; Q652-R790 PolarHBondContact O-NH2 3.08Å; Q652-R790 VanDerWaalsContact O-NH2 3.17Å; Q652-R790 VanDerWaalsContact OE1-CZ 3.31Å; N654-R790 VanDerWaalsContact OD1-CA 3.32Å; N654-R790 WeakPolarHBondContact OD1-CA 3.37Å; N654-R790 PolarHBondContact OD1-NH1 3Å; R762-R790 WeakPolarHBondContact O-CB 3.47Å; R762-R790 PolarHBondContact O-N 3.07Å; Y763-R790 CarbonylContact C-O 3.52Å; Y763-R790 WeakPolarHBondContact CA-O 3.3Å; Y763-R790 HydrophobicContact CD1-CB 3.58Å; Y763-R790 HydrophobicContact CD2-CB 3.82Å; Y763-R790 HydrophobicContact CD2-CG 4.27Å; Y763-R790 HydrophobicContact CE1-CB 3.34Å; Y763-R790 HydrophobicContact CE1-CG 4.18Å; Y763-R790 HydrophobicContact CE2-CB 3.58Å; Y763-R790 HydrophobicContact CE2-CG 3.69Å; Y763-R790 HydrophobicContact CG-CB 3.81Å; G764-R790 PolarHBondContact N-O 3.38Å; V788-R790 WeakPolarHBondContact CG1-O 3.44Å
791	R	92.9	Very high	82.1	Confident	15 Å²	15	36.4 Å²	36.4	6%	0.057	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.4	-176.5	-63.7	-178.3	179.2	-166.4	-1.7	111	N654 G655 F766 M784 V788 F812	N654-R791 WeakPolarHBondContact CA-O 3.26Å; N654-R791 HydrophobicContact CB-CB 4.32Å; N654-R791 VanDerWaalsContact CB-O 3.31Å; N654-R791 WeakPolarHBondContact CB-O 3.38Å; N654-R791 PolarHBondContact OD1-N 2.98Å; G655-R791 PolarHBondContact N-O 3.27Å; F766-R791 HydrophobicContact CE2-CG 4.37Å; M784-R791 PolarHBondContact O-NH2 3.13Å; M784-R791 PolarHBondContact SD-NH1 3.15Å; V788-R791 HydrophobicContact CG1-CG 3.85Å; R791-F812 WeakPolarHBondContact CD-O 3.42Å; R791-F812 PolarHBondContact NH1-O 2.82Å
792	L	94.1	Very high	81	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.3	173.3	175.8	57.6	0	0	0	109	L645 G655 F672 G764 I765 F766 L794	L645-L792 HydrophobicContact CD1-CD2 4.35Å; L645-L792 HydrophobicContact CD2-CD1 3.65Å; L645-L792 HydrophobicContact CD2-CD2 4.09Å; G655-L792 WeakPolarHBondContact O-CA 3.29Å; F672-L792 HydrophobicContact CD1-CD2 4.29Å; G764-L792 PolarHBondContact O-N 3.28Å; I765-L792 WeakPolarHBondContact CA-O 3.41Å; I765-L792 HydrophobicContact CD1-CD2 4.34Å; I765-L792 HydrophobicContact CG1-CB 4.38Å; I765-L792 HydrophobicContact CG1-CD2 4.38Å; I765-L792 HydrophobicContact CG2-CD2 4.46Å; F766-L792 PolarHBondContact N-O 3.37Å; L792-L794 HydrophobicContact CD1-CD2 4.23Å; L792-L794 HydrophobicContact CD2-CD2 4.08Å; L792-L794 HydrophobicContact CG-CD2 3.9Å
793	L	93.1	Very high	79.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135	172.5	-62	-170.8	0	0	0	109.9	G655 I656 L657 F766 A769 L772 L809 F812 V813	G655-L793 PolarHBondContact O-N 2.92Å; I656-L793 CarbonylContact C-O 3.51Å; I656-L793 WeakPolarHBondContact CA-O 3.39Å; I656-L793 HydrophobicContact CB-CB 4.42Å; I656-L793 HydrophobicContact CD1-CD1 4.46Å; I656-L793 HydrophobicContact CG1-CB 4.21Å; I656-L793 HydrophobicContact CG1-CD1 4.31Å; I656-L793 HydrophobicContact CG2-CB 4.14Å; L657-L793 PolarHBondContact N-O 2.99Å; F766-L793 HydrophobicContact CB-CD2 3.68Å; F766-L793 HydrophobicContact CD2-CD2 3.98Å; F766-L793 HydrophobicContact CG-CD2 4.07Å; A769-L793 HydrophobicContact CB-CB 3.79Å; A769-L793 HydrophobicContact CB-CD1 4.17Å; A769-L793 HydrophobicContact CB-CD2 4.01Å; A769-L793 HydrophobicContact CB-CG 4.21Å; L772-L793 HydrophobicContact CD1-CD2 3.87Å; L793-L809 HydrophobicContact CD1-CB 4.21Å; L793-L809 HydrophobicContact CD1-CD2 4.12Å; L793-F812 HydrophobicContact CD2-CD1 3.86Å; L793-F812 HydrophobicContact CD2-CE1 4.04Å; L793-V813 HydrophobicContact CD1-CG2 3.43Å; L793-V813 VanDerWaalsContact CD1-CG2 3.43Å; L793-V813 HydrophobicContact CG-CG2 3.79Å
794	L	92.5	Very high	78.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132	170.5	-45.7	176.8	0	0	0	108.6	L657 A669 W697 I765 F766 E768 A769 L792	L657-L794 HydrophobicContact CB-CD2 3.78Å; L657-L794 HydrophobicContact CD2-CD2 4.15Å; A669-L794 HydrophobicContact CB-CD1 4.06Å; A669-L794 HydrophobicContact CB-CD2 4.49Å; W697-L794 HydrophobicContact CH2-CD1 3.67Å; W697-L794 HydrophobicContact CZ2-CD1 3.67Å; I765-L794 HydrophobicContact CG2-CD1 3.67Å; I765-L794 HydrophobicContact CG2-CD2 4.46Å; I765-L794 HydrophobicContact CG2-CG 3.91Å; F766-L794 PolarHBondContact O-N 2.75Å; E768-L794 PolarHBondContact N-O 3.4Å; A769-L794 WeakPolarHBondContact CB-O 3.39Å; A769-L794 PolarHBondContact N-O 3.28Å; L792-L794 HydrophobicContact CD1-CD2 4.23Å; L792-L794 HydrophobicContact CD2-CD2 4.08Å; L792-L794 HydrophobicContact CG-CD2 3.9Å
795	T	86.1	Confident	78.1	Confident	1 Å²	1	32 Å²	32	1%	0.006	15%	0.153	C	C	.	.			trans	-148.8	147.1	177	-175	0	0	0	0	111.8	I656 L657 A658 K665 T797 P798	I656-T795 HydrophobicContact CG2-CG2 4.1Å; L657-T795 PolarHBondContact O-N 3.41Å; A658-T795 HydrophobicContact CB-CG2 4.03Å; K665-T795 WeakPolarHBondContact CD-O 3.21Å; K665-T795 VanDerWaalsContact CE-C 3.49Å; K665-T795 WeakPolarHBondContact CE-O 3.32Å; K665-T795 PolarHBondContact NZ-O 3.4Å; K665-T795 VanDerWaalsContact NZ-O 3.07Å; T795-T797 VanDerWaalsContact OG1-C 3.22Å; T795-T797 PolarHBondContact OG1-N 3.36Å; T795-T797 PolarHBondContact OG1-O 3.46Å; T795-P798 HydrophobicContact CG2-CB 3.97Å
796	G	77.1	Confident	77.4	Confident	7 Å²	7	28.4 Å²	28.4	7%	0.072	13%	0.134	C	C	.	.	S	Bend	trans	-91.3	-12.5	165.6	0	0	0	0	0	113.9
797	T	70.2	Confident	76.6	Confident	12 Å²	12	28.7 Å²	28.7	7%	0.074	14%	0.136	C	C	.	.			trans	-139.9	93.7	178	49.6	0	0	0	0	108.3	M661 T795 I799 Q800 Y1153	M661-T797 HydrophobicContact CE-CG2 4.07Å; T795-T797 VanDerWaalsContact OG1-C 3.22Å; T795-T797 PolarHBondContact OG1-N 3.36Å; T795-T797 PolarHBondContact OG1-O 3.46Å; T797-I799 PolarHBondContact O-N 3.43Å; T797-Q800 PolarHBondContact OG1-NE2 3.15Å; T797-Q800 VanDerWaalsContact OG1-NE2 3.1Å; T797-Y1153 HydrophobicContact CG2-CD1 3.46Å; T797-Y1153 VanDerWaalsContact CG2-CD1 3.46Å; T797-Y1153 HydrophobicContact CG2-CE1 3.99Å; T797-Y1153 HydrophobicContact CG2-CG 4.23Å
798	P	63	Low	76.2	Confident	12 Å²	12	21.8 Å²	21.8	8%	0.078	11%	0.11	C	C	.	.	S	Bend	trans	-68.6	-22.6	-178.4	27.8	-35.1	0	0	0	113	A658 T795 L809 R872	A658-P798 HydrophobicContact CB-CB 3.92Å; A658-P798 HydrophobicContact CB-CG 4.03Å; T795-P798 HydrophobicContact CG2-CB 3.97Å; P798-L809 WeakPolarHBondContact O-CD1 3.28Å; P798-R872 VanDerWaalsContact CD-NH1 3.35Å
799	I	65.9	Low	75.8	Confident	17 Å²	17	21.2 Å²	21.2	9%	0.087	11%	0.106	C	C	.	.			trans	-138.8	130.3	-172.9	-61.4	175.7	0	0	0	108.1	T797 L806 L866 Y1153 V1200	T797-I799 PolarHBondContact O-N 3.43Å; I799-L806 HydrophobicContact CD1-CD1 3.81Å; I799-L806 HydrophobicContact CG1-CD1 3.72Å; I799-L866 HydrophobicContact CD1-CD1 4.44Å; I799-Y1153 PolarHBondContact O-OH 2.9Å; I799-V1200 HydrophobicContact CD1-CG1 3.42Å; I799-V1200 VanDerWaalsContact CD1-CG1 3.42Å; I799-V1200 HydrophobicContact CG2-CG1 4.24Å
800	Q	54.7	Low	75.2	Confident	19 Å²	19	15.7 Å²	15.7	9%	0.089	8%	0.08	C	C	.	.	S	Bend	trans	-123.4	47.2	170.8	-59.9	-178.8	-6.3	0	0	110.4	T797 Y1153	T797-Q800 PolarHBondContact OG1-NE2 3.15Å; T797-Q800 VanDerWaalsContact OG1-NE2 3.1Å; Q800-Y1153 HydrophobicContact CB-CD2 4.36Å; Q800-Y1153 HydrophobicContact CB-CE2 3.94Å; Q800-Y1153 HydrophobicContact CG-CD2 3.97Å; Q800-Y1153 HydrophobicContact CG-CE2 3.89Å; Q800-Y1153 HydrophobicContact CG-CG 4.42Å
801	N	58.6	Low	74.7	Confident	24 Å²	24	13.6 Å²	13.6	13%	0.128	7%	0.072	C	C	.	.	S	Bend	trans	73.3	29	166.7	-46.8	-5.6	0	0	0	116.6	Y1153 K1193	N801-Y1153 PolarHBondContact OD1-OH 3.06Å; N801-K1193 VanDerWaalsContact ND2-CA 3.29Å; N801-K1193 WeakPolarHBondContact ND2-CA 3.49Å; N801-K1193 WeakPolarHBondContact ND2-CB 3.22Å; N801-K1193 PolarHBondContact ND2-O 2.66Å
802	N	62.7	Low	74.3	Confident	21 Å²	21	12.9 Å²	12.9	11%	0.112	7%	0.07	C	C	.	.			trans	-143.7	124.8	172.5	177.6	7	0	0	0	111.9	L804 E805 L806 S1271	N802-L804 PolarHBondContact O-N 3.48Å; N802-L804 WeakPolarHBondContact OD1-CB 3.28Å; N802-L804 PolarHBondContact OD1-N 2.74Å; N802-E805 HydrophobicContact CB-CG 4Å; N802-E805 WeakPolarHBondContact O-CB 3.31Å; N802-E805 PolarHBondContact O-N 3.21Å; N802-L806 PolarHBondContact O-N 3.32Å; N802-S1271 VanDerWaalsContact ND2-CB 3.26Å; N802-S1271 WeakPolarHBondContact ND2-CB 3.41Å
803	L	63.7	Low	73.8	Confident	70 Å²	70	12.7 Å²	12.7	37%	0.366	7%	0.069	S	C	.	.	H	α-helix	trans	-61.3	-29.2	178.4	-64.8	165.4	0	0	0	112.7	E805 L806 I807 F829	L803-E805 VanDerWaalsContact C-N 3.29Å; L803-E805 PolarHBondContact O-N 2.67Å; L803-L806 WeakPolarHBondContact O-CB 3.48Å; L803-L806 PolarHBondContact O-N 3.21Å; L803-I807 VanDerWaalsContact O-CD1 3.31Å; L803-I807 WeakPolarHBondContact O-CD1 3.24Å; L803-I807 VanDerWaalsContact O-CG1 3.25Å; L803-I807 WeakPolarHBondContact O-CG1 3.41Å; L803-I807 PolarHBondContact O-N 3.4Å; L803-F829 HydrophobicContact CB-CD1 3.57Å; L803-F829 HydrophobicContact CB-CE1 4.02Å; L803-F829 HydrophobicContact CB-CG 4.35Å; L803-F829 HydrophobicContact CD1-CD1 3.8Å; L803-F829 HydrophobicContact CD1-CE1 3.89Å; L803-F829 HydrophobicContact CG-CD1 4.29Å; L803-F829 HydrophobicContact CG-CE1 4.44Å
804	L	67	Low	73.1	Confident	31 Å²	31	13.6 Å²	13.6	16%	0.162	7%	0.073	C	C	.	.	H	α-helix	trans	-65.4	-29.6	172.7	-68.1	160.4	0	0	0	112.8	N802 S808 F829 Q830	N802-L804 PolarHBondContact O-N 3.48Å; N802-L804 WeakPolarHBondContact OD1-CB 3.28Å; N802-L804 PolarHBondContact OD1-N 2.74Å; L804-S808 PolarHBondContact O-N 2.76Å; L804-S808 VanDerWaalsContact O-N 3.08Å; L804-F829 HydrophobicContact CD2-CB 3.64Å; L804-F829 HydrophobicContact CG-CB 3.8Å; L804-Q830 HydrophobicContact CD1-CG 4.08Å
805	E	70.8	Confident	72.3	Confident	10 Å²	10	14.9 Å²	14.9	5%	0.047	8%	0.081	C	C	.	.	H	α-helix	trans	-70	-45.6	173.9	-64.6	-169.8	169.6	0	0	110.1	K773 N802 L803 I807 S808 L809 S1272	K773-E805 HydrophobicContact CB-CB 4.05Å; K773-E805 HydrophobicContact CB-CG 3.95Å; K773-E805 WeakPolarHBondContact CD-OE1 3.48Å; K773-E805 WeakPolarHBondContact CE-OE1 3.22Å; K773-E805 HydrophobicContact CG-CG 4.28Å; K773-E805 VanDerWaalsContact NZ-CD 3.3Å; K773-E805 IonicContact NZ-OE1 3.39Å; K773-E805 PolarHBondContact NZ-OE1 3.24Å; K773-E805 IonicContact NZ-OE2 3.84Å; K773-E805 PolarHBondContact NZ-OE2 2.91Å; K773-E805 VanDerWaalsContact NZ-OE2 3.16Å; N802-E805 HydrophobicContact CB-CG 4Å; N802-E805 WeakPolarHBondContact O-CB 3.31Å; N802-E805 PolarHBondContact O-N 3.21Å; L803-E805 VanDerWaalsContact C-N 3.29Å; L803-E805 PolarHBondContact O-N 2.67Å; E805-I807 VanDerWaalsContact C-N 3.34Å; E805-I807 PolarHBondContact O-N 3.05Å; E805-S808 WeakPolarHBondContact O-CB 3.42Å; E805-S808 PolarHBondContact O-N 3.19Å; E805-S808 PolarHBondContact O-OG 3.42Å; E805-L809 PolarHBondContact O-N 3.02Å; E805-L809 VanDerWaalsContact O-N 3.07Å; E805-S1272 WeakPolarHBondContact OE1-CA 3.36Å; E805-S1272 WeakPolarHBondContact OE1-CB 3.48Å
806	L	70.8	Confident	71.5	Confident	16 Å²	16	23.2 Å²	23.2	8%	0.084	12%	0.121	C	C	.	.	H	α-helix	trans	-55.8	-47.7	175.4	-169	80.8	0	0	0	111.9	I799 N802 L803 S808 L809 L810 L866	I799-L806 HydrophobicContact CD1-CD1 3.81Å; I799-L806 HydrophobicContact CG1-CD1 3.72Å; N802-L806 PolarHBondContact O-N 3.32Å; L803-L806 WeakPolarHBondContact O-CB 3.48Å; L803-L806 PolarHBondContact O-N 3.21Å; L806-S808 VanDerWaalsContact C-N 3.26Å; L806-S808 PolarHBondContact O-N 3.14Å; L806-L809 PolarHBondContact O-N 3.48Å; L806-L809 VanDerWaalsContact O-N 3.11Å; L806-L810 HydrophobicContact CD2-CD1 4.48Å; L806-L810 HydrophobicContact CG-CD1 4.39Å; L806-L810 PolarHBondContact O-N 2.85Å; L806-L866 HydrophobicContact CD1-CD1 3.59Å; L806-L866 HydrophobicContact CD1-CD2 3.7Å; L806-L866 HydrophobicContact CD1-CG 4.23Å; L806-L866 HydrophobicContact CD2-CD1 3.85Å; L806-L866 HydrophobicContact CD2-CD2 4.13Å; L806-L866 HydrophobicContact CD2-CG 4.23Å; L806-L866 HydrophobicContact CG-CD1 4.24Å; L806-L866 HydrophobicContact CG-CD2 4.01Å
807	I	70.8	Confident	71.1	Confident	13 Å²	13	24.5 Å²	24.5	7%	0.067	13%	0.125	C	C	.	.	H	α-helix	trans	-65.9	-30.8	178.6	-64.1	157.6	0	0	0	111.2	M775 L803 E805 S811 L825 F829	M775-I807 HydrophobicContact CE-CB 4.41Å; M775-I807 HydrophobicContact CE-CG2 4.03Å; L803-I807 VanDerWaalsContact O-CD1 3.31Å; L803-I807 WeakPolarHBondContact O-CD1 3.24Å; L803-I807 VanDerWaalsContact O-CG1 3.25Å; L803-I807 WeakPolarHBondContact O-CG1 3.41Å; L803-I807 PolarHBondContact O-N 3.4Å; E805-I807 VanDerWaalsContact C-N 3.34Å; E805-I807 PolarHBondContact O-N 3.05Å; I807-S811 WeakPolarHBondContact O-CB 3.5Å; I807-S811 PolarHBondContact O-N 2.97Å; I807-S811 PolarHBondContact O-OG 2.84Å; I807-L825 HydrophobicContact CG2-CB 4.19Å; I807-L825 HydrophobicContact CG2-CD1 4.19Å; I807-F829 HydrophobicContact CD1-CB 4.17Å; I807-F829 HydrophobicContact CD1-CD1 4.07Å; I807-F829 HydrophobicContact CD1-CD2 3.09Å; I807-F829 HydrophobicContact CD1-CE1 4.24Å; I807-F829 HydrophobicContact CD1-CE2 3.31Å; I807-F829 HydrophobicContact CD1-CG 3.5Å; I807-F829 HydrophobicContact CD1-CZ 3.89Å; I807-F829 HydrophobicContact CG1-CE2 4.48Å
808	S	77.4	Confident	70.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67	-37.7	172.8	81.1	0	0	0	0	112.2	K773 Y780 L804 E805 L806 F812	K773-S808 VanDerWaalsContact CA-OG 3.29Å; K773-S808 WeakPolarHBondContact CA-OG 3.37Å; K773-S808 PolarHBondContact O-OG 2.86Å; K773-S808 VanDerWaalsContact O-OG 3.11Å; Y780-S808 WeakPolarHBondContact CE2-O 3.4Å; Y780-S808 PolarHBondContact OH-O 3.39Å; L804-S808 PolarHBondContact O-N 2.76Å; L804-S808 VanDerWaalsContact O-N 3.08Å; E805-S808 WeakPolarHBondContact O-CB 3.42Å; E805-S808 PolarHBondContact O-N 3.19Å; E805-S808 PolarHBondContact O-OG 3.42Å; L806-S808 VanDerWaalsContact C-N 3.26Å; L806-S808 PolarHBondContact O-N 3.14Å; S808-F812 WeakPolarHBondContact O-CB 3.35Å; S808-F812 PolarHBondContact O-N 2.93Å; S808-F812 VanDerWaalsContact O-N 3.11Å
809	L	80	Confident	70.8	Confident	6 Å²	6	30 Å²	30	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-67.6	-53.3	174	-59.6	179.9	0	0	0	110.2	I656 A769 L772 L793 P798 E805 L806 S811 F812 V813	I656-L809 HydrophobicContact CD1-CB 4.47Å; A769-L809 WeakPolarHBondContact O-CD2 3.49Å; L772-L809 HydrophobicContact CB-CD2 4.22Å; L793-L809 HydrophobicContact CD1-CB 4.21Å; L793-L809 HydrophobicContact CD1-CD2 4.12Å; P798-L809 WeakPolarHBondContact O-CD1 3.28Å; E805-L809 PolarHBondContact O-N 3.02Å; E805-L809 VanDerWaalsContact O-N 3.07Å; L806-L809 PolarHBondContact O-N 3.48Å; L806-L809 VanDerWaalsContact O-N 3.11Å; L809-S811 VanDerWaalsContact C-N 3.34Å; L809-S811 PolarHBondContact O-N 3.27Å; L809-F812 CarbonylContact O-C 3.57Å; L809-F812 WeakPolarHBondContact O-CA 3.18Å; L809-F812 WeakPolarHBondContact O-CB 3.47Å; L809-F812 PolarHBondContact O-N 3.43Å; L809-V813 WeakPolarHBondContact O-CG2 3.48Å; L809-V813 PolarHBondContact O-N 3.41Å
810	L	76.8	Confident	70.5	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-54.8	-45	176.7	-80	170.3	0	0	0	112.9	L806 F812 V813 M814 F818 L866	L806-L810 HydrophobicContact CD2-CD1 4.48Å; L806-L810 HydrophobicContact CG-CD1 4.39Å; L806-L810 PolarHBondContact O-N 2.85Å; L810-F812 PolarHBondContact O-N 2.98Å; L810-V813 PolarHBondContact O-N 2.96Å; L810-M814 HydrophobicContact CD2-CE 4.37Å; L810-M814 PolarHBondContact O-N 3.22Å; L810-F818 HydrophobicContact CB-CE2 3.9Å; L810-F818 HydrophobicContact CB-CZ 4.13Å; L810-L866 HydrophobicContact CD1-CD2 3.96Å; L810-L866 HydrophobicContact CD2-CD2 4.05Å; L810-L866 HydrophobicContact CG-CD2 4.04Å
811	S	80.2	Confident	70.6	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-31.9	175.3	-63.7	0	0	0	0	112.5	Y780 M784 I807 L809 P815	Y780-S811 VanDerWaalsContact OH-CB 3.29Å; Y780-S811 WeakPolarHBondContact OH-CB 3.4Å; M784-S811 WeakPolarHBondContact CE-O 3.44Å; I807-S811 WeakPolarHBondContact O-CB 3.5Å; I807-S811 PolarHBondContact O-N 2.97Å; I807-S811 PolarHBondContact O-OG 2.84Å; L809-S811 VanDerWaalsContact C-N 3.34Å; L809-S811 PolarHBondContact O-N 3.27Å; S811-P815 WeakPolarHBondContact O-CA 3.14Å
812	F	84.6	Confident	70.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-80	-34.5	177.7	-167.8	-85.8	0	0	0	112.7	F766 L772 Y780 L783 M784 R791 L793 S808 L809 L810	F766-F812 HydrophobicContact CD1-CE1 4.1Å; F766-F812 HydrophobicContact CD1-CZ 4.06Å; F766-F812 AromaticContact CD2-CE1 3.85Å; F766-F812 HydrophobicContact CD2-CE1 3.85Å; F766-F812 AromaticContact CE1-CE1 3.94Å; F766-F812 HydrophobicContact CE1-CE1 3.94Å; F766-F812 AromaticContact CE1-CZ 3.63Å; F766-F812 HydrophobicContact CE1-CZ 3.63Å; F766-F812 AromaticContact CE2-CE1 3.7Å; F766-F812 HydrophobicContact CE2-CE1 3.7Å; F766-F812 HydrophobicContact CE2-CZ 4.14Å; F766-F812 HydrophobicContact CG-CE1 4.06Å; F766-F812 HydrophobicContact CG-CZ 4.49Å; F766-F812 AromaticContact CZ-CE1 3.75Å; F766-F812 HydrophobicContact CZ-CE1 3.75Å; F766-F812 AromaticContact CZ-CZ 3.68Å; F766-F812 HydrophobicContact CZ-CZ 3.68Å; L772-F812 HydrophobicContact CD1-CD1 3.83Å; L772-F812 HydrophobicContact CD1-CD2 4.35Å; L772-F812 HydrophobicContact CD1-CE1 3.82Å; L772-F812 HydrophobicContact CD1-CE2 4.36Å; L772-F812 HydrophobicContact CD1-CG 4.1Å; L772-F812 HydrophobicContact CD1-CZ 4.1Å; Y780-F812 HydrophobicContact CD2-CD2 4.11Å; Y780-F812 HydrophobicContact CE2-CB 3.96Å; Y780-F812 AromaticContact CE2-CD2 3.91Å; Y780-F812 HydrophobicContact CE2-CD2 3.91Å; Y780-F812 HydrophobicContact CE2-CG 4.38Å; L783-F812 HydrophobicContact CB-CE2 3.82Å; L783-F812 HydrophobicContact CB-CZ 4.02Å; M784-F812 HydrophobicContact CE-CD2 4.43Å; M784-F812 HydrophobicContact CG-CD2 3.9Å; M784-F812 HydrophobicContact CG-CE2 4.11Å; M784-F812 HydrophobicContact SD-CD2 3.9Å; M784-F812 HydrophobicContact SD-CE2 4.32Å; R791-F812 WeakPolarHBondContact CD-O 3.42Å; R791-F812 PolarHBondContact NH1-O 2.82Å; L793-F812 HydrophobicContact CD2-CD1 3.86Å; L793-F812 HydrophobicContact CD2-CE1 4.04Å; S808-F812 WeakPolarHBondContact O-CB 3.35Å; S808-F812 PolarHBondContact O-N 2.93Å; S808-F812 VanDerWaalsContact O-N 3.11Å; L809-F812 CarbonylContact O-C 3.57Å; L809-F812 WeakPolarHBondContact O-CA 3.18Å; L809-F812 WeakPolarHBondContact O-CB 3.47Å; L809-F812 PolarHBondContact O-N 3.43Å; L810-F812 PolarHBondContact O-N 2.98Å
813	V	83.3	Confident	70.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-46.1	174.3	-179.3	0	0	0	0	111.1	N654 I656 L793 L809 L810 P815	N654-V813 VanDerWaalsContact C-CG1 3.43Å; N654-V813 HydrophobicContact CB-CG1 3.45Å; N654-V813 VanDerWaalsContact CB-CG1 3.45Å; N654-V813 WeakPolarHBondContact CB-O 3.3Å; N654-V813 PolarHBondContact ND2-O 3.11Å; N654-V813 VanDerWaalsContact O-CG1 3.28Å; N654-V813 WeakPolarHBondContact O-CG1 3.34Å; I656-V813 HydrophobicContact CD1-CG2 3.99Å; I656-V813 HydrophobicContact CG1-CG2 3.74Å; L793-V813 HydrophobicContact CD1-CG2 3.43Å; L793-V813 VanDerWaalsContact CD1-CG2 3.43Å; L793-V813 HydrophobicContact CG-CG2 3.79Å; L809-V813 WeakPolarHBondContact O-CG2 3.48Å; L809-V813 PolarHBondContact O-N 3.41Å; L810-V813 PolarHBondContact O-N 2.96Å; V813-P815 WeakPolarHBondContact O-CD 3.35Å
814	M	78.2	Confident	70.5	Confident	18 Å²	18	41.4 Å²	41.4	9%	0.089	21%	0.207	C	C	.	.			trans	-126	68.6	-175.5	-57.2	-169.1	-71.2	0	0	112.7	L810 E816 M817 F818 F869	L810-M814 HydrophobicContact CD2-CE 4.37Å; L810-M814 PolarHBondContact O-N 3.22Å; M814-E816 VanDerWaalsContact C-N 3.27Å; M814-E816 PolarHBondContact O-N 3Å; M814-M817 HydrophobicContact CB-CB 4.44Å; M814-M817 HydrophobicContact CB-CG 4.26Å; M814-M817 HydrophobicContact CB-SD 4Å; M814-M817 HydrophobicContact CE-SD 3.7Å; M814-M817 HydrophobicContact CG-SD 4.38Å; M814-M817 PolarHBondContact O-N 2.89Å; M814-M817 HydrophobicContact SD-SD 3.53Å; M814-F818 HydrophobicContact CB-CD2 4.46Å; M814-F818 HydrophobicContact CB-CE2 4.44Å; M814-F818 HydrophobicContact CE-CE2 4.4Å; M814-F818 WeakPolarHBondContact O-CD2 3.4Å; M814-F869 HydrophobicContact CE-CD1 4.31Å; M814-F869 HydrophobicContact CE-CD2 3.71Å; M814-F869 HydrophobicContact CE-CE1 4.08Å; M814-F869 HydrophobicContact CE-CE2 3.46Å; M814-F869 VanDerWaalsContact CE-CE2 3.46Å; M814-F869 HydrophobicContact CE-CG 4.16Å; M814-F869 HydrophobicContact CE-CZ 3.66Å; M814-F869 HydrophobicContact SD-CD1 4.14Å; M814-F869 HydrophobicContact SD-CE1 3.78Å; M814-F869 HydrophobicContact SD-CE2 4.26Å; M814-F869 HydrophobicContact SD-CZ 3.85Å
815	P	76.4	Confident	70.2	Confident	27 Å²	27	40.3 Å²	40.3	18%	0.175	20%	0.201	C	C	.	.	H	α-helix	trans	-55.1	-39.1	-175.9	-26	34.9	0	0	0	113.9	M784 S811 V813 M817 F818 L819	M784-P815 HydrophobicContact CE-CB 4.32Å; M784-P815 HydrophobicContact CE-CG 4.21Å; M784-P815 HydrophobicContact SD-CB 4.48Å; M784-P815 HydrophobicContact SD-CG 4.06Å; S811-P815 WeakPolarHBondContact O-CA 3.14Å; V813-P815 WeakPolarHBondContact O-CD 3.35Å; P815-M817 VanDerWaalsContact C-N 3.3Å; P815-M817 PolarHBondContact O-N 2.88Å; P815-F818 PolarHBondContact O-N 2.95Å; P815-F818 VanDerWaalsContact O-N 3.16Å; P815-L819 WeakPolarHBondContact O-CB 3.35Å; P815-L819 WeakPolarHBondContact O-CG 3.5Å; P815-L819 PolarHBondContact O-N 2.97Å
816	E	69.9	Low	69.7	Low	177 Å²	177	41.8 Å²	41.8	83%	0.827	21%	0.207	S	C	*	.	H	α-helix	trans	-62.5	-33.8	-175.7	-61.6	-175.6	177.1	0	0	113.5	M814	M814-E816 VanDerWaalsContact C-N 3.27Å; M814-E816 PolarHBondContact O-N 3Å
817	M	67.3	Low	69.1	Low	34 Å²	34	47.4 Å²	47.4	17%	0.167	23%	0.227	C	C	.	.	H	α-helix	trans	-71.3	-43	175.4	-62.1	-179.4	72.3	0	0	111.1	L562 K565 C566 L569 M814 P815	L562-M817 HydrophobicContact CD2-CB 4.42Å; L562-M817 WeakPolarHBondContact CD2-O 3.35Å; K565-M817 HydrophobicContact CB-CE 3.9Å; C566-M817 WeakPolarHBondContact SG-CE 3.24Å; L569-M817 HydrophobicContact CD1-CE 4.07Å; L569-M817 HydrophobicContact CD1-SD 3.9Å; M814-M817 HydrophobicContact CB-CB 4.44Å; M814-M817 HydrophobicContact CB-CG 4.26Å; M814-M817 HydrophobicContact CB-SD 4Å; M814-M817 HydrophobicContact CE-SD 3.7Å; M814-M817 HydrophobicContact CG-SD 4.38Å; M814-M817 PolarHBondContact O-N 2.89Å; M814-M817 HydrophobicContact SD-SD 3.53Å; P815-M817 VanDerWaalsContact C-N 3.3Å; P815-M817 PolarHBondContact O-N 2.88Å
818	F	65.8	Low	68.3	Low	13 Å²	13	47 Å²	47	6%	0.057	23%	0.225	C	C	.	.	H	α-helix	trans	-93.6	-14.6	-169.6	-66.5	-70.4	0	0	0	114.9	L562 L810 M814 P815 K820 S821 T822 L825	L562-F818 HydrophobicContact CD1-CD1 4.13Å; L562-F818 HydrophobicContact CD1-CE1 4.09Å; L810-F818 HydrophobicContact CB-CE2 3.9Å; L810-F818 HydrophobicContact CB-CZ 4.13Å; M814-F818 HydrophobicContact CB-CD2 4.46Å; M814-F818 HydrophobicContact CB-CE2 4.44Å; M814-F818 HydrophobicContact CE-CE2 4.4Å; M814-F818 WeakPolarHBondContact O-CD2 3.4Å; P815-F818 PolarHBondContact O-N 2.95Å; P815-F818 VanDerWaalsContact O-N 3.16Å; F818-K820 VanDerWaalsContact C-N 3.27Å; F818-K820 PolarHBondContact O-N 3.04Å; F818-K820 VanDerWaalsContact O-N 3.12Å; F818-S821 CarbonylContact O-C 3.49Å; F818-S821 PolarHBondContact O-N 3.33Å; F818-T822 HydrophobicContact CB-CG2 4.16Å; F818-T822 WeakPolarHBondContact O-CG2 3.46Å; F818-T822 PolarHBondContact O-N 3.41Å; F818-L825 HydrophobicContact CD1-CD1 3.53Å; F818-L825 HydrophobicContact CE1-CD1 3.98Å
819	L	61.3	Low	67.3	Low	127 Å²	127	48.8 Å²	48.8	67%	0.665	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-41	-175	-99	168.3	0	0	0	114.1	P815	P815-L819 WeakPolarHBondContact O-CB 3.35Å; P815-L819 WeakPolarHBondContact O-CG 3.5Å; P815-L819 PolarHBondContact O-N 2.97Å
820	K	60.2	Low	66.1	Low	207 Å²	207	53.3 Å²	53.3	90%	0.9	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-15.3	179	-63.1	-172.9	-179.4	-176.7	0	114	F818	F818-K820 VanDerWaalsContact C-N 3.27Å; F818-K820 PolarHBondContact O-N 3.04Å; F818-K820 VanDerWaalsContact O-N 3.12Å
821	S	57.8	Low	64.9	Low	15 Å²	15	54.9 Å²	54.9	11%	0.105	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-3.6	-167.5	-56.1	0	0	0	0	114.2	F818 D823 L824 L825	F818-S821 CarbonylContact O-C 3.49Å; F818-S821 PolarHBondContact O-N 3.33Å; S821-D823 VanDerWaalsContact C-N 3.32Å; S821-D823 PolarHBondContact O-N 2.92Å; S821-L824 PolarHBondContact O-N 3.03Å; S821-L825 WeakPolarHBondContact O-CB 3.23Å; S821-L825 WeakPolarHBondContact O-CG 3.3Å; S821-L825 PolarHBondContact O-N 3.11Å
822	T	62.8	Low	63.5	Low	30 Å²	30	57.1 Å²	57.1	18%	0.184	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-37.6	-176.1	70.2	0	0	0	0	113.9	F818 K826	F818-T822 HydrophobicContact CB-CG2 4.16Å; F818-T822 WeakPolarHBondContact O-CG2 3.46Å; F818-T822 PolarHBondContact O-N 3.41Å; T822-K826 WeakPolarHBondContact O-CD 3.42Å; T822-K826 WeakPolarHBondContact O-CE 3.44Å; T822-K826 WeakPolarHBondContact O-CG 3.37Å; T822-K826 PolarHBondContact O-N 3.12Å; T822-K826 PolarHBondContact OG1-NZ 3.44Å
823	D	62	Low	61.8	Low	107 Å²	107	58.7 Å²	58.7	57%	0.572	28%	0.281	S	S	*	.	H	α-helix	trans	-76.2	-32.9	178.4	-70.6	-60.3	0	0	0	113	S821 K826 R827	S821-D823 VanDerWaalsContact C-N 3.32Å; S821-D823 PolarHBondContact O-N 2.92Å; D823-K826 WeakPolarHBondContact O-CB 3.41Å; D823-K826 PolarHBondContact O-N 3.32Å; D823-K826 WeakPolarHBondContact OD1-CD 3.21Å; D823-K826 IonicContact OD1-NZ 2.68Å; D823-K826 PolarHBondContact OD1-NZ 2.96Å; D823-K826 IonicContact OD2-NZ 3.71Å; D823-R827 PolarHBondContact O-N 3.46Å; D823-R827 VanDerWaalsContact O-N 3.08Å
824	L	57.5	Low	59.9	Low	31 Å²	31	65 Å²	65	16%	0.162	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-50.7	170.4	175.8	143.4	0	0	0	109.8	E554 V555 S821 K826 R827 I828	E554-L824 HydrophobicContact CG-CD1 4.5Å; V555-L824 HydrophobicContact CG2-CD1 4.24Å; V555-L824 HydrophobicContact CG2-CD2 4.36Å; V555-L824 HydrophobicContact CG2-CG 3.85Å; S821-L824 PolarHBondContact O-N 3.03Å; L824-K826 VanDerWaalsContact C-N 3.32Å; L824-K826 PolarHBondContact O-N 3.44Å; L824-R827 WeakPolarHBondContact O-CA 3.34Å; L824-R827 WeakPolarHBondContact O-CB 3.45Å; L824-R827 PolarHBondContact O-N 2.97Å; L824-I828 HydrophobicContact CD2-CD1 3.52Å; L824-I828 HydrophobicContact CD2-CG1 4.46Å; L824-I828 HydrophobicContact CG-CD1 4.27Å; L824-I828 VanDerWaalsContact O-CG1 3.25Å; L824-I828 WeakPolarHBondContact O-CG1 3.47Å; L824-I828 PolarHBondContact O-N 2.99Å
825	L	59.7	Low	58	Low	8 Å²	8	64.9 Å²	64.9	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-35	174.5	-70.2	162.3	0	0	0	113.1	V559 L562 I807 F818 S821 I828 F829	V559-L825 HydrophobicContact CG2-CD2 3.98Å; L562-L825 HydrophobicContact CD1-CD1 4.24Å; I807-L825 HydrophobicContact CG2-CB 4.19Å; I807-L825 HydrophobicContact CG2-CD1 4.19Å; F818-L825 HydrophobicContact CD1-CD1 3.53Å; F818-L825 HydrophobicContact CE1-CD1 3.98Å; S821-L825 WeakPolarHBondContact O-CB 3.23Å; S821-L825 WeakPolarHBondContact O-CG 3.3Å; S821-L825 PolarHBondContact O-N 3.11Å; L825-I828 HydrophobicContact CD2-CD1 4.18Å; L825-I828 PolarHBondContact O-N 3.44Å; L825-F829 HydrophobicContact CD2-CD2 4.42Å; L825-F829 HydrophobicContact CD2-CE2 3.91Å; L825-F829 WeakPolarHBondContact O-CD2 3.46Å; L825-F829 PolarHBondContact O-N 3.44Å; L825-F829 VanDerWaalsContact O-N 3.08Å
826	K	61.6	Low	55.9	Low	40 Å²	40	66.9 Å²	66.9	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-47.2	169.5	-74.7	163.1	-148.3	134.7	0	111	M775 T822 D823 L824 Q830	M775-K826 HydrophobicContact SD-CD 3.87Å; M775-K826 WeakPolarHBondContact SD-CE 3.28Å; M775-K826 HydrophobicContact SD-CG 3.55Å; M775-K826 VanDerWaalsContact SD-CG 3.55Å; T822-K826 WeakPolarHBondContact O-CD 3.42Å; T822-K826 WeakPolarHBondContact O-CE 3.44Å; T822-K826 WeakPolarHBondContact O-CG 3.37Å; T822-K826 PolarHBondContact O-N 3.12Å; T822-K826 PolarHBondContact OG1-NZ 3.44Å; D823-K826 WeakPolarHBondContact O-CB 3.41Å; D823-K826 PolarHBondContact O-N 3.32Å; D823-K826 WeakPolarHBondContact OD1-CD 3.21Å; D823-K826 IonicContact OD1-NZ 2.68Å; D823-K826 PolarHBondContact OD1-NZ 2.96Å; D823-K826 IonicContact OD2-NZ 3.71Å; L824-K826 VanDerWaalsContact C-N 3.32Å; L824-K826 PolarHBondContact O-N 3.44Å; K826-Q830 WeakPolarHBondContact O-CB 3.4Å; K826-Q830 VanDerWaalsContact O-CD 3.32Å; K826-Q830 WeakPolarHBondContact O-CG 3.37Å; K826-Q830 PolarHBondContact O-N 2.85Å
827	R	57.6	Low	53.9	Low	135 Å²	135	65.3 Å²	65.3	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-51.2	176.2	-66.1	-175.4	-162.6	178.1	10.1	111	D551 D823 L824 F829 Q830 I831	D551-R827 IonicContact OD1-NH1 3.76Å; D551-R827 IonicContact OD2-CZ 3.9Å; D551-R827 IonicContact OD2-NH1 2.68Å; D551-R827 PolarHBondContact OD2-NH1 3.11Å; D823-R827 PolarHBondContact O-N 3.46Å; D823-R827 VanDerWaalsContact O-N 3.08Å; L824-R827 WeakPolarHBondContact O-CA 3.34Å; L824-R827 WeakPolarHBondContact O-CB 3.45Å; L824-R827 PolarHBondContact O-N 2.97Å; R827-F829 PolarHBondContact O-N 3.26Å; R827-Q830 CarbonylContact O-C 3.59Å; R827-Q830 PolarHBondContact O-N 2.94Å; R827-I831 VanDerWaalsContact O-CG1 3.32Å; R827-I831 WeakPolarHBondContact O-CG1 3.48Å; R827-I831 PolarHBondContact O-N 3.34Å
828	I	54.1	Low	52.2	Low	4 Å²	4	66 Å²	66	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-48	-64.2	-179.5	-67.8	178.1	0	0	0	111	V555 V559 L824 L825 Q830 I831 Y832	V555-I828 HydrophobicContact CB-CD1 3.96Å; V555-I828 HydrophobicContact CB-CG1 3.94Å; V555-I828 HydrophobicContact CG1-CD1 3.56Å; V555-I828 HydrophobicContact CG1-CG1 3.41Å; V555-I828 VanDerWaalsContact CG1-CG1 3.41Å; V555-I828 HydrophobicContact CG2-CD1 3.81Å; V555-I828 HydrophobicContact CG2-CG1 3.48Å; V555-I828 VanDerWaalsContact CG2-CG1 3.48Å; V559-I828 HydrophobicContact CG2-CD1 3.44Å; V559-I828 VanDerWaalsContact CG2-CD1 3.44Å; L824-I828 HydrophobicContact CD2-CD1 3.52Å; L824-I828 HydrophobicContact CD2-CG1 4.46Å; L824-I828 HydrophobicContact CG-CD1 4.27Å; L824-I828 VanDerWaalsContact O-CG1 3.25Å; L824-I828 WeakPolarHBondContact O-CG1 3.47Å; L824-I828 PolarHBondContact O-N 2.99Å; L825-I828 HydrophobicContact CD2-CD1 4.18Å; L825-I828 PolarHBondContact O-N 3.44Å; I828-Q830 VanDerWaalsContact C-N 3.28Å; I828-Q830 PolarHBondContact O-N 3.17Å; I828-I831 WeakPolarHBondContact O-CB 3.25Å; I828-I831 PolarHBondContact O-N 2.9Å; I828-I831 VanDerWaalsContact O-N 3.09Å; I828-Y832 HydrophobicContact CG2-CD2 3.77Å; I828-Y832 HydrophobicContact CG2-CE2 3.39Å; I828-Y832 VanDerWaalsContact O-CD2 3.3Å; I828-Y832 WeakPolarHBondContact O-CD2 3.22Å; I828-Y832 PolarHBondContact O-N 3.47Å
829	F	56.3	Low	50.6	Low	38 Å²	38	76 Å²	76	17%	0.167	36%	0.36	C	S	.	.	H	α-helix	trans	-80.4	-10.8	-172.6	-66.2	-89.4	0	0	0	112.2	L803 L804 I807 L825 R827 Y832 S833	L803-F829 HydrophobicContact CB-CD1 3.57Å; L803-F829 HydrophobicContact CB-CE1 4.02Å; L803-F829 HydrophobicContact CB-CG 4.35Å; L803-F829 HydrophobicContact CD1-CD1 3.8Å; L803-F829 HydrophobicContact CD1-CE1 3.89Å; L803-F829 HydrophobicContact CG-CD1 4.29Å; L803-F829 HydrophobicContact CG-CE1 4.44Å; L804-F829 HydrophobicContact CD2-CB 3.64Å; L804-F829 HydrophobicContact CG-CB 3.8Å; I807-F829 HydrophobicContact CD1-CB 4.17Å; I807-F829 HydrophobicContact CD1-CD1 4.07Å; I807-F829 HydrophobicContact CD1-CD2 3.09Å; I807-F829 HydrophobicContact CD1-CE1 4.24Å; I807-F829 HydrophobicContact CD1-CE2 3.31Å; I807-F829 HydrophobicContact CD1-CG 3.5Å; I807-F829 HydrophobicContact CD1-CZ 3.89Å; I807-F829 HydrophobicContact CG1-CE2 4.48Å; L825-F829 HydrophobicContact CD2-CD2 4.42Å; L825-F829 HydrophobicContact CD2-CE2 3.91Å; L825-F829 WeakPolarHBondContact O-CD2 3.46Å; L825-F829 PolarHBondContact O-N 3.44Å; L825-F829 VanDerWaalsContact O-N 3.08Å; R827-F829 PolarHBondContact O-N 3.26Å; F829-Y832 HydrophobicContact CD1-CD2 4.43Å; F829-S833 WeakPolarHBondContact O-CB 3.34Å; F829-S833 PolarHBondContact O-N 3.1Å; F829-S833 PolarHBondContact O-OG 3.44Å
830	Q	55.8	Low	49	Very low	101 Å²	101	78.7 Å²	78.7	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-79.7	-24.3	163.6	-74.4	171.7	26.8	0	0	113.9	L804 K826 R827 I828 K834	L804-Q830 HydrophobicContact CD1-CG 4.08Å; K826-Q830 WeakPolarHBondContact O-CB 3.4Å; K826-Q830 VanDerWaalsContact O-CD 3.32Å; K826-Q830 WeakPolarHBondContact O-CG 3.37Å; K826-Q830 PolarHBondContact O-N 2.85Å; R827-Q830 CarbonylContact O-C 3.59Å; R827-Q830 PolarHBondContact O-N 2.94Å; I828-Q830 VanDerWaalsContact C-N 3.28Å; I828-Q830 PolarHBondContact O-N 3.17Å; Q830-K834 WeakPolarHBondContact O-CG 3.4Å
831	I	50.9	Low	47.5	Very low	40 Å²	40	77.7 Å²	77.7	21%	0.205	37%	0.368	C	S	.	.	H	α-helix	trans	-72.2	-49.4	169.1	-69.5	162.2	0	0	0	108	L507 R827 I828 S833 K834	L507-I831 WeakPolarHBondContact O-CG2 3.34Å; R827-I831 VanDerWaalsContact O-CG1 3.32Å; R827-I831 WeakPolarHBondContact O-CG1 3.48Å; R827-I831 PolarHBondContact O-N 3.34Å; I828-I831 WeakPolarHBondContact O-CB 3.25Å; I828-I831 PolarHBondContact O-N 2.9Å; I828-I831 VanDerWaalsContact O-N 3.09Å; I831-S833 VanDerWaalsContact C-N 3.34Å; I831-S833 PolarHBondContact O-N 2.95Å; I831-K834 WeakPolarHBondContact O-CB 3.3Å; I831-K834 PolarHBondContact O-N 3.16Å; I831-K834 VanDerWaalsContact O-N 3.15Å
832	Y	50	Low	46.2	Very low	48 Å²	48	85 Å²	85	19%	0.188	41%	0.406	C	S	.	.	H	α-helix	trans	-72.2	-22	178.8	-50.8	-38.2	0	0	0	114	L507 I828 F829 K834 R858	L507-Y832 HydrophobicContact CB-CE1 4.38Å; L507-Y832 HydrophobicContact CD1-CD1 4.12Å; L507-Y832 HydrophobicContact CD1-CE1 3.83Å; L507-Y832 HydrophobicContact CD2-CD1 4.2Å; L507-Y832 HydrophobicContact CG-CE1 4.47Å; I828-Y832 HydrophobicContact CG2-CD2 3.77Å; I828-Y832 HydrophobicContact CG2-CE2 3.39Å; I828-Y832 VanDerWaalsContact O-CD2 3.3Å; I828-Y832 WeakPolarHBondContact O-CD2 3.22Å; I828-Y832 PolarHBondContact O-N 3.47Å; F829-Y832 HydrophobicContact CD1-CD2 4.43Å; Y832-K834 VanDerWaalsContact C-N 3.26Å; Y832-K834 PolarHBondContact O-N 3.31Å; Y832-R858 PolarHBondContact OH-NH1 3.18Å
833	S	48.5	Very low	44.5	Very low	32 Å²	32	92.8 Å²	92.8	22%	0.224	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	7.7	170.3	-59	0	0	0	0	114.2	F829 I831	F829-S833 WeakPolarHBondContact O-CB 3.34Å; F829-S833 PolarHBondContact O-N 3.1Å; F829-S833 PolarHBondContact O-OG 3.44Å; I831-S833 VanDerWaalsContact C-N 3.34Å; I831-S833 PolarHBondContact O-N 2.95Å
834	K	44.7	Very low	43	Very low	132 Å²	132	93.4 Å²	93.4	57%	0.574	45%	0.453	S	S	*	.	S	Bend	trans	-99.3	113.5	173.1	-80.5	170.1	-179.2	174.9	0	109.7	Q830 I831 Y832	Q830-K834 WeakPolarHBondContact O-CG 3.4Å; I831-K834 WeakPolarHBondContact O-CB 3.3Å; I831-K834 PolarHBondContact O-N 3.16Å; I831-K834 VanDerWaalsContact O-N 3.15Å; Y832-K834 VanDerWaalsContact C-N 3.26Å; Y832-K834 PolarHBondContact O-N 3.31Å
835	P	39	Very low	41.5	Very low	17 Å²	17	96.1 Å²	96.1	11%	0.11	48%	0.479	C	S	.	.			trans	-64.1	147.7	168	27.8	-33.8	0	0	0	110.9	N837 N1268 R1278	P835-N837 PolarHBondContact O-N 3.45Å; P835-N1268 HydrophobicContact CB-CB 4.08Å; P835-N1268 WeakPolarHBondContact CB-OD1 3.32Å; P835-N1268 HydrophobicContact CG-CB 4.12Å; P835-N1268 WeakPolarHBondContact CG-OD1 3.43Å; P835-R1278 VanDerWaalsContact CG-NH1 3.33Å
836	M	30.6	Very low	39.8	Very low	68 Å²	68	102.9 Å²	102.9	34%	0.335	52%	0.516	S	S	.	.			trans	-66.5	116.8	170.4	-71.9	-155.5	75.7	0	0	110	T506 S838 I1266	T506-M836 HydrophobicContact CG2-CE 3.9Å; T506-M836 HydrophobicContact CG2-SD 4.33Å; T506-M836 PolarHBondContact OG1-SD 3.46Å; M836-S838 VanDerWaalsContact C-N 3.26Å; M836-S838 PolarHBondContact O-N 3.45Å; M836-I1266 HydrophobicContact CB-CD1 4.03Å
837	N	29.2	Very low	38.2	Very low	145 Å²	145	107.7 Å²	107.7	78%	0.775	54%	0.543	S	S	*	.			trans	-75.1	78.2	169.7	-67.3	-19.3	0	0	0	109.3	P835	P835-N837 PolarHBondContact O-N 3.45Å
838	S	32	Very low	37.1	Very low	49 Å²	49	105.1 Å²	105.1	34%	0.343	55%	0.546	S	S	.	.			trans	-149.9	107.7	176.2	51.9	0	0	0	0	113.7	M836 I1266	M836-S838 VanDerWaalsContact C-N 3.26Å; M836-S838 PolarHBondContact O-N 3.45Å; S838-I1266 WeakPolarHBondContact O-CD1 3.49Å
839	R	32.1	Very low	36.4	Very low	223 Å²	223	108.5 Å²	108.5	84%	0.842	57%	0.569	S	S	*	*			trans	77.2	111.3	160.6	-71.3	177.9	163.1	166.8	-13.2	118.4
840	E	27	Very low	35.6	Very low	183 Å²	183	112.8 Å²	112.8	86%	0.855	59%	0.592	S	S	*	*			trans	-65.6	177.2	143.3	-63.2	153.5	129.3	0	0	109.8
841	E	27.9	Very low	35.2	Very low	185 Å²	185	111 Å²	111	86%	0.864	58%	0.581	S	S	*	*			trans	73.5	79.8	178.5	-54	179.4	162.9	0	0	115.7
842	D	30.7	Very low	35.3	Very low	169 Å²	169	110.8 Å²	110.8	90%	0.904	58%	0.583	S	S	*	*				-151.6	150.8	118	-118.7	-34.8	0	0	0	111.1
843	Q	27.5	Very low	35.1	Very low	194 Å²	194	113.1 Å²	113.1	91%	0.907	61%	0.606	S	S	*	*			trans	-117.1	99.8	-171.4	-65.8	-178.3	26.7	0	0	112.3
844	S	29.7	Very low	35.1	Very low	120 Å²	120	113.1 Å²	113.1	84%	0.839	60%	0.602	S	S	*	*			trans	-144.2	140.8	161.3	50.5	0	0	0	0	110.5
845	A	26.6	Very low	35.5	Very low	87 Å²	87	111.1 Å²	111.1	72%	0.719	60%	0.595	S	S	*	*			trans	-84.5	160.4	-178.4	0	0	0	0	0	111.4
846	N	23.7	Very low	36.2	Very low	150 Å²	150	114 Å²	114	80%	0.802	61%	0.607	S	S	*	*			trans	72.6	105.8	-177	-43	-25.4	0	0	0	113.8
847	N	28.8	Very low	37.4	Very low	141 Å²	141	115.9 Å²	115.9	75%	0.754	62%	0.615	S	S	*	*			trans	-173.6	149.5	137.9	-97.6	-28.2	0	0	0	111.7
848	S	34.1	Very low	38.7	Very low	82 Å²	82	111.6 Å²	111.6	57%	0.573	59%	0.588	S	S	*	*			trans	-72.9	155.5	164.8	48.4	0	0	0	0	110.7	I850	S848-I850 PolarHBondContact O-N 3.21Å
849	P	38.4	Very low	39.9	Very low	75 Å²	75	110.4 Å²	110.4	49%	0.487	58%	0.577	S	S	.	*			trans	-71.5	94.8	-179.2	28.1	-34.2	0	0	0	111.6	V1267	P849-V1267 HydrophobicContact CB-CG1 4.31Å; P849-V1267 HydrophobicContact CB-CG2 3.93Å
850	I	40.2	Very low	41.3	Very low	128 Å²	128	102.6 Å²	102.6	66%	0.656	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-65	136.3	173.1	-59.8	174.7	0	0	0	109.4	S848	S848-I850 PolarHBondContact O-N 3.21Å
851	R	46.8	Very low	42.8	Very low	63 Å²	63	97.7 Å²	97.7	24%	0.238	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-81.9	152.7	177.4	-67.5	173	168.2	-174.8	-7.9	110.7	E856	R851-E856 WeakPolarHBondContact CD-OE1 2.87Å; R851-E856 IonicContact CZ-OE1 3.29Å; R851-E856 IonicContact NH1-OE1 2.8Å; R851-E856 PolarHBondContact NH1-OE1 3.2Å
852	S	52.9	Low	44.3	Very low	36 Å²	36	89.7 Å²	89.7	25%	0.252	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-67.4	136.5	165.7	69.1	0	0	0	0	109.6	F854 E855 E856	S852-F854 PolarHBondContact O-N 3.18Å; S852-E855 PolarHBondContact O-N 3.3Å; S852-E855 WeakPolarHBondContact OG-CB 3.14Å; S852-E855 VanDerWaalsContact OG-CD 3.27Å; S852-E855 WeakPolarHBondContact OG-CG 3.24Å; S852-E855 PolarHBondContact OG-N 2.99Å; S852-E855 PolarHBondContact OG-OE2 2.96Å; S852-E856 PolarHBondContact O-N 3.45Å; S852-E856 VanDerWaalsContact O-N 3.07Å
853	S	47.5	Very low	45.7	Very low	97 Å²	97	84.6 Å²	84.6	68%	0.678	47%	0.467	S	S	*	.	H	α-helix	trans	-57.7	-33.9	179.4	52.1	0	0	0	0	111.9	E856 E857	S853-E856 PolarHBondContact O-N 3.48Å; S853-E857 WeakPolarHBondContact O-CB 3.45Å; S853-E857 PolarHBondContact O-N 3.15Å
854	F	48.6	Very low	47.4	Very low	32 Å²	32	77 Å²	77	14%	0.14	44%	0.44	C	S	.	.	H	α-helix	trans	-65.9	-36	174.9	-177.3	-99.9	0	0	0	114	E504 L507 S852 R858	E504-F854 HydrophobicContact CG-CD2 4.22Å; E504-F854 HydrophobicContact CG-CE2 3.48Å; E504-F854 VanDerWaalsContact CG-CE2 3.48Å; E504-F854 HydrophobicContact CG-CZ 3.8Å; L507-F854 HydrophobicContact CD1-CD1 4.26Å; L507-F854 HydrophobicContact CD1-CE1 3.38Å; L507-F854 HydrophobicContact CD1-CZ 3.76Å; S852-F854 PolarHBondContact O-N 3.18Å; F854-R858 VanDerWaalsContact CZ-NE 3.29Å; F854-R858 WeakPolarHBondContact O-CB 2.89Å; F854-R858 WeakPolarHBondContact O-CD 3.42Å; F854-R858 VanDerWaalsContact O-CG 3.26Å; F854-R858 WeakPolarHBondContact O-CG 3.47Å; F854-R858 PolarHBondContact O-N 3.39Å
855	E	52	Low	49	Very low	89 Å²	89	73 Å²	73	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-71.3	-37.8	170.5	-76.7	170.4	124.3	0	0	111.4	S852 L859	S852-E855 PolarHBondContact O-N 3.3Å; S852-E855 WeakPolarHBondContact OG-CB 3.14Å; S852-E855 VanDerWaalsContact OG-CD 3.27Å; S852-E855 WeakPolarHBondContact OG-CG 3.24Å; S852-E855 PolarHBondContact OG-N 2.99Å; S852-E855 PolarHBondContact OG-OE2 2.96Å; E855-L859 WeakPolarHBondContact O-CB 3.4Å; E855-L859 PolarHBondContact O-N 3.39Å
856	E	53.8	Low	50.9	Low	78 Å²	78	69.9 Å²	69.9	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-48.4	177.8	-161.1	103	-100.7	0	0	111.6	R851 S852 S853 R858 L859 V860	R851-E856 WeakPolarHBondContact CD-OE1 2.87Å; R851-E856 IonicContact CZ-OE1 3.29Å; R851-E856 IonicContact NH1-OE1 2.8Å; R851-E856 PolarHBondContact NH1-OE1 3.2Å; S852-E856 PolarHBondContact O-N 3.45Å; S852-E856 VanDerWaalsContact O-N 3.07Å; S853-E856 PolarHBondContact O-N 3.48Å; E856-R858 VanDerWaalsContact C-N 3.32Å; E856-R858 PolarHBondContact O-N 3.28Å; E856-L859 CarbonylContact O-C 3.52Å; E856-L859 WeakPolarHBondContact O-CB 3.45Å; E856-L859 PolarHBondContact O-N 2.99Å; E856-L859 VanDerWaalsContact O-N 3.14Å; E856-V860 WeakPolarHBondContact O-CG2 3.28Å; E856-V860 PolarHBondContact O-N 3.43Å
857	E	57.1	Low	52.8	Low	107 Å²	107	68.4 Å²	68.4	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-56.8	-45.9	176.1	-167.6	-148.2	152.3	0	0	111.1	S853 L859 V860 Q861	S853-E857 WeakPolarHBondContact O-CB 3.45Å; S853-E857 PolarHBondContact O-N 3.15Å; E857-L859 VanDerWaalsContact C-N 3.32Å; E857-L859 PolarHBondContact O-N 2.61Å; E857-V860 WeakPolarHBondContact O-CB 3.04Å; E857-V860 PolarHBondContact O-N 3.42Å; E857-Q861 WeakPolarHBondContact O-CG 3.47Å; E857-Q861 PolarHBondContact O-N 2.94Å; E857-Q861 PolarHBondContact OE1-NE2 3.19Å
858	R	55.6	Low	54.7	Low	56 Å²	56	62.2 Å²	62.2	21%	0.211	34%	0.336	C	S	.	.	H	α-helix	trans	-72	-26.8	179.4	-70.9	175.2	171.5	-143.4	-4.5	113	Y832 F854 E856 A862	Y832-R858 PolarHBondContact OH-NH1 3.18Å; F854-R858 VanDerWaalsContact CZ-NE 3.29Å; F854-R858 WeakPolarHBondContact O-CB 2.89Å; F854-R858 WeakPolarHBondContact O-CD 3.42Å; F854-R858 VanDerWaalsContact O-CG 3.26Å; F854-R858 WeakPolarHBondContact O-CG 3.47Å; F854-R858 PolarHBondContact O-N 3.39Å; E856-R858 VanDerWaalsContact C-N 3.32Å; E856-R858 PolarHBondContact O-N 3.28Å; R858-A862 VanDerWaalsContact O-CB 3.23Å; R858-A862 WeakPolarHBondContact O-CB 3.46Å; R858-A862 PolarHBondContact O-N 3.15Å
859	L	57.1	Low	56.7	Low	23 Å²	23	58.4 Å²	58.4	12%	0.12	31%	0.309	C	S	.	.	H	α-helix	trans	-72.4	-34.1	170.6	178.2	161.9	0	0	0	110.8	E855 E856 E857 K863 V1200	E855-L859 WeakPolarHBondContact O-CB 3.4Å; E855-L859 PolarHBondContact O-N 3.39Å; E856-L859 CarbonylContact O-C 3.52Å; E856-L859 WeakPolarHBondContact O-CB 3.45Å; E856-L859 PolarHBondContact O-N 2.99Å; E856-L859 VanDerWaalsContact O-N 3.14Å; E857-L859 VanDerWaalsContact C-N 3.32Å; E857-L859 PolarHBondContact O-N 2.61Å; L859-K863 HydrophobicContact CD2-CD 3.9Å; L859-K863 VanDerWaalsContact CD2-CE 3.4Å; L859-K863 HydrophobicContact CD2-CG 4.44Å; L859-K863 WeakPolarHBondContact O-CB 3.48Å; L859-K863 VanDerWaalsContact O-CG 3.29Å; L859-K863 WeakPolarHBondContact O-CG 3.48Å; L859-K863 PolarHBondContact O-N 2.7Å; L859-V1200 HydrophobicContact CD1-CG2 3.75Å; L859-V1200 HydrophobicContact CG-CG2 4.46Å
860	V	61.1	Low	58.6	Low	59 Å²	59	56 Å²	56	36%	0.358	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-47.6	169.5	171.6	0	0	0	0	111.2	M59 E856 E857 A862 K863 G864	M59-V860 HydrophobicContact CE-CG1 4.32Å; E856-V860 WeakPolarHBondContact O-CG2 3.28Å; E856-V860 PolarHBondContact O-N 3.43Å; E857-V860 WeakPolarHBondContact O-CB 3.04Å; E857-V860 PolarHBondContact O-N 3.42Å; V860-A862 VanDerWaalsContact C-N 3.29Å; V860-A862 PolarHBondContact O-N 3.34Å; V860-K863 WeakPolarHBondContact O-CB 3.38Å; V860-K863 PolarHBondContact O-N 3.05Å; V860-K863 VanDerWaalsContact O-N 3.12Å; V860-G864 PolarHBondContact O-N 3.23Å
861	Q	59	Low	60.6	Low	81 Å²	81	51.6 Å²	51.6	38%	0.379	27%	0.272	S	S	.	.	H	α-helix	trans	-56.4	-44.5	172.7	-67.3	173.1	13.5	0	0	111.2	E857 K863 G864 L865	E857-Q861 WeakPolarHBondContact O-CG 3.47Å; E857-Q861 PolarHBondContact O-N 2.94Å; E857-Q861 PolarHBondContact OE1-NE2 3.19Å; Q861-K863 PolarHBondContact O-N 2.84Å; Q861-G864 PolarHBondContact O-N 2.88Å; Q861-L865 PolarHBondContact O-N 3.29Å
862	A	58.6	Low	62.3	Low	17 Å²	17	51.3 Å²	51.3	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-31.3	176.8	0	0	0	0	0	113.8	R858 V860 L866	R858-A862 VanDerWaalsContact O-CB 3.23Å; R858-A862 WeakPolarHBondContact O-CB 3.46Å; R858-A862 PolarHBondContact O-N 3.15Å; V860-A862 VanDerWaalsContact C-N 3.29Å; V860-A862 PolarHBondContact O-N 3.34Å; A862-L866 WeakPolarHBondContact O-CG 3.4Å
863	K	60.8	Low	63.6	Low	62 Å²	62	50.8 Å²	50.8	27%	0.27	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-47	170.2	-80.5	165.2	171.8	168.6	0	110.8	L859 V860 Q861 L865 L866 Q867 N1199 V1200	L859-K863 HydrophobicContact CD2-CD 3.9Å; L859-K863 VanDerWaalsContact CD2-CE 3.4Å; L859-K863 HydrophobicContact CD2-CG 4.44Å; L859-K863 WeakPolarHBondContact O-CB 3.48Å; L859-K863 VanDerWaalsContact O-CG 3.29Å; L859-K863 WeakPolarHBondContact O-CG 3.48Å; L859-K863 PolarHBondContact O-N 2.7Å; V860-K863 WeakPolarHBondContact O-CB 3.38Å; V860-K863 PolarHBondContact O-N 3.05Å; V860-K863 VanDerWaalsContact O-N 3.12Å; Q861-K863 PolarHBondContact O-N 2.84Å; K863-L865 VanDerWaalsContact C-N 3.28Å; K863-L865 PolarHBondContact O-N 3.06Å; K863-L866 WeakPolarHBondContact O-CB 3.46Å; K863-L866 PolarHBondContact O-N 2.89Å; K863-Q867 PolarHBondContact O-N 2.95Å; K863-N1199 PolarHBondContact NZ-O 2.98Å; K863-V1200 WeakPolarHBondContact CE-O 3.43Å
864	G	62.4	Low	65.1	Low	34 Å²	34	47.5 Å²	47.5	35%	0.351	24%	0.238	S	C	.	.	H	α-helix	trans	-56.6	-39.4	178.3	0	0	0	0	0	113.1	V860 Q861 L866 Q867	V860-G864 PolarHBondContact O-N 3.23Å; Q861-G864 PolarHBondContact O-N 2.88Å; G864-L866 VanDerWaalsContact C-N 3.25Å; G864-L866 PolarHBondContact O-N 3.29Å; G864-Q867 PolarHBondContact O-N 3.35Å
865	L	63.4	Low	66.5	Low	36 Å²	36	46.7 Å²	46.7	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-25.1	174.2	-61.6	175.8	0	0	0	114.7	L563 C566 Q861 K863 F869	L563-L865 HydrophobicContact CB-CD2 4.3Å; L563-L865 HydrophobicContact CD2-CD1 3.53Å; L563-L865 HydrophobicContact CD2-CD2 3.6Å; L563-L865 HydrophobicContact CD2-CG 3.92Å; C566-L865 HydrophobicContact CB-CD2 3.63Å; Q861-L865 PolarHBondContact O-N 3.29Å; K863-L865 VanDerWaalsContact C-N 3.28Å; K863-L865 PolarHBondContact O-N 3.06Å; L865-F869 VanDerWaalsContact O-CD2 3.22Å; L865-F869 WeakPolarHBondContact O-CD2 3.26Å
866	L	66.6	Low	67.5	Low	21 Å²	21	47.1 Å²	47.1	11%	0.11	25%	0.247	C	C	.	.	H	α-helix	trans	-88.2	-31.9	-177.9	-65.8	169.2	0	0	0	112.3	I799 L806 L810 A862 K863 G864 F869 C870	I799-L866 HydrophobicContact CD1-CD1 4.44Å; L806-L866 HydrophobicContact CD1-CD1 3.59Å; L806-L866 HydrophobicContact CD1-CD2 3.7Å; L806-L866 HydrophobicContact CD1-CG 4.23Å; L806-L866 HydrophobicContact CD2-CD1 3.85Å; L806-L866 HydrophobicContact CD2-CD2 4.13Å; L806-L866 HydrophobicContact CD2-CG 4.23Å; L806-L866 HydrophobicContact CG-CD1 4.24Å; L806-L866 HydrophobicContact CG-CD2 4.01Å; L810-L866 HydrophobicContact CD1-CD2 3.96Å; L810-L866 HydrophobicContact CD2-CD2 4.05Å; L810-L866 HydrophobicContact CG-CD2 4.04Å; A862-L866 WeakPolarHBondContact O-CG 3.4Å; K863-L866 WeakPolarHBondContact O-CB 3.46Å; K863-L866 PolarHBondContact O-N 2.89Å; G864-L866 VanDerWaalsContact C-N 3.25Å; G864-L866 PolarHBondContact O-N 3.29Å; L866-F869 CarbonylContact O-C 3.56Å; L866-F869 PolarHBondContact O-N 3.22Å; L866-C870 HydrophobicContact CB-CB 4.15Å; L866-C870 WeakPolarHBondContact O-CB 3.23Å; L866-C870 PolarHBondContact O-N 2.73Å
867	Q	65.1	Low	68.3	Low	119 Å²	119	49 Å²	49	56%	0.556	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-47.4	-167.6	-167.2	169.8	-5.4	0	0	115.2	K863 G864	K863-Q867 PolarHBondContact O-N 2.95Å; G864-Q867 PolarHBondContact O-N 3.35Å
868	P	67.9	Low	68.9	Low	12 Å²	12	45.5 Å²	45.5	8%	0.078	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-30.2	177.2	30.3	-38.4	0	0	0	113.7	T570 W644	T570-P868 HydrophobicContact CG2-CB 4.1Å; T570-P868 HydrophobicContact CG2-CG 4.01Å; T570-P868 WeakPolarHBondContact OG1-CG 3.23Å; W644-P868 WeakPolarHBondContact CZ2-O 2.99Å
869	F	75.3	Confident	69.4	Low	1 Å²	1	43.3 Å²	43.3	0%	0.004	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-4.6	-172.8	-48.1	-61.7	0	0	0	113.3	C566 L569 V653 G655 I656 M814 L865 L866	C566-F869 HydrophobicContact CB-CE2 4.28Å; L569-F869 HydrophobicContact CB-CE1 4.48Å; L569-F869 HydrophobicContact CB-CZ 4.11Å; L569-F869 HydrophobicContact CD1-CZ 4.31Å; V653-F869 HydrophobicContact CG1-CD1 3.53Å; V653-F869 HydrophobicContact CG1-CE1 3.59Å; G655-F869 CarbonylContact C-O 3.55Å; I656-F869 WeakPolarHBondContact CB-O 3.5Å; I656-F869 PolarHBondContact N-O 3.34Å; M814-F869 HydrophobicContact CE-CD1 4.31Å; M814-F869 HydrophobicContact CE-CD2 3.71Å; M814-F869 HydrophobicContact CE-CE1 4.08Å; M814-F869 HydrophobicContact CE-CE2 3.46Å; M814-F869 VanDerWaalsContact CE-CE2 3.46Å; M814-F869 HydrophobicContact CE-CG 4.16Å; M814-F869 HydrophobicContact CE-CZ 3.66Å; M814-F869 HydrophobicContact SD-CD1 4.14Å; M814-F869 HydrophobicContact SD-CE1 3.78Å; M814-F869 HydrophobicContact SD-CE2 4.26Å; M814-F869 HydrophobicContact SD-CZ 3.85Å; L865-F869 VanDerWaalsContact O-CD2 3.22Å; L865-F869 WeakPolarHBondContact O-CD2 3.26Å; L866-F869 CarbonylContact O-C 3.56Å; L866-F869 PolarHBondContact O-N 3.22Å
870	C	79.6	Confident	69.8	Low	26 Å²	26	46.3 Å²	46.3	18%	0.176	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	94.9	-167.8	-166.1	0	0	0	0	112.5	I656 A658 L866	I656-C870 HydrophobicContact CB-CB 4.47Å; I656-C870 WeakPolarHBondContact O-CA 3.45Å; A658-C870 VanDerWaalsContact CB-SG 3.57Å; L866-C870 HydrophobicContact CB-CB 4.15Å; L866-C870 WeakPolarHBondContact O-CB 3.23Å; L866-C870 PolarHBondContact O-N 2.73Å
871	L	82.4	Confident	70	Confident	34 Å²	34	51 Å²	51	18%	0.178	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.4	173.8	-179.7	60.4	0	0	0	110.2	W644 I656 L657 A658 D659	W644-L871 HydrophobicContact CB-CD2 4.13Å; W644-L871 HydrophobicContact CD2-CB 3.81Å; W644-L871 HydrophobicContact CD2-CD2 3.85Å; W644-L871 HydrophobicContact CD2-CG 4.41Å; W644-L871 HydrophobicContact CE3-CB 3.69Å; W644-L871 HydrophobicContact CE3-CD2 3.7Å; W644-L871 HydrophobicContact CE3-CG 4.36Å; W644-L871 HydrophobicContact CG-CD2 4.05Å; W644-L871 HydrophobicContact CH2-CB 3.66Å; W644-L871 HydrophobicContact CZ2-CB 3.77Å; W644-L871 HydrophobicContact CZ3-CB 3.62Å; W644-L871 HydrophobicContact CZ3-CD2 4.38Å; I656-L871 PolarHBondContact O-N 3.38Å; L657-L871 HydrophobicContact CD1-CB 4.18Å; L657-L871 HydrophobicContact CD1-CD2 3.93Å; L657-L871 HydrophobicContact CD1-CG 4.17Å; A658-L871 CarbonylContact C-O 3.42Å; A658-L871 WeakPolarHBondContact CA-O 3.28Å; A658-L871 PolarHBondContact N-O 3.18Å; D659-L871 PolarHBondContact N-O 3.02Å
872	R	81.2	Confident	70.7	Confident	57 Å²	57	48.6 Å²	48.6	22%	0.215	28%	0.278	C	S	.	.			trans	-124.8	124.9	175.2	171.9	174.9	171.9	126.8	-13.5	110.7	A658 P798 E1197 T1201	A658-R872 HydrophobicContact CB-CB 4.08Å; A658-R872 WeakPolarHBondContact O-CG 3.45Å; P798-R872 VanDerWaalsContact CD-NH1 3.35Å; R872-E1197 IonicContact CZ-OE1 2.71Å; R872-E1197 VanDerWaalsContact CZ-OE1 3.22Å; R872-E1197 IonicContact NH1-OE1 2.8Å; R872-E1197 PolarHBondContact NH1-OE1 3.08Å; R872-E1197 IonicContact NH2-OE1 2.77Å; R872-E1197 PolarHBondContact NH2-OE1 3.37Å; R872-T1201 PolarHBondContact NH2-OG1 3.11Å; R872-T1201 VanDerWaalsContact NH2-OG1 3.17Å
873	R	81.3	Confident	71.9	Confident	25 Å²	25	48.8 Å²	48.8	9%	0.094	28%	0.278	C	S	.	.			trans	-125.8	149	168.3	-62.8	160.3	-68.6	-163.5	8.1	111	Y637 D659 E660 L663 V878	Y637-R873 PolarHBondContact O-NH1 3.12Å; D659-R873 WeakPolarHBondContact OD1-CB 3.24Å; D659-R873 IonicContact OD1-CZ 3.46Å; D659-R873 PolarHBondContact OD1-N 3.3Å; D659-R873 VanDerWaalsContact OD1-N 3.17Å; D659-R873 IonicContact OD1-NE 2.82Å; D659-R873 PolarHBondContact OD1-NE 2.82Å; D659-R873 IonicContact OD1-NH2 3.24Å; D659-R873 PolarHBondContact OD1-NH2 3.22Å; D659-R873 IonicContact OD2-CZ 3.65Å; D659-R873 IonicContact OD2-NE 3.73Å; D659-R873 IonicContact OD2-NH2 2.74Å; D659-R873 PolarHBondContact OD2-NH2 3.08Å; E660-R873 PolarHBondContact N-O 3.42Å; L663-R873 HydrophobicContact CD1-CB 4.28Å; L663-R873 VanDerWaalsContact CD1-O 3.31Å; L663-R873 WeakPolarHBondContact CD1-O 3.44Å; R873-V878 HydrophobicContact CB-CG2 3.79Å; R873-V878 HydrophobicContact CG-CG2 4.47Å
874	L	79.3	Confident	73.1	Confident	28 Å²	28	50.3 Å²	50.3	15%	0.147	29%	0.294	C	S	.	.			trans	-95.6	159.3	176.5	-59.9	-175.9	0	0	0	112	S876 Q877 V878 C1203	L874-S876 VanDerWaalsContact C-N 3.28Å; L874-S876 PolarHBondContact O-N 2.86Å; L874-Q877 HydrophobicContact CB-CG 4.24Å; L874-Q877 PolarHBondContact O-N 2.82Å; L874-V878 VanDerWaalsContact O-CG2 3.32Å; L874-V878 WeakPolarHBondContact O-CG2 3.17Å; L874-C1203 HydrophobicContact CD1-CB 4.06Å
875	K	76.4	Confident	74.4	Confident	16 Å²	16	51.7 Å²	51.7	7%	0.07	29%	0.29	C	S	.	.	S	Bend	trans	-55.5	-43.3	171.9	-71.6	172.7	179.1	-175.9	0	112.1	E660 M661 L663 Q877 V878 L879 L882 D1160 H1163	E660-K875 HydrophobicContact CB-CG 4.5Å; E660-K875 HydrophobicContact CG-CD 4.49Å; E660-K875 HydrophobicContact CG-CG 4.2Å; E660-K875 WeakPolarHBondContact OE2-CB 3.42Å; E660-K875 WeakPolarHBondContact OE2-CG 3.36Å; E660-K875 PolarHBondContact OE2-N 3.34Å; M661-K875 WeakPolarHBondContact O-CE 3.46Å; L663-K875 HydrophobicContact CD2-CG 4.47Å; K875-Q877 VanDerWaalsContact C-N 3.32Å; K875-Q877 PolarHBondContact O-N 2.92Å; K875-V878 PolarHBondContact O-N 3.27Å; K875-L879 PolarHBondContact O-N 3.36Å; K875-L882 HydrophobicContact CB-CD1 4.24Å; K875-L882 HydrophobicContact CD-CD1 4.2Å; K875-L882 HydrophobicContact CG-CD1 4.26Å; K875-D1160 IonicContact NZ-OD1 3.22Å; K875-D1160 PolarHBondContact NZ-OD1 2.74Å; K875-D1160 IonicContact NZ-OD2 2.77Å; K875-H1163 PolarHBondContact NZ-ND1 2.85Å; K875-H1163 PolarHBondContact NZ-O 3.43Å
876	S	72.8	Confident	75.7	Confident	97 Å²	97	53.3 Å²	53.3	68%	0.678	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-34.3	-179.3	48.4	0	0	0	0	113.8	L874 V878	L874-S876 VanDerWaalsContact C-N 3.28Å; L874-S876 PolarHBondContact O-N 2.86Å; S876-V878 VanDerWaalsContact C-N 3.28Å; S876-V878 PolarHBondContact O-N 3.43Å
877	Q	71.4	Confident	76.9	Confident	118 Å²	118	55.8 Å²	55.8	55%	0.551	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.8	179.4	-66.6	170.4	-39.9	0	0	113.5	L874 K875	L874-Q877 HydrophobicContact CB-CG 4.24Å; L874-Q877 PolarHBondContact O-N 2.82Å; K875-Q877 VanDerWaalsContact C-N 3.32Å; K875-Q877 PolarHBondContact O-N 2.92Å
878	V	69	Low	78.3	Confident	33 Å²	33	55.4 Å²	55.4	20%	0.2	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	-25.7	-161.8	177.9	0	0	0	0	112.8	Y637 L663 R873 L874 K875 S876	Y637-V878 HydrophobicContact CD1-CG1 3.12Å; Y637-V878 HydrophobicContact CD2-CG1 3.59Å; Y637-V878 HydrophobicContact CE1-CG1 3.36Å; Y637-V878 HydrophobicContact CE2-CG1 3.82Å; Y637-V878 HydrophobicContact CG-CG1 3.22Å; L663-V878 HydrophobicContact CD1-CG2 4.46Å; L663-V878 HydrophobicContact CD2-CB 4.23Å; L663-V878 HydrophobicContact CD2-CG1 3.99Å; R873-V878 HydrophobicContact CB-CG2 3.79Å; R873-V878 HydrophobicContact CG-CG2 4.47Å; L874-V878 VanDerWaalsContact O-CG2 3.32Å; L874-V878 WeakPolarHBondContact O-CG2 3.17Å; K875-V878 PolarHBondContact O-N 3.27Å; S876-V878 VanDerWaalsContact C-N 3.28Å; S876-V878 PolarHBondContact O-N 3.43Å
879	L	66.6	Low	79.5	Confident	11 Å²	11	58.4 Å²	58.4	6%	0.058	33%	0.334	C	S	.	.			trans	-138.1	68.4	-170.7	-62.1	173.6	0	0	0	111.3	K635 Y637 L663 K875 Q881 L882 L1165	K635-L879 HydrophobicContact CD-CD2 4.33Å; Y637-L879 HydrophobicContact CE1-CD2 4.39Å; L663-L879 HydrophobicContact CD2-CD1 3.64Å; L663-L879 HydrophobicContact CD2-CG 4.18Å; K875-L879 PolarHBondContact O-N 3.36Å; L879-Q881 PolarHBondContact O-N 3.08Å; L879-L882 HydrophobicContact CB-CB 4.36Å; L879-L882 HydrophobicContact CB-CD1 3.88Å; L879-L882 HydrophobicContact CB-CG 3.88Å; L879-L882 HydrophobicContact CD1-CD1 3.56Å; L879-L882 HydrophobicContact CD1-CG 4Å; L879-L882 HydrophobicContact CG-CD1 4.39Å; L879-L882 PolarHBondContact O-N 3.43Å; L879-L1165 HydrophobicContact CD1-CD2 3.61Å; L879-L1165 HydrophobicContact CD1-CG 4.08Å; L879-L1165 HydrophobicContact CD2-CD2 3.84Å; L879-L1165 HydrophobicContact CG-CD2 4.4Å
880	G	66.4	Low	80.5	Confident	85 Å²	85	59 Å²	59	88%	0.876	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.1	164.9	0	0	0	0	0	113.7
881	Q	65.6	Low	81.2	Confident	159 Å²	159	61.1 Å²	61.1	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-5.7	173.2	-64.2	175.6	-21.9	0	0	114.6	K635 L879	K635-Q881 VanDerWaalsContact NZ-OE1 3.15Å; L879-Q881 PolarHBondContact O-N 3.08Å
882	L	73	Confident	81.7	Confident	29 Å²	29	59.9 Å²	59.9	15%	0.152	35%	0.347	C	S	.	.	S	Bend	trans	-80	133.8	176.1	-86.1	175.9	0	0	0	110.5	K875 L879	K875-L882 HydrophobicContact CB-CD1 4.24Å; K875-L882 HydrophobicContact CD-CD1 4.2Å; K875-L882 HydrophobicContact CG-CD1 4.26Å; L879-L882 HydrophobicContact CB-CB 4.36Å; L879-L882 HydrophobicContact CB-CD1 3.88Å; L879-L882 HydrophobicContact CB-CG 3.88Å; L879-L882 HydrophobicContact CD1-CD1 3.56Å; L879-L882 HydrophobicContact CD1-CG 4Å; L879-L882 HydrophobicContact CG-CD1 4.39Å; L879-L882 PolarHBondContact O-N 3.43Å
883	P	82.7	Confident	82.3	Confident	22 Å²	22	61.7 Å²	61.7	14%	0.143	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-54.7	148.6	169.1	-25.7	34.7	0	0	0	111.9	H1163 Q1167 K1168 N1169	P883-H1163 PolarHBondContact O-NE2 3.06Å; P883-Q1167 HydrophobicContact CG-CG 4.37Å; P883-K1168 WeakPolarHBondContact CG-O 3.46Å; P883-N1169 WeakPolarHBondContact CB-O 3.23Å
884	P	86.6	Confident	82.8	Confident	94 Å²	94	61.7 Å²	61.7	61%	0.61	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-62.5	144.7	-178.7	26	-34.1	0	0	0	111.3	P1170 V1171	P884-P1170 HydrophobicContact CG-CB 4.11Å; P884-V1171 PolarHBondContact O-N 3.49Å
885	K	89	Confident	83.4	Confident	62 Å²	62	61.5 Å²	61.5	27%	0.27	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112.9	169.4	-176.5	171.4	73.8	166	0	109	E1159 D1160 H1163 V1171 V1173	K885-E1159 IonicContact NZ-OE2 3.78Å; K885-D1160 IonicContact NZ-OD1 3.84Å; K885-D1160 PolarHBondContact NZ-OD1 2.76Å; K885-H1163 HydrophobicContact CD-CB 3.85Å; K885-V1171 CarbonylContact C-O 3.54Å; K885-V1171 VanDerWaalsContact CA-O 3.32Å; K885-V1171 WeakPolarHBondContact CA-O 3.29Å; K885-V1171 HydrophobicContact CB-CB 4.42Å; K885-V1171 HydrophobicContact CD-CG1 4.35Å; K885-V1171 HydrophobicContact CG-CB 4.23Å; K885-V1171 HydrophobicContact CG-CG1 4.15Å; K885-V1173 HydrophobicContact CD-CG2 3.96Å; K885-V1173 HydrophobicContact CG-CG2 4.04Å
886	T	92	Very high	84.1	Confident	70 Å²	70	69.8 Å²	69.8	43%	0.429	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	159.7	170.6	62	0	0	0	0	110.1	V1171 H1172 V1173	T886-V1171 PolarHBondContact N-O 2.98Å; T886-H1172 PolarHBondContact OG1-ND1 3.36Å; T886-V1173 PolarHBondContact O-N 3.02Å; T886-V1173 VanDerWaalsContact O-N 3.16Å
887	T	91.6	Very high	84.8	Confident	74 Å²	74	67.8 Å²	67.8	45%	0.454	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	119	174.8	-62.5	0	0	0	0	109.9	V1173	T887-V1173 CarbonylContact C-O 3.55Å; T887-V1173 VanDerWaalsContact CA-O 3.31Å; T887-V1173 WeakPolarHBondContact CA-O 3.49Å; T887-V1173 HydrophobicContact CG2-CB 4.3Å; T887-V1173 HydrophobicContact CG2-CG1 4.29Å
888	E	93.9	Very high	85.7	Confident	110 Å²	110	62.2 Å²	62.2	51%	0.514	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.5	179.9	-169.9	-177.1	175.9	0	0	109.7	V890 V1173 R1175	E888-V890 HydrophobicContact CG-CG2 3.93Å; E888-V890 WeakPolarHBondContact OE1-CG2 3.08Å; E888-V1173 PolarHBondContact N-O 3.3Å; E888-R1175 PolarHBondContact O-N 3.36Å
889	V	94.1	Very high	86.8	Confident	75 Å²	75	61.5 Å²	61.5	46%	0.455	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	108.8	169	179.9	0	0	0	0	107.2	I1177 L1187	V889-I1177 HydrophobicContact CG1-CG1 3.85Å; V889-L1187 HydrophobicContact CG1-CD2 3.79Å
890	V	95.4	Very high	87.9	Confident	15 Å²	15	64.6 Å²	64.6	9%	0.091	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.4	179.9	175.6	0	0	0	0	108.8	E888 V892 W1058 I1174 R1175 L1176 I1177	E888-V890 HydrophobicContact CG-CG2 3.93Å; E888-V890 WeakPolarHBondContact OE1-CG2 3.08Å; V890-V892 HydrophobicContact CG1-CG2 3.94Å; V890-W1058 HydrophobicContact CG1-CZ2 4.33Å; V890-W1058 HydrophobicContact CG2-CZ2 4.32Å; V890-I1174 HydrophobicContact CB-CG2 4.28Å; V890-I1174 HydrophobicContact CG2-CG2 3.64Å; V890-R1175 PolarHBondContact N-O 2.84Å; V890-L1176 HydrophobicContact CB-CD2 4.05Å; V890-L1176 HydrophobicContact CG1-CD2 4.23Å; V890-I1177 PolarHBondContact O-N 3.49Å
891	S	93.9	Very high	88.9	Confident	70 Å²	70	63 Å²	63	49%	0.49	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.2	171.8	-157	0	0	0	0	109.5	E1179	S891-E1179 VanDerWaalsContact CB-OE1 3.28Å; S891-E1179 WeakPolarHBondContact CB-OE1 3.42Å; S891-E1179 VanDerWaalsContact OG-CD 3.26Å; S891-E1179 WeakPolarHBondContact OG-CG 3.39Å; S891-E1179 PolarHBondContact OG-OE1 2.94Å
892	V	93.9	Very high	90	Very high	7 Å²	7	55.6 Å²	55.6	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	117.1	-173.4	-177.2	0	0	0	0	110.9	V890 G1054 K1055 W1058 L1176 I1177 S1178 E1179	V890-V892 HydrophobicContact CG1-CG2 3.94Å; V892-G1054 VanDerWaalsContact CG1-C 3.41Å; V892-G1054 WeakPolarHBondContact CG1-O 3.16Å; V892-K1055 HydrophobicContact CG1-CG 4.31Å; V892-W1058 HydrophobicContact CG1-CB 4.41Å; V892-W1058 HydrophobicContact CG2-CG 4.44Å; V892-L1176 HydrophobicContact CG2-CD2 4.32Å; V892-I1177 PolarHBondContact N-O 3.04Å; V892-S1178 WeakPolarHBondContact O-CA 3.41Å; V892-E1179 PolarHBondContact O-N 3.47Å
893	T	93.8	Very high	90.8	Very high	96 Å²	96	60 Å²	60	59%	0.589	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-63.1	134.9	172.5	48.5	0	0	0	0	111.4	G1054 E1179	T893-G1054 WeakPolarHBondContact O-CA 3.45Å; T893-E1179 WeakPolarHBondContact CG2-OE2 3.44Å
894	M	91.1	Very high	91.1	Very high	25 Å²	25	62.3 Å²	62.3	12%	0.123	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72.5	145	170.2	-71	-171.7	-72.4	0	0	110.9	Q898 A899 Y902 T1181	M894-Q898 HydrophobicContact CB-CB 4.34Å; M894-Q898 HydrophobicContact CB-CG 4.25Å; M894-Q898 HydrophobicContact CG-CG 4.27Å; M894-Q898 HydrophobicContact SD-CG 4.14Å; M894-A899 HydrophobicContact CB-CB 4.08Å; M894-A899 HydrophobicContact CE-CB 4.26Å; M894-Y902 HydrophobicContact CE-CD1 4.17Å; M894-Y902 HydrophobicContact CE-CG 4.11Å; M894-Y902 HydrophobicContact SD-CD2 4.23Å; M894-Y902 HydrophobicContact SD-CG 4.13Å; M894-T1181 HydrophobicContact CE-CG2 3.57Å; M894-T1181 HydrophobicContact CG-CG2 4.37Å; M894-T1181 HydrophobicContact SD-CG2 3.63Å
895	T	92	Very high	91.1	Very high	23 Å²	23	58.4 Å²	58.4	14%	0.141	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-67.2	153.4	173	67.3	0	0	0	0	110.6	S897 Q898 A899 Q983 S1051	T895-S897 PolarHBondContact O-N 2.8Å; T895-S897 VanDerWaalsContact O-N 3.11Å; T895-Q898 WeakPolarHBondContact O-CA 3.27Å; T895-Q898 WeakPolarHBondContact O-CB 3.27Å; T895-Q898 PolarHBondContact O-N 3.18Å; T895-A899 PolarHBondContact O-N 2.8Å; T895-Q983 PolarHBondContact OG1-NE2 2.82Å; T895-S1051 PolarHBondContact OG1-O 3.33Å
896	K	91	Very high	91	Very high	190 Å²	190	55.6 Å²	55.6	83%	0.826	30%	0.302	S	S	*	.	H	α-helix	trans	-53.2	-39.7	-172.9	-66.4	179.7	179.7	176.6	0	113.2	T900	K896-T900 WeakPolarHBondContact O-CB 3.44Å; K896-T900 PolarHBondContact O-N 2.94Å; K896-T900 VanDerWaalsContact O-N 3.1Å; K896-T900 PolarHBondContact O-OG1 3.13Å
897	S	87.8	Confident	90.8	Very high	56 Å²	56	59 Å²	59	39%	0.392	31%	0.311	S	S	.	.	H	α-helix	trans	-68.7	-48.2	176.7	-168.7	0	0	0	0	111.8	T895 A899 T900 H901 Q983	T895-S897 PolarHBondContact O-N 2.8Å; T895-S897 VanDerWaalsContact O-N 3.11Å; S897-A899 PolarHBondContact O-N 2.77Å; S897-T900 PolarHBondContact O-N 3.37Å; S897-H901 PolarHBondContact O-CD2 3.21Å; S897-H901 PolarHBondContact O-N 3.33Å; S897-H901 VanDerWaalsContact O-N 3.08Å; S897-Q983 PolarHBondContact OG-OE1 2.64Å
898	Q	91	Very high	90.5	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-55.8	-48.2	175	-173.6	-177.8	16.4	0	0	112.3	M894 T895 T900 H901 Y902 A979 A980 Q983 G1054	M894-Q898 HydrophobicContact CB-CB 4.34Å; M894-Q898 HydrophobicContact CB-CG 4.25Å; M894-Q898 HydrophobicContact CG-CG 4.27Å; M894-Q898 HydrophobicContact SD-CG 4.14Å; T895-Q898 WeakPolarHBondContact O-CA 3.27Å; T895-Q898 WeakPolarHBondContact O-CB 3.27Å; T895-Q898 PolarHBondContact O-N 3.18Å; Q898-T900 PolarHBondContact O-N 3.48Å; Q898-H901 PolarHBondContact O-N 2.74Å; Q898-Y902 WeakPolarHBondContact O-CB 3.47Å; Q898-Y902 PolarHBondContact O-N 3.33Å; Q898-A979 WeakPolarHBondContact CG-O 3.12Å; Q898-A979 PolarHBondContact NE2-O 3.31Å; Q898-A980 VanDerWaalsContact NE2-C 3.32Å; Q898-A980 PolarHBondContact NE2-O 3.13Å; Q898-Q983 HydrophobicContact CB-CG 3.88Å; Q898-Q983 HydrophobicContact CG-CG 4.21Å; Q898-G1054 VanDerWaalsContact OE1-N 3.07Å
899	A	90.7	Very high	90	Very high	18 Å²	18	57 Å²	57	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-44.5	178.4	0	0	0	0	0	111.7	M894 T895 S897 H901 Y902 Y903	M894-A899 HydrophobicContact CB-CB 4.08Å; M894-A899 HydrophobicContact CE-CB 4.26Å; T895-A899 PolarHBondContact O-N 2.8Å; S897-A899 PolarHBondContact O-N 2.77Å; A899-H901 PolarHBondContact O-N 2.8Å; A899-Y902 WeakPolarHBondContact O-CB 3.31Å; A899-Y902 PolarHBondContact O-N 3.2Å; A899-Y903 HydrophobicContact CB-CD2 4.45Å; A899-Y903 HydrophobicContact CB-CE2 4.16Å; A899-Y903 WeakPolarHBondContact O-CD2 3.34Å; A899-Y903 PolarHBondContact O-N 3.36Å
900	T	90.7	Very high	89.5	Confident	77 Å²	77	58.3 Å²	58.3	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-57.7	-49.9	178	-58.3	0	0	0	0	111	K896 S897 Q898 Y902 Y903 D904	K896-T900 WeakPolarHBondContact O-CB 3.44Å; K896-T900 PolarHBondContact O-N 2.94Å; K896-T900 VanDerWaalsContact O-N 3.1Å; K896-T900 PolarHBondContact O-OG1 3.13Å; S897-T900 PolarHBondContact O-N 3.37Å; Q898-T900 PolarHBondContact O-N 3.48Å; T900-Y902 PolarHBondContact O-N 3.22Å; T900-Y903 PolarHBondContact O-N 3.45Å; T900-D904 PolarHBondContact O-N 3.07Å
901	H	86.9	Confident	88.8	Confident	51 Å²	51	61 Å²	61	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-70	-29.2	179.4	-61.3	-42.2	0	0	0	113.6	S897 Q898 A899 L905 F986 L989	S897-H901 PolarHBondContact O-CD2 3.21Å; S897-H901 PolarHBondContact O-N 3.33Å; S897-H901 VanDerWaalsContact O-N 3.08Å; Q898-H901 PolarHBondContact O-N 2.74Å; A899-H901 PolarHBondContact O-N 2.8Å; H901-L905 WeakPolarHBondContact O-CB 3.49Å; H901-L905 PolarHBondContact O-N 3.1Å; H901-F986 HydrophobicContact CB-CE2 4.17Å; H901-F986 HydrophobicContact CB-CZ 3.93Å; H901-L989 HydrophobicContact CB-CD1 4.21Å
902	Y	89.7	Confident	87.8	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-48.8	170.4	-174.7	-84.2	0	0	0	111.2	M894 Q898 A899 T900 L905 V906 L976 A979 A980 T1181 L1182	M894-Y902 HydrophobicContact CE-CD1 4.17Å; M894-Y902 HydrophobicContact CE-CG 4.11Å; M894-Y902 HydrophobicContact SD-CD2 4.23Å; M894-Y902 HydrophobicContact SD-CG 4.13Å; Q898-Y902 WeakPolarHBondContact O-CB 3.47Å; Q898-Y902 PolarHBondContact O-N 3.33Å; A899-Y902 WeakPolarHBondContact O-CB 3.31Å; A899-Y902 PolarHBondContact O-N 3.2Å; T900-Y902 PolarHBondContact O-N 3.22Å; Y902-L905 WeakPolarHBondContact O-CB 3.37Å; Y902-L905 PolarHBondContact O-N 3.13Å; Y902-V906 HydrophobicContact CD1-CG2 4.03Å; Y902-V906 HydrophobicContact CE1-CG2 3.69Å; Y902-V906 WeakPolarHBondContact O-CG2 3.49Å; Y902-V906 PolarHBondContact O-N 3.46Å; Y902-L976 HydrophobicContact CE2-CB 4.2Å; Y902-L976 HydrophobicContact CE2-CD2 4.07Å; Y902-A979 HydrophobicContact CD2-CB 3.69Å; Y902-A979 HydrophobicContact CE2-CB 4.45Å; Y902-A980 HydrophobicContact CE2-CB 4.33Å; Y902-T1181 HydrophobicContact CD2-CG2 4.41Å; Y902-T1181 HydrophobicContact CE1-CG2 4.47Å; Y902-T1181 HydrophobicContact CE2-CG2 3.99Å; Y902-T1181 WeakPolarHBondContact OH-CA 3.45Å; Y902-L1182 PolarHBondContact OH-N 3.04Å
903	Y	89.8	Confident	86.7	Confident	120 Å²	120	63.3 Å²	63.3	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-67.9	-35.8	178.9	-67.3	-55.7	0	0	0	113.1	A899 T900 L905 V906 K907	A899-Y903 HydrophobicContact CB-CD2 4.45Å; A899-Y903 HydrophobicContact CB-CE2 4.16Å; A899-Y903 WeakPolarHBondContact O-CD2 3.34Å; A899-Y903 PolarHBondContact O-N 3.36Å; T900-Y903 PolarHBondContact O-N 3.45Å; Y903-L905 VanDerWaalsContact C-N 3.34Å; Y903-V906 PolarHBondContact O-N 3.46Å; Y903-K907 VanDerWaalsContact O-CB 3.29Å; Y903-K907 WeakPolarHBondContact O-CB 3.11Å; Y903-K907 PolarHBondContact O-N 2.96Å
904	D	88	Confident	85.4	Confident	71 Å²	71	62.1 Å²	62.1	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-38.2	171.7	-88.6	-27.9	0	0	0	112.4	T900 R908	T900-D904 PolarHBondContact O-N 3.07Å; D904-R908 VanDerWaalsContact O-CB 3.26Å; D904-R908 WeakPolarHBondContact O-CB 3.37Å; D904-R908 PolarHBondContact O-N 3.28Å
905	L	86.9	Confident	84	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-48.9	172.9	178.3	60.4	0	0	0	110.8	H901 Y902 Y903 K907 R908 L909 A975 L976 A979 F986	H901-L905 WeakPolarHBondContact O-CB 3.49Å; H901-L905 PolarHBondContact O-N 3.1Å; Y902-L905 WeakPolarHBondContact O-CB 3.37Å; Y902-L905 PolarHBondContact O-N 3.13Å; Y903-L905 VanDerWaalsContact C-N 3.34Å; L905-K907 PolarHBondContact O-N 3.17Å; L905-R908 WeakPolarHBondContact O-CB 3.42Å; L905-R908 PolarHBondContact O-N 2.73Å; L905-L909 HydrophobicContact CD1-CD1 4.13Å; L905-L909 HydrophobicContact CD1-CG 4.18Å; L905-L909 HydrophobicContact CG-CD1 4.12Å; L905-L909 VanDerWaalsContact O-CG 3.25Å; L905-L909 WeakPolarHBondContact O-CG 3.39Å; L905-L909 PolarHBondContact O-N 3.43Å; L905-A975 HydrophobicContact CD2-CB 3.99Å; L905-L976 HydrophobicContact CD2-CD2 4.03Å; L905-L976 HydrophobicContact CG-CD2 4.11Å; L905-A979 HydrophobicContact CD2-CB 4.17Å; L905-F986 HydrophobicContact CB-CE1 4.35Å; L905-F986 HydrophobicContact CD2-CE1 4.05Å; L905-F986 HydrophobicContact CD2-CZ 4.31Å
906	V	87.4	Confident	82.4	Confident	3 Å²	3	69 Å²	69	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-51.6	-52.5	173.4	161.4	0	0	0	0	110.9	Y902 Y903 R908 L909 R910 L976 L1288	Y902-V906 HydrophobicContact CD1-CG2 4.03Å; Y902-V906 HydrophobicContact CE1-CG2 3.69Å; Y902-V906 WeakPolarHBondContact O-CG2 3.49Å; Y902-V906 PolarHBondContact O-N 3.46Å; Y903-V906 PolarHBondContact O-N 3.46Å; V906-R908 PolarHBondContact O-N 3.35Å; V906-L909 PolarHBondContact O-N 2.86Å; V906-L909 VanDerWaalsContact O-N 3.12Å; V906-R910 WeakPolarHBondContact O-CG 3.4Å; V906-R910 PolarHBondContact O-N 3.45Å; V906-L976 HydrophobicContact CG2-CD2 3.61Å; V906-L1288 HydrophobicContact CB-CD2 4.36Å; V906-L1288 HydrophobicContact CG1-CD2 3.83Å; V906-L1288 HydrophobicContact CG2-CD2 4.47Å
907	K	87.1	Confident	80.7	Confident	141 Å²	141	64.3 Å²	64.3	61%	0.613	32%	0.321	S	S	*	.	H	α-helix	trans	-58.1	-45.9	179.1	-174.3	176.4	-179.5	179.8	0	112.2	Y903 L905 L909 R910 S911	Y903-K907 VanDerWaalsContact O-CB 3.29Å; Y903-K907 WeakPolarHBondContact O-CB 3.11Å; Y903-K907 PolarHBondContact O-N 2.96Å; L905-K907 PolarHBondContact O-N 3.17Å; K907-L909 VanDerWaalsContact C-N 3.3Å; K907-L909 PolarHBondContact O-N 2.89Å; K907-R910 PolarHBondContact O-N 2.9Å; K907-S911 PolarHBondContact O-N 2.99Å; K907-S911 VanDerWaalsContact O-N 3.09Å; K907-S911 PolarHBondContact O-OG 3.2Å
908	R	85.2	Confident	79.1	Confident	142 Å²	142	65.2 Å²	65.2	54%	0.536	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-38.5	176	-170.4	179.9	-60.5	161.1	4.3	112.1	D904 L905 V906 Q912	D904-R908 VanDerWaalsContact O-CB 3.26Å; D904-R908 WeakPolarHBondContact O-CB 3.37Å; D904-R908 PolarHBondContact O-N 3.28Å; L905-R908 WeakPolarHBondContact O-CB 3.42Å; L905-R908 PolarHBondContact O-N 2.73Å; V906-R908 PolarHBondContact O-N 3.35Å; R908-Q912 WeakPolarHBondContact O-CG 3.48Å; R908-Q912 PolarHBondContact O-N 3.06Å
909	L	83.7	Confident	77.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-73.7	-36	177	-64.2	176.1	0	0	0	112.7	L905 V906 K907 Q912 R913 L966 M972 L976 L1288	L905-L909 HydrophobicContact CD1-CD1 4.13Å; L905-L909 HydrophobicContact CD1-CG 4.18Å; L905-L909 HydrophobicContact CG-CD1 4.12Å; L905-L909 VanDerWaalsContact O-CG 3.25Å; L905-L909 WeakPolarHBondContact O-CG 3.39Å; L905-L909 PolarHBondContact O-N 3.43Å; V906-L909 PolarHBondContact O-N 2.86Å; V906-L909 VanDerWaalsContact O-N 3.12Å; K907-L909 VanDerWaalsContact C-N 3.3Å; K907-L909 PolarHBondContact O-N 2.89Å; L909-Q912 PolarHBondContact O-N 2.81Å; L909-R913 PolarHBondContact O-N 2.82Å; L909-L966 HydrophobicContact CD2-CD1 4.43Å; L909-M972 HydrophobicContact CB-SD 4.43Å; L909-M972 HydrophobicContact CD1-CB 4.07Å; L909-M972 HydrophobicContact CD1-CG 4.4Å; L909-M972 HydrophobicContact CD2-CB 4.31Å; L909-M972 HydrophobicContact CD2-CG 3.74Å; L909-M972 HydrophobicContact CD2-SD 3.85Å; L909-L976 HydrophobicContact CD1-CD1 4.41Å; L909-L976 HydrophobicContact CD1-CD2 4.22Å; L909-L976 HydrophobicContact CD1-CG 4.17Å; L909-L1288 HydrophobicContact CB-CD2 4.41Å
910	R	82.8	Confident	74.8	Confident	103 Å²	103	72 Å²	72	39%	0.389	36%	0.363	S	S	.	.	H	α-helix	trans	-58.3	-49.9	171	-66	-173.9	-166.1	173.4	6.2	111	V906 K907 Q912 R913 S914 L1288 L1290	V906-R910 WeakPolarHBondContact O-CG 3.4Å; V906-R910 PolarHBondContact O-N 3.45Å; K907-R910 PolarHBondContact O-N 2.9Å; R910-Q912 VanDerWaalsContact C-N 3.35Å; R910-Q912 PolarHBondContact O-N 2.95Å; R910-R913 PolarHBondContact O-N 3.36Å; R910-S914 PolarHBondContact O-N 2.89Å; R910-L1288 HydrophobicContact CG-CB 4.13Å; R910-L1288 HydrophobicContact CG-CD1 4.31Å; R910-L1288 HydrophobicContact CG-CD2 3.93Å; R910-L1288 HydrophobicContact CG-CG 4.35Å; R910-L1288 PolarHBondContact NE-O 3.37Å; R910-L1288 PolarHBondContact NH2-O 3.03Å; R910-L1290 PolarHBondContact NH2-O 3.1Å; R910-L1290 PolarHBondContact NH2-OXT 3.46Å
911	S	81.1	Confident	72.4	Confident	71 Å²	71	74.7 Å²	74.7	50%	0.497	38%	0.375	S	S	.	.	H	α-helix	trans	-61.3	-39.5	178.5	-58.6	0	0	0	0	113	K907 R913 S914 V915	K907-S911 PolarHBondContact O-N 2.99Å; K907-S911 VanDerWaalsContact O-N 3.09Å; K907-S911 PolarHBondContact O-OG 3.2Å; S911-R913 VanDerWaalsContact C-N 3.27Å; S911-R913 PolarHBondContact O-N 2.97Å; S911-S914 PolarHBondContact O-N 3.24Å; S911-V915 WeakPolarHBondContact O-CG2 3.43Å; S911-V915 PolarHBondContact O-N 2.85Å
912	Q	73.4	Confident	70	Confident	57 Å²	57	76.1 Å²	76.1	27%	0.266	39%	0.391	S	S	.	.	H	α-helix	trans	-67.9	-21.1	177.6	-75	179.7	10.5	0	0	114.2	R908 L909 R910	R908-Q912 WeakPolarHBondContact O-CG 3.48Å; R908-Q912 PolarHBondContact O-N 3.06Å; L909-Q912 PolarHBondContact O-N 2.81Å; R910-Q912 VanDerWaalsContact C-N 3.35Å; R910-Q912 PolarHBondContact O-N 2.95Å
913	R	70.5	Confident	67.5	Low	70 Å²	70	83 Å²	83	26%	0.264	42%	0.423	S	S	.	.	H	α-helix	trans	-75.8	-55.3	169.2	-88.5	-179.8	152	173.3	-3.6	111.5	L909 R910 S911 V915 K916 D917 L1284	L909-R913 PolarHBondContact O-N 2.82Å; R910-R913 PolarHBondContact O-N 3.36Å; S911-R913 VanDerWaalsContact C-N 3.27Å; S911-R913 PolarHBondContact O-N 2.97Å; R913-V915 VanDerWaalsContact C-N 3.26Å; R913-V915 PolarHBondContact O-N 2.96Å; R913-V915 VanDerWaalsContact O-N 3.14Å; R913-K916 WeakPolarHBondContact O-CA 3.24Å; R913-K916 WeakPolarHBondContact O-CB 3.14Å; R913-K916 PolarHBondContact O-N 2.87Å; R913-D917 PolarHBondContact O-N 2.67Å; R913-D917 VanDerWaalsContact O-N 3.11Å; R913-D917 VanDerWaalsContact O-OD2 3.12Å; R913-L1284 PolarHBondContact NH1-O 3.47Å
914	S	66.3	Low	64.8	Low	71 Å²	71	84.5 Å²	84.5	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-53.6	-39.2	-177.5	179.3	0	0	0	0	113.6	R910 S911 K916 D917 T918	R910-S914 PolarHBondContact O-N 2.89Å; S911-S914 PolarHBondContact O-N 3.24Å; S914-K916 VanDerWaalsContact C-N 3.3Å; S914-K916 PolarHBondContact O-N 3.42Å; S914-D917 PolarHBondContact O-N 2.75Å; S914-T918 PolarHBondContact O-N 3.43Å; S914-T918 VanDerWaalsContact O-N 3.11Å; S914-T918 PolarHBondContact O-OG1 2.79Å
915	V	62.6	Low	62	Low	89 Å²	89	86.6 Å²	86.6	54%	0.539	46%	0.459	S	S	.	.	H	α-helix	trans	-68.3	-23.6	175.6	176.2	0	0	0	0	113.2	S911 R913 T918 N919	S911-V915 WeakPolarHBondContact O-CG2 3.43Å; S911-V915 PolarHBondContact O-N 2.85Å; R913-V915 VanDerWaalsContact C-N 3.26Å; R913-V915 PolarHBondContact O-N 2.96Å; R913-V915 VanDerWaalsContact O-N 3.14Å; V915-T918 WeakPolarHBondContact CA-OG1 3.1Å; V915-T918 PolarHBondContact O-OG1 3.11Å; V915-N919 WeakPolarHBondContact O-CB 3.45Å; V915-N919 PolarHBondContact O-ND2 2.51Å
916	K	56.9	Low	59.4	Low	102 Å²	102	91 Å²	91	44%	0.443	49%	0.491	S	S	.	.	H	α-helix	trans	-78.1	-47.9	171.2	-72.6	-179.4	175	-176.2	0	111.3	R913 S914 T918 N919 S920 Q967	R913-K916 WeakPolarHBondContact O-CA 3.24Å; R913-K916 WeakPolarHBondContact O-CB 3.14Å; R913-K916 PolarHBondContact O-N 2.87Å; S914-K916 VanDerWaalsContact C-N 3.3Å; S914-K916 PolarHBondContact O-N 3.42Å; K916-T918 VanDerWaalsContact C-N 3.31Å; K916-T918 PolarHBondContact O-N 3.01Å; K916-N919 CarbonylContact O-C 3.6Å; K916-N919 PolarHBondContact O-N 2.84Å; K916-N919 VanDerWaalsContact O-N 3.07Å; K916-S920 PolarHBondContact O-N 3.48Å; K916-S920 PolarHBondContact O-OG 3.01Å; K916-Q967 PolarHBondContact NZ-O 3.22Å
917	D	55.8	Low	56.6	Low	92 Å²	92	99.1 Å²	99.1	49%	0.492	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-37.8	-173.2	-54.6	-40.5	0	0	0	111.4	R913 S914 S920 N921	R913-D917 PolarHBondContact O-N 2.67Å; R913-D917 VanDerWaalsContact O-N 3.11Å; R913-D917 VanDerWaalsContact O-OD2 3.12Å; S914-D917 PolarHBondContact O-N 2.75Å; D917-S920 WeakPolarHBondContact CA-OG 3.29Å; D917-S920 PolarHBondContact O-OG 3.24Å; D917-N921 PolarHBondContact O-N 3.4Å
918	T	54.6	Low	53.8	Low	76 Å²	76	100.2 Å²	100.2	47%	0.466	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-45.1	169.8	44.8	0	0	0	0	112.8	S914 V915 K916 S920 N921 S922	S914-T918 PolarHBondContact O-N 3.43Å; S914-T918 VanDerWaalsContact O-N 3.11Å; S914-T918 PolarHBondContact O-OG1 2.79Å; V915-T918 WeakPolarHBondContact CA-OG1 3.1Å; V915-T918 PolarHBondContact O-OG1 3.11Å; K916-T918 VanDerWaalsContact C-N 3.31Å; K916-T918 PolarHBondContact O-N 3.01Å; T918-S920 VanDerWaalsContact C-N 3.33Å; T918-S920 PolarHBondContact O-N 3.47Å; T918-N921 PolarHBondContact O-N 3.29Å; T918-S922 PolarHBondContact O-N 3.28Å; T918-S922 PolarHBondContact O-OG 3.03Å; T918-S922 VanDerWaalsContact O-OG 3.1Å
919	N	49.7	Very low	51.1	Low	88 Å²	88	101.1 Å²	101.1	47%	0.471	56%	0.56	S	S	.	*	H	α-helix	trans	-70.2	-24.3	179.2	-85.6	-64	0	0	0	113.9	V915 K916 Q923	V915-N919 WeakPolarHBondContact O-CB 3.45Å; V915-N919 PolarHBondContact O-ND2 2.51Å; K916-N919 CarbonylContact O-C 3.6Å; K916-N919 PolarHBondContact O-N 2.84Å; K916-N919 VanDerWaalsContact O-N 3.07Å; N919-Q923 WeakPolarHBondContact O-CG 3.38Å; N919-Q923 PolarHBondContact O-NE2 3.25Å
920	S	42.8	Very low	48.4	Very low	71 Å²	71	108.4 Å²	108.4	50%	0.497	60%	0.599	S	S	.	*	H	α-helix	trans	-75.4	-32.9	173.3	44.4	0	0	0	0	113.3	K916 D917 T918	K916-S920 PolarHBondContact O-N 3.48Å; K916-S920 PolarHBondContact O-OG 3.01Å; D917-S920 WeakPolarHBondContact CA-OG 3.29Å; D917-S920 PolarHBondContact O-OG 3.24Å; T918-S920 VanDerWaalsContact C-N 3.33Å; T918-S920 PolarHBondContact O-N 3.47Å
921	N	38.4	Very low	46	Very low	134 Å²	134	109.3 Å²	109.3	72%	0.717	62%	0.621	S	S	*	*	H	α-helix	trans	-81.6	-16.8	-177.5	-69.9	-2.7	0	0	0	113.5	D917 T918	D917-N921 PolarHBondContact O-N 3.4Å; T918-N921 PolarHBondContact O-N 3.29Å
922	S	37.7	Very low	43.4	Very low	82 Å²	82	113.8 Å²	113.8	57%	0.573	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-2	-175.2	-58.1	0	0	0	0	115.7	T918	T918-S922 PolarHBondContact O-N 3.28Å; T918-S922 PolarHBondContact O-OG 3.03Å; T918-S922 VanDerWaalsContact O-OG 3.1Å
923	Q	37	Very low	41.1	Very low	148 Å²	148	116.5 Å²	116.5	69%	0.692	66%	0.658	S	S	*	*	S	Bend	trans	-96.6	-4.9	-169.5	-69.9	-173.6	16.3	0	0	115.8	N919	N919-Q923 WeakPolarHBondContact O-CG 3.38Å; N919-Q923 PolarHBondContact O-NE2 3.25Å
924	D	33	Very low	39.2	Very low	152 Å²	152	119.2 Å²	119.2	81%	0.813	68%	0.677	S	S	*	*	S	Bend	trans	-109.8	18.2	-174.4	-81.8	-31.2	0	0	0	114.4
925	S	30	Very low	37.5	Very low	114 Å²	114	123.2 Å²	123.2	80%	0.797	69%	0.693	S	S	*	*	S	Bend	trans	-144.8	8.7	-170.9	-61.5	0	0	0	0	118.9
926	S	31.6	Very low	36	Very low	104 Å²	104	122.3 Å²	122.3	73%	0.727	70%	0.702	S	S	*	*			trans	-139.8	62.7	179.1	69.8	0	0	0	0	114.6
927	L	28.4	Very low	34.8	Very low	174 Å²	174	124.8 Å²	124.8	91%	0.911	72%	0.72	S	S	*	*			trans	-119.9	79	159.3	-81.7	176.5	0	0	0	109.1
928	L	28	Very low	33.6	Very low	164 Å²	164	127.8 Å²	127.8	86%	0.859	73%	0.731	S	S	*	*			trans	-178.7	109.2	161.2	-106.3	167.7	0	0	0	110.3
929	L	29.2	Very low	32.4	Very low	162 Å²	162	130.2 Å²	130.2	85%	0.848	74%	0.742	S	S	*	*				166.3	126.3	129.5	-91.5	165.2	0	0	0	110.2
930	N	26.7	Very low	31.5	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	75%	0.754	S	S	*	*			trans	-107.1	147.2	160.8	-58.6	-8.5	0	0	0	106.9
931	S	31.4	Very low	31.1	Very low	121 Å²	121	134.7 Å²	134.7	85%	0.846	77%	0.772	S	S	*	*			trans	-166.6	133.5	143.1	-113.5	0	0	0	0	111.1
932	E	27.5	Very low	31.1	Very low	166 Å²	166	134 Å²	134	78%	0.776	78%	0.775	S	S	*	*			trans	-72.8	166.8	-177.8	-61.9	126.1	139.9	0	0	115.1
933	C	25.9	Very low	30.7	Very low	113 Å²	113	137.8 Å²	137.8	76%	0.764	79%	0.789	S	S	*	*			trans	69.3	155.3	152	-68.1	0	0	0	0	119
934	D	28.6	Very low	30.5	Very low	127 Å²	127	134.5 Å²	134.5	68%	0.679	79%	0.787	S	S	*	*			cis	-155.7	180	-4.7	-130.3	-38	0	0	0	113.4
935	D	31.8	Very low	30.3	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	79%	0.789	S	S	*	*			trans	65.4	149.3	154.4	-68.4	-44.9	0	0	0	122.2
936	G	31	Very low	30.3	Very low	71 Å²	71	135.4 Å²	135.4	73%	0.732	78%	0.783	S	S	*	*			trans	142.2	47.9	150.2	0	0	0	0	0	123
937	D	32.5	Very low	30.1	Very low	154 Å²	154	140 Å²	140	82%	0.824	78%	0.784	S	S	*	*			trans	53.6	121.9	145.6	-76.4	-1	0	0	0	126
938	E	30	Very low	30.1	Very low	155 Å²	155	141.2 Å²	141.2	72%	0.724	78%	0.782	S	S	*	*				89.7	114.6	122.7	-69.4	-150.8	142.5	0	0	125.9
939	N	30.3	Very low	30.1	Very low	127 Å²	127	139.7 Å²	139.7	68%	0.679	78%	0.78	S	S	*	*				82	105.2	122	-65.2	-18	0	0	0	124.1
940	A	29.5	Very low	29.9	Very low	89 Å²	89	139.5 Å²	139.5	74%	0.736	78%	0.779	S	S	*	*				113.3	118.6	107.9	0	0	0	0	0	121.4
941	D	34.9	Very low	29.9	Very low	164 Å²	164	135.7 Å²	135.7	88%	0.877	78%	0.776	S	S	*	*			trans	73.9	135.8	147	-71.8	-13.8	0	0	0	125
942	P	38.7	Very low	29.7	Very low	120 Å²	120	135.9 Å²	135.9	78%	0.779	77%	0.772	S	S	*	*			trans	-114.8	160.1	176.2	42.1	-32.6	0	0	0	114.7
943	D	29.3	Very low	29.6	Very low	161 Å²	161	137.1 Å²	137.1	86%	0.861	78%	0.775	S	S	*	*			trans	-168	173.5	130.1	-143.1	-20.2	0	0	0	113.3
944	A	31.6	Very low	29.6	Very low	79 Å²	79	137 Å²	137	65%	0.653	78%	0.776	S	S	*	*			trans	69.8	103.4	149.4	0	0	0	0	0	121.3
945	N	29	Very low	29.4	Very low	160 Å²	160	139.6 Å²	139.6	86%	0.856	78%	0.781	S	S	*	*			trans	-13.4	137.7	147.3	-55.5	-70.9	0	0	0	118.9
946	D	30	Very low	29.1	Very low	125 Å²	125	137.1 Å²	137.1	67%	0.668	77%	0.774	S	S	*	*				-162.3	175.8	86.3	-158	6.1	0	0	0	112
947	R	28.5	Very low	28.9	Very low	200 Å²	200	139.6 Å²	139.6	76%	0.755	77%	0.774	S	S	*	*			trans	-80.3	147.6	-166.3	-45.5	132.1	177.5	122.3	-12.6	113.5
948	K	27.6	Very low	28.8	Very low	199 Å²	199	135.8 Å²	135.8	87%	0.865	76%	0.757	S	S	*	*				-178.1	143.8	110	-101.7	159.9	-175.2	170.2	0	116.4
949	V	28.7	Very low	28.8	Very low	133 Å²	133	132.9 Å²	132.9	81%	0.806	75%	0.754	S	S	*	*			trans	59.6	96.4	157	-174	0	0	0	0	117.8
950	N	24.5	Very low	28.7	Very low	157 Å²	157	136.7 Å²	136.7	84%	0.84	76%	0.758	S	S	*	*			trans	-80.3	120.1	160.7	-82.6	-27	0	0	0	111.1	T952	N950-T952 PolarHBondContact O-N 3Å
951	G	26.3	Very low	28.9	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	75%	0.751	S	S	*	*			trans	-93.1	78.5	171.3	0	0	0	0	0	112.6	K953	G951-K953 PolarHBondContact O-N 3.03Å; G951-K953 VanDerWaalsContact O-N 3.1Å
952	T	27.1	Very low	29	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	73%	0.731	S	S	*	*			trans	-70.7	101.9	-176.2	2.4	0	0	0	0	112.7	N950 S954	N950-T952 PolarHBondContact O-N 3Å; T952-S954 PolarHBondContact O-N 3.45Å
953	K	26.1	Very low	28.9	Very low	193 Å²	193	129.8 Å²	129.8	84%	0.839	71%	0.712	S	S	*	*			trans	-74.6	84.9	168.2	-69.3	-177.6	-179.9	176.5	0	110.6	G951 F955	G951-K953 PolarHBondContact O-N 3.03Å; G951-K953 VanDerWaalsContact O-N 3.1Å; K953-F955 PolarHBondContact O-N 2.88Å
954	S	25.5	Very low	29.5	Very low	110 Å²	110	128 Å²	128	77%	0.769	70%	0.699	S	S	*	*			trans	-76.8	108.5	179.2	42.3	0	0	0	0	112.4	T952	T952-S954 PolarHBondContact O-N 3.45Å
955	F	24	Very low	30.3	Very low	182 Å²	182	127.6 Å²	127.6	80%	0.798	69%	0.691	S	S	*	*			trans	-82.5	126.8	166	-76.3	-90.1	0	0	0	110.2	K953	K953-F955 PolarHBondContact O-N 2.88Å
956	P	26.7	Very low	31.7	Very low	103 Å²	103	121.2 Å²	121.2	67%	0.669	66%	0.657	S	S	*	*			trans	-74.1	138.7	-175.7	28.1	-34	0	0	0	113.2	T958	P956-T958 VanDerWaalsContact C-N 3.27Å; P956-T958 PolarHBondContact O-N 3.21Å
957	V	26.6	Very low	33.1	Very low	123 Å²	123	120.7 Å²	120.7	75%	0.745	65%	0.65	S	S	*	*			trans	-86.9	16.4	-167.2	-174.8	0	0	0	0	113.1	S959	V957-S959 PolarHBondContact O-N 3.1Å
958	T	29.6	Very low	35.1	Very low	74 Å²	74	113 Å²	113	45%	0.454	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.5	3.1	-157.8	45.5	0	0	0	0	117.3	P956	P956-T958 VanDerWaalsContact C-N 3.27Å; P956-T958 PolarHBondContact O-N 3.21Å
959	S	29.6	Very low	37.4	Very low	94 Å²	94	105 Å²	105	66%	0.657	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-10.3	-162	59.3	0	0	0	0	117.7	V957	V957-S959 PolarHBondContact O-N 3.1Å
960	R	28.3	Very low	39.6	Very low	206 Å²	206	101.6 Å²	101.6	78%	0.777	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-22.4	-163	-76.3	-177.4	172.6	166.3	-1	117.5	S963	R960-S963 PolarHBondContact O-OG 3.04Å; R960-S963 VanDerWaalsContact O-OG 3.08Å
961	S	33.8	Very low	42.3	Very low	83 Å²	83	97.7 Å²	97.7	58%	0.58	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-35.4	-172.5	52.4	0	0	0	0	114.4
962	I	38.5	Very low	45	Very low	90 Å²	90	94.8 Å²	94.8	46%	0.462	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-73.8	-32.3	-176.1	-61.5	174.4	0	0	0	111.4	E964 S965	I962-E964 VanDerWaalsContact C-N 3.28Å; I962-E964 PolarHBondContact O-N 3.31Å; I962-S965 PolarHBondContact O-N 2.72Å; I962-S965 VanDerWaalsContact O-N 3.15Å; I962-S965 PolarHBondContact O-OG 2.96Å
963	S	35.7	Very low	47.8	Very low	55 Å²	55	88.9 Å²	88.9	39%	0.385	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-62.9	-23.3	-174.5	45.1	0	0	0	0	115.4	R960 S965	R960-S963 PolarHBondContact O-OG 3.04Å; R960-S963 VanDerWaalsContact O-OG 3.08Å; S963-S965 VanDerWaalsContact C-N 3.35Å
964	E	41.5	Very low	50.6	Low	125 Å²	125	82.2 Å²	82.2	58%	0.584	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-74.5	-25.1	176.9	-63.9	-159.1	145.3	0	0	113.1	I962 Q967	I962-E964 VanDerWaalsContact C-N 3.28Å; I962-E964 PolarHBondContact O-N 3.31Å; E964-Q967 WeakPolarHBondContact O-CG 3.18Å
965	S	49.5	Very low	53.5	Low	70 Å²	70	78.1 Å²	78.1	49%	0.49	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-27.9	-172.1	70.8	0	0	0	0	114.6	I962 S963 Q967 N971	I962-S965 PolarHBondContact O-N 2.72Å; I962-S965 VanDerWaalsContact O-N 3.15Å; I962-S965 PolarHBondContact O-OG 2.96Å; S963-S965 VanDerWaalsContact C-N 3.35Å; S965-Q967 VanDerWaalsContact C-N 3.34Å; S965-Q967 PolarHBondContact O-N 2.97Å; S965-N971 PolarHBondContact O-ND2 2.67Å
966	L	56.7	Low	56.7	Low	26 Å²	26	69.4 Å²	69.4	14%	0.136	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	1.2	-173.2	-70.5	169.4	0	0	0	114	L909 S968 M972	L909-L966 HydrophobicContact CD2-CD1 4.43Å; L966-S968 PolarHBondContact O-N 2.82Å; L966-M972 WeakPolarHBondContact O-CG 3.45Å
967	Q	60.4	Low	59.7	Low	113 Å²	113	64.9 Å²	64.9	53%	0.528	37%	0.367	S	S	.	.			trans	-62.9	-14.3	-168.6	-66.3	179.9	7.1	0	0	115.9	K916 E964 S965	K916-Q967 PolarHBondContact NZ-O 3.22Å; E964-Q967 WeakPolarHBondContact O-CG 3.18Å; S965-Q967 VanDerWaalsContact C-N 3.34Å; S965-Q967 PolarHBondContact O-N 2.97Å
968	S	70.8	Confident	62.8	Low	40 Å²	40	61.2 Å²	61.2	28%	0.28	34%	0.341	S	S	.	.	S	Bend	trans	-97.5	132.1	-177.1	146.1	0	0	0	0	111.9	L966 C970 N971 M972	L966-S968 PolarHBondContact O-N 2.82Å; S968-C970 PolarHBondContact O-N 3.29Å; S968-C970 PolarHBondContact OG-N 3.28Å; S968-N971 WeakPolarHBondContact CB-OD1 3.35Å; S968-N971 WeakPolarHBondContact O-CA 3.3Å; S968-N971 WeakPolarHBondContact O-CB 3.36Å; S968-N971 PolarHBondContact O-N 3.42Å; S968-N971 PolarHBondContact OG-N 3.27Å; S968-N971 PolarHBondContact OG-OD1 2.87Å; S968-M972 PolarHBondContact O-N 2.59Å
969	P	75.8	Confident	65.7	Low	30 Å²	30	57.7 Å²	57.7	20%	0.195	32%	0.319	C	S	.	.	H	α-helix	trans	-56.4	-33.4	175.3	-26.7	35.5	0	0	0	114.5	N971 M972 V973 V1280 L1284	P969-N971 VanDerWaalsContact C-N 3.34Å; P969-M972 HydrophobicContact CB-CE 4.34Å; P969-M972 HydrophobicContact CG-CE 4.24Å; P969-M972 PolarHBondContact O-N 3.46Å; P969-V973 WeakPolarHBondContact O-CB 3.48Å; P969-V973 PolarHBondContact O-N 3.46Å; P969-V1280 HydrophobicContact CB-CG1 3.77Å; P969-L1284 HydrophobicContact CB-CD2 4.16Å
970	C	74.2	Confident	68.6	Low	62 Å²	62	53.2 Å²	53.2	42%	0.419	29%	0.288	S	S	.	.	H	α-helix	trans	-68.4	-34.3	175.3	-171.1	0	0	0	0	111.7	S968 T974	S968-C970 PolarHBondContact O-N 3.29Å; S968-C970 PolarHBondContact OG-N 3.28Å; C970-T974 WeakPolarHBondContact O-CB 3.43Å; C970-T974 PolarHBondContact O-N 3.15Å; C970-T974 PolarHBondContact O-OG1 3.31Å
971	N	80.9	Confident	71.7	Confident	74 Å²	74	43.4 Å²	43.4	40%	0.396	25%	0.251	S	S	.	.	H	α-helix	trans	-69.5	-41.5	175.9	-59.7	19.4	0	0	0	110.3	S965 S968 P969 T974 A975	S965-N971 PolarHBondContact O-ND2 2.67Å; S968-N971 WeakPolarHBondContact CB-OD1 3.35Å; S968-N971 WeakPolarHBondContact O-CA 3.3Å; S968-N971 WeakPolarHBondContact O-CB 3.36Å; S968-N971 PolarHBondContact O-N 3.42Å; S968-N971 PolarHBondContact OG-N 3.27Å; S968-N971 PolarHBondContact OG-OD1 2.87Å; P969-N971 VanDerWaalsContact C-N 3.34Å; N971-T974 PolarHBondContact O-N 3.27Å; N971-A975 PolarHBondContact O-N 2.74Å
972	M	83.3	Confident	74.4	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.059	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-51.2	174.8	-64	-166.1	-94.5	0	0	111.5	L909 L966 S968 P969 T974 A975 L976 L1284	L909-M972 HydrophobicContact CB-SD 4.43Å; L909-M972 HydrophobicContact CD1-CB 4.07Å; L909-M972 HydrophobicContact CD1-CG 4.4Å; L909-M972 HydrophobicContact CD2-CB 4.31Å; L909-M972 HydrophobicContact CD2-CG 3.74Å; L909-M972 HydrophobicContact CD2-SD 3.85Å; L966-M972 WeakPolarHBondContact O-CG 3.45Å; S968-M972 PolarHBondContact O-N 2.59Å; P969-M972 HydrophobicContact CB-CE 4.34Å; P969-M972 HydrophobicContact CG-CE 4.24Å; P969-M972 PolarHBondContact O-N 3.46Å; M972-T974 VanDerWaalsContact C-N 3.32Å; M972-T974 PolarHBondContact O-N 2.9Å; M972-A975 PolarHBondContact O-N 3.18Å; M972-L976 PolarHBondContact O-N 3.25Å; M972-L976 VanDerWaalsContact O-N 3.07Å; M972-L1284 HydrophobicContact CB-CD1 4.15Å; M972-L1284 HydrophobicContact CB-CD2 3.79Å; M972-L1284 HydrophobicContact CE-CD2 3.77Å; M972-L1284 HydrophobicContact CG-CD2 4.42Å; M972-L1284 HydrophobicContact SD-CD2 4.01Å
973	V	86	Confident	76.8	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-58.6	-40.4	174.4	154	0	0	0	0	112.6	P969 A975 L976 R977 F1150 L1182 V1280 L1284	P969-V973 WeakPolarHBondContact O-CB 3.48Å; P969-V973 PolarHBondContact O-N 3.46Å; V973-A975 VanDerWaalsContact C-N 3.34Å; V973-A975 PolarHBondContact O-N 2.9Å; V973-L976 PolarHBondContact O-N 3.18Å; V973-R977 PolarHBondContact O-N 3.47Å; V973-F1150 HydrophobicContact CG1-CE1 4.25Å; V973-F1150 HydrophobicContact CG1-CZ 3.62Å; V973-L1182 HydrophobicContact CB-CD2 4.11Å; V973-L1182 HydrophobicContact CG1-CD2 3.78Å; V973-L1182 HydrophobicContact CG2-CD2 3.98Å; V973-V1280 HydrophobicContact CB-CG1 4.5Å; V973-V1280 HydrophobicContact CG2-CG1 3.97Å; V973-L1284 HydrophobicContact CG2-CB 4.17Å; V973-L1284 HydrophobicContact CG2-CD1 4.44Å
974	T	85.9	Confident	79.1	Confident	54 Å²	54	34.2 Å²	34.2	33%	0.331	19%	0.192	S	C	.	.	H	α-helix	trans	-66.6	-35.5	177.3	-57.5	0	0	0	0	112.2	C970 N971 M972 K978 F1079	C970-T974 WeakPolarHBondContact O-CB 3.43Å; C970-T974 PolarHBondContact O-N 3.15Å; C970-T974 PolarHBondContact O-OG1 3.31Å; N971-T974 PolarHBondContact O-N 3.27Å; M972-T974 VanDerWaalsContact C-N 3.32Å; M972-T974 PolarHBondContact O-N 2.9Å; T974-K978 PolarHBondContact O-N 2.9Å; T974-K978 VanDerWaalsContact O-N 3.12Å; T974-F1079 HydrophobicContact CG2-CE1 4Å; T974-F1079 HydrophobicContact CG2-CZ 4.29Å
975	A	86.4	Confident	81.2	Confident	23 Å²	23	28.4 Å²	28.4	19%	0.19	17%	0.165	C	C	.	.	H	α-helix	trans	-68.8	-42.5	176	0	0	0	0	0	112	L905 N971 M972 V973 K978 A979	L905-A975 HydrophobicContact CD2-CB 3.99Å; N971-A975 PolarHBondContact O-N 2.74Å; M972-A975 PolarHBondContact O-N 3.18Å; V973-A975 VanDerWaalsContact C-N 3.34Å; V973-A975 PolarHBondContact O-N 2.9Å; A975-K978 WeakPolarHBondContact O-CB 3.23Å; A975-K978 PolarHBondContact O-N 3.35Å; A975-A979 PolarHBondContact O-N 2.99Å; A975-A979 VanDerWaalsContact O-N 3.08Å
976	L	89.9	Confident	82.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-43	174.6	-66.7	172.5	0	0	0	111.8	Y902 L905 V906 L909 M972 V973 K978 A979 A980 L1182 L1284	Y902-L976 HydrophobicContact CE2-CB 4.2Å; Y902-L976 HydrophobicContact CE2-CD2 4.07Å; L905-L976 HydrophobicContact CD2-CD2 4.03Å; L905-L976 HydrophobicContact CG-CD2 4.11Å; V906-L976 HydrophobicContact CG2-CD2 3.61Å; L909-L976 HydrophobicContact CD1-CD1 4.41Å; L909-L976 HydrophobicContact CD1-CD2 4.22Å; L909-L976 HydrophobicContact CD1-CG 4.17Å; M972-L976 PolarHBondContact O-N 3.25Å; M972-L976 VanDerWaalsContact O-N 3.07Å; V973-L976 PolarHBondContact O-N 3.18Å; L976-K978 PolarHBondContact O-N 3.11Å; L976-A979 WeakPolarHBondContact O-CB 3.45Å; L976-A979 PolarHBondContact O-N 3.06Å; L976-A980 PolarHBondContact O-N 2.92Å; L976-L1182 HydrophobicContact CB-CD2 4.22Å; L976-L1182 HydrophobicContact CD1-CD1 4.49Å; L976-L1284 HydrophobicContact CD1-CD1 3.79Å
977	R	91.2	Very high	83.4	Confident	8 Å²	8	28.5 Å²	28.5	3%	0.03	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-38.8	174	-78.6	-174.1	61.1	148.7	4	113.6	V973 N981 F1079 D1147 I1148 L1182 M1186	V973-R977 PolarHBondContact O-N 3.47Å; R977-N981 PolarHBondContact O-N 3.19Å; R977-N981 PolarHBondContact O-ND2 3.4Å; R977-F1079 HydrophobicContact CB-CE2 4.02Å; R977-F1079 HydrophobicContact CB-CZ 4.01Å; R977-D1147 IonicContact CZ-OD2 2.7Å; R977-D1147 IonicContact NE-OD2 2.71Å; R977-D1147 IonicContact NH2-OD2 3.09Å; R977-D1147 PolarHBondContact NH2-OD2 2.96Å; R977-I1148 PolarHBondContact NH1-O 3.4Å; R977-I1148 PolarHBondContact NH2-O 3.17Å; R977-L1182 HydrophobicContact CG-CD2 4.23Å; R977-M1186 HydrophobicContact CG-SD 4.15Å
978	K	90.7	Very high	83.8	Confident	45 Å²	45	25.1 Å²	25.1	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-45.8	173.4	-80.7	175.3	141.5	-141.1	0	111.3	T974 A975 L976 N981 H982 L985 N1025	T974-K978 PolarHBondContact O-N 2.9Å; T974-K978 VanDerWaalsContact O-N 3.12Å; A975-K978 WeakPolarHBondContact O-CB 3.23Å; A975-K978 PolarHBondContact O-N 3.35Å; L976-K978 PolarHBondContact O-N 3.11Å; K978-N981 PolarHBondContact O-N 2.97Å; K978-N981 VanDerWaalsContact O-N 3.14Å; K978-H982 PolarHBondContact O-N 2.99Å; K978-L985 HydrophobicContact CB-CB 4.04Å; K978-L985 HydrophobicContact CB-CD1 4.47Å; K978-L985 HydrophobicContact CG-CB 4.27Å; K978-L985 PolarHBondContact NZ-O 3.45Å; K978-N1025 PolarHBondContact NZ-OD1 3.12Å
979	A	89.8	Confident	84	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-41.6	-179.4	0	0	0	0	0	112.8	Q898 Y902 L905 A975 L976 N981 F986	Q898-A979 WeakPolarHBondContact CG-O 3.12Å; Q898-A979 PolarHBondContact NE2-O 3.31Å; Y902-A979 HydrophobicContact CD2-CB 3.69Å; Y902-A979 HydrophobicContact CE2-CB 4.45Å; L905-A979 HydrophobicContact CD2-CB 4.17Å; A975-A979 PolarHBondContact O-N 2.99Å; A975-A979 VanDerWaalsContact O-N 3.08Å; L976-A979 WeakPolarHBondContact O-CB 3.45Å; L976-A979 PolarHBondContact O-N 3.06Å; A979-N981 VanDerWaalsContact C-N 3.27Å; A979-N981 PolarHBondContact O-N 3.39Å; A979-F986 HydrophobicContact CB-CE1 4.34Å; A979-F986 HydrophobicContact CB-CE2 3.46Å; A979-F986 VanDerWaalsContact CB-CE2 3.46Å; A979-F986 HydrophobicContact CB-CZ 3.33Å
980	A	91.8	Very high	84.1	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-29.6	173.2	0	0	0	0	0	113	Q898 Y902 L976 S1178 T1181 E1183	Q898-A980 VanDerWaalsContact NE2-C 3.32Å; Q898-A980 PolarHBondContact NE2-O 3.13Å; Y902-A980 HydrophobicContact CE2-CB 4.33Å; L976-A980 PolarHBondContact O-N 2.92Å; A980-S1178 PolarHBondContact O-OG 3.16Å; A980-T1181 HydrophobicContact CB-CG2 4.01Å; A980-E1183 HydrophobicContact CB-CG 4.45Å
981	N	92.5	Very high	84.5	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-82	-52.9	179.1	-81.3	-35.4	0	0	0	114.1	R977 K978 A979 L985 S1053 K1055 M1082 H1146 D1147	R977-N981 PolarHBondContact O-N 3.19Å; R977-N981 PolarHBondContact O-ND2 3.4Å; K978-N981 PolarHBondContact O-N 2.97Å; K978-N981 VanDerWaalsContact O-N 3.14Å; A979-N981 VanDerWaalsContact C-N 3.27Å; A979-N981 PolarHBondContact O-N 3.39Å; N981-L985 HydrophobicContact CB-CD1 4.04Å; N981-S1053 VanDerWaalsContact O-CB 3.25Å; N981-S1053 WeakPolarHBondContact O-CB 3.06Å; N981-S1053 PolarHBondContact O-OG 3.49Å; N981-K1055 PolarHBondContact OD1-NZ 3.24Å; N981-M1082 HydrophobicContact CB-SD 4.01Å; N981-H1146 PolarHBondContact OD1-CE1 3.18Å; N981-H1146 PolarHBondContact OD1-ND1 3.22Å; N981-D1147 WeakPolarHBondContact ND2-CB 3.26Å; N981-D1147 PolarHBondContact ND2-OD2 3.28Å; N981-D1147 WeakPolarHBondContact OD1-CB 3.33Å
982	H	91.3	Very high	84.7	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.019	15%	0.148	C	C	.	.			trans	-163.2	143.2	-179	-163.9	-90.7	0	0	0	114.4	K978 A984 L985 I1049 S1053 I1056 M1082 I1085	K978-H982 PolarHBondContact O-N 2.99Å; H982-A984 WeakPolarHBondContact CE1-CB 3.46Å; H982-A984 WeakPolarHBondContact ND1-CB 3.34Å; H982-A984 PolarHBondContact ND1-N 3.49Å; H982-A984 PolarHBondContact O-N 2.98Å; H982-L985 HydrophobicContact CB-CD1 4.11Å; H982-L985 HydrophobicContact CB-CG 4.18Å; H982-L985 WeakPolarHBondContact O-CB 3.36Å; H982-L985 PolarHBondContact O-N 3.17Å; H982-I1049 WeakPolarHBondContact NE2-CA 3.38Å; H982-I1049 PolarHBondContact NE2-O 2.92Å; H982-S1053 VanDerWaalsContact CD2-CB 3.44Å; H982-S1053 WeakPolarHBondContact CD2-CB 3.22Å; H982-I1056 WeakPolarHBondContact CD2-CD1 3.35Å; H982-I1056 WeakPolarHBondContact NE2-CD1 3.49Å; H982-M1082 HydrophobicContact CB-CE 4.21Å; H982-M1082 HydrophobicContact CB-SD 3.96Å; H982-I1085 HydrophobicContact CB-CD1 4.16Å
983	Q	88.4	Confident	84.6	Confident	25 Å²	25	25.6 Å²	25.6	12%	0.117	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-60.8	-39.9	178.3	-76.7	172.2	82.4	0	0	113.7	T895 S897 Q898 L985 F986 L989 G1052	T895-Q983 PolarHBondContact OG1-NE2 2.82Å; S897-Q983 PolarHBondContact OG-OE1 2.64Å; Q898-Q983 HydrophobicContact CB-CG 3.88Å; Q898-Q983 HydrophobicContact CG-CG 4.21Å; Q983-L985 PolarHBondContact O-N 2.93Å; Q983-F986 WeakPolarHBondContact O-CB 3.31Å; Q983-F986 WeakPolarHBondContact O-CD2 3.47Å; Q983-F986 PolarHBondContact O-N 3.3Å; Q983-L989 HydrophobicContact CB-CD1 4.38Å; Q983-G1052 WeakPolarHBondContact CB-O 3.16Å; Q983-G1052 VanDerWaalsContact CG-O 3.28Å; Q983-G1052 WeakPolarHBondContact CG-O 3.25Å; Q983-G1052 PolarHBondContact N-O 2.74Å; Q983-G1052 VanDerWaalsContact N-O 3.12Å; Q983-G1052 VanDerWaalsContact NE2-C 3.32Å; Q983-G1052 PolarHBondContact NE2-O 3.1Å
984	A	84.5	Confident	84.6	Confident	6 Å²	6	28.9 Å²	28.9	5%	0.05	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-72.8	3.5	-180	0	0	0	0	0	114.4	H982 D1026 H1027	H982-A984 WeakPolarHBondContact CE1-CB 3.46Å; H982-A984 WeakPolarHBondContact ND1-CB 3.34Å; H982-A984 PolarHBondContact ND1-N 3.49Å; H982-A984 PolarHBondContact O-N 2.98Å; A984-D1026 HydrophobicContact CB-CB 4.41Å; A984-D1026 PolarHBondContact O-N 3.39Å; A984-H1027 HydrophobicContact CB-CB 3.92Å; A984-H1027 WeakPolarHBondContact O-CB 3.42Å; A984-H1027 PolarHBondContact O-N 3.32Å
985	L	84.8	Confident	84.6	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.016	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-87.9	-7.2	167.1	-65.4	173.9	0	0	0	113.7	K978 N981 H982 Q983 N1025 I1081 M1082 I1085	K978-L985 HydrophobicContact CB-CB 4.04Å; K978-L985 HydrophobicContact CB-CD1 4.47Å; K978-L985 HydrophobicContact CG-CB 4.27Å; K978-L985 PolarHBondContact NZ-O 3.45Å; N981-L985 HydrophobicContact CB-CD1 4.04Å; H982-L985 HydrophobicContact CB-CD1 4.11Å; H982-L985 HydrophobicContact CB-CG 4.18Å; H982-L985 WeakPolarHBondContact O-CB 3.36Å; H982-L985 PolarHBondContact O-N 3.17Å; Q983-L985 PolarHBondContact O-N 2.93Å; L985-N1025 PolarHBondContact O-OD1 3.1Å; L985-N1025 VanDerWaalsContact O-OD1 3.13Å; L985-I1081 HydrophobicContact CD2-CB 3.87Å; L985-I1081 HydrophobicContact CD2-CG2 3.53Å; L985-M1082 HydrophobicContact CD1-SD 3.94Å; L985-I1085 HydrophobicContact CD1-CD1 4.42Å; L985-I1085 HydrophobicContact CD2-CD1 3.58Å; L985-I1085 HydrophobicContact CG-CD1 3.67Å
986	F	79.8	Confident	84.6	Confident	33 Å²	33	27.9 Å²	27.9	15%	0.145	17%	0.173	C	C	.	.	S	Bend	trans	-76.7	172.9	163	-74.4	-96.2	0	0	0	111	H901 L905 A979 Q983 L989 N1025 D1026	H901-F986 HydrophobicContact CB-CE2 4.17Å; H901-F986 HydrophobicContact CB-CZ 3.93Å; L905-F986 HydrophobicContact CB-CE1 4.35Å; L905-F986 HydrophobicContact CD2-CE1 4.05Å; L905-F986 HydrophobicContact CD2-CZ 4.31Å; A979-F986 HydrophobicContact CB-CE1 4.34Å; A979-F986 HydrophobicContact CB-CE2 3.46Å; A979-F986 VanDerWaalsContact CB-CE2 3.46Å; A979-F986 HydrophobicContact CB-CZ 3.33Å; Q983-F986 WeakPolarHBondContact O-CB 3.31Å; Q983-F986 WeakPolarHBondContact O-CD2 3.47Å; Q983-F986 PolarHBondContact O-N 3.3Å; F986-L989 HydrophobicContact CB-CD1 3.61Å; F986-L989 HydrophobicContact CB-CG 3.77Å; F986-L989 HydrophobicContact CD1-CD1 4.34Å; F986-L989 HydrophobicContact CD2-CD1 3.59Å; F986-L989 HydrophobicContact CE2-CD1 4.22Å; F986-L989 HydrophobicContact CG-CD1 3.64Å; F986-L989 HydrophobicContact CG-CG 4.18Å; F986-N1025 CarbonylContact O-C 3.6Å; F986-N1025 VanDerWaalsContact O-CA 3.24Å; F986-N1025 WeakPolarHBondContact O-CA 3.46Å; F986-N1025 WeakPolarHBondContact O-CB 3.49Å; F986-D1026 PolarHBondContact O-N 3.37Å
987	S	72.9	Confident	84.4	Confident	65 Å²	65	34.1 Å²	34.1	46%	0.455	20%	0.197	S	C	.	.	S	Bend	trans	-119.8	122	171	56.5	0	0	0	0	109	M1024	S987-M1024 WeakPolarHBondContact CB-O 3.44Å
988	G	68.4	Low	84.2	Confident	42 Å²	42	36.6 Å²	36.6	43%	0.433	21%	0.21	S	C	.	.	S	Bend	trans	86.8	30.3	174.4	0	0	0	0	0	115.7	Y991 D1026	G988-Y991 WeakPolarHBondContact CA-O 3.44Å; G988-D1026 PolarHBondContact N-OD1 3.18Å
989	L	76.7	Confident	84	Confident	59 Å²	59	34.5 Å²	34.5	31%	0.309	20%	0.201	S	C	.	.	S	Bend	trans	-93.2	-56.1	168.5	-63.3	-176.4	0	0	0	110.9	H901 Q983 F986 D1026	H901-L989 HydrophobicContact CB-CD1 4.21Å; Q983-L989 HydrophobicContact CB-CD1 4.38Å; F986-L989 HydrophobicContact CB-CD1 3.61Å; F986-L989 HydrophobicContact CB-CG 3.77Å; F986-L989 HydrophobicContact CD1-CD1 4.34Å; F986-L989 HydrophobicContact CD2-CD1 3.59Å; F986-L989 HydrophobicContact CE2-CD1 4.22Å; F986-L989 HydrophobicContact CG-CD1 3.64Å; F986-L989 HydrophobicContact CG-CG 4.18Å; L989-D1026 WeakPolarHBondContact CA-OD2 3.24Å; L989-D1026 WeakPolarHBondContact CB-OD2 3.38Å; L989-D1026 PolarHBondContact N-OD2 3.08Å
990	A	77.2	Confident	83.9	Confident	42 Å²	42	34.6 Å²	34.6	35%	0.347	20%	0.202	S	C	.	.	S	Bend	trans	-83.9	-27.3	179.5	0	0	0	0	0	112.8	D1026 L1044	A990-D1026 HydrophobicContact CB-CB 4.4Å; A990-D1026 PolarHBondContact N-OD2 3.12Å; A990-L1044 HydrophobicContact CB-CD1 4.21Å; A990-L1044 HydrophobicContact CB-CD2 3.75Å
991	Y	82.6	Confident	83.6	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.016	23%	0.229	C	C	.	.	S	Bend	trans	-113.8	97.6	-179.5	-65.7	-78.2	0	0	0	110.7	G988 I999 D1026 I1029 H1030 Y1042 L1044	G988-Y991 WeakPolarHBondContact CA-O 3.44Å; Y991-I999 HydrophobicContact CD1-CD1 3.61Å; Y991-I999 HydrophobicContact CE1-CD1 3.83Å; Y991-D1026 HydrophobicContact CD2-CB 4Å; Y991-D1026 HydrophobicContact CE2-CB 4.42Å; Y991-D1026 WeakPolarHBondContact CE2-O 3.36Å; Y991-I1029 HydrophobicContact CD1-CG2 3.86Å; Y991-I1029 HydrophobicContact CD2-CB 3.81Å; Y991-I1029 HydrophobicContact CD2-CD1 4.25Å; Y991-I1029 HydrophobicContact CD2-CG2 3.76Å; Y991-I1029 HydrophobicContact CE1-CG2 3.93Å; Y991-I1029 HydrophobicContact CE2-CB 3.85Å; Y991-I1029 HydrophobicContact CE2-CG2 3.83Å; Y991-I1029 HydrophobicContact CG-CB 4.3Å; Y991-I1029 HydrophobicContact CG-CD1 4.41Å; Y991-I1029 HydrophobicContact CG-CG2 3.78Å; Y991-H1030 HydrophobicContact CE2-CB 4.29Å; Y991-H1030 WeakPolarHBondContact OH-CA 3.49Å; Y991-Y1042 VanDerWaalsContact CE1-O 3.26Å; Y991-Y1042 WeakPolarHBondContact CE1-O 3.38Å; Y991-Y1042 PolarHBondContact OH-O 3.18Å; Y991-L1044 HydrophobicContact CE2-CD1 4.24Å; Y991-L1044 HydrophobicContact CE2-CD2 3.9Å; Y991-L1044 HydrophobicContact CE2-CG 4.12Å
992	T	84.2	Confident	83.3	Confident	64 Å²	64	41.4 Å²	41.4	39%	0.393	24%	0.236	S	C	.	.			trans	-70.1	160.1	-178.3	85.2	0	0	0	0	112.4	S994 N995 L996	T992-S994 CarbonylContact O-C 3.57Å; T992-S994 PolarHBondContact O-N 3.28Å; T992-S994 PolarHBondContact OG1-N 3.35Å; T992-S994 VanDerWaalsContact OG1-N 3.17Å; T992-N995 PolarHBondContact O-N 2.79Å; T992-N995 PolarHBondContact OG1-N 2.79Å; T992-N995 PolarHBondContact OG1-OD1 3.34Å; T992-L996 WeakPolarHBondContact O-CG 3.35Å; T992-L996 PolarHBondContact O-N 2.68Å
993	D	82.9	Confident	82.8	Confident	59 Å²	59	41.3 Å²	41.3	32%	0.316	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-13.7	172.7	-89.9	-0.6	0	0	0	113.8	R997 R1022	D993-R997 WeakPolarHBondContact O-CG 3.3Å; D993-R997 PolarHBondContact O-NE 2.79Å; D993-R1022 IonicContact OD1-CZ 3.39Å; D993-R1022 IonicContact OD1-NE 3.28Å; D993-R1022 PolarHBondContact OD1-NE 3.31Å; D993-R1022 IonicContact OD1-NH2 2.7Å; D993-R1022 IonicContact OD2-CZ 3.6Å; D993-R1022 IonicContact OD2-NE 2.78Å; D993-R1022 PolarHBondContact OD2-NE 2.84Å; D993-R1022 IonicContact OD2-NH2 3.56Å; D993-R1022 PolarHBondContact OD2-NH2 3.07Å
994	S	84.4	Confident	82.5	Confident	69 Å²	69	43.2 Å²	43.2	48%	0.483	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-59.9	166.3	-164	0	0	0	0	110.6	T992 L996 R997 D998	T992-S994 CarbonylContact O-C 3.57Å; T992-S994 PolarHBondContact O-N 3.28Å; T992-S994 PolarHBondContact OG1-N 3.35Å; T992-S994 VanDerWaalsContact OG1-N 3.17Å; S994-L996 PolarHBondContact O-N 2.84Å; S994-R997 WeakPolarHBondContact O-CA 3.44Å; S994-R997 WeakPolarHBondContact O-CB 3.44Å; S994-R997 PolarHBondContact O-N 2.65Å; S994-D998 VanDerWaalsContact C-OD2 3.24Å; S994-D998 VanDerWaalsContact O-CG 3.28Å; S994-D998 PolarHBondContact O-N 2.68Å; S994-D998 VanDerWaalsContact O-N 3.11Å; S994-D998 VanDerWaalsContact O-OD2 3.12Å
995	N	85.7	Confident	82.3	Confident	53 Å²	53	49.5 Å²	49.5	28%	0.283	28%	0.276	S	S	.	.	H	α-helix	trans	-51	-35.9	-179.5	-52.5	36.9	0	0	0	111.9	T992 R997 D998 I999	T992-N995 PolarHBondContact O-N 2.79Å; T992-N995 PolarHBondContact OG1-N 2.79Å; T992-N995 PolarHBondContact OG1-OD1 3.34Å; N995-R997 VanDerWaalsContact C-N 3.31Å; N995-R997 PolarHBondContact O-N 2.81Å; N995-D998 VanDerWaalsContact CA-OD2 3.3Å; N995-D998 WeakPolarHBondContact CA-OD2 3.41Å; N995-D998 PolarHBondContact N-OD2 2.77Å; N995-D998 PolarHBondContact O-N 2.79Å; N995-I999 VanDerWaalsContact O-CB 3.29Å; N995-I999 WeakPolarHBondContact O-CB 3.46Å; N995-I999 WeakPolarHBondContact O-CD1 3.35Å; N995-I999 WeakPolarHBondContact O-CG1 3.47Å; N995-I999 PolarHBondContact O-N 3.5Å
996	L	86.5	Confident	82.1	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-28.5	177	-65.8	-179.2	0	0	0	113.9	T992 S994 A1000 Y1018 L1021 R1022 I1029	T992-L996 WeakPolarHBondContact O-CG 3.35Å; T992-L996 PolarHBondContact O-N 2.68Å; S994-L996 PolarHBondContact O-N 2.84Å; L996-A1000 VanDerWaalsContact O-CB 3.28Å; L996-A1000 WeakPolarHBondContact O-CB 3.26Å; L996-A1000 PolarHBondContact O-N 3.02Å; L996-A1000 VanDerWaalsContact O-N 3.14Å; L996-Y1018 HydrophobicContact CB-CD2 3.82Å; L996-Y1018 HydrophobicContact CB-CE2 3.88Å; L996-L1021 HydrophobicContact CD2-CB 4.25Å; L996-R1022 HydrophobicContact CD1-CB 4.09Å; L996-R1022 HydrophobicContact CD1-CG 4.16Å; L996-I1029 HydrophobicContact CD2-CD1 3.77Å
997	R	87.4	Confident	81.8	Confident	131 Å²	131	54.3 Å²	54.3	49%	0.494	31%	0.31	S	S	.	.	H	α-helix	trans	-78.7	-44.7	172.5	-61.7	175.1	-171.8	-163.5	-1.1	110.4	D993 S994 N995 I999 A1000 E1001 Y1018	D993-R997 WeakPolarHBondContact O-CG 3.3Å; D993-R997 PolarHBondContact O-NE 2.79Å; S994-R997 WeakPolarHBondContact O-CA 3.44Å; S994-R997 WeakPolarHBondContact O-CB 3.44Å; S994-R997 PolarHBondContact O-N 2.65Å; N995-R997 VanDerWaalsContact C-N 3.31Å; N995-R997 PolarHBondContact O-N 2.81Å; R997-I999 PolarHBondContact O-N 3.23Å; R997-A1000 CarbonylContact O-C 3.59Å; R997-A1000 WeakPolarHBondContact O-CA 3.48Å; R997-A1000 WeakPolarHBondContact O-CB 3.41Å; R997-A1000 PolarHBondContact O-N 2.85Å; R997-E1001 PolarHBondContact O-N 3.33Å; R997-Y1018 HydrophobicContact CB-CD2 4.46Å; R997-Y1018 HydrophobicContact CG-CD2 3.52Å; R997-Y1018 HydrophobicContact CG-CE2 3.54Å; R997-Y1018 HydrophobicContact CG-CG 4.34Å
998	D	86.8	Confident	81.9	Confident	60 Å²	60	55.2 Å²	55.2	32%	0.321	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-41.1	178.1	-45.9	-37.3	0	0	0	110.2	S994 N995 S1002 Y1042	S994-D998 VanDerWaalsContact C-OD2 3.24Å; S994-D998 VanDerWaalsContact O-CG 3.28Å; S994-D998 PolarHBondContact O-N 2.68Å; S994-D998 VanDerWaalsContact O-N 3.11Å; S994-D998 VanDerWaalsContact O-OD2 3.12Å; N995-D998 VanDerWaalsContact CA-OD2 3.3Å; N995-D998 WeakPolarHBondContact CA-OD2 3.41Å; N995-D998 PolarHBondContact N-OD2 2.77Å; N995-D998 PolarHBondContact O-N 2.79Å; D998-S1002 VanDerWaalsContact O-CB 3.22Å; D998-S1002 WeakPolarHBondContact O-CB 3.17Å; D998-S1002 PolarHBondContact O-N 2.85Å; D998-S1002 PolarHBondContact O-OG 3.29Å; D998-Y1042 HydrophobicContact CB-CE1 4.21Å; D998-Y1042 WeakPolarHBondContact CB-OH 3.21Å
999	I	86.5	Confident	81.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-38.6	170.5	-70.4	165.3	0	0	0	112.2	Y991 N995 R997 S1002 L1003 L1021 I1029 L1039 Y1042	Y991-I999 HydrophobicContact CD1-CD1 3.61Å; Y991-I999 HydrophobicContact CE1-CD1 3.83Å; N995-I999 VanDerWaalsContact O-CB 3.29Å; N995-I999 WeakPolarHBondContact O-CB 3.46Å; N995-I999 WeakPolarHBondContact O-CD1 3.35Å; N995-I999 WeakPolarHBondContact O-CG1 3.47Å; N995-I999 PolarHBondContact O-N 3.5Å; R997-I999 PolarHBondContact O-N 3.23Å; I999-S1002 PolarHBondContact O-N 3.18Å; I999-L1003 HydrophobicContact CG2-CD1 3.97Å; I999-L1003 WeakPolarHBondContact O-CB 3.42Å; I999-L1003 WeakPolarHBondContact O-CG 3.28Å; I999-L1003 PolarHBondContact O-N 3.11Å; I999-L1021 HydrophobicContact CB-CD1 4.39Å; I999-L1021 HydrophobicContact CG2-CD1 3.69Å; I999-I1029 HydrophobicContact CD1-CG2 4.34Å; I999-L1039 HydrophobicContact CB-CD2 4.29Å; I999-L1039 HydrophobicContact CG1-CD2 4.32Å; I999-L1039 HydrophobicContact CG2-CD1 3.94Å; I999-L1039 HydrophobicContact CG2-CD2 3.85Å; I999-Y1042 HydrophobicContact CD1-CD1 4.09Å; I999-Y1042 HydrophobicContact CD1-CG 3.96Å; I999-Y1042 HydrophobicContact CG1-CD1 3.79Å; I999-Y1042 HydrophobicContact CG1-CD2 3.72Å; I999-Y1042 HydrophobicContact CG1-CE1 4.11Å; I999-Y1042 HydrophobicContact CG1-CE2 4.04Å; I999-Y1042 HydrophobicContact CG1-CG 3.58Å
1000	A	86.8	Confident	81.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-41	179.8	0	0	0	0	0	113	L996 R997 H1004 I1017 L1021	L996-A1000 VanDerWaalsContact O-CB 3.28Å; L996-A1000 WeakPolarHBondContact O-CB 3.26Å; L996-A1000 PolarHBondContact O-N 3.02Å; L996-A1000 VanDerWaalsContact O-N 3.14Å; R997-A1000 CarbonylContact O-C 3.59Å; R997-A1000 WeakPolarHBondContact O-CA 3.48Å; R997-A1000 WeakPolarHBondContact O-CB 3.41Å; R997-A1000 PolarHBondContact O-N 2.85Å; A1000-H1004 PolarHBondContact O-N 3.49Å; A1000-I1017 HydrophobicContact CB-CB 4.01Å; A1000-I1017 HydrophobicContact CB-CG2 3.54Å; A1000-L1021 HydrophobicContact CB-CD1 4.35Å
1001	E	86	Confident	81.8	Confident	123 Å²	123	59.6 Å²	59.6	58%	0.575	33%	0.328	S	S	*	.	H	α-helix	trans	-68.4	-43.3	173.3	-68.2	177.9	-158.4	0	0	110.5	R997 L1003 H1004 L1005	R997-E1001 PolarHBondContact O-N 3.33Å; E1001-L1003 VanDerWaalsContact C-N 3.34Å; E1001-L1003 PolarHBondContact O-N 2.63Å; E1001-H1004 WeakPolarHBondContact O-CB 3.47Å; E1001-H1004 PolarHBondContact O-N 2.82Å; E1001-H1004 VanDerWaalsContact O-N 3.14Å; E1001-L1005 PolarHBondContact O-N 2.87Å
1002	S	84.8	Confident	81.6	Confident	22 Å²	22	59.8 Å²	59.8	15%	0.154	33%	0.33	C	S	.	.	H	α-helix	trans	-59.5	-40.8	173.9	-59.7	0	0	0	0	112.5	D998 I999 L1005	D998-S1002 VanDerWaalsContact O-CB 3.22Å; D998-S1002 WeakPolarHBondContact O-CB 3.17Å; D998-S1002 PolarHBondContact O-N 2.85Å; D998-S1002 PolarHBondContact O-OG 3.29Å; I999-S1002 PolarHBondContact O-N 3.18Å; S1002-L1005 PolarHBondContact O-N 3.27Å
1003	L	82.4	Confident	81.5	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-38.1	174.4	-83.6	164.7	0	0	0	112.3	F371 I999 E1001 L1005 D1006 H1009 I1017 L1021 Y1036 L1039	F371-L1003 HydrophobicContact CE1-CD1 4.17Å; F371-L1003 HydrophobicContact CZ-CD1 3.85Å; I999-L1003 HydrophobicContact CG2-CD1 3.97Å; I999-L1003 WeakPolarHBondContact O-CB 3.42Å; I999-L1003 WeakPolarHBondContact O-CG 3.28Å; I999-L1003 PolarHBondContact O-N 3.11Å; E1001-L1003 VanDerWaalsContact C-N 3.34Å; E1001-L1003 PolarHBondContact O-N 2.63Å; L1003-L1005 PolarHBondContact O-N 2.94Å; L1003-D1006 WeakPolarHBondContact O-CB 3.07Å; L1003-D1006 PolarHBondContact O-N 3.03Å; L1003-H1009 WeakPolarHBondContact O-CB 3.44Å; L1003-I1017 HydrophobicContact CB-CD1 4.12Å; L1003-I1017 HydrophobicContact CD1-CG2 3.96Å; L1003-L1021 HydrophobicContact CD1-CD1 4.34Å; L1003-Y1036 HydrophobicContact CD2-CD2 4.02Å; L1003-Y1036 HydrophobicContact CD2-CE2 4.48Å; L1003-Y1036 HydrophobicContact CD2-CG 4.15Å; L1003-L1039 HydrophobicContact CD1-CD1 3.99Å; L1003-L1039 HydrophobicContact CD2-CD1 3.81Å; L1003-L1039 HydrophobicContact CD2-CG 4.26Å; L1003-L1039 HydrophobicContact CG-CD1 3.79Å; L1003-L1039 HydrophobicContact CG-CD2 4.2Å; L1003-L1039 HydrophobicContact CG-CG 4.21Å
1004	H	82.1	Confident	81.6	Confident	66 Å²	66	59 Å²	59	31%	0.306	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-24.7	177.9	-177	72.9	0	0	0	112.9	A1000 E1001 D1006 S1010 A1012 P1014	A1000-H1004 PolarHBondContact O-N 3.49Å; E1001-H1004 WeakPolarHBondContact O-CB 3.47Å; E1001-H1004 PolarHBondContact O-N 2.82Å; E1001-H1004 VanDerWaalsContact O-N 3.14Å; H1004-D1006 VanDerWaalsContact C-N 3.33Å; H1004-S1010 PolarHBondContact CE1-O 3.37Å; H1004-S1010 VanDerWaalsContact CE1-O 3.3Å; H1004-S1010 WeakPolarHBondContact O-CA 3.23Å; H1004-A1012 PolarHBondContact CE1-O 2.88Å; H1004-A1012 PolarHBondContact ND1-O 3.45Å; H1004-P1014 HydrophobicContact CB-CG 3.99Å
1005	L	80.3	Confident	81.6	Confident	138 Å²	138	61 Å²	61	72%	0.723	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.9	171.8	-62.1	174	0	0	0	113.5	E1001 S1002 L1003	E1001-L1005 PolarHBondContact O-N 2.87Å; S1002-L1005 PolarHBondContact O-N 3.27Å; L1003-L1005 PolarHBondContact O-N 2.94Å
1006	D	78.7	Confident	81.5	Confident	24 Å²	24	62.2 Å²	62.2	13%	0.128	34%	0.337	C	S	.	.	S	Bend	trans	-72.6	133.9	177.9	179	75.5	0	0	0	111.3	L1003 H1004 S1008 H1009 S1010	L1003-D1006 WeakPolarHBondContact O-CB 3.07Å; L1003-D1006 PolarHBondContact O-N 3.03Å; H1004-D1006 VanDerWaalsContact C-N 3.33Å; D1006-S1008 PolarHBondContact O-N 3.41Å; D1006-S1008 WeakPolarHBondContact OD2-CA 3.45Å; D1006-S1008 WeakPolarHBondContact OD2-CB 3.26Å; D1006-S1008 PolarHBondContact OD2-N 3.13Å; D1006-S1008 PolarHBondContact OD2-OG 2.92Å; D1006-H1009 PolarHBondContact O-N 2.79Å; D1006-H1009 IonicContact OD2-ND1 2.64Å; D1006-S1010 PolarHBondContact O-N 2.97Å
1007	P	75.1	Confident	81.4	Confident	112 Å²	112	62 Å²	62	73%	0.727	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-23.8	179.5	-29.9	37	0	0	0	115.4	S1010	P1007-S1010 PolarHBondContact O-OG 2.85Å
1008	S	74.4	Confident	81.4	Confident	85 Å²	85	57.4 Å²	57.4	59%	0.594	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-25.7	176.8	-37	0	0	0	0	113.2	D1006	D1006-S1008 PolarHBondContact O-N 3.41Å; D1006-S1008 WeakPolarHBondContact OD2-CA 3.45Å; D1006-S1008 WeakPolarHBondContact OD2-CB 3.26Å; D1006-S1008 PolarHBondContact OD2-N 3.13Å; D1006-S1008 PolarHBondContact OD2-OG 2.92Å
1009	H	69.3	Low	81.2	Confident	23 Å²	23	59.2 Å²	59.2	11%	0.106	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	6.9	-173.4	-50.6	96.6	0	0	0	114.5	F371 L1003 D1006 N1011 A1012 I1017 Y1036	F371-H1009 AromaticContact CE1-NE2 3.97Å; L1003-H1009 WeakPolarHBondContact O-CB 3.44Å; D1006-H1009 PolarHBondContact O-N 2.79Å; D1006-H1009 IonicContact OD2-ND1 2.64Å; H1009-N1011 PolarHBondContact O-N 2.82Å; H1009-A1012 HydrophobicContact CB-CB 4.4Å; H1009-A1012 WeakPolarHBondContact O-CB 3.36Å; H1009-A1012 PolarHBondContact O-N 2.97Å; H1009-I1017 HydrophobicContact CB-CD1 4.42Å; H1009-Y1036 AromaticContact CE1-CE1 3.63Å; H1009-Y1036 AromaticContact CE1-CZ 3.53Å
1010	S	74.2	Confident	81.1	Confident	56 Å²	56	60 Å²	60	39%	0.392	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-21.9	171.3	57.5	0	0	0	0	115.5	H1004 D1006 P1007	H1004-S1010 PolarHBondContact CE1-O 3.37Å; H1004-S1010 VanDerWaalsContact CE1-O 3.3Å; H1004-S1010 WeakPolarHBondContact O-CA 3.23Å; D1006-S1010 PolarHBondContact O-N 2.97Å; P1007-S1010 PolarHBondContact O-OG 2.85Å
1011	N	76.9	Confident	81	Confident	155 Å²	155	60 Å²	60	83%	0.829	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	10.4	175.7	-62	-83.3	0	0	0	113.7	H1009	H1009-N1011 PolarHBondContact O-N 2.82Å
1012	A	78.1	Confident	80.9	Confident	9 Å²	9	57.1 Å²	57.1	7%	0.074	31%	0.313	C	S	.	.	S	Bend	trans	-86.6	156.1	177.5	0	0	0	0	0	112.5	F370 H1004 H1009 I1017	F370-A1012 HydrophobicContact CE1-CB 3.46Å; F370-A1012 VanDerWaalsContact CE1-CB 3.46Å; F370-A1012 HydrophobicContact CE2-CB 4.11Å; F370-A1012 HydrophobicContact CZ-CB 3.21Å; H1004-A1012 PolarHBondContact CE1-O 2.88Å; H1004-A1012 PolarHBondContact ND1-O 3.45Å; H1009-A1012 HydrophobicContact CB-CB 4.4Å; H1009-A1012 WeakPolarHBondContact O-CB 3.36Å; H1009-A1012 PolarHBondContact O-N 2.97Å; A1012-I1017 HydrophobicContact CB-CD1 3.46Å; A1012-I1017 VanDerWaalsContact CB-CD1 3.46Å; A1012-I1017 HydrophobicContact CB-CG1 3.89Å
1013	D	83.1	Confident	80.8	Confident	71 Å²	71	60 Å²	60	38%	0.38	34%	0.338	S	S	.	.			trans	-86.5	121.2	155.7	177.5	-3.9	0	0	0	108.3	N1015 L1016 I1017	D1013-N1015 PolarHBondContact O-N 3.32Å; D1013-N1015 VanDerWaalsContact O-N 3.15Å; D1013-N1015 WeakPolarHBondContact OD1-CB 3.35Å; D1013-N1015 PolarHBondContact OD1-N 2.75Å; D1013-N1015 PolarHBondContact OD1-ND2 3.3Å; D1013-L1016 HydrophobicContact CB-CB 4.22Å; D1013-L1016 HydrophobicContact CB-CD1 4.02Å; D1013-L1016 HydrophobicContact CB-CG 3.97Å; D1013-L1016 PolarHBondContact O-N 3.03Å; D1013-I1017 PolarHBondContact O-N 3.06Å; D1013-I1017 VanDerWaalsContact O-N 3.08Å
1014	P	84.1	Confident	80.6	Confident	35 Å²	35	61.3 Å²	61.3	23%	0.227	34%	0.344	C	S	.	.	H	α-helix	trans	-53.4	-30.6	175.2	-26.5	34.6	0	0	0	113.7	H1004 I1017 Y1018	H1004-P1014 HydrophobicContact CB-CG 3.99Å; P1014-I1017 PolarHBondContact O-N 3.46Å; P1014-Y1018 WeakPolarHBondContact O-CB 3.32Å; P1014-Y1018 PolarHBondContact O-N 3.04Å
1015	N	84.6	Confident	80.7	Confident	111 Å²	111	59.3 Å²	59.3	59%	0.594	34%	0.336	S	S	*	.	H	α-helix	trans	-67.3	-40.4	177.1	-59.9	-84.1	0	0	0	111.6	D1013 I1017 Y1018 E1019	D1013-N1015 PolarHBondContact O-N 3.32Å; D1013-N1015 VanDerWaalsContact O-N 3.15Å; D1013-N1015 WeakPolarHBondContact OD1-CB 3.35Å; D1013-N1015 PolarHBondContact OD1-N 2.75Å; D1013-N1015 PolarHBondContact OD1-ND2 3.3Å; N1015-I1017 VanDerWaalsContact C-N 3.33Å; N1015-Y1018 PolarHBondContact O-N 3.43Å; N1015-E1019 WeakPolarHBondContact O-CG 3.45Å; N1015-E1019 PolarHBondContact O-N 2.87Å
1016	L	84.1	Confident	80.9	Confident	78 Å²	78	52.8 Å²	52.8	41%	0.408	30%	0.302	S	S	.	.	H	α-helix	trans	-70.2	-30.6	174.7	-64.8	179.6	0	0	0	112	D1013 D1020	D1013-L1016 HydrophobicContact CB-CB 4.22Å; D1013-L1016 HydrophobicContact CB-CD1 4.02Å; D1013-L1016 HydrophobicContact CB-CG 3.97Å; D1013-L1016 PolarHBondContact O-N 3.03Å; L1016-D1020 PolarHBondContact O-N 2.91Å; L1016-D1020 VanDerWaalsContact O-N 3.16Å
1017	I	83.9	Confident	81.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-51.5	170.2	-68.2	176.7	0	0	0	110.1	F370 F371 A1000 L1003 H1009 A1012 D1013 P1014 N1015 E1019 D1020 L1021	F370-I1017 HydrophobicContact CD1-CG1 3.92Å; F370-I1017 HydrophobicContact CE1-CD1 4.32Å; F370-I1017 HydrophobicContact CE1-CG1 3.94Å; F371-I1017 HydrophobicContact CE2-CB 4.02Å; F371-I1017 HydrophobicContact CE2-CG1 3.88Å; F371-I1017 HydrophobicContact CE2-CG2 3.68Å; F371-I1017 HydrophobicContact CZ-CB 4.39Å; F371-I1017 HydrophobicContact CZ-CD1 4.45Å; F371-I1017 HydrophobicContact CZ-CG1 4.03Å; F371-I1017 HydrophobicContact CZ-CG2 3.8Å; A1000-I1017 HydrophobicContact CB-CB 4.01Å; A1000-I1017 HydrophobicContact CB-CG2 3.54Å; L1003-I1017 HydrophobicContact CB-CD1 4.12Å; L1003-I1017 HydrophobicContact CD1-CG2 3.96Å; H1009-I1017 HydrophobicContact CB-CD1 4.42Å; A1012-I1017 HydrophobicContact CB-CD1 3.46Å; A1012-I1017 VanDerWaalsContact CB-CD1 3.46Å; A1012-I1017 HydrophobicContact CB-CG1 3.89Å; D1013-I1017 PolarHBondContact O-N 3.06Å; D1013-I1017 VanDerWaalsContact O-N 3.08Å; P1014-I1017 PolarHBondContact O-N 3.46Å; N1015-I1017 VanDerWaalsContact C-N 3.33Å; I1017-E1019 VanDerWaalsContact C-N 3.34Å; I1017-E1019 PolarHBondContact O-N 3.09Å; I1017-D1020 PolarHBondContact O-N 2.97Å; I1017-L1021 HydrophobicContact CG2-CD1 3.61Å; I1017-L1021 HydrophobicContact CG2-CG 4.07Å; I1017-L1021 WeakPolarHBondContact O-CB 3.19Å; I1017-L1021 VanDerWaalsContact O-CG 3.32Å; I1017-L1021 WeakPolarHBondContact O-CG 3.28Å; I1017-L1021 PolarHBondContact O-N 3.43Å
1018	Y	87.2	Confident	81.7	Confident	34 Å²	34	49.9 Å²	49.9	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-42.8	177.8	171	-98.1	0	0	0	112.5	L996 R997 P1014 N1015 L1021 R1022	L996-Y1018 HydrophobicContact CB-CD2 3.82Å; L996-Y1018 HydrophobicContact CB-CE2 3.88Å; R997-Y1018 HydrophobicContact CB-CD2 4.46Å; R997-Y1018 HydrophobicContact CG-CD2 3.52Å; R997-Y1018 HydrophobicContact CG-CE2 3.54Å; R997-Y1018 HydrophobicContact CG-CG 4.34Å; P1014-Y1018 WeakPolarHBondContact O-CB 3.32Å; P1014-Y1018 PolarHBondContact O-N 3.04Å; N1015-Y1018 PolarHBondContact O-N 3.43Å; Y1018-L1021 PolarHBondContact O-N 3.19Å; Y1018-R1022 WeakPolarHBondContact O-CB 3.09Å; Y1018-R1022 PolarHBondContact O-N 3.43Å
1019	E	83.5	Confident	82.2	Confident	99 Å²	99	46 Å²	46	46%	0.463	25%	0.25	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.7	-77.3	-163.3	160.5	0	0	113.4	N1015 I1017 A1023	N1015-E1019 WeakPolarHBondContact O-CG 3.45Å; N1015-E1019 PolarHBondContact O-N 2.87Å; I1017-E1019 VanDerWaalsContact C-N 3.34Å; I1017-E1019 PolarHBondContact O-N 3.09Å; E1019-A1023 PolarHBondContact O-N 3.24Å
1020	D	83.6	Confident	83.1	Confident	17 Å²	17	45.1 Å²	45.1	9%	0.091	25%	0.246	C	C	.	.	H	α-helix	trans	-68.8	-43.2	177.1	-92.4	26.4	0	0	0	111.3	N368 F370 F371 L1016 I1017 R1022 A1023 M1024	N368-D1020 VanDerWaalsContact CB-OD1 3.23Å; N368-D1020 WeakPolarHBondContact CB-OD1 3.45Å; N368-D1020 PolarHBondContact ND2-OD1 3.41Å; F370-D1020 WeakPolarHBondContact CA-OD2 3.3Å; F370-D1020 VanDerWaalsContact CB-OD2 3.29Å; F370-D1020 WeakPolarHBondContact CB-OD2 3.33Å; F370-D1020 PolarHBondContact N-OD2 3.05Å; F371-D1020 HydrophobicContact CD2-CB 3.7Å; F371-D1020 HydrophobicContact CE2-CB 4.41Å; F371-D1020 PolarHBondContact N-OD2 3.17Å; L1016-D1020 PolarHBondContact O-N 2.91Å; L1016-D1020 VanDerWaalsContact O-N 3.16Å; I1017-D1020 PolarHBondContact O-N 2.97Å; D1020-R1022 PolarHBondContact O-N 2.88Å; D1020-A1023 WeakPolarHBondContact O-CB 3.3Å; D1020-A1023 PolarHBondContact O-N 3.21Å; D1020-A1023 VanDerWaalsContact O-N 3.11Å; D1020-M1024 WeakPolarHBondContact O-CG 3.48Å; D1020-M1024 PolarHBondContact O-N 3.03Å
1021	L	85.5	Confident	83.6	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-44	176.9	-71.5	174.1	0	0	0	111.7	L996 I999 A1000 L1003 I1017 Y1018 A1023 M1024 L1032	L996-L1021 HydrophobicContact CD2-CB 4.25Å; I999-L1021 HydrophobicContact CB-CD1 4.39Å; I999-L1021 HydrophobicContact CG2-CD1 3.69Å; A1000-L1021 HydrophobicContact CB-CD1 4.35Å; L1003-L1021 HydrophobicContact CD1-CD1 4.34Å; I1017-L1021 HydrophobicContact CG2-CD1 3.61Å; I1017-L1021 HydrophobicContact CG2-CG 4.07Å; I1017-L1021 WeakPolarHBondContact O-CB 3.19Å; I1017-L1021 VanDerWaalsContact O-CG 3.32Å; I1017-L1021 WeakPolarHBondContact O-CG 3.28Å; I1017-L1021 PolarHBondContact O-N 3.43Å; Y1018-L1021 PolarHBondContact O-N 3.19Å; L1021-A1023 PolarHBondContact O-N 3.49Å; L1021-A1023 VanDerWaalsContact O-N 3.13Å; L1021-M1024 HydrophobicContact CD2-SD 4.41Å; L1021-M1024 WeakPolarHBondContact O-CB 3.48Å; L1021-M1024 PolarHBondContact O-N 3.49Å; L1021-L1032 HydrophobicContact CD2-CD1 3.6Å
1022	R	84.1	Confident	84	Confident	63 Å²	63	39.8 Å²	39.8	24%	0.238	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.9	177.2	-162.6	175.6	-167.4	-116.2	4	113.5	D993 L996 Y1018 D1020	D993-R1022 IonicContact OD1-CZ 3.39Å; D993-R1022 IonicContact OD1-NE 3.28Å; D993-R1022 PolarHBondContact OD1-NE 3.31Å; D993-R1022 IonicContact OD1-NH2 2.7Å; D993-R1022 IonicContact OD2-CZ 3.6Å; D993-R1022 IonicContact OD2-NE 2.78Å; D993-R1022 PolarHBondContact OD2-NE 2.84Å; D993-R1022 IonicContact OD2-NH2 3.56Å; D993-R1022 PolarHBondContact OD2-NH2 3.07Å; L996-R1022 HydrophobicContact CD1-CB 4.09Å; L996-R1022 HydrophobicContact CD1-CG 4.16Å; Y1018-R1022 WeakPolarHBondContact O-CB 3.09Å; Y1018-R1022 PolarHBondContact O-N 3.43Å; D1020-R1022 PolarHBondContact O-N 2.88Å
1023	A	81	Confident	84.3	Confident	81 Å²	81	39.4 Å²	39.4	67%	0.669	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.8	172.9	0	0	0	0	0	113.8	E1019 D1020 L1021	E1019-A1023 PolarHBondContact O-N 3.24Å; D1020-A1023 WeakPolarHBondContact O-CB 3.3Å; D1020-A1023 PolarHBondContact O-N 3.21Å; D1020-A1023 VanDerWaalsContact O-N 3.11Å; L1021-A1023 PolarHBondContact O-N 3.49Å; L1021-A1023 VanDerWaalsContact O-N 3.13Å
1024	M	79.6	Confident	84.4	Confident	29 Å²	29	40 Å²	40	14%	0.143	21%	0.207	C	C	.	.	S	Bend	trans	-94.5	158.8	177	-68	174.9	61.4	0	0	111.6	F371 S987 D1020 L1021 Q1028 I1029 L1032	F371-M1024 HydrophobicContact CB-SD 4.42Å; S987-M1024 WeakPolarHBondContact CB-O 3.44Å; D1020-M1024 WeakPolarHBondContact O-CG 3.48Å; D1020-M1024 PolarHBondContact O-N 3.03Å; L1021-M1024 HydrophobicContact CD2-SD 4.41Å; L1021-M1024 WeakPolarHBondContact O-CB 3.48Å; L1021-M1024 PolarHBondContact O-N 3.49Å; M1024-Q1028 HydrophobicContact CB-CB 4.32Å; M1024-Q1028 HydrophobicContact CE-CB 3.46Å; M1024-Q1028 VanDerWaalsContact CE-CB 3.46Å; M1024-I1029 HydrophobicContact CB-CD1 4.33Å; M1024-I1029 HydrophobicContact CB-CG1 3.88Å; M1024-L1032 HydrophobicContact CE-CD1 3.57Å; M1024-L1032 HydrophobicContact CE-CG 4.04Å; M1024-L1032 HydrophobicContact SD-CD1 3.93Å
1025	N	83.6	Confident	84.4	Confident	25 Å²	25	44 Å²	44	13%	0.134	23%	0.226	C	C	.	.			trans	-85.6	152.7	170.8	-45.5	-85.3	0	0	0	109.4	K978 L985 F986 H1027 Q1028 I1029	K978-N1025 PolarHBondContact NZ-OD1 3.12Å; L985-N1025 PolarHBondContact O-OD1 3.1Å; L985-N1025 VanDerWaalsContact O-OD1 3.13Å; F986-N1025 CarbonylContact O-C 3.6Å; F986-N1025 VanDerWaalsContact O-CA 3.24Å; F986-N1025 WeakPolarHBondContact O-CA 3.46Å; F986-N1025 WeakPolarHBondContact O-CB 3.49Å; N1025-H1027 VanDerWaalsContact C-N 3.28Å; N1025-H1027 PolarHBondContact O-N 3.27Å; N1025-H1027 VanDerWaalsContact O-N 3.16Å; N1025-Q1028 HydrophobicContact CB-CG 4.43Å; N1025-Q1028 VanDerWaalsContact N-OE1 3.16Å; N1025-Q1028 PolarHBondContact ND2-OE1 2.93Å; N1025-Q1028 WeakPolarHBondContact O-CA 3.49Å; N1025-Q1028 WeakPolarHBondContact O-CB 3.38Å; N1025-Q1028 PolarHBondContact O-N 3.29Å; N1025-I1029 PolarHBondContact O-N 2.65Å
1026	D	85.2	Confident	84.3	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-37.7	-171.1	-66.1	-4.6	0	0	0	113	A984 F986 G988 L989 A990 Y991 Q1028 I1029 H1030	A984-D1026 HydrophobicContact CB-CB 4.41Å; A984-D1026 PolarHBondContact O-N 3.39Å; F986-D1026 PolarHBondContact O-N 3.37Å; G988-D1026 PolarHBondContact N-OD1 3.18Å; L989-D1026 WeakPolarHBondContact CA-OD2 3.24Å; L989-D1026 WeakPolarHBondContact CB-OD2 3.38Å; L989-D1026 PolarHBondContact N-OD2 3.08Å; A990-D1026 HydrophobicContact CB-CB 4.4Å; A990-D1026 PolarHBondContact N-OD2 3.12Å; Y991-D1026 HydrophobicContact CD2-CB 4Å; Y991-D1026 HydrophobicContact CE2-CB 4.42Å; Y991-D1026 WeakPolarHBondContact CE2-O 3.36Å; D1026-Q1028 VanDerWaalsContact C-N 3.26Å; D1026-Q1028 PolarHBondContact O-N 2.94Å; D1026-I1029 PolarHBondContact O-N 3.01Å; D1026-I1029 VanDerWaalsContact O-N 3.15Å; D1026-H1030 PolarHBondContact O-N 3.14Å
1027	H	84.4	Confident	84.2	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.023	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-33.3	173.8	-177.6	-110.7	0	0	0	113.5	A984 N1025 K1031 D1084 I1085	A984-H1027 HydrophobicContact CB-CB 3.92Å; A984-H1027 WeakPolarHBondContact O-CB 3.42Å; A984-H1027 PolarHBondContact O-N 3.32Å; N1025-H1027 VanDerWaalsContact C-N 3.28Å; N1025-H1027 PolarHBondContact O-N 3.27Å; N1025-H1027 VanDerWaalsContact O-N 3.16Å; H1027-K1031 WeakPolarHBondContact O-CB 3.25Å; H1027-K1031 PolarHBondContact O-N 2.7Å; H1027-D1084 PolarHBondContact CE1-O 3.15Å; H1027-I1085 HydrophobicContact CB-CD1 4.22Å; H1027-I1085 HydrophobicContact CB-CG1 4.02Å; H1027-I1085 VanDerWaalsContact CG-CG1 3.46Å
1028	Q	85.5	Confident	84.1	Confident	70 Å²	70	49 Å²	49	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-75.5	-30.8	177.8	-53.2	-177.7	-95.9	0	0	111.9	M1024 N1025 D1026 K1031 L1032	M1024-Q1028 HydrophobicContact CB-CB 4.32Å; M1024-Q1028 HydrophobicContact CE-CB 3.46Å; M1024-Q1028 VanDerWaalsContact CE-CB 3.46Å; N1025-Q1028 HydrophobicContact CB-CG 4.43Å; N1025-Q1028 VanDerWaalsContact N-OE1 3.16Å; N1025-Q1028 PolarHBondContact ND2-OE1 2.93Å; N1025-Q1028 WeakPolarHBondContact O-CA 3.49Å; N1025-Q1028 WeakPolarHBondContact O-CB 3.38Å; N1025-Q1028 PolarHBondContact O-N 3.29Å; D1026-Q1028 VanDerWaalsContact C-N 3.26Å; D1026-Q1028 PolarHBondContact O-N 2.94Å; Q1028-K1031 PolarHBondContact O-N 3.18Å; Q1028-L1032 PolarHBondContact O-N 3.37Å; Q1028-L1032 VanDerWaalsContact O-N 3.1Å
1029	I	85.8	Confident	83.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-71.4	-45.2	174.7	-57.6	170.8	0	0	0	108.7	Y991 L996 I999 M1024 N1025 D1026 K1031 L1032 C1033	Y991-I1029 HydrophobicContact CD1-CG2 3.86Å; Y991-I1029 HydrophobicContact CD2-CB 3.81Å; Y991-I1029 HydrophobicContact CD2-CD1 4.25Å; Y991-I1029 HydrophobicContact CD2-CG2 3.76Å; Y991-I1029 HydrophobicContact CE1-CG2 3.93Å; Y991-I1029 HydrophobicContact CE2-CB 3.85Å; Y991-I1029 HydrophobicContact CE2-CG2 3.83Å; Y991-I1029 HydrophobicContact CG-CB 4.3Å; Y991-I1029 HydrophobicContact CG-CD1 4.41Å; Y991-I1029 HydrophobicContact CG-CG2 3.78Å; L996-I1029 HydrophobicContact CD2-CD1 3.77Å; I999-I1029 HydrophobicContact CD1-CG2 4.34Å; M1024-I1029 HydrophobicContact CB-CD1 4.33Å; M1024-I1029 HydrophobicContact CB-CG1 3.88Å; N1025-I1029 PolarHBondContact O-N 2.65Å; D1026-I1029 PolarHBondContact O-N 3.01Å; D1026-I1029 VanDerWaalsContact O-N 3.15Å; I1029-K1031 VanDerWaalsContact C-N 3.26Å; I1029-K1031 PolarHBondContact O-N 3.36Å; I1029-L1032 CarbonylContact O-C 3.58Å; I1029-L1032 WeakPolarHBondContact O-CA 3.44Å; I1029-L1032 WeakPolarHBondContact O-CB 3.46Å; I1029-L1032 PolarHBondContact O-N 3.15Å; I1029-C1033 PolarHBondContact O-N 2.91Å; I1029-C1033 PolarHBondContact O-SG 3.17Å
1030	H	86.4	Confident	83.8	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.028	24%	0.239	C	C	.	.	H	α-helix	trans	-52.6	-43.5	170.4	177.5	45	0	0	0	112.5	Y991 D1026 L1032 C1033 Q1034 L1044	Y991-H1030 HydrophobicContact CE2-CB 4.29Å; Y991-H1030 WeakPolarHBondContact OH-CA 3.49Å; D1026-H1030 PolarHBondContact O-N 3.14Å; H1030-L1032 VanDerWaalsContact C-N 3.34Å; H1030-L1032 PolarHBondContact O-N 1.84Å; H1030-C1033 CarbonylContact O-C 3.57Å; H1030-C1033 WeakPolarHBondContact O-CA 3.28Å; H1030-C1033 WeakPolarHBondContact O-CB 3.41Å; H1030-C1033 PolarHBondContact O-N 3.32Å; H1030-C1033 VanDerWaalsContact O-N 3.08Å; H1030-Q1034 PolarHBondContact O-N 3.44Å; H1030-L1044 HydrophobicContact CB-CD1 4.05Å; H1030-L1044 HydrophobicContact CB-CG 4.09Å; H1030-L1044 PolarHBondContact ND1-N 3.05Å
1031	K	85.1	Confident	83.8	Confident	76 Å²	76	49.9 Å²	49.9	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-67.7	-27.5	175.6	-168.2	162	-172.1	159.2	0	113.8	H1027 Q1028 I1029 L1035	H1027-K1031 WeakPolarHBondContact O-CB 3.25Å; H1027-K1031 PolarHBondContact O-N 2.7Å; Q1028-K1031 PolarHBondContact O-N 3.18Å; I1029-K1031 VanDerWaalsContact C-N 3.26Å; I1029-K1031 PolarHBondContact O-N 3.36Å; K1031-L1035 WeakPolarHBondContact O-CD1 3.39Å; K1031-L1035 VanDerWaalsContact O-CG 3.23Å; K1031-L1035 WeakPolarHBondContact O-CG 3.33Å; K1031-L1035 PolarHBondContact O-N 2.82Å
1032	L	84.7	Confident	83.7	Confident	22 Å²	22	52.9 Å²	52.9	12%	0.115	28%	0.279	C	S	.	.	H	α-helix	trans	-70.2	-41.4	166.3	-70.1	175.8	0	0	0	110.9	F371 L1021 M1024 Q1028 I1029 H1030 Q1034 L1035 Y1036	F371-L1032 HydrophobicContact CD1-CD1 4.03Å; F371-L1032 HydrophobicContact CD1-CD2 4.21Å; F371-L1032 HydrophobicContact CE1-CD1 4.38Å; L1021-L1032 HydrophobicContact CD2-CD1 3.6Å; M1024-L1032 HydrophobicContact CE-CD1 3.57Å; M1024-L1032 HydrophobicContact CE-CG 4.04Å; M1024-L1032 HydrophobicContact SD-CD1 3.93Å; Q1028-L1032 PolarHBondContact O-N 3.37Å; Q1028-L1032 VanDerWaalsContact O-N 3.1Å; I1029-L1032 CarbonylContact O-C 3.58Å; I1029-L1032 WeakPolarHBondContact O-CA 3.44Å; I1029-L1032 WeakPolarHBondContact O-CB 3.46Å; I1029-L1032 PolarHBondContact O-N 3.15Å; H1030-L1032 VanDerWaalsContact C-N 3.34Å; H1030-L1032 PolarHBondContact O-N 1.84Å; L1032-Q1034 PolarHBondContact O-N 3.27Å; L1032-L1035 PolarHBondContact O-N 3.09Å; L1032-Y1036 HydrophobicContact CD2-CE2 4.16Å; L1032-Y1036 WeakPolarHBondContact O-CD2 3.37Å; L1032-Y1036 PolarHBondContact O-N 3.18Å
1033	C	85.7	Confident	83.6	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-29.9	177	-59.9	0	0	0	0	113.3	I1029 H1030 L1039 T1043	I1029-C1033 PolarHBondContact O-N 2.91Å; I1029-C1033 PolarHBondContact O-SG 3.17Å; H1030-C1033 CarbonylContact O-C 3.57Å; H1030-C1033 WeakPolarHBondContact O-CA 3.28Å; H1030-C1033 WeakPolarHBondContact O-CB 3.41Å; H1030-C1033 PolarHBondContact O-N 3.32Å; H1030-C1033 VanDerWaalsContact O-N 3.08Å; C1033-L1039 HydrophobicContact CB-CB 4.12Å; C1033-T1043 HydrophobicContact CB-CG2 3.68Å
1034	Q	84.4	Confident	83.7	Confident	84 Å²	84	50.2 Å²	50.2	39%	0.393	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.3	170.9	-70.8	-178	-32.8	0	0	114.1	H1030 L1032 T1043 E1088	H1030-Q1034 PolarHBondContact O-N 3.44Å; L1032-Q1034 PolarHBondContact O-N 3.27Å; Q1034-T1043 HydrophobicContact CG-CG2 4.21Å; Q1034-E1088 PolarHBondContact NE2-OE1 3.21Å
1035	L	84.4	Confident	83.8	Confident	119 Å²	119	51.9 Å²	51.9	62%	0.623	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-21.1	-175.2	-78.2	169.4	0	0	0	113.9	K1031 L1032	K1031-L1035 WeakPolarHBondContact O-CD1 3.39Å; K1031-L1035 VanDerWaalsContact O-CG 3.23Å; K1031-L1035 WeakPolarHBondContact O-CG 3.33Å; K1031-L1035 PolarHBondContact O-N 2.82Å; L1032-L1035 PolarHBondContact O-N 3.09Å
1036	Y	83.6	Confident	83.7	Confident	49 Å²	49	54.2 Å²	54.2	19%	0.192	29%	0.291	C	S	.	.			trans	-121.3	118.2	-179.2	-62.7	-76.3	0	0	0	109.8	L1003 H1009 L1032 V1038 L1039 S1040	L1003-Y1036 HydrophobicContact CD2-CD2 4.02Å; L1003-Y1036 HydrophobicContact CD2-CE2 4.48Å; L1003-Y1036 HydrophobicContact CD2-CG 4.15Å; H1009-Y1036 AromaticContact CE1-CE1 3.63Å; H1009-Y1036 AromaticContact CE1-CZ 3.53Å; L1032-Y1036 HydrophobicContact CD2-CE2 4.16Å; L1032-Y1036 WeakPolarHBondContact O-CD2 3.37Å; L1032-Y1036 PolarHBondContact O-N 3.18Å; Y1036-V1038 PolarHBondContact O-N 2.84Å; Y1036-L1039 WeakPolarHBondContact O-CA 3.15Å; Y1036-L1039 WeakPolarHBondContact O-CB 3.12Å; Y1036-L1039 PolarHBondContact O-N 3.39Å; Y1036-S1040 PolarHBondContact O-N 3.05Å
1037	E	80.4	Confident	83.7	Confident	177 Å²	177	61.3 Å²	61.3	83%	0.827	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-56.5	-37	-177.6	-172.5	174.1	-170	0	0	112.5	L1039 S1040	E1037-L1039 PolarHBondContact O-N 2.99Å; E1037-L1039 VanDerWaalsContact O-N 3.16Å; E1037-S1040 VanDerWaalsContact O-CB 3.27Å; E1037-S1040 WeakPolarHBondContact O-CB 3.48Å; E1037-S1040 PolarHBondContact O-N 2.81Å; E1037-S1040 PolarHBondContact O-OG 3.43Å
1038	V	83.2	Confident	83.6	Confident	67 Å²	67	63.2 Å²	63.2	41%	0.406	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-57.2	-27.2	173.7	-169.6	0	0	0	0	112.7	Y1036	Y1036-V1038 PolarHBondContact O-N 2.84Å
1039	L	83.4	Confident	83.6	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-97.3	1.9	178.9	-64.6	-171.2	0	0	0	114.5	I999 L1003 C1033 Y1036 E1037 P1041 Y1042	I999-L1039 HydrophobicContact CB-CD2 4.29Å; I999-L1039 HydrophobicContact CG1-CD2 4.32Å; I999-L1039 HydrophobicContact CG2-CD1 3.94Å; I999-L1039 HydrophobicContact CG2-CD2 3.85Å; L1003-L1039 HydrophobicContact CD1-CD1 3.99Å; L1003-L1039 HydrophobicContact CD2-CD1 3.81Å; L1003-L1039 HydrophobicContact CD2-CG 4.26Å; L1003-L1039 HydrophobicContact CG-CD1 3.79Å; L1003-L1039 HydrophobicContact CG-CD2 4.2Å; L1003-L1039 HydrophobicContact CG-CG 4.21Å; C1033-L1039 HydrophobicContact CB-CB 4.12Å; Y1036-L1039 WeakPolarHBondContact O-CA 3.15Å; Y1036-L1039 WeakPolarHBondContact O-CB 3.12Å; Y1036-L1039 PolarHBondContact O-N 3.39Å; E1037-L1039 PolarHBondContact O-N 2.99Å; E1037-L1039 VanDerWaalsContact O-N 3.16Å; L1039-P1041 VanDerWaalsContact C-N 3.28Å; L1039-Y1042 HydrophobicContact CD2-CD2 4Å; L1039-Y1042 HydrophobicContact CD2-CE2 4.28Å; L1039-Y1042 PolarHBondContact O-N 2.98Å
1040	S	80.3	Confident	83.7	Confident	64 Å²	64	61.5 Å²	61.5	45%	0.448	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-52.6	-33.5	176.7	59.1	0	0	0	0	114.7	Y1036 E1037 Y1042 T1043	Y1036-S1040 PolarHBondContact O-N 3.05Å; E1037-S1040 VanDerWaalsContact O-CB 3.27Å; E1037-S1040 WeakPolarHBondContact O-CB 3.48Å; E1037-S1040 PolarHBondContact O-N 2.81Å; E1037-S1040 PolarHBondContact O-OG 3.43Å; S1040-Y1042 PolarHBondContact O-N 3.21Å; S1040-Y1042 VanDerWaalsContact O-N 3.16Å; S1040-T1043 PolarHBondContact O-N 2.83Å; S1040-T1043 PolarHBondContact O-OG1 2.64Å
1041	P	83.6	Confident	83.7	Confident	106 Å²	106	64.3 Å²	64.3	69%	0.688	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.8	175.9	-21.4	35.2	0	0	0	114.2	L1039	L1039-P1041 VanDerWaalsContact C-N 3.28Å
1042	Y	82.9	Confident	83.7	Confident	64 Å²	64	60.9 Å²	60.9	25%	0.251	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-99	8	-179.4	-55.2	-80.1	0	0	0	112.9	Y991 D998 I999 L1039 S1040	Y991-Y1042 VanDerWaalsContact CE1-O 3.26Å; Y991-Y1042 WeakPolarHBondContact CE1-O 3.38Å; Y991-Y1042 PolarHBondContact OH-O 3.18Å; D998-Y1042 HydrophobicContact CB-CE1 4.21Å; D998-Y1042 WeakPolarHBondContact CB-OH 3.21Å; I999-Y1042 HydrophobicContact CD1-CD1 4.09Å; I999-Y1042 HydrophobicContact CD1-CG 3.96Å; I999-Y1042 HydrophobicContact CG1-CD1 3.79Å; I999-Y1042 HydrophobicContact CG1-CD2 3.72Å; I999-Y1042 HydrophobicContact CG1-CE1 4.11Å; I999-Y1042 HydrophobicContact CG1-CE2 4.04Å; I999-Y1042 HydrophobicContact CG1-CG 3.58Å; L1039-Y1042 HydrophobicContact CD2-CD2 4Å; L1039-Y1042 HydrophobicContact CD2-CE2 4.28Å; L1039-Y1042 PolarHBondContact O-N 2.98Å; S1040-Y1042 PolarHBondContact O-N 3.21Å; S1040-Y1042 VanDerWaalsContact O-N 3.16Å
1043	T	83.7	Confident	84.1	Confident	59 Å²	59	59.8 Å²	59.8	36%	0.362	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-70.2	136.6	173.2	55.5	0	0	0	0	111.3	C1033 Q1034 S1040	C1033-T1043 HydrophobicContact CB-CG2 3.68Å; Q1034-T1043 HydrophobicContact CG-CG2 4.21Å; S1040-T1043 PolarHBondContact O-N 2.83Å; S1040-T1043 PolarHBondContact O-OG1 2.64Å
1044	L	82.5	Confident	84.4	Confident	29 Å²	29	60 Å²	60	15%	0.152	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-66.2	146.7	172.6	-53.2	-177	0	0	0	110.5	A990 Y991 H1030	A990-L1044 HydrophobicContact CB-CD1 4.21Å; A990-L1044 HydrophobicContact CB-CD2 3.75Å; Y991-L1044 HydrophobicContact CE2-CD1 4.24Å; Y991-L1044 HydrophobicContact CE2-CD2 3.9Å; Y991-L1044 HydrophobicContact CE2-CG 4.12Å; H1030-L1044 HydrophobicContact CB-CD1 4.05Å; H1030-L1044 HydrophobicContact CB-CG 4.09Å; H1030-L1044 PolarHBondContact ND1-N 3.05Å
1045	S	81.7	Confident	84.9	Confident	64 Å²	64	56 Å²	56	45%	0.448	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-67	146.7	173	64.8	0	0	0	0	110.9	E1047 S1048	S1045-E1047 PolarHBondContact O-N 3.25Å; S1045-S1048 VanDerWaalsContact O-CB 3.25Å; S1045-S1048 WeakPolarHBondContact O-CB 3.12Å; S1045-S1048 PolarHBondContact O-N 2.65Å; S1045-S1048 PolarHBondContact OG-N 2.67Å
1046	P	81.6	Confident	85.3	Confident	73 Å²	73	50.3 Å²	50.3	47%	0.474	29%	0.285	S	S	.	.	H	α-helix	trans	-52	-39.1	175.4	-30.9	37.7	0	0	0	113.5	S1048 I1049 I1050 I1092	P1046-S1048 VanDerWaalsContact C-N 3.29Å; P1046-S1048 PolarHBondContact O-N 3.36Å; P1046-I1049 PolarHBondContact O-N 3.09Å; P1046-I1049 VanDerWaalsContact O-N 3.15Å; P1046-I1050 PolarHBondContact O-N 3.18Å; P1046-I1092 HydrophobicContact CB-CD1 3.81Å; P1046-I1092 HydrophobicContact CB-CG1 3.94Å; P1046-I1092 HydrophobicContact CB-CG2 3.79Å
1047	E	84.6	Confident	85.8	Confident	150 Å²	150	52.3 Å²	52.3	70%	0.701	30%	0.296	S	S	*	.	H	α-helix	trans	-63.3	-30.5	177.8	-60.9	178.9	169.9	0	0	113.2	S1045 I1049 I1050 S1051	S1045-E1047 PolarHBondContact O-N 3.25Å; E1047-I1049 VanDerWaalsContact C-N 3.28Å; E1047-I1049 PolarHBondContact O-N 3.14Å; E1047-I1050 PolarHBondContact O-N 2.92Å; E1047-S1051 WeakPolarHBondContact O-CB 3.45Å; E1047-S1051 PolarHBondContact O-N 3.45Å; E1047-S1051 PolarHBondContact O-OG 3.01Å
1048	S	83.5	Confident	86.5	Confident	46 Å²	46	46.2 Å²	46.2	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-65.9	-31.7	175.8	-172.5	0	0	0	0	111.9	S1045 P1046 G1052	S1045-S1048 VanDerWaalsContact O-CB 3.25Å; S1045-S1048 WeakPolarHBondContact O-CB 3.12Å; S1045-S1048 PolarHBondContact O-N 2.65Å; S1045-S1048 PolarHBondContact OG-N 2.67Å; P1046-S1048 VanDerWaalsContact C-N 3.29Å; P1046-S1048 PolarHBondContact O-N 3.36Å; S1048-G1052 WeakPolarHBondContact O-CA 3.45Å; S1048-G1052 PolarHBondContact O-N 3.06Å
1049	I	85	Confident	87	Confident	2 Å²	2	43 Å²	43	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-73.3	-40	175.9	-55.8	-177.9	0	0	0	110.6	H982 P1046 E1047 G1052 I1085 E1088 I1092	H982-I1049 WeakPolarHBondContact NE2-CA 3.38Å; H982-I1049 PolarHBondContact NE2-O 2.92Å; P1046-I1049 PolarHBondContact O-N 3.09Å; P1046-I1049 VanDerWaalsContact O-N 3.15Å; E1047-I1049 VanDerWaalsContact C-N 3.28Å; E1047-I1049 PolarHBondContact O-N 3.14Å; I1049-G1052 PolarHBondContact O-N 2.86Å; I1049-I1085 HydrophobicContact CG2-CG2 3.99Å; I1049-E1088 HydrophobicContact CD1-CB 4.41Å; I1049-E1088 HydrophobicContact CD1-CG 3.92Å; I1049-I1092 HydrophobicContact CB-CD1 4.38Å; I1049-I1092 HydrophobicContact CD1-CD1 4.03Å
1050	I	86.8	Confident	87.5	Confident	33 Å²	33	45.5 Å²	45.5	17%	0.169	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-51.8	179.3	-58.6	176.8	0	0	0	111.1	P1046 E1047 G1052 N1060 F1089 I1092	P1046-I1050 PolarHBondContact O-N 3.18Å; E1047-I1050 PolarHBondContact O-N 2.92Å; I1050-G1052 PolarHBondContact O-N 3.38Å; I1050-N1060 HydrophobicContact CG2-CB 4.13Å; I1050-F1089 HydrophobicContact CG1-CD2 4.13Å; I1050-F1089 HydrophobicContact CG1-CE2 4.46Å; I1050-I1092 HydrophobicContact CD1-CG2 3.98Å
1051	S	87.1	Confident	88.1	Confident	66 Å²	66	46 Å²	46	46%	0.462	26%	0.257	S	S	.	.	H	α-helix	trans	-69.6	-10.7	176.7	61.2	0	0	0	0	113.9	T895 E1047 S1053	T895-S1051 PolarHBondContact OG1-O 3.33Å; E1047-S1051 WeakPolarHBondContact O-CB 3.45Å; E1047-S1051 PolarHBondContact O-N 3.45Å; E1047-S1051 PolarHBondContact O-OG 3.01Å; S1051-S1053 PolarHBondContact O-N 3.23Å
1052	G	85.7	Confident	88.5	Confident	3 Å²	3	42.5 Å²	42.5	3%	0.031	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.2	178.9	0	0	0	0	0	115.4	Q983 S1048 I1049 I1050	Q983-G1052 WeakPolarHBondContact CB-O 3.16Å; Q983-G1052 VanDerWaalsContact CG-O 3.28Å; Q983-G1052 WeakPolarHBondContact CG-O 3.25Å; Q983-G1052 PolarHBondContact N-O 2.74Å; Q983-G1052 VanDerWaalsContact N-O 3.12Å; Q983-G1052 VanDerWaalsContact NE2-C 3.32Å; Q983-G1052 PolarHBondContact NE2-O 3.1Å; S1048-G1052 WeakPolarHBondContact O-CA 3.45Å; S1048-G1052 PolarHBondContact O-N 3.06Å; I1049-G1052 PolarHBondContact O-N 2.86Å; I1050-G1052 PolarHBondContact O-N 3.38Å
1053	S	91.4	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.			trans	-156.6	140.8	177.2	179.4	0	0	0	0	113.3	N981 H982 S1051 K1055 I1056 Q1057	N981-S1053 VanDerWaalsContact O-CB 3.25Å; N981-S1053 WeakPolarHBondContact O-CB 3.06Å; N981-S1053 PolarHBondContact O-OG 3.49Å; H982-S1053 VanDerWaalsContact CD2-CB 3.44Å; H982-S1053 WeakPolarHBondContact CD2-CB 3.22Å; S1051-S1053 PolarHBondContact O-N 3.23Å; S1053-K1055 PolarHBondContact O-N 2.92Å; S1053-K1055 PolarHBondContact OG-N 3.23Å; S1053-K1055 VanDerWaalsContact OG-N 3.1Å; S1053-I1056 PolarHBondContact O-N 2.85Å; S1053-Q1057 PolarHBondContact O-N 2.68Å
1054	G	92.4	Very high	89.4	Confident	4 Å²	4	39.4 Å²	39.4	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-59.6	-32.6	170	0	0	0	0	0	112.9	V892 T893 Q898 Q1057 W1058	V892-G1054 VanDerWaalsContact CG1-C 3.41Å; V892-G1054 WeakPolarHBondContact CG1-O 3.16Å; T893-G1054 WeakPolarHBondContact O-CA 3.45Å; Q898-G1054 VanDerWaalsContact OE1-N 3.07Å; G1054-Q1057 PolarHBondContact O-N 3.44Å; G1054-W1058 WeakPolarHBondContact O-CB 3.44Å; G1054-W1058 PolarHBondContact O-N 3.11Å
1055	K	94.6	Very high	90	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.2	-36.9	177.3	-63.4	-171.4	-178.5	-173.5	0	112.6	V892 N981 S1053 L1059 H1146 L1176 S1178 E1183	V892-K1055 HydrophobicContact CG1-CG 4.31Å; N981-K1055 PolarHBondContact OD1-NZ 3.24Å; S1053-K1055 PolarHBondContact O-N 2.92Å; S1053-K1055 PolarHBondContact OG-N 3.23Å; S1053-K1055 VanDerWaalsContact OG-N 3.1Å; K1055-L1059 WeakPolarHBondContact O-CG 3.47Å; K1055-L1059 PolarHBondContact O-N 3.37Å; K1055-L1059 VanDerWaalsContact O-N 3.08Å; K1055-H1146 PolarHBondContact NZ-O 2.91Å; K1055-L1176 HydrophobicContact CB-CD1 4.47Å; K1055-L1176 HydrophobicContact CD-CB 4.25Å; K1055-L1176 HydrophobicContact CG-CB 4.49Å; K1055-L1176 PolarHBondContact NZ-O 3.02Å; K1055-S1178 WeakPolarHBondContact CE-OG 3.33Å; K1055-E1183 VanDerWaalsContact CE-OE2 3.3Å; K1055-E1183 WeakPolarHBondContact CE-OE2 3.47Å; K1055-E1183 IonicContact NZ-OE1 3.83Å; K1055-E1183 PolarHBondContact NZ-OE1 2.86Å; K1055-E1183 IonicContact NZ-OE2 3.62Å; K1055-E1183 PolarHBondContact NZ-OE2 3.18Å
1056	I	94.1	Very high	90.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-74	-37.2	174.6	-61.9	-167.5	0	0	0	110.6	H982 S1053 L1059 N1060 M1082 I1085 F1089	H982-I1056 WeakPolarHBondContact CD2-CD1 3.35Å; H982-I1056 WeakPolarHBondContact NE2-CD1 3.49Å; S1053-I1056 PolarHBondContact O-N 2.85Å; I1056-L1059 WeakPolarHBondContact O-CB 3.23Å; I1056-L1059 PolarHBondContact O-N 3.22Å; I1056-N1060 WeakPolarHBondContact O-CB 3.01Å; I1056-N1060 PolarHBondContact O-N 3.01Å; I1056-M1082 HydrophobicContact CD1-CE 3.78Å; I1056-M1082 HydrophobicContact CG1-CE 4.04Å; I1056-I1085 HydrophobicContact CD1-CG2 3.65Å; I1056-F1089 HydrophobicContact CG2-CB 4.43Å; I1056-F1089 HydrophobicContact CG2-CD1 4.48Å; I1056-F1089 HydrophobicContact CG2-CD2 3.56Å; I1056-F1089 HydrophobicContact CG2-CE2 3.88Å; I1056-F1089 HydrophobicContact CG2-CG 3.89Å; I1056-F1089 HydrophobicContact CG2-CZ 4.47Å
1057	Q	92.9	Very high	91	Very high	91 Å²	91	39 Å²	39	43%	0.425	21%	0.205	S	C	.	.	H	α-helix	trans	-60.3	-45.8	171.9	-172.9	175.3	-10.6	0	0	111.5	S1053 G1054 L1059 N1060 D1061	S1053-Q1057 PolarHBondContact O-N 2.68Å; G1054-Q1057 PolarHBondContact O-N 3.44Å; Q1057-L1059 VanDerWaalsContact C-N 3.3Å; Q1057-L1059 PolarHBondContact O-N 2.85Å; Q1057-N1060 WeakPolarHBondContact O-CB 3.49Å; Q1057-N1060 PolarHBondContact O-N 3.41Å; Q1057-N1060 VanDerWaalsContact O-N 3.12Å; Q1057-D1061 PolarHBondContact O-N 3.39Å
1058	W	94.9	Very high	91.3	Very high	49 Å²	49	36.6 Å²	36.6	19%	0.186	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-38.8	174.5	-175.6	94.3	0	0	0	112.7	V890 V892 G1054 D1061 N1062 I1144 I1174 L1176	V890-W1058 HydrophobicContact CG1-CZ2 4.33Å; V890-W1058 HydrophobicContact CG2-CZ2 4.32Å; V892-W1058 HydrophobicContact CG1-CB 4.41Å; V892-W1058 HydrophobicContact CG2-CG 4.44Å; G1054-W1058 WeakPolarHBondContact O-CB 3.44Å; G1054-W1058 PolarHBondContact O-N 3.11Å; W1058-D1061 PolarHBondContact O-N 2.9Å; W1058-N1062 HydrophobicContact CH2-CB 4.16Å; W1058-N1062 HydrophobicContact CZ2-CB 4.11Å; W1058-N1062 HydrophobicContact CZ3-CB 4.42Å; W1058-N1062 PolarHBondContact NE1-ND2 3.41Å; W1058-N1062 WeakPolarHBondContact O-CB 3.46Å; W1058-N1062 PolarHBondContact O-N 3Å; W1058-N1062 PolarHBondContact O-ND2 3.39Å; W1058-I1144 HydrophobicContact CZ3-CD1 4.34Å; W1058-I1174 HydrophobicContact CH2-CD1 4.04Å; W1058-I1174 HydrophobicContact CH2-CG2 3.91Å; W1058-I1174 HydrophobicContact CZ2-CG2 4.28Å; W1058-L1176 HydrophobicContact CD2-CD2 3.87Å; W1058-L1176 HydrophobicContact CE3-CD1 3.91Å; W1058-L1176 HydrophobicContact CE3-CD2 3.61Å; W1058-L1176 HydrophobicContact CE3-CG 4.41Å; W1058-L1176 HydrophobicContact CH2-CD2 4.14Å; W1058-L1176 HydrophobicContact CZ2-CD2 4.34Å; W1058-L1176 HydrophobicContact CZ3-CD1 4.27Å; W1058-L1176 HydrophobicContact CZ3-CD2 3.77Å
1059	L	94.6	Very high	91.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-43.4	173.2	-76.1	170.4	0	0	0	111.8	K1055 I1056 Q1057 D1061 N1062 L1063 I1075 L1086 F1089 I1144 L1176	K1055-L1059 WeakPolarHBondContact O-CG 3.47Å; K1055-L1059 PolarHBondContact O-N 3.37Å; K1055-L1059 VanDerWaalsContact O-N 3.08Å; I1056-L1059 WeakPolarHBondContact O-CB 3.23Å; I1056-L1059 PolarHBondContact O-N 3.22Å; Q1057-L1059 VanDerWaalsContact C-N 3.3Å; Q1057-L1059 PolarHBondContact O-N 2.85Å; L1059-D1061 PolarHBondContact O-N 3.07Å; L1059-N1062 PolarHBondContact O-N 3.17Å; L1059-L1063 WeakPolarHBondContact O-CB 3.3Å; L1059-L1063 PolarHBondContact O-N 3.06Å; L1059-I1075 HydrophobicContact CD2-CD1 4.45Å; L1059-L1086 HydrophobicContact CD1-CD2 3.74Å; L1059-F1089 HydrophobicContact CB-CE1 3.95Å; L1059-F1089 HydrophobicContact CB-CZ 4.06Å; L1059-I1144 HydrophobicContact CD2-CD1 3.84Å; L1059-I1144 HydrophobicContact CD2-CG2 4.48Å; L1059-L1176 HydrophobicContact CG-CD1 4.41Å
1060	N	93.1	Very high	91.9	Very high	52 Å²	52	42.8 Å²	42.8	28%	0.278	24%	0.244	S	C	.	.	H	α-helix	trans	-56.1	-39.5	175.9	-178.9	85.3	0	0	0	111.9	I1050 I1056 Q1057 P1064 F1089	I1050-N1060 HydrophobicContact CG2-CB 4.13Å; I1056-N1060 WeakPolarHBondContact O-CB 3.01Å; I1056-N1060 PolarHBondContact O-N 3.01Å; Q1057-N1060 WeakPolarHBondContact O-CB 3.49Å; Q1057-N1060 PolarHBondContact O-N 3.41Å; Q1057-N1060 VanDerWaalsContact O-N 3.12Å; N1060-P1064 WeakPolarHBondContact O-CD 3.39Å; N1060-P1064 VanDerWaalsContact O-CG 3.23Å; N1060-P1064 WeakPolarHBondContact O-CG 3.47Å; N1060-F1089 HydrophobicContact CB-CE2 4.01Å; N1060-F1089 HydrophobicContact CB-CZ 4.21Å
1061	D	92.5	Very high	92.2	Very high	74 Å²	74	43.7 Å²	43.7	40%	0.396	25%	0.247	S	C	.	.	H	α-helix	trans	-86.5	-16.5	-172.6	-59.8	-11.8	0	0	0	113.3	Q1057 W1058 L1059 K1065	Q1057-D1061 PolarHBondContact O-N 3.39Å; W1058-D1061 PolarHBondContact O-N 2.9Å; L1059-D1061 PolarHBondContact O-N 3.07Å; D1061-K1065 WeakPolarHBondContact O-CE 3.38Å; D1061-K1065 PolarHBondContact O-NZ 3.04Å
1062	N	93.9	Very high	92.5	Very high	34 Å²	34	43.9 Å²	43.9	18%	0.182	24%	0.238	C	C	.	.	H	α-helix	trans	-123.9	-29.7	-174.4	-61.4	-67	0	0	0	115	W1058 L1059 P1064 K1065 L1066	W1058-N1062 HydrophobicContact CH2-CB 4.16Å; W1058-N1062 HydrophobicContact CZ2-CB 4.11Å; W1058-N1062 HydrophobicContact CZ3-CB 4.42Å; W1058-N1062 PolarHBondContact NE1-ND2 3.41Å; W1058-N1062 WeakPolarHBondContact O-CB 3.46Å; W1058-N1062 PolarHBondContact O-N 3Å; W1058-N1062 PolarHBondContact O-ND2 3.39Å; L1059-N1062 PolarHBondContact O-N 3.17Å; N1062-P1064 VanDerWaalsContact C-CD 3.46Å; N1062-P1064 VanDerWaalsContact C-N 3.33Å; N1062-K1065 WeakPolarHBondContact O-CB 3.49Å; N1062-K1065 PolarHBondContact O-N 3.22Å; N1062-K1065 VanDerWaalsContact O-N 3.09Å; N1062-K1065 PolarHBondContact OD1-NZ 3.23Å; N1062-L1066 PolarHBondContact O-N 3.44Å
1063	L	93.1	Very high	93	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-57.3	-38.6	174.3	-165.4	81.2	0	0	0	112.6	L1059 K1065 I1067 I1073 I1075 F1089 L1090 V1123	L1059-L1063 WeakPolarHBondContact O-CB 3.3Å; L1059-L1063 PolarHBondContact O-N 3.06Å; L1063-K1065 VanDerWaalsContact C-N 3.32Å; L1063-K1065 PolarHBondContact O-N 3.31Å; L1063-I1067 HydrophobicContact CD2-CD1 4.29Å; L1063-I1067 HydrophobicContact CG-CD1 3.88Å; L1063-I1067 WeakPolarHBondContact O-CB 3.38Å; L1063-I1067 VanDerWaalsContact O-CG1 3.28Å; L1063-I1067 WeakPolarHBondContact O-CG1 3.37Å; L1063-I1067 PolarHBondContact O-N 2.95Å; L1063-I1067 VanDerWaalsContact O-N 3.12Å; L1063-I1073 HydrophobicContact CD1-CD1 3.54Å; L1063-I1073 HydrophobicContact CD1-CG2 4.27Å; L1063-I1073 HydrophobicContact CG-CD1 4.4Å; L1063-I1075 HydrophobicContact CD1-CD1 4.41Å; L1063-F1089 HydrophobicContact CD2-CE1 4.25Å; L1063-L1090 HydrophobicContact CD2-CD2 3.63Å; L1063-V1123 HydrophobicContact CD1-CG2 4.39Å; L1063-V1123 HydrophobicContact CD2-CG2 4.39Å
1064	P	92.4	Very high	93.1	Very high	54 Å²	54	43.7 Å²	43.7	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-64.6	-32.3	175.3	-23.3	35.8	0	0	0	113.9	N1060 N1062 S1068	N1060-P1064 WeakPolarHBondContact O-CD 3.39Å; N1060-P1064 VanDerWaalsContact O-CG 3.23Å; N1060-P1064 WeakPolarHBondContact O-CG 3.47Å; N1062-P1064 VanDerWaalsContact C-CD 3.46Å; N1062-P1064 VanDerWaalsContact C-N 3.33Å; P1064-S1068 WeakPolarHBondContact O-CB 3.42Å; P1064-S1068 PolarHBondContact O-N 2.84Å; P1064-S1068 PolarHBondContact O-OG 2.86Å
1065	K	93.8	Very high	93.3	Very high	105 Å²	105	43.6 Å²	43.6	46%	0.457	24%	0.235	S	C	.	.	H	α-helix	trans	-68.6	-55.4	179.6	-58.1	173.6	-173.1	151.6	0	110.2	D1061 N1062 L1063 I1067 S1068 E1069	D1061-K1065 WeakPolarHBondContact O-CE 3.38Å; D1061-K1065 PolarHBondContact O-NZ 3.04Å; N1062-K1065 WeakPolarHBondContact O-CB 3.49Å; N1062-K1065 PolarHBondContact O-N 3.22Å; N1062-K1065 VanDerWaalsContact O-N 3.09Å; N1062-K1065 PolarHBondContact OD1-NZ 3.23Å; L1063-K1065 VanDerWaalsContact C-N 3.32Å; L1063-K1065 PolarHBondContact O-N 3.31Å; K1065-I1067 VanDerWaalsContact C-N 3.26Å; K1065-I1067 PolarHBondContact O-N 2.95Å; K1065-S1068 CarbonylContact O-C 3.56Å; K1065-S1068 WeakPolarHBondContact O-CA 3.39Å; K1065-S1068 WeakPolarHBondContact O-CB 3.44Å; K1065-S1068 PolarHBondContact O-N 2.7Å; K1065-S1068 PolarHBondContact O-OG 3.25Å; K1065-E1069 WeakPolarHBondContact O-CG 3.35Å; K1065-E1069 PolarHBondContact O-N 3.03Å
1066	L	92.6	Very high	93.3	Very high	28 Å²	28	43.6 Å²	43.6	15%	0.147	24%	0.235	C	C	.	.	H	α-helix	trans	-54.9	-41.3	177.7	-65.7	167.6	0	0	0	112	N1062 E1069 G1070 H1071 I1073 T1142	N1062-L1066 PolarHBondContact O-N 3.44Å; L1066-E1069 WeakPolarHBondContact CA-OE2 3.25Å; L1066-E1069 PolarHBondContact O-N 3.41Å; L1066-G1070 PolarHBondContact O-N 3.13Å; L1066-H1071 HydrophobicContact CB-CB 4.5Å; L1066-H1071 WeakPolarHBondContact O-CB 3.48Å; L1066-H1071 PolarHBondContact O-N 3.48Å; L1066-I1073 HydrophobicContact CB-CD1 3.68Å; L1066-I1073 HydrophobicContact CD1-CD1 4.18Å; L1066-T1142 HydrophobicContact CD1-CG2 4.33Å
1067	I	92.1	Very high	93.3	Very high	24 Å²	24	43.6 Å²	43.6	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-70.4	-35.1	175.9	-65.1	168.8	0	0	0	111.8	L1063 K1065 E1069 G1070 I1073 R1095 E1122 V1123	L1063-I1067 HydrophobicContact CD2-CD1 4.29Å; L1063-I1067 HydrophobicContact CG-CD1 3.88Å; L1063-I1067 WeakPolarHBondContact O-CB 3.38Å; L1063-I1067 VanDerWaalsContact O-CG1 3.28Å; L1063-I1067 WeakPolarHBondContact O-CG1 3.37Å; L1063-I1067 PolarHBondContact O-N 2.95Å; L1063-I1067 VanDerWaalsContact O-N 3.12Å; K1065-I1067 VanDerWaalsContact C-N 3.26Å; K1065-I1067 PolarHBondContact O-N 2.95Å; I1067-E1069 VanDerWaalsContact C-N 3.29Å; I1067-E1069 PolarHBondContact O-N 2.96Å; I1067-G1070 PolarHBondContact O-N 2.89Å; I1067-G1070 VanDerWaalsContact O-N 3.1Å; I1067-I1073 HydrophobicContact CG1-CD1 3.91Å; I1067-R1095 VanDerWaalsContact CG2-NH1 3.31Å; I1067-E1122 HydrophobicContact CD1-CB 4.02Å; I1067-E1122 HydrophobicContact CD1-CG 4.41Å; I1067-E1122 HydrophobicContact CG1-CB 4.27Å; I1067-E1122 HydrophobicContact CG1-CG 4.5Å; I1067-E1122 HydrophobicContact CG2-CG 3.83Å; I1067-V1123 HydrophobicContact CD1-CG2 4.27Å
1068	S	91	Very high	93.2	Very high	100 Å²	100	40.6 Å²	40.6	70%	0.699	22%	0.221	S	C	*	.	H	α-helix	trans	-69.5	-26	175.2	71.6	0	0	0	0	113.6	P1064 K1065 G1070	P1064-S1068 WeakPolarHBondContact O-CB 3.42Å; P1064-S1068 PolarHBondContact O-N 2.84Å; P1064-S1068 PolarHBondContact O-OG 2.86Å; K1065-S1068 CarbonylContact O-C 3.56Å; K1065-S1068 WeakPolarHBondContact O-CA 3.39Å; K1065-S1068 WeakPolarHBondContact O-CB 3.44Å; K1065-S1068 PolarHBondContact O-N 2.7Å; K1065-S1068 PolarHBondContact O-OG 3.25Å; S1068-G1070 VanDerWaalsContact C-N 3.26Å
1069	E	91.5	Very high	93	Very high	121 Å²	121	40.2 Å²	40.2	57%	0.565	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.4	171.1	-68.5	153.4	176.4	0	0	112.3	K1065 L1066 I1067 H1071	K1065-E1069 WeakPolarHBondContact O-CG 3.35Å; K1065-E1069 PolarHBondContact O-N 3.03Å; L1066-E1069 WeakPolarHBondContact CA-OE2 3.25Å; L1066-E1069 PolarHBondContact O-N 3.41Å; I1067-E1069 VanDerWaalsContact C-N 3.29Å; I1067-E1069 PolarHBondContact O-N 2.96Å; E1069-H1071 IonicContact OE2-CD2 2.79Å
1070	G	90.3	Very high	92.8	Very high	57 Å²	57	42.7 Å²	42.7	59%	0.588	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	94	6.4	176.8	0	0	0	0	0	115.2	L1066 I1067 S1068	L1066-G1070 PolarHBondContact O-N 3.13Å; I1067-G1070 PolarHBondContact O-N 2.89Å; I1067-G1070 VanDerWaalsContact O-N 3.1Å; S1068-G1070 VanDerWaalsContact C-N 3.26Å
1071	H	93	Very high	92.6	Very high	52 Å²	52	42.6 Å²	42.6	24%	0.241	23%	0.234	C	C	.	.			trans	-69.4	146.9	-178.5	-66.2	-54.8	0	0	0	112.9	L1066 E1069 D1141	L1066-H1071 HydrophobicContact CB-CB 4.5Å; L1066-H1071 WeakPolarHBondContact O-CB 3.48Å; L1066-H1071 PolarHBondContact O-N 3.48Å; E1069-H1071 IonicContact OE2-CD2 2.79Å; H1071-D1141 WeakPolarHBondContact CA-OD1 3.23Å; H1071-D1141 WeakPolarHBondContact CB-OD1 3.47Å; H1071-D1141 IonicContact CE1-OD2 2.82Å; H1071-D1141 IonicContact CG-OD1 3.82Å; H1071-D1141 IonicContact CG-OD2 2.72Å; H1071-D1141 IonicContact ND1-OD1 2.85Å; H1071-D1141 IonicContact ND1-OD2 3.55Å; H1071-D1141 PolarHBondContact ND1-OD2 3Å
1072	R	93	Very high	92.7	Very high	70 Å²	70	39 Å²	39	26%	0.264	22%	0.215	S	C	.	.			trans	-112.7	125	177.3	-75.7	-165.2	-64.4	-173.2	-4.4	110.1	F1116 N1117 S1119 I1121 G1139 A1140 D1141 T1142	R1072-F1116 HydrophobicContact CB-CZ 4.22Å; R1072-F1116 PolarHBondContact NH1-O 3.03Å; R1072-N1117 PolarHBondContact NH1-O 3.16Å; R1072-S1119 PolarHBondContact NH1-O 2.87Å; R1072-I1121 WeakPolarHBondContact CD-O 3.44Å; R1072-G1139 PolarHBondContact NE-O 2.66Å; R1072-G1139 VanDerWaalsContact NH2-CA 3.28Å; R1072-G1139 PolarHBondContact NH2-O 2.9Å; R1072-A1140 WeakPolarHBondContact O-CA 3.35Å; R1072-A1140 VanDerWaalsContact O-CB 3.32Å; R1072-A1140 WeakPolarHBondContact O-CB 3.44Å; R1072-D1141 PolarHBondContact N-OD1 3.34Å; R1072-D1141 PolarHBondContact O-N 2.76Å; R1072-D1141 VanDerWaalsContact O-N 3.08Å; R1072-D1141 VanDerWaalsContact O-OD1 3.14Å; R1072-T1142 PolarHBondContact O-N 3.19Å
1073	I	95	Very high	92.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.8	-153	-50.2	178.4	0	0	0	111.2	L1063 L1066 I1067 I1075 E1122 V1123 F1124 T1142 I1144	L1063-I1073 HydrophobicContact CD1-CD1 3.54Å; L1063-I1073 HydrophobicContact CD1-CG2 4.27Å; L1063-I1073 HydrophobicContact CG-CD1 4.4Å; L1066-I1073 HydrophobicContact CB-CD1 3.68Å; L1066-I1073 HydrophobicContact CD1-CD1 4.18Å; I1067-I1073 HydrophobicContact CG1-CD1 3.91Å; I1073-I1075 HydrophobicContact CG2-CG1 4.15Å; I1073-E1122 PolarHBondContact N-O 3.15Å; I1073-V1123 CarbonylContact O-C 3.59Å; I1073-V1123 WeakPolarHBondContact O-CA 3.47Å; I1073-F1124 PolarHBondContact O-N 3.3Å; I1073-T1142 WeakPolarHBondContact CA-O 3.48Å; I1073-T1142 HydrophobicContact CG2-CG2 4.31Å; I1073-I1144 HydrophobicContact CG2-CD1 3.65Å; I1073-I1144 HydrophobicContact CG2-CG1 3.96Å
1074	L	95	Very high	92.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.4	167.3	-52.7	-174.9	0	0	0	109.5	F1076 F1116 F1124 L1126 L1137 A1140 T1142 V1143 I1144 C1162	L1074-F1076 HydrophobicContact CB-CD2 4.37Å; L1074-F1076 HydrophobicContact CB-CE2 3.81Å; L1074-F1076 HydrophobicContact CB-CZ 4.32Å; L1074-F1076 HydrophobicContact CD1-CE2 3.96Å; L1074-F1076 HydrophobicContact CD1-CZ 4Å; L1074-F1116 HydrophobicContact CD2-CE1 3.85Å; L1074-F1116 HydrophobicContact CD2-CZ 3.91Å; L1074-F1124 HydrophobicContact CD2-CB 3.71Å; L1074-F1124 HydrophobicContact CD2-CD1 4.25Å; L1074-F1124 HydrophobicContact CD2-CG 4.35Å; L1074-L1126 HydrophobicContact CB-CD1 4.36Å; L1074-L1126 HydrophobicContact CD1-CD1 4.38Å; L1074-L1126 HydrophobicContact CD2-CD1 4.1Å; L1074-L1137 HydrophobicContact CD1-CB 4.03Å; L1074-L1137 HydrophobicContact CD1-CD1 3.69Å; L1074-L1137 HydrophobicContact CD2-CD1 4.09Å; L1074-A1140 HydrophobicContact CD1-CB 4.03Å; L1074-A1140 HydrophobicContact CD2-CB 3.62Å; L1074-A1140 HydrophobicContact CG-CB 3.5Å; L1074-T1142 PolarHBondContact N-O 2.7Å; L1074-V1143 HydrophobicContact CB-CG2 4.44Å; L1074-V1143 HydrophobicContact CD1-CG2 4.21Å; L1074-I1144 PolarHBondContact O-N 2.71Å; L1074-C1162 HydrophobicContact CD1-CB 4.03Å
1075	I	95.6	Very high	92.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116	172.6	-51.7	-178.7	0	0	0	109.2	L1059 L1063 I1073 L1086 V1123 F1124 L1125 L1126 I1144 H1146	L1059-I1075 HydrophobicContact CD2-CD1 4.45Å; L1063-I1075 HydrophobicContact CD1-CD1 4.41Å; I1073-I1075 HydrophobicContact CG2-CG1 4.15Å; I1075-L1086 HydrophobicContact CG2-CD1 4.12Å; I1075-V1123 HydrophobicContact CD1-CG1 3.74Å; I1075-V1123 HydrophobicContact CG1-CG1 4.04Å; I1075-F1124 PolarHBondContact N-O 2.81Å; I1075-L1125 HydrophobicContact CB-CD2 3.99Å; I1075-L1125 HydrophobicContact CD1-CD2 4.2Å; I1075-L1125 HydrophobicContact CG1-CD2 4.49Å; I1075-L1125 HydrophobicContact CG2-CD2 4.47Å; I1075-L1126 PolarHBondContact O-N 3.24Å; I1075-I1144 WeakPolarHBondContact CA-O 3.35Å; I1075-I1144 HydrophobicContact CG1-CB 4.38Å; I1075-I1144 HydrophobicContact CG1-CD1 4.45Å; I1075-H1146 HydrophobicContact CG2-CB 4.39Å
1076	F	94.7	Very high	92.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.2	180	-68.9	-75.6	0	0	0	112.3	L1074 L1126 V1143 I1144 I1145 H1146 A1158	L1074-F1076 HydrophobicContact CB-CD2 4.37Å; L1074-F1076 HydrophobicContact CB-CE2 3.81Å; L1074-F1076 HydrophobicContact CB-CZ 4.32Å; L1074-F1076 HydrophobicContact CD1-CE2 3.96Å; L1074-F1076 HydrophobicContact CD1-CZ 4Å; F1076-L1126 VanDerWaalsContact CA-O 3.31Å; F1076-L1126 WeakPolarHBondContact CA-O 3.43Å; F1076-L1126 HydrophobicContact CD1-CB 3.47Å; F1076-L1126 VanDerWaalsContact CD1-CB 3.47Å; F1076-L1126 HydrophobicContact CD1-CD1 4.28Å; F1076-L1126 HydrophobicContact CD1-CG 4.5Å; F1076-L1126 HydrophobicContact CE1-CB 3.42Å; F1076-L1126 VanDerWaalsContact CE1-CB 3.42Å; F1076-L1126 HydrophobicContact CE1-CD1 3.44Å; F1076-L1126 VanDerWaalsContact CE1-CD1 3.44Å; F1076-L1126 HydrophobicContact CE1-CG 4.02Å; F1076-L1126 HydrophobicContact CE2-CD1 4.45Å; F1076-L1126 HydrophobicContact CG-CB 4.4Å; F1076-L1126 HydrophobicContact CZ-CB 4.34Å; F1076-L1126 HydrophobicContact CZ-CD1 3.57Å; F1076-V1143 HydrophobicContact CD2-CG1 3.71Å; F1076-V1143 HydrophobicContact CE2-CG1 3.65Å; F1076-I1144 PolarHBondContact N-O 2.81Å; F1076-I1145 HydrophobicContact CB-CD1 3.89Å; F1076-I1145 HydrophobicContact CD2-CD1 3.79Å; F1076-I1145 HydrophobicContact CG-CD1 4.19Å; F1076-H1146 WeakPolarHBondContact O-CB 3.3Å; F1076-H1146 PolarHBondContact O-N 2.97Å; F1076-A1158 HydrophobicContact CD1-CB 4.1Å; F1076-A1158 HydrophobicContact CD2-CB 4.37Å; F1076-A1158 HydrophobicContact CE1-CB 3.87Å; F1076-A1158 HydrophobicContact CE2-CB 4.13Å; F1076-A1158 HydrophobicContact CG-CB 4.34Å; F1076-A1158 HydrophobicContact CZ-CB 3.87Å
1077	S	94.5	Very high	92.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	149.2	168.7	178.9	0	0	0	0	113	F1079 L1126 S1127 T1128 D1147	S1077-F1079 PolarHBondContact OG-N 3.45Å; S1077-L1126 PolarHBondContact N-O 3.38Å; S1077-L1126 VanDerWaalsContact N-O 3.08Å; S1077-S1127 VanDerWaalsContact O-CA 3.28Å; S1077-S1127 WeakPolarHBondContact O-CA 3.33Å; S1077-S1127 PolarHBondContact O-OG 2.74Å; S1077-T1128 PolarHBondContact O-N 3.24Å; S1077-T1128 PolarHBondContact O-OG1 3.26Å; S1077-D1147 VanDerWaalsContact CA-OD1 3.26Å; S1077-D1147 WeakPolarHBondContact CA-OD1 3.46Å; S1077-D1147 WeakPolarHBondContact CB-OD1 3.43Å; S1077-D1147 PolarHBondContact OG-OD1 3.4Å
1078	Q	91.3	Very high	92.5	Very high	28 Å²	28	31.2 Å²	31.2	13%	0.131	17%	0.174	C	C	.	.	S	Bend	trans	-77.1	-28.1	172.9	-64.7	-70.7	-18.9	0	0	112.5	T1128 D1147 D1149	Q1078-T1128 PolarHBondContact NE2-OG1 2.94Å; Q1078-D1147 PolarHBondContact N-OD1 2.82Å; Q1078-D1149 VanDerWaalsContact NE2-CG 3.28Å; Q1078-D1149 PolarHBondContact NE2-OD2 3.25Å; Q1078-D1149 PolarHBondContact OE1-OD2 3.4Å
1079	F	90	Very high	92.6	Very high	41 Å²	41	26.6 Å²	26.6	18%	0.18	14%	0.142	C	C	.	.			trans	-99.3	113.4	-177.3	-64.8	-78.8	0	0	0	111.7	T974 R977 S1077 I1081 M1082 L1083 D1147	T974-F1079 HydrophobicContact CG2-CE1 4Å; T974-F1079 HydrophobicContact CG2-CZ 4.29Å; R977-F1079 HydrophobicContact CB-CE2 4.02Å; R977-F1079 HydrophobicContact CB-CZ 4.01Å; S1077-F1079 PolarHBondContact OG-N 3.45Å; F1079-I1081 PolarHBondContact O-N 3.1Å; F1079-I1081 VanDerWaalsContact O-N 3.15Å; F1079-M1082 HydrophobicContact CB-CB 3.99Å; F1079-M1082 WeakPolarHBondContact O-CA 3.39Å; F1079-M1082 VanDerWaalsContact O-CB 3.31Å; F1079-M1082 WeakPolarHBondContact O-CB 3.46Å; F1079-M1082 PolarHBondContact O-N 3.48Å; F1079-L1083 PolarHBondContact O-N 3.27Å; F1079-D1147 WeakPolarHBondContact CD2-OD2 3.47Å; F1079-D1147 VanDerWaalsContact CE2-OD2 3.23Å; F1079-D1147 WeakPolarHBondContact CE2-OD2 3.41Å
1080	V	90.6	Very high	92.7	Very high	52 Å²	52	20.8 Å²	20.8	32%	0.315	12%	0.115	S	C	.	.	H	α-helix	trans	-57.7	-30.7	174.4	-177.6	0	0	0	0	112.1	M1082 L1083 D1084 R1099 D1101	V1080-M1082 VanDerWaalsContact C-N 3.3Å; V1080-M1082 PolarHBondContact O-N 3.08Å; V1080-L1083 WeakPolarHBondContact O-CB 3.37Å; V1080-L1083 PolarHBondContact O-N 2.97Å; V1080-D1084 PolarHBondContact O-N 2.85Å; V1080-D1084 VanDerWaalsContact O-N 3.1Å; V1080-R1099 VanDerWaalsContact CG1-NH2 3.32Å; V1080-D1101 WeakPolarHBondContact CG1-OD2 3.44Å
1081	I	89.7	Confident	92.8	Very high	49 Å²	49	23.4 Å²	23.4	25%	0.251	11%	0.107	S	C	.	.	H	α-helix	trans	-69.9	-27.5	175.9	-44.1	177.5	0	0	0	111.8	L985 F1079 D1084 I1085	L985-I1081 HydrophobicContact CD2-CB 3.87Å; L985-I1081 HydrophobicContact CD2-CG2 3.53Å; F1079-I1081 PolarHBondContact O-N 3.1Å; F1079-I1081 VanDerWaalsContact O-N 3.15Å; I1081-D1084 WeakPolarHBondContact CA-OD2 3.3Å; I1081-D1084 WeakPolarHBondContact O-CB 3.29Å; I1081-D1084 PolarHBondContact O-N 3.15Å; I1081-I1085 PolarHBondContact O-N 3.2Å
1082	M	93.2	Very high	92.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-71.8	-35.1	171.7	-169.1	68	-143.3	0	0	110.9	N981 H982 L985 I1056 F1079 V1080 D1084 I1085 L1086 H1146	N981-M1082 HydrophobicContact CB-SD 4.01Å; H982-M1082 HydrophobicContact CB-CE 4.21Å; H982-M1082 HydrophobicContact CB-SD 3.96Å; L985-M1082 HydrophobicContact CD1-SD 3.94Å; I1056-M1082 HydrophobicContact CD1-CE 3.78Å; I1056-M1082 HydrophobicContact CG1-CE 4.04Å; F1079-M1082 HydrophobicContact CB-CB 3.99Å; F1079-M1082 WeakPolarHBondContact O-CA 3.39Å; F1079-M1082 VanDerWaalsContact O-CB 3.31Å; F1079-M1082 WeakPolarHBondContact O-CB 3.46Å; F1079-M1082 PolarHBondContact O-N 3.48Å; V1080-M1082 VanDerWaalsContact C-N 3.3Å; V1080-M1082 PolarHBondContact O-N 3.08Å; M1082-D1084 VanDerWaalsContact C-N 3.29Å; M1082-D1084 PolarHBondContact O-N 2.94Å; M1082-I1085 HydrophobicContact CE-CB 4.33Å; M1082-I1085 HydrophobicContact CE-CG2 4.16Å; M1082-I1085 PolarHBondContact O-N 3.31Å; M1082-I1085 HydrophobicContact SD-CD1 4.35Å; M1082-L1086 HydrophobicContact CE-CD2 4.15Å; M1082-L1086 HydrophobicContact CE-CG 4.01Å; M1082-L1086 HydrophobicContact CG-CD1 4.28Å; M1082-L1086 WeakPolarHBondContact O-CG 3.34Å; M1082-L1086 PolarHBondContact O-N 3.41Å; M1082-H1146 WeakPolarHBondContact CE-NE2 3.49Å
1083	L	93.4	Very high	92.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.9	-37.1	171.2	-55.7	179.9	0	0	0	111.5	F1079 V1080 I1085 L1086 E1087 D1101 L1125	F1079-L1083 PolarHBondContact O-N 3.27Å; V1080-L1083 WeakPolarHBondContact O-CB 3.37Å; V1080-L1083 PolarHBondContact O-N 2.97Å; L1083-I1085 VanDerWaalsContact C-N 3.28Å; L1083-I1085 PolarHBondContact O-N 2.67Å; L1083-L1086 HydrophobicContact CD2-CD1 4.39Å; L1083-L1086 PolarHBondContact O-N 3.27Å; L1083-E1087 WeakPolarHBondContact O-CG 3.23Å; L1083-E1087 PolarHBondContact O-N 2.69Å; L1083-D1101 HydrophobicContact CD1-CB 4.16Å; L1083-L1125 HydrophobicContact CD2-CB 4.4Å
1084	D	92	Very high	92.3	Very high	38 Å²	38	29.2 Å²	29.2	20%	0.203	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-38.3	173.7	-54.9	-33.1	0	0	0	111.9	H1027 V1080 I1081 M1082 R1099	H1027-D1084 PolarHBondContact CE1-O 3.15Å; V1080-D1084 PolarHBondContact O-N 2.85Å; V1080-D1084 VanDerWaalsContact O-N 3.1Å; I1081-D1084 WeakPolarHBondContact CA-OD2 3.3Å; I1081-D1084 WeakPolarHBondContact O-CB 3.29Å; I1081-D1084 PolarHBondContact O-N 3.15Å; M1082-D1084 VanDerWaalsContact C-N 3.29Å; M1082-D1084 PolarHBondContact O-N 2.94Å; D1084-R1099 IonicContact OD1-CZ 3.16Å; D1084-R1099 IonicContact OD1-NH1 3.52Å; D1084-R1099 PolarHBondContact OD1-NH1 3.06Å; D1084-R1099 IonicContact OD1-NH2 2.69Å; D1084-R1099 PolarHBondContact OD1-NH2 2.97Å
1085	I	92	Very high	92	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-73.8	-40	177.4	-63.7	166.3	0	0	0	111.2	H982 L985 H1027 I1049 I1056 I1081 M1082 L1083 E1087 E1088 F1089	H982-I1085 HydrophobicContact CB-CD1 4.16Å; L985-I1085 HydrophobicContact CD1-CD1 4.42Å; L985-I1085 HydrophobicContact CD2-CD1 3.58Å; L985-I1085 HydrophobicContact CG-CD1 3.67Å; H1027-I1085 HydrophobicContact CB-CD1 4.22Å; H1027-I1085 HydrophobicContact CB-CG1 4.02Å; H1027-I1085 VanDerWaalsContact CG-CG1 3.46Å; I1049-I1085 HydrophobicContact CG2-CG2 3.99Å; I1056-I1085 HydrophobicContact CD1-CG2 3.65Å; I1081-I1085 PolarHBondContact O-N 3.2Å; M1082-I1085 HydrophobicContact CE-CB 4.33Å; M1082-I1085 HydrophobicContact CE-CG2 4.16Å; M1082-I1085 PolarHBondContact O-N 3.31Å; M1082-I1085 HydrophobicContact SD-CD1 4.35Å; L1083-I1085 VanDerWaalsContact C-N 3.28Å; L1083-I1085 PolarHBondContact O-N 2.67Å; I1085-E1087 VanDerWaalsContact C-N 3.33Å; I1085-E1087 PolarHBondContact O-N 3.07Å; I1085-E1088 PolarHBondContact O-N 3.07Å; I1085-E1088 VanDerWaalsContact O-N 3.17Å; I1085-F1089 PolarHBondContact O-N 3.3Å
1086	L	93.9	Very high	91.8	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-31.7	177.9	-70.9	169.5	0	0	0	112.3	L1059 I1075 M1082 L1083 E1088 F1089 L1090 L1125	L1059-L1086 HydrophobicContact CD1-CD2 3.74Å; I1075-L1086 HydrophobicContact CG2-CD1 4.12Å; M1082-L1086 HydrophobicContact CE-CD2 4.15Å; M1082-L1086 HydrophobicContact CE-CG 4.01Å; M1082-L1086 HydrophobicContact CG-CD1 4.28Å; M1082-L1086 WeakPolarHBondContact O-CG 3.34Å; M1082-L1086 PolarHBondContact O-N 3.41Å; L1083-L1086 HydrophobicContact CD2-CD1 4.39Å; L1083-L1086 PolarHBondContact O-N 3.27Å; L1086-E1088 VanDerWaalsContact C-N 3.35Å; L1086-F1089 HydrophobicContact CD2-CD1 4.45Å; L1086-L1090 WeakPolarHBondContact O-CB 3.26Å; L1086-L1090 VanDerWaalsContact O-CG 3.24Å; L1086-L1090 WeakPolarHBondContact O-CG 3.37Å; L1086-L1090 PolarHBondContact O-N 3.45Å; L1086-L1125 HydrophobicContact CB-CD1 4.14Å; L1086-L1125 HydrophobicContact CB-CD2 4.04Å; L1086-L1125 HydrophobicContact CD1-CD2 4.43Å
1087	E	93.5	Very high	91.8	Very high	25 Å²	25	40.6 Å²	40.6	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-44.8	168.5	-76	-164.8	116.7	0	0	111.8	L1083 I1085 L1090 R1091 Y1097 R1099 L1125	L1083-E1087 WeakPolarHBondContact O-CG 3.23Å; L1083-E1087 PolarHBondContact O-N 2.69Å; I1085-E1087 VanDerWaalsContact C-N 3.33Å; I1085-E1087 PolarHBondContact O-N 3.07Å; E1087-L1090 PolarHBondContact O-N 3.06Å; E1087-R1091 WeakPolarHBondContact O-CG 3.27Å; E1087-R1091 PolarHBondContact O-N 3.46Å; E1087-Y1097 HydrophobicContact CB-CE2 4.35Å; E1087-Y1097 VanDerWaalsContact CD-OH 3.31Å; E1087-Y1097 HydrophobicContact CG-CE2 3.62Å; E1087-Y1097 WeakPolarHBondContact CG-OH 3.24Å; E1087-Y1097 WeakPolarHBondContact OE1-CE2 3.18Å; E1087-Y1097 PolarHBondContact OE1-OH 2.68Å; E1087-R1099 VanDerWaalsContact CD-CD 3.45Å; E1087-R1099 WeakPolarHBondContact OE1-CD 3.44Å; E1087-R1099 IonicContact OE2-CZ 2.81Å; E1087-R1099 IonicContact OE2-NH1 3.53Å; E1087-R1099 PolarHBondContact OE2-NH1 3.47Å; E1087-L1125 HydrophobicContact CB-CD1 4.43Å; E1087-L1125 HydrophobicContact CG-CD1 3.6Å
1088	E	90.3	Very high	91.8	Very high	21 Å²	21	41 Å²	41	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-41.6	-178.8	-150.8	62.1	-161.8	0	0	111.5	Q1034 I1049 I1085 L1086 L1090 R1091 I1092	Q1034-E1088 PolarHBondContact NE2-OE1 3.21Å; I1049-E1088 HydrophobicContact CD1-CB 4.41Å; I1049-E1088 HydrophobicContact CD1-CG 3.92Å; I1085-E1088 PolarHBondContact O-N 3.07Å; I1085-E1088 VanDerWaalsContact O-N 3.17Å; L1086-E1088 VanDerWaalsContact C-N 3.35Å; E1088-L1090 VanDerWaalsContact C-N 3.33Å; E1088-L1090 PolarHBondContact O-N 3.43Å; E1088-R1091 WeakPolarHBondContact O-CB 3.29Å; E1088-R1091 PolarHBondContact O-N 2.93Å; E1088-R1091 IonicContact OE1-NH1 2.63Å; E1088-R1091 IonicContact OE2-CZ 2.75Å; E1088-R1091 IonicContact OE2-NE 3.77Å; E1088-R1091 IonicContact OE2-NH1 3.39Å; E1088-R1091 PolarHBondContact OE2-NH1 3.31Å; E1088-I1092 HydrophobicContact CG-CD1 4.37Å; E1088-I1092 WeakPolarHBondContact O-CD1 3.25Å; E1088-I1092 VanDerWaalsContact O-CG1 3.24Å; E1088-I1092 WeakPolarHBondContact O-CG1 3.5Å; E1088-I1092 PolarHBondContact O-N 2.85Å
1089	F	93	Very high	91.9	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-56.5	-43	170.3	166.6	-110.9	0	0	0	112.8	I1050 I1056 L1059 N1060 L1063 I1085 L1086 I1092 T1093	I1050-F1089 HydrophobicContact CG1-CD2 4.13Å; I1050-F1089 HydrophobicContact CG1-CE2 4.46Å; I1056-F1089 HydrophobicContact CG2-CB 4.43Å; I1056-F1089 HydrophobicContact CG2-CD1 4.48Å; I1056-F1089 HydrophobicContact CG2-CD2 3.56Å; I1056-F1089 HydrophobicContact CG2-CE2 3.88Å; I1056-F1089 HydrophobicContact CG2-CG 3.89Å; I1056-F1089 HydrophobicContact CG2-CZ 4.47Å; L1059-F1089 HydrophobicContact CB-CE1 3.95Å; L1059-F1089 HydrophobicContact CB-CZ 4.06Å; N1060-F1089 HydrophobicContact CB-CE2 4.01Å; N1060-F1089 HydrophobicContact CB-CZ 4.21Å; L1063-F1089 HydrophobicContact CD2-CE1 4.25Å; I1085-F1089 PolarHBondContact O-N 3.3Å; L1086-F1089 HydrophobicContact CD2-CD1 4.45Å; F1089-I1092 PolarHBondContact O-N 3.37Å; F1089-T1093 HydrophobicContact CD2-CG2 4.11Å; F1089-T1093 HydrophobicContact CE2-CG2 3.62Å; F1089-T1093 HydrophobicContact CZ-CG2 4.07Å; F1089-T1093 PolarHBondContact O-N 3.41Å; F1089-T1093 PolarHBondContact O-OG1 2.89Å
1090	L	93.5	Very high	91.9	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.8	-27.3	178.2	-68.7	172.1	0	0	0	112.8	L1063 L1086 E1087 E1088 T1093 N1094 R1095 Y1097 V1123 L1125	L1063-L1090 HydrophobicContact CD2-CD2 3.63Å; L1086-L1090 WeakPolarHBondContact O-CB 3.26Å; L1086-L1090 VanDerWaalsContact O-CG 3.24Å; L1086-L1090 WeakPolarHBondContact O-CG 3.37Å; L1086-L1090 PolarHBondContact O-N 3.45Å; E1087-L1090 PolarHBondContact O-N 3.06Å; E1088-L1090 VanDerWaalsContact C-N 3.33Å; E1088-L1090 PolarHBondContact O-N 3.43Å; L1090-T1093 WeakPolarHBondContact CA-OG1 3.42Å; L1090-N1094 PolarHBondContact O-N 3.12Å; L1090-R1095 HydrophobicContact CB-CB 4.49Å; L1090-R1095 HydrophobicContact CD2-CB 3.93Å; L1090-R1095 HydrophobicContact CD2-CG 4.36Å; L1090-R1095 PolarHBondContact O-N 2.95Å; L1090-Y1097 HydrophobicContact CB-CD1 3.74Å; L1090-Y1097 HydrophobicContact CB-CE1 4.25Å; L1090-Y1097 HydrophobicContact CB-CG 4.36Å; L1090-Y1097 HydrophobicContact CD1-CD1 4.24Å; L1090-Y1097 HydrophobicContact CD1-CG 4.01Å; L1090-V1123 HydrophobicContact CD1-CB 4.35Å; L1090-V1123 HydrophobicContact CD1-CG1 3.87Å; L1090-V1123 HydrophobicContact CD2-CG2 4.37Å; L1090-L1125 HydrophobicContact CD1-CD1 4.07Å; L1090-L1125 HydrophobicContact CD1-CD2 3.88Å; L1090-L1125 HydrophobicContact CD1-CG 4.02Å
1091	R	92	Very high	91.9	Very high	111 Å²	111	37.7 Å²	37.7	42%	0.419	17%	0.171	S	C	.	.	H	α-helix	trans	-69.3	-47.2	168.6	-69.4	172.6	-164.4	158.2	13.6	111.9	E1087 E1088 T1093 N1094 Y1097	E1087-R1091 WeakPolarHBondContact O-CG 3.27Å; E1087-R1091 PolarHBondContact O-N 3.46Å; E1088-R1091 WeakPolarHBondContact O-CB 3.29Å; E1088-R1091 PolarHBondContact O-N 2.93Å; E1088-R1091 IonicContact OE1-NH1 2.63Å; E1088-R1091 IonicContact OE2-CZ 2.75Å; E1088-R1091 IonicContact OE2-NE 3.77Å; E1088-R1091 IonicContact OE2-NH1 3.39Å; E1088-R1091 PolarHBondContact OE2-NH1 3.31Å; R1091-T1093 VanDerWaalsContact C-N 3.26Å; R1091-T1093 PolarHBondContact O-N 3.42Å; R1091-N1094 WeakPolarHBondContact O-CA 3.41Å; R1091-N1094 PolarHBondContact O-N 3.24Å; R1091-Y1097 HydrophobicContact CG-CE1 4.28Å; R1091-Y1097 PolarHBondContact NH2-OH 3.17Å
1092	I	89.7	Confident	91.6	Very high	58 Å²	58	36.8 Å²	36.8	30%	0.297	17%	0.174	S	C	.	.	H	α-helix	trans	-60	-38.8	179.3	-68.1	162.3	0	0	0	110.9	P1046 I1049 I1050 E1088 F1089 N1094	P1046-I1092 HydrophobicContact CB-CD1 3.81Å; P1046-I1092 HydrophobicContact CB-CG1 3.94Å; P1046-I1092 HydrophobicContact CB-CG2 3.79Å; I1049-I1092 HydrophobicContact CB-CD1 4.38Å; I1049-I1092 HydrophobicContact CD1-CD1 4.03Å; I1050-I1092 HydrophobicContact CD1-CG2 3.98Å; E1088-I1092 HydrophobicContact CG-CD1 4.37Å; E1088-I1092 WeakPolarHBondContact O-CD1 3.25Å; E1088-I1092 VanDerWaalsContact O-CG1 3.24Å; E1088-I1092 WeakPolarHBondContact O-CG1 3.5Å; E1088-I1092 PolarHBondContact O-N 2.85Å; F1089-I1092 PolarHBondContact O-N 3.37Å; I1092-N1094 VanDerWaalsContact C-N 3.29Å; I1092-N1094 PolarHBondContact O-N 2.96Å
1093	T	89.8	Confident	91.3	Very high	40 Å²	40	39 Å²	39	25%	0.245	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	5.7	175.1	55.1	0	0	0	0	114.2	F1089 L1090 R1091 R1095	F1089-T1093 HydrophobicContact CD2-CG2 4.11Å; F1089-T1093 HydrophobicContact CE2-CG2 3.62Å; F1089-T1093 HydrophobicContact CZ-CG2 4.07Å; F1089-T1093 PolarHBondContact O-N 3.41Å; F1089-T1093 PolarHBondContact O-OG1 2.89Å; L1090-T1093 WeakPolarHBondContact CA-OG1 3.42Å; R1091-T1093 VanDerWaalsContact C-N 3.26Å; R1091-T1093 PolarHBondContact O-N 3.42Å; T1093-R1095 PolarHBondContact O-N 3.26Å
1094	N	89.9	Confident	90.9	Very high	147 Å²	147	40 Å²	40	79%	0.786	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	46.7	179.7	-163.4	20.8	0	0	0	114.6	L1090 R1091 I1092	L1090-N1094 PolarHBondContact O-N 3.12Å; R1091-N1094 WeakPolarHBondContact O-CA 3.41Å; R1091-N1094 PolarHBondContact O-N 3.24Å; I1092-N1094 VanDerWaalsContact C-N 3.29Å; I1092-N1094 PolarHBondContact O-N 2.96Å
1095	R	89.8	Confident	90.4	Very high	68 Å²	68	41.1 Å²	41.1	26%	0.257	20%	0.204	S	C	.	.			trans	-102.9	138.2	-178.3	-63.4	-55.5	-176.2	155.4	-3.4	112.4	I1067 L1090 T1093 Y1097 E1122	I1067-R1095 VanDerWaalsContact CG2-NH1 3.31Å; L1090-R1095 HydrophobicContact CB-CB 4.49Å; L1090-R1095 HydrophobicContact CD2-CB 3.93Å; L1090-R1095 HydrophobicContact CD2-CG 4.36Å; L1090-R1095 PolarHBondContact O-N 2.95Å; T1093-R1095 PolarHBondContact O-N 3.26Å; R1095-Y1097 PolarHBondContact O-N 3.39Å; R1095-E1122 WeakPolarHBondContact CD-OE2 3.37Å; R1095-E1122 IonicContact NH1-OE2 3.2Å; R1095-E1122 PolarHBondContact NH1-OE2 3.38Å; R1095-E1122 VanDerWaalsContact NH1-OE2 3.07Å
1096	R	92.2	Very high	89.6	Confident	117 Å²	117	45.7 Å²	45.7	44%	0.442	23%	0.232	S	C	.	.			trans	-78	120.5	178.2	-64.2	176.7	-60.9	136.4	9.7	110	S1120 E1122 V1123	R1096-S1120 PolarHBondContact NH1-O 3.39Å; R1096-S1120 PolarHBondContact NH1-OG 3.4Å; R1096-S1120 PolarHBondContact NH2-O 3.23Å; R1096-E1122 IonicContact CZ-OE1 2.79Å; R1096-E1122 IonicContact NE-OE1 2.63Å; R1096-E1122 PolarHBondContact NE-OE1 3.23Å; R1096-E1122 IonicContact NH2-OE1 2.68Å; R1096-E1122 PolarHBondContact NH2-OE1 3.19Å; R1096-E1122 PolarHBondContact O-N 2.83Å; R1096-V1123 PolarHBondContact O-N 3.08Å
1097	Y	94.3	Very high	88.9	Confident	55 Å²	55	50.2 Å²	50.2	22%	0.216	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	159.3	-175.8	76.2	-96.1	0	0	0	113.3	E1087 L1090 R1091 R1095 R1099 V1123 L1125	E1087-Y1097 HydrophobicContact CB-CE2 4.35Å; E1087-Y1097 VanDerWaalsContact CD-OH 3.31Å; E1087-Y1097 HydrophobicContact CG-CE2 3.62Å; E1087-Y1097 WeakPolarHBondContact CG-OH 3.24Å; E1087-Y1097 WeakPolarHBondContact OE1-CE2 3.18Å; E1087-Y1097 PolarHBondContact OE1-OH 2.68Å; L1090-Y1097 HydrophobicContact CB-CD1 3.74Å; L1090-Y1097 HydrophobicContact CB-CE1 4.25Å; L1090-Y1097 HydrophobicContact CB-CG 4.36Å; L1090-Y1097 HydrophobicContact CD1-CD1 4.24Å; L1090-Y1097 HydrophobicContact CD1-CG 4.01Å; R1091-Y1097 HydrophobicContact CG-CE1 4.28Å; R1091-Y1097 PolarHBondContact NH2-OH 3.17Å; R1095-Y1097 PolarHBondContact O-N 3.39Å; Y1097-R1099 HydrophobicContact CE2-CB 4.48Å; Y1097-V1123 CarbonylContact C-O 3.55Å; Y1097-V1123 VanDerWaalsContact CA-O 3.22Å; Y1097-V1123 WeakPolarHBondContact CA-O 3.12Å; Y1097-L1125 HydrophobicContact CD2-CD1 4.22Å; Y1097-L1125 HydrophobicContact CE2-CD1 4.47Å
1098	I	93.6	Very high	88.5	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	149.8	164.4	-70.4	168	0	0	0	108.9	L1112 R1115 F1116 I1121 V1123 F1124 L1125	I1098-L1112 HydrophobicContact CG2-CB 4.15Å; I1098-L1112 HydrophobicContact CG2-CD1 4.4Å; I1098-L1112 HydrophobicContact CG2-CD2 4.07Å; I1098-L1112 HydrophobicContact CG2-CG 4.43Å; I1098-R1115 HydrophobicContact CD1-CB 4.35Å; I1098-R1115 HydrophobicContact CD1-CG 4.06Å; I1098-F1116 HydrophobicContact CD1-CB 4.08Å; I1098-I1121 HydrophobicContact CD1-CD1 3.63Å; I1098-I1121 HydrophobicContact CD1-CG2 4.32Å; I1098-I1121 HydrophobicContact CG1-CD1 3.94Å; I1098-I1121 HydrophobicContact CG1-CG2 4.23Å; I1098-V1123 PolarHBondContact N-O 3.26Å; I1098-F1124 HydrophobicContact CB-CD2 4.09Å; I1098-F1124 HydrophobicContact CB-CE2 4.24Å; I1098-F1124 HydrophobicContact CB-CG 4.48Å; I1098-F1124 HydrophobicContact CG2-CD2 3.86Å; I1098-F1124 HydrophobicContact CG2-CE2 3.5Å; I1098-F1124 VanDerWaalsContact CG2-CE2 3.5Å; I1098-F1124 HydrophobicContact CG2-CZ 3.88Å; I1098-F1124 CarbonylContact O-C 3.41Å; I1098-F1124 WeakPolarHBondContact O-CA 3.47Å; I1098-F1124 WeakPolarHBondContact O-CD2 3.31Å; I1098-L1125 PolarHBondContact O-N 2.83Å
1099	R	93.7	Very high	88.2	Confident	46 Å²	46	54.4 Å²	54.4	17%	0.174	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.7	173.1	176.4	178.2	169	162.2	2.4	111.7	V1080 D1084 E1087 Y1097 D1101 L1125	V1080-R1099 VanDerWaalsContact CG1-NH2 3.32Å; D1084-R1099 IonicContact OD1-CZ 3.16Å; D1084-R1099 IonicContact OD1-NH1 3.52Å; D1084-R1099 PolarHBondContact OD1-NH1 3.06Å; D1084-R1099 IonicContact OD1-NH2 2.69Å; D1084-R1099 PolarHBondContact OD1-NH2 2.97Å; E1087-R1099 VanDerWaalsContact CD-CD 3.45Å; E1087-R1099 WeakPolarHBondContact OE1-CD 3.44Å; E1087-R1099 IonicContact OE2-CZ 2.81Å; E1087-R1099 IonicContact OE2-NH1 3.53Å; E1087-R1099 PolarHBondContact OE2-NH1 3.47Å; Y1097-R1099 HydrophobicContact CE2-CB 4.48Å; R1099-D1101 IonicContact CZ-OD2 3.98Å; R1099-D1101 VanDerWaalsContact CZ-OD2 3.29Å; R1099-D1101 IonicContact NE-OD2 3.16Å; R1099-D1101 PolarHBondContact NE-OD2 3.08Å; R1099-D1101 IonicContact NH2-OD2 3.39Å; R1099-D1101 PolarHBondContact NH2-OD2 2.76Å; R1099-L1125 WeakPolarHBondContact CA-O 3.33Å; R1099-L1125 HydrophobicContact CB-CB 4.25Å; R1099-L1125 HydrophobicContact CG-CB 4.4Å
1100	M	90.4	Very high	87.7	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	126.5	168.1	176.5	178.6	60.1	0	0	111.5	T1104 R1109 L1112 I1113 F1124 L1125 L1126 S1127 I1135	M1100-T1104 HydrophobicContact CG-CG2 4.39Å; M1100-R1109 HydrophobicContact CG-CG 4.31Å; M1100-R1109 HydrophobicContact SD-CB 3.69Å; M1100-R1109 HydrophobicContact SD-CG 3.63Å; M1100-L1112 HydrophobicContact CB-CD1 4.47Å; M1100-I1113 HydrophobicContact CE-CD1 4.33Å; M1100-I1113 HydrophobicContact CE-CG1 4.31Å; M1100-F1124 HydrophobicContact CB-CE2 3.69Å; M1100-F1124 HydrophobicContact CB-CZ 4.07Å; M1100-F1124 HydrophobicContact CE-CZ 4.19Å; M1100-L1125 PolarHBondContact N-O 3.4Å; M1100-L1126 HydrophobicContact CB-CD2 4.04Å; M1100-L1126 HydrophobicContact CE-CD2 3.54Å; M1100-S1127 PolarHBondContact O-N 3.22Å; M1100-I1135 HydrophobicContact CE-CD1 3.9Å
1101	D	90.4	Very high	87.4	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	32%	0.324	C	S	.	.			trans	-141.8	-158.8	-178.3	70.5	34.2	0	0	0	113.9	V1080 L1083 R1099 S1103 T1104 R1109	V1080-D1101 WeakPolarHBondContact CG1-OD2 3.44Å; L1083-D1101 HydrophobicContact CD1-CB 4.16Å; R1099-D1101 IonicContact CZ-OD2 3.98Å; R1099-D1101 VanDerWaalsContact CZ-OD2 3.29Å; R1099-D1101 IonicContact NE-OD2 3.16Å; R1099-D1101 PolarHBondContact NE-OD2 3.08Å; R1099-D1101 IonicContact NH2-OD2 3.39Å; R1099-D1101 PolarHBondContact NH2-OD2 2.76Å; D1101-S1103 PolarHBondContact O-N 3.46Å; D1101-S1103 WeakPolarHBondContact OD1-CA 3.39Å; D1101-S1103 WeakPolarHBondContact OD1-CB 3.33Å; D1101-S1103 PolarHBondContact OD1-N 2.84Å; D1101-S1103 PolarHBondContact OD1-OG 2.87Å; D1101-T1104 PolarHBondContact N-OG1 3.48Å; D1101-T1104 VanDerWaalsContact N-OG1 3.13Å; D1101-R1109 PolarHBondContact O-NH2 3.21Å
1102	G	84	Confident	87.3	Confident	30 Å²	30	58.4 Å²	58.4	31%	0.309	31%	0.313	S	S	.	.	S	Bend	trans	-71.9	-6.7	179	0	0	0	0	0	115.5
1103	S	85.2	Confident	87.2	Confident	47 Å²	47	56 Å²	56	33%	0.329	30%	0.3	S	S	.	.	S	Bend	trans	-95	-40.2	-178.2	-34.2	0	0	0	0	111.9	Q380 D1101	Q380-S1103 VanDerWaalsContact NE2-CB 3.27Å; Q380-S1103 PolarHBondContact NE2-OG 2.9Å; D1101-S1103 PolarHBondContact O-N 3.46Å; D1101-S1103 WeakPolarHBondContact OD1-CA 3.39Å; D1101-S1103 WeakPolarHBondContact OD1-CB 3.33Å; D1101-S1103 PolarHBondContact OD1-N 2.84Å; D1101-S1103 PolarHBondContact OD1-OG 2.87Å
1104	T	85.6	Confident	87.1	Confident	19 Å²	19	57.7 Å²	57.7	12%	0.117	31%	0.308	C	S	.	.	S	Bend	trans	-51.3	120.2	-175.4	-45.4	0	0	0	0	111.5	M1100 D1101 E1108 R1109 L1112	M1100-T1104 HydrophobicContact CG-CG2 4.39Å; D1101-T1104 PolarHBondContact N-OG1 3.48Å; D1101-T1104 VanDerWaalsContact N-OG1 3.13Å; T1104-E1108 HydrophobicContact CG2-CB 4.28Å; T1104-R1109 HydrophobicContact CG2-CG 3.99Å; T1104-R1109 VanDerWaalsContact O-CZ 3.28Å; T1104-R1109 PolarHBondContact O-NE 3.16Å; T1104-R1109 PolarHBondContact O-NH2 2.94Å; T1104-L1112 HydrophobicContact CG2-CD1 3.86Å
1105	P	81.9	Confident	87.1	Confident	62 Å²	62	57.8 Å²	57.8	40%	0.403	30%	0.297	S	S	.	.			trans	-51.4	141.6	173.9	-30.4	38.5	0	0	0	112.4	S1107 E1108 R1109	P1105-S1107 VanDerWaalsContact C-N 3.26Å; P1105-S1107 PolarHBondContact O-N 3.22Å; P1105-E1108 HydrophobicContact CB-CG 4.4Å; P1105-E1108 WeakPolarHBondContact CD-OE2 3.26Å; P1105-E1108 VanDerWaalsContact CG-OE1 3.3Å; P1105-E1108 WeakPolarHBondContact CG-OE1 3.42Å; P1105-E1108 PolarHBondContact O-N 2.68Å; P1105-E1108 VanDerWaalsContact O-N 3.13Å; P1105-R1109 WeakPolarHBondContact O-CG 3.47Å; P1105-R1109 PolarHBondContact O-N 2.96Å
1106	V	76	Confident	87.2	Confident	97 Å²	97	54.5 Å²	54.5	59%	0.588	29%	0.285	S	S	*	.	H	α-helix	trans	-61.6	-36.5	-173.2	-179.3	0	0	0	0	111.9	E1108 R1109	V1106-E1108 VanDerWaalsContact C-N 3.3Å; V1106-E1108 PolarHBondContact O-N 3.46Å; V1106-R1109 PolarHBondContact O-N 2.94Å
1107	S	78.8	Confident	86.9	Confident	94 Å²	94	50.9 Å²	50.9	66%	0.657	28%	0.275	S	S	*	.	H	α-helix	trans	-56.1	-37.4	174.9	43.3	0	0	0	0	114.1	P1105	P1105-S1107 VanDerWaalsContact C-N 3.26Å; P1105-S1107 PolarHBondContact O-N 3.22Å
1108	E	84.3	Confident	86.5	Confident	96 Å²	96	53.1 Å²	53.1	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-81.9	-23.8	-176.5	-69.7	161.1	-145.2	0	0	112.7	T1104 P1105 V1106 Q1110 T1111 L1112	T1104-E1108 HydrophobicContact CG2-CB 4.28Å; P1105-E1108 HydrophobicContact CB-CG 4.4Å; P1105-E1108 WeakPolarHBondContact CD-OE2 3.26Å; P1105-E1108 VanDerWaalsContact CG-OE1 3.3Å; P1105-E1108 WeakPolarHBondContact CG-OE1 3.42Å; P1105-E1108 PolarHBondContact O-N 2.68Å; P1105-E1108 VanDerWaalsContact O-N 3.13Å; V1106-E1108 VanDerWaalsContact C-N 3.3Å; V1106-E1108 PolarHBondContact O-N 3.46Å; E1108-Q1110 VanDerWaalsContact C-N 3.34Å; E1108-Q1110 PolarHBondContact O-N 3.3Å; E1108-T1111 WeakPolarHBondContact O-CB 3.41Å; E1108-T1111 PolarHBondContact O-N 2.71Å; E1108-L1112 WeakPolarHBondContact O-CG 3.37Å; E1108-L1112 PolarHBondContact O-N 2.7Å
1109	R	84	Confident	85.8	Confident	39 Å²	39	54.2 Å²	54.2	15%	0.147	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-43.9	-172.9	-65.2	175.1	-174	-121.8	-16.1	112.3	M1100 D1101 T1104 P1105 V1106 L1112 I1113	M1100-R1109 HydrophobicContact CG-CG 4.31Å; M1100-R1109 HydrophobicContact SD-CB 3.69Å; M1100-R1109 HydrophobicContact SD-CG 3.63Å; D1101-R1109 PolarHBondContact O-NH2 3.21Å; T1104-R1109 HydrophobicContact CG2-CG 3.99Å; T1104-R1109 VanDerWaalsContact O-CZ 3.28Å; T1104-R1109 PolarHBondContact O-NE 3.16Å; T1104-R1109 PolarHBondContact O-NH2 2.94Å; P1105-R1109 WeakPolarHBondContact O-CG 3.47Å; P1105-R1109 PolarHBondContact O-N 2.96Å; V1106-R1109 PolarHBondContact O-N 2.94Å; R1109-L1112 PolarHBondContact O-N 3.03Å; R1109-I1113 VanDerWaalsContact O-CD1 3.25Å; R1109-I1113 WeakPolarHBondContact O-CD1 3.43Å; R1109-I1113 WeakPolarHBondContact O-CG1 3.45Å; R1109-I1113 PolarHBondContact O-N 3.46Å
1110	Q	82.2	Confident	85.5	Confident	63 Å²	63	56.1 Å²	56.1	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-48	178.2	-173.3	60.4	65.3	0	0	110.2	E1108 L1112 I1113 D1114	E1108-Q1110 VanDerWaalsContact C-N 3.34Å; E1108-Q1110 PolarHBondContact O-N 3.3Å; Q1110-L1112 VanDerWaalsContact C-N 3.31Å; Q1110-L1112 PolarHBondContact O-N 2.88Å; Q1110-I1113 WeakPolarHBondContact O-CB 3.27Å; Q1110-I1113 PolarHBondContact O-N 3.16Å; Q1110-I1113 VanDerWaalsContact O-N 3.11Å; Q1110-D1114 WeakPolarHBondContact CG-OD2 3.4Å; Q1110-D1114 PolarHBondContact NE2-OD1 3.24Å; Q1110-D1114 PolarHBondContact NE2-OD2 3.19Å; Q1110-D1114 VanDerWaalsContact O-CG 3.28Å; Q1110-D1114 PolarHBondContact O-N 3.21Å
1111	T	88	Confident	85.4	Confident	96 Å²	96	56.7 Å²	56.7	59%	0.589	33%	0.33	S	S	*	.	H	α-helix	trans	-57.5	-39.4	176.1	-41.8	0	0	0	0	112.9	E1108 R1115	E1108-T1111 WeakPolarHBondContact O-CB 3.41Å; E1108-T1111 PolarHBondContact O-N 2.71Å; T1111-R1115 WeakPolarHBondContact O-CB 3.22Å; T1111-R1115 PolarHBondContact O-N 2.96Å
1112	L	89.5	Confident	85.5	Confident	37 Å²	37	57.8 Å²	57.8	19%	0.194	34%	0.335	C	S	.	.	H	α-helix	trans	-68.9	-38.9	175.9	-66.6	179.9	0	0	0	112.8	I1098 M1100 T1104 E1108 R1109 Q1110 F1116	I1098-L1112 HydrophobicContact CG2-CB 4.15Å; I1098-L1112 HydrophobicContact CG2-CD1 4.4Å; I1098-L1112 HydrophobicContact CG2-CD2 4.07Å; I1098-L1112 HydrophobicContact CG2-CG 4.43Å; M1100-L1112 HydrophobicContact CB-CD1 4.47Å; T1104-L1112 HydrophobicContact CG2-CD1 3.86Å; E1108-L1112 WeakPolarHBondContact O-CG 3.37Å; E1108-L1112 PolarHBondContact O-N 2.7Å; R1109-L1112 PolarHBondContact O-N 3.03Å; Q1110-L1112 VanDerWaalsContact C-N 3.31Å; Q1110-L1112 PolarHBondContact O-N 2.88Å; L1112-F1116 WeakPolarHBondContact O-CB 3.4Å; L1112-F1116 PolarHBondContact O-N 3.28Å
1113	I	87.3	Confident	86	Confident	7 Å²	7	56.4 Å²	56.4	4%	0.036	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-46.7	176.1	-69.1	157.4	0	0	0	110.5	M1100 R1109 Q1110 F1116 N1117 I1135 N1136 L1137	M1100-I1113 HydrophobicContact CE-CD1 4.33Å; M1100-I1113 HydrophobicContact CE-CG1 4.31Å; R1109-I1113 VanDerWaalsContact O-CD1 3.25Å; R1109-I1113 WeakPolarHBondContact O-CD1 3.43Å; R1109-I1113 WeakPolarHBondContact O-CG1 3.45Å; R1109-I1113 PolarHBondContact O-N 3.46Å; Q1110-I1113 WeakPolarHBondContact O-CB 3.27Å; Q1110-I1113 PolarHBondContact O-N 3.16Å; Q1110-I1113 VanDerWaalsContact O-N 3.11Å; I1113-F1116 PolarHBondContact O-N 2.85Å; I1113-N1117 PolarHBondContact O-N 3.16Å; I1113-N1117 PolarHBondContact O-ND2 3.36Å; I1113-I1135 HydrophobicContact CD1-CB 3.79Å; I1113-I1135 HydrophobicContact CD1-CG2 3.45Å; I1113-I1135 VanDerWaalsContact CD1-CG2 3.45Å; I1113-N1136 WeakPolarHBondContact CG2-O 3.3Å; I1113-L1137 HydrophobicContact CG1-CD2 4.32Å; I1113-L1137 HydrophobicContact CG2-CD2 4.21Å
1114	D	87.2	Confident	86.5	Confident	76 Å²	76	54.1 Å²	54.1	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-69	-38.1	-179.1	-62.5	-29.4	0	0	0	110.9	Q1110 N1117 S1118	Q1110-D1114 WeakPolarHBondContact CG-OD2 3.4Å; Q1110-D1114 PolarHBondContact NE2-OD1 3.24Å; Q1110-D1114 PolarHBondContact NE2-OD2 3.19Å; Q1110-D1114 VanDerWaalsContact O-CG 3.28Å; Q1110-D1114 PolarHBondContact O-N 3.21Å; D1114-N1117 PolarHBondContact O-N 2.9Å; D1114-S1118 VanDerWaalsContact O-CB 3.29Å; D1114-S1118 WeakPolarHBondContact O-CB 3.32Å; D1114-S1118 PolarHBondContact O-N 3.3Å; D1114-S1118 PolarHBondContact O-OG 2.96Å
1115	R	91	Very high	86.9	Confident	149 Å²	149	53.2 Å²	53.2	56%	0.562	30%	0.299	S	S	*	.	H	α-helix	trans	-58.9	-45.8	169.1	-175.4	178.7	-179.4	173.5	1.9	111.5	I1098 T1111 S1118 S1119 I1121	I1098-R1115 HydrophobicContact CD1-CB 4.35Å; I1098-R1115 HydrophobicContact CD1-CG 4.06Å; T1111-R1115 WeakPolarHBondContact O-CB 3.22Å; T1111-R1115 PolarHBondContact O-N 2.96Å; R1115-S1118 PolarHBondContact O-OG 3.06Å; R1115-S1119 WeakPolarHBondContact O-CB 3.14Å; R1115-S1119 PolarHBondContact O-N 3Å; R1115-S1119 PolarHBondContact O-OG 3.14Å; R1115-I1121 HydrophobicContact CG-CD1 4.34Å
1116	F	91.1	Very high	87.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-44.1	178.8	179.1	-101.6	0	0	0	112.5	R1072 L1074 I1098 L1112 I1113 I1121 F1124 L1137 A1140	R1072-F1116 HydrophobicContact CB-CZ 4.22Å; R1072-F1116 PolarHBondContact NH1-O 3.03Å; L1074-F1116 HydrophobicContact CD2-CE1 3.85Å; L1074-F1116 HydrophobicContact CD2-CZ 3.91Å; I1098-F1116 HydrophobicContact CD1-CB 4.08Å; L1112-F1116 WeakPolarHBondContact O-CB 3.4Å; L1112-F1116 PolarHBondContact O-N 3.28Å; I1113-F1116 PolarHBondContact O-N 2.85Å; F1116-I1121 HydrophobicContact CD2-CG2 4.36Å; F1116-F1124 HydrophobicContact CB-CD1 3.76Å; F1116-F1124 HydrophobicContact CB-CE1 3.83Å; F1116-F1124 AromaticContact CD1-CD1 3.71Å; F1116-F1124 HydrophobicContact CD1-CD1 3.71Å; F1116-F1124 HydrophobicContact CD1-CE1 4.34Å; F1116-F1124 HydrophobicContact CD2-CB 3.96Å; F1116-F1124 AromaticContact CD2-CD1 3.82Å; F1116-F1124 HydrophobicContact CD2-CD1 3.82Å; F1116-F1124 HydrophobicContact CD2-CG 4.23Å; F1116-F1124 HydrophobicContact CE1-CD1 4.26Å; F1116-F1124 HydrophobicContact CE2-CB 3.85Å; F1116-F1124 HydrophobicContact CE2-CD1 4.37Å; F1116-F1124 HydrophobicContact CG-CB 4.43Å; F1116-F1124 AromaticContact CG-CD1 3.45Å; F1116-F1124 HydrophobicContact CG-CD1 3.45Å; F1116-F1124 VanDerWaalsContact CG-CD1 3.45Å; F1116-F1124 HydrophobicContact CG-CE1 4.04Å; F1116-F1124 HydrophobicContact CG-CG 4.31Å; F1116-F1124 HydrophobicContact CZ-CB 4.21Å; F1116-L1137 HydrophobicContact CD1-CD2 4.26Å; F1116-A1140 HydrophobicContact CE1-CB 3.85Å; F1116-A1140 HydrophobicContact CZ-CB 3.98Å
1117	N	87.1	Confident	88.2	Confident	41 Å²	41	46.1 Å²	46.1	22%	0.219	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-38.8	179.9	-72.4	-38.7	0	0	0	112.3	R1072 I1113 D1114 N1136 G1139	R1072-N1117 PolarHBondContact NH1-O 3.16Å; I1113-N1117 PolarHBondContact O-N 3.16Å; I1113-N1117 PolarHBondContact O-ND2 3.36Å; D1114-N1117 PolarHBondContact O-N 2.9Å; N1117-N1136 PolarHBondContact ND2-O 3.36Å; N1117-G1139 PolarHBondContact OD1-N 3.5Å; N1117-G1139 VanDerWaalsContact OD1-N 3.11Å
1118	S	85.7	Confident	88.5	Confident	102 Å²	102	41.7 Å²	41.7	71%	0.713	22%	0.224	S	C	*	.	H	α-helix	trans	-86.5	-25.9	-177	59.7	0	0	0	0	115.5	D1114 R1115	D1114-S1118 VanDerWaalsContact O-CB 3.29Å; D1114-S1118 WeakPolarHBondContact O-CB 3.32Å; D1114-S1118 PolarHBondContact O-N 3.3Å; D1114-S1118 PolarHBondContact O-OG 2.96Å; R1115-S1118 PolarHBondContact O-OG 3.06Å
1119	S	78.7	Confident	88.2	Confident	33 Å²	33	45.1 Å²	45.1	23%	0.231	23%	0.233	C	C	.	.	S	Bend	trans	-100.3	167.1	-174.5	73.7	0	0	0	0	114	R1072 R1115 I1121	R1072-S1119 PolarHBondContact NH1-O 2.87Å; R1115-S1119 WeakPolarHBondContact O-CB 3.14Å; R1115-S1119 PolarHBondContact O-N 3Å; R1115-S1119 PolarHBondContact O-OG 3.14Å; S1119-I1121 PolarHBondContact O-N 2.76Å; S1119-I1121 WeakPolarHBondContact OG-CD1 3.18Å; S1119-I1121 WeakPolarHBondContact OG-CG1 3.46Å
1120	S	86.1	Confident	87.8	Confident	85 Å²	85	43.4 Å²	43.4	59%	0.594	23%	0.227	S	C	*	.			trans	-79.8	22.6	177.4	61.1	0	0	0	0	114.2	R1096	R1096-S1120 PolarHBondContact NH1-O 3.39Å; R1096-S1120 PolarHBondContact NH1-OG 3.4Å; R1096-S1120 PolarHBondContact NH2-O 3.23Å
1121	I	89.7	Confident	87	Confident	14 Å²	14	40.4 Å²	40.4	7%	0.072	21%	0.213	C	C	.	.			trans	-72	132.9	-177	-71.4	171.9	0	0	0	110.6	R1072 I1098 R1115 F1116 S1119	R1072-I1121 WeakPolarHBondContact CD-O 3.44Å; I1098-I1121 HydrophobicContact CD1-CD1 3.63Å; I1098-I1121 HydrophobicContact CD1-CG2 4.32Å; I1098-I1121 HydrophobicContact CG1-CD1 3.94Å; I1098-I1121 HydrophobicContact CG1-CG2 4.23Å; R1115-I1121 HydrophobicContact CG-CD1 4.34Å; F1116-I1121 HydrophobicContact CD2-CG2 4.36Å; S1119-I1121 PolarHBondContact O-N 2.76Å; S1119-I1121 WeakPolarHBondContact OG-CD1 3.18Å; S1119-I1121 WeakPolarHBondContact OG-CG1 3.46Å
1122	E	91.9	Very high	85.7	Confident	27 Å²	27	36.4 Å²	36.4	13%	0.126	19%	0.191	C	C	.	.			trans	-77.9	-42.5	-169	-67.6	144	-111.5	0	0	112.7	I1067 I1073 R1095 R1096	I1067-E1122 HydrophobicContact CD1-CB 4.02Å; I1067-E1122 HydrophobicContact CD1-CG 4.41Å; I1067-E1122 HydrophobicContact CG1-CB 4.27Å; I1067-E1122 HydrophobicContact CG1-CG 4.5Å; I1067-E1122 HydrophobicContact CG2-CG 3.83Å; I1073-E1122 PolarHBondContact N-O 3.15Å; R1095-E1122 WeakPolarHBondContact CD-OE2 3.37Å; R1095-E1122 IonicContact NH1-OE2 3.2Å; R1095-E1122 PolarHBondContact NH1-OE2 3.38Å; R1095-E1122 VanDerWaalsContact NH1-OE2 3.07Å; R1096-E1122 IonicContact CZ-OE1 2.79Å; R1096-E1122 IonicContact NE-OE1 2.63Å; R1096-E1122 PolarHBondContact NE-OE1 3.23Å; R1096-E1122 IonicContact NH2-OE1 2.68Å; R1096-E1122 PolarHBondContact NH2-OE1 3.19Å; R1096-E1122 PolarHBondContact O-N 2.83Å
1123	V	94.8	Very high	84.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	138	-168.6	-174.4	0	0	0	0	112.9	L1063 I1067 I1073 I1075 L1090 R1096 Y1097 I1098 L1125	L1063-V1123 HydrophobicContact CD1-CG2 4.39Å; L1063-V1123 HydrophobicContact CD2-CG2 4.39Å; I1067-V1123 HydrophobicContact CD1-CG2 4.27Å; I1073-V1123 CarbonylContact O-C 3.59Å; I1073-V1123 WeakPolarHBondContact O-CA 3.47Å; I1075-V1123 HydrophobicContact CD1-CG1 3.74Å; I1075-V1123 HydrophobicContact CG1-CG1 4.04Å; L1090-V1123 HydrophobicContact CD1-CB 4.35Å; L1090-V1123 HydrophobicContact CD1-CG1 3.87Å; L1090-V1123 HydrophobicContact CD2-CG2 4.37Å; R1096-V1123 PolarHBondContact O-N 3.08Å; Y1097-V1123 CarbonylContact C-O 3.55Å; Y1097-V1123 VanDerWaalsContact CA-O 3.22Å; Y1097-V1123 WeakPolarHBondContact CA-O 3.12Å; I1098-V1123 PolarHBondContact N-O 3.26Å; V1123-L1125 HydrophobicContact CG1-CD2 4.32Å
1124	F	94.8	Very high	83.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	108.5	170.9	-158.1	161.7	0	0	0	110.9	I1073 L1074 I1075 I1098 M1100 F1116 L1126 L1137	I1073-F1124 PolarHBondContact O-N 3.3Å; L1074-F1124 HydrophobicContact CD2-CB 3.71Å; L1074-F1124 HydrophobicContact CD2-CD1 4.25Å; L1074-F1124 HydrophobicContact CD2-CG 4.35Å; I1075-F1124 PolarHBondContact N-O 2.81Å; I1098-F1124 HydrophobicContact CB-CD2 4.09Å; I1098-F1124 HydrophobicContact CB-CE2 4.24Å; I1098-F1124 HydrophobicContact CB-CG 4.48Å; I1098-F1124 HydrophobicContact CG2-CD2 3.86Å; I1098-F1124 HydrophobicContact CG2-CE2 3.5Å; I1098-F1124 VanDerWaalsContact CG2-CE2 3.5Å; I1098-F1124 HydrophobicContact CG2-CZ 3.88Å; I1098-F1124 CarbonylContact O-C 3.41Å; I1098-F1124 WeakPolarHBondContact O-CA 3.47Å; I1098-F1124 WeakPolarHBondContact O-CD2 3.31Å; M1100-F1124 HydrophobicContact CB-CE2 3.69Å; M1100-F1124 HydrophobicContact CB-CZ 4.07Å; M1100-F1124 HydrophobicContact CE-CZ 4.19Å; F1116-F1124 HydrophobicContact CB-CD1 3.76Å; F1116-F1124 HydrophobicContact CB-CE1 3.83Å; F1116-F1124 AromaticContact CD1-CD1 3.71Å; F1116-F1124 HydrophobicContact CD1-CD1 3.71Å; F1116-F1124 HydrophobicContact CD1-CE1 4.34Å; F1116-F1124 HydrophobicContact CD2-CB 3.96Å; F1116-F1124 AromaticContact CD2-CD1 3.82Å; F1116-F1124 HydrophobicContact CD2-CD1 3.82Å; F1116-F1124 HydrophobicContact CD2-CG 4.23Å; F1116-F1124 HydrophobicContact CE1-CD1 4.26Å; F1116-F1124 HydrophobicContact CE2-CB 3.85Å; F1116-F1124 HydrophobicContact CE2-CD1 4.37Å; F1116-F1124 HydrophobicContact CG-CB 4.43Å; F1116-F1124 AromaticContact CG-CD1 3.45Å; F1116-F1124 HydrophobicContact CG-CD1 3.45Å; F1116-F1124 VanDerWaalsContact CG-CD1 3.45Å; F1116-F1124 HydrophobicContact CG-CE1 4.04Å; F1116-F1124 HydrophobicContact CG-CG 4.31Å; F1116-F1124 HydrophobicContact CZ-CB 4.21Å; F1124-L1126 HydrophobicContact CD1-CD1 4.46Å; F1124-L1126 HydrophobicContact CD2-CD1 4.34Å; F1124-L1126 HydrophobicContact CD2-CD2 3.82Å; F1124-L1126 HydrophobicContact CD2-CG 3.78Å; F1124-L1126 HydrophobicContact CE1-CD2 4.48Å; F1124-L1126 HydrophobicContact CE2-CD2 3.54Å; F1124-L1126 HydrophobicContact CE2-CG 4.06Å; F1124-L1126 HydrophobicContact CG-CD1 4.21Å; F1124-L1126 HydrophobicContact CG-CD2 4.4Å; F1124-L1126 HydrophobicContact CG-CG 4.14Å; F1124-L1126 HydrophobicContact CZ-CD2 3.93Å; F1124-L1137 HydrophobicContact CD1-CD2 3.96Å; F1124-L1137 HydrophobicContact CE1-CD2 3.67Å
1125	L	95.2	Very high	83	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	120.7	171.5	-62.6	-174.2	0	0	0	111	I1075 L1083 L1086 E1087 L1090 Y1097 I1098 R1099 M1100 V1123	I1075-L1125 HydrophobicContact CB-CD2 3.99Å; I1075-L1125 HydrophobicContact CD1-CD2 4.2Å; I1075-L1125 HydrophobicContact CG1-CD2 4.49Å; I1075-L1125 HydrophobicContact CG2-CD2 4.47Å; L1083-L1125 HydrophobicContact CD2-CB 4.4Å; L1086-L1125 HydrophobicContact CB-CD1 4.14Å; L1086-L1125 HydrophobicContact CB-CD2 4.04Å; L1086-L1125 HydrophobicContact CD1-CD2 4.43Å; E1087-L1125 HydrophobicContact CB-CD1 4.43Å; E1087-L1125 HydrophobicContact CG-CD1 3.6Å; L1090-L1125 HydrophobicContact CD1-CD1 4.07Å; L1090-L1125 HydrophobicContact CD1-CD2 3.88Å; L1090-L1125 HydrophobicContact CD1-CG 4.02Å; Y1097-L1125 HydrophobicContact CD2-CD1 4.22Å; Y1097-L1125 HydrophobicContact CE2-CD1 4.47Å; I1098-L1125 PolarHBondContact O-N 2.83Å; R1099-L1125 WeakPolarHBondContact CA-O 3.33Å; R1099-L1125 HydrophobicContact CB-CB 4.25Å; R1099-L1125 HydrophobicContact CG-CB 4.4Å; M1100-L1125 PolarHBondContact N-O 3.4Å; V1123-L1125 HydrophobicContact CG1-CD2 4.32Å
1126	L	93.4	Very high	82.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.7	-175	-71	164.8	0	0	0	110.8	L1074 I1075 F1076 S1077 M1100 F1124 L1137	L1074-L1126 HydrophobicContact CB-CD1 4.36Å; L1074-L1126 HydrophobicContact CD1-CD1 4.38Å; L1074-L1126 HydrophobicContact CD2-CD1 4.1Å; I1075-L1126 PolarHBondContact O-N 3.24Å; F1076-L1126 VanDerWaalsContact CA-O 3.31Å; F1076-L1126 WeakPolarHBondContact CA-O 3.43Å; F1076-L1126 HydrophobicContact CD1-CB 3.47Å; F1076-L1126 VanDerWaalsContact CD1-CB 3.47Å; F1076-L1126 HydrophobicContact CD1-CD1 4.28Å; F1076-L1126 HydrophobicContact CD1-CG 4.5Å; F1076-L1126 HydrophobicContact CE1-CB 3.42Å; F1076-L1126 VanDerWaalsContact CE1-CB 3.42Å; F1076-L1126 HydrophobicContact CE1-CD1 3.44Å; F1076-L1126 VanDerWaalsContact CE1-CD1 3.44Å; F1076-L1126 HydrophobicContact CE1-CG 4.02Å; F1076-L1126 HydrophobicContact CE2-CD1 4.45Å; F1076-L1126 HydrophobicContact CG-CB 4.4Å; F1076-L1126 HydrophobicContact CZ-CB 4.34Å; F1076-L1126 HydrophobicContact CZ-CD1 3.57Å; S1077-L1126 PolarHBondContact N-O 3.38Å; S1077-L1126 VanDerWaalsContact N-O 3.08Å; M1100-L1126 HydrophobicContact CB-CD2 4.04Å; M1100-L1126 HydrophobicContact CE-CD2 3.54Å; F1124-L1126 HydrophobicContact CD1-CD1 4.46Å; F1124-L1126 HydrophobicContact CD2-CD1 4.34Å; F1124-L1126 HydrophobicContact CD2-CD2 3.82Å; F1124-L1126 HydrophobicContact CD2-CG 3.78Å; F1124-L1126 HydrophobicContact CE1-CD2 4.48Å; F1124-L1126 HydrophobicContact CE2-CD2 3.54Å; F1124-L1126 HydrophobicContact CE2-CG 4.06Å; F1124-L1126 HydrophobicContact CG-CD1 4.21Å; F1124-L1126 HydrophobicContact CG-CD2 4.4Å; F1124-L1126 HydrophobicContact CG-CG 4.14Å; F1124-L1126 HydrophobicContact CZ-CD2 3.93Å; L1126-L1137 HydrophobicContact CD1-CD1 3.55Å
1127	S	91.7	Very high	82.2	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.063	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.8	161.9	-179.3	0	0	0	0	108.7	S1077 M1100 R1129 A1130 G1131	S1077-S1127 VanDerWaalsContact O-CA 3.28Å; S1077-S1127 WeakPolarHBondContact O-CA 3.33Å; S1077-S1127 PolarHBondContact O-OG 2.74Å; M1100-S1127 PolarHBondContact O-N 3.22Å; S1127-R1129 PolarHBondContact O-N 3.04Å; S1127-A1130 CarbonylContact O-C 3.57Å; S1127-A1130 WeakPolarHBondContact O-CA 3.41Å; S1127-A1130 WeakPolarHBondContact O-CB 3.4Å; S1127-A1130 PolarHBondContact O-N 3.06Å; S1127-G1131 PolarHBondContact O-N 3Å
1128	T	85	Confident	82.1	Confident	2 Å²	2	30 Å²	30	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-52.1	-37	-177.2	-41.3	0	0	0	0	112.3	S1077 Q1078 A1130 G1131 G1132 D1155 A1158	S1077-T1128 PolarHBondContact O-N 3.24Å; S1077-T1128 PolarHBondContact O-OG1 3.26Å; Q1078-T1128 PolarHBondContact NE2-OG1 2.94Å; T1128-A1130 VanDerWaalsContact C-N 3.34Å; T1128-A1130 PolarHBondContact O-N 3.35Å; T1128-G1131 PolarHBondContact O-N 2.97Å; T1128-G1132 PolarHBondContact O-N 2.83Å; T1128-D1155 WeakPolarHBondContact CG2-OD1 3.42Å; T1128-A1158 HydrophobicContact CG2-CB 4.07Å
1129	R	78	Confident	82.2	Confident	168 Å²	168	25.6 Å²	25.6	63%	0.634	15%	0.145	S	C	*	.	H	α-helix	trans	-79.8	-9.3	178.7	-58.2	179.9	-175.5	-155.4	-8.1	115	S1127 D1149	S1127-R1129 PolarHBondContact O-N 3.04Å; R1129-D1149 IonicContact NH2-OD2 2.67Å
1130	A	74.5	Confident	82.8	Confident	3 Å²	3	24 Å²	24	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-99.4	-31.3	169.4	0	0	0	0	0	111.5	S1127 T1128 L1133	S1127-A1130 CarbonylContact O-C 3.57Å; S1127-A1130 WeakPolarHBondContact O-CA 3.41Å; S1127-A1130 WeakPolarHBondContact O-CB 3.4Å; S1127-A1130 PolarHBondContact O-N 3.06Å; T1128-A1130 VanDerWaalsContact C-N 3.34Å; T1128-A1130 PolarHBondContact O-N 3.35Å; A1130-L1133 WeakPolarHBondContact O-CD1 3.33Å; A1130-L1133 VanDerWaalsContact O-CG 3.24Å; A1130-L1133 WeakPolarHBondContact O-CG 3.25Å
1131	G	65.6	Low	83.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-73.3	-39.3	173.6	0	0	0	0	0	114.1	S1127 T1128 L1133 I1135	S1127-G1131 PolarHBondContact O-N 3Å; T1128-G1131 PolarHBondContact O-N 2.97Å; G1131-L1133 PolarHBondContact O-N 3.45Å; G1131-I1135 VanDerWaalsContact O-CD1 3.3Å; G1131-I1135 WeakPolarHBondContact O-CD1 3.49Å; G1131-I1135 WeakPolarHBondContact O-CG1 3.42Å
1132	G	62.1	Low	83.4	Confident	11 Å²	11	19.7 Å²	19.7	11%	0.113	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-1.3	177.9	0	0	0	0	0	115.4	T1128 Q1157 R1161	T1128-G1132 PolarHBondContact O-N 2.83Å; G1132-Q1157 PolarHBondContact O-OE1 3.15Å; G1132-R1161 PolarHBondContact O-NH2 3.36Å
1133	L	65.1	Low	83.6	Confident	47 Å²	47	18.4 Å²	18.4	25%	0.246	10%	0.098	C	C	.	.	S	Bend	trans	-71.2	179.7	172.4	-53.4	-178.4	0	0	0	111.2	A1130 G1131 I1135 R1161	A1130-L1133 WeakPolarHBondContact O-CD1 3.33Å; A1130-L1133 VanDerWaalsContact O-CG 3.24Å; A1130-L1133 WeakPolarHBondContact O-CG 3.25Å; G1131-L1133 PolarHBondContact O-N 3.45Å; L1133-I1135 PolarHBondContact O-N 3Å; L1133-R1161 PolarHBondContact O-NE 3.16Å; L1133-R1161 VanDerWaalsContact O-NE 3.11Å; L1133-R1161 PolarHBondContact O-NH1 2.78Å; L1133-R1161 PolarHBondContact O-NH2 3.17Å
1134	G	62.4	Low	83.6	Confident	21 Å²	21	18.4 Å²	18.4	22%	0.216	10%	0.098	C	C	.	.	S	Bend	trans	-69	26.6	-170	0	0	0	0	0	117.9
1135	I	78.2	Confident	83.7	Confident	20 Å²	20	18.4 Å²	18.4	10%	0.103	10%	0.098	C	C	.	.			trans	-80.9	168.7	-168.9	69.3	-179.5	0	0	0	113	M1100 I1113 G1131 L1133 L1137 R1161 R1164	M1100-I1135 HydrophobicContact CE-CD1 3.9Å; I1113-I1135 HydrophobicContact CD1-CB 3.79Å; I1113-I1135 HydrophobicContact CD1-CG2 3.45Å; I1113-I1135 VanDerWaalsContact CD1-CG2 3.45Å; G1131-I1135 VanDerWaalsContact O-CD1 3.3Å; G1131-I1135 WeakPolarHBondContact O-CD1 3.49Å; G1131-I1135 WeakPolarHBondContact O-CG1 3.42Å; L1133-I1135 PolarHBondContact O-N 3Å; I1135-L1137 HydrophobicContact CD1-CD1 3.57Å; I1135-L1137 HydrophobicContact CD1-CD2 4.49Å; I1135-L1137 HydrophobicContact CD1-CG 3.94Å; I1135-L1137 HydrophobicContact CG1-CD1 4.28Å; I1135-L1137 HydrophobicContact CG1-CG 4.22Å; I1135-R1161 HydrophobicContact CG1-CB 4.23Å; I1135-R1161 HydrophobicContact CG1-CG 4.1Å; I1135-R1164 PolarHBondContact O-NH1 3.49Å; I1135-R1164 VanDerWaalsContact O-NH1 3.14Å
1136	N	82.2	Confident	83.6	Confident	56 Å²	56	18.4 Å²	18.4	30%	0.299	10%	0.098	S	C	.	.			trans	-132	115.7	175.6	-165.5	64.1	0	0	0	109.8	I1113 N1117 T1138 R1164	I1113-N1136 WeakPolarHBondContact CG2-O 3.3Å; N1117-N1136 PolarHBondContact ND2-O 3.36Å; N1136-T1138 PolarHBondContact ND2-OG1 3.13Å; N1136-T1138 VanDerWaalsContact ND2-OG1 3.11Å; N1136-R1164 WeakPolarHBondContact OD1-CD 3.29Å
1137	L	84.5	Confident	83.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.098	C	C	.	.			trans	-122.9	39.4	-173.5	-64.4	176.3	0	0	0	111.4	L1074 I1113 F1116 F1124 L1126 I1135 G1139 A1140 R1161	L1074-L1137 HydrophobicContact CD1-CB 4.03Å; L1074-L1137 HydrophobicContact CD1-CD1 3.69Å; L1074-L1137 HydrophobicContact CD2-CD1 4.09Å; I1113-L1137 HydrophobicContact CG1-CD2 4.32Å; I1113-L1137 HydrophobicContact CG2-CD2 4.21Å; F1116-L1137 HydrophobicContact CD1-CD2 4.26Å; F1124-L1137 HydrophobicContact CD1-CD2 3.96Å; F1124-L1137 HydrophobicContact CE1-CD2 3.67Å; L1126-L1137 HydrophobicContact CD1-CD1 3.55Å; I1135-L1137 HydrophobicContact CD1-CD1 3.57Å; I1135-L1137 HydrophobicContact CD1-CD2 4.49Å; I1135-L1137 HydrophobicContact CD1-CG 3.94Å; I1135-L1137 HydrophobicContact CG1-CD1 4.28Å; I1135-L1137 HydrophobicContact CG1-CG 4.22Å; L1137-G1139 PolarHBondContact O-N 3.25Å; L1137-A1140 PolarHBondContact O-N 2.96Å; L1137-A1140 VanDerWaalsContact O-N 3.13Å; L1137-R1161 PolarHBondContact N-O 3.23Å
1138	T	84.5	Confident	83.6	Confident	31 Å²	31	18.1 Å²	18.1	19%	0.19	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-0.7	179.4	50.9	0	0	0	0	114	N1136 R1164 Q1167	N1136-T1138 PolarHBondContact ND2-OG1 3.13Å; N1136-T1138 VanDerWaalsContact ND2-OG1 3.11Å; T1138-R1164 HydrophobicContact CG2-CB 4.31Å; T1138-Q1167 HydrophobicContact CG2-CB 4.44Å
1139	G	87.5	Confident	83.8	Confident	11 Å²	11	18.4 Å²	18.4	11%	0.113	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-29.8	167.3	0	0	0	0	0	113.9	R1072 N1117 L1137	R1072-G1139 PolarHBondContact NE-O 2.66Å; R1072-G1139 VanDerWaalsContact NH2-CA 3.28Å; R1072-G1139 PolarHBondContact NH2-O 2.9Å; N1117-G1139 PolarHBondContact OD1-N 3.5Å; N1117-G1139 VanDerWaalsContact OD1-N 3.11Å; L1137-G1139 PolarHBondContact O-N 3.25Å
1140	A	92.3	Very high	83.9	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	8%	0.075	C	C	.	.			trans	-81.2	158	175.9	0	0	0	0	0	111.7	R1072 L1074 F1116 L1137 C1162 Q1167	R1072-A1140 WeakPolarHBondContact O-CA 3.35Å; R1072-A1140 VanDerWaalsContact O-CB 3.32Å; R1072-A1140 WeakPolarHBondContact O-CB 3.44Å; L1074-A1140 HydrophobicContact CD1-CB 4.03Å; L1074-A1140 HydrophobicContact CD2-CB 3.62Å; L1074-A1140 HydrophobicContact CG-CB 3.5Å; F1116-A1140 HydrophobicContact CE1-CB 3.85Å; F1116-A1140 HydrophobicContact CZ-CB 3.98Å; L1137-A1140 PolarHBondContact O-N 2.96Å; L1137-A1140 VanDerWaalsContact O-N 3.13Å; A1140-C1162 PolarHBondContact O-SG 3.37Å; A1140-Q1167 PolarHBondContact O-NE2 2.87Å
1141	D	93.3	Very high	84.1	Confident	5 Å²	5	12.8 Å²	12.8	3%	0.027	8%	0.078	C	C	.	.			trans	-125.3	-33.9	170.5	50.7	12.6	0	0	0	112.2	H1071 R1072 N1169 V1171 H1172	H1071-D1141 WeakPolarHBondContact CA-OD1 3.23Å; H1071-D1141 WeakPolarHBondContact CB-OD1 3.47Å; H1071-D1141 IonicContact CE1-OD2 2.82Å; H1071-D1141 IonicContact CG-OD1 3.82Å; H1071-D1141 IonicContact CG-OD2 2.72Å; H1071-D1141 IonicContact ND1-OD1 2.85Å; H1071-D1141 IonicContact ND1-OD2 3.55Å; H1071-D1141 PolarHBondContact ND1-OD2 3Å; R1072-D1141 PolarHBondContact N-OD1 3.34Å; R1072-D1141 PolarHBondContact O-N 2.76Å; R1072-D1141 VanDerWaalsContact O-N 3.08Å; R1072-D1141 VanDerWaalsContact O-OD1 3.14Å; D1141-N1169 HydrophobicContact CB-CB 3.72Å; D1141-N1169 PolarHBondContact OD2-ND2 3.27Å; D1141-V1171 VanDerWaalsContact O-CA 3.31Å; D1141-V1171 WeakPolarHBondContact O-CA 3.36Å; D1141-H1172 PolarHBondContact O-N 3Å
1142	T	95	Very high	84.9	Confident	2 Å²	2	13.6 Å²	13.6	1%	0.012	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136	178	-54.3	0	0	0	0	111.9	L1066 R1072 I1073 L1074 I1144 H1172 I1174	L1066-T1142 HydrophobicContact CD1-CG2 4.33Å; R1072-T1142 PolarHBondContact O-N 3.19Å; I1073-T1142 WeakPolarHBondContact CA-O 3.48Å; I1073-T1142 HydrophobicContact CG2-CG2 4.31Å; L1074-T1142 PolarHBondContact N-O 2.7Å; T1142-I1144 HydrophobicContact CG2-CG1 4.38Å; T1142-H1172 WeakPolarHBondContact CA-O 3.35Å; T1142-I1174 HydrophobicContact CG2-CD1 4.38Å
1143	V	95.1	Very high	85.7	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	112.8	-179.6	178.6	0	0	0	0	110.5	L1074 F1076 I1145 E1159 C1162 V1171 H1172 V1173 I1174	L1074-V1143 HydrophobicContact CB-CG2 4.44Å; L1074-V1143 HydrophobicContact CD1-CG2 4.21Å; F1076-V1143 HydrophobicContact CD2-CG1 3.71Å; F1076-V1143 HydrophobicContact CE2-CG1 3.65Å; V1143-I1145 HydrophobicContact CG1-CD1 4.05Å; V1143-E1159 HydrophobicContact CG1-CG 4.31Å; V1143-C1162 HydrophobicContact CG2-CB 3.83Å; V1143-V1171 HydrophobicContact CG2-CG1 4.47Å; V1143-H1172 PolarHBondContact N-O 2.92Å; V1143-V1173 HydrophobicContact CB-CG2 4.32Å; V1143-V1173 CarbonylContact O-C 3.57Å; V1143-V1173 WeakPolarHBondContact O-CA 3.4Å; V1143-I1174 PolarHBondContact O-N 3.14Å
1144	I	96.2	Very high	86.6	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.6	177.7	-53.8	177.2	0	0	0	109.5	W1058 L1059 I1073 L1074 I1075 F1076 T1142 I1174 L1176	W1058-I1144 HydrophobicContact CZ3-CD1 4.34Å; L1059-I1144 HydrophobicContact CD2-CD1 3.84Å; L1059-I1144 HydrophobicContact CD2-CG2 4.48Å; I1073-I1144 HydrophobicContact CG2-CD1 3.65Å; I1073-I1144 HydrophobicContact CG2-CG1 3.96Å; L1074-I1144 PolarHBondContact O-N 2.71Å; I1075-I1144 WeakPolarHBondContact CA-O 3.35Å; I1075-I1144 HydrophobicContact CG1-CB 4.38Å; I1075-I1144 HydrophobicContact CG1-CD1 4.45Å; F1076-I1144 PolarHBondContact N-O 2.81Å; T1142-I1144 HydrophobicContact CG2-CG1 4.38Å; I1144-I1174 CarbonylContact C-O 3.51Å; I1144-I1174 WeakPolarHBondContact CA-O 3.49Å; I1144-L1176 HydrophobicContact CG2-CD1 3.94Å; I1144-L1176 HydrophobicContact CG2-CG 4.03Å
1145	I	95.1	Very high	87.8	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	102.1	168.3	-49.7	-56.5	0	0	0	107.6	F1076 V1143 I1148 I1174 R1175 L1176	F1076-I1145 HydrophobicContact CB-CD1 3.89Å; F1076-I1145 HydrophobicContact CD2-CD1 3.79Å; F1076-I1145 HydrophobicContact CG-CD1 4.19Å; V1143-I1145 HydrophobicContact CG1-CD1 4.05Å; I1145-I1148 HydrophobicContact CG2-CG2 4.01Å; I1145-I1174 PolarHBondContact N-O 3.04Å; I1145-R1175 HydrophobicContact CB-CG 4.35Å; I1145-R1175 HydrophobicContact CG1-CG 4.33Å; I1145-L1176 PolarHBondContact O-N 3.02Å
1146	H	95.1	Very high	88.1	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.076	C	C	.	.	S	Bend	trans	-71.2	-36.6	-179.5	-174.1	-67.7	0	0	0	111.9	N981 K1055 I1075 F1076 M1082	N981-H1146 PolarHBondContact OD1-CE1 3.18Å; N981-H1146 PolarHBondContact OD1-ND1 3.22Å; K1055-H1146 PolarHBondContact NZ-O 2.91Å; I1075-H1146 HydrophobicContact CG2-CB 4.39Å; F1076-H1146 WeakPolarHBondContact O-CB 3.3Å; F1076-H1146 PolarHBondContact O-N 2.97Å; M1082-H1146 WeakPolarHBondContact CE-NE2 3.49Å
1147	D	93.1	Very high	88.1	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-150.5	127.8	174.6	81	-59.1	0	0	0	113	R977 N981 S1077 Q1078 F1079	R977-D1147 IonicContact CZ-OD2 2.7Å; R977-D1147 IonicContact NE-OD2 2.71Å; R977-D1147 IonicContact NH2-OD2 3.09Å; R977-D1147 PolarHBondContact NH2-OD2 2.96Å; N981-D1147 WeakPolarHBondContact ND2-CB 3.26Å; N981-D1147 PolarHBondContact ND2-OD2 3.28Å; N981-D1147 WeakPolarHBondContact OD1-CB 3.33Å; S1077-D1147 VanDerWaalsContact CA-OD1 3.26Å; S1077-D1147 WeakPolarHBondContact CA-OD1 3.46Å; S1077-D1147 WeakPolarHBondContact CB-OD1 3.43Å; S1077-D1147 PolarHBondContact OG-OD1 3.4Å; Q1078-D1147 PolarHBondContact N-OD1 2.82Å; F1079-D1147 WeakPolarHBondContact CD2-OD2 3.47Å; F1079-D1147 VanDerWaalsContact CE2-OD2 3.23Å; F1079-D1147 WeakPolarHBondContact CE2-OD2 3.41Å
1148	I	91.8	Very high	88.2	Confident	4 Å²	4	13 Å²	13	2%	0.021	7%	0.068	C	C	.	.			trans	-74.6	151.2	-168.1	48.9	162.8	0	0	0	114.2	R977 I1145 I1177 M1186 L1187	R977-I1148 PolarHBondContact NH1-O 3.4Å; R977-I1148 PolarHBondContact NH2-O 3.17Å; I1145-I1148 HydrophobicContact CG2-CG2 4.01Å; I1148-I1177 HydrophobicContact CD1-CD1 3.91Å; I1148-I1177 HydrophobicContact CG1-CD1 4.12Å; I1148-I1177 HydrophobicContact CG2-CD1 4.07Å; I1148-M1186 HydrophobicContact CD1-CB 3.77Å; I1148-M1186 HydrophobicContact CD1-CE 4Å; I1148-M1186 HydrophobicContact CG1-CE 3.8Å; I1148-L1187 HydrophobicContact CD1-CB 4.19Å
1149	D	88	Confident	88.4	Confident	8 Å²	8	11.7 Å²	11.7	4%	0.043	6%	0.06	C	C	.	.			trans	-76.1	164.4	167.2	-145.4	-52.4	0	0	0	111.3	Q1078 R1129 N1151 N1154 D1155	Q1078-D1149 VanDerWaalsContact NE2-CG 3.28Å; Q1078-D1149 PolarHBondContact NE2-OD2 3.25Å; Q1078-D1149 PolarHBondContact OE1-OD2 3.4Å; R1129-D1149 IonicContact NH2-OD2 2.67Å; D1149-N1151 PolarHBondContact OD1-N 2.76Å; D1149-N1154 HydrophobicContact CB-CB 4.12Å; D1149-N1154 PolarHBondContact OD2-ND2 3.11Å; D1149-D1155 PolarHBondContact N-OD1 3.09Å; D1149-D1155 PolarHBondContact N-OD2 3.18Å
1150	F	80.4	Confident	88.3	Confident	38 Å²	38	11.4 Å²	11.4	17%	0.167	6%	0.056	C	C	.	.	S	Bend	trans	-81.1	-5.5	165.6	-62.6	-87	0	0	0	112.7	V973 M1186 K1193 I1275 L1283	V973-F1150 HydrophobicContact CG1-CE1 4.25Å; V973-F1150 HydrophobicContact CG1-CZ 3.62Å; F1150-M1186 HydrophobicContact CD1-CE 4.03Å; F1150-M1186 HydrophobicContact CD1-CG 3.95Å; F1150-M1186 HydrophobicContact CD1-SD 4.11Å; F1150-M1186 HydrophobicContact CE1-CE 3.78Å; F1150-M1186 HydrophobicContact CE1-CG 3.55Å; F1150-M1186 HydrophobicContact CE1-SD 3.36Å; F1150-M1186 WeakPolarHBondContact CE1-SD 3.16Å; F1150-M1186 HydrophobicContact CE2-CE 4.27Å; F1150-M1186 HydrophobicContact CG-CE 4.4Å; F1150-M1186 HydrophobicContact CZ-CE 3.9Å; F1150-M1186 HydrophobicContact CZ-CG 4.39Å; F1150-M1186 HydrophobicContact CZ-SD 3.6Å; F1150-M1186 VanDerWaalsContact CZ-SD 3.6Å; F1150-K1193 PolarHBondContact O-NZ 3.07Å; F1150-I1275 HydrophobicContact CB-CD1 4.28Å; F1150-I1275 HydrophobicContact CB-CG1 3.61Å; F1150-I1275 HydrophobicContact CD1-CD1 3.49Å; F1150-I1275 VanDerWaalsContact CD1-CD1 3.49Å; F1150-I1275 HydrophobicContact CD1-CG1 3.59Å; F1150-I1275 HydrophobicContact CD2-CD1 3.65Å; F1150-I1275 HydrophobicContact CD2-CG1 3.92Å; F1150-I1275 HydrophobicContact CE1-CD1 3.51Å; F1150-I1275 HydrophobicContact CE1-CG1 4.16Å; F1150-I1275 HydrophobicContact CE2-CD1 3.68Å; F1150-I1275 HydrophobicContact CE2-CG1 4.45Å; F1150-I1275 HydrophobicContact CG-CD1 3.55Å; F1150-I1275 HydrophobicContact CG-CG1 3.44Å; F1150-I1275 VanDerWaalsContact CG-CG1 3.44Å; F1150-I1275 HydrophobicContact CZ-CD1 3.61Å; F1150-L1283 HydrophobicContact CD1-CD1 4.26Å; F1150-L1283 HydrophobicContact CE1-CD1 3.94Å
1151	N	77.7	Confident	88	Confident	15 Å²	15	12.4 Å²	12.4	8%	0.08	6%	0.06	C	C	.	.	S	Bend	trans	-120.6	95.6	177.5	-168.5	57.2	0	0	0	109.1	D1149 Y1153 N1154	D1149-N1151 PolarHBondContact OD1-N 2.76Å; N1151-Y1153 PolarHBondContact O-N 3.35Å; N1151-N1154 PolarHBondContact ND2-OD1 3.18Å; N1151-N1154 WeakPolarHBondContact O-CB 3.44Å; N1151-N1154 PolarHBondContact O-N 3.11Å
1152	P	83.7	Confident	87.7	Confident	16 Å²	16	12.2 Å²	12.2	10%	0.104	6%	0.059	C	C	.	.	H	α-helix	trans	-57.4	-27.9	-172	22.2	-34.8	0	0	0	113.5	N1154 D1155 K1156 A1190 K1193	P1152-N1154 PolarHBondContact O-N 3.4Å; P1152-D1155 PolarHBondContact O-N 3.42Å; P1152-D1155 VanDerWaalsContact O-N 3.12Å; P1152-K1156 PolarHBondContact O-N 3.39Å; P1152-A1190 HydrophobicContact CB-CB 4.2Å; P1152-A1190 HydrophobicContact CG-CB 4.42Å; P1152-K1193 HydrophobicContact CG-CB 3.89Å
1153	Y	79.5	Confident	87.3	Confident	7 Å²	7	12.8 Å²	12.8	3%	0.027	6%	0.061	C	C	.	.	H	α-helix	trans	-57	-28.1	173.6	-57	-74.7	0	0	0	113.8	T797 I799 Q800 N801 N1151 Q1157 E1197	T797-Y1153 HydrophobicContact CG2-CD1 3.46Å; T797-Y1153 VanDerWaalsContact CG2-CD1 3.46Å; T797-Y1153 HydrophobicContact CG2-CE1 3.99Å; T797-Y1153 HydrophobicContact CG2-CG 4.23Å; I799-Y1153 PolarHBondContact O-OH 2.9Å; Q800-Y1153 HydrophobicContact CB-CD2 4.36Å; Q800-Y1153 HydrophobicContact CB-CE2 3.94Å; Q800-Y1153 HydrophobicContact CG-CD2 3.97Å; Q800-Y1153 HydrophobicContact CG-CE2 3.89Å; Q800-Y1153 HydrophobicContact CG-CG 4.42Å; N801-Y1153 PolarHBondContact OD1-OH 3.06Å; N1151-Y1153 PolarHBondContact O-N 3.35Å; Y1153-Q1157 WeakPolarHBondContact O-CB 3.4Å; Y1153-Q1157 PolarHBondContact O-N 3.23Å; Y1153-E1197 HydrophobicContact CE1-CB 4.48Å; Y1153-E1197 HydrophobicContact CE1-CG 4.17Å; Y1153-E1197 WeakPolarHBondContact CE1-OE2 3.41Å; Y1153-E1197 WeakPolarHBondContact OH-CB 3.38Å; Y1153-E1197 WeakPolarHBondContact OH-CG 3.45Å
1154	N	83.1	Confident	86.6	Confident	46 Å²	46	16 Å²	16	25%	0.246	7%	0.073	C	C	.	.	H	α-helix	trans	-71.4	-40.2	176.6	-66.2	2.6	0	0	0	111.4	D1149 N1151 P1152 A1158	D1149-N1154 HydrophobicContact CB-CB 4.12Å; D1149-N1154 PolarHBondContact OD2-ND2 3.11Å; N1151-N1154 PolarHBondContact ND2-OD1 3.18Å; N1151-N1154 WeakPolarHBondContact O-CB 3.44Å; N1151-N1154 PolarHBondContact O-N 3.11Å; P1152-N1154 PolarHBondContact O-N 3.4Å; N1154-A1158 PolarHBondContact O-N 3.35Å
1155	D	87.8	Confident	85.6	Confident	6 Å²	6	18.9 Å²	18.9	3%	0.032	9%	0.088	C	C	.	.	H	α-helix	trans	-74.4	-45.9	180	-59.3	-27.2	0	0	0	109.7	T1128 D1149 P1152 Q1157 A1158 E1159	T1128-D1155 WeakPolarHBondContact CG2-OD1 3.42Å; D1149-D1155 PolarHBondContact N-OD1 3.09Å; D1149-D1155 PolarHBondContact N-OD2 3.18Å; P1152-D1155 PolarHBondContact O-N 3.42Å; P1152-D1155 VanDerWaalsContact O-N 3.12Å; D1155-Q1157 VanDerWaalsContact C-N 3.28Å; D1155-Q1157 PolarHBondContact O-N 3.32Å; D1155-A1158 WeakPolarHBondContact O-CA 3.35Å; D1155-A1158 WeakPolarHBondContact O-CB 3.36Å; D1155-A1158 PolarHBondContact O-N 2.8Å; D1155-E1159 VanDerWaalsContact C-OE1 3.24Å; D1155-E1159 WeakPolarHBondContact O-CG 3.32Å; D1155-E1159 PolarHBondContact O-N 2.77Å
1156	K	83.9	Confident	84.9	Confident	55 Å²	55	21.5 Å²	21.5	24%	0.239	12%	0.116	C	C	.	.	H	α-helix	trans	-55.7	-41.7	171.2	-175.2	178.6	175.6	-176.9	0	111.9	E660 P1152 A1158 E1159 D1160	E660-K1156 WeakPolarHBondContact OE1-CE 3.5Å; E660-K1156 IonicContact OE1-NZ 2.94Å; E660-K1156 PolarHBondContact OE1-NZ 3.18Å; P1152-K1156 PolarHBondContact O-N 3.39Å; K1156-A1158 PolarHBondContact O-N 3.14Å; K1156-E1159 PolarHBondContact N-OE1 3.39Å; K1156-E1159 PolarHBondContact O-N 3.15Å; K1156-D1160 WeakPolarHBondContact CE-OD2 3.34Å; K1156-D1160 WeakPolarHBondContact O-CB 3.48Å; K1156-D1160 PolarHBondContact O-N 2.92Å
1157	Q	82.9	Confident	84.4	Confident	28 Å²	28	22.3 Å²	22.3	13%	0.131	12%	0.12	C	C	.	.	H	α-helix	trans	-66.9	-21.3	175.9	177.3	168.3	72.4	0	0	113.6	M661 E768 G1132 Y1153 D1155 R1161	M661-Q1157 HydrophobicContact CE-CB 4.07Å; M661-Q1157 HydrophobicContact CE-CG 4.12Å; M661-Q1157 VanDerWaalsContact CE-NE2 3.34Å; M661-Q1157 HydrophobicContact SD-CB 3.88Å; M661-Q1157 HydrophobicContact SD-CG 3.68Å; M661-Q1157 PolarHBondContact SD-NE2 2.74Å; E768-Q1157 PolarHBondContact OE1-NE2 2.83Å; G1132-Q1157 PolarHBondContact O-OE1 3.15Å; Y1153-Q1157 WeakPolarHBondContact O-CB 3.4Å; Y1153-Q1157 PolarHBondContact O-N 3.23Å; D1155-Q1157 VanDerWaalsContact C-N 3.28Å; D1155-Q1157 PolarHBondContact O-N 3.32Å; Q1157-R1161 VanDerWaalsContact CG-NH2 3.35Å; Q1157-R1161 VanDerWaalsContact O-CG 3.31Å; Q1157-R1161 WeakPolarHBondContact O-CG 3.38Å; Q1157-R1161 PolarHBondContact O-NE 3.39Å
1158	A	86.5	Confident	84.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-82.7	-43.9	172.6	0	0	0	0	0	111.5	F1076 T1128 N1154 D1155 K1156 D1160 R1161	F1076-A1158 HydrophobicContact CD1-CB 4.1Å; F1076-A1158 HydrophobicContact CD2-CB 4.37Å; F1076-A1158 HydrophobicContact CE1-CB 3.87Å; F1076-A1158 HydrophobicContact CE2-CB 4.13Å; F1076-A1158 HydrophobicContact CG-CB 4.34Å; F1076-A1158 HydrophobicContact CZ-CB 3.87Å; T1128-A1158 HydrophobicContact CG2-CB 4.07Å; N1154-A1158 PolarHBondContact O-N 3.35Å; D1155-A1158 WeakPolarHBondContact O-CA 3.35Å; D1155-A1158 WeakPolarHBondContact O-CB 3.36Å; D1155-A1158 PolarHBondContact O-N 2.8Å; K1156-A1158 PolarHBondContact O-N 3.14Å; A1158-D1160 PolarHBondContact O-N 3.49Å; A1158-R1161 WeakPolarHBondContact O-CB 3.2Å; A1158-R1161 WeakPolarHBondContact O-CG 3.14Å; A1158-R1161 PolarHBondContact O-N 2.89Å; A1158-R1161 VanDerWaalsContact O-N 3.15Å
1159	E	88.8	Confident	84	Confident	5 Å²	5	34.5 Å²	34.5	2%	0.023	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-44.5	175.4	-63.2	153.3	-143.1	0	0	112.2	K885 V1143 D1155 K1156 R1161 C1162 H1163 V1173 R1175	K885-E1159 IonicContact NZ-OE2 3.78Å; V1143-E1159 HydrophobicContact CG1-CG 4.31Å; D1155-E1159 VanDerWaalsContact C-OE1 3.24Å; D1155-E1159 WeakPolarHBondContact O-CG 3.32Å; D1155-E1159 PolarHBondContact O-N 2.77Å; K1156-E1159 PolarHBondContact N-OE1 3.39Å; K1156-E1159 PolarHBondContact O-N 3.15Å; E1159-R1161 PolarHBondContact O-N 3.21Å; E1159-C1162 PolarHBondContact O-N 3.13Å; E1159-H1163 PolarHBondContact O-N 3.11Å; E1159-V1173 HydrophobicContact CB-CG2 4.32Å; E1159-V1173 HydrophobicContact CG-CG1 3.81Å; E1159-V1173 HydrophobicContact CG-CG2 4.05Å; E1159-R1175 IonicContact OE1-CZ 2.67Å; E1159-R1175 IonicContact OE1-NH1 3.94Å; E1159-R1175 PolarHBondContact OE1-NH1 3.49Å; E1159-R1175 IonicContact OE1-NH2 2.83Å; E1159-R1175 PolarHBondContact OE1-NH2 2.87Å; E1159-R1175 IonicContact OE2-NH2 3.24Å; E1159-R1175 PolarHBondContact OE2-NH2 2.96Å
1160	D	85.6	Confident	84.2	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	7.2	179.4	-69.6	-25.4	0	0	0	113.5	M661 K875 K885 K1156 A1158	M661-D1160 HydrophobicContact CB-CB 4.44Å; K875-D1160 IonicContact NZ-OD1 3.22Å; K875-D1160 PolarHBondContact NZ-OD1 2.74Å; K875-D1160 IonicContact NZ-OD2 2.77Å; K885-D1160 IonicContact NZ-OD1 3.84Å; K885-D1160 PolarHBondContact NZ-OD1 2.76Å; K1156-D1160 WeakPolarHBondContact CE-OD2 3.34Å; K1156-D1160 WeakPolarHBondContact O-CB 3.48Å; K1156-D1160 PolarHBondContact O-N 2.92Å; A1158-D1160 PolarHBondContact O-N 3.49Å
1161	R	84.5	Confident	84.8	Confident	22 Å²	22	35 Å²	35	8%	0.083	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-23.9	164.6	-51.8	-56.6	171.4	175.4	3.2	113.3	G1132 L1133 I1135 L1137 Q1157 A1158 E1159	G1132-R1161 PolarHBondContact O-NH2 3.36Å; L1133-R1161 PolarHBondContact O-NE 3.16Å; L1133-R1161 VanDerWaalsContact O-NE 3.11Å; L1133-R1161 PolarHBondContact O-NH1 2.78Å; L1133-R1161 PolarHBondContact O-NH2 3.17Å; I1135-R1161 HydrophobicContact CG1-CB 4.23Å; I1135-R1161 HydrophobicContact CG1-CG 4.1Å; L1137-R1161 PolarHBondContact N-O 3.23Å; Q1157-R1161 VanDerWaalsContact CG-NH2 3.35Å; Q1157-R1161 VanDerWaalsContact O-CG 3.31Å; Q1157-R1161 WeakPolarHBondContact O-CG 3.38Å; Q1157-R1161 PolarHBondContact O-NE 3.39Å; A1158-R1161 WeakPolarHBondContact O-CB 3.2Å; A1158-R1161 WeakPolarHBondContact O-CG 3.14Å; A1158-R1161 PolarHBondContact O-N 2.89Å; A1158-R1161 VanDerWaalsContact O-N 3.15Å; E1159-R1161 PolarHBondContact O-N 3.21Å
1162	C	87.8	Confident	85.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-50.2	169	169.2	0	0	0	0	109.9	L1074 A1140 V1143 E1159 R1164 Q1167	L1074-C1162 HydrophobicContact CD1-CB 4.03Å; A1140-C1162 PolarHBondContact O-SG 3.37Å; V1143-C1162 HydrophobicContact CG2-CB 3.83Å; E1159-C1162 PolarHBondContact O-N 3.13Å; C1162-R1164 PolarHBondContact O-N 3.4Å; C1162-Q1167 PolarHBondContact O-NE2 2.67Å; C1162-Q1167 PolarHBondContact SG-NE2 2.99Å
1163	H	86.4	Confident	86.1	Confident	15 Å²	15	37 Å²	37	7%	0.069	19%	0.191	C	C	.	.	S	Bend	trans	-80.1	80.3	177	-169.5	-112.2	0	0	0	111.6	K875 P883 K885 E1159 V1171	K875-H1163 PolarHBondContact NZ-ND1 2.85Å; K875-H1163 PolarHBondContact NZ-O 3.43Å; P883-H1163 PolarHBondContact O-NE2 3.06Å; K885-H1163 HydrophobicContact CD-CB 3.85Å; E1159-H1163 PolarHBondContact O-N 3.11Å; H1163-V1171 HydrophobicContact CB-CB 4.39Å; H1163-V1171 HydrophobicContact CB-CG1 4.29Å; H1163-V1171 HydrophobicContact CB-CG2 4.16Å
1164	R	81.5	Confident	86.9	Confident	67 Å²	67	37.3 Å²	37.3	25%	0.253	19%	0.193	S	C	.	.	S	Bend	trans	-142	162.9	-177.6	-167.4	164.8	176.2	-169.9	-1.6	111	I1135 N1136 T1138 C1162 G1166 Q1167	I1135-R1164 PolarHBondContact O-NH1 3.49Å; I1135-R1164 VanDerWaalsContact O-NH1 3.14Å; N1136-R1164 WeakPolarHBondContact OD1-CD 3.29Å; T1138-R1164 HydrophobicContact CG2-CB 4.31Å; C1162-R1164 PolarHBondContact O-N 3.4Å; R1164-G1166 PolarHBondContact O-N 2.85Å; R1164-Q1167 VanDerWaalsContact O-CB 3.23Å; R1164-Q1167 WeakPolarHBondContact O-CB 3.32Å; R1164-Q1167 PolarHBondContact O-N 3.43Å
1165	L	74.6	Confident	87.5	Confident	60 Å²	60	36.9 Å²	36.9	31%	0.314	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	124.5	170.4	-72.9	170.5	0	0	0	110.5	L879	L879-L1165 HydrophobicContact CD1-CD2 3.61Å; L879-L1165 HydrophobicContact CD1-CG 4.08Å; L879-L1165 HydrophobicContact CD2-CD2 3.84Å; L879-L1165 HydrophobicContact CG-CD2 4.4Å
1166	G	79.1	Confident	87.9	Confident	56 Å²	56	36.6 Å²	36.6	58%	0.577	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.8	-12.3	-172.8	0	0	0	0	0	114.6	R1164	R1164-G1166 PolarHBondContact O-N 2.85Å
1167	Q	86.1	Confident	88.5	Confident	17 Å²	17	34.2 Å²	34.2	8%	0.079	18%	0.176	C	C	.	.			trans	-65.1	139.3	166	180	56.8	-86.1	0	0	110.7	P883 T1138 A1140 C1162 R1164 N1169 V1171	P883-Q1167 HydrophobicContact CG-CG 4.37Å; T1138-Q1167 HydrophobicContact CG2-CB 4.44Å; A1140-Q1167 PolarHBondContact O-NE2 2.87Å; C1162-Q1167 PolarHBondContact O-NE2 2.67Å; C1162-Q1167 PolarHBondContact SG-NE2 2.99Å; R1164-Q1167 VanDerWaalsContact O-CB 3.23Å; R1164-Q1167 WeakPolarHBondContact O-CB 3.32Å; R1164-Q1167 PolarHBondContact O-N 3.43Å; Q1167-N1169 VanDerWaalsContact CG-O 3.22Å; Q1167-N1169 WeakPolarHBondContact CG-O 3.39Å; Q1167-V1171 HydrophobicContact CG-CG2 3.79Å
1168	K	86.3	Confident	88.9	Confident	185 Å²	185	32.9 Å²	32.9	80%	0.804	17%	0.17	S	C	*	.			trans	-116.1	-31.3	177.8	-63.9	-174.3	177.3	-173.7	0	113.2	P883	P883-K1168 WeakPolarHBondContact CG-O 3.46Å
1169	N	89.6	Confident	89.1	Confident	74 Å²	74	36.4 Å²	36.4	40%	0.396	19%	0.186	S	C	.	.	S	Bend	trans	-90	152.6	-179.1	-68.7	14.6	0	0	0	110.6	P883 D1141 Q1167	P883-N1169 WeakPolarHBondContact CB-O 3.23Å; D1141-N1169 HydrophobicContact CB-CB 3.72Å; D1141-N1169 PolarHBondContact OD2-ND2 3.27Å; Q1167-N1169 VanDerWaalsContact CG-O 3.22Å; Q1167-N1169 WeakPolarHBondContact CG-O 3.39Å
1170	P	91.7	Very high	89	Confident	58 Å²	58	37.5 Å²	37.5	38%	0.377	20%	0.199	S	C	.	.			trans	-57.7	145.7	164.4	28.7	-35.7	0	0	0	110	P884	P884-P1170 HydrophobicContact CG-CB 4.11Å
1171	V	93.1	Very high	89.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.3	-175.8	176.6	0	0	0	0	110.6	P884 K885 T886 D1141 V1143 H1163 Q1167 V1173	P884-V1171 PolarHBondContact O-N 3.49Å; K885-V1171 CarbonylContact C-O 3.54Å; K885-V1171 VanDerWaalsContact CA-O 3.32Å; K885-V1171 WeakPolarHBondContact CA-O 3.29Å; K885-V1171 HydrophobicContact CB-CB 4.42Å; K885-V1171 HydrophobicContact CD-CG1 4.35Å; K885-V1171 HydrophobicContact CG-CB 4.23Å; K885-V1171 HydrophobicContact CG-CG1 4.15Å; T886-V1171 PolarHBondContact N-O 2.98Å; D1141-V1171 VanDerWaalsContact O-CA 3.31Å; D1141-V1171 WeakPolarHBondContact O-CA 3.36Å; V1143-V1171 HydrophobicContact CG2-CG1 4.47Å; H1163-V1171 HydrophobicContact CB-CB 4.39Å; H1163-V1171 HydrophobicContact CB-CG1 4.29Å; H1163-V1171 HydrophobicContact CB-CG2 4.16Å; Q1167-V1171 HydrophobicContact CG-CG2 3.79Å; V1171-V1173 HydrophobicContact CG1-CG2 4.3Å
1172	H	94.8	Very high	89.4	Confident	71 Å²	71	36.5 Å²	36.5	33%	0.329	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	111.2	-176.9	-64.4	-97	0	0	0	109.9	T886 D1141 T1142 V1143	T886-H1172 PolarHBondContact OG1-ND1 3.36Å; D1141-H1172 PolarHBondContact O-N 3Å; T1142-H1172 WeakPolarHBondContact CA-O 3.35Å; V1143-H1172 PolarHBondContact N-O 2.92Å
1173	V	94.9	Very high	89.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.4	178.6	-176.9	0	0	0	0	110.2	K885 T886 T887 E888 V1143 E1159 V1171	K885-V1173 HydrophobicContact CD-CG2 3.96Å; K885-V1173 HydrophobicContact CG-CG2 4.04Å; T886-V1173 PolarHBondContact O-N 3.02Å; T886-V1173 VanDerWaalsContact O-N 3.16Å; T887-V1173 CarbonylContact C-O 3.55Å; T887-V1173 VanDerWaalsContact CA-O 3.31Å; T887-V1173 WeakPolarHBondContact CA-O 3.49Å; T887-V1173 HydrophobicContact CG2-CB 4.3Å; T887-V1173 HydrophobicContact CG2-CG1 4.29Å; E888-V1173 PolarHBondContact N-O 3.3Å; V1143-V1173 HydrophobicContact CB-CG2 4.32Å; V1143-V1173 CarbonylContact O-C 3.57Å; V1143-V1173 WeakPolarHBondContact O-CA 3.4Å; E1159-V1173 HydrophobicContact CB-CG2 4.32Å; E1159-V1173 HydrophobicContact CG-CG1 3.81Å; E1159-V1173 HydrophobicContact CG-CG2 4.05Å; V1171-V1173 HydrophobicContact CG1-CG2 4.3Å
1174	I	96.2	Very high	89.7	Confident	13 Å²	13	39.5 Å²	39.5	7%	0.067	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.4	179.7	-56.5	176.7	0	0	0	109	V890 W1058 T1142 V1143 I1144 I1145 L1176	V890-I1174 HydrophobicContact CB-CG2 4.28Å; V890-I1174 HydrophobicContact CG2-CG2 3.64Å; W1058-I1174 HydrophobicContact CH2-CD1 4.04Å; W1058-I1174 HydrophobicContact CH2-CG2 3.91Å; W1058-I1174 HydrophobicContact CZ2-CG2 4.28Å; T1142-I1174 HydrophobicContact CG2-CD1 4.38Å; V1143-I1174 PolarHBondContact O-N 3.14Å; I1144-I1174 CarbonylContact C-O 3.51Å; I1144-I1174 WeakPolarHBondContact CA-O 3.49Å; I1145-I1174 PolarHBondContact N-O 3.04Å; I1174-L1176 HydrophobicContact CG2-CD2 3.97Å
1175	R	95.8	Very high	89.9	Confident	37 Å²	37	36.9 Å²	36.9	14%	0.14	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.8	174.7	-52.9	-174.7	-166.2	-78.2	-10.1	110.3	E888 V890 I1145 E1159	E888-R1175 PolarHBondContact O-N 3.36Å; V890-R1175 PolarHBondContact N-O 2.84Å; I1145-R1175 HydrophobicContact CB-CG 4.35Å; I1145-R1175 HydrophobicContact CG1-CG 4.33Å; E1159-R1175 IonicContact OE1-CZ 2.67Å; E1159-R1175 IonicContact OE1-NH1 3.94Å; E1159-R1175 PolarHBondContact OE1-NH1 3.49Å; E1159-R1175 IonicContact OE1-NH2 2.83Å; E1159-R1175 PolarHBondContact OE1-NH2 2.87Å; E1159-R1175 IonicContact OE2-NH2 3.24Å; E1159-R1175 PolarHBondContact OE2-NH2 2.96Å
1176	L	96.1	Very high	90.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.9	178.4	-55.4	-175.3	0	0	0	110.8	V890 V892 K1055 W1058 L1059 I1144 I1145 I1174	V890-L1176 HydrophobicContact CB-CD2 4.05Å; V890-L1176 HydrophobicContact CG1-CD2 4.23Å; V892-L1176 HydrophobicContact CG2-CD2 4.32Å; K1055-L1176 HydrophobicContact CB-CD1 4.47Å; K1055-L1176 HydrophobicContact CD-CB 4.25Å; K1055-L1176 HydrophobicContact CG-CB 4.49Å; K1055-L1176 PolarHBondContact NZ-O 3.02Å; W1058-L1176 HydrophobicContact CD2-CD2 3.87Å; W1058-L1176 HydrophobicContact CE3-CD1 3.91Å; W1058-L1176 HydrophobicContact CE3-CD2 3.61Å; W1058-L1176 HydrophobicContact CE3-CG 4.41Å; W1058-L1176 HydrophobicContact CH2-CD2 4.14Å; W1058-L1176 HydrophobicContact CZ2-CD2 4.34Å; W1058-L1176 HydrophobicContact CZ3-CD1 4.27Å; W1058-L1176 HydrophobicContact CZ3-CD2 3.77Å; L1059-L1176 HydrophobicContact CG-CD1 4.41Å; I1144-L1176 HydrophobicContact CG2-CD1 3.94Å; I1144-L1176 HydrophobicContact CG2-CG 4.03Å; I1145-L1176 PolarHBondContact O-N 3.02Å; I1174-L1176 HydrophobicContact CG2-CD2 3.97Å
1177	I	95.1	Very high	91.1	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.4	-179.1	-57.9	-63.7	0	0	0	109	V889 V890 V892 I1148 E1183 E1184 L1187	V889-I1177 HydrophobicContact CG1-CG1 3.85Å; V890-I1177 PolarHBondContact O-N 3.49Å; V892-I1177 PolarHBondContact N-O 3.04Å; I1148-I1177 HydrophobicContact CD1-CD1 3.91Å; I1148-I1177 HydrophobicContact CG1-CD1 4.12Å; I1148-I1177 HydrophobicContact CG2-CD1 4.07Å; I1177-E1183 HydrophobicContact CD1-CB 4.46Å; I1177-E1183 HydrophobicContact CG2-CB 3.99Å; I1177-E1184 HydrophobicContact CG2-CG 4.11Å; I1177-L1187 HydrophobicContact CG1-CD2 4.34Å
1178	S	93	Very high	91.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	128	177.2	-76.1	0	0	0	0	113	V892 A980 K1055 T1181 E1183	V892-S1178 WeakPolarHBondContact O-CA 3.41Å; A980-S1178 PolarHBondContact O-OG 3.16Å; K1055-S1178 WeakPolarHBondContact CE-OG 3.33Å; S1178-T1181 WeakPolarHBondContact O-CB 3.39Å; S1178-T1181 WeakPolarHBondContact O-CG2 2.96Å; S1178-T1181 PolarHBondContact O-N 3.35Å; S1178-T1181 PolarHBondContact O-OG1 3.2Å; S1178-E1183 PolarHBondContact N-OE2 2.94Å
1179	E	90.9	Very high	90.9	Very high	74 Å²	74	30.2 Å²	30.2	35%	0.346	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	139.8	-177.3	-72.7	-179.4	-180	0	0	113.7	S891 V892 T893 T1181 E1184	S891-E1179 VanDerWaalsContact CB-OE1 3.28Å; S891-E1179 WeakPolarHBondContact CB-OE1 3.42Å; S891-E1179 VanDerWaalsContact OG-CD 3.26Å; S891-E1179 WeakPolarHBondContact OG-CG 3.39Å; S891-E1179 PolarHBondContact OG-OE1 2.94Å; V892-E1179 PolarHBondContact O-N 3.47Å; T893-E1179 WeakPolarHBondContact CG2-OE2 3.44Å; E1179-T1181 PolarHBondContact O-N 2.9Å; E1179-E1184 WeakPolarHBondContact CA-OE1 3.38Å
1180	G	85	Confident	90.7	Very high	27 Å²	27	27.2 Å²	27.2	28%	0.278	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	16.3	-178	0	0	0	0	0	113.8	E1184	G1180-E1184 PolarHBondContact N-OE1 3.08Å
1181	T	89.4	Confident	90.4	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.144	C	C	.	.	S	Bend	trans	-109.5	170.3	-177.4	79.3	0	0	0	0	113.7	M894 Y902 A980 S1178 E1179 E1183 E1184	M894-T1181 HydrophobicContact CE-CG2 3.57Å; M894-T1181 HydrophobicContact CG-CG2 4.37Å; M894-T1181 HydrophobicContact SD-CG2 3.63Å; Y902-T1181 HydrophobicContact CD2-CG2 4.41Å; Y902-T1181 HydrophobicContact CE1-CG2 4.47Å; Y902-T1181 HydrophobicContact CE2-CG2 3.99Å; Y902-T1181 WeakPolarHBondContact OH-CA 3.45Å; A980-T1181 HydrophobicContact CB-CG2 4.01Å; S1178-T1181 WeakPolarHBondContact O-CB 3.39Å; S1178-T1181 WeakPolarHBondContact O-CG2 2.96Å; S1178-T1181 PolarHBondContact O-N 3.35Å; S1178-T1181 PolarHBondContact O-OG1 3.2Å; E1179-T1181 PolarHBondContact O-N 2.9Å; T1181-E1183 PolarHBondContact O-N 2.91Å; T1181-E1183 PolarHBondContact OG1-N 2.67Å; T1181-E1184 PolarHBondContact O-N 3.41Å
1182	L	89.7	Confident	89.6	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-51.1	-24.6	171.4	-166	78	0	0	0	113.9	Y902 V973 L976 R977 E1184 G1185 M1186 L1283 A1287	Y902-L1182 PolarHBondContact OH-N 3.04Å; V973-L1182 HydrophobicContact CB-CD2 4.11Å; V973-L1182 HydrophobicContact CG1-CD2 3.78Å; V973-L1182 HydrophobicContact CG2-CD2 3.98Å; L976-L1182 HydrophobicContact CB-CD2 4.22Å; L976-L1182 HydrophobicContact CD1-CD1 4.49Å; R977-L1182 HydrophobicContact CG-CD2 4.23Å; L1182-E1184 VanDerWaalsContact C-N 3.35Å; L1182-E1184 PolarHBondContact O-N 3Å; L1182-G1185 PolarHBondContact O-N 3.01Å; L1182-M1186 HydrophobicContact CD2-SD 4.27Å; L1182-M1186 HydrophobicContact CG-SD 4.37Å; L1182-M1186 WeakPolarHBondContact O-CG 3.42Å; L1182-M1186 PolarHBondContact O-N 2.53Å; L1182-M1186 VanDerWaalsContact O-N 3.11Å; L1182-L1283 HydrophobicContact CD1-CB 3.87Å; L1182-L1283 WeakPolarHBondContact CD1-O 3.37Å; L1182-A1287 HydrophobicContact CB-CB 4.28Å; L1182-A1287 HydrophobicContact CD1-CB 3.44Å; L1182-A1287 VanDerWaalsContact CD1-CB 3.44Å; L1182-A1287 HydrophobicContact CG-CB 4.48Å
1183	E	90.4	Very high	88.5	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-30.9	-176.1	-62.8	-168.9	141.7	0	0	113.2	A980 K1055 I1177 S1178 T1181 M1186 L1187	A980-E1183 HydrophobicContact CB-CG 4.45Å; K1055-E1183 VanDerWaalsContact CE-OE2 3.3Å; K1055-E1183 WeakPolarHBondContact CE-OE2 3.47Å; K1055-E1183 IonicContact NZ-OE1 3.83Å; K1055-E1183 PolarHBondContact NZ-OE1 2.86Å; K1055-E1183 IonicContact NZ-OE2 3.62Å; K1055-E1183 PolarHBondContact NZ-OE2 3.18Å; I1177-E1183 HydrophobicContact CD1-CB 4.46Å; I1177-E1183 HydrophobicContact CG2-CB 3.99Å; S1178-E1183 PolarHBondContact N-OE2 2.94Å; T1181-E1183 PolarHBondContact O-N 2.91Å; T1181-E1183 PolarHBondContact OG1-N 2.67Å; E1183-M1186 WeakPolarHBondContact O-CB 3.29Å; E1183-M1186 PolarHBondContact O-N 3.29Å; E1183-L1187 WeakPolarHBondContact O-CB 3.41Å; E1183-L1187 PolarHBondContact O-N 3.47Å
1184	E	90.1	Very high	87.7	Confident	78 Å²	78	31 Å²	31	36%	0.364	16%	0.161	S	C	.	.	H	α-helix	trans	-63	-48.1	174.9	-64.7	173.8	-179.2	0	0	111.4	I1177 E1179 G1180 T1181 L1182 M1186 L1187 R1188	I1177-E1184 HydrophobicContact CG2-CG 4.11Å; E1179-E1184 WeakPolarHBondContact CA-OE1 3.38Å; G1180-E1184 PolarHBondContact N-OE1 3.08Å; T1181-E1184 PolarHBondContact O-N 3.41Å; L1182-E1184 VanDerWaalsContact C-N 3.35Å; L1182-E1184 PolarHBondContact O-N 3Å; E1184-M1186 VanDerWaalsContact C-N 3.27Å; E1184-M1186 PolarHBondContact O-N 2.75Å; E1184-L1187 WeakPolarHBondContact O-CB 3.27Å; E1184-L1187 PolarHBondContact O-N 3.08Å; E1184-R1188 PolarHBondContact O-N 2.79Å
1185	G	86.2	Confident	86.6	Confident	11 Å²	11	35 Å²	35	11%	0.113	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-35.3	175.7	0	0	0	0	0	112.1	L1182 I1189 L1283	L1182-G1185 PolarHBondContact O-N 3.01Å; G1185-I1189 WeakPolarHBondContact O-CG1 3.29Å; G1185-I1189 PolarHBondContact O-N 2.89Å; G1185-L1283 WeakPolarHBondContact O-CD2 3.11Å
1186	M	89	Confident	85.1	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-41.4	173.4	-72.6	171.6	42.6	0	0	112.4	R977 I1148 F1150 L1182 E1183 E1184 I1189 A1190 L1283	R977-M1186 HydrophobicContact CG-SD 4.15Å; I1148-M1186 HydrophobicContact CD1-CB 3.77Å; I1148-M1186 HydrophobicContact CD1-CE 4Å; I1148-M1186 HydrophobicContact CG1-CE 3.8Å; F1150-M1186 HydrophobicContact CD1-CE 4.03Å; F1150-M1186 HydrophobicContact CD1-CG 3.95Å; F1150-M1186 HydrophobicContact CD1-SD 4.11Å; F1150-M1186 HydrophobicContact CE1-CE 3.78Å; F1150-M1186 HydrophobicContact CE1-CG 3.55Å; F1150-M1186 HydrophobicContact CE1-SD 3.36Å; F1150-M1186 WeakPolarHBondContact CE1-SD 3.16Å; F1150-M1186 HydrophobicContact CE2-CE 4.27Å; F1150-M1186 HydrophobicContact CG-CE 4.4Å; F1150-M1186 HydrophobicContact CZ-CE 3.9Å; F1150-M1186 HydrophobicContact CZ-CG 4.39Å; F1150-M1186 HydrophobicContact CZ-SD 3.6Å; F1150-M1186 VanDerWaalsContact CZ-SD 3.6Å; L1182-M1186 HydrophobicContact CD2-SD 4.27Å; L1182-M1186 HydrophobicContact CG-SD 4.37Å; L1182-M1186 WeakPolarHBondContact O-CG 3.42Å; L1182-M1186 PolarHBondContact O-N 2.53Å; L1182-M1186 VanDerWaalsContact O-N 3.11Å; E1183-M1186 WeakPolarHBondContact O-CB 3.29Å; E1183-M1186 PolarHBondContact O-N 3.29Å; E1184-M1186 VanDerWaalsContact C-N 3.27Å; E1184-M1186 PolarHBondContact O-N 2.75Å; M1186-I1189 PolarHBondContact O-N 3.45Å; M1186-A1190 WeakPolarHBondContact O-CB 3.27Å; M1186-A1190 PolarHBondContact O-N 2.9Å; M1186-L1283 HydrophobicContact CG-CD1 3.82Å; M1186-L1283 HydrophobicContact CG-CD2 4.26Å
1187	L	90	Very high	83.6	Confident	39 Å²	39	36.5 Å²	36.5	20%	0.204	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-44.9	175.3	-179.3	71.7	0	0	0	110.6	V889 I1148 I1177 E1183 E1184 I1189 A1190 S1191	V889-L1187 HydrophobicContact CG1-CD2 3.79Å; I1148-L1187 HydrophobicContact CD1-CB 4.19Å; I1177-L1187 HydrophobicContact CG1-CD2 4.34Å; E1183-L1187 WeakPolarHBondContact O-CB 3.41Å; E1183-L1187 PolarHBondContact O-N 3.47Å; E1184-L1187 WeakPolarHBondContact O-CB 3.27Å; E1184-L1187 PolarHBondContact O-N 3.08Å; L1187-I1189 PolarHBondContact O-N 3.42Å; L1187-A1190 CarbonylContact O-C 3.39Å; L1187-A1190 WeakPolarHBondContact O-CA 3.34Å; L1187-A1190 WeakPolarHBondContact O-CB 3.29Å; L1187-A1190 PolarHBondContact O-N 2.9Å; L1187-S1191 PolarHBondContact O-N 3.17Å; L1187-S1191 PolarHBondContact O-OG 2.88Å
1188	R	86.7	Confident	82.2	Confident	123 Å²	123	40.9 Å²	40.9	46%	0.464	21%	0.209	S	C	.	.	H	α-helix	trans	-53.6	-53	175.9	-166.4	-180	69.5	-141.9	0.8	111.3	E1184 A1190 S1191 E1192 D1286	E1184-R1188 PolarHBondContact O-N 2.79Å; R1188-A1190 VanDerWaalsContact C-N 3.29Å; R1188-A1190 PolarHBondContact O-N 2.8Å; R1188-S1191 PolarHBondContact O-N 3.38Å; R1188-E1192 IonicContact NE-OE1 2.85Å; R1188-E1192 VanDerWaalsContact O-CG 3.31Å; R1188-E1192 WeakPolarHBondContact O-CG 3.36Å; R1188-E1192 PolarHBondContact O-N 2.85Å; R1188-D1286 IonicContact CZ-OD2 3.27Å; R1188-D1286 IonicContact NH1-OD2 2.76Å; R1188-D1286 IonicContact NH2-OD2 2.69Å; R1188-D1286 PolarHBondContact NH2-OD2 2.88Å
1189	I	81.5	Confident	80.8	Confident	13 Å²	13	44.5 Å²	44.5	7%	0.067	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-31	177	-66.4	179.4	0	0	0	112.2	G1185 M1186 L1187 K1193 D1279 L1283	G1185-I1189 WeakPolarHBondContact O-CG1 3.29Å; G1185-I1189 PolarHBondContact O-N 2.89Å; M1186-I1189 PolarHBondContact O-N 3.45Å; L1187-I1189 PolarHBondContact O-N 3.42Å; I1189-K1193 HydrophobicContact CG2-CD 4.09Å; I1189-K1193 WeakPolarHBondContact O-CB 3.42Å; I1189-K1193 VanDerWaalsContact O-CD 3.31Å; I1189-K1193 WeakPolarHBondContact O-CD 3.28Å; I1189-K1193 WeakPolarHBondContact O-CG 3.23Å; I1189-K1193 PolarHBondContact O-N 2.64Å; I1189-K1193 VanDerWaalsContact O-N 3.14Å; I1189-D1279 HydrophobicContact CD1-CB 4.18Å; I1189-L1283 HydrophobicContact CD1-CD1 4.16Å; I1189-L1283 HydrophobicContact CD1-CD2 3.74Å; I1189-L1283 HydrophobicContact CD1-CG 3.81Å
1190	A	84.3	Confident	79.2	Confident	12 Å²	12	42.3 Å²	42.3	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-70.3	-41.3	175.4	0	0	0	0	0	112	P1152 M1186 L1187 R1188 K1193 L1194	P1152-A1190 HydrophobicContact CB-CB 4.2Å; P1152-A1190 HydrophobicContact CG-CB 4.42Å; M1186-A1190 WeakPolarHBondContact O-CB 3.27Å; M1186-A1190 PolarHBondContact O-N 2.9Å; L1187-A1190 CarbonylContact O-C 3.39Å; L1187-A1190 WeakPolarHBondContact O-CA 3.34Å; L1187-A1190 WeakPolarHBondContact O-CB 3.29Å; L1187-A1190 PolarHBondContact O-N 2.9Å; R1188-A1190 VanDerWaalsContact C-N 3.29Å; R1188-A1190 PolarHBondContact O-N 2.8Å; A1190-K1193 WeakPolarHBondContact O-CB 3.49Å; A1190-K1193 PolarHBondContact O-N 2.82Å; A1190-L1194 PolarHBondContact O-N 3.32Å; A1190-L1194 VanDerWaalsContact O-N 3.08Å
1191	S	85.6	Confident	78	Confident	66 Å²	66	42.4 Å²	42.4	46%	0.462	22%	0.215	S	C	.	.	H	α-helix	trans	-66.9	-46.3	175.7	-62.4	0	0	0	0	112	L1187 R1188 K1193 L1194 Q1195	L1187-S1191 PolarHBondContact O-N 3.17Å; L1187-S1191 PolarHBondContact O-OG 2.88Å; R1188-S1191 PolarHBondContact O-N 3.38Å; S1191-K1193 PolarHBondContact O-N 2.93Å; S1191-L1194 PolarHBondContact O-N 3.21Å; S1191-Q1195 PolarHBondContact O-N 3.1Å
1192	E	76.2	Confident	76.2	Confident	60 Å²	60	44.1 Å²	44.1	28%	0.28	23%	0.233	S	C	.	.	H	α-helix	trans	-51.7	-44.7	170.9	-71.2	162.6	-162.2	0	0	111.2	R1188 L1194 M1196	R1188-E1192 IonicContact NE-OE1 2.85Å; R1188-E1192 VanDerWaalsContact O-CG 3.31Å; R1188-E1192 WeakPolarHBondContact O-CG 3.36Å; R1188-E1192 PolarHBondContact O-N 2.85Å; E1192-L1194 VanDerWaalsContact C-N 3.34Å; E1192-L1194 PolarHBondContact O-N 3.28Å; E1192-M1196 WeakPolarHBondContact O-CB 3.46Å; E1192-M1196 WeakPolarHBondContact O-CG 3.43Å; E1192-M1196 PolarHBondContact O-N 3.42Å
1193	K	72.2	Confident	73.8	Confident	20 Å²	20	46 Å²	46	9%	0.087	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-29.5	178.2	-77.7	167	-177.9	163.9	0	113.9	N801 F1150 P1152 I1189 A1190 S1191 M1196	N801-K1193 VanDerWaalsContact ND2-CA 3.29Å; N801-K1193 WeakPolarHBondContact ND2-CA 3.49Å; N801-K1193 WeakPolarHBondContact ND2-CB 3.22Å; N801-K1193 PolarHBondContact ND2-O 2.66Å; F1150-K1193 PolarHBondContact O-NZ 3.07Å; P1152-K1193 HydrophobicContact CG-CB 3.89Å; I1189-K1193 HydrophobicContact CG2-CD 4.09Å; I1189-K1193 WeakPolarHBondContact O-CB 3.42Å; I1189-K1193 VanDerWaalsContact O-CD 3.31Å; I1189-K1193 WeakPolarHBondContact O-CD 3.28Å; I1189-K1193 WeakPolarHBondContact O-CG 3.23Å; I1189-K1193 PolarHBondContact O-N 2.64Å; I1189-K1193 VanDerWaalsContact O-N 3.14Å; A1190-K1193 WeakPolarHBondContact O-CB 3.49Å; A1190-K1193 PolarHBondContact O-N 2.82Å; S1191-K1193 PolarHBondContact O-N 2.93Å; K1193-M1196 HydrophobicContact CG-CE 4.3Å
1194	L	77.3	Confident	70.9	Confident	62 Å²	62	51.5 Å²	51.5	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-79.3	-44.9	177.2	-168.9	73.2	0	0	0	111.3	A1190 S1191 E1192 M1196 E1197 Q1198	A1190-L1194 PolarHBondContact O-N 3.32Å; A1190-L1194 VanDerWaalsContact O-N 3.08Å; S1191-L1194 PolarHBondContact O-N 3.21Å; E1192-L1194 VanDerWaalsContact C-N 3.34Å; E1192-L1194 PolarHBondContact O-N 3.28Å; L1194-M1196 VanDerWaalsContact C-N 3.28Å; L1194-M1196 PolarHBondContact O-N 2.9Å; L1194-E1197 WeakPolarHBondContact O-CB 3.32Å; L1194-E1197 PolarHBondContact O-N 2.78Å; L1194-Q1198 PolarHBondContact O-N 3.17Å
1195	Q	74	Confident	67.9	Low	98 Å²	98	52.6 Å²	52.6	46%	0.458	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-38.9	176.4	-168.1	-179	26	0	0	111.4	S1191 E1197 Q1198 N1199	S1191-Q1195 PolarHBondContact O-N 3.1Å; Q1195-E1197 VanDerWaalsContact C-N 3.28Å; Q1195-E1197 PolarHBondContact O-N 3.42Å; Q1195-Q1198 PolarHBondContact O-N 3.36Å; Q1195-N1199 PolarHBondContact O-N 2.78Å; Q1195-N1199 VanDerWaalsContact O-N 3.11Å; Q1195-N1199 PolarHBondContact O-OD1 3.01Å
1196	M	63.3	Low	64.9	Low	62 Å²	62	55 Å²	55	31%	0.305	32%	0.32	S	S	.	.	H	α-helix	trans	-57.4	-38.4	171.4	-80.3	-168.2	-80.2	0	0	112.9	E1192 K1193 L1194 V1200	E1192-M1196 WeakPolarHBondContact O-CB 3.46Å; E1192-M1196 WeakPolarHBondContact O-CG 3.43Å; E1192-M1196 PolarHBondContact O-N 3.42Å; K1193-M1196 HydrophobicContact CG-CE 4.3Å; L1194-M1196 VanDerWaalsContact C-N 3.28Å; L1194-M1196 PolarHBondContact O-N 2.9Å; M1196-V1200 WeakPolarHBondContact O-CB 3.34Å; M1196-V1200 WeakPolarHBondContact O-CG2 3.12Å; M1196-V1200 PolarHBondContact O-N 2.93Å; M1196-V1200 VanDerWaalsContact O-N 3.11Å
1197	E	64.7	Low	61.8	Low	7 Å²	7	64.4 Å²	64.4	3%	0.033	36%	0.357	C	S	.	.	H	α-helix	trans	-65.8	-45.8	176.6	-156.8	-146.7	157.4	0	0	111.6	R872 Y1153 L1194 Q1195 N1199 V1200 T1201	R872-E1197 IonicContact CZ-OE1 2.71Å; R872-E1197 VanDerWaalsContact CZ-OE1 3.22Å; R872-E1197 IonicContact NH1-OE1 2.8Å; R872-E1197 PolarHBondContact NH1-OE1 3.08Å; R872-E1197 IonicContact NH2-OE1 2.77Å; R872-E1197 PolarHBondContact NH2-OE1 3.37Å; Y1153-E1197 HydrophobicContact CE1-CB 4.48Å; Y1153-E1197 HydrophobicContact CE1-CG 4.17Å; Y1153-E1197 WeakPolarHBondContact CE1-OE2 3.41Å; Y1153-E1197 WeakPolarHBondContact OH-CB 3.38Å; Y1153-E1197 WeakPolarHBondContact OH-CG 3.45Å; L1194-E1197 WeakPolarHBondContact O-CB 3.32Å; L1194-E1197 PolarHBondContact O-N 2.78Å; Q1195-E1197 VanDerWaalsContact C-N 3.28Å; Q1195-E1197 PolarHBondContact O-N 3.42Å; E1197-N1199 PolarHBondContact O-N 3.36Å; E1197-V1200 PolarHBondContact O-N 3Å; E1197-T1201 HydrophobicContact CG-CG2 4.26Å; E1197-T1201 WeakPolarHBondContact O-CB 3.18Å; E1197-T1201 WeakPolarHBondContact O-CG2 3.3Å; E1197-T1201 PolarHBondContact O-N 3.44Å; E1197-T1201 PolarHBondContact O-OG1 2.78Å
1198	Q	67.2	Low	58.7	Low	98 Å²	98	68.5 Å²	68.5	46%	0.458	38%	0.379	S	S	.	.	H	α-helix	trans	-58	-50.3	-178.8	-68.2	170.4	-49.9	0	0	110.6	L1194 Q1195 V1200 T1201 G1202	L1194-Q1198 PolarHBondContact O-N 3.17Å; Q1195-Q1198 PolarHBondContact O-N 3.36Å; Q1198-V1200 VanDerWaalsContact C-N 3.33Å; Q1198-V1200 PolarHBondContact O-N 2.68Å; Q1198-T1201 CarbonylContact O-C 3.57Å; Q1198-T1201 PolarHBondContact O-N 2.72Å; Q1198-T1201 VanDerWaalsContact O-N 3.09Å; Q1198-T1201 PolarHBondContact O-OG1 3.38Å; Q1198-G1202 PolarHBondContact O-N 2.95Å; Q1198-G1202 VanDerWaalsContact O-N 3.15Å
1199	N	62.3	Low	56	Low	76 Å²	76	67.7 Å²	67.7	41%	0.406	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-33.5	179	-60.8	16.5	0	0	0	112.4	K863 Q1195 E1197	K863-N1199 PolarHBondContact NZ-O 2.98Å; Q1195-N1199 PolarHBondContact O-N 2.78Å; Q1195-N1199 VanDerWaalsContact O-N 3.11Å; Q1195-N1199 PolarHBondContact O-OD1 3.01Å; E1197-N1199 PolarHBondContact O-N 3.36Å
1200	V	58	Low	53.5	Low	28 Å²	28	74.9 Å²	74.9	17%	0.17	42%	0.421	C	S	.	.	H	α-helix	trans	-74.5	-26.3	174.9	-180	0	0	0	0	111.9	I799 L859 K863 M1196 E1197 Q1198	I799-V1200 HydrophobicContact CD1-CG1 3.42Å; I799-V1200 VanDerWaalsContact CD1-CG1 3.42Å; I799-V1200 HydrophobicContact CG2-CG1 4.24Å; L859-V1200 HydrophobicContact CD1-CG2 3.75Å; L859-V1200 HydrophobicContact CG-CG2 4.46Å; K863-V1200 WeakPolarHBondContact CE-O 3.43Å; M1196-V1200 WeakPolarHBondContact O-CB 3.34Å; M1196-V1200 WeakPolarHBondContact O-CG2 3.12Å; M1196-V1200 PolarHBondContact O-N 2.93Å; M1196-V1200 VanDerWaalsContact O-N 3.11Å; E1197-V1200 PolarHBondContact O-N 3Å; Q1198-V1200 VanDerWaalsContact C-N 3.33Å; Q1198-V1200 PolarHBondContact O-N 2.68Å
1201	T	59.2	Low	50.8	Low	29 Å²	29	81.2 Å²	81.2	18%	0.178	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	6.8	-176.2	55.5	0	0	0	0	114.2	R872 E1197 Q1198 C1203	R872-T1201 PolarHBondContact NH2-OG1 3.11Å; R872-T1201 VanDerWaalsContact NH2-OG1 3.17Å; E1197-T1201 HydrophobicContact CG-CG2 4.26Å; E1197-T1201 WeakPolarHBondContact O-CB 3.18Å; E1197-T1201 WeakPolarHBondContact O-CG2 3.3Å; E1197-T1201 PolarHBondContact O-N 3.44Å; E1197-T1201 PolarHBondContact O-OG1 2.78Å; Q1198-T1201 CarbonylContact O-C 3.57Å; Q1198-T1201 PolarHBondContact O-N 2.72Å; Q1198-T1201 VanDerWaalsContact O-N 3.09Å; Q1198-T1201 PolarHBondContact O-OG1 3.38Å; T1201-C1203 PolarHBondContact O-N 3.39Å; T1201-C1203 VanDerWaalsContact O-N 3.17Å; T1201-C1203 PolarHBondContact O-SG 2.91Å
1202	G	52.7	Low	48.2	Very low	37 Å²	37	82.4 Å²	82.4	38%	0.381	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	8.4	168.6	0	0	0	0	0	115.1	Q1198 V1204	Q1198-G1202 PolarHBondContact O-N 2.95Å; Q1198-G1202 VanDerWaalsContact O-N 3.15Å; G1202-V1204 PolarHBondContact O-N 3.14Å
1203	C	39.6	Very low	46	Very low	42 Å²	42	84.3 Å²	84.3	28%	0.284	46%	0.462	S	S	.	.			trans	-91	74.3	-175.6	-61.6	0	0	0	0	110.2	L874 T1201 S1205	L874-C1203 HydrophobicContact CD1-CB 4.06Å; T1201-C1203 PolarHBondContact O-N 3.39Å; T1201-C1203 VanDerWaalsContact O-N 3.17Å; T1201-C1203 PolarHBondContact O-SG 2.91Å; C1203-S1205 PolarHBondContact O-N 3.31Å
1204	V	28.2	Very low	43.9	Very low	117 Å²	117	90 Å²	90	71%	0.709	49%	0.489	S	S	*	.			trans	-73.4	106.2	164.3	-178	0	0	0	0	107.4	G1202 G1206	G1202-V1204 PolarHBondContact O-N 3.14Å; V1204-G1206 PolarHBondContact O-N 2.87Å
1205	S	26.9	Very low	41.7	Very low	102 Å²	102	90.7 Å²	90.7	71%	0.713	50%	0.499	S	S	*	.			trans	-71.1	109.1	164.4	-70.5	0	0	0	0	108	C1203 Y1207	C1203-S1205 PolarHBondContact O-N 3.31Å; S1205-Y1207 PolarHBondContact O-N 2.95Å
1206	G	24.1	Very low	39.8	Very low	60 Å²	60	90.4 Å²	90.4	62%	0.619	50%	0.498	S	S	*	.	S	Bend	trans	-71	33.5	179.8	0	0	0	0	0	115.3	V1204	V1204-G1206 PolarHBondContact O-N 2.87Å
1207	Y	24.3	Very low	38.3	Very low	202 Å²	202	93.4 Å²	93.4	79%	0.792	51%	0.509	S	S	*	.			trans	-140.7	109	-178.9	-66.4	-79	0	0	0	109.1	S1205	S1205-Y1207 PolarHBondContact O-N 2.95Å
1208	N	25.2	Very low	36.8	Very low	125 Å²	125	97.9 Å²	97.9	67%	0.668	54%	0.537	S	S	*	.			trans	153.9	-3.1	159.4	-84.2	-2	0	0	0	113.7	E1210	N1208-E1210 PolarHBondContact O-N 2.63Å
1209	T	28.9	Very low	35.2	Very low	105 Å²	105	96.4 Å²	96.4	64%	0.644	54%	0.542	S	S	*	.	H	α-helix	trans	-58.1	-35.9	-178.3	-40.2	0	0	0	0	112.8
1210	E	28.3	Very low	33.9	Very low	164 Å²	164	100.3 Å²	100.3	77%	0.766	55%	0.551	S	S	*	*	H	α-helix	trans	-68.9	-45.8	-171.4	-63	169.7	151.8	0	0	113.5	N1208 T1212 E1213 E1214	N1208-E1210 PolarHBondContact O-N 2.63Å; E1210-T1212 PolarHBondContact O-N 3.39Å; E1210-E1213 PolarHBondContact O-N 3.44Å; E1210-E1213 VanDerWaalsContact O-N 3.13Å; E1210-E1214 PolarHBondContact O-N 3.38Å
1211	Q	27.9	Very low	32.8	Very low	146 Å²	146	104.5 Å²	104.5	68%	0.682	58%	0.576	S	S	*	*	H	α-helix	trans	-67.2	-24.1	-176.7	-67.9	-172.3	-6.6	0	0	113.6	S1215	Q1211-S1215 PolarHBondContact O-OG 2.93Å
1212	T	30.7	Very low	31.4	Very low	91 Å²	91	108.4 Å²	108.4	56%	0.558	61%	0.605	S	S	*	*	H	α-helix	trans	-73.9	-37.4	176	-44.9	0	0	0	0	110.7	E1210 E1216	E1210-T1212 PolarHBondContact O-N 3.39Å; T1212-E1216 PolarHBondContact O-N 2.82Å; T1212-E1216 VanDerWaalsContact O-N 3.14Å
1213	E	30.3	Very low	30.5	Very low	99 Å²	99	111.5 Å²	111.5	46%	0.463	62%	0.621	S	S	.	*	H	α-helix	trans	-72.6	-39.4	-179.3	-72.3	-154.7	-179.3	0	0	113.4	E1210 S1215 E1216 K1217	E1210-E1213 PolarHBondContact O-N 3.44Å; E1210-E1213 VanDerWaalsContact O-N 3.13Å; E1213-S1215 VanDerWaalsContact C-N 3.3Å; E1213-S1215 PolarHBondContact O-N 3.09Å; E1213-E1216 PolarHBondContact O-N 2.89Å; E1213-K1217 HydrophobicContact CB-CD 4.31Å; E1213-K1217 VanDerWaalsContact O-CB 3.24Å; E1213-K1217 WeakPolarHBondContact O-CB 3.19Å; E1213-K1217 WeakPolarHBondContact O-CD 3.45Å; E1213-K1217 WeakPolarHBondContact O-CG 3.2Å; E1213-K1217 PolarHBondContact O-N 3.26Å; E1213-K1217 VanDerWaalsContact OE2-CE 3.31Å; E1213-K1217 WeakPolarHBondContact OE2-CE 3.43Å; E1213-K1217 IonicContact OE2-NZ 2.62Å; E1213-K1217 PolarHBondContact OE2-NZ 3.29Å
1214	E	29.1	Very low	29.8	Very low	139 Å²	139	120.9 Å²	120.9	65%	0.65	65%	0.65	S	S	*	*	H	α-helix	trans	-64.5	-37.2	176.3	-65.7	-160.3	118.2	0	0	112.1	E1210 K1217 T1218	E1210-E1214 PolarHBondContact O-N 3.38Å; E1214-K1217 PolarHBondContact O-N 3.14Å; E1214-T1218 WeakPolarHBondContact O-CB 3.31Å; E1214-T1218 WeakPolarHBondContact O-CG2 3.49Å; E1214-T1218 PolarHBondContact O-N 3.07Å; E1214-T1218 PolarHBondContact O-OG1 2.92Å
1215	S	30.6	Very low	29.8	Very low	78 Å²	78	126.3 Å²	126.3	55%	0.545	66%	0.658	S	S	.	*	H	α-helix	trans	-64	-40.1	174.8	-58.9	0	0	0	0	112.2	Q1211 E1213 T1218 A1219	Q1211-S1215 PolarHBondContact O-OG 2.93Å; E1213-S1215 VanDerWaalsContact C-N 3.3Å; E1213-S1215 PolarHBondContact O-N 3.09Å; S1215-T1218 PolarHBondContact O-OG1 3.08Å; S1215-T1218 VanDerWaalsContact O-OG1 3.13Å; S1215-A1219 WeakPolarHBondContact O-CB 3.3Å; S1215-A1219 PolarHBondContact O-N 3.03Å
1216	E	34.2	Very low	29.9	Very low	91 Å²	91	132.6 Å²	132.6	43%	0.425	67%	0.666	S	S	.	*	H	α-helix	trans	-76.2	-35.1	174.1	-71.1	-149.6	131.4	0	0	113.5	T1212 E1213 A1219 R1220	T1212-E1216 PolarHBondContact O-N 2.82Å; T1212-E1216 VanDerWaalsContact O-N 3.14Å; E1213-E1216 PolarHBondContact O-N 2.89Å; E1216-A1219 PolarHBondContact O-N 3.15Å; E1216-R1220 WeakPolarHBondContact O-CB 3.36Å; E1216-R1220 VanDerWaalsContact O-CG 3.31Å; E1216-R1220 WeakPolarHBondContact O-CG 3.43Å; E1216-R1220 PolarHBondContact O-N 3.37Å; E1216-R1220 IonicContact OE1-CZ 3.56Å; E1216-R1220 IonicContact OE1-NH2 3.79Å; E1216-R1220 PolarHBondContact OE1-NH2 3.06Å; E1216-R1220 IonicContact OE2-CZ 2.84Å; E1216-R1220 IonicContact OE2-NH1 3.82Å; E1216-R1220 PolarHBondContact OE2-NH1 2.82Å; E1216-R1220 IonicContact OE2-NH2 3.78Å; E1216-R1220 PolarHBondContact OE2-NH2 3.16Å
1217	K	31.8	Very low	30.1	Very low	125 Å²	125	140.9 Å²	140.9	54%	0.543	68%	0.679	S	S	.	*	H	α-helix	trans	-65.8	-40.4	178.8	-75.9	161.5	-179.7	166.2	0	111	E1213 E1214	E1213-K1217 HydrophobicContact CB-CD 4.31Å; E1213-K1217 VanDerWaalsContact O-CB 3.24Å; E1213-K1217 WeakPolarHBondContact O-CB 3.19Å; E1213-K1217 WeakPolarHBondContact O-CD 3.45Å; E1213-K1217 WeakPolarHBondContact O-CG 3.2Å; E1213-K1217 PolarHBondContact O-N 3.26Å; E1213-K1217 VanDerWaalsContact OE2-CE 3.31Å; E1213-K1217 WeakPolarHBondContact OE2-CE 3.43Å; E1213-K1217 IonicContact OE2-NZ 2.62Å; E1213-K1217 PolarHBondContact OE2-NZ 3.29Å; E1214-K1217 PolarHBondContact O-N 3.14Å
1218	T	32.4	Very low	30.1	Very low	102 Å²	102	136.4 Å²	136.4	63%	0.626	68%	0.676	S	S	*	*	H	α-helix	trans	-68.8	-42.7	173.3	49.7	0	0	0	0	112.3	E1214 S1215 R1220	E1214-T1218 WeakPolarHBondContact O-CB 3.31Å; E1214-T1218 WeakPolarHBondContact O-CG2 3.49Å; E1214-T1218 PolarHBondContact O-N 3.07Å; E1214-T1218 PolarHBondContact O-OG1 2.92Å; S1215-T1218 PolarHBondContact O-OG1 3.08Å; S1215-T1218 VanDerWaalsContact O-OG1 3.13Å; T1218-R1220 PolarHBondContact O-N 2.97Å
1219	A	35.1	Very low	30.3	Very low	67 Å²	67	140.2 Å²	140.2	55%	0.554	69%	0.687	S	S	*	*	H	α-helix	trans	-64.5	-33.3	178.1	0	0	0	0	0	114.1	S1215 E1216 V1221	S1215-A1219 WeakPolarHBondContact O-CB 3.3Å; S1215-A1219 PolarHBondContact O-N 3.03Å; E1216-A1219 PolarHBondContact O-N 3.15Å; A1219-V1221 VanDerWaalsContact C-N 3.35Å; A1219-V1221 PolarHBondContact O-N 2.93Å
1220	R	34.1	Very low	30.3	Very low	157 Å²	157	140.5 Å²	140.5	59%	0.592	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-7.3	-176.5	-76.3	-179.6	179.9	124.2	13.2	115.5	E1216 T1218	E1216-R1220 WeakPolarHBondContact O-CB 3.36Å; E1216-R1220 VanDerWaalsContact O-CG 3.31Å; E1216-R1220 WeakPolarHBondContact O-CG 3.43Å; E1216-R1220 PolarHBondContact O-N 3.37Å; E1216-R1220 IonicContact OE1-CZ 3.56Å; E1216-R1220 IonicContact OE1-NH2 3.79Å; E1216-R1220 PolarHBondContact OE1-NH2 3.06Å; E1216-R1220 IonicContact OE2-CZ 2.84Å; E1216-R1220 IonicContact OE2-NH1 3.82Å; E1216-R1220 PolarHBondContact OE2-NH1 2.82Å; E1216-R1220 IonicContact OE2-NH2 3.78Å; E1216-R1220 PolarHBondContact OE2-NH2 3.16Å; T1218-R1220 PolarHBondContact O-N 2.97Å
1221	V	34.4	Very low	30.4	Very low	116 Å²	116	136.2 Å²	136.2	70%	0.703	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-29.1	179.8	171.8	0	0	0	0	112.7	A1219 S1223	A1219-V1221 VanDerWaalsContact C-N 3.35Å; A1219-V1221 PolarHBondContact O-N 2.93Å; V1221-S1223 PolarHBondContact O-N 3.08Å
1222	S	31.6	Very low	30.3	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-0.8	-164	-57.6	0	0	0	0	116.7
1223	S	32.3	Very low	30.2	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	29.4	-165.7	54.6	0	0	0	0	115.5	V1221	V1221-S1223 PolarHBondContact O-N 3.08Å
1224	R	25.8	Very low	30	Very low	238 Å²	238	141.3 Å²	141.3	90%	0.898	72%	0.716	S	S	*	*			trans	-102.9	87.2	-168.6	-154.4	176.6	-164.4	-178.6	5.8	114.8
1225	R	27.9	Very low	30	Very low	231 Å²	231	140.2 Å²	140.2	87%	0.872	72%	0.721	S	S	*	*			trans	-153.5	122.6	166.8	-125.9	174.8	-175.7	-176.8	2.1	115.6
1226	R	29.2	Very low	29.7	Very low	235 Å²	235	142.1 Å²	142.1	89%	0.887	73%	0.733	S	S	*	*			trans	72.7	142.5	171.3	-56.6	173.6	174.2	173.8	-2.7	115.8
1227	R	27.4	Very low	29.2	Very low	234 Å²	234	143.1 Å²	143.1	88%	0.883	75%	0.75	S	S	*	*			cis	-161.9	179.8	-28.6	-145.6	-179.8	-175	-175.6	1.9	109.2
1228	S	25.3	Very low	29	Very low	107 Å²	107	142.1 Å²	142.1	75%	0.748	76%	0.759	S	S	*	*				-149.9	128.3	-108.2	-62.3	0	0	0	0	111.6
1229	K	29.3	Very low	28.9	Very low	205 Å²	205	144.4 Å²	144.4	89%	0.891	77%	0.766	S	S	*	*			trans	-177	148.4	170.1	-96.4	157.5	-177.6	-173.5	0	106.6
1230	S	28.4	Very low	28.3	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	78%	0.779	S	S	*	*			cis	170.9	149.7	-10.9	-88.8	0	0	0	0	105.2
1231	A	29.7	Very low	28	Very low	75 Å²	75	144.4 Å²	144.4	62%	0.62	79%	0.785	S	S	*	*			cis	-171.2	159.7	-12.1	0	0	0	0	0	110.4
1232	N	26.3	Very low	27.8	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	79%	0.793	S	S	*	*			trans	66	153.6	151	-63.7	4.6	0	0	0	119
1233	I	28.2	Very low	27.7	Very low	134 Å²	134	147.8 Å²	147.8	69%	0.687	79%	0.791	S	S	*	*			cis	-153.1	125.3	2.3	-113.1	152.9	0	0	0	106.2
1234	L	25.8	Very low	27.5	Very low	159 Å²	159	150.4 Å²	150.4	83%	0.832	79%	0.792	S	S	*	*				76.7	145.6	87.1	-69	174.2	0	0	0	118
1235	P	30.3	Very low	27.5	Very low	116 Å²	116	146 Å²	146	75%	0.753	79%	0.786	S	S	*	*			trans	-143.2	-166.6	-149	41.1	-18.3	0	0	0	118.5
1236	C	23.1	Very low	27.6	Very low	119 Å²	119	138.2 Å²	138.2	80%	0.804	78%	0.778	S	S	*	*			trans	94.3	159.6	143.5	-150.4	0	0	0	0	122.2
1237	S	25.3	Very low	27.5	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	77%	0.773	S	S	*	*			trans	68.1	148.8	176.3	73.1	0	0	0	0	116.9
1238	S	26.9	Very low	27.4	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	77%	0.77	S	S	*	*			cis	-155.3	-178.6	-7.7	44.9	0	0	0	0	107.3
1239	L	29.6	Very low	27.4	Very low	150 Å²	150	133.6 Å²	133.6	79%	0.785	78%	0.776	S	S	*	*			cis	-167.4	166.8	29.6	-144.5	152.2	0	0	0	109.4
1240	D	23.3	Very low	27.3	Very low	154 Å²	154	132.8 Å²	132.8	82%	0.824	77%	0.772	S	S	*	*			trans	-75.3	166.9	-170.9	-43.9	-95.6	0	0	0	117.1
1241	G	27.8	Very low	27.2	Very low	69 Å²	69	134.3 Å²	134.3	71%	0.711	78%	0.777	S	S	*	*			trans	168.2	95.7	160.9	0	0	0	0	0	119.6
1242	M	29.4	Very low	26.9	Very low	179 Å²	179	138.5 Å²	138.5	88%	0.882	79%	0.788	S	S	*	*			trans	67	117.8	139.8	-68.1	173.8	175.5	0	0	122.2
1243	T	30.9	Very low	26.8	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	78%	0.779	S	S	*	*				32.6	143	125.7	62.9	0	0	0	0	120.8
1244	E	27.4	Very low	26.6	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	79%	0.787	S	S	*	*			cis	-169.9	171.8	-3.9	-121.7	-178.3	-162	0	0	109.2
1245	N	27	Very low	26.6	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	79%	0.79	S	S	*	*			trans	42.9	94.2	148.9	-66.2	-38.5	0	0	0	119.6
1246	G	28.3	Very low	26.3	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	79%	0.793	S	S	*	*			trans	173.1	126	159.7	0	0	0	0	0	118.2
1247	N	27.4	Very low	26.5	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	79%	0.794	S	S	*	*			trans	63.1	83.6	157.7	-55.4	-58.2	0	0	0	118.4	F1249	N1247-F1249 PolarHBondContact O-N 3.5Å
1248	V	24.7	Very low	26.4	Very low	136 Å²	136	139.3 Å²	139.3	82%	0.824	80%	0.796	S	S	*	*	S	Bend	trans	-73.6	60	161.5	-169.8	0	0	0	0	110.6
1249	F	26	Very low	26.5	Very low	199 Å²	199	139.5 Å²	139.5	87%	0.873	80%	0.804	S	S	*	*			trans	-154.1	44.4	-178.8	-123.5	-74.9	0	0	0	112.8	N1247	N1247-F1249 PolarHBondContact O-N 3.5Å
1250	K	26.6	Very low	26.2	Very low	188 Å²	188	136.9 Å²	136.9	82%	0.817	80%	0.798	S	S	*	*			trans	-146	10.9	-176	-129	173.5	-173.9	176	0	117.9	L1252	K1250-L1252 VanDerWaalsContact C-N 3.35Å; K1250-L1252 PolarHBondContact O-N 3.32Å
1251	V	26.6	Very low	26.3	Very low	143 Å²	143	136.4 Å²	136.4	87%	0.867	80%	0.796	S	S	*	*			trans	-98.4	41.1	-177	-158.8	0	0	0	0	112.3
1252	L	24.7	Very low	26.2	Very low	163 Å²	163	141.3 Å²	141.3	85%	0.853	81%	0.805	S	S	*	*	S	Bend	trans	-132.7	74.5	171	-76.1	177	0	0	0	109.5	K1250	K1250-L1252 VanDerWaalsContact C-N 3.35Å; K1250-L1252 PolarHBondContact O-N 3.32Å
1253	G	23.6	Very low	25.9	Very low	59 Å²	59	137.8 Å²	137.8	61%	0.608	80%	0.798	S	S	*	*	S	Bend	trans	167.2	144.6	177.7	0	0	0	0	0	111.5
1254	N	23.4	Very low	25.5	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	80%	0.8	S	S	*	*			trans	65.9	77.3	173	-52.8	-18	0	0	0	117.2
1255	L	26.3	Very low	25.4	Very low	172 Å²	172	136 Å²	136	90%	0.901	80%	0.795	S	S	*	*			trans	-132.7	106.5	148.3	-77.5	179.4	0	0	0	110.3
1256	N	23.2	Very low	25.2	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	78%	0.778	S	S	*	*			trans	-87.1	131.3	168	-76.5	-28	0	0	0	109.3
1257	P	27.6	Very low	25.2	Very low	127 Å²	127	133.8 Å²	133.8	83%	0.825	77%	0.769	S	S	*	*			trans	-93.6	99.4	175.9	33.6	-30.5	0	0	0	111.8
1258	T	24.3	Very low	25.2	Very low	133 Å²	133	130.8 Å²	130.8	82%	0.816	75%	0.753	S	S	*	*			trans	-142.2	84.6	171.9	55.4	0	0	0	0	112.8
1259	A	27.9	Very low	25.5	Very low	109 Å²	109	126.7 Å²	126.7	90%	0.901	73%	0.729	S	S	*	*			trans	-159.6	148.3	158.1	0	0	0	0	0	109.5
1260	S	24.6	Very low	25.8	Very low	95 Å²	95	118.8 Å²	118.8	66%	0.664	70%	0.696	S	S	*	*			trans	-112	149.8	178.4	51.3	0	0	0	0	111
1261	D	24.3	Very low	25.9	Very low	144 Å²	144	112 Å²	112	77%	0.77	67%	0.672	S	S	*	*				160.2	171.8	104.4	-95.6	-62	0	0	0	113.4
1262	L	26.2	Very low	26.4	Very low	171 Å²	171	107.5 Å²	107.5	90%	0.895	65%	0.647	S	S	*	*			trans	79.6	128.6	171.5	-58.5	168.5	0	0	0	117.4
1263	S	22.4	Very low	27.1	Very low	105 Å²	105	103.5 Å²	103.5	73%	0.734	63%	0.632	S	S	*	*			trans	-84.6	156.6	-171	54.6	0	0	0	0	114.8
1264	L	24	Very low	28.1	Very low	150 Å²	150	107.9 Å²	107.9	79%	0.785	63%	0.631	S	S	*	*				-170.9	-177.2	122.2	-100.4	161.5	0	0	0	112.4
1265	S	23.4	Very low	29.7	Very low	90 Å²	90	101.7 Å²	101.7	63%	0.629	60%	0.597	S	S	*	*			trans	-108.3	127.4	-148.9	56.8	0	0	0	0	118.2
1266	I	24.2	Very low	31.2	Very low	80 Å²	80	95 Å²	95	41%	0.41	57%	0.565	S	S	.	*			trans	40.3	110.5	141.7	-48.3	171.2	0	0	0	118	M836 S838	M836-I1266 HydrophobicContact CB-CD1 4.03Å; S838-I1266 WeakPolarHBondContact O-CD1 3.49Å
1267	V	27.9	Very low	33	Very low	86 Å²	86	93.1 Å²	93.1	52%	0.521	55%	0.551	S	S	.	*			trans	-125.3	151.4	162.9	-179.6	0	0	0	0	110.3	P849	P849-V1267 HydrophobicContact CB-CG1 4.31Å; P849-V1267 HydrophobicContact CB-CG2 3.93Å
1268	N	28	Very low	34.6	Very low	83 Å²	83	93.3 Å²	93.3	44%	0.444	54%	0.536	S	S	.	.			trans	-101.8	127	-166.5	-56.3	-30.9	0	0	0	113	P835 I1270	P835-N1268 HydrophobicContact CB-CB 4.08Å; P835-N1268 WeakPolarHBondContact CB-OD1 3.32Å; P835-N1268 HydrophobicContact CG-CB 4.12Å; P835-N1268 WeakPolarHBondContact CG-OD1 3.43Å; N1268-I1270 PolarHBondContact O-N 3.43Å
1269	P	30.4	Very low	36.5	Very low	49 Å²	49	87.4 Å²	87.4	32%	0.318	50%	0.499	S	S	.	.			trans	-72.9	115.4	176.6	25.6	-31.9	0	0	0	112.8
1270	I	31.9	Very low	38.4	Very low	33 Å²	33	82.6 Å²	82.6	17%	0.169	46%	0.458	C	S	.	.			trans	-95.5	116.4	-176.4	-59	175	0	0	0	110.7	N1268 D1279	N1268-I1270 PolarHBondContact O-N 3.43Å; I1270-D1279 WeakPolarHBondContact CG2-OD2 3.22Å
1271	S	29.9	Very low	40.6	Very low	46 Å²	46	84.4 Å²	84.4	32%	0.322	45%	0.451	S	S	.	.			trans	-109.4	130.3	-172	51.3	0	0	0	0	116	N802	N802-S1271 VanDerWaalsContact ND2-CB 3.26Å; N802-S1271 WeakPolarHBondContact ND2-CB 3.41Å
1272	S	35.9	Very low	42.9	Very low	48 Å²	48	80 Å²	80	34%	0.336	43%	0.431	S	S	.	.	S	Bend	trans	74.6	76.3	142	73.7	0	0	0	0	120.8	E805 R1274	E805-S1272 WeakPolarHBondContact OE1-CA 3.36Å; E805-S1272 WeakPolarHBondContact OE1-CB 3.48Å; S1272-R1274 PolarHBondContact O-N 2.9Å
1273	S	39.7	Very low	45.3	Very low	79 Å²	79	72 Å²	72	55%	0.552	39%	0.389	S	S	*	.	S	Bend	trans	60.3	-12.5	155.2	60.8	0	0	0	0	119.9	K773	K773-S1273 WeakPolarHBondContact CE-OG 3.05Å
1274	R	45.4	Very low	47.8	Very low	151 Å²	151	67 Å²	67	57%	0.57	35%	0.354	S	S	*	.	S	Bend	trans	-107.4	148.2	155.5	-64.3	179.4	179.7	173.7	1.3	105.9	S394 S1272 S1276	S394-R1274 PolarHBondContact OG-NH2 2.88Å; S1272-R1274 PolarHBondContact O-N 2.9Å; R1274-S1276 PolarHBondContact O-N 3.28Å
1275	I	56.2	Low	50.2	Low	32 Å²	32	61.9 Å²	61.9	16%	0.164	33%	0.331	C	S	.	.			trans	-53.1	132.4	162	-38.7	158.9	0	0	0	106.2	F1150 D1279 V1280	F1150-I1275 HydrophobicContact CB-CD1 4.28Å; F1150-I1275 HydrophobicContact CB-CG1 3.61Å; F1150-I1275 HydrophobicContact CD1-CD1 3.49Å; F1150-I1275 VanDerWaalsContact CD1-CD1 3.49Å; F1150-I1275 HydrophobicContact CD1-CG1 3.59Å; F1150-I1275 HydrophobicContact CD2-CD1 3.65Å; F1150-I1275 HydrophobicContact CD2-CG1 3.92Å; F1150-I1275 HydrophobicContact CE1-CD1 3.51Å; F1150-I1275 HydrophobicContact CE1-CG1 4.16Å; F1150-I1275 HydrophobicContact CE2-CD1 3.68Å; F1150-I1275 HydrophobicContact CE2-CG1 4.45Å; F1150-I1275 HydrophobicContact CG-CD1 3.55Å; F1150-I1275 HydrophobicContact CG-CG1 3.44Å; F1150-I1275 VanDerWaalsContact CG-CG1 3.44Å; F1150-I1275 HydrophobicContact CZ-CD1 3.61Å; I1275-D1279 HydrophobicContact CG2-CB 3.69Å; I1275-D1279 WeakPolarHBondContact CG2-OD2 3.5Å; I1275-V1280 HydrophobicContact CB-CG2 3.55Å; I1275-V1280 HydrophobicContact CD1-CG2 3.75Å; I1275-V1280 HydrophobicContact CG1-CG2 4.27Å; I1275-V1280 HydrophobicContact CG2-CB 4.41Å; I1275-V1280 HydrophobicContact CG2-CG2 3.48Å; I1275-V1280 VanDerWaalsContact CG2-CG2 3.48Å
1276	S	57.4	Low	52.6	Low	32 Å²	32	59.7 Å²	59.7	22%	0.224	31%	0.312	C	S	.	.			trans	-66.2	149.2	170.4	105.7	0	0	0	0	107.9	R1274 R1278 D1279 V1280	R1274-S1276 PolarHBondContact O-N 3.28Å; S1276-R1278 PolarHBondContact O-N 2.9Å; S1276-R1278 WeakPolarHBondContact OG-CB 3.41Å; S1276-R1278 PolarHBondContact OG-N 3.12Å; S1276-D1279 WeakPolarHBondContact CB-OD1 3.28Å; S1276-D1279 PolarHBondContact N-OD2 2.7Å; S1276-D1279 PolarHBondContact O-N 3.04Å; S1276-D1279 PolarHBondContact OG-N 3.32Å; S1276-D1279 PolarHBondContact OG-OD1 3.13Å; S1276-V1280 PolarHBondContact O-N 3.27Å
1277	E	60.3	Low	54.9	Low	112 Å²	112	56.1 Å²	56.1	52%	0.523	30%	0.295	S	S	.	.	H	α-helix	trans	-61.1	-20	-178.7	-148.7	-161.7	140	0	0	111.8	R1281	E1277-R1281 VanDerWaalsContact O-CB 3.3Å; E1277-R1281 WeakPolarHBondContact O-CB 3.36Å; E1277-R1281 VanDerWaalsContact O-CD 3.28Å; E1277-R1281 WeakPolarHBondContact O-CD 3.19Å; E1277-R1281 WeakPolarHBondContact O-CG 3.02Å; E1277-R1281 PolarHBondContact O-N 3.45Å; E1277-R1281 IonicContact OE1-CZ 3.07Å; E1277-R1281 IonicContact OE1-NE 3.22Å; E1277-R1281 PolarHBondContact OE1-NE 3.11Å; E1277-R1281 IonicContact OE1-NH2 2.9Å; E1277-R1281 PolarHBondContact OE1-NH2 2.77Å; E1277-R1281 IonicContact OE2-NH2 2.71Å
1278	R	61.3	Low	57.1	Low	132 Å²	132	53 Å²	53	50%	0.498	28%	0.275	S	S	.	.	H	α-helix	trans	-69.6	-49.5	171.4	-64.1	171.7	166.1	169.9	-14.6	111.7	P835 S1276 V1280 R1281 S1282	P835-R1278 VanDerWaalsContact CG-NH1 3.33Å; S1276-R1278 PolarHBondContact O-N 2.9Å; S1276-R1278 WeakPolarHBondContact OG-CB 3.41Å; S1276-R1278 PolarHBondContact OG-N 3.12Å; R1278-V1280 VanDerWaalsContact C-N 3.32Å; R1278-V1280 PolarHBondContact O-N 3.28Å; R1278-R1281 CarbonylContact O-C 3.57Å; R1278-R1281 PolarHBondContact O-N 3.14Å; R1278-R1281 VanDerWaalsContact O-N 3.09Å; R1278-S1282 VanDerWaalsContact O-CB 3.32Å; R1278-S1282 WeakPolarHBondContact O-CB 3.47Å; R1278-S1282 PolarHBondContact O-N 3.06Å
1279	D	64.3	Low	59.1	Low	8 Å²	8	56.8 Å²	56.8	4%	0.043	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-33.1	176.9	13	-48.1	0	0	0	111.7	I1189 I1270 I1275 S1276 S1282 L1283	I1189-D1279 HydrophobicContact CD1-CB 4.18Å; I1270-D1279 WeakPolarHBondContact CG2-OD2 3.22Å; I1275-D1279 HydrophobicContact CG2-CB 3.69Å; I1275-D1279 WeakPolarHBondContact CG2-OD2 3.5Å; S1276-D1279 WeakPolarHBondContact CB-OD1 3.28Å; S1276-D1279 PolarHBondContact N-OD2 2.7Å; S1276-D1279 PolarHBondContact O-N 3.04Å; S1276-D1279 PolarHBondContact OG-N 3.32Å; S1276-D1279 PolarHBondContact OG-OD1 3.13Å; D1279-S1282 PolarHBondContact O-N 2.67Å; D1279-L1283 VanDerWaalsContact O-CB 3.29Å; D1279-L1283 WeakPolarHBondContact O-CB 3.44Å; D1279-L1283 VanDerWaalsContact O-CG 3.24Å; D1279-L1283 WeakPolarHBondContact O-CG 3.48Å; D1279-L1283 PolarHBondContact O-N 3.29Å
1280	V	68.9	Low	60.5	Low	8 Å²	8	60 Å²	60	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-46.2	168.6	-175.6	0	0	0	0	111.1	P969 V973 I1275 S1276 R1278 L1284	P969-V1280 HydrophobicContact CB-CG1 3.77Å; V973-V1280 HydrophobicContact CB-CG1 4.5Å; V973-V1280 HydrophobicContact CG2-CG1 3.97Å; I1275-V1280 HydrophobicContact CB-CG2 3.55Å; I1275-V1280 HydrophobicContact CD1-CG2 3.75Å; I1275-V1280 HydrophobicContact CG1-CG2 4.27Å; I1275-V1280 HydrophobicContact CG2-CB 4.41Å; I1275-V1280 HydrophobicContact CG2-CG2 3.48Å; I1275-V1280 VanDerWaalsContact CG2-CG2 3.48Å; S1276-V1280 PolarHBondContact O-N 3.27Å; R1278-V1280 VanDerWaalsContact C-N 3.32Å; R1278-V1280 PolarHBondContact O-N 3.28Å; V1280-L1284 WeakPolarHBondContact O-CB 3.5Å; V1280-L1284 PolarHBondContact O-N 3.2Å
1281	R	70.2	Confident	61.9	Low	134 Å²	134	61.4 Å²	61.4	51%	0.506	31%	0.308	S	S	.	.	H	α-helix	trans	-71.4	-29.7	-178.9	-73.7	167.1	-179.3	-142.3	8.5	113	E1277 R1278 L1284 S1285	E1277-R1281 VanDerWaalsContact O-CB 3.3Å; E1277-R1281 WeakPolarHBondContact O-CB 3.36Å; E1277-R1281 VanDerWaalsContact O-CD 3.28Å; E1277-R1281 WeakPolarHBondContact O-CD 3.19Å; E1277-R1281 WeakPolarHBondContact O-CG 3.02Å; E1277-R1281 PolarHBondContact O-N 3.45Å; E1277-R1281 IonicContact OE1-CZ 3.07Å; E1277-R1281 IonicContact OE1-NE 3.22Å; E1277-R1281 PolarHBondContact OE1-NE 3.11Å; E1277-R1281 IonicContact OE1-NH2 2.9Å; E1277-R1281 PolarHBondContact OE1-NH2 2.77Å; E1277-R1281 IonicContact OE2-NH2 2.71Å; R1278-R1281 CarbonylContact O-C 3.57Å; R1278-R1281 PolarHBondContact O-N 3.14Å; R1278-R1281 VanDerWaalsContact O-N 3.09Å; R1281-L1284 CarbonylContact O-C 3.54Å; R1281-S1285 WeakPolarHBondContact O-CB 3.28Å; R1281-S1285 PolarHBondContact O-N 2.84Å
1282	S	73.8	Confident	63.6	Low	50 Å²	50	62.2 Å²	62.2	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-77.4	-47.8	177	161.1	0	0	0	0	111.3	R1278 D1279 L1284 S1285 D1286	R1278-S1282 VanDerWaalsContact O-CB 3.32Å; R1278-S1282 WeakPolarHBondContact O-CB 3.47Å; R1278-S1282 PolarHBondContact O-N 3.06Å; D1279-S1282 PolarHBondContact O-N 2.67Å; S1282-L1284 VanDerWaalsContact C-N 3.25Å; S1282-L1284 PolarHBondContact O-N 3.18Å; S1282-S1285 CarbonylContact O-C 3.46Å; S1282-S1285 WeakPolarHBondContact O-CA 3.43Å; S1282-S1285 VanDerWaalsContact O-CB 3.26Å; S1282-S1285 WeakPolarHBondContact O-CB 3.3Å; S1282-S1285 PolarHBondContact O-N 3.2Å; S1282-D1286 PolarHBondContact O-N 2.97Å
1283	L	75.2	Confident	65.2	Low	3 Å²	3	63 Å²	63	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-56.8	-41.9	170.9	-72.7	171.5	0	0	0	111.3	F1150 L1182 G1185 M1186 I1189 D1279 S1285 A1287	F1150-L1283 HydrophobicContact CD1-CD1 4.26Å; F1150-L1283 HydrophobicContact CE1-CD1 3.94Å; L1182-L1283 HydrophobicContact CD1-CB 3.87Å; L1182-L1283 WeakPolarHBondContact CD1-O 3.37Å; G1185-L1283 WeakPolarHBondContact O-CD2 3.11Å; M1186-L1283 HydrophobicContact CG-CD1 3.82Å; M1186-L1283 HydrophobicContact CG-CD2 4.26Å; I1189-L1283 HydrophobicContact CD1-CD1 4.16Å; I1189-L1283 HydrophobicContact CD1-CD2 3.74Å; I1189-L1283 HydrophobicContact CD1-CG 3.81Å; D1279-L1283 VanDerWaalsContact O-CB 3.29Å; D1279-L1283 WeakPolarHBondContact O-CB 3.44Å; D1279-L1283 VanDerWaalsContact O-CG 3.24Å; D1279-L1283 WeakPolarHBondContact O-CG 3.48Å; D1279-L1283 PolarHBondContact O-N 3.29Å; L1283-S1285 PolarHBondContact O-N 3.22Å; L1283-A1287 VanDerWaalsContact O-CB 3.3Å; L1283-A1287 WeakPolarHBondContact O-CB 3.06Å; L1283-A1287 PolarHBondContact O-N 3.3Å
1284	L	74.9	Confident	66.7	Low	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-78.5	-0.6	172.9	-167.1	64.2	0	0	0	113.6	R913 P969 M972 V973 L976 V1280 R1281 S1282 L1288	R913-L1284 PolarHBondContact NH1-O 3.47Å; P969-L1284 HydrophobicContact CB-CD2 4.16Å; M972-L1284 HydrophobicContact CB-CD1 4.15Å; M972-L1284 HydrophobicContact CB-CD2 3.79Å; M972-L1284 HydrophobicContact CE-CD2 3.77Å; M972-L1284 HydrophobicContact CG-CD2 4.42Å; M972-L1284 HydrophobicContact SD-CD2 4.01Å; V973-L1284 HydrophobicContact CG2-CB 4.17Å; V973-L1284 HydrophobicContact CG2-CD1 4.44Å; L976-L1284 HydrophobicContact CD1-CD1 3.79Å; V1280-L1284 WeakPolarHBondContact O-CB 3.5Å; V1280-L1284 PolarHBondContact O-N 3.2Å; R1281-L1284 CarbonylContact O-C 3.54Å; S1282-L1284 VanDerWaalsContact C-N 3.25Å; S1282-L1284 PolarHBondContact O-N 3.18Å; L1284-L1288 HydrophobicContact CD1-CD1 4.08Å; L1284-L1288 HydrophobicContact CD1-CD2 4.4Å; L1284-L1288 HydrophobicContact CD1-CG 4.08Å; L1284-L1288 HydrophobicContact CG-CD1 4.08Å; L1284-L1288 HydrophobicContact CG-CG 4.41Å; L1284-L1288 VanDerWaalsContact O-CD1 3.3Å; L1284-L1288 WeakPolarHBondContact O-CD1 3.27Å; L1284-L1288 VanDerWaalsContact O-CG 3.23Å; L1284-L1288 WeakPolarHBondContact O-CG 3.44Å
1285	S	75	Confident	68	Low	44 Å²	44	56.5 Å²	56.5	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-91.1	-52.1	167.2	-164.1	0	0	0	0	108.2	R1281 S1282 L1283 L1288 K1289	R1281-S1285 WeakPolarHBondContact O-CB 3.28Å; R1281-S1285 PolarHBondContact O-N 2.84Å; S1282-S1285 CarbonylContact O-C 3.46Å; S1282-S1285 WeakPolarHBondContact O-CA 3.43Å; S1282-S1285 VanDerWaalsContact O-CB 3.26Å; S1282-S1285 WeakPolarHBondContact O-CB 3.3Å; S1282-S1285 PolarHBondContact O-N 3.2Å; L1283-S1285 PolarHBondContact O-N 3.22Å; S1285-L1288 CarbonylContact O-C 3.59Å; S1285-L1288 PolarHBondContact O-N 3.32Å; S1285-K1289 WeakPolarHBondContact O-CG 3.48Å; S1285-K1289 PolarHBondContact O-N 2.69Å
1286	D	74.7	Confident	68.8	Low	43 Å²	43	58.1 Å²	58.1	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-52.2	178.6	-65.3	11.6	0	0	0	111	R1188 S1282 L1288 K1289 L1290	R1188-D1286 IonicContact CZ-OD2 3.27Å; R1188-D1286 IonicContact NH1-OD2 2.76Å; R1188-D1286 IonicContact NH2-OD2 2.69Å; R1188-D1286 PolarHBondContact NH2-OD2 2.88Å; S1282-D1286 PolarHBondContact O-N 2.97Å; D1286-L1288 PolarHBondContact O-N 3.16Å; D1286-L1288 VanDerWaalsContact O-N 3.13Å; D1286-K1289 WeakPolarHBondContact O-CB 3.45Å; D1286-K1289 PolarHBondContact O-N 2.79Å; D1286-L1290 WeakPolarHBondContact O-CG 3.32Å; D1286-L1290 PolarHBondContact O-N 3.01Å
1287	A	71.6	Confident	69.6	Low	6 Å²	6	60 Å²	60	5%	0.05	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	12	176.6	0	0	0	0	0	114.9	L1182 L1283	L1182-A1287 HydrophobicContact CB-CB 4.28Å; L1182-A1287 HydrophobicContact CD1-CB 3.44Å; L1182-A1287 VanDerWaalsContact CD1-CB 3.44Å; L1182-A1287 HydrophobicContact CG-CB 4.48Å; L1283-A1287 VanDerWaalsContact O-CB 3.3Å; L1283-A1287 WeakPolarHBondContact O-CB 3.06Å; L1283-A1287 PolarHBondContact O-N 3.3Å
1288	L	73.6	Confident	70.3	Confident	20 Å²	20	56 Å²	56	11%	0.105	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	2.1	161.6	-61.2	-175.6	0	0	0	112.2	V906 L909 R910 L1284 S1285 D1286 L1290	V906-L1288 HydrophobicContact CB-CD2 4.36Å; V906-L1288 HydrophobicContact CG1-CD2 3.83Å; V906-L1288 HydrophobicContact CG2-CD2 4.47Å; L909-L1288 HydrophobicContact CB-CD2 4.41Å; R910-L1288 HydrophobicContact CG-CB 4.13Å; R910-L1288 HydrophobicContact CG-CD1 4.31Å; R910-L1288 HydrophobicContact CG-CD2 3.93Å; R910-L1288 HydrophobicContact CG-CG 4.35Å; R910-L1288 PolarHBondContact NE-O 3.37Å; R910-L1288 PolarHBondContact NH2-O 3.03Å; L1284-L1288 HydrophobicContact CD1-CD1 4.08Å; L1284-L1288 HydrophobicContact CD1-CD2 4.4Å; L1284-L1288 HydrophobicContact CD1-CG 4.08Å; L1284-L1288 HydrophobicContact CG-CD1 4.08Å; L1284-L1288 HydrophobicContact CG-CG 4.41Å; L1284-L1288 VanDerWaalsContact O-CD1 3.3Å; L1284-L1288 WeakPolarHBondContact O-CD1 3.27Å; L1284-L1288 VanDerWaalsContact O-CG 3.23Å; L1284-L1288 WeakPolarHBondContact O-CG 3.44Å; S1285-L1288 CarbonylContact O-C 3.59Å; S1285-L1288 PolarHBondContact O-N 3.32Å; D1286-L1288 PolarHBondContact O-N 3.16Å; D1286-L1288 VanDerWaalsContact O-N 3.13Å; L1288-L1290 WeakPolarHBondContact CA-OXT 3.23Å
1289	K	71.1	Confident	71	Confident	163 Å²	163	49.7 Å²	49.7	71%	0.709	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-44.1	167.4	-76.5	172.2	177.8	-177.2	0	109.7	S1285 D1286	S1285-K1289 WeakPolarHBondContact O-CG 3.48Å; S1285-K1289 PolarHBondContact O-N 2.69Å; D1286-K1289 WeakPolarHBondContact O-CB 3.45Å; D1286-K1289 PolarHBondContact O-N 2.79Å
1290	L	59.3	Low	71.7	Confident	117 Å²	117	53.5 Å²	53.5	61%	0.613	27%	0.267	S	S	*	.			trans	-58	0	147.6	-54.5	170.6	0	0	0	107.6	R910 D1286 L1288	R910-L1290 PolarHBondContact NH2-O 3.1Å; R910-L1290 PolarHBondContact NH2-OXT 3.46Å; D1286-L1290 WeakPolarHBondContact O-CG 3.32Å; D1286-L1290 PolarHBondContact O-N 3.01Å; L1288-L1290 WeakPolarHBondContact CA-OXT 3.23Å

Retrieved 1,290 of 1,290 residues in 1136.3 ms (Link to these results)

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